#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y57 s VAL 83 N 0.00 2.32 0.00 2.03 1.01 -1.26 -1.26 120.40 123.23 1y57 s VAL 83 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.24 1y57 s VAL 83 Cb 0.00 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.22 1y57 s VAL 83 CO 0.00 0.04 0.00 0.35 0.00 0.00 0.00 175.10 175.49 1y57 n THR 84 N 2.63 0.00 -3.47 3.92 -2.24 -1.26 -5.06 114.28 108.80 1y57 n THR 84 Ca 0.09 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.50 1y57 n THR 84 Cb 0.38 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.54 1y57 n THR 84 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1y57 s THR 85 N -3.02 5.27 0.26 4.28 2.01 -0.39 -1.31 115.64 122.74 1y57 s THR 85 Ca 0.00 0.65 0.11 0.00 0.31 0.00 0.00 61.69 62.76 1y57 s THR 85 Cb 0.00 -3.68 -0.05 0.00 0.01 0.00 0.00 72.50 68.78 1y57 s THR 85 CO 0.00 0.36 -0.18 -0.36 -0.69 0.00 0.00 174.62 173.75 1y57 s PHE 86 N 0.62 2.37 -0.07 4.92 0.40 0.50 -1.07 117.98 125.64 1y57 s PHE 86 Ca 0.19 -0.31 0.05 0.00 -0.60 0.00 0.00 56.93 56.25 1y57 s PHE 86 Cb -0.14 -1.06 -0.00 0.00 0.51 0.00 0.00 43.02 42.32 1y57 s PHE 86 CO 0.06 0.65 -0.24 0.08 0.70 0.00 0.00 175.22 176.47 1y57 s VAL 87 N -2.27 1.99 0.13 -0.44 1.01 0.19 -0.74 120.40 120.27 1y57 s VAL 87 Ca 0.28 -1.01 -0.30 0.00 0.00 0.00 0.00 61.98 60.95 1y57 s VAL 87 Cb -0.06 -1.70 -0.08 0.00 0.00 0.00 0.00 36.38 34.55 1y57 s VAL 87 CO 0.15 0.55 1.28 0.00 0.00 0.00 0.00 175.10 177.07 1y57 s ALA 88 N 0.09 3.49 -0.17 5.51 0.00 -0.36 -0.97 121.76 129.35 1y57 s ALA 88 Ca -0.10 1.01 0.19 0.00 0.00 0.00 0.00 51.96 53.05 1y57 s ALA 88 Cb -0.15 -3.47 -0.06 0.00 0.00 0.00 0.00 23.12 19.43 1y57 s ALA 88 CO 0.06 -0.49 0.97 -0.07 0.00 0.00 0.00 175.76 176.23 1y57 h LEU 89 N 6.13 0.00 -8.37 0.00 3.38 -0.77 0.39 115.31 116.07 1y57 h LEU 89 Ca -0.43 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.37 1y57 h LEU 89 Cb 1.21 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.81 1y57 h LEU 89 CO 0.80 0.37 -0.65 -0.31 0.09 0.00 0.00 178.44 178.74 1y57 s TYR 90 N -3.08 0.76 0.37 1.13 2.02 -1.25 -4.83 117.35 112.48 1y57 s TYR 90 Ca -0.01 -1.18 -0.26 0.00 -0.37 0.00 0.00 57.07 55.25 1y57 s TYR 90 Cb 0.09 -0.45 -0.09 0.00 -0.40 0.00 0.00 41.96 41.11 1y57 s TYR 90 CO 0.79 -0.48 1.10 -0.51 -1.57 0.00 0.00 175.55 174.88 1y57 s ASP 91 N -3.01 6.80 -0.04 2.29 1.01 -1.26 -3.48 116.67 118.98 1y57 s ASP 91 Ca 0.19 2.19 0.01 0.00 0.71 0.00 0.00 52.55 55.65 1y57 s ASP 91 Cb 0.08 -2.60 0.02 0.00 1.01 0.00 0.00 42.92 41.43 1y57 s ASP 91 CO -0.01 -0.47 -0.02 -0.47 0.21 0.00 0.00 175.17 174.40 1y57 s TYR 92 N -1.47 0.57 -0.20 4.23 5.04 -0.37 -4.95 117.35 120.21 1y57 s TYR 92 Ca 0.54 -0.12 -0.12 0.00 -2.44 0.00 0.00 57.07 54.93 1y57 s TYR 92 Cb -0.27 -0.57 -0.05 0.00 0.35 0.00 0.00 41.96 41.42 1y57 s TYR 92 CO 0.34 -0.17 0.22 -2.00 -1.34 0.00 0.00 175.55 172.60 1y57 s GLU 93 N 1.01 4.19 0.19 4.97 2.12 -1.26 -1.48 118.70 128.43 1y57 s GLU 93 Ca -0.10 -0.07 -0.33 0.00 0.36 0.00 0.00 54.97 54.83 1y57 s GLU 93 Cb -0.14 -3.46 -0.13 0.00 0.26 0.00 0.00 34.13 30.66 1y57 s GLU 93 CO -0.01 0.19 1.62 0.45 -0.54 0.00 0.00 175.26 176.97 1y57 n SER 94 N 3.81 3.43 0.00 -1.70 2.88 -1.26 -4.90 113.62 115.88 1y57 n SER 94 Ca -0.13 1.08 0.00 0.00 -1.33 0.00 0.00 58.87 58.49 1y57 n SER 94 Cb 0.52 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.49 1y57 n SER 94 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1y57 n ARG 95 N 3.49 1.13 -4.41 -1.46 1.85 -1.26 -5.01 116.66 111.00 1y57 n ARG 95 Ca 0.16 -0.87 -0.24 0.00 -1.00 0.00 0.00 57.85 55.90 1y57 n ARG 95 Cb 0.31 -0.70 -0.08 0.00 -1.05 0.00 0.00 32.46 30.95 1y57 n ARG 95 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1y57 n THR 96 N -0.19 0.00 0.64 8.89 -2.24 -1.26 -4.86 114.28 115.26 1y57 n THR 96 Ca 0.00 -2.47 0.13 0.00 -2.27 0.00 0.00 64.05 59.44 1y57 n THR 96 Cb 0.39 1.01 0.45 0.00 -2.10 0.00 0.00 70.33 70.08 1y57 n THR 96 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1y57 n GLU 97 N -0.84 0.20 0.00 -0.78 1.02 -1.26 -4.08 120.64 114.90 1y57 n GLU 97 Ca -0.01 0.22 0.00 0.00 -0.02 0.00 0.00 57.16 57.35 1y57 n GLU 97 Cb 0.63 -1.76 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 1y57 n GLU 97 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1y57 n THR 98 N -2.11 0.23 -2.29 2.62 -2.24 -1.26 -5.05 114.28 104.19 1y57 n THR 98 Ca 0.05 -0.39 -0.26 0.00 -2.27 0.00 0.00 64.05 61.18 1y57 n THR 98 Cb 0.37 1.14 0.05 0.00 -2.10 0.00 0.00 70.33 69.79 1y57 n THR 98 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1y57 s ASP 99 N -0.23 5.19 -0.16 3.42 -4.77 -1.26 -1.28 116.67 117.58 1y57 s ASP 99 Ca 0.00 0.58 0.02 0.00 -3.30 0.00 0.00 52.55 49.85 1y57 s ASP 99 Cb 0.00 -1.39 0.02 0.00 -1.09 0.00 0.00 42.92 40.45 1y57 s ASP 99 CO 0.00 -1.34 -0.21 -0.22 0.70 0.00 0.00 175.17 174.10 1y57 s LEU 100 N -5.13 2.12 0.32 2.11 2.96 -0.24 -4.50 118.68 116.32 1y57 s LEU 100 Ca 0.57 -0.63 -0.29 0.00 -0.22 0.00 0.00 54.13 53.57 1y57 s LEU 100 Cb -0.11 -1.46 -0.10 0.00 0.50 0.00 0.00 46.19 45.02 1y57 s LEU 100 CO 0.45 0.03 1.21 -0.44 -1.32 0.00 0.00 176.35 176.28 1y57 s SER 101 N 1.09 6.93 0.16 3.68 0.01 -1.26 -4.63 113.70 119.68 1y57 s SER 101 Ca -0.00 2.48 -0.18 0.00 1.31 0.00 0.00 55.95 59.57 1y57 s SER 101 Cb -0.14 -2.64 0.04 0.00 0.21 0.00 0.00 66.02 63.49 1y57 s SER 101 CO -0.08 -0.40 0.49 0.72 0.41 0.00 0.00 173.24 174.37 1y57 s PHE 102 N -1.19 -0.22 0.16 2.43 -0.12 -0.55 -4.97 117.98 113.53 1y57 s PHE 102 Ca 0.48 -0.10 0.07 0.00 -0.05 0.00 0.00 56.93 57.34 1y57 s PHE 102 Cb -0.36 0.37 -0.04 0.00 -0.63 0.00 0.00 43.02 42.36 1y57 s PHE 102 CO 0.47 -0.83 -0.02 0.15 -0.05 0.00 0.00 175.22 174.94 1y57 s LYS 103 N -3.83 2.36 0.40 1.99 -0.14 -1.26 -1.24 119.74 118.02 1y57 s LYS 103 Ca 0.06 -1.10 -0.26 0.00 -1.36 0.00 0.00 55.97 53.30 1y57 s LYS 103 Cb 0.00 -2.35 -0.10 0.00 -1.68 0.00 0.00 37.83 33.70 1y57 s LYS 103 CO -0.08 0.46 1.30 0.36 -0.76 0.00 0.00 175.35 176.63 1y57 n LYS 104 N 0.00 2.04 0.00 1.68 2.85 -1.23 -1.53 118.16 121.97 1y57 n LYS 104 Ca -0.10 0.72 0.00 0.00 -1.05 0.00 0.00 58.31 57.88 1y57 n LYS 104 Cb 0.55 -2.40 0.00 0.00 -0.65 0.00 0.00 35.03 32.53 1y57 n LYS 104 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1y57 n GLY 105 N 0.77 2.09 3.77 2.58 0.00 0.13 -4.96 105.19 109.56 1y57 n GLY 105 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1y57 n GLY 105 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1y57 s GLU 106 N -0.36 4.41 -0.18 1.61 2.12 -0.59 -4.66 118.70 121.06 1y57 s GLU 106 Ca 0.00 2.08 -0.12 0.00 0.36 0.00 0.00 54.97 57.29 1y57 s GLU 106 Cb 0.00 -3.08 -0.05 0.00 0.26 0.00 0.00 34.13 31.27 1y57 s GLU 106 CO 0.00 -0.09 0.21 1.03 -0.54 0.00 0.00 175.26 175.87 1y57 s ARG 107 N -1.73 4.20 -0.03 4.30 0.52 -1.26 -1.22 118.95 123.73 1y57 s ARG 107 Ca 0.48 -0.06 0.03 0.00 -0.52 0.00 0.00 55.73 55.66 1y57 s ARG 107 Cb -0.37 -3.42 -0.00 0.00 0.52 0.00 0.00 34.95 31.68 1y57 s ARG 107 CO 0.49 0.28 -0.12 -0.51 0.02 0.00 0.00 175.30 175.46 1y57 s LEU 108 N 0.37 1.85 -0.08 2.53 1.43 0.08 -1.16 118.68 123.70 1y57 s LEU 108 Ca 0.12 -0.24 -0.26 0.00 -1.03 0.00 0.00 54.13 52.72 1y57 s LEU 108 Cb -0.12 -0.68 -0.03 0.00 0.03 0.00 0.00 46.19 45.39 1y57 s LEU 108 CO 0.01 0.10 0.83 -1.10 0.23 0.00 0.00 176.35 176.42 1y57 s GLN 109 N 0.08 4.43 -0.25 1.70 -1.52 0.29 -0.37 119.66 124.02 1y57 s GLN 109 Ca -0.02 1.08 -0.02 0.00 -1.95 0.00 0.00 55.36 54.46 1y57 s GLN 109 Cb -0.09 -3.49 0.08 0.00 -0.22 0.00 0.00 33.01 29.29 1y57 s GLN 109 CO 0.01 -0.10 0.05 0.42 -0.25 0.00 0.00 175.29 175.43 1y57 s ILE 110 N 1.30 0.75 -0.33 1.08 1.01 -0.42 -1.07 121.20 123.52 1y57 s ILE 110 Ca 0.42 -0.98 0.23 0.00 0.00 0.00 0.00 60.65 60.32 1y57 s ILE 110 Cb -0.18 -1.37 0.03 0.00 0.01 0.00 0.00 42.46 40.94 1y57 s ILE 110 CO 0.19 -0.41 1.13 -0.37 0.00 0.00 0.00 174.94 175.48 1y57 h VAL 111 N 6.52 0.00 -3.32 2.92 -1.51 -1.81 -3.41 116.25 115.64 1y57 h VAL 111 Ca -0.15 -0.89 -0.63 0.00 -1.23 0.00 0.00 66.70 63.80 1y57 h VAL 111 Cb 1.07 1.43 -0.40 0.00 -2.13 0.00 0.00 31.29 31.26 1y57 h VAL 111 CO 0.40 0.00 -0.70 0.20 -1.23 0.00 0.00 177.57 176.24 1y57 s ASN 112 N -5.17 4.21 -0.34 4.19 0.01 -1.26 -4.92 114.94 111.65 1y57 s ASN 112 Ca 0.01 -2.45 0.07 0.00 -0.71 0.00 0.00 52.86 49.79 1y57 s ASN 112 Cb 0.10 -1.34 0.54 0.00 0.41 0.00 0.00 41.25 40.96 1y57 s ASN 112 CO 0.77 -0.31 1.57 -0.46 -1.51 0.00 0.00 177.10 177.16 1y57 n ASN 113 N 3.83 2.99 0.40 -1.22 6.94 -1.26 -4.59 115.26 122.35 1y57 n ASN 113 Ca 0.04 -3.76 -0.18 0.00 -0.02 0.00 0.00 54.58 50.67 1y57 n ASN 113 Cb 0.37 -0.68 -0.09 0.00 -2.36 0.00 0.00 39.78 37.02 1y57 n ASN 113 CO 0.00 0.00 0.00 0.74 -1.03 0.00 0.00 177.26 176.97 1y57 h THR 114 N 1.04 0.21 0.00 5.53 2.02 -1.98 -3.48 112.91 116.25 1y57 h THR 114 Ca 0.33 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.40 1y57 h THR 114 Cb 1.89 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 68.53 1y57 h THR 114 CO 0.60 0.01 0.00 1.21 0.37 0.00 0.00 175.52 177.71 1y57 n GLU 115 N -5.49 0.00 0.00 6.66 4.07 -1.26 -5.14 120.64 119.47 1y57 n GLU 115 Ca -0.14 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 56.96 1y57 n GLU 115 Cb 0.41 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.79 1y57 n GLU 115 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1y57 n GLY 116 N 0.00 -1.51 0.40 8.31 0.00 -1.26 -4.69 105.19 106.44 1y57 n GLY 116 Ca 0.00 -1.56 0.12 0.00 0.00 0.00 0.00 46.02 44.58 1y57 n GLY 116 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1y57 n ASP 117 N -1.99 1.62 -3.96 1.61 8.00 -1.26 -4.88 116.55 115.70 1y57 n ASP 117 Ca 0.00 -1.27 -0.25 0.00 0.71 0.00 0.00 54.79 53.99 1y57 n ASP 117 Cb 0.00 0.33 -0.17 0.00 -0.02 0.00 0.00 41.12 41.26 1y57 n ASP 117 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1y57 s TRP 118 N -2.47 1.34 0.05 1.24 0.52 -1.26 -1.23 118.94 117.12 1y57 s TRP 118 Ca 0.21 -0.55 0.08 0.00 0.02 0.00 0.00 56.10 55.87 1y57 s TRP 118 Cb 0.19 -1.06 -0.03 0.00 -1.15 0.00 0.00 33.47 31.42 1y57 s TRP 118 CO 0.54 -0.35 -0.21 -1.58 0.02 0.00 0.00 176.95 175.37 1y57 s TRP 119 N 1.09 2.46 -0.13 -1.98 0.51 -0.27 -4.89 118.94 115.73 1y57 s TRP 119 Ca -0.07 -0.32 -0.29 0.00 -2.12 0.00 0.00 56.10 53.30 1y57 s TRP 119 Cb -0.14 -1.42 -0.01 0.00 -0.81 0.00 0.00 33.47 31.08 1y57 s TRP 119 CO -0.01 0.22 1.06 -1.17 -0.51 0.00 0.00 176.95 176.54 1y57 s LEU 120 N -1.42 4.22 0.15 2.99 2.96 -1.26 -0.99 118.68 125.32 1y57 s LEU 120 Ca 0.14 1.56 0.06 0.00 -0.22 0.00 0.00 54.13 55.67 1y57 s LEU 120 Cb -0.10 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.99 1y57 s LEU 120 CO 0.04 -0.54 -0.14 0.00 -1.32 0.00 0.00 176.35 174.40 1y57 s ALA 121 N 2.38 1.64 -0.06 5.97 0.00 0.00 -4.44 121.76 127.25 1y57 s ALA 121 Ca 0.49 -1.42 -0.00 0.00 0.00 0.00 0.00 51.96 51.03 1y57 s ALA 121 Cb -0.19 -0.07 0.03 0.00 0.00 0.00 0.00 23.12 22.89 1y57 s ALA 121 CO 0.16 0.08 -0.03 -1.58 0.00 0.00 0.00 175.76 174.39 1y57 s HIS 122 N -2.48 0.79 0.09 0.00 2.46 -0.23 -1.40 115.29 114.51 1y57 s HIS 122 Ca 0.13 -0.25 -0.30 0.00 0.47 0.00 0.00 55.06 55.12 1y57 s HIS 122 Cb -0.03 -0.79 -0.05 0.00 -0.13 0.00 0.00 32.58 31.57 1y57 s HIS 122 CO 0.04 -0.29 0.97 0.45 -2.47 0.00 0.00 174.74 173.43 1y57 s SER 123 N 1.51 7.46 0.00 9.88 0.15 -0.16 -0.55 113.70 132.00 1y57 s SER 123 Ca -0.02 1.77 0.29 0.00 0.70 0.00 0.00 55.95 58.69 1y57 s SER 123 Cb -0.13 -2.58 1.21 0.00 -1.71 0.00 0.00 66.02 62.81 1y57 s SER 123 CO -0.03 -0.12 1.86 0.18 1.20 0.00 0.00 173.24 176.33 1y57 n LEU 124 N 3.05 0.33 -0.10 3.45 4.77 -0.31 -1.42 117.00 126.77 1y57 n LEU 124 Ca 0.03 0.12 -0.19 0.00 -0.03 0.00 0.00 56.01 55.94 1y57 n LEU 124 Cb 0.50 -0.25 -0.09 0.00 -2.33 0.00 0.00 43.42 41.24 1y57 n LEU 124 CO 0.51 0.06 -0.55 -1.20 -1.33 0.00 0.00 177.39 174.89 1y57 n SER 125 N -1.13 1.86 -0.00 -1.43 7.64 -1.26 -4.75 113.62 114.54 1y57 n SER 125 Ca 0.13 0.46 0.09 0.00 1.01 0.00 0.00 58.87 60.55 1y57 n SER 125 Cb 0.28 -0.94 -0.12 0.00 -1.01 0.00 0.00 64.21 62.43 1y57 n SER 125 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1y57 n THR 126 N -4.46 0.00 -0.99 0.44 -2.24 -1.25 -4.99 114.28 100.80 1y57 n THR 126 Ca -0.29 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 1y57 n THR 126 Cb 0.61 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 1y57 n THR 126 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1y57 n GLY 127 N 1.45 0.32 3.83 3.38 0.00 -0.51 -5.01 105.19 108.65 1y57 n GLY 127 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1y57 n GLY 127 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1y57 s GLN 128 N -0.76 4.19 -0.04 1.61 -0.21 -1.26 -4.78 119.66 118.42 1y57 s GLN 128 Ca 0.00 0.91 0.03 0.00 0.02 0.00 0.00 55.36 56.32 1y57 s GLN 128 Cb 0.00 -2.52 -0.03 0.00 1.00 0.00 0.00 33.01 31.46 1y57 s GLN 128 CO 0.00 0.18 -0.10 0.99 -2.12 0.00 0.00 175.29 174.24 1y57 s THR 129 N -1.88 3.41 -1.37 -0.19 2.01 -1.26 -0.99 115.64 115.37 1y57 s THR 129 Ca 0.53 -0.67 0.00 0.00 0.31 0.00 0.00 61.69 61.85 1y57 s THR 129 Cb -0.12 -2.40 0.00 0.00 0.01 0.00 0.00 72.50 69.99 1y57 s THR 129 CO 0.18 0.53 0.00 0.61 -0.69 0.00 0.00 174.62 175.25 1y57 n GLY 130 N 2.06 -1.59 3.81 4.40 0.00 -0.49 -4.78 105.19 108.61 1y57 n GLY 130 Ca -0.17 -1.09 -0.38 0.00 0.00 0.00 0.00 46.02 44.38 1y57 n GLY 130 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1y57 s TYR 131 N -2.03 3.75 0.09 1.61 1.51 -0.40 -0.82 117.35 121.06 1y57 s TYR 131 Ca 0.00 1.35 0.05 0.00 -1.01 0.00 0.00 57.07 57.45 1y57 s TYR 131 Cb 0.00 -2.57 -0.03 0.00 -0.11 0.00 0.00 41.96 39.25 1y57 s TYR 131 CO 0.00 0.48 -0.13 0.96 -1.11 0.00 0.00 175.55 175.75 1y57 s ILE 132 N -1.29 1.08 -0.03 2.71 -5.25 -0.16 -1.08 121.20 117.18 1y57 s ILE 132 Ca 0.36 -1.49 -0.30 0.00 -0.99 0.00 0.00 60.65 58.22 1y57 s ILE 132 Cb -0.19 -1.24 -0.04 0.00 2.95 0.00 0.00 42.46 43.94 1y57 s ILE 132 CO 0.21 -0.38 1.21 -2.16 -1.79 0.00 0.00 174.94 172.02 1y57 s PRO 133 N -2.28 4.37 0.49 0.37 0.04 -1.26 -1.12 135.00 135.61 1y57 s PRO 133 Ca 0.02 1.70 0.26 0.00 0.04 0.00 0.00 61.00 63.03 1y57 s PRO 133 Cb -0.07 -3.52 1.22 0.00 0.04 0.00 0.00 34.50 32.18 1y57 s PRO 133 CO 0.02 -0.41 1.96 0.66 0.04 0.00 0.00 177.00 179.27 1y57 h SER 134 N 7.34 0.00 0.00 6.66 4.64 -1.51 -1.63 113.55 129.05 1y57 h SER 134 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1y57 h SER 134 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1y57 h SER 134 CO 0.87 0.16 0.00 -0.46 -0.87 0.00 0.00 176.83 176.53 1y57 n ASN 135 N -3.48 0.00 -0.87 4.97 6.94 -1.26 -3.29 115.26 118.27 1y57 n ASN 135 Ca -0.01 -0.94 0.12 0.00 -0.02 0.00 0.00 54.58 53.74 1y57 n ASN 135 Cb 0.33 0.00 0.21 0.00 -2.36 0.00 0.00 39.78 37.96 1y57 n ASN 135 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 1y57 n TYR 136 N -0.99 0.07 -4.30 -2.53 4.02 -0.61 -4.96 117.16 107.86 1y57 n TYR 136 Ca 0.22 -0.04 -0.17 0.00 -0.01 0.00 0.00 57.90 57.90 1y57 n TYR 136 Cb 0.10 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.32 1y57 n TYR 136 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1y57 s VAL 137 N -1.93 1.47 0.08 -0.72 -7.23 -1.21 -0.01 120.40 110.86 1y57 s VAL 137 Ca 0.32 -2.11 0.05 0.00 -1.81 0.00 0.00 61.98 58.43 1y57 s VAL 137 Cb 0.20 -1.92 -0.03 0.00 0.56 0.00 0.00 36.38 35.19 1y57 s VAL 137 CO 0.31 -0.64 -0.14 0.00 -0.31 0.00 0.00 175.10 174.32 1y57 s ALA 138 N -3.05 1.23 0.34 1.32 0.00 -0.14 -4.89 121.76 116.57 1y57 s ALA 138 Ca 0.19 -1.08 -0.29 0.00 0.00 0.00 0.00 51.96 50.78 1y57 s ALA 138 Cb 0.00 -0.08 -0.11 0.00 0.00 0.00 0.00 23.12 22.93 1y57 s ALA 138 CO 0.04 0.13 1.50 -2.30 0.00 0.00 0.00 175.76 175.13 1y57 n PRO 139 N 1.05 2.61 0.28 0.00 -0.02 -1.26 -0.64 135.00 137.02 1y57 n PRO 139 Ca -0.19 0.92 0.19 0.00 -2.02 0.00 0.00 63.50 62.39 1y57 n PRO 139 Cb 0.55 -2.65 0.87 0.00 -0.02 0.00 0.00 33.50 32.25 1y57 n PRO 139 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1y57 h SER 140 N 3.54 0.00 -0.18 2.55 4.64 -1.37 -2.47 113.55 120.26 1y57 h SER 140 Ca -0.49 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.64 1y57 h SER 140 Cb 1.24 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.34 1y57 h SER 140 CO 0.69 0.00 -0.64 0.44 -0.87 0.00 0.00 176.83 176.45 1y57 h ASP 141 N 0.00 0.88 -4.03 4.97 3.32 -1.85 -3.43 116.42 116.29 1y57 h ASP 141 Ca 0.00 -0.60 -0.51 0.00 0.02 0.00 0.00 57.03 55.94 1y57 h ASP 141 Cb 0.26 -0.26 0.07 0.00 0.22 0.00 0.00 39.33 39.63 1y57 h ASP 141 CO 0.00 1.33 0.49 -0.94 -1.72 0.00 0.00 179.24 178.40 1y57 s SER 142 N -6.96 5.95 0.59 6.45 1.04 -0.93 -4.93 113.70 114.92 1y57 s SER 142 Ca -0.11 2.33 0.29 0.00 0.48 0.00 0.00 55.95 58.94 1y57 s SER 142 Cb 0.08 -2.60 1.68 0.00 0.10 0.00 0.00 66.02 65.29 1y57 s SER 142 CO 0.88 -1.07 2.13 -0.29 0.98 0.00 0.00 173.24 175.87 1y57 h ILE 143 N 1.66 0.48 0.00 -1.02 6.09 -1.91 -1.53 117.51 121.27 1y57 h ILE 143 Ca -0.50 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 62.99 1y57 h ILE 143 Cb 1.26 0.87 -0.00 0.00 0.47 0.00 0.00 36.82 39.41 1y57 h ILE 143 CO 0.59 0.00 -0.03 1.56 -3.07 0.00 0.00 178.15 177.20 1y57 h GLN 144 N 0.00 0.00 0.00 2.19 7.50 -1.91 -1.92 115.11 120.97 1y57 h GLN 144 Ca 0.07 0.00 -0.00 0.00 0.50 0.00 0.00 58.65 59.22 1y57 h GLN 144 Cb 0.40 0.00 -0.00 0.00 0.05 0.00 0.00 27.48 27.93 1y57 h GLN 144 CO -0.00 0.03 -0.02 0.00 -1.50 0.00 0.00 178.83 177.34 1y57 h ALA 145 N 1.97 1.02 -2.46 3.87 0.00 -1.48 -3.44 119.26 118.75 1y57 h ALA 145 Ca -0.00 -0.01 -0.54 0.00 0.00 0.00 0.00 54.91 54.36 1y57 h ALA 145 Cb 0.13 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1y57 h ALA 145 CO 0.00 0.02 0.43 -1.21 0.00 0.00 0.00 179.25 178.49 1y57 s GLU 146 N -3.87 4.54 0.36 0.00 0.41 -0.72 -4.94 118.70 114.47 1y57 s GLU 146 Ca -0.01 1.54 0.07 0.00 -0.41 0.00 0.00 54.97 56.15 1y57 s GLU 146 Cb 0.11 -3.41 0.67 0.00 -1.78 0.00 0.00 34.13 29.71 1y57 s GLU 146 CO 0.50 -0.08 1.87 1.49 -0.49 0.00 0.00 175.26 178.55 1y57 h GLU 147 N 6.61 0.34 -0.00 1.61 4.81 -1.89 -2.33 114.58 123.73 1y57 h GLU 147 Ca -0.41 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1y57 h GLU 147 Cb 1.22 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.55 1y57 h GLU 147 CO 0.76 0.48 -0.03 -2.67 -0.73 0.00 0.00 179.01 176.82 1y57 n TRP 148 N -4.24 0.00 -3.13 0.92 4.27 -1.26 -4.77 117.44 109.23 1y57 n TRP 148 Ca -0.00 0.00 -0.41 0.00 -3.89 0.00 0.00 57.50 53.20 1y57 n TRP 148 Cb 0.29 -0.11 -0.07 0.00 -1.36 0.00 0.00 31.31 30.07 1y57 n TRP 148 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 1y57 s TYR 149 N -2.25 3.19 -1.72 -2.67 5.04 -0.88 -0.51 117.35 117.55 1y57 s TYR 149 Ca 0.37 0.47 0.14 0.00 -2.44 0.00 0.00 57.07 55.61 1y57 s TYR 149 Cb 0.21 -3.03 0.11 0.00 0.35 0.00 0.00 41.96 39.61 1y57 s TYR 149 CO 0.41 -0.53 0.95 1.19 -1.34 0.00 0.00 175.55 176.23 1y57 n PHE 150 N 5.92 0.01 -1.52 4.97 3.01 0.30 -4.92 117.46 125.22 1y57 n PHE 150 Ca -0.01 -0.01 0.00 0.00 1.01 0.00 0.00 57.45 58.44 1y57 n PHE 150 Cb 0.49 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.96 1y57 n PHE 150 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1y57 n GLY 151 N 0.78 1.85 3.41 1.37 0.00 -1.25 -4.21 105.19 107.14 1y57 n GLY 151 Ca 0.08 -0.49 -0.45 0.00 0.00 0.00 0.00 46.02 45.17 1y57 n GLY 151 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1y57 s LYS 152 N 0.00 3.83 0.10 1.61 2.20 -1.26 -0.57 119.74 125.65 1y57 s LYS 152 Ca 0.00 -2.35 0.09 0.00 -0.36 0.00 0.00 55.97 53.35 1y57 s LYS 152 Cb 0.00 -4.81 -0.04 0.00 -1.51 0.00 0.00 37.83 31.48 1y57 s LYS 152 CO 0.00 -1.60 -0.22 0.96 -0.36 0.00 0.00 175.35 174.13 1y57 s ILE 153 N 1.29 1.81 0.81 5.43 -4.36 -1.26 -5.03 121.20 119.89 1y57 s ILE 153 Ca 0.32 -1.57 -0.11 0.00 -0.26 0.00 0.00 60.65 59.03 1y57 s ILE 153 Cb -0.06 -1.64 0.08 0.00 1.25 0.00 0.00 42.46 42.09 1y57 s ILE 153 CO -0.07 -0.02 1.09 0.42 0.24 0.00 0.00 174.94 176.60 1y57 s THR 154 N -1.13 3.15 0.19 8.37 -4.23 -1.26 -4.74 115.64 115.99 1y57 s THR 154 Ca 0.08 0.37 -0.13 0.00 -1.18 0.00 0.00 61.69 60.83 1y57 s THR 154 Cb -0.10 -2.96 0.11 0.00 1.34 0.00 0.00 72.50 70.89 1y57 s THR 154 CO 0.04 -0.49 1.71 -0.09 -0.54 0.00 0.00 174.62 175.26 1y57 h ARG 155 N -1.20 0.21 -0.15 3.99 2.43 -2.00 -1.22 114.38 116.44 1y57 h ARG 155 Ca -0.46 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 58.58 1y57 h ARG 155 Cb 1.25 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 1y57 h ARG 155 CO 0.55 0.14 -0.41 0.00 -1.51 0.00 0.00 179.97 178.73 1y57 h ARG 156 N 0.21 0.35 -0.15 0.20 2.47 -2.00 -2.40 114.38 113.08 1y57 h ARG 156 Ca 0.25 -0.17 -0.16 0.00 -1.26 0.00 0.00 59.98 58.63 1y57 h ARG 156 Cb 0.34 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.66 1y57 h ARG 156 CO -0.34 0.71 -0.59 1.49 0.56 0.00 0.00 179.97 181.80 1y57 h GLU 157 N 0.29 0.49 -0.67 0.04 4.57 -1.87 -2.29 114.58 115.14 1y57 h GLU 157 Ca 0.03 -0.33 -0.01 0.00 -1.18 0.00 0.00 59.36 57.87 1y57 h GLU 157 Cb 0.86 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.46 1y57 h GLU 157 CO 0.07 0.94 0.38 0.66 -1.18 0.00 0.00 179.01 179.87 1y57 h SER 158 N 0.37 0.81 -0.14 1.04 4.64 -0.96 -2.46 113.55 116.85 1y57 h SER 158 Ca -0.00 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.25 1y57 h SER 158 Cb 1.14 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 1y57 h SER 158 CO 0.11 0.65 0.03 -0.33 -0.87 0.00 0.00 176.83 176.42 1y57 h GLU 159 N 0.93 0.23 -0.70 4.77 5.08 -1.24 -0.51 114.58 123.14 1y57 h GLU 159 Ca 0.24 -0.06 0.12 0.00 -1.00 0.00 0.00 59.36 58.66 1y57 h GLU 159 Cb 0.01 -0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.14 1y57 h GLU 159 CO -0.04 0.39 0.29 -0.09 -1.00 0.00 0.00 179.01 178.56 1y57 h ARG 160 N 0.03 0.46 -0.30 2.33 2.43 -1.18 -0.56 114.38 117.60 1y57 h ARG 160 Ca 0.04 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.06 1y57 h ARG 160 Cb 0.26 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1y57 h ARG 160 CO 0.00 0.31 -0.32 -0.07 -1.51 0.00 0.00 179.97 178.37 1y57 h LEU 161 N 0.48 0.80 -0.92 3.80 3.38 -1.23 -3.21 115.31 118.41 1y57 h LEU 161 Ca 0.37 -0.48 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 1y57 h LEU 161 Cb 0.49 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1y57 h LEU 161 CO -0.34 1.12 -0.34 -0.07 0.09 0.00 0.00 178.44 178.90 1y57 h LEU 162 N 0.50 0.00 -0.38 1.67 3.38 -0.72 -3.11 115.31 116.65 1y57 h LEU 162 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1y57 h LEU 162 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1y57 h LEU 162 CO 0.08 0.34 0.00 0.18 0.09 0.00 0.00 178.44 179.12 1y57 n LEU 163 N -3.47 0.56 -4.54 1.67 4.77 -0.25 -4.81 117.00 110.94 1y57 n LEU 163 Ca 0.00 -0.28 -0.51 0.00 -0.03 0.00 0.00 56.01 55.20 1y57 n LEU 163 Cb 0.50 -0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.48 1y57 n LEU 163 CO 0.36 0.14 0.57 -3.20 -1.33 0.00 0.00 177.39 173.93 1y57 n ASN 164 N -0.21 0.68 0.15 -1.43 2.85 -1.18 -4.82 115.26 111.31 1y57 n ASN 164 Ca 0.04 1.14 0.15 0.00 -0.11 0.00 0.00 54.58 55.81 1y57 n ASN 164 Cb 0.09 -1.12 0.73 0.00 1.24 0.00 0.00 39.78 40.72 1y57 n ASN 164 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1y57 h ALA 165 N 2.91 2.09 -0.13 5.20 0.00 -1.94 -2.52 119.26 124.87 1y57 h ALA 165 Ca -0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1y57 h ALA 165 Cb 1.37 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1y57 h ALA 165 CO 0.67 -0.32 0.00 0.39 0.00 0.00 0.00 179.25 179.99 1y57 n GLU 166 N -4.22 2.20 -2.35 0.00 1.02 -1.26 -4.96 120.64 111.08 1y57 n GLU 166 Ca 0.03 -1.95 -0.42 0.00 -0.02 0.00 0.00 57.16 54.80 1y57 n GLU 166 Cb 0.35 -1.45 -0.03 0.00 -0.02 0.00 0.00 31.44 30.29 1y57 n GLU 166 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1y57 s ASN 167 N -1.73 7.02 0.76 1.62 0.01 -0.95 -5.01 114.94 116.65 1y57 s ASN 167 Ca 0.29 2.15 -0.14 0.00 -0.71 0.00 0.00 52.86 54.46 1y57 s ASN 167 Cb 0.20 -2.59 0.05 0.00 0.41 0.00 0.00 41.25 39.32 1y57 s ASN 167 CO 0.29 -0.48 1.18 -2.84 -1.51 0.00 0.00 177.10 173.73 1y57 s PRO 168 N 0.66 2.04 0.28 -0.60 0.02 -1.26 -4.93 135.00 131.22 1y57 s PRO 168 Ca 0.58 1.64 -0.30 0.00 0.02 0.00 0.00 61.00 62.95 1y57 s PRO 168 Cb -0.32 -1.83 -0.13 0.00 0.02 0.00 0.00 34.50 32.23 1y57 s PRO 168 CO 0.32 -1.89 1.32 -2.13 -0.33 0.00 0.00 177.00 174.29 1y57 n ARG 169 N -2.99 1.99 -0.68 5.54 0.63 -1.26 -2.15 116.66 117.74 1y57 n ARG 169 Ca 0.12 0.70 0.00 0.00 -0.92 0.00 0.00 57.85 57.76 1y57 n ARG 169 Cb 0.51 -2.30 0.00 0.00 0.45 0.00 0.00 32.46 31.12 1y57 n ARG 169 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1y57 n GLY 170 N 1.52 0.66 3.77 5.14 0.00 -0.42 -4.66 105.19 111.19 1y57 n GLY 170 Ca 0.09 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 1y57 n GLY 170 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y57 s THR 171 N -2.00 2.32 0.15 2.61 2.01 -0.91 -1.24 115.64 118.57 1y57 s THR 171 Ca 0.00 0.28 -0.13 0.00 0.31 0.00 0.00 61.69 62.15 1y57 s THR 171 Cb 0.00 -3.16 0.01 0.00 0.01 0.00 0.00 72.50 69.36 1y57 s THR 171 CO 0.00 0.04 0.36 0.72 -0.69 0.00 0.00 174.62 175.05 1y57 s PHE 172 N -1.24 0.07 0.14 4.92 -0.71 -0.02 -0.80 117.98 120.34 1y57 s PHE 172 Ca 0.60 -0.42 -0.09 0.00 -1.04 0.00 0.00 56.93 55.97 1y57 s PHE 172 Cb -0.41 0.14 -0.01 0.00 -1.21 0.00 0.00 43.02 41.54 1y57 s PHE 172 CO 0.53 -0.74 0.26 -0.48 -1.34 0.00 0.00 175.22 173.45 1y57 s LEU 173 N -2.88 1.07 -0.05 -1.99 0.05 -0.75 -1.08 118.68 113.04 1y57 s LEU 173 Ca 0.09 -0.79 0.05 0.00 0.05 0.00 0.00 54.13 53.53 1y57 s LEU 173 Cb 0.02 1.17 -0.02 0.00 -2.05 0.00 0.00 46.19 45.32 1y57 s LEU 173 CO -0.06 -0.85 -0.21 -0.69 -0.55 0.00 0.00 176.35 173.99 1y57 s VAL 174 N -3.93 2.42 0.24 1.48 1.01 0.33 -1.49 120.40 120.46 1y57 s VAL 174 Ca 0.13 -0.95 -0.02 0.00 0.00 0.00 0.00 61.98 61.14 1y57 s VAL 174 Cb 0.04 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 1y57 s VAL 174 CO -0.03 0.57 0.25 0.00 0.00 0.00 0.00 175.10 175.89 1y57 s ARG 175 N -0.39 1.41 0.42 2.72 1.70 -0.47 -0.54 118.95 123.81 1y57 s ARG 175 Ca 0.03 -1.62 -0.25 0.00 -0.47 0.00 0.00 55.73 53.43 1y57 s ARG 175 Cb -0.12 0.33 -0.08 0.00 -0.57 0.00 0.00 34.95 34.51 1y57 s ARG 175 CO 0.02 -0.51 1.22 -1.21 -1.08 0.00 0.00 175.30 173.73 1y57 s GLU 176 N -3.93 3.91 0.15 3.89 2.02 0.27 -0.28 118.70 124.72 1y57 s GLU 176 Ca 0.35 1.95 -0.30 0.00 0.02 0.00 0.00 54.97 56.99 1y57 s GLU 176 Cb 0.04 -2.62 -0.07 0.00 0.10 0.00 0.00 34.13 31.58 1y57 s GLU 176 CO 0.14 -0.48 1.06 0.45 0.02 0.00 0.00 175.26 176.46 1y57 s SER 177 N -1.05 7.33 0.33 -0.19 0.15 -0.66 -4.59 113.70 115.02 1y57 s SER 177 Ca 0.59 1.99 0.24 0.00 0.70 0.00 0.00 55.95 59.47 1y57 s SER 177 Cb -0.33 -2.60 0.47 0.00 -1.71 0.00 0.00 66.02 61.85 1y57 s SER 177 CO 0.41 -0.18 1.61 -0.33 1.20 0.00 0.00 173.24 175.95 1y57 h GLU 178 N 5.34 0.00 0.00 5.44 5.08 -1.91 -3.39 114.58 125.14 1y57 h GLU 178 Ca -0.44 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 57.79 1y57 h GLU 178 Cb 1.21 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.44 1y57 h GLU 178 CO 0.73 0.00 -1.71 0.25 -1.00 0.00 0.00 179.01 177.28 1y57 n THR 179 N -2.74 0.51 -4.04 1.13 -2.24 -1.26 -4.92 114.28 100.72 1y57 n THR 179 Ca 0.04 -0.42 -0.31 0.00 -2.27 0.00 0.00 64.05 61.09 1y57 n THR 179 Cb 0.49 -0.37 -0.16 0.00 -2.10 0.00 0.00 70.33 68.19 1y57 n THR 179 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1y57 s THR 180 N -2.48 1.86 0.20 4.28 2.01 -1.26 -5.10 115.64 115.14 1y57 s THR 180 Ca -0.05 -1.17 -0.33 0.00 0.31 0.00 0.00 61.69 60.46 1y57 s THR 180 Cb 0.05 -1.90 -0.13 0.00 0.01 0.00 0.00 72.50 70.54 1y57 s THR 180 CO 0.49 0.18 1.64 1.17 -0.69 0.00 0.00 174.62 177.41 1y57 n LYS 181 N 4.60 2.50 0.00 4.92 4.81 -1.26 -2.15 118.16 131.59 1y57 n LYS 181 Ca -0.16 0.90 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 1y57 n LYS 181 Cb 0.46 -2.71 0.00 0.00 0.02 0.00 0.00 35.03 32.80 1y57 n LYS 181 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1y57 n GLY 182 N 3.52 2.36 3.95 3.14 0.00 -1.26 -5.03 105.19 111.88 1y57 n GLY 182 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 1y57 n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y57 s ALA 183 N -2.70 3.69 0.48 4.61 0.00 -0.91 -4.78 121.76 122.16 1y57 s ALA 183 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 51.96 50.86 1y57 s ALA 183 Cb 0.00 -2.22 -0.00 0.00 0.00 0.00 0.00 23.12 20.90 1y57 s ALA 183 CO 0.00 -0.68 0.02 0.66 0.00 0.00 0.00 175.76 175.76 1y57 n TYR 184 N -2.34 1.03 -3.74 0.00 4.01 0.05 -1.66 117.16 114.51 1y57 n TYR 184 Ca 0.05 -2.46 -0.12 0.00 -0.16 0.00 0.00 57.90 55.21 1y57 n TYR 184 Cb 0.59 -0.29 -0.13 0.00 -0.31 0.00 0.00 39.34 39.20 1y57 n TYR 184 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1y57 s LEU 186 N 1.00 4.18 -0.11 0.00 2.96 -0.44 -1.36 118.68 124.90 1y57 s LEU 186 Ca -0.07 -0.03 0.00 0.00 -0.22 0.00 0.00 54.13 53.81 1y57 s LEU 186 Cb -0.08 -2.26 -0.02 0.00 0.50 0.00 0.00 46.19 44.33 1y57 s LEU 186 CO -0.07 -0.18 -0.12 -0.44 -1.32 0.00 0.00 176.35 174.23 1y57 s SER 187 N 1.72 4.16 -0.03 3.68 0.01 -0.56 -0.60 113.70 122.07 1y57 s SER 187 Ca 0.10 -0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.11 1y57 s SER 187 Cb -0.16 -1.45 0.03 0.00 0.21 0.00 0.00 66.02 64.64 1y57 s SER 187 CO 0.11 0.22 -0.00 -0.69 0.41 0.00 0.00 173.24 173.28 1y57 s VAL 188 N 0.05 0.20 0.26 3.43 1.01 -0.26 -1.82 120.40 123.28 1y57 s VAL 188 Ca -0.04 0.07 -0.30 0.00 0.00 0.00 0.00 61.98 61.72 1y57 s VAL 188 Cb -0.14 -0.30 -0.09 0.00 0.00 0.00 0.00 36.38 35.85 1y57 s VAL 188 CO 0.04 0.15 1.12 -0.94 0.00 0.00 0.00 175.10 175.47 1y57 s SER 189 N 1.04 7.23 0.31 3.32 1.04 0.02 -1.25 113.70 125.41 1y57 s SER 189 Ca -0.09 2.26 0.06 0.00 0.48 0.00 0.00 55.95 58.66 1y57 s SER 189 Cb -0.14 -2.62 -0.02 0.00 0.10 0.00 0.00 66.02 63.34 1y57 s SER 189 CO -0.02 -0.19 0.22 -0.67 0.98 0.00 0.00 173.24 173.56 1y57 n ASP 190 N 1.45 -0.11 -3.68 7.02 2.03 0.39 -1.30 116.55 122.36 1y57 n ASP 190 Ca -0.00 -2.94 -0.09 0.00 0.52 0.00 0.00 54.79 52.28 1y57 n ASP 190 Cb 0.45 1.32 -0.10 0.00 -0.72 0.00 0.00 41.12 42.07 1y57 n ASP 190 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1y57 s PHE 191 N -3.12 -0.74 -0.23 -0.67 5.36 -1.26 -2.40 117.98 114.92 1y57 s PHE 191 Ca 0.30 1.50 -0.10 0.00 -0.96 0.00 0.00 56.93 57.67 1y57 s PHE 191 Cb 0.01 0.35 -0.05 0.00 -0.34 0.00 0.00 43.02 42.99 1y57 s PHE 191 CO 0.22 -0.42 0.15 0.34 -1.46 0.00 0.00 175.22 174.05 1y57 s ASP 192 N 1.81 6.14 0.44 6.13 -1.08 -0.31 -4.96 116.67 124.85 1y57 s ASP 192 Ca -0.07 0.15 0.10 0.00 -0.52 0.00 0.00 52.55 52.20 1y57 s ASP 192 Cb -0.09 -2.10 0.99 0.00 -1.46 0.00 0.00 42.92 40.25 1y57 s ASP 192 CO -0.14 0.10 2.09 0.78 0.52 0.00 0.00 175.17 178.51 1y57 h ASN 193 N 7.28 0.32 0.35 -0.34 2.35 -2.01 0.20 115.58 123.73 1y57 h ASN 193 Ca -0.39 -0.01 -0.32 0.00 -0.55 0.00 0.00 56.30 55.03 1y57 h ASN 193 Cb 1.16 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.46 1y57 h ASN 193 CO 0.69 0.24 -1.60 0.00 -1.65 0.00 0.00 177.43 175.10 1y57 h ALA 194 N 1.82 0.19 0.00 -0.83 0.00 -2.06 -3.42 119.26 114.96 1y57 h ALA 194 Ca 0.10 -1.10 0.00 0.00 0.00 0.00 0.00 54.91 53.92 1y57 h ALA 194 Cb -0.04 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1y57 h ALA 194 CO -0.02 1.06 -0.47 1.63 0.00 0.00 0.00 179.25 181.44 1y57 n LYS 195 N -3.52 4.04 0.00 0.00 4.76 -0.97 -5.11 118.16 117.35 1y57 n LYS 195 Ca -0.19 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.24 1y57 n LYS 195 Cb 1.06 -0.88 0.00 0.00 -1.84 0.00 0.00 35.03 33.37 1y57 n LYS 195 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1y57 n GLY 196 N 1.30 -1.49 3.77 0.72 0.00 0.67 -4.91 105.19 105.26 1y57 n GLY 196 Ca 0.01 -1.76 -0.41 0.00 0.00 0.00 0.00 46.02 43.86 1y57 n GLY 196 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y57 s LEU 197 N 0.00 4.30 0.26 0.99 1.43 -1.26 -1.17 118.68 123.23 1y57 s LEU 197 Ca 0.00 2.91 -0.17 0.00 -1.03 0.00 0.00 54.13 55.84 1y57 s LEU 197 Cb 0.00 -3.73 0.01 0.00 0.03 0.00 0.00 46.19 42.50 1y57 s LEU 197 CO 0.00 -0.84 0.60 0.54 0.23 0.00 0.00 176.35 176.88 1y57 s ASN 198 N -0.34 -0.18 -0.04 2.29 2.20 -1.01 -4.91 114.94 112.95 1y57 s ASN 198 Ca 0.54 -0.75 0.06 0.00 -0.94 0.00 0.00 52.86 51.76 1y57 s ASN 198 Cb -0.44 0.66 -0.01 0.00 -2.00 0.00 0.00 41.25 39.46 1y57 s ASN 198 CO 0.58 -1.24 -0.20 -0.69 -2.94 0.00 0.00 177.10 172.60 1y57 s VAL 199 N -3.96 1.66 0.04 3.54 1.01 -1.26 -0.46 120.40 120.97 1y57 s VAL 199 Ca 0.16 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.31 1y57 s VAL 199 Cb -0.03 -1.41 -0.04 0.00 0.00 0.00 0.00 36.38 34.90 1y57 s VAL 199 CO 0.08 0.47 -0.01 -0.54 0.00 0.00 0.00 175.10 175.09 1y57 s LYS 200 N -0.21 2.62 -0.04 2.72 -0.14 -0.38 -4.96 119.74 119.36 1y57 s LYS 200 Ca 0.01 -0.74 0.04 0.00 -1.36 0.00 0.00 55.97 53.92 1y57 s LYS 200 Cb -0.11 -2.57 -0.00 0.00 -1.68 0.00 0.00 37.83 33.46 1y57 s LYS 200 CO 0.01 0.58 -0.17 -1.01 -0.76 0.00 0.00 175.35 174.00 1y57 s HIS 201 N -1.18 1.70 -0.17 3.18 3.76 -1.26 -1.10 115.29 120.21 1y57 s HIS 201 Ca 0.22 -0.47 -0.00 0.00 -0.15 0.00 0.00 55.06 54.66 1y57 s HIS 201 Cb -0.12 -1.14 0.04 0.00 1.11 0.00 0.00 32.58 32.47 1y57 s HIS 201 CO 0.14 -0.15 -0.07 0.71 -0.85 0.00 0.00 174.74 174.51 1y57 s TYR 202 N 0.00 1.93 0.21 1.40 2.02 0.23 -4.98 117.35 118.15 1y57 s TYR 202 Ca -0.03 -1.23 -0.30 0.00 -0.37 0.00 0.00 57.07 55.14 1y57 s TYR 202 Cb -0.11 -1.42 -0.09 0.00 -0.40 0.00 0.00 41.96 39.94 1y57 s TYR 202 CO 0.02 -0.65 1.33 0.21 -1.57 0.00 0.00 175.55 174.88 1y57 s LYS 203 N 1.56 4.37 -0.39 -0.62 2.20 -1.26 -1.33 119.74 124.27 1y57 s LYS 203 Ca 0.00 2.09 -0.09 0.00 -0.36 0.00 0.00 55.97 57.61 1y57 s LYS 203 Cb -0.15 -3.18 0.05 0.00 -1.51 0.00 0.00 37.83 33.04 1y57 s LYS 203 CO -0.08 -0.27 0.21 0.42 -0.36 0.00 0.00 175.35 175.27 1y57 s ILE 204 N 0.05 4.29 0.38 5.43 1.01 0.35 -4.35 121.20 128.36 1y57 s ILE 204 Ca 0.57 -1.13 -0.02 0.00 0.00 0.00 0.00 60.65 60.07 1y57 s ILE 204 Cb -0.37 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 1y57 s ILE 204 CO 0.39 -0.34 0.61 -0.13 0.00 0.00 0.00 174.94 175.48 1y57 s ARG 205 N 1.47 3.52 -0.04 2.79 0.52 -0.43 -0.77 118.95 126.01 1y57 s ARG 205 Ca 0.02 -0.15 0.07 0.00 -0.52 0.00 0.00 55.73 55.14 1y57 s ARG 205 Cb -0.21 -2.58 -0.01 0.00 0.52 0.00 0.00 34.95 32.67 1y57 s ARG 205 CO 0.04 0.06 -0.24 0.21 0.02 0.00 0.00 175.30 175.39 1y57 s LYS 206 N -4.36 2.27 0.77 3.54 2.47 -1.26 -1.67 119.74 121.51 1y57 s LYS 206 Ca 0.42 -0.87 -0.03 0.00 -1.56 0.00 0.00 55.97 53.94 1y57 s LYS 206 Cb -0.10 -2.02 0.15 0.00 -1.46 0.00 0.00 37.83 34.40 1y57 s LYS 206 CO 0.38 0.43 1.06 -0.51 0.16 0.00 0.00 175.35 176.86 1y57 s LEU 207 N -0.31 2.92 0.14 5.43 1.43 -0.69 -5.00 118.68 122.61 1y57 s LEU 207 Ca 0.02 -0.36 -0.01 0.00 -1.03 0.00 0.00 54.13 52.74 1y57 s LEU 207 Cb -0.12 -1.87 -0.08 0.00 0.03 0.00 0.00 46.19 44.14 1y57 s LEU 207 CO 0.02 -2.05 1.31 0.44 0.23 0.00 0.00 176.35 176.30 1y57 h ASP 208 N -0.72 0.38 0.03 2.29 3.32 -2.01 -3.20 116.42 116.50 1y57 h ASP 208 Ca -0.36 -0.32 -0.00 0.00 0.02 0.00 0.00 57.03 56.36 1y57 h ASP 208 Cb 1.26 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.69 1y57 h ASP 208 CO 0.38 1.14 -0.00 0.28 -1.72 0.00 0.00 179.24 179.32 1y57 h SER 209 N 0.15 0.00 0.00 6.45 0.02 -2.04 -3.45 113.55 114.68 1y57 h SER 209 Ca -0.07 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1y57 h SER 209 Cb 1.60 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.14 1y57 h SER 209 CO 0.15 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.46 1y57 n GLY 210 N -1.10 0.80 3.83 -3.77 0.00 -1.21 -5.10 105.19 98.64 1y57 n GLY 210 Ca -0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 1y57 n GLY 210 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1y57 s GLY 211 N -1.00 1.94 -0.03 -0.02 0.00 -1.26 -4.76 107.32 102.18 1y57 s GLY 211 Ca 0.00 0.16 0.07 0.00 0.00 0.00 0.00 44.72 44.96 1y57 s GLY 211 CO 0.00 0.45 -0.24 -1.36 0.00 0.00 0.00 173.10 171.95 1y57 s PHE 212 N -2.76 2.38 -0.01 1.90 0.08 0.36 -1.70 117.98 118.24 1y57 s PHE 212 Ca 0.59 -0.42 -0.18 0.00 0.12 0.00 0.00 56.93 57.04 1y57 s PHE 212 Cb -0.12 -1.52 0.03 0.00 -0.57 0.00 0.00 43.02 40.84 1y57 s PHE 212 CO 0.41 -0.02 0.40 1.52 -0.10 0.00 0.00 175.22 177.43 1y57 s TYR 213 N -0.60 -0.28 -0.17 0.36 1.13 -0.67 -1.50 117.35 115.62 1y57 s TYR 213 Ca 0.09 0.41 -0.08 0.00 -1.41 0.00 0.00 57.07 56.08 1y57 s TYR 213 Cb -0.10 0.18 -0.23 0.00 -1.10 0.00 0.00 41.96 40.71 1y57 s TYR 213 CO -0.01 -0.47 0.20 -0.89 -2.51 0.00 0.00 175.55 171.87 1y57 n ILE 214 N 1.04 1.68 -4.80 -3.49 5.41 -1.26 -1.31 119.36 116.62 1y57 n ILE 214 Ca -0.20 -0.52 -0.26 0.00 1.00 0.00 0.00 62.75 62.77 1y57 n ILE 214 Cb 0.57 -1.75 -0.15 0.00 -0.71 0.00 0.00 39.64 37.61 1y57 n ILE 214 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1y57 s THR 215 N -2.51 1.69 0.41 1.39 -1.32 -1.26 -4.92 115.64 109.11 1y57 s THR 215 Ca -0.27 -1.09 0.14 0.00 -1.21 0.00 0.00 61.69 59.26 1y57 s THR 215 Cb 0.07 -1.44 0.35 0.00 -1.51 0.00 0.00 72.50 69.97 1y57 s THR 215 CO 0.69 0.31 1.91 -1.28 -2.21 0.00 0.00 174.62 174.05 1y57 h SER 216 N 5.15 0.44 1.05 8.08 0.87 -2.00 -2.02 113.55 125.12 1y57 h SER 216 Ca -0.42 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 1y57 h SER 216 Cb 1.15 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1y57 h SER 216 CO 0.45 0.23 0.00 0.08 -0.53 0.00 0.00 176.83 177.06 1y57 h ARG 217 N 0.47 0.00 -4.38 2.24 -0.00 -2.02 -3.40 114.38 107.30 1y57 h ARG 217 Ca 0.38 0.00 -0.63 0.00 -0.00 0.00 0.00 59.98 59.73 1y57 h ARG 217 Cb 0.81 0.00 -0.39 0.00 -0.00 0.00 0.00 29.97 30.39 1y57 h ARG 217 CO -0.13 0.00 -0.75 0.99 -0.00 0.00 0.00 179.97 180.07 1y57 s THR 218 N -3.55 1.77 0.21 0.08 2.01 -0.76 -5.12 115.64 110.28 1y57 s THR 218 Ca 0.02 -1.77 0.09 0.00 0.31 0.00 0.00 61.69 60.35 1y57 s THR 218 Cb 0.09 -2.19 -0.04 0.00 0.01 0.00 0.00 72.50 70.36 1y57 s THR 218 CO 0.52 -0.42 -0.08 -1.10 -0.69 0.00 0.00 174.62 172.85 1y57 s GLN 219 N 1.21 2.10 0.06 4.92 -0.21 -1.26 -4.40 119.66 122.07 1y57 s GLN 219 Ca 0.04 -1.33 0.01 0.00 0.02 0.00 0.00 55.36 54.11 1y57 s GLN 219 Cb -0.19 -2.14 -0.03 0.00 1.00 0.00 0.00 33.01 31.65 1y57 s GLN 219 CO -0.11 0.41 -0.06 -0.06 -2.12 0.00 0.00 175.29 173.35 1y57 s PHE 220 N -1.89 0.66 -1.36 0.91 0.08 -0.56 -4.96 117.98 110.85 1y57 s PHE 220 Ca 0.27 -0.71 0.27 0.00 0.12 0.00 0.00 56.93 56.87 1y57 s PHE 220 Cb -0.08 -0.41 0.79 0.00 -0.57 0.00 0.00 43.02 42.75 1y57 s PHE 220 CO 0.16 -0.16 1.59 0.09 -0.10 0.00 0.00 175.22 176.81 1y57 n ASN 221 N 0.84 0.62 -3.61 1.36 5.03 -1.26 -0.49 115.26 117.74 1y57 n ASN 221 Ca -0.18 -0.45 -0.12 0.00 0.87 0.00 0.00 54.58 54.69 1y57 n ASN 221 Cb 0.57 0.08 -0.05 0.00 -1.02 0.00 0.00 39.78 39.36 1y57 n ASN 221 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1y57 s SER 222 N -2.74 -0.34 0.39 6.41 1.04 -1.26 -4.85 113.70 112.35 1y57 s SER 222 Ca 0.19 -0.02 0.07 0.00 0.48 0.00 0.00 55.95 56.67 1y57 s SER 222 Cb 0.19 0.47 0.82 0.00 0.10 0.00 0.00 66.02 67.59 1y57 s SER 222 CO 0.58 -0.75 1.99 -0.07 0.98 0.00 0.00 173.24 175.98 1y57 h LEU 223 N 2.72 0.56 -0.70 2.42 3.38 -1.97 -2.32 115.31 119.40 1y57 h LEU 223 Ca -0.32 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 1y57 h LEU 223 Cb 1.23 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.82 1y57 h LEU 223 CO 0.43 0.38 0.39 1.56 0.09 0.00 0.00 178.44 181.29 1y57 h GLN 224 N 0.65 0.98 -0.04 1.13 7.50 -1.99 -0.74 115.11 122.60 1y57 h GLN 224 Ca 0.26 -0.11 -0.17 0.00 0.50 0.00 0.00 58.65 59.12 1y57 h GLN 224 Cb 0.20 -0.19 -0.01 0.00 0.05 0.00 0.00 27.48 27.53 1y57 h GLN 224 CO -0.07 0.73 -0.73 1.96 -1.50 0.00 0.00 178.83 179.21 1y57 h GLN 225 N 0.97 0.24 -0.15 1.46 4.20 -1.89 -1.57 115.11 118.35 1y57 h GLN 225 Ca 0.25 -0.20 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 1y57 h GLN 225 Cb 0.04 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1y57 h GLN 225 CO -0.04 0.87 0.09 1.25 -0.67 0.00 0.00 178.83 180.32 1y57 h LEU 226 N 0.16 0.19 -0.65 1.46 6.46 -1.07 -1.74 115.31 120.11 1y57 h LEU 226 Ca -0.03 -0.08 -0.04 0.00 -0.12 0.00 0.00 57.88 57.62 1y57 h LEU 226 Cb 1.30 -0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 41.15 1y57 h LEU 226 CO 0.11 0.21 0.26 0.58 -0.62 0.00 0.00 178.44 178.98 1y57 h VAL 227 N 0.15 1.24 -0.69 1.05 2.07 -1.07 -2.27 116.25 116.73 1y57 h VAL 227 Ca 0.05 -0.76 -0.00 0.00 0.82 0.00 0.00 66.70 66.82 1y57 h VAL 227 Cb 0.06 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 1y57 h VAL 227 CO -0.01 0.30 0.42 0.00 0.02 0.00 0.00 177.57 178.30 1y57 h ALA 228 N 1.11 0.88 -0.17 1.67 0.00 -1.16 -1.40 119.26 120.19 1y57 h ALA 228 Ca 0.22 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1y57 h ALA 228 Cb 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1y57 h ALA 228 CO -0.02 0.35 0.05 -0.92 0.00 0.00 0.00 179.25 178.72 1y57 h TYR 229 N 0.94 0.28 0.00 0.00 5.03 -1.09 -2.98 116.97 119.16 1y57 h TYR 229 Ca 0.25 -0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.53 1y57 h TYR 229 Cb -0.03 -0.08 0.00 0.00 1.55 0.00 0.00 36.73 38.16 1y57 h TYR 229 CO -0.01 0.38 0.00 0.66 -1.32 0.00 0.00 178.16 177.87 1y57 n TYR 230 N -4.82 0.77 0.31 -3.82 4.01 -0.88 -1.50 117.16 111.24 1y57 n TYR 230 Ca -0.04 0.24 0.14 0.00 -0.16 0.00 0.00 57.90 58.08 1y57 n TYR 230 Cb 0.15 -0.89 0.40 0.00 -0.31 0.00 0.00 39.34 38.68 1y57 n TYR 230 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1y57 h SER 231 N 0.00 0.00 0.07 7.72 0.02 -1.11 -1.45 113.55 118.80 1y57 h SER 231 Ca 0.00 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.61 1y57 h SER 231 Cb 0.61 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 1y57 h SER 231 CO 0.00 0.00 -1.89 0.29 -1.14 0.00 0.00 176.83 174.09 1y57 n LYS 232 N -2.91 0.69 -3.96 3.45 5.02 -0.56 -4.61 118.16 115.28 1y57 n LYS 232 Ca 0.03 0.33 -0.15 0.00 -2.02 0.00 0.00 58.31 56.50 1y57 n LYS 232 Cb 0.42 -1.69 -0.15 0.00 -0.02 0.00 0.00 35.03 33.59 1y57 n LYS 232 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1y57 s HIS 233 N -2.50 0.24 0.14 2.13 3.76 -0.76 -5.04 115.29 113.26 1y57 s HIS 233 Ca -0.26 -0.01 -0.17 0.00 -0.15 0.00 0.00 55.06 54.47 1y57 s HIS 233 Cb 0.07 -0.25 -0.00 0.00 1.11 0.00 0.00 32.58 33.51 1y57 s HIS 233 CO 0.69 -0.06 1.77 0.00 -0.85 0.00 0.00 174.74 176.29 1y57 h ALA 234 N 6.61 0.48 -6.85 -1.40 0.00 -1.85 -3.36 119.26 112.88 1y57 h ALA 234 Ca -0.34 -0.05 -0.58 0.00 0.00 0.00 0.00 54.91 53.94 1y57 h ALA 234 Cb 1.17 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 1y57 h ALA 234 CO 0.49 -0.03 -0.98 -3.47 0.00 0.00 0.00 179.25 175.27 1y57 n ASP 235 N -4.79 -2.12 0.00 0.00 2.03 -1.26 -1.61 116.55 108.80 1y57 n ASP 235 Ca -0.00 -1.23 0.00 0.00 0.52 0.00 0.00 54.79 54.08 1y57 n ASP 235 Cb 0.05 -2.01 0.00 0.00 -0.72 0.00 0.00 41.12 38.44 1y57 n ASP 235 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1y57 n GLY 236 N -2.20 2.03 3.72 0.27 0.00 -1.26 -5.08 105.19 102.67 1y57 n GLY 236 Ca -0.21 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.40 1y57 n GLY 236 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y57 s LEU 237 N 0.00 2.66 0.50 0.99 1.43 -0.63 -4.94 118.68 118.68 1y57 s LEU 237 Ca 0.00 1.79 0.14 0.00 -1.03 0.00 0.00 54.13 55.03 1y57 s LEU 237 Cb 0.00 -4.30 1.18 0.00 0.03 0.00 0.00 46.19 43.10 1y57 s LEU 237 CO 0.00 -2.55 2.12 0.00 0.23 0.00 0.00 176.35 176.16 1y57 s HIS 239 N -5.16 -0.49 0.52 0.00 5.65 -1.26 -5.07 115.29 109.48 1y57 s HIS 239 Ca -0.06 0.68 -0.23 0.00 0.25 0.00 0.00 55.06 55.71 1y57 s HIS 239 Cb 0.17 0.47 -0.06 0.00 -1.18 0.00 0.00 32.58 31.98 1y57 s HIS 239 CO 0.69 -0.55 1.36 -2.13 -0.65 0.00 0.00 174.74 173.46 1y57 n ARG 240 N 0.45 1.79 -2.36 2.88 0.63 -1.26 -4.72 116.66 114.06 1y57 n ARG 240 Ca -0.14 0.65 -0.42 0.00 -0.92 0.00 0.00 57.85 57.02 1y57 n ARG 240 Cb 0.59 -2.57 -0.03 0.00 0.45 0.00 0.00 32.46 30.91 1y57 n ARG 240 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1y57 s LEU 241 N -3.17 4.30 -0.00 6.15 1.43 -0.55 -4.51 118.68 122.33 1y57 s LEU 241 Ca 0.69 1.94 -0.01 0.00 -1.03 0.00 0.00 54.13 55.73 1y57 s LEU 241 Cb -0.43 -3.56 -0.00 0.00 0.03 0.00 0.00 46.19 42.23 1y57 s LEU 241 CO 0.51 -0.64 -0.01 0.35 0.23 0.00 0.00 176.35 176.79 1y57 n THR 242 N 4.62 0.13 -4.75 5.49 -2.24 -0.37 -4.38 114.28 112.78 1y57 n THR 242 Ca 0.12 0.21 -0.33 0.00 -2.27 0.00 0.00 64.05 61.77 1y57 n THR 242 Cb 0.45 -1.26 -0.12 0.00 -2.10 0.00 0.00 70.33 67.30 1y57 n THR 242 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1y57 s THR 243 N -1.13 3.38 0.14 4.28 2.01 -1.23 -4.98 115.64 118.11 1y57 s THR 243 Ca -0.01 -0.60 -0.30 0.00 0.31 0.00 0.00 61.69 61.09 1y57 s THR 243 Cb 0.00 -2.36 -0.07 0.00 0.01 0.00 0.00 72.50 70.07 1y57 s THR 243 CO 0.02 0.58 1.23 -0.69 -0.69 0.00 0.00 174.62 175.08 1y57 s VAL 244 N -0.63 3.62 -0.03 3.82 1.01 -1.26 -0.84 120.40 126.09 1y57 s VAL 244 Ca 0.09 1.27 -0.35 0.00 0.00 0.00 0.00 61.98 63.00 1y57 s VAL 244 Cb -0.11 -3.81 -0.13 0.00 0.00 0.00 0.00 36.38 32.32 1y57 s VAL 244 CO 0.01 0.16 1.75 0.00 0.00 0.00 0.00 175.10 177.03 1y57 s PRO 246 N 2.94 3.12 0.18 0.00 0.02 -1.26 -4.97 135.00 135.03 1y57 s PRO 246 Ca 0.89 1.17 -0.11 0.00 0.02 0.00 0.00 61.00 62.97 1y57 s PRO 246 Cb -0.75 -2.01 -0.00 0.00 0.02 0.00 0.00 34.50 31.77 1y57 s PRO 246 CO 0.49 -0.97 0.36 -0.08 -0.33 0.00 0.00 177.00 176.47 1y57 s THR 247 N -2.59 0.05 0.22 0.99 -1.32 -1.26 -4.98 115.64 106.75 1y57 s THR 247 Ca 0.63 -1.26 -0.30 0.00 -1.21 0.00 0.00 61.69 59.55 1y57 s THR 247 Cb -0.16 -1.83 -0.09 0.00 -1.51 0.00 0.00 72.50 68.90 1y57 s THR 247 CO 0.42 -0.22 1.38 -0.44 -2.21 0.00 0.00 174.62 173.55 1y57 s SER 248 N -2.95 6.78 -0.01 8.08 0.01 -1.26 -5.01 113.70 119.33 1y57 s SER 248 Ca 0.16 2.53 -0.30 0.00 1.31 0.00 0.00 55.95 59.66 1y57 s SER 248 Cb 0.02 -2.62 -0.03 0.00 0.21 0.00 0.00 66.02 63.60 1y57 s SER 248 CO 0.01 -0.62 0.97 -0.75 0.41 0.00 0.00 173.24 173.26 1y57 s LYS 249 N -0.19 4.54 0.69 12.44 2.20 -1.26 -5.06 119.74 133.10 1y57 s LYS 249 Ca 0.58 1.39 -0.11 0.00 -0.36 0.00 0.00 55.97 57.47 1y57 s LYS 249 Cb -0.39 -3.47 0.00 0.00 -1.51 0.00 0.00 37.83 32.47 1y57 s LYS 249 CO 0.40 -0.07 1.06 -1.25 -0.36 0.00 0.00 175.35 175.13 1y57 s PRO 250 N 1.08 3.00 0.52 4.03 0.04 -1.26 -5.03 135.00 137.38 1y57 s PRO 250 Ca 0.51 0.87 -0.20 0.00 0.04 0.00 0.00 61.00 62.22 1y57 s PRO 250 Cb -0.21 -2.00 -0.07 0.00 0.04 0.00 0.00 34.50 32.26 1y57 s PRO 250 CO 0.27 -1.03 1.11 -0.65 0.04 0.00 0.00 177.00 176.73 1y57 s GLN 251 N -5.09 3.52 0.83 4.56 -0.21 -1.26 -5.04 119.66 116.96 1y57 s GLN 251 Ca 0.58 1.55 -0.10 0.00 0.02 0.00 0.00 55.36 57.41 1y57 s GLN 251 Cb -0.13 -2.07 0.09 0.00 1.00 0.00 0.00 33.01 31.90 1y57 s GLN 251 CO 0.55 -0.70 1.11 0.95 -2.12 0.00 0.00 175.29 175.08 1y57 s THR 252 N -1.81 2.82 -0.66 -0.19 -4.23 -1.26 -4.98 115.64 105.33 1y57 s THR 252 Ca 0.70 0.27 -0.19 0.00 -1.18 0.00 0.00 61.69 61.30 1y57 s THR 252 Cb -0.22 -2.58 0.11 0.00 1.34 0.00 0.00 72.50 71.16 1y57 s THR 252 CO 0.25 -0.35 0.80 -1.10 -0.54 0.00 0.00 174.62 173.68 1y57 s GLN 253 N -4.79 3.17 0.11 3.99 -0.21 -1.26 -4.89 119.66 115.79 1y57 s GLN 253 Ca 0.63 -1.42 0.00 0.00 0.02 0.00 0.00 55.36 54.59 1y57 s GLN 253 Cb -0.19 -4.36 0.00 0.00 1.00 0.00 0.00 33.01 29.45 1y57 s GLN 253 CO 0.57 -1.58 0.00 0.41 -2.12 0.00 0.00 175.29 172.56 1y57 n GLY 254 N 5.20 -2.08 3.88 3.09 0.00 -1.26 -4.82 105.19 109.20 1y57 n GLY 254 Ca -0.03 -1.41 -0.34 0.00 0.00 0.00 0.00 46.02 44.24 1y57 n GLY 254 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y57 s LEU 255 N -5.41 4.35 0.45 0.99 1.43 -1.26 -5.08 118.68 114.15 1y57 s LEU 255 Ca 0.00 0.67 -0.25 0.00 -1.03 0.00 0.00 54.13 53.52 1y57 s LEU 255 Cb 0.00 -2.88 -0.08 0.00 0.03 0.00 0.00 46.19 43.26 1y57 s LEU 255 CO 0.00 0.20 1.37 0.00 0.23 0.00 0.00 176.35 178.15 1y57 s ALA 256 N -1.38 3.18 0.10 4.21 0.00 -1.26 -5.04 121.76 121.57 1y57 s ALA 256 Ca 0.31 1.36 0.06 0.00 0.00 0.00 0.00 51.96 53.69 1y57 s ALA 256 Cb -0.13 -3.55 -0.03 0.00 0.00 0.00 0.00 23.12 19.40 1y57 s ALA 256 CO 0.18 -1.08 -0.15 0.15 0.00 0.00 0.00 175.76 174.86 1y57 s LYS 257 N -2.45 0.94 0.00 0.00 1.02 -1.26 -4.92 119.74 113.07 1y57 s LYS 257 Ca 0.61 -1.09 0.00 0.00 0.02 0.00 0.00 55.97 55.51 1y57 s LYS 257 Cb -0.41 -0.94 0.00 0.00 -0.52 0.00 0.00 37.83 35.96 1y57 s LYS 257 CO 0.52 0.20 0.00 -0.40 -0.92 0.00 0.00 175.35 174.75 1y57 n ASP 258 N 0.97 0.66 0.00 2.83 5.68 -1.26 -4.84 116.55 120.59 1y57 n ASP 258 Ca -0.19 -0.36 0.10 0.00 -0.50 0.00 0.00 54.79 53.84 1y57 n ASP 258 Cb 0.55 0.00 0.48 0.00 -1.14 0.00 0.00 41.12 41.01 1y57 n ASP 258 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1y57 n ALA 259 N -3.00 2.01 0.59 2.12 0.00 -1.26 -2.11 120.51 118.86 1y57 n ALA 259 Ca 0.00 -0.09 0.12 0.00 0.00 0.00 0.00 53.44 53.48 1y57 n ALA 259 Cb 0.00 -1.32 0.45 0.00 0.00 0.00 0.00 19.45 18.58 1y57 n ALA 259 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1y57 n TRP 260 N -1.35 0.72 -2.05 0.00 7.02 -1.26 -4.86 117.44 115.67 1y57 n TRP 260 Ca 0.08 0.24 -0.41 0.00 -1.02 0.00 0.00 57.50 56.39 1y57 n TRP 260 Cb 0.18 -0.88 -0.02 0.00 -2.42 0.00 0.00 31.31 28.17 1y57 n TRP 260 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 1y57 s GLU 261 N -3.15 4.30 0.14 -0.99 2.56 -0.90 -1.71 118.70 118.95 1y57 s GLU 261 Ca 0.09 2.28 0.06 0.00 0.00 0.00 0.00 54.97 57.40 1y57 s GLU 261 Cb 0.12 -3.08 -0.04 0.00 2.00 0.00 0.00 34.13 33.13 1y57 s GLU 261 CO 0.50 -0.32 -0.15 0.96 -0.56 0.00 0.00 175.26 175.70 1y57 s ILE 262 N -0.63 1.46 0.23 -3.70 -4.36 -0.74 -4.90 121.20 108.56 1y57 s ILE 262 Ca 0.54 -1.84 -0.30 0.00 -0.26 0.00 0.00 60.65 58.78 1y57 s ILE 262 Cb -0.41 -1.68 -0.10 0.00 1.25 0.00 0.00 42.46 41.52 1y57 s ILE 262 CO 0.49 -0.45 1.40 -2.16 0.24 0.00 0.00 174.94 174.46 1y57 s PRO 263 N -2.91 4.31 0.54 0.37 0.05 -1.26 -4.69 135.00 131.40 1y57 s PRO 263 Ca 0.12 2.21 0.27 0.00 0.05 0.00 0.00 61.00 63.66 1y57 s PRO 263 Cb -0.04 -3.14 1.52 0.00 0.05 0.00 0.00 34.50 32.89 1y57 s PRO 263 CO 0.04 -0.37 2.11 -0.09 0.05 0.00 0.00 177.00 178.74 1y57 h ARG 264 N 5.26 0.00 0.00 4.56 2.43 -1.96 -2.02 114.38 122.64 1y57 h ARG 264 Ca -0.45 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 1y57 h ARG 264 Cb 1.22 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.77 1y57 h ARG 264 CO 0.78 0.09 0.00 0.93 -1.51 0.00 0.00 179.97 180.27 1y57 h GLU 265 N 0.00 0.00 0.00 0.20 3.07 -2.03 -1.36 114.58 114.46 1y57 h GLU 265 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1y57 h GLU 265 Cb 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 1y57 h GLU 265 CO 0.01 0.00 0.00 -1.13 -1.40 0.00 0.00 179.01 176.49 1y57 n SER 266 N -2.47 0.00 -4.47 1.42 3.41 -0.76 -4.80 113.62 105.94 1y57 n SER 266 Ca 0.00 -0.25 -0.33 0.00 -0.26 0.00 0.00 58.87 58.04 1y57 n SER 266 Cb 0.16 -0.21 -0.13 0.00 -0.26 0.00 0.00 64.21 63.77 1y57 n SER 266 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1y57 s LEU 267 N -2.42 2.71 -0.17 1.04 1.43 -0.52 -0.71 118.68 120.05 1y57 s LEU 267 Ca 0.26 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.17 1y57 s LEU 267 Cb 0.16 -1.55 0.02 0.00 0.03 0.00 0.00 46.19 44.86 1y57 s LEU 267 CO 0.34 0.35 -0.18 -0.60 0.23 0.00 0.00 176.35 176.48 1y57 s ARG 268 N -0.73 2.76 0.05 1.70 3.52 -0.35 -4.99 118.95 120.91 1y57 s ARG 268 Ca 0.11 -0.74 -0.30 0.00 -0.13 0.00 0.00 55.73 54.67 1y57 s ARG 268 Cb -0.11 -2.40 -0.04 0.00 -1.56 0.00 0.00 34.95 30.85 1y57 s ARG 268 CO 0.00 -0.20 0.98 -0.51 -0.81 0.00 0.00 175.30 174.77 1y57 s LEU 269 N 1.31 4.42 0.05 -0.88 1.43 -1.26 -1.19 118.68 122.56 1y57 s LEU 269 Ca 0.04 1.73 -0.01 0.00 -1.03 0.00 0.00 54.13 54.86 1y57 s LEU 269 Cb -0.13 -3.58 -0.01 0.00 0.03 0.00 0.00 46.19 42.50 1y57 s LEU 269 CO -0.11 -0.19 -0.03 -0.62 0.23 0.00 0.00 176.35 175.63 1y57 n GLU 270 N 3.42 0.04 -4.39 1.70 1.02 -0.10 -4.98 120.64 117.36 1y57 n GLU 270 Ca 0.05 0.02 -0.26 0.00 -0.02 0.00 0.00 57.16 56.94 1y57 n GLU 270 Cb 0.50 -0.57 -0.17 0.00 -0.02 0.00 0.00 31.44 31.18 1y57 n GLU 270 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1y57 s VAL 271 N -2.06 1.16 -0.23 2.62 1.01 -0.71 -4.99 120.40 117.20 1y57 s VAL 271 Ca -0.02 -0.46 -0.29 0.00 0.00 0.00 0.00 61.98 61.21 1y57 s VAL 271 Cb 0.01 -1.09 0.01 0.00 0.00 0.00 0.00 36.38 35.30 1y57 s VAL 271 CO 0.03 0.37 1.07 -0.75 0.00 0.00 0.00 175.10 175.82 1y57 s LYS 272 N 0.98 4.23 -0.04 2.72 2.20 -1.26 -0.43 119.74 128.14 1y57 s LYS 272 Ca -0.08 1.35 0.08 0.00 -0.36 0.00 0.00 55.97 56.96 1y57 s LYS 272 Cb -0.15 -3.66 -0.24 0.00 -1.51 0.00 0.00 37.83 32.27 1y57 s LYS 272 CO -0.00 -0.67 0.67 -0.07 -0.36 0.00 0.00 175.35 174.91 1y57 h LEU 273 N 9.55 0.09 -7.64 5.43 3.38 -0.82 -3.48 115.31 121.83 1y57 h LEU 273 Ca -0.20 -0.19 0.38 0.00 0.09 0.00 0.00 57.88 57.96 1y57 h LEU 273 Cb 1.06 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 41.69 1y57 h LEU 273 CO 0.99 1.17 0.96 -0.83 0.09 0.00 0.00 178.44 180.82 1y57 s GLY 274 N -5.15 -0.29 0.15 0.83 0.00 -1.06 -4.99 107.32 96.81 1y57 s GLY 274 Ca -0.07 0.40 -0.21 0.00 0.00 0.00 0.00 44.72 44.84 1y57 s GLY 274 CO 0.82 4.09 0.54 -0.86 0.00 0.00 0.00 173.10 177.68 1y57 s GLN 275 N -2.06 1.23 0.00 2.90 -2.07 -1.26 -1.21 119.66 117.19 1y57 s GLN 275 Ca 0.25 -0.57 0.00 0.00 -1.82 0.00 0.00 55.36 53.22 1y57 s GLN 275 Cb 0.02 0.55 0.00 0.00 -1.09 0.00 0.00 33.01 32.49 1y57 s GLN 275 CO -0.03 -0.52 0.00 0.41 -1.32 0.00 0.00 175.29 173.82 1y57 n GLY 276 N -0.33 2.09 0.23 2.60 0.00 -0.29 -5.01 105.19 104.48 1y57 n GLY 276 Ca -0.16 -0.85 0.06 0.00 0.00 0.00 0.00 46.02 45.08 1y57 n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y57 n PHE 278 N -4.22 0.00 -0.35 0.00 3.72 -1.26 -4.89 117.46 110.46 1y57 n PHE 278 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1y57 n PHE 278 Cb 0.24 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.78 1y57 n PHE 278 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1y57 n GLY 279 N 1.06 0.35 3.28 1.37 0.00 -1.14 -0.69 105.19 109.41 1y57 n GLY 279 Ca 0.10 -1.38 -0.15 0.00 0.00 0.00 0.00 46.02 44.58 1y57 n GLY 279 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y57 s GLU 280 N -2.00 1.21 -0.06 1.61 2.02 -1.00 -1.13 118.70 119.34 1y57 s GLU 280 Ca 0.00 -1.59 0.02 0.00 0.02 0.00 0.00 54.97 53.42 1y57 s GLU 280 Cb 0.00 -0.45 0.01 0.00 0.10 0.00 0.00 34.13 33.79 1y57 s GLU 280 CO 0.00 -0.10 -0.12 0.08 0.02 0.00 0.00 175.26 175.15 1y57 s VAL 281 N -3.52 1.08 0.15 2.63 1.01 -0.35 -0.85 120.40 120.55 1y57 s VAL 281 Ca 0.25 -0.45 0.10 0.00 0.00 0.00 0.00 61.98 61.88 1y57 s VAL 281 Cb 0.06 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 1y57 s VAL 281 CO 0.06 0.34 -0.22 0.26 0.00 0.00 0.00 175.10 175.54 1y57 s TRP 282 N 0.63 2.05 -0.03 5.22 0.52 0.15 -0.06 118.94 127.42 1y57 s TRP 282 Ca -0.13 -0.41 -0.14 0.00 0.02 0.00 0.00 56.10 55.44 1y57 s TRP 282 Cb -0.15 -1.06 -0.05 0.00 -1.15 0.00 0.00 33.47 31.06 1y57 s TRP 282 CO 0.03 0.36 0.38 1.41 0.02 0.00 0.00 176.95 179.15 1y57 s MET 283 N -2.43 3.91 0.00 4.98 -2.45 0.43 -0.16 119.30 123.58 1y57 s MET 283 Ca 0.15 0.34 0.00 0.00 -1.25 0.00 0.00 55.69 54.93 1y57 s MET 283 Cb -0.08 -3.24 0.00 0.00 1.25 0.00 0.00 34.83 32.76 1y57 s MET 283 CO 0.07 0.65 0.00 0.41 1.05 0.00 0.00 175.02 177.20 1y57 n GLY 284 N 2.00 2.46 3.16 2.11 0.00 -0.27 -0.92 105.19 113.73 1y57 n GLY 284 Ca -0.14 -1.09 -0.25 0.00 0.00 0.00 0.00 46.02 44.54 1y57 n GLY 284 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y57 s THR 285 N -2.81 1.37 -0.09 2.61 2.01 -0.33 -1.23 115.64 117.16 1y57 s THR 285 Ca 0.00 -0.74 0.04 0.00 0.31 0.00 0.00 61.69 61.30 1y57 s THR 285 Cb 0.00 -1.14 -0.00 0.00 0.01 0.00 0.00 72.50 71.37 1y57 s THR 285 CO 0.00 0.39 -0.24 0.86 -0.69 0.00 0.00 174.62 174.94 1y57 s TRP 286 N -0.41 2.54 -1.48 4.92 -0.00 0.35 -1.21 118.94 123.66 1y57 s TRP 286 Ca 0.07 -0.96 0.00 0.00 -0.00 0.00 0.00 56.10 55.20 1y57 s TRP 286 Cb -0.07 -1.69 0.00 0.00 -0.00 0.00 0.00 33.47 31.71 1y57 s TRP 286 CO -0.01 -0.37 0.00 0.09 -0.00 0.00 0.00 176.95 176.67 1y57 n ASN 287 N 3.39 -4.77 0.00 5.86 3.02 0.11 -1.53 115.26 121.33 1y57 n ASN 287 Ca -0.19 0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.52 1y57 n ASN 287 Cb 0.53 -4.07 0.00 0.00 -0.61 0.00 0.00 39.78 35.63 1y57 n ASN 287 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1y57 n GLY 288 N -0.79 0.40 0.00 7.41 0.00 -1.26 -4.70 105.19 106.26 1y57 n GLY 288 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1y57 n GLY 288 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1y57 n THR 289 N -2.13 0.00 -4.10 2.61 5.66 -0.96 -5.08 114.28 110.28 1y57 n THR 289 Ca 0.00 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.66 1y57 n THR 289 Cb 0.07 -0.13 -0.14 0.00 -1.55 0.00 0.00 70.33 68.59 1y57 n THR 289 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1y57 s THR 290 N -1.03 3.34 0.17 1.09 2.01 -0.58 -4.94 115.64 115.70 1y57 s THR 290 Ca 0.00 -0.52 -0.30 0.00 0.31 0.00 0.00 61.69 61.18 1y57 s THR 290 Cb 0.00 -2.49 -0.08 0.00 0.01 0.00 0.00 72.50 69.93 1y57 s THR 290 CO 0.00 0.45 1.29 -0.60 -0.69 0.00 0.00 174.62 175.07 1y57 s ARG 291 N 1.18 4.40 0.07 4.92 3.52 -1.26 -0.50 118.95 131.28 1y57 s ARG 291 Ca 0.02 2.01 -0.03 0.00 -0.13 0.00 0.00 55.73 57.60 1y57 s ARG 291 Cb -0.14 -3.22 -0.03 0.00 -1.56 0.00 0.00 34.95 29.99 1y57 s ARG 291 CO -0.01 -0.25 0.04 0.14 -0.81 0.00 0.00 175.30 174.40 1y57 s VAL 292 N 0.30 0.19 -0.11 7.11 -7.23 -0.36 -4.19 120.40 116.10 1y57 s VAL 292 Ca 0.57 -1.67 -0.05 0.00 -1.81 0.00 0.00 61.98 59.02 1y57 s VAL 292 Cb -0.35 -1.55 -0.04 0.00 0.56 0.00 0.00 36.38 35.00 1y57 s VAL 292 CO 0.36 -0.84 0.09 0.00 -0.31 0.00 0.00 175.10 174.40 1y57 s ALA 293 N -3.92 3.66 -0.23 1.32 0.00 -0.38 -1.11 121.76 121.10 1y57 s ALA 293 Ca 0.09 -0.70 0.01 0.00 0.00 0.00 0.00 51.96 51.36 1y57 s ALA 293 Cb 0.07 -1.81 0.05 0.00 0.00 0.00 0.00 23.12 21.43 1y57 s ALA 293 CO -0.09 0.58 -0.08 0.42 0.00 0.00 0.00 175.76 176.59 1y57 s ILE 294 N -0.88 1.67 -0.17 0.00 1.01 0.78 -1.21 121.20 122.39 1y57 s ILE 294 Ca 0.14 -1.21 -0.15 0.00 0.00 0.00 0.00 60.65 59.42 1y57 s ILE 294 Cb -0.12 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.46 1y57 s ILE 294 CO 0.03 0.00 0.35 -0.75 0.00 0.00 0.00 174.94 174.58 1y57 s LYS 295 N 1.35 4.23 0.02 2.79 2.20 0.23 -0.67 119.74 129.89 1y57 s LYS 295 Ca -0.05 0.17 0.06 0.00 -0.36 0.00 0.00 55.97 55.79 1y57 s LYS 295 Cb -0.18 -3.47 -0.03 0.00 -1.51 0.00 0.00 37.83 32.63 1y57 s LYS 295 CO -0.07 0.12 -0.16 0.95 -0.36 0.00 0.00 175.35 175.83 1y57 s THR 296 N 0.82 2.95 -0.23 3.43 -4.23 -0.03 -0.48 115.64 117.88 1y57 s THR 296 Ca 0.18 -1.04 -0.10 0.00 -1.18 0.00 0.00 61.69 59.55 1y57 s THR 296 Cb -0.14 -2.23 -0.05 0.00 1.34 0.00 0.00 72.50 71.42 1y57 s THR 296 CO 0.06 0.39 0.16 -0.22 -0.54 0.00 0.00 174.62 174.47 1y57 s LEU 297 N -1.30 4.14 -0.16 4.79 2.96 -0.50 -2.38 118.68 126.22 1y57 s LEU 297 Ca 0.14 0.15 -0.29 0.00 -0.22 0.00 0.00 54.13 53.91 1y57 s LEU 297 Cb -0.11 -2.11 -0.01 0.00 0.50 0.00 0.00 46.19 44.46 1y57 s LEU 297 CO 0.05 0.09 1.26 -0.75 -1.32 0.00 0.00 176.35 175.68 1y57 s LYS 298 N 0.90 4.23 0.67 1.98 2.20 0.14 -4.22 119.74 125.64 1y57 s LYS 298 Ca 0.08 1.66 -0.17 0.00 -0.36 0.00 0.00 55.97 57.18 1y57 s LYS 298 Cb -0.13 -3.76 -0.01 0.00 -1.51 0.00 0.00 37.83 32.42 1y57 s LYS 298 CO 0.03 -0.70 1.01 -2.30 -0.36 0.00 0.00 175.35 173.03 1y57 n PRO 299 N 6.58 0.71 -0.99 4.03 -0.02 -1.26 -3.02 135.00 141.03 1y57 n PRO 299 Ca 0.14 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 1y57 n PRO 299 Cb 0.45 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1y57 n PRO 299 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1y57 n GLY 300 N 1.14 0.69 0.00 -1.23 0.00 -1.26 -4.96 105.19 99.58 1y57 n GLY 300 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1y57 n GLY 300 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1y57 n THR 301 N -2.50 0.00 -1.74 2.61 -2.24 -1.17 -5.08 114.28 104.16 1y57 n THR 301 Ca 0.00 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.47 1y57 n THR 301 Cb 0.02 0.00 0.04 0.00 -2.10 0.00 0.00 70.33 68.29 1y57 n THR 301 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1y57 s MET 302 N 2.47 2.99 0.52 -0.78 0.23 -1.26 -5.00 119.30 118.47 1y57 s MET 302 Ca 0.00 0.71 -0.21 0.00 -1.03 0.00 0.00 55.69 55.16 1y57 s MET 302 Cb 0.00 -2.01 -0.06 0.00 -1.53 0.00 0.00 34.83 31.23 1y57 s MET 302 CO 0.00 -1.00 1.21 -1.54 -2.03 0.00 0.00 175.02 171.66 1y57 s SER 303 N -4.08 5.70 0.32 -1.18 1.04 -1.26 -4.86 113.70 109.38 1y57 s SER 303 Ca 0.58 2.40 0.09 0.00 0.48 0.00 0.00 55.95 59.49 1y57 s SER 303 Cb -0.12 -2.61 0.83 0.00 0.10 0.00 0.00 66.02 64.22 1y57 s SER 303 CO 0.54 -1.25 1.76 -0.65 0.98 0.00 0.00 173.24 174.62 1y57 h PRO 304 N 1.54 0.64 -0.29 4.02 0.11 -1.99 -1.31 132.00 134.72 1y57 h PRO 304 Ca -0.50 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.55 1y57 h PRO 304 Cb 1.27 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1y57 h PRO 304 CO 0.58 0.42 0.11 0.93 -0.21 0.00 0.00 178.00 179.84 1y57 h GLU 305 N 0.66 0.43 -0.72 1.05 3.07 -1.98 -0.61 114.58 116.48 1y57 h GLU 305 Ca 0.60 -0.08 -0.05 0.00 -0.50 0.00 0.00 59.36 59.33 1y57 h GLU 305 Cb 1.07 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.88 1y57 h GLU 305 CO -0.40 0.45 0.24 0.00 -1.40 0.00 0.00 179.01 177.90 1y57 h ALA 306 N 0.96 0.94 -0.49 3.43 0.00 -1.82 -2.21 119.26 120.07 1y57 h ALA 306 Ca 0.10 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1y57 h ALA 306 Cb 0.18 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1y57 h ALA 306 CO -0.01 0.61 0.30 0.35 0.00 0.00 0.00 179.25 180.51 1y57 h PHE 307 N 1.06 0.64 0.00 0.00 3.57 -1.00 -2.72 116.94 118.49 1y57 h PHE 307 Ca 0.23 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.74 1y57 h PHE 307 Cb 0.29 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.81 1y57 h PHE 307 CO 0.02 0.44 0.00 1.28 -2.23 0.00 0.00 178.31 177.82 1y57 n LEU 308 N -4.71 0.00 -0.28 0.59 4.77 -0.26 -3.31 117.00 113.81 1y57 n LEU 308 Ca 0.02 0.32 0.12 0.00 -0.03 0.00 0.00 56.01 56.44 1y57 n LEU 308 Cb 0.05 -0.32 0.37 0.00 -2.33 0.00 0.00 43.42 41.19 1y57 n LEU 308 CO 0.36 -0.03 1.22 1.56 -1.33 0.00 0.00 177.39 179.16 1y57 h GLN 309 N 0.00 0.69 -0.64 3.23 4.20 -1.07 -0.54 115.11 120.99 1y57 h GLN 309 Ca 0.00 -0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.72 1y57 h GLN 309 Cb 0.29 -0.16 -0.05 0.00 0.30 0.00 0.00 27.48 27.86 1y57 h GLN 309 CO 0.00 0.46 0.36 1.49 -0.67 0.00 0.00 178.83 180.47 1y57 h GLU 310 N 0.71 0.67 -0.41 1.46 4.81 -1.74 -2.11 114.58 117.98 1y57 h GLU 310 Ca 0.46 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.51 1y57 h GLU 310 Cb 0.72 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 1y57 h GLU 310 CO -0.22 0.44 -0.29 0.00 -0.73 0.00 0.00 179.01 178.21 1y57 h ALA 311 N 1.32 0.71 -0.70 2.92 0.00 -1.37 -2.56 119.26 119.58 1y57 h ALA 311 Ca 0.28 -0.41 0.09 0.00 0.00 0.00 0.00 54.91 54.86 1y57 h ALA 311 Cb 0.13 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 1y57 h ALA 311 CO -0.16 0.66 0.36 0.37 0.00 0.00 0.00 179.25 180.48 1y57 h GLN 312 N 0.75 0.60 -0.29 0.00 4.15 -0.84 -0.80 115.11 118.67 1y57 h GLN 312 Ca 0.08 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.45 1y57 h GLN 312 Cb 0.85 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.40 1y57 h GLN 312 CO 0.08 0.40 0.11 0.28 -1.93 0.00 0.00 178.83 177.76 1y57 h VAL 313 N 0.62 1.18 0.00 2.39 2.07 -1.33 -3.02 116.25 118.16 1y57 h VAL 313 Ca 0.34 -0.56 -0.02 0.00 0.82 0.00 0.00 66.70 67.27 1y57 h VAL 313 Cb 0.33 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1y57 h VAL 313 CO -0.25 0.19 -0.10 0.24 0.02 0.00 0.00 177.57 177.67 1y57 h MET 314 N 0.32 0.00 -0.02 1.57 2.86 -1.01 -1.95 114.93 116.71 1y57 h MET 314 Ca 0.10 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.67 1y57 h MET 314 Cb 0.19 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 1y57 h MET 314 CO -0.01 0.10 -0.29 0.87 1.06 0.00 0.00 176.91 178.65 1y57 h LYS 315 N 0.00 0.03 0.02 1.72 1.57 -1.03 -3.23 116.57 115.65 1y57 h LYS 315 Ca -0.00 -0.01 -0.31 0.00 -1.87 0.00 0.00 60.65 58.46 1y57 h LYS 315 Cb 0.47 -0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.73 1y57 h LYS 315 CO 0.01 0.32 -1.84 1.17 -0.57 0.00 0.00 179.45 178.54 1y57 n LYS 316 N -4.19 0.66 -3.52 3.15 3.00 -0.85 -4.84 118.16 111.58 1y57 n LYS 316 Ca -0.02 0.26 -0.42 0.00 -0.00 0.00 0.00 58.31 58.13 1y57 n LYS 316 Cb 0.34 -1.75 -0.10 0.00 0.00 0.00 0.00 35.03 33.52 1y57 n LYS 316 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1y57 s LEU 317 N -6.21 5.09 -0.14 3.14 1.43 -0.79 -5.05 118.68 116.15 1y57 s LEU 317 Ca -0.09 -1.13 -0.00 0.00 -1.03 0.00 0.00 54.13 51.88 1y57 s LEU 317 Cb 0.08 -2.09 0.03 0.00 0.03 0.00 0.00 46.19 44.24 1y57 s LEU 317 CO 0.81 -0.48 -0.09 -0.60 0.23 0.00 0.00 176.35 176.21 1y57 s ARG 318 N 1.58 1.78 -0.07 1.70 3.52 -1.26 -4.75 118.95 121.44 1y57 s ARG 318 Ca 0.03 -0.45 -0.30 0.00 -0.13 0.00 0.00 55.73 54.88 1y57 s ARG 318 Cb -0.21 -1.90 0.09 0.00 -1.56 0.00 0.00 34.95 31.37 1y57 s ARG 318 CO 0.07 -0.31 0.80 -1.58 -0.81 0.00 0.00 175.30 173.47 1y57 s HIS 319 N 1.60 -0.53 0.54 5.12 2.46 -1.26 -5.05 115.29 118.16 1y57 s HIS 319 Ca 0.04 0.86 0.32 0.00 0.47 0.00 0.00 55.06 56.74 1y57 s HIS 319 Cb -0.13 0.44 1.82 0.00 -0.13 0.00 0.00 32.58 34.57 1y57 s HIS 319 CO -0.09 -0.53 2.22 1.05 -2.47 0.00 0.00 174.74 174.92 1y57 h GLU 320 N 2.73 0.00 -0.39 2.88 4.11 -1.99 -2.12 114.58 119.80 1y57 h GLU 320 Ca -0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.19 1y57 h GLU 320 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1y57 h GLU 320 CO 0.36 0.04 0.00 1.63 0.07 0.00 0.00 179.01 181.10 1y57 n LYS 321 N -3.62 3.63 -5.18 1.06 4.76 -1.26 -4.88 118.16 112.66 1y57 n LYS 321 Ca -0.03 -2.92 -0.30 0.00 -2.87 0.00 0.00 58.31 52.19 1y57 n LYS 321 Cb 0.13 -1.96 -0.16 0.00 -1.84 0.00 0.00 35.03 31.20 1y57 n LYS 321 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1y57 s LEU 322 N -2.67 2.04 0.22 -0.35 1.43 -0.80 -0.77 118.68 117.78 1y57 s LEU 322 Ca 0.46 -0.45 -0.32 0.00 -1.03 0.00 0.00 54.13 52.79 1y57 s LEU 322 Cb 0.36 -1.26 -0.12 0.00 0.03 0.00 0.00 46.19 45.19 1y57 s LEU 322 CO 0.12 0.26 1.64 0.52 0.23 0.00 0.00 176.35 179.12 1y57 n VAL 323 N 2.75 0.30 -3.30 -1.59 0.31 -0.66 -4.62 118.33 111.52 1y57 n VAL 323 Ca -0.17 -0.08 -0.38 0.00 -0.01 0.00 0.00 64.34 63.71 1y57 n VAL 323 Cb 0.52 -1.84 -0.06 0.00 -0.91 0.00 0.00 33.84 31.55 1y57 n VAL 323 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1y57 s GLN 324 N 0.61 4.27 0.23 5.55 0.74 -1.26 -4.97 119.66 124.83 1y57 s GLN 324 Ca 0.73 0.54 -0.30 0.00 0.05 0.00 0.00 55.36 56.38 1y57 s GLN 324 Cb -0.55 -3.38 -0.09 0.00 1.10 0.00 0.00 33.01 30.09 1y57 s GLN 324 CO 0.38 0.30 1.13 -1.17 -0.55 0.00 0.00 175.29 175.38 1y57 s LEU 325 N 0.13 4.50 -0.13 3.68 2.96 -1.26 -1.58 118.68 126.98 1y57 s LEU 325 Ca 0.27 2.22 0.02 0.00 -0.22 0.00 0.00 54.13 56.42 1y57 s LEU 325 Cb -0.16 -3.62 -0.09 0.00 0.50 0.00 0.00 46.19 42.82 1y57 s LEU 325 CO 0.13 -0.24 -0.10 -1.22 -1.32 0.00 0.00 176.35 173.61 1y57 n TYR 326 N 1.87 0.00 -3.60 5.38 4.01 0.41 -4.89 117.16 120.33 1y57 n TYR 326 Ca 0.01 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.72 1y57 n TYR 326 Cb 0.45 -0.51 -0.01 0.00 -0.31 0.00 0.00 39.34 38.96 1y57 n TYR 326 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1y57 s ALA 327 N -2.26 -2.04 0.11 -0.72 0.00 -0.93 -5.00 121.76 110.92 1y57 s ALA 327 Ca -0.16 1.11 0.04 0.00 0.00 0.00 0.00 51.96 52.95 1y57 s ALA 327 Cb 0.04 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.30 1y57 s ALA 327 CO 0.32 -0.79 -0.11 0.14 0.00 0.00 0.00 175.76 175.33 1y57 s VAL 328 N -2.61 1.05 -0.21 0.00 -7.23 -0.69 -0.70 120.40 110.01 1y57 s VAL 328 Ca 0.10 -1.75 0.02 0.00 -1.81 0.00 0.00 61.98 58.54 1y57 s VAL 328 Cb 0.01 -1.50 0.04 0.00 0.56 0.00 0.00 36.38 35.49 1y57 s VAL 328 CO -0.04 -0.58 -0.14 -0.69 -0.31 0.00 0.00 175.10 173.34 1y57 s VAL 329 N -2.60 1.93 -0.44 1.32 1.01 -0.63 -1.79 120.40 119.20 1y57 s VAL 329 Ca 0.08 -1.16 0.15 0.00 0.00 0.00 0.00 61.98 61.05 1y57 s VAL 329 Cb -0.02 -1.92 0.81 0.00 0.00 0.00 0.00 36.38 35.24 1y57 s VAL 329 CO 0.01 0.24 1.73 -1.20 0.00 0.00 0.00 175.10 175.88 1y57 n SER 330 N 4.59 5.55 -4.46 3.32 7.64 -1.26 -1.77 113.62 127.23 1y57 n SER 330 Ca -0.17 -2.83 -0.28 0.00 1.01 0.00 0.00 58.87 56.60 1y57 n SER 330 Cb 0.46 -0.67 -0.12 0.00 -1.01 0.00 0.00 64.21 62.88 1y57 n SER 330 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1y57 s GLU 331 N -2.57 1.65 0.29 1.43 2.02 -1.26 -4.77 118.70 115.49 1y57 s GLU 331 Ca 0.54 -1.33 -0.29 0.00 0.02 0.00 0.00 54.97 53.91 1y57 s GLU 331 Cb 0.40 -1.99 -0.10 0.00 0.10 0.00 0.00 34.13 32.54 1y57 s GLU 331 CO 0.18 0.44 1.32 -1.21 0.02 0.00 0.00 175.26 176.01 1y57 s GLU 332 N -2.36 4.37 0.15 1.61 2.02 -1.26 -3.17 118.70 120.06 1y57 s GLU 332 Ca 0.19 2.17 -0.30 0.00 0.02 0.00 0.00 54.97 57.05 1y57 s GLU 332 Cb -0.09 -3.11 -0.07 0.00 0.10 0.00 0.00 34.13 30.96 1y57 s GLU 332 CO 0.10 -0.21 1.02 -1.25 0.02 0.00 0.00 175.26 174.93 1y57 s PRO 333 N -1.18 4.67 0.28 0.39 0.04 -1.26 -5.10 135.00 132.83 1y57 s PRO 333 Ca 0.52 1.57 -0.30 0.00 0.04 0.00 0.00 61.00 62.84 1y57 s PRO 333 Cb -0.39 -3.32 -0.10 0.00 0.04 0.00 0.00 34.50 30.72 1y57 s PRO 333 CO 0.47 0.18 1.44 0.42 0.04 0.00 0.00 177.00 179.55 1y57 s ILE 334 N -0.21 2.54 -0.01 0.56 -1.09 -1.19 -4.81 121.20 116.99 1y57 s ILE 334 Ca 0.48 0.47 0.06 0.00 -2.23 0.00 0.00 60.65 59.43 1y57 s ILE 334 Cb -0.26 -3.30 -0.03 0.00 -1.58 0.00 0.00 42.46 37.29 1y57 s ILE 334 CO 0.32 0.09 -0.20 -0.31 -1.23 0.00 0.00 174.94 173.61 1y57 s TYR 335 N -0.29 2.52 -0.17 3.97 2.02 -0.73 -1.41 117.35 123.25 1y57 s TYR 335 Ca 0.58 -0.29 -0.01 0.00 -0.37 0.00 0.00 57.07 56.97 1y57 s TYR 335 Cb -0.43 -1.53 -0.00 0.00 -0.40 0.00 0.00 41.96 39.60 1y57 s TYR 335 CO 0.47 0.13 -0.12 0.42 -1.57 0.00 0.00 175.55 174.88 1y57 s ILE 336 N -0.75 2.89 -0.21 2.71 1.01 0.37 -1.61 121.20 125.61 1y57 s ILE 336 Ca 0.12 -0.68 -0.05 0.00 0.00 0.00 0.00 60.65 60.03 1y57 s ILE 336 Cb -0.10 -2.25 -0.02 0.00 0.01 0.00 0.00 42.46 40.10 1y57 s ILE 336 CO 0.01 0.49 -0.00 -0.69 0.00 0.00 0.00 174.94 174.75 1y57 s VAL 337 N 0.95 3.83 0.36 2.92 1.01 0.12 -0.60 120.40 128.99 1y57 s VAL 337 Ca -0.02 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 61.65 1y57 s VAL 337 Cb -0.15 -2.74 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 1y57 s VAL 337 CO -0.01 0.41 0.09 0.42 0.00 0.00 0.00 175.10 176.01 1y57 s THR 338 N 1.26 0.88 0.72 3.92 -4.23 -0.35 -0.45 115.64 117.39 1y57 s THR 338 Ca 0.04 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.39 1y57 s THR 338 Cb -0.15 -2.57 0.02 0.00 1.34 0.00 0.00 72.50 71.14 1y57 s THR 338 CO 0.01 0.00 1.11 -1.84 -0.54 0.00 0.00 174.62 173.36 1y57 n GLU 339 N -0.78 0.62 -3.97 3.99 0.28 -0.62 -1.25 120.64 118.91 1y57 n GLU 339 Ca -0.04 0.27 -0.35 0.00 -0.16 0.00 0.00 57.16 56.88 1y57 n GLU 339 Cb 0.66 -2.35 -0.09 0.00 1.43 0.00 0.00 31.44 31.08 1y57 n GLU 339 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 1y57 s TYR 340 N -1.75 3.30 -0.29 -1.84 5.04 -1.26 -4.13 117.35 116.41 1y57 s TYR 340 Ca 0.76 0.15 -0.08 0.00 -2.44 0.00 0.00 57.07 55.46 1y57 s TYR 340 Cb -0.35 -2.07 -0.01 0.00 0.35 0.00 0.00 41.96 39.89 1y57 s TYR 340 CO 0.47 0.23 0.11 -1.64 -1.34 0.00 0.00 175.55 173.39 1y57 s MET 341 N 0.22 3.34 0.50 4.97 -1.94 -1.26 -4.98 119.30 120.15 1y57 s MET 341 Ca 0.05 -0.70 0.29 0.00 -1.71 0.00 0.00 55.69 53.62 1y57 s MET 341 Cb -0.12 -3.46 1.14 0.00 2.01 0.00 0.00 34.83 34.40 1y57 s MET 341 CO 0.00 -0.37 1.90 0.66 -0.01 0.00 0.00 175.02 177.20 1y57 h SER 342 N 8.29 0.00 -0.02 3.03 4.64 -1.92 -3.19 113.55 124.39 1y57 h SER 342 Ca -0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 1y57 h SER 342 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1y57 h SER 342 CO 0.60 0.10 -0.21 0.29 -0.87 0.00 0.00 176.83 176.75 1y57 n LYS 343 N -3.24 1.72 0.00 4.77 4.76 0.05 -5.01 118.16 121.21 1y57 n LYS 343 Ca 0.00 -1.40 0.00 0.00 -2.87 0.00 0.00 58.31 54.04 1y57 n LYS 343 Cb 0.37 -1.42 0.00 0.00 -1.84 0.00 0.00 35.03 32.13 1y57 n LYS 343 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1y57 n GLY 344 N 1.29 -1.37 3.78 0.72 0.00 -1.19 -4.73 105.19 103.69 1y57 n GLY 344 Ca 0.11 -1.38 -0.36 0.00 0.00 0.00 0.00 46.02 44.39 1y57 n GLY 344 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y57 s SER 345 N -4.00 6.35 0.22 1.61 1.04 -1.26 -0.70 113.70 116.96 1y57 s SER 345 Ca 0.00 2.11 -0.09 0.00 0.48 0.00 0.00 55.95 58.46 1y57 s SER 345 Cb 0.00 -2.58 0.21 0.00 0.10 0.00 0.00 66.02 63.75 1y57 s SER 345 CO 0.00 -0.78 1.88 0.25 0.98 0.00 0.00 173.24 175.57 1y57 h LEU 346 N 1.98 0.91 -0.12 2.42 5.85 -0.94 -1.46 115.31 123.95 1y57 h LEU 346 Ca -0.49 -0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.25 1y57 h LEU 346 Cb 1.23 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.01 1y57 h LEU 346 CO 0.60 0.65 -0.10 0.25 -0.34 0.00 0.00 178.44 179.50 1y57 h LEU 347 N 1.08 -0.33 -1.06 2.25 5.85 -1.73 -0.43 115.31 120.93 1y57 h LEU 347 Ca 0.31 0.07 -0.06 0.00 0.84 0.00 0.00 57.88 59.04 1y57 h LEU 347 Cb -0.07 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1y57 h LEU 347 CO -0.09 -0.14 -0.01 0.44 -0.34 0.00 0.00 178.44 178.30 1y57 h ASP 348 N -0.12 0.62 -0.43 1.25 3.32 -1.83 -2.55 116.42 116.68 1y57 h ASP 348 Ca 0.08 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 56.96 1y57 h ASP 348 Cb 0.24 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 1y57 h ASP 348 CO -0.19 0.70 0.14 0.15 -1.72 0.00 0.00 179.24 178.32 1y57 h PHE 349 N 0.61 0.69 -0.58 4.55 3.57 -0.82 -1.74 116.94 123.23 1y57 h PHE 349 Ca 0.12 -0.07 -0.08 0.00 3.53 0.00 0.00 57.97 61.48 1y57 h PHE 349 Cb 0.41 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 1y57 h PHE 349 CO 0.02 0.62 0.05 -0.07 -2.23 0.00 0.00 178.31 176.70 1y57 h LEU 350 N 0.56 0.92 -0.36 0.59 3.38 -0.95 -3.01 115.31 116.44 1y57 h LEU 350 Ca 0.14 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1y57 h LEU 350 Cb 0.25 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1y57 h LEU 350 CO -0.01 0.94 0.00 0.11 0.09 0.00 0.00 178.44 179.58 1y57 h LYS 351 N 0.89 0.00 0.00 1.13 1.57 -1.30 -3.35 116.57 115.52 1y57 h LYS 351 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1y57 h LYS 351 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.76 1y57 h LYS 351 CO 0.02 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.31 1y57 n GLY 352 N 0.83 0.16 0.32 3.86 0.00 -0.67 -4.92 105.19 104.77 1y57 n GLY 352 Ca 0.04 -1.86 -0.00 0.00 0.00 0.00 0.00 46.02 44.20 1y57 n GLY 352 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1y57 h GLU 353 N 0.00 0.80 -0.30 1.61 4.57 -1.89 -2.11 114.58 117.26 1y57 h GLU 353 Ca 0.00 -0.10 -0.04 0.00 -1.18 0.00 0.00 59.36 58.05 1y57 h GLU 353 Cb 0.00 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.42 1y57 h GLU 353 CO 0.00 0.62 0.03 1.15 -1.18 0.00 0.00 179.01 179.63 1y57 h THR 354 N 0.81 1.17 -0.98 0.32 2.02 -1.91 -2.46 112.91 111.88 1y57 h THR 354 Ca 0.20 -0.63 0.21 0.00 0.77 0.00 0.00 66.41 66.95 1y57 h THR 354 Cb 0.08 0.92 -0.09 0.00 -1.74 0.00 0.00 68.15 67.31 1y57 h THR 354 CO -0.03 0.22 0.62 1.23 0.37 0.00 0.00 175.52 177.93 1y57 h GLY 355 N 0.73 1.39 2.00 2.16 0.00 -1.45 -0.90 103.07 106.99 1y57 h GLY 355 Ca 0.10 -0.28 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 1y57 h GLY 355 CO 0.00 -0.05 -0.10 0.50 0.00 0.00 0.00 176.54 176.89 1y57 h LYS 356 N 0.59 0.00 -0.01 4.80 1.57 -1.56 -2.65 116.57 119.31 1y57 h LYS 356 Ca 0.55 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.33 1y57 h LYS 356 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1y57 h LYS 356 CO -0.30 0.10 -0.43 0.66 -0.57 0.00 0.00 179.45 178.91 1y57 n TYR 357 N -4.27 0.00 -3.27 -1.35 4.01 -0.37 -4.94 117.16 106.97 1y57 n TYR 357 Ca -0.03 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.38 1y57 n TYR 357 Cb 0.18 -0.07 -0.06 0.00 -0.31 0.00 0.00 39.34 39.09 1y57 n TYR 357 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1y57 s LEU 358 N -2.57 4.18 0.00 7.72 1.43 -1.00 -5.09 118.68 123.34 1y57 s LEU 358 Ca 0.19 1.13 0.02 0.00 -1.03 0.00 0.00 54.13 54.45 1y57 s LEU 358 Cb 0.18 -3.74 -0.01 0.00 0.03 0.00 0.00 46.19 42.65 1y57 s LEU 358 CO 0.59 -0.08 0.08 0.54 0.23 0.00 0.00 176.35 177.71 1y57 n ARG 359 N 0.05 0.80 -0.30 1.70 5.12 -1.26 -4.69 116.66 118.06 1y57 n ARG 359 Ca 0.00 -2.42 0.02 0.00 -1.93 0.00 0.00 57.85 53.52 1y57 n ARG 359 Cb 0.52 1.16 0.16 0.00 -1.16 0.00 0.00 32.46 33.14 1y57 n ARG 359 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 1y57 h LEU 360 N 0.00 0.76 -1.14 0.55 5.85 -1.19 -2.39 115.31 117.75 1y57 h LEU 360 Ca -0.24 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.56 1y57 h LEU 360 Cb 0.85 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.71 1y57 h LEU 360 CO 0.38 0.46 0.59 -0.65 -0.34 0.00 0.00 178.44 178.87 1y57 h PRO 361 N 0.88 1.07 -0.30 5.25 0.11 -1.98 0.28 132.00 137.30 1y57 h PRO 361 Ca 0.39 -0.06 -0.17 0.00 0.11 0.00 0.00 66.00 66.26 1y57 h PRO 361 Cb 0.28 -0.24 -0.00 0.00 0.11 0.00 0.00 31.00 31.15 1y57 h PRO 361 CO -0.21 0.71 -0.49 1.96 -0.21 0.00 0.00 178.00 179.75 1y57 h GLN 362 N 1.10 0.84 -0.22 1.05 7.50 -1.86 -1.77 115.11 121.76 1y57 h GLN 362 Ca 0.36 -0.50 -0.20 0.00 0.50 0.00 0.00 58.65 58.81 1y57 h GLN 362 Cb 0.05 0.04 0.00 0.00 0.05 0.00 0.00 27.48 27.63 1y57 h GLN 362 CO -0.11 1.13 -0.65 -0.07 -1.50 0.00 0.00 178.83 177.63 1y57 h LEU 363 N 0.66 0.93 -0.83 1.46 3.38 -1.00 -1.87 115.31 118.04 1y57 h LEU 363 Ca 0.03 -0.55 -0.08 0.00 0.09 0.00 0.00 57.88 57.37 1y57 h LEU 363 Cb 1.08 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 1y57 h LEU 363 CO 0.11 1.35 -0.00 0.58 0.09 0.00 0.00 178.44 180.56 1y57 h VAL 364 N 0.59 1.25 -0.64 1.22 2.07 -0.99 -0.64 116.25 119.12 1y57 h VAL 364 Ca -0.02 -1.06 -0.04 0.00 0.82 0.00 0.00 66.70 66.41 1y57 h VAL 364 Cb 1.27 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 1y57 h VAL 364 CO 0.14 0.38 0.24 -0.78 0.02 0.00 0.00 177.57 177.56 1y57 h ASP 365 N 0.81 0.89 -0.60 0.57 3.58 -1.18 -0.66 116.42 119.82 1y57 h ASP 365 Ca 0.15 -0.18 -0.04 0.00 0.42 0.00 0.00 57.03 57.38 1y57 h ASP 365 Cb 0.49 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 41.28 1y57 h ASP 365 CO 0.02 0.83 0.22 0.24 -2.88 0.00 0.00 179.24 177.67 1y57 h MET 366 N 0.90 0.91 -0.90 0.28 2.86 -1.08 -1.91 114.93 115.99 1y57 h MET 366 Ca 0.21 -0.18 0.05 0.00 -2.06 0.00 0.00 59.70 57.72 1y57 h MET 366 Cb 0.23 -0.14 -0.06 0.00 0.06 0.00 0.00 31.60 31.69 1y57 h MET 366 CO -0.01 0.79 0.57 0.00 1.06 0.00 0.00 176.91 179.32 1y57 h ALA 367 N 1.08 1.23 -0.38 6.32 0.00 -0.79 -2.20 119.26 124.51 1y57 h ALA 367 Ca 0.20 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1y57 h ALA 367 Cb 0.24 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1y57 h ALA 367 CO -0.01 0.37 -0.05 0.00 0.00 0.00 0.00 179.25 179.56 1y57 h ALA 368 N 1.40 1.20 -0.32 0.00 0.00 -0.69 0.11 119.26 120.97 1y57 h ALA 368 Ca 0.38 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1y57 h ALA 368 Cb 0.11 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1y57 h ALA 368 CO -0.15 0.52 -0.10 1.96 0.00 0.00 0.00 179.25 181.48 1y57 h GLN 369 N 0.59 0.63 -0.56 0.00 4.20 -0.82 -1.04 115.11 118.12 1y57 h GLN 369 Ca 0.12 -0.25 -0.03 0.00 0.06 0.00 0.00 58.65 58.54 1y57 h GLN 369 Cb 0.45 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1y57 h GLN 369 CO 0.02 0.82 0.24 0.82 -0.67 0.00 0.00 178.83 180.06 1y57 h ILE 370 N 0.40 1.22 -0.29 2.54 2.04 -1.19 -1.81 117.51 120.42 1y57 h ILE 370 Ca 0.08 -0.66 -0.04 0.00 1.00 0.00 0.00 64.86 65.24 1y57 h ILE 370 Cb 0.61 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.28 1y57 h ILE 370 CO 0.04 0.26 0.02 0.00 0.00 0.00 0.00 178.15 178.46 1y57 h ALA 371 N 1.08 1.49 -0.41 1.87 0.00 -0.82 -0.78 119.26 121.69 1y57 h ALA 371 Ca 0.19 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1y57 h ALA 371 Cb 0.17 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1y57 h ALA 371 CO -0.02 0.37 -0.12 1.03 0.00 0.00 0.00 179.25 180.52 1y57 h SER 372 N 0.42 0.80 -0.57 0.00 0.87 -0.74 0.77 113.55 115.11 1y57 h SER 372 Ca 0.10 -0.37 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 1y57 h SER 372 Cb 0.25 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 61.97 1y57 h SER 372 CO 0.00 0.99 0.36 1.23 -0.53 0.00 0.00 176.83 178.88 1y57 h GLY 373 N 0.61 0.81 2.00 5.77 0.00 -0.91 -2.48 103.07 108.87 1y57 h GLY 373 Ca 0.10 -0.32 -0.09 0.00 0.00 0.00 0.00 47.33 47.02 1y57 h GLY 373 CO 0.04 0.31 -0.41 -0.33 0.00 0.00 0.00 176.54 176.16 1y57 h MET 374 N 0.77 0.00 -0.15 4.80 2.86 -0.95 -1.96 114.93 120.30 1y57 h MET 374 Ca 0.21 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.74 1y57 h MET 374 Cb -0.05 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 1y57 h MET 374 CO -0.04 0.41 -0.38 0.00 1.06 0.00 0.00 176.91 177.96 1y57 h ALA 375 N 1.59 1.07 -0.08 6.32 0.00 -0.64 0.27 119.26 127.79 1y57 h ALA 375 Ca -0.00 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 1y57 h ALA 375 Cb 0.93 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1y57 h ALA 375 CO 0.05 0.59 -0.01 -0.92 0.00 0.00 0.00 179.25 178.96 1y57 h TYR 376 N 0.27 0.17 -0.77 0.00 3.20 -1.05 -0.94 116.97 117.86 1y57 h TYR 376 Ca 0.03 -0.04 0.12 0.00 3.14 0.00 0.00 58.73 61.98 1y57 h TYR 376 Cb 0.80 -0.04 -0.08 0.00 1.54 0.00 0.00 36.73 38.94 1y57 h TYR 376 CO 0.02 0.46 0.37 0.28 -1.64 0.00 0.00 178.16 177.65 1y57 h VAL 377 N -0.16 0.78 0.07 1.81 2.07 -1.19 -0.88 116.25 118.75 1y57 h VAL 377 Ca 0.02 -0.20 0.01 0.00 0.82 0.00 0.00 66.70 67.35 1y57 h VAL 377 Cb 0.40 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 1y57 h VAL 377 CO 0.01 0.11 -0.11 -0.08 0.02 0.00 0.00 177.57 177.52 1y57 h GLU 378 N 0.59 -0.21 -0.13 1.57 4.81 -0.85 -2.05 114.58 118.31 1y57 h GLU 378 Ca 0.40 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.62 1y57 h GLU 378 Cb 0.51 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.92 1y57 h GLU 378 CO -0.32 -0.14 -0.03 0.00 -0.73 0.00 0.00 179.01 177.79 1y57 h ARG 379 N -0.22 0.19 -0.06 1.92 3.08 -0.55 -2.09 114.38 116.64 1y57 h ARG 379 Ca 0.02 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1y57 h ARG 379 Cb 0.23 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.25 1y57 h ARG 379 CO -0.06 0.23 0.00 -1.33 -1.07 0.00 0.00 179.97 177.74 1y57 n MET 380 N -4.40 1.33 -2.87 0.04 2.81 -0.39 -4.93 117.12 108.72 1y57 n MET 380 Ca -0.01 -0.50 -0.19 0.00 -1.81 0.00 0.00 57.70 55.20 1y57 n MET 380 Cb 0.17 -1.37 0.03 0.00 -0.71 0.00 0.00 33.22 31.34 1y57 n MET 380 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1y57 n ASN 381 N -0.31 -5.39 -4.83 7.83 3.02 -0.79 -4.96 115.26 109.83 1y57 n ASN 381 Ca 0.16 -0.23 -0.22 0.00 -0.03 0.00 0.00 54.58 54.27 1y57 n ASN 381 Cb 0.20 -4.24 -0.04 0.00 -0.61 0.00 0.00 39.78 35.09 1y57 n ASN 381 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1y57 s TYR 382 N -3.07 2.76 -0.01 3.10 1.51 -0.79 -1.56 117.35 119.29 1y57 s TYR 382 Ca 0.24 -0.42 0.03 0.00 -1.01 0.00 0.00 57.07 55.91 1y57 s TYR 382 Cb -0.11 -1.94 -0.00 0.00 -0.11 0.00 0.00 41.96 39.80 1y57 s TYR 382 CO 0.30 0.08 -0.08 0.54 -1.11 0.00 0.00 175.55 175.28 1y57 s VAL 383 N -2.42 0.68 -0.18 0.71 0.11 -0.43 -4.46 120.40 114.41 1y57 s VAL 383 Ca 0.43 -0.35 -0.21 0.00 -2.93 0.00 0.00 61.98 58.92 1y57 s VAL 383 Cb -0.03 -0.59 -0.18 0.00 -1.53 0.00 0.00 36.38 34.05 1y57 s VAL 383 CO 0.26 0.20 0.31 -0.74 -3.33 0.00 0.00 175.10 171.81 1y57 h HIS 384 N 6.06 0.00 0.00 1.54 2.76 -1.90 -1.84 115.15 121.77 1y57 h HIS 384 Ca -0.31 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.86 1y57 h HIS 384 Cb 1.18 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.14 1y57 h HIS 384 CO 0.41 1.09 0.00 0.54 -1.30 0.00 0.00 177.93 178.68 1y57 n ARG 385 N -4.53 -0.08 -2.35 5.26 1.74 -1.26 -2.67 116.66 112.78 1y57 n ARG 385 Ca -0.21 0.02 -0.01 0.00 -0.77 0.00 0.00 57.85 56.88 1y57 n ARG 385 Cb 0.54 -2.94 0.05 0.00 -1.02 0.00 0.00 32.46 29.08 1y57 n ARG 385 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1y57 n ASP 386 N -0.04 0.38 -4.69 0.55 2.03 -1.26 -4.95 116.55 108.57 1y57 n ASP 386 Ca 0.00 -2.07 -0.42 0.00 0.52 0.00 0.00 54.79 52.82 1y57 n ASP 386 Cb 0.02 -0.05 -0.03 0.00 -0.72 0.00 0.00 41.12 40.34 1y57 n ASP 386 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1y57 s LEU 387 N -2.78 4.26 -0.13 -2.67 2.96 -1.26 -4.77 118.68 114.28 1y57 s LEU 387 Ca 0.21 1.65 -0.34 0.00 -0.22 0.00 0.00 54.13 55.43 1y57 s LEU 387 Cb 0.33 -3.56 0.13 0.00 0.50 0.00 0.00 46.19 43.60 1y57 s LEU 387 CO -0.08 -0.51 1.24 0.00 -1.32 0.00 0.00 176.35 175.67 1y57 s ARG 388 N 2.12 0.34 0.53 1.98 1.70 -1.26 -4.77 118.95 119.58 1y57 s ARG 388 Ca 0.51 -0.15 0.23 0.00 -0.47 0.00 0.00 55.73 55.85 1y57 s ARG 388 Cb -0.21 0.14 1.44 0.00 -0.57 0.00 0.00 34.95 35.74 1y57 s ARG 388 CO 0.19 -0.15 2.13 0.00 -1.08 0.00 0.00 175.30 176.40 1y57 h ALA 389 N 2.00 1.61 0.00 7.88 0.00 -1.94 -0.80 119.26 128.01 1y57 h ALA 389 Ca -0.16 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.67 1y57 h ALA 389 Cb 1.18 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1y57 h ALA 389 CO 0.25 0.09 -0.07 0.00 0.00 0.00 0.00 179.25 179.51 1y57 h ALA 390 N 1.93 1.14 -0.37 0.00 0.00 -1.95 -2.60 119.26 117.40 1y57 h ALA 390 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1y57 h ALA 390 Cb 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1y57 h ALA 390 CO 0.01 0.09 0.00 0.09 0.00 0.00 0.00 179.25 179.44 1y57 n ASN 391 N -3.37 3.93 -4.74 0.00 3.02 -0.31 -4.76 115.26 109.03 1y57 n ASN 391 Ca -0.01 -2.65 -0.35 0.00 -0.03 0.00 0.00 54.58 51.53 1y57 n ASN 391 Cb 0.23 -0.48 -0.09 0.00 -0.61 0.00 0.00 39.78 38.84 1y57 n ASN 391 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1y57 s ILE 392 N -2.18 4.65 0.12 2.41 -1.09 -1.09 -1.87 121.20 122.15 1y57 s ILE 392 Ca 0.40 -0.12 0.07 0.00 -2.23 0.00 0.00 60.65 58.77 1y57 s ILE 392 Cb 0.29 -2.98 -0.04 0.00 -1.58 0.00 0.00 42.46 38.15 1y57 s ILE 392 CO 0.14 0.61 -0.08 -0.76 -1.23 0.00 0.00 174.94 173.61 1y57 s LEU 393 N -0.90 3.09 0.00 2.97 1.43 -0.34 -0.86 118.68 124.08 1y57 s LEU 393 Ca 0.13 -0.39 0.08 0.00 -1.03 0.00 0.00 54.13 52.92 1y57 s LEU 393 Cb -0.12 -1.86 -0.02 0.00 0.03 0.00 0.00 46.19 44.22 1y57 s LEU 393 CO 0.03 0.16 -0.24 -0.69 0.23 0.00 0.00 176.35 175.84 1y57 s VAL 394 N -1.32 1.92 0.22 -1.59 1.01 0.13 -0.87 120.40 119.89 1y57 s VAL 394 Ca 0.23 -1.13 0.01 0.00 0.00 0.00 0.00 61.98 61.09 1y57 s VAL 394 Cb -0.11 -1.61 0.01 0.00 0.00 0.00 0.00 36.38 34.67 1y57 s VAL 394 CO 0.15 0.46 0.06 0.61 0.00 0.00 0.00 175.10 176.37 1y57 n GLY 395 N 2.25 3.59 3.70 4.51 0.00 -0.12 -0.77 105.19 118.35 1y57 n GLY 395 Ca -0.16 -2.26 -0.35 0.00 0.00 0.00 0.00 46.02 43.25 1y57 n GLY 395 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1y57 n GLU 396 N -0.71 0.48 -2.82 1.61 1.02 -1.26 -3.49 120.64 115.48 1y57 n GLU 396 Ca -0.06 0.23 -0.21 0.00 -0.02 0.00 0.00 57.16 57.10 1y57 n GLU 396 Cb 0.27 -2.45 0.02 0.00 -0.02 0.00 0.00 31.44 29.26 1y57 n GLU 396 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1y57 n ASN 397 N -2.76 -5.87 -1.66 1.62 3.02 -1.26 -2.84 115.26 105.51 1y57 n ASN 397 Ca 0.14 -0.20 -0.18 0.00 -0.03 0.00 0.00 54.58 54.31 1y57 n ASN 397 Cb 0.50 -4.75 -0.04 0.00 -0.61 0.00 0.00 39.78 34.87 1y57 n ASN 397 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1y57 n LEU 398 N -3.58 -1.53 -4.70 3.41 4.77 -1.23 -4.97 117.00 109.18 1y57 n LEU 398 Ca -0.14 0.23 -0.42 0.00 -0.03 0.00 0.00 56.01 55.64 1y57 n LEU 398 Cb 0.63 -2.54 -0.03 0.00 -2.33 0.00 0.00 43.42 39.16 1y57 n LEU 398 CO 0.40 -0.59 1.12 -0.69 -1.33 0.00 0.00 177.39 176.30 1y57 s VAL 399 N -2.76 3.51 -0.04 4.08 1.01 -1.13 -4.78 120.40 120.28 1y57 s VAL 399 Ca 0.00 0.98 0.07 0.00 0.00 0.00 0.00 61.98 63.03 1y57 s VAL 399 Cb 0.00 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.74 1y57 s VAL 399 CO 0.00 0.03 -0.24 0.00 0.00 0.00 0.00 175.10 174.88 1y57 s LYS 401 N -0.32 0.53 0.18 0.00 1.02 -0.05 -4.64 119.74 116.45 1y57 s LYS 401 Ca 0.02 -0.40 -0.30 0.00 0.02 0.00 0.00 55.97 55.31 1y57 s LYS 401 Cb -0.12 -0.46 -0.08 0.00 -0.52 0.00 0.00 37.83 36.65 1y57 s LYS 401 CO 0.02 0.12 1.20 0.08 -0.92 0.00 0.00 175.35 175.84 1y57 s VAL 402 N -0.52 3.56 0.00 3.17 1.01 0.05 -1.20 120.40 126.47 1y57 s VAL 402 Ca -0.01 1.31 0.00 0.00 0.00 0.00 0.00 61.98 63.28 1y57 s VAL 402 Cb -0.05 -3.84 -0.00 0.00 0.00 0.00 0.00 36.38 32.50 1y57 s VAL 402 CO 0.00 0.21 0.00 0.00 0.00 0.00 0.00 175.10 175.31 1y57 n ALA 403 N 2.54 0.01 -3.31 5.51 0.00 -0.78 -1.66 120.51 122.82 1y57 n ALA 403 Ca 0.05 -0.02 -0.15 0.00 0.00 0.00 0.00 53.44 53.32 1y57 n ALA 403 Cb 0.45 0.02 0.01 0.00 0.00 0.00 0.00 19.45 19.92 1y57 n ALA 403 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1y57 n ASP 404 N -2.36 -6.61 -1.45 0.00 -0.08 -1.26 -4.84 116.55 99.94 1y57 n ASP 404 Ca -0.00 -0.23 -0.03 0.00 -1.51 0.00 0.00 54.79 53.02 1y57 n ASP 404 Cb 0.01 -3.70 0.18 0.00 2.34 0.00 0.00 41.12 39.95 1y57 n ASP 404 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1y57 n PHE 405 N -1.50 1.41 0.30 -0.67 3.01 -1.26 -4.47 117.46 114.28 1y57 n PHE 405 Ca -0.09 -0.74 0.15 0.00 1.01 0.00 0.00 57.45 57.79 1y57 n PHE 405 Cb 0.58 -0.46 0.69 0.00 -0.01 0.00 0.00 39.48 40.29 1y57 n PHE 405 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1y57 h GLY 406 N 3.63 0.00 -0.35 1.37 0.00 -1.90 -2.48 103.07 103.34 1y57 h GLY 406 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1y57 h GLY 406 CO 0.42 0.00 -0.07 1.04 0.00 0.00 0.00 176.54 177.92 1y57 n LEU 407 N -2.62 1.15 -4.76 3.11 4.77 -1.26 -4.77 117.00 112.61 1y57 n LEU 407 Ca 0.00 -0.86 -0.35 0.00 -0.03 0.00 0.00 56.01 54.77 1y57 n LEU 407 Cb 0.18 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.30 1y57 n LEU 407 CO 0.20 0.24 0.81 0.00 -1.33 0.00 0.00 177.39 177.31 1y57 s ALA 408 N -0.79 2.56 -0.06 -1.18 0.00 -0.94 -4.73 121.76 116.62 1y57 s ALA 408 Ca 0.06 0.91 -0.16 0.00 0.00 0.00 0.00 51.96 52.77 1y57 s ALA 408 Cb 0.05 -3.42 0.03 0.00 0.00 0.00 0.00 23.12 19.78 1y57 s ALA 408 CO 0.12 -1.10 0.36 1.03 0.00 0.00 0.00 175.76 176.17 1y57 s ARG 409 N -3.41 0.62 0.30 0.00 0.52 -0.69 -4.97 118.95 111.32 1y57 s ARG 409 Ca 0.75 0.10 -0.29 0.00 -0.52 0.00 0.00 55.73 55.77 1y57 s ARG 409 Cb -0.28 0.28 -0.10 0.00 0.52 0.00 0.00 34.95 35.38 1y57 s ARG 409 CO 0.33 -0.15 1.24 -1.17 0.02 0.00 0.00 175.30 175.57 1y57 s LEU 410 N -0.78 4.47 0.09 2.53 2.96 -1.26 -1.31 118.68 125.38 1y57 s LEU 410 Ca -0.09 2.54 -0.28 0.00 -0.22 0.00 0.00 54.13 56.08 1y57 s LEU 410 Cb -0.04 -3.64 -0.06 0.00 0.50 0.00 0.00 46.19 42.95 1y57 s LEU 410 CO 0.03 -0.41 0.89 -0.63 -1.32 0.00 0.00 176.35 174.91 1y57 s ILE 411 N -1.04 4.56 0.16 6.68 1.01 -0.60 -4.90 121.20 127.07 1y57 s ILE 411 Ca 0.48 1.92 0.11 0.00 0.00 0.00 0.00 60.65 63.16 1y57 s ILE 411 Cb -0.37 -4.25 -0.04 0.00 0.01 0.00 0.00 42.46 37.81 1y57 s ILE 411 CO 0.48 0.34 -0.25 -1.61 0.00 0.00 0.00 174.94 173.90 1y57 s GLU 412 N -0.07 1.43 -0.11 2.79 2.02 -1.26 -5.00 118.70 118.51 1y57 s GLU 412 Ca 0.44 -1.43 -0.02 0.00 0.02 0.00 0.00 54.97 53.98 1y57 s GLU 412 Cb -0.22 -1.81 -0.02 0.00 0.10 0.00 0.00 34.13 32.18 1y57 s GLU 412 CO 0.28 0.41 2.49 -3.47 0.02 0.00 0.00 175.26 174.98 1y57 n ASP 413 N 0.57 5.66 -3.88 -0.19 2.03 -1.26 -4.79 116.55 114.69 1y57 n ASP 413 Ca -0.15 -2.64 -0.10 0.00 0.52 0.00 0.00 54.79 52.42 1y57 n ASP 413 Cb 0.55 -1.20 -0.06 0.00 -0.72 0.00 0.00 41.12 39.69 1y57 n ASP 413 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1y57 s ASN 414 N 1.48 0.12 0.60 1.67 4.22 -1.26 -5.18 114.94 116.60 1y57 s ASN 414 Ca 0.29 -1.10 -0.05 0.00 -2.14 0.00 0.00 52.86 49.85 1y57 s ASN 414 Cb 0.17 0.57 0.02 0.00 1.28 0.00 0.00 41.25 43.29 1y57 s ASN 414 CO -0.02 -1.13 0.91 -1.61 -2.04 0.00 0.00 177.10 173.20 1y57 s GLU 415 N -3.84 2.76 0.02 3.55 0.41 -1.26 -5.12 118.70 115.22 1y57 s GLU 415 Ca 0.26 -0.12 -0.16 0.00 -0.41 0.00 0.00 54.97 54.54 1y57 s GLU 415 Cb 0.01 -2.28 0.03 0.00 -1.78 0.00 0.00 34.13 30.11 1y57 s GLU 415 CO 0.11 -0.79 0.36 1.52 -0.49 0.00 0.00 175.26 175.97 1y57 s TYR 416 N -3.01 -0.20 -0.41 1.61 -0.85 -1.26 -5.11 117.35 108.11 1y57 s TYR 416 Ca 0.55 0.19 -0.29 0.00 -0.52 0.00 0.00 57.07 57.00 1y57 s TYR 416 Cb -0.11 0.15 0.01 0.00 0.38 0.00 0.00 41.96 42.40 1y57 s TYR 416 CO 0.44 -0.50 1.32 0.99 -1.52 0.00 0.00 175.55 176.28 1y57 s THR 417 N -2.12 4.02 0.50 -3.49 2.01 -1.26 -4.93 115.64 110.38 1y57 s THR 417 Ca -0.08 1.06 -0.20 0.00 0.31 0.00 0.00 61.69 62.79 1y57 s THR 417 Cb -0.02 -4.31 -0.07 0.00 0.01 0.00 0.00 72.50 68.11 1y57 s THR 417 CO -0.00 -0.78 1.08 0.00 -0.69 0.00 0.00 174.62 174.22 1y57 s ALA 418 N 5.01 2.81 0.49 7.40 0.00 -1.26 -5.01 121.76 131.19 1y57 s ALA 418 Ca 0.57 0.70 -0.24 0.00 0.00 0.00 0.00 51.96 52.99 1y57 s ALA 418 Cb -0.12 -3.30 -0.07 0.00 0.00 0.00 0.00 23.12 19.63 1y57 s ALA 418 CO 0.31 -0.49 1.36 1.03 0.00 0.00 0.00 175.76 177.97 1y57 s ARG 419 N -3.22 3.48 0.53 0.00 1.81 -1.26 -4.90 118.95 115.40 1y57 s ARG 419 Ca 0.69 2.25 0.26 0.00 -1.72 0.00 0.00 55.73 57.21 1y57 s ARG 419 Cb -0.20 -2.47 1.41 0.00 -0.45 0.00 0.00 34.95 33.24 1y57 s ARG 419 CO 0.23 -0.92 1.98 -0.56 -0.68 0.00 0.00 175.30 175.35 1y57 h GLN 420 N 1.96 0.00 0.00 3.54 3.07 -2.04 -2.47 115.11 119.17 1y57 h GLN 420 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.23 1y57 h GLN 420 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.84 1y57 h GLN 420 CO 0.59 0.00 -0.11 0.78 0.09 0.00 0.00 178.83 180.19 1y57 h GLY 421 N 0.00 0.00 1.96 0.06 0.00 -1.96 -3.37 103.07 99.76 1y57 h GLY 421 Ca 0.27 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.56 1y57 h GLY 421 CO -0.00 0.00 -0.16 0.00 0.00 0.00 0.00 176.54 176.38 1y57 h ALA 422 N 2.13 1.67 0.00 3.60 0.00 -1.82 -2.69 119.26 122.15 1y57 h ALA 422 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1y57 h ALA 422 Cb 0.94 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1y57 h ALA 422 CO 0.00 0.24 0.00 0.36 0.00 0.00 0.00 179.25 179.85 1y57 n LYS 423 N -4.32 0.11 -3.97 0.00 2.85 -1.26 -4.77 118.16 106.80 1y57 n LYS 423 Ca -0.02 0.23 -0.35 0.00 -1.05 0.00 0.00 58.31 57.12 1y57 n LYS 423 Cb 0.24 -1.67 -0.06 0.00 -0.65 0.00 0.00 35.03 32.89 1y57 n LYS 423 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 1y57 s PHE 424 N -3.11 3.50 0.23 5.58 0.08 -1.01 -3.26 117.98 119.99 1y57 s PHE 424 Ca 0.09 0.41 -0.30 0.00 0.12 0.00 0.00 56.93 57.25 1y57 s PHE 424 Cb 0.12 -1.87 -0.09 0.00 -0.57 0.00 0.00 43.02 40.62 1y57 s PHE 424 CO 0.44 0.66 1.17 -1.25 -0.10 0.00 0.00 175.22 176.14 1y57 s PRO 425 N -1.34 4.53 0.41 0.24 0.04 -1.26 -5.05 135.00 132.58 1y57 s PRO 425 Ca 0.19 1.88 0.12 0.00 0.04 0.00 0.00 61.00 63.23 1y57 s PRO 425 Cb -0.12 -3.21 0.85 0.00 0.04 0.00 0.00 34.50 32.06 1y57 s PRO 425 CO 0.09 0.01 1.92 0.97 0.04 0.00 0.00 177.00 180.03 1y57 h ILE 426 N 3.45 1.18 0.00 0.56 6.09 -1.94 -2.98 117.51 123.87 1y57 h ILE 426 Ca -0.46 -0.86 0.00 0.00 -1.37 0.00 0.00 64.86 62.18 1y57 h ILE 426 Cb 1.21 1.39 0.00 0.00 0.47 0.00 0.00 36.82 39.89 1y57 h ILE 426 CO 0.71 0.25 0.00 0.29 -3.07 0.00 0.00 178.15 176.33 1y57 n LYS 427 N -4.25 0.15 -0.01 2.19 5.02 -1.26 -2.01 118.16 117.99 1y57 n LYS 427 Ca -0.02 0.45 0.10 0.00 -2.02 0.00 0.00 58.31 56.83 1y57 n LYS 427 Cb 0.30 -1.83 0.09 0.00 -0.02 0.00 0.00 35.03 33.57 1y57 n LYS 427 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1y57 n TRP 428 N -2.12 0.03 -4.01 2.13 8.01 -1.13 -4.98 117.44 115.37 1y57 n TRP 428 Ca 0.01 -0.02 -0.35 0.00 -1.31 0.00 0.00 57.50 55.84 1y57 n TRP 428 Cb 0.17 -0.00 -0.10 0.00 -2.01 0.00 0.00 31.31 29.37 1y57 n TRP 428 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.69 177.67 1y57 s THR 429 N -1.67 4.64 0.52 -0.99 2.01 -0.85 -3.83 115.64 115.47 1y57 s THR 429 Ca 0.24 -0.08 -0.22 0.00 0.31 0.00 0.00 61.69 61.94 1y57 s THR 429 Cb 0.17 -3.10 -0.06 0.00 0.01 0.00 0.00 72.50 69.53 1y57 s THR 429 CO 0.26 0.44 1.28 0.00 -0.69 0.00 0.00 174.62 175.91 1y57 s ALA 430 N 0.57 2.84 0.26 7.40 0.00 -1.26 -4.77 121.76 126.80 1y57 s ALA 430 Ca 0.03 1.17 -0.02 0.00 0.00 0.00 0.00 51.96 53.14 1y57 s ALA 430 Cb -0.13 -3.49 0.46 0.00 0.00 0.00 0.00 23.12 19.95 1y57 s ALA 430 CO 0.01 -1.11 1.82 -1.35 0.00 0.00 0.00 175.76 175.12 1y57 h PRO 431 N 1.60 0.83 0.00 0.00 0.11 -1.96 -0.78 132.00 131.80 1y57 h PRO 431 Ca -0.50 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.46 1y57 h PRO 431 Cb 1.28 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1y57 h PRO 431 CO 0.58 0.55 -0.48 1.05 -0.21 0.00 0.00 178.00 179.49 1y57 h GLU 432 N 0.86 0.00 -0.15 1.05 9.09 -1.91 0.16 114.58 123.68 1y57 h GLU 432 Ca 0.44 0.00 -0.14 0.00 0.05 0.00 0.00 59.36 59.71 1y57 h GLU 432 Cb 0.42 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.53 1y57 h GLU 432 CO -0.26 0.48 -0.44 0.00 0.05 0.00 0.00 179.01 178.84 1y57 h ALA 433 N 1.52 0.25 -0.26 1.06 0.00 -1.46 -2.12 119.26 118.24 1y57 h ALA 433 Ca -0.00 -0.47 -0.17 0.00 0.00 0.00 0.00 54.91 54.26 1y57 h ALA 433 Cb 0.93 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1y57 h ALA 433 CO 0.06 0.38 -0.53 0.00 0.00 0.00 0.00 179.25 179.17 1y57 h ALA 434 N 0.53 0.57 0.18 0.00 0.00 -0.86 -1.78 119.26 117.91 1y57 h ALA 434 Ca -0.01 -0.51 -0.34 0.00 0.00 0.00 0.00 54.91 54.05 1y57 h ALA 434 Cb 1.06 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.78 1y57 h ALA 434 CO 0.09 0.68 -1.68 -0.07 0.00 0.00 0.00 179.25 178.28 1y57 h LEU 435 N 0.59 0.60 -1.52 0.00 3.38 -0.82 -3.41 115.31 114.14 1y57 h LEU 435 Ca 0.02 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 57.06 1y57 h LEU 435 Cb 1.11 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1y57 h LEU 435 CO 0.11 1.76 0.00 -1.22 0.09 0.00 0.00 178.44 179.18 1y57 n TYR 436 N -3.65 0.00 -1.57 1.13 4.01 -0.83 -5.01 117.16 111.23 1y57 n TYR 436 Ca -0.24 -0.16 -0.13 0.00 -0.16 0.00 0.00 57.90 57.22 1y57 n TYR 436 Cb 1.05 -0.02 -0.04 0.00 -0.31 0.00 0.00 39.34 40.02 1y57 n TYR 436 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1y57 n GLY 437 N -0.16 1.00 3.40 2.72 0.00 -0.67 -4.94 105.19 106.55 1y57 n GLY 437 Ca 0.00 -0.42 -0.44 0.00 0.00 0.00 0.00 46.02 45.16 1y57 n GLY 437 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y57 n ARG 438 N -2.54 3.42 -3.06 1.61 1.74 -1.01 -4.83 116.66 112.00 1y57 n ARG 438 Ca -0.13 -3.89 -0.41 0.00 -0.77 0.00 0.00 57.85 52.65 1y57 n ARG 438 Cb 0.46 -2.98 -0.06 0.00 -1.02 0.00 0.00 32.46 28.86 1y57 n ARG 438 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1y57 s PHE 439 N 1.14 3.25 0.32 -1.55 0.08 -1.26 -3.76 117.98 116.20 1y57 s PHE 439 Ca 0.41 0.77 0.05 0.00 0.12 0.00 0.00 56.93 58.29 1y57 s PHE 439 Cb -0.02 -2.98 -0.03 0.00 -0.57 0.00 0.00 43.02 39.42 1y57 s PHE 439 CO -0.00 -0.43 0.23 0.95 -0.10 0.00 0.00 175.22 175.87 1y57 s THR 440 N 2.65 0.12 0.56 0.64 -4.23 -1.26 -4.99 115.64 109.12 1y57 s THR 440 Ca 0.28 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.04 1y57 s THR 440 Cb -0.15 -2.48 0.34 0.00 1.34 0.00 0.00 72.50 71.55 1y57 s THR 440 CO 0.10 0.00 2.12 -0.29 -0.54 0.00 0.00 174.62 176.01 1y57 h ILE 441 N 2.16 0.67 0.00 2.99 6.09 -1.96 -0.92 117.51 126.54 1y57 h ILE 441 Ca -0.29 0.00 -0.11 0.00 -1.37 0.00 0.00 64.86 63.10 1y57 h ILE 441 Cb 1.24 0.89 -0.02 0.00 0.47 0.00 0.00 36.82 39.40 1y57 h ILE 441 CO 0.43 0.00 -0.52 0.11 -3.07 0.00 0.00 178.15 175.10 1y57 h LYS 442 N 0.00 0.00 0.00 2.19 1.79 -1.94 -1.28 116.57 117.33 1y57 h LYS 442 Ca 0.08 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.40 1y57 h LYS 442 Cb 0.38 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.01 1y57 h LYS 442 CO -0.00 0.52 -0.74 0.66 -1.08 0.00 0.00 179.45 178.80 1y57 h SER 443 N 0.00 0.00 -0.22 0.86 4.64 -1.51 -2.63 113.55 114.70 1y57 h SER 443 Ca -0.01 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1y57 h SER 443 Cb 1.01 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.08 1y57 h SER 443 CO 0.07 0.74 -0.07 0.44 -0.87 0.00 0.00 176.83 177.13 1y57 h ASP 444 N 0.00 0.55 -0.68 4.97 3.32 -1.07 -2.44 116.42 121.06 1y57 h ASP 444 Ca -0.01 -0.13 -0.04 0.00 0.02 0.00 0.00 57.03 56.87 1y57 h ASP 444 Cb 1.34 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.72 1y57 h ASP 444 CO 0.10 0.67 0.28 0.58 -1.72 0.00 0.00 179.24 179.15 1y57 h VAL 445 N 0.54 1.24 -0.15 -1.35 2.07 -1.00 -0.37 116.25 117.23 1y57 h VAL 445 Ca 0.10 -0.75 0.03 0.00 0.82 0.00 0.00 66.70 66.90 1y57 h VAL 445 Cb 0.46 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1y57 h VAL 445 CO 0.02 0.30 -0.06 -0.25 0.02 0.00 0.00 177.57 177.61 1y57 h TRP 446 N 0.97 -0.13 -0.66 1.57 2.91 -1.33 -1.59 115.95 117.70 1y57 h TRP 446 Ca 0.23 0.02 0.03 0.00 1.13 0.00 0.00 58.89 60.29 1y57 h TRP 446 Cb 0.20 0.08 -0.04 0.00 -0.51 0.00 0.00 29.16 28.90 1y57 h TRP 446 CO 0.01 -0.09 0.44 0.77 -1.03 0.00 0.00 178.44 178.54 1y57 h SER 447 N -0.03 0.69 -0.65 2.65 0.02 -1.09 -1.86 113.55 113.27 1y57 h SER 447 Ca 0.08 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.94 1y57 h SER 447 Cb 0.15 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.50 1y57 h SER 447 CO -0.17 0.48 0.12 0.15 -1.14 0.00 0.00 176.83 176.27 1y57 h PHE 448 N 0.80 1.15 -0.88 3.45 3.57 -0.41 0.12 116.94 124.75 1y57 h PHE 448 Ca 0.26 -0.15 0.06 0.00 3.53 0.00 0.00 57.97 61.67 1y57 h PHE 448 Cb 0.04 -0.32 -0.06 0.00 2.79 0.00 0.00 35.95 38.40 1y57 h PHE 448 CO -0.00 0.96 0.55 0.78 -2.23 0.00 0.00 178.31 178.36 1y57 h GLY 449 N 1.05 1.33 0.98 2.40 0.00 -0.51 0.26 103.07 108.58 1y57 h GLY 449 Ca 0.20 -0.40 -0.08 0.00 0.00 0.00 0.00 47.33 47.06 1y57 h GLY 449 CO 0.01 0.27 -0.04 -2.22 0.00 0.00 0.00 176.54 174.57 1y57 h ILE 450 N 1.00 1.27 -0.88 2.60 1.08 -0.90 -2.50 117.51 119.18 1y57 h ILE 450 Ca 0.38 -1.10 0.10 0.00 -0.39 0.00 0.00 64.86 63.85 1y57 h ILE 450 Cb 0.17 1.11 -0.06 0.00 -3.07 0.00 0.00 36.82 34.96 1y57 h ILE 450 CO -0.17 0.38 0.57 0.25 -0.69 0.00 0.00 178.15 178.48 1y57 h LEU 451 N 0.63 0.77 -1.35 1.44 6.46 -0.37 -0.93 115.31 121.96 1y57 h LEU 451 Ca 0.12 0.02 -0.02 0.00 -0.12 0.00 0.00 57.88 57.88 1y57 h LEU 451 Cb 0.55 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 40.32 1y57 h LEU 451 CO 0.03 0.45 0.19 -0.07 -0.62 0.00 0.00 178.44 178.42 1y57 h LEU 452 N 0.85 0.56 -0.67 2.25 3.38 -0.52 -1.26 115.31 119.91 1y57 h LEU 452 Ca 0.41 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 58.25 1y57 h LEU 452 Cb 0.44 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1y57 h LEU 452 CO -0.17 0.51 0.13 0.71 0.09 0.00 0.00 178.44 179.70 1y57 h THR 453 N 0.63 1.26 -0.87 0.22 1.35 -0.97 -2.03 112.91 112.50 1y57 h THR 453 Ca 0.15 -1.01 0.03 0.00 -0.55 0.00 0.00 66.41 65.03 1y57 h THR 453 Cb 0.11 0.62 -0.05 0.00 -1.73 0.00 0.00 68.15 67.10 1y57 h THR 453 CO -0.02 0.38 0.56 -0.33 -0.25 0.00 0.00 175.52 175.87 1y57 h GLU 454 N 1.02 1.08 0.10 4.72 5.08 -0.94 -0.91 114.58 124.73 1y57 h GLU 454 Ca 0.21 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1y57 h GLU 454 Cb 0.41 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1y57 h GLU 454 CO 0.01 0.71 -0.05 -0.07 -1.00 0.00 0.00 179.01 178.61 1y57 h LEU 455 N 1.11 -0.12 -0.78 1.33 3.38 -1.10 0.12 115.31 119.26 1y57 h LEU 455 Ca 0.34 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1y57 h LEU 455 Cb -0.02 0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1y57 h LEU 455 CO -0.11 -0.01 0.00 0.71 0.09 0.00 0.00 178.44 179.12 1y57 h THR 456 N -0.21 0.00 -0.34 0.22 1.35 -1.25 -2.43 112.91 110.25 1y57 h THR 456 Ca -0.01 -0.71 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 1y57 h THR 456 Cb 0.17 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.30 1y57 h THR 456 CO 0.02 0.00 0.00 0.35 -0.25 0.00 0.00 175.52 175.64 1y57 n THR 457 N -3.05 0.43 -3.71 6.82 -2.24 -0.36 -4.95 114.28 107.21 1y57 n THR 457 Ca 0.02 -0.70 -0.25 0.00 -2.27 0.00 0.00 64.05 60.85 1y57 n THR 457 Cb 0.40 1.03 0.05 0.00 -2.10 0.00 0.00 70.33 69.71 1y57 n THR 457 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1y57 n LYS 458 N 1.44 -6.33 0.00 -0.78 5.02 -0.70 -3.61 118.16 113.19 1y57 n LYS 458 Ca 0.19 0.71 0.00 0.00 -2.02 0.00 0.00 58.31 57.19 1y57 n LYS 458 Cb 0.60 -5.61 0.00 0.00 -0.02 0.00 0.00 35.03 30.00 1y57 n LYS 458 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1y57 n GLY 459 N -1.69 1.06 3.76 0.72 0.00 0.33 -3.83 105.19 105.54 1y57 n GLY 459 Ca -0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 1y57 n GLY 459 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1y57 s ARG 460 N -0.80 3.07 0.23 1.61 3.52 -1.24 -4.97 118.95 120.37 1y57 s ARG 460 Ca 0.00 1.81 -0.30 0.00 -0.13 0.00 0.00 55.73 57.11 1y57 s ARG 460 Cb 0.00 -1.97 -0.09 0.00 -1.56 0.00 0.00 34.95 31.33 1y57 s ARG 460 CO 0.00 -1.12 1.27 0.08 -0.81 0.00 0.00 175.30 174.71 1y57 s VAL 461 N -1.60 3.20 0.78 7.11 1.01 -1.26 -4.64 120.40 125.01 1y57 s VAL 461 Ca 0.76 1.05 -0.14 0.00 0.00 0.00 0.00 61.98 63.65 1y57 s VAL 461 Cb -0.30 -3.67 0.06 0.00 0.00 0.00 0.00 36.38 32.46 1y57 s VAL 461 CO 0.33 0.19 1.11 -2.65 0.00 0.00 0.00 175.10 174.07 1y57 n PRO 462 N 2.08 0.30 -3.73 2.72 -0.02 -1.26 -3.75 135.00 131.34 1y57 n PRO 462 Ca 0.04 0.17 -0.32 0.00 -2.02 0.00 0.00 63.50 61.36 1y57 n PRO 462 Cb 0.43 -2.36 0.04 0.00 -0.02 0.00 0.00 33.50 31.59 1y57 n PRO 462 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1y57 n TYR 463 N -3.03 -1.85 -1.89 6.00 4.01 -1.26 -4.88 117.16 114.27 1y57 n TYR 463 Ca 0.13 0.44 -0.39 0.00 -0.16 0.00 0.00 57.90 57.92 1y57 n TYR 463 Cb 0.50 -3.41 0.01 0.00 -0.31 0.00 0.00 39.34 36.13 1y57 n TYR 463 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1y57 s PRO 464 N -6.14 3.70 0.00 -0.72 0.04 -1.25 -1.91 135.00 128.73 1y57 s PRO 464 Ca 0.44 2.29 0.00 0.00 0.04 0.00 0.00 61.00 63.77 1y57 s PRO 464 Cb -0.16 -2.63 0.00 0.00 0.04 0.00 0.00 34.50 31.75 1y57 s PRO 464 CO 0.87 -0.76 0.00 0.41 0.04 0.00 0.00 177.00 177.56 1y57 n GLY 465 N 0.62 2.80 3.63 0.56 0.00 -1.26 -5.01 105.19 106.53 1y57 n GLY 465 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.72 1y57 n GLY 465 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1y57 s MET 466 N -0.07 3.99 0.50 1.61 0.00 -0.80 -5.10 119.30 119.42 1y57 s MET 466 Ca 0.00 -0.33 -0.18 0.00 0.00 0.00 0.00 55.69 55.18 1y57 s MET 466 Cb 0.00 -3.31 -0.08 0.00 0.00 0.00 0.00 34.83 31.43 1y57 s MET 466 CO 0.00 0.19 0.98 0.14 0.00 0.00 0.00 175.02 176.33 1y57 s VAL 467 N 0.62 4.43 0.26 10.11 -7.23 -1.26 -4.96 120.40 122.37 1y57 s VAL 467 Ca 0.05 1.26 -0.02 0.00 -1.81 0.00 0.00 61.98 61.46 1y57 s VAL 467 Cb -0.13 -3.66 0.24 0.00 0.56 0.00 0.00 36.38 33.39 1y57 s VAL 467 CO 0.01 -0.57 1.79 0.78 -0.31 0.00 0.00 175.10 176.80 1y57 h ASN 468 N 1.16 0.67 0.22 4.85 2.35 -1.98 -2.17 115.58 120.68 1y57 h ASN 468 Ca -0.47 0.07 -0.00 0.00 -0.55 0.00 0.00 56.30 55.34 1y57 h ASN 468 Cb 1.19 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 39.50 1y57 h ASN 468 CO 0.61 0.33 -0.01 0.03 -1.65 0.00 0.00 177.43 176.74 1y57 h ARG 469 N 0.76 0.00 0.00 0.81 -0.00 -2.04 -2.65 114.38 111.26 1y57 h ARG 469 Ca 0.45 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.93 1y57 h ARG 469 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.49 1y57 h ARG 469 CO -0.30 0.01 -1.10 -0.85 0.00 0.00 0.00 179.97 177.73 1y57 n GLU 470 N -3.19 0.10 0.01 0.04 -0.00 -0.82 -4.68 120.64 112.09 1y57 n GLU 470 Ca -0.02 -0.03 -0.12 0.00 -0.00 0.00 0.00 57.16 57.00 1y57 n GLU 470 Cb 0.13 -1.51 -0.06 0.00 -0.00 0.00 0.00 31.44 30.00 1y57 n GLU 470 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1y57 h VAL 471 N 0.00 1.08 -0.44 3.84 2.07 -1.44 -2.84 116.25 118.51 1y57 h VAL 471 Ca 0.00 -0.24 0.03 0.00 0.82 0.00 0.00 66.70 67.31 1y57 h VAL 471 Cb 0.57 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1y57 h VAL 471 CO 0.00 0.07 0.24 0.25 0.02 0.00 0.00 177.57 178.15 1y57 h LEU 472 N 0.01 0.37 -0.72 2.57 5.85 -1.83 -1.04 115.31 120.52 1y57 h LEU 472 Ca 0.02 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1y57 h LEU 472 Cb 0.08 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.02 1y57 h LEU 472 CO -0.00 0.27 0.31 0.44 -0.34 0.00 0.00 178.44 179.11 1y57 h ASP 473 N 0.49 0.97 -0.06 1.25 3.32 -1.86 -0.41 116.42 120.12 1y57 h ASP 473 Ca 0.18 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 1y57 h ASP 473 Cb 0.06 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.35 1y57 h ASP 473 CO -0.11 0.86 0.01 1.56 -1.72 0.00 0.00 179.24 179.85 1y57 h GLN 474 N 1.02 0.09 -0.82 3.56 1.08 -1.19 -2.37 115.11 116.48 1y57 h GLN 474 Ca 0.24 -0.02 -0.04 0.00 -1.45 0.00 0.00 58.65 57.38 1y57 h GLN 474 Cb 0.18 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 27.56 1y57 h GLN 474 CO -0.02 0.28 0.35 0.28 -0.95 0.00 0.00 178.83 178.77 1y57 h VAL 475 N -0.12 1.26 -0.53 -0.54 2.07 -1.06 -1.31 116.25 116.03 1y57 h VAL 475 Ca 0.02 -0.80 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 1y57 h VAL 475 Cb 0.23 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.23 1y57 h VAL 475 CO -0.00 0.33 0.27 -0.33 0.02 0.00 0.00 177.57 177.86 1y57 h GLU 476 N 1.18 0.73 -0.00 1.57 3.07 -1.00 -2.18 114.58 117.95 1y57 h GLU 476 Ca 0.28 -0.08 0.00 0.00 -0.50 0.00 0.00 59.36 59.06 1y57 h GLU 476 Cb 0.18 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 1y57 h GLU 476 CO -0.03 0.55 -0.04 0.54 -1.40 0.00 0.00 179.01 178.63 1y57 n ARG 477 N -4.39 0.85 0.00 2.33 1.74 -0.90 -4.90 116.66 111.39 1y57 n ARG 477 Ca 0.05 -0.20 0.00 0.00 -0.77 0.00 0.00 57.85 56.92 1y57 n ARG 477 Cb 0.11 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.05 1y57 n ARG 477 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1y57 n GLY 478 N 1.18 0.93 3.72 -0.13 0.00 -0.82 -5.08 105.19 104.99 1y57 n GLY 478 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1y57 n GLY 478 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1y57 s TYR 479 N -2.00 3.17 0.07 1.61 5.04 -0.53 -4.98 117.35 119.73 1y57 s TYR 479 Ca 0.00 0.88 0.06 0.00 -2.44 0.00 0.00 57.07 55.57 1y57 s TYR 479 Cb 0.00 -3.76 -0.03 0.00 0.35 0.00 0.00 41.96 38.52 1y57 s TYR 479 CO 0.00 -2.69 -0.16 1.03 -1.34 0.00 0.00 175.55 172.38 1y57 s ARG 480 N 0.91 0.97 0.40 4.97 1.81 -1.26 -4.35 118.95 122.40 1y57 s ARG 480 Ca 0.65 -0.96 -0.27 0.00 -1.72 0.00 0.00 55.73 53.44 1y57 s ARG 480 Cb -0.39 -1.06 -0.10 0.00 -0.45 0.00 0.00 34.95 32.95 1y57 s ARG 480 CO 0.32 0.25 1.44 -1.64 -0.68 0.00 0.00 175.30 174.99 1y57 s MET 481 N -1.58 3.95 0.95 3.54 -1.94 -1.26 -5.01 119.30 117.95 1y57 s MET 481 Ca 0.02 2.46 -0.14 0.00 -1.71 0.00 0.00 55.69 56.31 1y57 s MET 481 Cb -0.09 -2.84 0.17 0.00 2.01 0.00 0.00 34.83 34.07 1y57 s MET 481 CO 0.02 -0.62 1.18 -1.25 -0.01 0.00 0.00 175.02 174.35 1y57 s PRO 482 N -2.22 0.78 -0.08 2.03 0.04 -1.26 -4.99 135.00 129.30 1y57 s PRO 482 Ca 0.56 0.05 -0.30 0.00 0.04 0.00 0.00 61.00 61.35 1y57 s PRO 482 Cb -0.44 -1.82 -0.05 0.00 0.04 0.00 0.00 34.50 32.23 1y57 s PRO 482 CO 0.59 -2.40 1.63 0.00 0.04 0.00 0.00 177.00 176.86 1y57 n PRO 484 N 7.16 0.89 -1.68 0.00 -0.02 -1.26 -4.91 135.00 135.18 1y57 n PRO 484 Ca 0.17 0.35 -0.44 0.00 -2.02 0.00 0.00 63.50 61.56 1y57 n PRO 484 Cb 0.43 -2.31 -0.02 0.00 -0.02 0.00 0.00 33.50 31.58 1y57 n PRO 484 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1y57 n PRO 485 N -1.53 2.06 -0.80 0.52 -0.02 -1.26 -1.98 135.00 131.98 1y57 n PRO 485 Ca 0.15 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 1y57 n PRO 485 Cb 0.48 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 1y57 n PRO 485 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1y57 n GLU 486 N 1.74 -0.15 -2.97 -0.52 1.02 -1.26 -4.87 120.64 113.63 1y57 n GLU 486 Ca 0.10 0.04 -0.41 0.00 -0.02 0.00 0.00 57.16 56.87 1y57 n GLU 486 Cb 0.32 -3.52 -0.04 0.00 -0.02 0.00 0.00 31.44 28.18 1y57 n GLU 486 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1y57 n PRO 488 N 4.52 2.38 -0.19 0.00 -0.02 -1.26 -4.82 135.00 135.61 1y57 n PRO 488 Ca 0.02 0.84 0.15 0.00 -2.02 0.00 0.00 63.50 62.49 1y57 n PRO 488 Cb 0.50 -2.62 0.48 0.00 -0.02 0.00 0.00 33.50 31.85 1y57 n PRO 488 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1y57 h GLU 489 N 2.52 0.45 -0.21 -0.52 3.07 -1.97 -1.28 114.58 116.65 1y57 h GLU 489 Ca -0.50 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.31 1y57 h GLU 489 Cb 1.26 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 29.06 1y57 h GLU 489 CO 0.62 0.30 0.03 0.66 -1.40 0.00 0.00 179.01 179.22 1y57 h SER 490 N 0.47 0.27 0.41 1.42 4.64 -1.98 0.12 113.55 118.89 1y57 h SER 490 Ca 0.39 -0.03 -0.30 0.00 -0.47 0.00 0.00 61.79 61.39 1y57 h SER 490 Cb 0.85 -0.07 0.02 0.00 -0.31 0.00 0.00 62.40 62.89 1y57 h SER 490 CO -0.14 0.29 -1.30 0.25 -0.87 0.00 0.00 176.83 175.06 1y57 h LEU 491 N 0.29 0.65 -1.15 5.97 5.85 -1.61 -2.79 115.31 122.52 1y57 h LEU 491 Ca 0.07 -0.67 -0.05 0.00 0.84 0.00 0.00 57.88 58.08 1y57 h LEU 491 Cb 0.15 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1y57 h LEU 491 CO -0.00 1.51 0.05 -0.74 -0.34 0.00 0.00 178.44 178.92 1y57 h HIS 492 N 0.14 0.67 -0.71 1.25 2.76 -1.16 -2.15 115.15 115.96 1y57 h HIS 492 Ca -0.18 -0.06 -0.00 0.00 -2.20 0.00 0.00 60.37 57.92 1y57 h HIS 492 Cb 2.00 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 30.73 1y57 h HIS 492 CO 0.09 0.61 0.44 -0.44 -1.30 0.00 0.00 177.93 177.33 1y57 h ASP 493 N 0.62 0.84 -0.36 3.26 3.32 -0.75 -0.75 116.42 122.61 1y57 h ASP 493 Ca 0.14 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 1y57 h ASP 493 Cb 0.31 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1y57 h ASP 493 CO 0.01 0.63 0.09 0.25 -1.72 0.00 0.00 179.24 178.50 1y57 h LEU 494 N 0.97 0.54 -0.67 1.55 5.85 -1.19 -2.03 115.31 120.34 1y57 h LEU 494 Ca 0.26 -0.23 0.07 0.00 0.84 0.00 0.00 57.88 58.82 1y57 h LEU 494 Cb -0.06 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 40.77 1y57 h LEU 494 CO -0.05 0.63 0.35 0.24 -0.34 0.00 0.00 178.44 179.27 1y57 h MET 495 N 0.43 0.62 -0.14 1.25 2.86 -0.85 -2.42 114.93 116.68 1y57 h MET 495 Ca 0.11 -0.04 -0.08 0.00 -2.06 0.00 0.00 59.70 57.63 1y57 h MET 495 Cb 0.29 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 1y57 h MET 495 CO 0.00 0.41 -0.28 0.00 1.06 0.00 0.00 176.91 178.10 1y57 h GLN 497 N 0.23 0.98 0.00 0.00 4.20 -1.03 -2.47 115.11 117.02 1y57 h GLN 497 Ca 0.03 -0.21 -0.03 0.00 0.06 0.00 0.00 58.65 58.50 1y57 h GLN 497 Cb 0.62 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.26 1y57 h GLN 497 CO 0.05 0.86 -0.16 0.00 -0.67 0.00 0.00 178.83 178.90 1y57 n TRP 499 N -3.80 2.25 -2.02 0.00 8.01 -0.93 -3.64 117.44 117.30 1y57 n TRP 499 Ca -0.02 -1.21 -0.40 0.00 -1.31 0.00 0.00 57.50 54.56 1y57 n TRP 499 Cb 0.27 -0.65 -0.01 0.00 -2.01 0.00 0.00 31.31 28.91 1y57 n TRP 499 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.69 177.71 1y57 s ARG 500 N -3.01 4.18 0.20 -0.99 0.52 -1.11 -4.91 118.95 113.82 1y57 s ARG 500 Ca 0.54 2.29 -0.11 0.00 -0.52 0.00 0.00 55.73 57.92 1y57 s ARG 500 Cb 0.43 -2.96 0.19 0.00 0.52 0.00 0.00 34.95 33.13 1y57 s ARG 500 CO 0.12 -0.36 1.80 -0.22 0.02 0.00 0.00 175.30 176.66 1y57 h LYS 501 N 3.09 0.59 -5.83 3.54 3.64 -1.93 -3.39 116.57 116.28 1y57 h LYS 501 Ca -0.50 -0.04 -0.60 0.00 -1.27 0.00 0.00 60.65 58.25 1y57 h LYS 501 Cb 1.24 -0.13 -0.10 0.00 -0.41 0.00 0.00 32.23 32.83 1y57 h LYS 501 CO 0.64 0.39 0.46 -1.21 -2.27 0.00 0.00 179.45 177.46 1y57 s GLU 502 N -6.11 4.02 0.28 1.90 0.41 -1.26 -4.96 118.70 112.97 1y57 s GLU 502 Ca -0.13 0.71 0.00 0.00 -0.41 0.00 0.00 54.97 55.15 1y57 s GLU 502 Cb 0.15 -3.71 0.52 0.00 -1.78 0.00 0.00 34.13 29.31 1y57 s GLU 502 CO 0.75 -0.67 1.85 -1.35 -0.49 0.00 0.00 175.26 175.35 1y57 h PRO 503 N 8.03 1.02 0.00 0.39 0.11 -1.96 -1.80 132.00 137.78 1y57 h PRO 503 Ca -0.24 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 1y57 h PRO 503 Cb 1.09 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 31.97 1y57 h PRO 503 CO 0.90 0.67 -0.03 1.05 -0.21 0.00 0.00 178.00 180.38 1y57 h GLU 504 N 1.05 0.00 -0.00 1.05 9.09 -1.94 -1.89 114.58 121.93 1y57 h GLU 504 Ca 0.48 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.89 1y57 h GLU 504 Cb 0.40 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.50 1y57 h GLU 504 CO -0.24 0.03 -0.10 0.39 0.05 0.00 0.00 179.01 179.14 1y57 n GLU 505 N -3.67 0.81 -2.68 1.06 1.02 -0.68 -4.86 120.64 111.64 1y57 n GLU 505 Ca -0.03 -0.30 -0.34 0.00 -0.02 0.00 0.00 57.16 56.47 1y57 n GLU 505 Cb 0.12 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 29.99 1y57 n GLU 505 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1y57 s ARG 506 N -2.39 4.07 0.91 3.49 0.52 -0.71 -4.95 118.95 119.89 1y57 s ARG 506 Ca 0.31 1.27 -0.11 0.00 -0.52 0.00 0.00 55.73 56.67 1y57 s ARG 506 Cb 0.20 -2.22 0.14 0.00 0.52 0.00 0.00 34.95 33.59 1y57 s ARG 506 CO 0.46 -0.19 1.09 -1.25 0.02 0.00 0.00 175.30 175.43 1y57 s PRO 507 N -3.07 1.10 0.48 3.54 0.04 -1.26 -5.04 135.00 130.79 1y57 s PRO 507 Ca 0.63 0.90 -0.06 0.00 0.04 0.00 0.00 61.00 62.51 1y57 s PRO 507 Cb -0.14 -1.78 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 1y57 s PRO 507 CO 0.18 -2.37 0.80 0.95 0.04 0.00 0.00 177.00 176.59 1y57 s THR 508 N -2.87 4.88 0.38 1.26 -4.23 -1.26 -4.95 115.64 108.86 1y57 s THR 508 Ca 0.64 0.30 0.18 0.00 -1.18 0.00 0.00 61.69 61.63 1y57 s THR 508 Cb -0.19 -3.85 0.18 0.00 1.34 0.00 0.00 72.50 69.99 1y57 s THR 508 CO 0.58 -0.83 1.94 -0.26 -0.54 0.00 0.00 174.62 175.51 1y57 h PHE 509 N 0.33 0.00 -0.45 3.99 0.04 -1.91 -1.61 116.94 117.32 1y57 h PHE 509 Ca -0.47 0.00 0.05 0.00 2.80 0.00 0.00 57.97 60.35 1y57 h PHE 509 Cb 1.20 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.31 1y57 h PHE 509 CO 0.59 0.24 0.20 1.49 -0.60 0.00 0.00 178.31 180.23 1y57 h GLU 510 N 0.00 0.39 -0.36 1.51 4.81 -1.89 -0.65 114.58 118.38 1y57 h GLU 510 Ca -0.00 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 1y57 h GLU 510 Cb 0.49 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1y57 h GLU 510 CO 0.03 0.26 0.03 -0.92 -0.73 0.00 0.00 179.01 177.68 1y57 h TYR 511 N 0.40 0.67 -0.74 0.92 3.20 -1.87 -2.84 116.97 116.71 1y57 h TYR 511 Ca 0.20 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 1y57 h TYR 511 Cb 0.15 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.21 1y57 h TYR 511 CO -0.12 0.70 0.41 -0.07 -1.64 0.00 0.00 178.16 177.43 1y57 h LEU 512 N 0.45 0.93 -0.12 2.82 3.38 -0.98 -0.84 115.31 120.95 1y57 h LEU 512 Ca 0.11 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1y57 h LEU 512 Cb 0.41 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1y57 h LEU 512 CO 0.01 0.76 0.07 -0.61 0.09 0.00 0.00 178.44 178.75 1y57 h GLN 513 N 1.03 0.17 -0.32 1.13 4.15 -1.09 -1.69 115.11 118.49 1y57 h GLN 513 Ca 0.26 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.65 1y57 h GLN 513 Cb 0.03 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 1y57 h GLN 513 CO -0.04 0.20 0.16 0.00 -1.93 0.00 0.00 178.83 177.22 1y57 h ALA 514 N 0.96 0.42 -0.50 3.38 0.00 -1.25 -0.08 119.26 122.18 1y57 h ALA 514 Ca 0.04 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1y57 h ALA 514 Cb 0.08 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 1y57 h ALA 514 CO -0.01 -0.03 0.20 0.35 0.00 0.00 0.00 179.25 179.76 1y57 h PHE 515 N 0.39 0.35 -0.07 0.00 3.57 -1.09 -1.68 116.94 118.41 1y57 h PHE 515 Ca 0.11 0.02 -0.23 0.00 3.53 0.00 0.00 57.97 61.40 1y57 h PHE 515 Cb 0.11 -0.08 0.02 0.00 2.79 0.00 0.00 35.95 38.78 1y57 h PHE 515 CO -0.02 0.13 -0.87 -0.07 -2.23 0.00 0.00 178.31 175.25 1y57 h LEU 516 N 0.39 0.89 -1.10 0.59 3.38 -1.14 -2.03 115.31 116.28 1y57 h LEU 516 Ca 0.24 -0.69 0.04 0.00 0.09 0.00 0.00 57.88 57.56 1y57 h LEU 516 Cb 0.23 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 1y57 h LEU 516 CO -0.22 1.45 0.61 -0.33 0.09 0.00 0.00 178.44 180.03 1y57 h GLU 517 N 0.40 1.12 -0.31 1.13 5.08 -0.93 -2.86 114.58 118.21 1y57 h GLU 517 Ca -0.09 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1y57 h GLU 517 Cb 1.52 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.51 1y57 h GLU 517 CO 0.17 0.74 0.00 -0.25 -1.00 0.00 0.00 179.01 178.68 1y57 n ASP 518 N -4.44 2.74 -0.21 1.42 8.00 -0.64 -4.69 116.55 118.72 1y57 n ASP 518 Ca 0.12 -1.89 0.01 0.00 0.71 0.00 0.00 54.79 53.74 1y57 n ASP 518 Cb 0.11 -0.20 0.12 0.00 -0.02 0.00 0.00 41.12 41.13 1y57 n ASP 518 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1y57 h TYR 519 N 3.53 0.27 -0.01 1.24 3.20 -1.12 0.15 116.97 124.24 1y57 h TYR 519 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1y57 h TYR 519 Cb 0.78 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.02 1y57 h TYR 519 CO 0.20 -0.00 -0.13 1.19 -1.64 0.00 0.00 178.16 177.78 1y57 n PHE 520 N -5.09 0.00 -0.09 -3.82 3.72 -1.26 -1.04 117.46 109.88 1y57 n PHE 520 Ca 0.10 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.33 1y57 n PHE 520 Cb 0.33 -0.11 -0.08 0.00 -0.94 0.00 0.00 39.48 38.68 1y57 n PHE 520 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1y57 n THR 521 N -0.59 1.05 0.06 4.37 -2.24 -0.87 -3.70 114.28 112.37 1y57 n THR 521 Ca 0.15 -0.33 -0.02 0.00 -2.27 0.00 0.00 64.05 61.58 1y57 n THR 521 Cb 0.31 -1.46 -0.07 0.00 -2.10 0.00 0.00 70.33 67.01 1y57 n THR 521 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1y57 h SER 522 N -0.36 0.00 0.00 3.42 0.02 -0.82 -3.40 113.55 112.41 1y57 h SER 522 Ca -0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 1y57 h SER 522 Cb 1.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.07 1y57 h SER 522 CO -0.19 0.71 -0.99 0.41 -1.14 0.00 0.00 176.83 175.64 1y57 n THR 523 N -3.12 0.00 -3.16 -2.27 -1.04 -0.65 -4.88 114.28 99.16 1y57 n THR 523 Ca -0.05 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.72 1y57 n THR 523 Cb 0.86 -0.90 -0.05 0.00 -1.82 0.00 0.00 70.33 68.42 1y57 n THR 523 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1y57 n GLU 524 N -2.69 1.90 0.17 -2.82 -0.58 -0.20 -4.92 120.64 111.50 1y57 n GLU 524 Ca 0.00 -4.05 0.13 0.00 -0.42 0.00 0.00 57.16 52.83 1y57 n GLU 524 Cb 0.49 -1.88 0.57 0.00 -0.57 0.00 0.00 31.44 30.06 1y57 n GLU 524 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 1y57 h PRO 525 N 3.43 0.00 -0.70 3.49 0.13 -1.78 -2.79 132.00 133.79 1y57 h PRO 525 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1y57 h PRO 525 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1y57 h PRO 525 CO 0.65 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.46 1y57 n GLN 526 N -2.43 2.62 -1.75 0.86 1.13 -1.26 -5.00 117.38 111.54 1y57 n GLN 526 Ca 0.01 -2.51 -0.42 0.00 -1.94 0.00 0.00 57.00 52.14 1y57 n GLN 526 Cb 0.21 -1.54 -0.01 0.00 0.11 0.00 0.00 30.24 29.00 1y57 n GLN 526 CO 0.00 0.00 0.00 0.98 -1.44 0.00 0.00 177.06 176.60 1y57 n TYR 527 N 1.55 2.90 -4.36 1.08 4.19 -1.05 -5.02 117.16 116.45 1y57 n TYR 527 Ca 0.23 0.30 -0.22 0.00 3.31 0.00 0.00 57.90 61.53 1y57 n TYR 527 Cb 0.59 -2.58 -0.16 0.00 0.49 0.00 0.00 39.34 37.67 1y57 n TYR 527 CO 0.00 0.00 0.00 -0.65 0.91 0.00 0.00 176.86 177.12 1y57 s GLN 528 N -0.91 1.18 0.52 2.98 -1.52 -1.26 -5.14 119.66 115.51 1y57 s GLN 528 Ca 0.61 -0.25 -0.22 0.00 -1.95 0.00 0.00 55.36 53.56 1y57 s GLN 528 Cb -0.49 -1.06 -0.06 0.00 -0.22 0.00 0.00 33.01 31.19 1y57 s GLN 528 CO 0.52 -0.01 1.25 -2.14 -0.25 0.00 0.00 175.29 174.66 1y57 s PRO 529 N 0.72 3.38 0.00 2.91 0.02 -1.26 -5.05 135.00 135.71 1y57 s PRO 529 Ca -0.12 1.97 0.00 0.00 0.02 0.00 0.00 61.00 62.87 1y57 s PRO 529 Cb -0.14 -2.27 0.00 0.00 0.02 0.00 0.00 34.50 32.11 1y57 s PRO 529 CO 0.02 -0.92 0.00 0.41 -0.33 0.00 0.00 177.00 176.18 1y57 n GLY 530 N 0.57 2.92 0.17 0.52 0.00 -1.26 -5.03 105.19 103.08 1y57 n GLY 530 Ca 0.10 -1.92 0.12 0.00 0.00 0.00 0.00 46.02 44.32 1y57 n GLY 530 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1y57 h GLU 531 N 0.00 0.00 0.00 1.61 5.08 -1.99 -3.40 114.58 115.87 1y57 h GLU 531 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1y57 h GLU 531 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1y57 h GLU 531 CO 0.00 0.00 -1.09 0.09 -1.00 0.00 0.00 179.01 177.01 1y57 n ASN 532 N -2.80 0.73 0.00 1.42 3.02 -1.26 -5.04 115.26 111.33 1y57 n ASN 532 Ca 0.03 0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 1y57 n ASN 532 Cb 0.51 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 1y57 n ASN 532 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82