#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i76 s LEU 81 N 0.00 4.35 0.46 4.03 1.02 -1.26 -1.08 118.68 126.19 1i76 s LEU 81 Ca 0.00 0.45 -0.24 0.00 0.02 0.00 0.00 54.13 54.36 1i76 s LEU 81 Cb 0.00 -2.85 -0.07 0.00 0.02 0.00 0.00 46.19 43.29 1i76 s LEU 81 CO 0.00 0.20 1.28 -0.89 0.02 0.00 0.00 176.35 176.96 1i76 s THR 82 N -1.42 2.60 0.15 5.49 2.01 -0.44 -4.38 115.64 119.64 1i76 s THR 82 Ca 0.32 0.49 -0.34 0.00 0.31 0.00 0.00 61.69 62.47 1i76 s THR 82 Cb -0.13 -3.27 -0.16 0.00 0.01 0.00 0.00 72.50 68.95 1i76 s THR 82 CO 0.21 0.03 1.13 -0.81 -0.69 0.00 0.00 174.62 174.49 1i76 n PRO 83 N -0.33 0.96 -0.47 4.92 -0.04 -1.26 -1.13 135.00 137.65 1i76 n PRO 83 Ca 0.06 0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.87 1i76 n PRO 83 Cb 0.45 -1.82 0.00 0.00 -0.04 0.00 0.00 33.50 32.09 1i76 n PRO 83 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1i76 n GLY 84 N 2.01 1.11 3.90 0.55 0.00 -1.26 -4.38 105.19 107.12 1i76 n GLY 84 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 1i76 n GLY 84 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1i76 n ASN 85 N 0.00 -1.34 -4.72 1.61 3.02 -0.28 -4.89 115.26 108.66 1i76 n ASN 85 Ca 0.00 -0.93 -0.42 0.00 -0.03 0.00 0.00 54.58 53.20 1i76 n ASN 85 Cb 0.00 -3.41 -0.03 0.00 -0.61 0.00 0.00 39.78 35.73 1i76 n ASN 85 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1i76 s PRO 86 N -6.43 4.33 0.04 3.52 0.04 -1.26 -5.00 135.00 130.24 1i76 s PRO 86 Ca 0.15 2.08 -0.05 0.00 0.04 0.00 0.00 61.00 63.22 1i76 s PRO 86 Cb -0.08 -3.23 -0.01 0.00 0.04 0.00 0.00 34.50 31.22 1i76 s PRO 86 CO 0.86 -0.40 0.08 -1.59 0.04 0.00 0.00 177.00 175.99 1i76 s LYS 87 N 0.81 0.58 0.31 4.56 -2.85 -1.26 -4.53 119.74 117.37 1i76 s LYS 87 Ca 0.63 -0.80 -0.29 0.00 -1.00 0.00 0.00 55.97 54.51 1i76 s LYS 87 Cb -0.37 0.23 -0.10 0.00 -2.06 0.00 0.00 37.83 35.53 1i76 s LYS 87 CO 0.32 -0.14 1.22 -1.58 0.10 0.00 0.00 175.35 175.27 1i76 s TRP 88 N -2.72 3.25 -0.37 1.78 0.52 -1.26 -4.86 118.94 115.28 1i76 s TRP 88 Ca -0.04 1.53 0.23 0.00 0.02 0.00 0.00 56.10 57.84 1i76 s TRP 88 Cb -0.01 -3.52 0.22 0.00 -1.15 0.00 0.00 33.47 29.02 1i76 s TRP 88 CO -0.05 -1.33 1.40 0.93 0.02 0.00 0.00 176.95 177.92 1i76 h GLU 89 N 3.51 0.00 -6.33 4.98 4.39 -2.01 -3.45 114.58 115.67 1i76 h GLU 89 Ca -0.48 0.00 -0.60 0.00 0.34 0.00 0.00 59.36 58.62 1i76 h GLU 89 Cb 1.22 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.75 1i76 h GLU 89 CO 0.66 0.00 -0.70 1.03 -1.16 0.00 0.00 179.01 178.84 1i76 s ARG 90 N -3.26 2.09 0.00 2.33 0.52 -1.26 -5.06 118.95 114.30 1i76 s ARG 90 Ca 0.04 -1.39 0.11 0.00 -0.52 0.00 0.00 55.73 53.97 1i76 s ARG 90 Cb 0.07 -2.11 -0.04 0.00 0.52 0.00 0.00 34.95 33.39 1i76 s ARG 90 CO 0.71 0.40 0.59 0.25 0.02 0.00 0.00 175.30 177.27 1i76 n THR 91 N -0.37 0.00 -3.49 0.02 -2.24 -1.26 -4.76 114.28 102.18 1i76 n THR 91 Ca -0.09 -0.34 -0.42 0.00 -2.27 0.00 0.00 64.05 60.93 1i76 n THR 91 Cb 0.57 1.09 -0.09 0.00 -2.10 0.00 0.00 70.33 69.80 1i76 n THR 91 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1i76 s ASN 92 N -1.63 5.93 0.06 3.42 3.04 -1.26 -0.74 114.94 123.76 1i76 s ASN 92 Ca 0.07 -1.27 0.05 0.00 0.04 0.00 0.00 52.86 51.76 1i76 s ASN 92 Cb 0.09 -2.10 -0.04 0.00 -1.54 0.00 0.00 41.25 37.66 1i76 s ASN 92 CO 0.33 -0.55 -0.05 -0.76 -3.04 0.00 0.00 177.10 173.04 1i76 s LEU 93 N 1.57 3.26 0.24 3.21 1.43 -0.32 -4.99 118.68 123.08 1i76 s LEU 93 Ca 0.03 -0.22 0.06 0.00 -1.03 0.00 0.00 54.13 52.98 1i76 s LEU 93 Cb -0.22 -1.97 -0.03 0.00 0.03 0.00 0.00 46.19 43.99 1i76 s LEU 93 CO 0.06 0.21 0.24 0.42 0.23 0.00 0.00 176.35 177.51 1i76 s THR 94 N -1.18 4.72 0.05 5.49 -4.23 -1.26 -0.85 115.64 118.37 1i76 s THR 94 Ca 0.22 -1.24 -0.00 0.00 -1.18 0.00 0.00 61.69 59.48 1i76 s THR 94 Cb -0.11 -3.54 -0.03 0.00 1.34 0.00 0.00 72.50 70.15 1i76 s THR 94 CO 0.13 -0.32 -0.04 -0.72 -0.54 0.00 0.00 174.62 173.13 1i76 s TYR 95 N -2.06 0.52 -0.05 3.99 -0.85 -0.59 -1.21 117.35 117.11 1i76 s TYR 95 Ca 0.33 -0.86 -0.02 0.00 -0.52 0.00 0.00 57.07 56.00 1i76 s TYR 95 Cb -0.08 -0.36 0.03 0.00 0.38 0.00 0.00 41.96 41.93 1i76 s TYR 95 CO 0.26 -0.27 0.11 0.50 -1.52 0.00 0.00 175.55 174.63 1i76 s ARG 96 N -3.08 0.06 -0.48 -3.49 3.52 -0.50 -1.00 118.95 113.97 1i76 s ARG 96 Ca 0.00 0.28 -0.21 0.00 -0.13 0.00 0.00 55.73 55.67 1i76 s ARG 96 Cb 0.01 -0.16 0.04 0.00 -1.56 0.00 0.00 34.95 33.28 1i76 s ARG 96 CO -0.06 -0.14 0.73 0.42 -0.81 0.00 0.00 175.30 175.44 1i76 s ILE 97 N 0.97 4.71 0.14 4.11 1.01 -1.26 -0.74 121.20 130.13 1i76 s ILE 97 Ca -0.08 0.04 0.03 0.00 0.00 0.00 0.00 60.65 60.64 1i76 s ILE 97 Cb -0.10 -4.33 -0.19 0.00 0.01 0.00 0.00 42.46 37.85 1i76 s ILE 97 CO -0.04 -0.79 1.31 0.03 0.00 0.00 0.00 174.94 175.44 1i76 h ARG 98 N 9.03 0.14 -3.54 2.79 3.08 -0.96 -3.48 114.38 121.43 1i76 h ARG 98 Ca -0.26 -0.19 -0.15 0.00 0.07 0.00 0.00 59.98 59.46 1i76 h ARG 98 Cb 1.09 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 31.17 1i76 h ARG 98 CO 0.97 1.01 0.06 0.54 -1.07 0.00 0.00 179.97 181.47 1i76 s ASN 99 N -6.90 0.47 0.27 7.04 2.20 -1.26 -5.06 114.94 111.70 1i76 s ASN 99 Ca -0.02 -1.32 0.02 0.00 -0.94 0.00 0.00 52.86 50.60 1i76 s ASN 99 Cb 0.10 0.77 -0.05 0.00 -2.00 0.00 0.00 41.25 40.06 1i76 s ASN 99 CO 0.83 -1.51 0.09 -0.31 -2.94 0.00 0.00 177.10 173.26 1i76 s TYR 100 N -2.63 1.63 -0.15 1.54 1.51 -1.26 -4.59 117.35 113.40 1i76 s TYR 100 Ca 0.23 -1.13 -0.04 0.00 -1.01 0.00 0.00 57.07 55.11 1i76 s TYR 100 Cb -0.03 -0.98 -0.03 0.00 -0.11 0.00 0.00 41.96 40.81 1i76 s TYR 100 CO 0.16 -0.26 0.00 -0.08 -1.11 0.00 0.00 175.55 174.26 1i76 s THR 101 N -3.66 4.26 -0.68 -0.71 -1.32 -1.26 -4.79 115.64 107.49 1i76 s THR 101 Ca 0.38 -0.23 0.17 0.00 -1.21 0.00 0.00 61.69 60.79 1i76 s THR 101 Cb 0.08 -2.87 0.17 0.00 -1.51 0.00 0.00 72.50 68.37 1i76 s THR 101 CO 0.14 0.51 1.53 -2.65 -2.21 0.00 0.00 174.62 171.94 1i76 n PRO 102 N 3.19 0.10 0.00 7.08 -0.02 -1.26 -3.37 135.00 140.72 1i76 n PRO 102 Ca -0.17 0.41 0.14 0.00 -2.02 0.00 0.00 63.50 61.85 1i76 n PRO 102 Cb 0.53 -1.71 0.59 0.00 -0.02 0.00 0.00 33.50 32.88 1i76 n PRO 102 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1i76 n GLN 103 N -1.90 0.28 -4.26 -0.52 6.02 -1.26 -4.73 117.38 111.01 1i76 n GLN 103 Ca 0.02 -0.07 -0.20 0.00 -0.01 0.00 0.00 57.00 56.75 1i76 n GLN 103 Cb 0.15 -1.50 -0.11 0.00 1.02 0.00 0.00 30.24 29.80 1i76 n GLN 103 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1i76 s LEU 104 N -2.76 2.38 0.96 1.08 1.43 -1.22 -4.93 118.68 115.63 1i76 s LEU 104 Ca 0.21 -0.78 -0.12 0.00 -1.03 0.00 0.00 54.13 52.41 1i76 s LEU 104 Cb 0.19 -0.64 0.17 0.00 0.03 0.00 0.00 46.19 45.94 1i76 s LEU 104 CO 0.53 -0.09 1.09 -0.94 0.23 0.00 0.00 176.35 177.16 1i76 s SER 105 N -2.34 2.80 0.22 2.29 1.04 -1.26 -4.81 113.70 111.63 1i76 s SER 105 Ca 0.09 1.59 -0.09 0.00 0.48 0.00 0.00 55.95 58.02 1i76 s SER 105 Cb -0.06 -2.24 0.22 0.00 0.10 0.00 0.00 66.02 64.03 1i76 s SER 105 CO 0.04 -3.08 1.86 -0.33 0.98 0.00 0.00 173.24 172.71 1i76 h GLU 106 N -1.85 0.93 -0.84 4.02 5.08 -1.97 -1.73 114.58 118.22 1i76 h GLU 106 Ca -0.51 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 57.77 1i76 h GLU 106 Cb 1.29 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 30.30 1i76 h GLU 106 CO 0.52 0.62 0.44 0.00 -1.00 0.00 0.00 179.01 179.58 1i76 h ALA 107 N 1.32 1.20 -0.59 3.43 0.00 -1.99 -0.34 119.26 122.29 1i76 h ALA 107 Ca 0.31 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 1i76 h ALA 107 Cb 0.01 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1i76 h ALA 107 CO -0.11 0.63 0.02 0.93 0.00 0.00 0.00 179.25 180.72 1i76 h GLU 108 N 1.18 1.01 -0.14 0.00 5.08 -1.76 -0.35 114.58 119.59 1i76 h GLU 108 Ca 0.29 -0.30 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1i76 h GLU 108 Cb 0.05 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 1i76 h GLU 108 CO -0.04 0.98 -0.01 0.28 -1.00 0.00 0.00 179.01 179.22 1i76 h VAL 109 N 0.93 1.26 -0.81 3.13 2.07 -0.82 -1.40 116.25 120.61 1i76 h VAL 109 Ca 0.17 -0.85 0.09 0.00 0.82 0.00 0.00 66.70 66.93 1i76 h VAL 109 Cb 0.51 1.55 -0.07 0.00 -1.52 0.00 0.00 31.29 31.76 1i76 h VAL 109 CO 0.02 0.25 0.46 -0.33 0.02 0.00 0.00 177.57 178.00 1i76 h GLU 110 N -0.02 0.77 -0.22 1.57 5.08 -0.87 -1.70 114.58 119.20 1i76 h GLU 110 Ca 0.04 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 1i76 h GLU 110 Cb 0.38 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1i76 h GLU 110 CO 0.01 0.51 -0.02 -0.09 -1.00 0.00 0.00 179.01 178.41 1i76 h ARG 111 N 0.79 0.40 -0.53 2.33 9.65 -0.98 -0.12 114.38 125.93 1i76 h ARG 111 Ca 0.38 -0.14 0.08 0.00 -1.10 0.00 0.00 59.98 59.21 1i76 h ARG 111 Cb 0.32 -0.03 -0.07 0.00 -1.39 0.00 0.00 29.97 28.81 1i76 h ARG 111 CO -0.23 0.62 0.16 0.00 2.80 0.00 0.00 179.97 183.31 1i76 h ALA 112 N 0.77 0.64 -0.13 2.80 0.00 -0.91 -0.68 119.26 121.75 1i76 h ALA 112 Ca 0.06 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1i76 h ALA 112 Cb 0.45 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1i76 h ALA 112 CO 0.02 -0.25 -0.04 0.82 0.00 0.00 0.00 179.25 179.80 1i76 h ILE 113 N 0.31 1.29 -0.43 0.00 1.08 -1.18 -1.29 117.51 117.29 1i76 h ILE 113 Ca 0.26 -0.99 0.08 0.00 -0.39 0.00 0.00 64.86 63.82 1i76 h ILE 113 Cb 0.33 1.69 -0.07 0.00 -3.07 0.00 0.00 36.82 35.70 1i76 h ILE 113 CO -0.30 0.29 0.03 0.50 -0.69 0.00 0.00 178.15 177.98 1i76 h LYS 114 N -0.06 0.14 -0.07 2.37 3.64 -0.83 -1.59 116.57 120.17 1i76 h LYS 114 Ca 0.03 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.28 1i76 h LYS 114 Cb 0.46 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1i76 h LYS 114 CO 0.01 0.09 -0.52 -0.44 -2.27 0.00 0.00 179.45 176.33 1i76 h ASP 115 N 0.15 0.21 -0.43 4.20 5.19 -1.08 -1.33 116.42 123.34 1i76 h ASP 115 Ca 0.21 -0.11 -0.03 0.00 -0.62 0.00 0.00 57.03 56.48 1i76 h ASP 115 Cb 0.30 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 39.73 1i76 h ASP 115 CO -0.33 0.70 0.14 0.00 -3.12 0.00 0.00 179.24 176.63 1i76 h ALA 116 N 1.31 0.56 -0.67 3.45 0.00 -0.78 -2.23 119.26 120.90 1i76 h ALA 116 Ca 0.00 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1i76 h ALA 116 Cb 0.97 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1i76 h ALA 116 CO 0.08 0.20 0.19 0.74 0.00 0.00 0.00 179.25 180.46 1i76 h PHE 117 N 0.55 1.09 -0.06 0.00 0.04 -1.10 -2.98 116.94 114.47 1i76 h PHE 117 Ca 0.14 -0.12 -0.03 0.00 2.80 0.00 0.00 57.97 60.76 1i76 h PHE 117 Cb 0.25 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 38.08 1i76 h PHE 117 CO 0.01 0.89 -0.08 1.49 -0.60 0.00 0.00 178.31 180.01 1i76 h GLU 118 N 0.98 0.09 -0.76 1.51 4.57 -0.96 -1.44 114.58 118.57 1i76 h GLU 118 Ca 0.21 -0.01 0.11 0.00 -1.18 0.00 0.00 59.36 58.49 1i76 h GLU 118 Cb 0.32 -0.02 -0.08 0.00 -0.16 0.00 0.00 28.75 28.82 1i76 h GLU 118 CO -0.00 0.18 0.38 -0.07 -1.18 0.00 0.00 179.01 178.31 1i76 h LEU 119 N 0.09 0.47 -0.01 1.64 3.38 -1.25 -1.68 115.31 117.95 1i76 h LEU 119 Ca 0.02 0.07 -0.26 0.00 0.09 0.00 0.00 57.88 57.80 1i76 h LEU 119 Cb 0.21 -0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.96 1i76 h LEU 119 CO 0.01 0.25 -1.11 -0.50 0.09 0.00 0.00 178.44 177.18 1i76 h TRP 120 N 0.61 0.71 -0.77 1.13 4.06 -1.46 -3.31 115.95 116.92 1i76 h TRP 120 Ca 0.39 -0.44 -0.03 0.00 2.06 0.00 0.00 58.89 60.87 1i76 h TRP 120 Cb 0.46 -0.06 -0.04 0.00 -1.00 0.00 0.00 29.16 28.53 1i76 h TRP 120 CO -0.11 1.28 0.37 0.66 -3.56 0.00 0.00 178.44 177.08 1i76 h SER 121 N 0.21 1.00 0.37 -3.49 4.64 -0.82 -2.41 113.55 113.05 1i76 h SER 121 Ca -0.13 -0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1i76 h SER 121 Cb 1.78 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 63.61 1i76 h SER 121 CO 0.20 0.85 0.00 1.33 -0.87 0.00 0.00 176.83 178.34 1i76 n VAL 122 N -4.32 0.14 -0.42 0.95 0.24 -0.67 -2.84 118.33 111.41 1i76 n VAL 122 Ca 0.07 0.03 0.05 0.00 -2.04 0.00 0.00 64.34 62.46 1i76 n VAL 122 Cb 0.14 -0.61 0.12 0.00 -1.47 0.00 0.00 33.84 32.02 1i76 n VAL 122 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1i76 n ALA 123 N -1.22 2.29 -3.82 2.33 0.00 -0.92 -5.05 120.51 114.13 1i76 n ALA 123 Ca 0.14 -1.55 -0.04 0.00 0.00 0.00 0.00 53.44 51.99 1i76 n ALA 123 Cb 0.18 -0.34 0.01 0.00 0.00 0.00 0.00 19.45 19.30 1i76 n ALA 123 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1i76 n SER 124 N -0.30 -1.96 -0.02 0.00 3.41 -1.13 -4.56 113.62 109.06 1i76 n SER 124 Ca 0.11 -2.59 0.13 0.00 -0.26 0.00 0.00 58.87 56.25 1i76 n SER 124 Cb 0.49 3.33 0.44 0.00 -0.26 0.00 0.00 64.21 68.21 1i76 n SER 124 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1i76 n PRO 125 N -0.52 0.09 -1.67 4.33 -0.02 -1.26 -4.84 135.00 131.10 1i76 n PRO 125 Ca -0.06 -0.03 -0.45 0.00 -2.02 0.00 0.00 63.50 60.94 1i76 n PRO 125 Cb 0.56 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.52 1i76 n PRO 125 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1i76 n LEU 126 N -1.43 3.04 -4.05 2.45 4.77 -1.26 -4.81 117.00 115.71 1i76 n LEU 126 Ca 0.07 1.14 -0.26 0.00 -0.03 0.00 0.00 56.01 56.94 1i76 n LEU 126 Cb 0.33 -1.42 -0.17 0.00 -2.33 0.00 0.00 43.42 39.84 1i76 n LEU 126 CO 0.30 -0.53 -0.48 -0.63 -1.33 0.00 0.00 177.39 174.73 1i76 s ILE 127 N -0.09 1.27 -0.15 -0.08 1.01 0.08 -4.53 121.20 118.71 1i76 s ILE 127 Ca 0.68 -0.55 -0.03 0.00 0.00 0.00 0.00 60.65 60.75 1i76 s ILE 127 Cb -0.66 -1.15 -0.02 0.00 0.01 0.00 0.00 42.46 40.64 1i76 s ILE 127 CO 0.50 0.39 -0.06 -0.36 0.00 0.00 0.00 174.94 175.40 1i76 s PHE 128 N 0.67 2.96 -0.21 3.97 0.08 -1.26 -1.18 117.98 123.01 1i76 s PHE 128 Ca -0.14 -0.40 0.01 0.00 0.12 0.00 0.00 56.93 56.52 1i76 s PHE 128 Cb -0.16 -1.92 0.03 0.00 -0.57 0.00 0.00 43.02 40.40 1i76 s PHE 128 CO 0.04 -0.09 -0.15 0.99 -0.10 0.00 0.00 175.22 175.91 1i76 s THR 129 N 0.35 2.25 0.23 0.64 2.01 -0.03 -4.98 115.64 116.11 1i76 s THR 129 Ca -0.06 -1.10 -0.30 0.00 0.31 0.00 0.00 61.69 60.54 1i76 s THR 129 Cb -0.15 -2.07 -0.09 0.00 0.01 0.00 0.00 72.50 70.20 1i76 s THR 129 CO 0.04 0.35 1.16 -0.60 -0.69 0.00 0.00 174.62 174.88 1i76 s ARG 130 N 1.26 4.55 0.11 4.92 3.52 -1.26 -1.53 118.95 130.51 1i76 s ARG 130 Ca 0.01 1.85 0.09 0.00 -0.13 0.00 0.00 55.73 57.56 1i76 s ARG 130 Cb -0.15 -3.22 -0.04 0.00 -1.56 0.00 0.00 34.95 29.98 1i76 s ARG 130 CO -0.09 0.03 -0.24 0.96 -0.81 0.00 0.00 175.30 175.15 1i76 s ILE 131 N -0.54 1.96 -0.20 4.11 -4.36 -0.17 -4.90 121.20 117.09 1i76 s ILE 131 Ca 0.49 -1.64 0.22 0.00 -0.26 0.00 0.00 60.65 59.46 1i76 s ILE 131 Cb -0.32 -1.76 -0.05 0.00 1.25 0.00 0.00 42.46 41.58 1i76 s ILE 131 CO 0.39 0.01 0.96 -1.20 0.24 0.00 0.00 174.94 175.34 1i76 n SER 132 N 1.01 0.78 -3.62 4.36 7.64 -1.26 -4.45 113.62 118.07 1i76 n SER 132 Ca -0.19 0.31 -0.10 0.00 1.01 0.00 0.00 58.87 59.90 1i76 n SER 132 Cb 0.53 0.54 -0.03 0.00 -1.01 0.00 0.00 64.21 64.25 1i76 n SER 132 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1i76 s GLN 133 N -3.32 1.39 0.64 1.43 -1.52 -1.26 -4.98 119.66 112.04 1i76 s GLN 133 Ca -0.01 -0.72 0.00 0.00 -1.95 0.00 0.00 55.36 52.68 1i76 s GLN 133 Cb 0.10 0.56 0.00 0.00 -0.22 0.00 0.00 33.01 33.45 1i76 s GLN 133 CO 0.80 -0.60 0.00 0.41 -0.25 0.00 0.00 175.29 175.65 1i76 n GLY 134 N -0.37 -1.86 3.71 3.09 0.00 -1.26 -4.90 105.19 103.60 1i76 n GLY 134 Ca -0.12 -1.71 -0.37 0.00 0.00 0.00 0.00 46.02 43.81 1i76 n GLY 134 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1i76 s GLU 135 N 0.00 4.26 0.21 1.61 0.41 -1.26 -5.02 118.70 118.92 1i76 s GLU 135 Ca 0.00 0.26 0.09 0.00 -0.41 0.00 0.00 54.97 54.91 1i76 s GLU 135 Cb 0.00 -3.46 -0.04 0.00 -1.78 0.00 0.00 34.13 28.85 1i76 s GLU 135 CO 0.00 0.13 -0.08 0.00 -0.49 0.00 0.00 175.26 174.82 1i76 s ALA 136 N 0.78 2.99 0.11 5.21 0.00 -1.26 -5.03 121.76 124.56 1i76 s ALA 136 Ca 0.21 -1.54 -0.28 0.00 0.00 0.00 0.00 51.96 50.35 1i76 s ALA 136 Cb -0.14 -0.72 -0.08 0.00 0.00 0.00 0.00 23.12 22.17 1i76 s ALA 136 CO 0.07 0.41 1.63 -0.44 0.00 0.00 0.00 175.76 177.42 1i76 h ASP 137 N 2.62 -0.86 -3.64 0.00 3.32 -1.90 -3.40 116.42 112.57 1i76 h ASP 137 Ca -0.46 0.10 -0.69 0.00 0.02 0.00 0.00 57.03 56.00 1i76 h ASP 137 Cb 1.22 0.33 -0.33 0.00 0.22 0.00 0.00 39.33 40.77 1i76 h ASP 137 CO 0.56 -0.39 -0.62 -0.63 -1.72 0.00 0.00 179.24 176.44 1i76 s ILE 138 N -6.03 3.24 0.06 0.35 1.01 -0.35 -4.52 121.20 114.96 1i76 s ILE 138 Ca -0.16 -1.62 -0.23 0.00 0.00 0.00 0.00 60.65 58.64 1i76 s ILE 138 Cb 0.08 -3.01 -0.06 0.00 0.01 0.00 0.00 42.46 39.48 1i76 s ILE 138 CO 0.65 -0.36 0.68 0.20 0.00 0.00 0.00 174.94 176.11 1i76 s ASN 139 N 1.51 7.15 -0.10 3.58 0.01 -1.26 -1.41 114.94 124.42 1i76 s ASN 139 Ca 0.01 1.37 0.04 0.00 -0.71 0.00 0.00 52.86 53.57 1i76 s ASN 139 Cb -0.21 -2.42 -0.00 0.00 0.41 0.00 0.00 41.25 39.02 1i76 s ASN 139 CO -0.02 0.12 -0.23 -0.63 -1.51 0.00 0.00 177.10 174.84 1i76 s ILE 140 N -0.47 2.21 0.05 0.60 1.01 0.08 -1.00 121.20 123.70 1i76 s ILE 140 Ca 0.34 -0.97 -0.22 0.00 0.00 0.00 0.00 60.65 59.79 1i76 s ILE 140 Cb -0.20 -1.85 0.05 0.00 0.01 0.00 0.00 42.46 40.47 1i76 s ILE 140 CO 0.21 0.56 0.53 0.00 0.00 0.00 0.00 174.94 176.24 1i76 s ALA 141 N 0.23 -1.34 -0.25 9.38 0.00 -0.96 -0.17 121.76 128.64 1i76 s ALA 141 Ca -0.14 0.59 -0.09 0.00 0.00 0.00 0.00 51.96 52.31 1i76 s ALA 141 Cb -0.17 0.42 -0.04 0.00 0.00 0.00 0.00 23.12 23.33 1i76 s ALA 141 CO 0.07 -0.53 0.12 -0.06 0.00 0.00 0.00 175.76 175.37 1i76 s PHE 142 N -2.55 3.18 0.12 0.00 0.40 -1.26 -0.75 117.98 117.12 1i76 s PHE 142 Ca -0.05 -0.09 0.03 0.00 -0.60 0.00 0.00 56.93 56.22 1i76 s PHE 142 Cb -0.01 -2.27 -0.04 0.00 0.51 0.00 0.00 43.02 41.21 1i76 s PHE 142 CO -0.03 -0.17 -0.08 0.71 0.70 0.00 0.00 175.22 176.35 1i76 s TYR 143 N 1.43 1.06 -0.04 0.36 2.02 -0.28 -4.78 117.35 117.13 1i76 s TYR 143 Ca 0.06 -0.82 0.03 0.00 -0.37 0.00 0.00 57.07 55.98 1i76 s TYR 143 Cb -0.15 -0.57 -0.03 0.00 -0.40 0.00 0.00 41.96 40.81 1i76 s TYR 143 CO 0.06 -0.04 -0.12 -1.14 -1.57 0.00 0.00 175.55 172.74 1i76 s GLN 144 N -3.66 2.53 3.07 -0.62 0.74 -1.26 -0.45 119.66 120.01 1i76 s GLN 144 Ca 0.13 -0.69 0.00 0.00 0.05 0.00 0.00 55.36 54.85 1i76 s GLN 144 Cb 0.03 -2.43 0.00 0.00 1.10 0.00 0.00 33.01 31.71 1i76 s GLN 144 CO -0.02 0.62 0.00 0.54 -0.55 0.00 0.00 175.29 175.88 1i76 n ARG 145 N 2.14 0.00 -2.14 1.67 5.12 -1.26 -4.37 116.66 117.83 1i76 n ARG 145 Ca -0.17 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.33 1i76 n ARG 145 Cb 0.52 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.79 1i76 n ARG 145 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1i76 s ASP 146 N -4.00 6.80 0.00 0.55 1.01 -1.26 -1.36 116.67 118.41 1i76 s ASP 146 Ca 0.00 2.39 0.15 0.00 0.71 0.00 0.00 52.55 55.81 1i76 s ASP 146 Cb 0.00 -2.59 0.25 0.00 1.01 0.00 0.00 42.92 41.59 1i76 s ASP 146 CO 0.00 -0.65 1.08 0.00 0.21 0.00 0.00 175.17 175.81 1i76 n HIS 147 N 3.62 0.00 -0.01 4.23 1.44 -1.26 -5.00 115.22 118.25 1i76 n HIS 147 Ca 0.10 -0.45 0.00 0.00 -2.01 0.00 0.00 57.72 55.36 1i76 n HIS 147 Cb 0.42 0.08 0.00 0.00 0.12 0.00 0.00 29.99 30.60 1i76 n HIS 147 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1i76 n GLY 148 N 0.29 0.16 0.15 -1.39 0.00 -1.26 -4.92 105.19 98.23 1i76 n GLY 148 Ca -0.05 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.99 1i76 n GLY 148 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1i76 n ASP 149 N 0.00 2.25 -0.19 1.61 5.68 -1.26 -4.98 116.55 119.67 1i76 n ASP 149 Ca 0.00 -2.13 -0.02 0.00 -0.50 0.00 0.00 54.79 52.13 1i76 n ASP 149 Cb 0.00 -0.10 -0.01 0.00 -1.14 0.00 0.00 41.12 39.87 1i76 n ASP 149 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1i76 n ASN 150 N -0.40 -4.90 -3.64 -1.12 5.15 -1.26 -4.92 115.26 104.16 1i76 n ASN 150 Ca 0.04 0.06 -0.27 0.00 -0.60 0.00 0.00 54.58 53.81 1i76 n ASN 150 Cb 0.34 -2.62 -0.10 0.00 -0.53 0.00 0.00 39.78 36.87 1i76 n ASN 150 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1i76 n SER 151 N -0.57 2.60 -4.75 1.20 7.64 -1.26 -5.11 113.62 113.37 1i76 n SER 151 Ca -0.02 -3.14 -0.38 0.00 1.01 0.00 0.00 58.87 56.34 1i76 n SER 151 Cb 0.35 -0.70 0.03 0.00 -1.01 0.00 0.00 64.21 62.88 1i76 n SER 151 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1i76 s PRO 152 N -1.57 3.25 0.98 1.43 0.04 -1.26 -4.87 135.00 133.00 1i76 s PRO 152 Ca 0.31 2.09 -0.14 0.00 0.04 0.00 0.00 61.00 63.30 1i76 s PRO 152 Cb 0.04 -2.25 0.18 0.00 0.04 0.00 0.00 34.50 32.51 1i76 s PRO 152 CO -0.12 -1.05 1.14 -0.06 0.04 0.00 0.00 177.00 176.94 1i76 s PHE 153 N -1.39 2.06 -0.05 0.56 0.08 -0.46 -4.92 117.98 113.86 1i76 s PHE 153 Ca 0.71 0.78 0.07 0.00 0.12 0.00 0.00 56.93 58.61 1i76 s PHE 153 Cb -0.37 -3.44 0.11 0.00 -0.57 0.00 0.00 43.02 38.76 1i76 s PHE 153 CO 0.43 -2.72 0.99 -0.40 -0.10 0.00 0.00 175.22 173.42 1i76 n ASP 154 N -4.00 1.15 -0.15 1.36 5.75 -1.26 -4.08 116.55 115.32 1i76 n ASP 154 Ca 0.08 -2.27 0.00 0.00 -0.01 0.00 0.00 54.79 52.59 1i76 n ASP 154 Cb 0.59 -0.23 -0.00 0.00 -1.03 0.00 0.00 41.12 40.45 1i76 n ASP 154 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1i76 n GLY 155 N -0.61 -1.99 3.62 6.12 0.00 -1.26 -4.91 105.19 106.17 1i76 n GLY 155 Ca 0.06 -1.39 -0.44 0.00 0.00 0.00 0.00 46.02 44.25 1i76 n GLY 155 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1i76 n PRO 156 N -0.44 1.59 0.00 1.61 -0.02 -1.26 -4.69 135.00 131.79 1i76 n PRO 156 Ca 0.00 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1i76 n PRO 156 Cb 0.01 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 1i76 n PRO 156 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1i76 n ASN 157 N 1.05 -3.52 0.00 2.55 3.02 -1.26 -4.95 115.26 112.16 1i76 n ASN 157 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 1i76 n ASN 157 Cb 0.34 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.51 1i76 n ASN 157 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1i76 n GLY 158 N 0.00 2.73 3.72 7.41 0.00 -1.26 -4.56 105.19 113.23 1i76 n GLY 158 Ca 0.00 -0.32 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 1i76 n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i76 s ILE 159 N 0.00 3.36 -0.13 -0.61 -1.09 -1.26 -4.92 121.20 116.55 1i76 s ILE 159 Ca 0.00 1.03 0.05 0.00 -2.23 0.00 0.00 60.65 59.50 1i76 s ILE 159 Cb 0.00 -3.66 -0.24 0.00 -1.58 0.00 0.00 42.46 36.99 1i76 s ILE 159 CO 0.00 0.11 0.33 0.18 -1.23 0.00 0.00 174.94 174.33 1i76 n LEU 160 N 3.47 1.65 -3.63 2.97 4.77 -1.26 -4.70 117.00 120.26 1i76 n LEU 160 Ca 0.09 0.19 -0.02 0.00 -0.03 0.00 0.00 56.01 56.24 1i76 n LEU 160 Cb 0.43 -0.38 -0.01 0.00 -2.33 0.00 0.00 43.42 41.13 1i76 n LEU 160 CO 0.58 0.65 0.92 0.00 -1.33 0.00 0.00 177.39 178.21 1i76 s ALA 161 N -2.56 -2.01 0.20 -1.18 0.00 -1.26 -0.63 121.76 114.32 1i76 s ALA 161 Ca -0.16 0.79 -0.17 0.00 0.00 0.00 0.00 51.96 52.41 1i76 s ALA 161 Cb 0.07 0.33 0.03 0.00 0.00 0.00 0.00 23.12 23.55 1i76 s ALA 161 CO 0.77 -0.91 0.53 -3.38 0.00 0.00 0.00 175.76 172.77 1i76 s HIS 162 N -2.72 -0.09 0.09 0.00 -3.43 -0.12 -4.98 115.29 104.04 1i76 s HIS 162 Ca 0.12 -0.26 -0.11 0.00 -0.80 0.00 0.00 55.06 54.01 1i76 s HIS 162 Cb 0.01 0.40 0.01 0.00 -1.43 0.00 0.00 32.58 31.57 1i76 s HIS 162 CO -0.03 -0.94 0.25 0.00 -2.00 0.00 0.00 174.74 172.02 1i76 s ALA 163 N -3.89 -0.46 -0.05 -1.38 0.00 -1.26 -0.70 121.76 114.03 1i76 s ALA 163 Ca 0.10 -0.39 0.00 0.00 0.00 0.00 0.00 51.96 51.67 1i76 s ALA 163 Cb -0.01 0.51 -0.03 0.00 0.00 0.00 0.00 23.12 23.58 1i76 s ALA 163 CO -0.01 -0.52 -0.02 -0.06 0.00 0.00 0.00 175.76 175.14 1i76 s PHE 164 N -3.63 3.07 0.90 0.00 0.40 -0.52 -4.86 117.98 113.35 1i76 s PHE 164 Ca 0.03 0.11 -0.11 0.00 -0.60 0.00 0.00 56.93 56.36 1i76 s PHE 164 Cb 0.03 -1.73 0.13 0.00 0.51 0.00 0.00 43.02 41.97 1i76 s PHE 164 CO -0.10 0.43 1.12 0.00 0.70 0.00 0.00 175.22 177.37 1i76 n GLN 165 N 1.90 -0.35 -1.63 0.44 10.64 -1.26 -1.22 117.38 125.89 1i76 n GLN 165 Ca -0.17 -0.03 -0.44 0.00 -1.83 0.00 0.00 57.00 54.53 1i76 n GLN 165 Cb 0.53 -2.36 -0.01 0.00 -0.86 0.00 0.00 30.24 27.54 1i76 n GLN 165 CO 0.00 0.00 0.00 -2.30 -1.83 0.00 0.00 177.06 172.93 1i76 n PRO 166 N -3.96 1.67 0.00 2.61 -0.02 -1.24 -1.29 135.00 132.76 1i76 n PRO 166 Ca 0.12 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 1i76 n PRO 166 Cb 0.52 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 1i76 n PRO 166 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i76 n GLY 167 N 1.14 -0.45 3.81 -1.23 0.00 -1.26 -4.72 105.19 102.49 1i76 n GLY 167 Ca 0.08 -1.28 -0.30 0.00 0.00 0.00 0.00 46.02 44.52 1i76 n GLY 167 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1i76 s GLN 168 N -2.00 2.27 7.79 1.61 1.03 -1.26 -3.89 119.66 125.22 1i76 s GLN 168 Ca 0.00 0.68 0.00 0.00 0.04 0.00 0.00 55.36 56.08 1i76 s GLN 168 Cb 0.00 -1.94 0.00 0.00 0.03 0.00 0.00 33.01 31.10 1i76 s GLN 168 CO 0.00 -1.50 0.00 0.41 -2.54 0.00 0.00 175.29 171.66 1i76 n GLY 169 N -2.13 3.45 0.32 2.60 0.00 -1.26 -1.68 105.19 106.49 1i76 n GLY 169 Ca 0.07 -0.10 0.21 0.00 0.00 0.00 0.00 46.02 46.21 1i76 n GLY 169 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1i76 h ILE 170 N 0.00 0.03 -2.76 -0.61 2.10 -1.94 -3.44 117.51 110.88 1i76 h ILE 170 Ca 0.00 -0.12 -0.59 0.00 1.08 0.00 0.00 64.86 65.22 1i76 h ILE 170 Cb 0.00 1.12 0.11 0.00 -1.09 0.00 0.00 36.82 36.96 1i76 h ILE 170 CO 0.00 0.00 0.31 0.61 -1.08 0.00 0.00 178.15 178.00 1i76 n GLY 171 N -0.83 0.15 3.75 8.18 0.00 -0.68 -1.36 105.19 114.39 1i76 n GLY 171 Ca -0.02 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1i76 n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i76 n GLY 172 N 1.18 2.82 3.80 -0.02 0.00 -0.36 -4.49 105.19 108.12 1i76 n GLY 172 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 1i76 n GLY 172 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1i76 s ASP 173 N -1.96 6.18 -0.08 1.61 1.11 -0.46 -4.58 116.67 118.48 1i76 s ASP 173 Ca 0.00 1.93 0.02 0.00 0.18 0.00 0.00 52.55 54.68 1i76 s ASP 173 Cb 0.00 -2.56 0.02 0.00 1.07 0.00 0.00 42.92 41.45 1i76 s ASP 173 CO 0.00 -0.90 -0.12 0.00 1.18 0.00 0.00 175.17 175.33 1i76 s ALA 174 N -2.05 1.38 0.01 5.23 0.00 -0.17 -1.44 121.76 124.72 1i76 s ALA 174 Ca 0.67 -0.52 0.08 0.00 0.00 0.00 0.00 51.96 52.20 1i76 s ALA 174 Cb -0.17 -0.69 -0.02 0.00 0.00 0.00 0.00 23.12 22.24 1i76 s ALA 174 CO 0.24 -0.01 -0.24 -1.01 0.00 0.00 0.00 175.76 174.73 1i76 s HIS 175 N 0.91 2.38 -0.03 0.00 3.76 0.13 -2.25 115.29 120.18 1i76 s HIS 175 Ca -0.10 -0.39 0.07 0.00 -0.15 0.00 0.00 55.06 54.49 1i76 s HIS 175 Cb -0.15 -1.47 -0.01 0.00 1.11 0.00 0.00 32.58 32.05 1i76 s HIS 175 CO 0.01 0.07 -0.23 -0.06 -0.85 0.00 0.00 174.74 173.67 1i76 s PHE 176 N -0.72 2.15 -0.29 1.40 0.40 0.07 -0.94 117.98 120.05 1i76 s PHE 176 Ca 0.11 -0.50 -0.29 0.00 -0.60 0.00 0.00 56.93 55.65 1i76 s PHE 176 Cb -0.10 -1.40 -0.00 0.00 0.51 0.00 0.00 43.02 42.03 1i76 s PHE 176 CO 0.01 -0.10 1.34 0.34 0.70 0.00 0.00 175.22 177.51 1i76 s ASP 177 N -0.38 6.63 0.52 1.36 -1.08 0.19 -1.13 116.67 122.79 1i76 s ASP 177 Ca 0.04 1.24 0.35 0.00 -0.52 0.00 0.00 52.55 53.66 1i76 s ASP 177 Cb -0.11 -2.54 1.79 0.00 -1.46 0.00 0.00 42.92 40.61 1i76 s ASP 177 CO 0.01 -1.11 2.06 0.00 0.52 0.00 0.00 175.17 176.65 1i76 h ALA 178 N 9.49 1.00 -0.01 3.66 0.00 -1.07 -2.33 119.26 130.01 1i76 h ALA 178 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1i76 h ALA 178 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1i76 h ALA 178 CO 1.03 0.00 -0.04 0.39 0.00 0.00 0.00 179.25 180.63 1i76 n GLU 179 N -2.79 1.34 -1.82 0.00 1.02 -1.26 -4.88 120.64 112.25 1i76 n GLU 179 Ca -0.01 -0.66 -0.31 0.00 -0.02 0.00 0.00 57.16 56.15 1i76 n GLU 179 Cb 0.12 -1.49 0.02 0.00 -0.02 0.00 0.00 31.44 30.07 1i76 n GLU 179 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1i76 s GLU 180 N -2.11 3.41 -0.26 3.49 0.41 -0.88 -4.24 118.70 118.51 1i76 s GLU 180 Ca 0.37 0.85 -0.29 0.00 -0.41 0.00 0.00 54.97 55.49 1i76 s GLU 180 Cb 0.21 -2.05 -0.01 0.00 -1.78 0.00 0.00 34.13 30.49 1i76 s GLU 180 CO 0.38 -0.72 1.43 0.99 -0.49 0.00 0.00 175.26 176.85 1i76 s THR 181 N -3.07 3.96 -0.12 3.63 2.01 -1.26 -5.03 115.64 115.75 1i76 s THR 181 Ca 0.57 1.08 -0.01 0.00 0.31 0.00 0.00 61.69 63.64 1i76 s THR 181 Cb -0.12 -3.97 -0.02 0.00 0.01 0.00 0.00 72.50 68.40 1i76 s THR 181 CO 0.52 -0.39 -0.10 0.26 -0.69 0.00 0.00 174.62 174.22 1i76 s TRP 182 N 4.69 2.88 0.24 4.92 0.52 -1.26 -0.84 118.94 130.09 1i76 s TRP 182 Ca 0.62 -0.38 0.02 0.00 0.02 0.00 0.00 56.10 56.39 1i76 s TRP 182 Cb -0.20 -1.83 -0.05 0.00 -1.15 0.00 0.00 33.47 30.24 1i76 s TRP 182 CO 0.25 -0.03 0.06 0.95 0.02 0.00 0.00 176.95 178.21 1i76 s THR 183 N 0.03 0.73 -0.27 2.01 -4.23 0.36 -4.62 115.64 109.65 1i76 s THR 183 Ca -0.03 -2.00 0.09 0.00 -1.18 0.00 0.00 61.69 58.57 1i76 s THR 183 Cb -0.14 -2.51 0.45 0.00 1.34 0.00 0.00 72.50 71.65 1i76 s THR 183 CO 0.04 -0.15 1.29 -0.46 -0.54 0.00 0.00 174.62 174.80 1i76 n ASN 184 N -0.44 3.10 -1.01 3.99 2.04 -1.26 -1.07 115.26 120.60 1i76 n ASN 184 Ca -0.02 -3.83 0.00 0.00 -0.44 0.00 0.00 54.58 50.28 1i76 n ASN 184 Cb 0.65 -0.51 0.00 0.00 -2.53 0.00 0.00 39.78 37.39 1i76 n ASN 184 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 1i76 n THR 185 N -0.99 0.00 0.55 5.53 -2.24 -1.26 -5.05 114.28 110.83 1i76 n THR 185 Ca 0.31 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.22 1i76 n THR 185 Cb 0.85 0.00 0.39 0.00 -2.10 0.00 0.00 70.33 69.47 1i76 n THR 185 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1i76 h SER 186 N 0.00 0.00 -3.79 3.42 4.64 -1.97 -3.41 113.55 112.44 1i76 h SER 186 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1i76 h SER 186 Cb 0.00 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.17 1i76 h SER 186 CO 0.00 0.00 0.74 0.00 -0.87 0.00 0.00 176.83 176.70 1i76 s ALA 187 N -3.15 3.57 0.23 5.18 0.00 -1.26 -4.91 121.76 121.43 1i76 s ALA 187 Ca 0.09 1.44 -0.31 0.00 0.00 0.00 0.00 51.96 53.18 1i76 s ALA 187 Cb 0.11 -3.56 -0.11 0.00 0.00 0.00 0.00 23.12 19.56 1i76 s ALA 187 CO 0.58 -0.87 1.64 -0.80 0.00 0.00 0.00 175.76 176.32 1i76 s ASN 188 N -0.14 6.43 -0.14 0.00 0.01 -1.26 -3.60 114.94 116.24 1i76 s ASN 188 Ca 0.53 2.84 -0.00 0.00 -0.71 0.00 0.00 52.86 55.52 1i76 s ASN 188 Cb -0.44 -2.61 -0.01 0.00 0.41 0.00 0.00 41.25 38.60 1i76 s ASN 188 CO 0.56 -0.92 -0.12 -0.31 -1.51 0.00 0.00 177.10 174.80 1i76 s TYR 189 N 0.76 2.82 -0.25 2.20 1.51 -0.02 -4.70 117.35 119.68 1i76 s TYR 189 Ca 0.70 -0.70 -0.29 0.00 -1.01 0.00 0.00 57.07 55.77 1i76 s TYR 189 Cb -0.48 -1.87 -0.01 0.00 -0.11 0.00 0.00 41.96 39.49 1i76 s TYR 189 CO 0.37 -0.26 1.46 1.21 -1.11 0.00 0.00 175.55 177.23 1i76 s ASN 190 N 0.47 6.54 0.15 2.29 3.84 -1.24 -0.49 114.94 126.50 1i76 s ASN 190 Ca -0.09 1.45 -0.14 0.00 0.21 0.00 0.00 52.86 54.29 1i76 s ASN 190 Cb -0.16 -2.54 0.03 0.00 -0.55 0.00 0.00 41.25 38.04 1i76 s ASN 190 CO 0.04 -1.15 1.72 0.25 -2.79 0.00 0.00 177.10 175.17 1i76 h LEU 191 N 11.22 0.63 -0.45 3.21 5.85 -1.46 -2.11 115.31 132.21 1i76 h LEU 191 Ca -0.30 -0.14 0.07 0.00 0.84 0.00 0.00 57.88 58.35 1i76 h LEU 191 Cb 1.13 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.93 1i76 h LEU 191 CO 1.01 0.60 0.09 0.15 -0.34 0.00 0.00 178.44 179.96 1i76 h PHE 192 N 0.62 0.15 -0.42 1.25 3.57 -1.82 0.14 116.94 120.43 1i76 h PHE 192 Ca 0.16 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.63 1i76 h PHE 192 Cb 0.15 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 1i76 h PHE 192 CO -0.00 0.01 0.02 -0.07 -2.23 0.00 0.00 178.31 176.04 1i76 h LEU 193 N 0.23 0.71 -0.53 0.59 3.38 -1.86 -0.14 115.31 117.69 1i76 h LEU 193 Ca 0.22 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1i76 h LEU 193 Cb 0.27 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1i76 h LEU 193 CO -0.28 0.83 0.20 0.58 0.09 0.00 0.00 178.44 179.86 1i76 h VAL 194 N 0.57 1.22 -0.56 1.22 2.07 -1.10 -2.00 116.25 117.68 1i76 h VAL 194 Ca 0.12 -0.70 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 1i76 h VAL 194 Cb 0.45 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 1i76 h VAL 194 CO 0.02 0.27 0.35 0.00 0.02 0.00 0.00 177.57 178.22 1i76 h ALA 195 N 1.05 0.71 -0.60 1.67 0.00 -0.62 -0.20 119.26 121.27 1i76 h ALA 195 Ca 0.17 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.08 1i76 h ALA 195 Cb 0.22 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1i76 h ALA 195 CO -0.01 0.18 0.31 0.00 0.00 0.00 0.00 179.25 179.72 1i76 h ALA 196 N 1.18 0.78 -0.11 0.00 0.00 -0.81 0.78 119.26 121.08 1i76 h ALA 196 Ca 0.20 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1i76 h ALA 196 Cb -0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1i76 h ALA 196 CO -0.04 -0.04 0.06 1.25 0.00 0.00 0.00 179.25 180.47 1i76 h HIS 197 N 0.57 0.16 -0.85 0.00 6.17 -0.98 -2.65 115.15 117.56 1i76 h HIS 197 Ca 0.27 -0.01 0.02 0.00 0.71 0.00 0.00 60.37 61.37 1i76 h HIS 197 Cb 0.20 -0.05 -0.05 0.00 2.52 0.00 0.00 27.41 30.03 1i76 h HIS 197 CO -0.10 0.21 0.56 0.93 0.71 0.00 0.00 177.93 180.25 1i76 h GLU 198 N 0.06 1.07 0.00 5.26 4.39 -0.53 -1.76 114.58 123.07 1i76 h GLU 198 Ca 0.04 -0.06 -0.05 0.00 0.34 0.00 0.00 59.36 59.62 1i76 h GLU 198 Cb 0.11 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 1i76 h GLU 198 CO -0.01 0.71 -0.26 0.74 -1.16 0.00 0.00 179.01 179.03 1i76 h PHE 199 N 1.11 0.00 -0.45 4.33 0.04 -0.70 -0.80 116.94 120.47 1i76 h PHE 199 Ca 0.33 0.00 0.05 0.00 2.80 0.00 0.00 57.97 61.15 1i76 h PHE 199 Cb -0.04 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.06 1i76 h PHE 199 CO -0.00 0.26 0.18 0.78 -0.60 0.00 0.00 178.31 178.93 1i76 h GLY 200 N 1.60 0.60 0.95 -1.45 0.00 -0.96 -1.08 103.07 102.72 1i76 h GLY 200 Ca -0.00 -0.11 0.02 0.00 0.00 0.00 0.00 47.33 47.23 1i76 h GLY 200 CO 0.03 0.05 0.38 0.45 0.00 0.00 0.00 176.54 177.45 1i76 h HIS 201 N 0.37 0.71 -0.16 5.60 3.86 -1.09 0.06 115.15 124.50 1i76 h HIS 201 Ca 0.21 0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.48 1i76 h HIS 201 Cb 0.17 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.40 1i76 h HIS 201 CO -0.14 0.43 0.14 0.77 0.86 0.00 0.00 177.93 179.99 1i76 h SER 202 N 0.75 0.00 0.26 2.45 0.02 -0.56 -1.42 113.55 115.05 1i76 h SER 202 Ca 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 1i76 h SER 202 Cb -0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.50 1i76 h SER 202 CO -0.07 0.00 -0.65 0.18 -1.14 0.00 0.00 176.83 175.14 1i76 n LEU 203 N -4.09 0.83 0.00 5.07 4.77 -0.47 -3.64 117.00 119.47 1i76 n LEU 203 Ca 0.01 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 1i76 n LEU 203 Cb 0.26 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1i76 n LEU 203 CO 0.31 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 1i76 n GLY 204 N 1.48 1.09 3.84 -0.72 0.00 -0.53 -4.64 105.19 105.70 1i76 n GLY 204 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 1i76 n GLY 204 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i76 s LEU 205 N 0.00 4.25 0.59 0.99 1.43 -0.04 -1.33 118.68 124.58 1i76 s LEU 205 Ca 0.00 1.26 0.09 0.00 -1.03 0.00 0.00 54.13 54.44 1i76 s LEU 205 Cb 0.00 -3.65 0.09 0.00 0.03 0.00 0.00 46.19 42.66 1i76 s LEU 205 CO 0.00 -0.02 0.82 0.00 0.23 0.00 0.00 176.35 177.38 1i76 s ALA 206 N -1.66 4.61 0.45 4.21 0.00 -0.25 -3.90 121.76 125.22 1i76 s ALA 206 Ca 0.45 -2.11 -0.24 0.00 0.00 0.00 0.00 51.96 50.06 1i76 s ALA 206 Cb -0.14 -1.52 -0.07 0.00 0.00 0.00 0.00 23.12 21.39 1i76 s ALA 206 CO 0.20 -0.94 1.24 -1.01 0.00 0.00 0.00 175.76 175.25 1i76 s HIS 207 N -2.73 2.76 0.07 0.00 0.09 -1.26 -4.76 115.29 109.47 1i76 s HIS 207 Ca 0.62 1.47 0.01 0.00 -0.00 0.00 0.00 55.06 57.16 1i76 s HIS 207 Cb -0.06 -3.55 -0.04 0.00 -0.00 0.00 0.00 32.58 28.94 1i76 s HIS 207 CO 0.40 -1.93 0.17 0.45 -0.00 0.00 0.00 174.74 173.83 1i76 s SER 208 N -1.08 6.13 0.00 1.40 0.15 -0.58 -4.28 113.70 115.44 1i76 s SER 208 Ca 0.63 0.19 0.27 0.00 0.70 0.00 0.00 55.95 57.74 1i76 s SER 208 Cb -0.34 -1.83 0.88 0.00 -1.71 0.00 0.00 66.02 63.03 1i76 s SER 208 CO 0.42 0.17 1.66 -1.54 1.20 0.00 0.00 173.24 175.14 1i76 n SER 209 N 0.34 0.52 -4.56 5.45 3.41 -1.26 -4.16 113.62 113.35 1i76 n SER 209 Ca -0.06 -0.35 -0.41 0.00 -0.26 0.00 0.00 58.87 57.79 1i76 n SER 209 Cb 0.51 0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.45 1i76 n SER 209 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1i76 s ASP 210 N -2.75 5.98 0.07 4.04 -1.08 -1.26 -4.91 116.67 116.77 1i76 s ASP 210 Ca 0.19 0.06 0.12 0.00 -0.52 0.00 0.00 52.55 52.40 1i76 s ASP 210 Cb 0.19 -2.55 0.52 0.00 -1.46 0.00 0.00 42.92 39.62 1i76 s ASP 210 CO 0.57 -1.87 1.36 -0.81 0.52 0.00 0.00 175.17 174.94 1i76 n PRO 211 N 8.98 0.04 0.00 4.34 -0.04 -1.26 -0.96 135.00 146.10 1i76 n PRO 211 Ca 0.11 0.40 0.13 0.00 -0.04 0.00 0.00 63.50 64.10 1i76 n PRO 211 Cb 0.50 -1.60 0.40 0.00 -0.04 0.00 0.00 33.50 32.76 1i76 n PRO 211 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1i76 n GLY 212 N -0.64 -0.64 3.84 0.55 0.00 -1.26 -4.96 105.19 102.09 1i76 n GLY 212 Ca 0.02 -0.39 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 1i76 n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i76 s ALA 213 N -2.50 3.18 0.40 4.61 0.00 -0.13 -4.82 121.76 122.49 1i76 s ALA 213 Ca 0.25 0.18 0.09 0.00 0.00 0.00 0.00 51.96 52.48 1i76 s ALA 213 Cb 0.19 -2.96 0.82 0.00 0.00 0.00 0.00 23.12 21.17 1i76 s ALA 213 CO 0.52 0.16 1.96 1.25 0.00 0.00 0.00 175.76 179.65 1i76 h LEU 214 N 1.90 0.30 -0.66 0.00 5.85 -1.91 -2.15 115.31 118.63 1i76 h LEU 214 Ca -0.48 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.20 1i76 h LEU 214 Cb 1.18 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.13 1i76 h LEU 214 CO 0.63 0.37 0.00 0.23 -0.34 0.00 0.00 178.44 179.33 1i76 n MET 215 N -4.34 1.41 -1.83 1.25 2.81 -1.26 -4.74 117.12 110.41 1i76 n MET 215 Ca 0.00 -0.58 -0.39 0.00 -1.81 0.00 0.00 57.70 54.92 1i76 n MET 215 Cb 0.20 -1.17 0.02 0.00 -0.71 0.00 0.00 33.22 31.57 1i76 n MET 215 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 1i76 s TYR 216 N -1.75 2.44 -2.00 2.03 5.04 -0.81 -1.52 117.35 120.77 1i76 s TYR 216 Ca 0.11 1.32 0.20 0.00 -2.44 0.00 0.00 57.07 56.25 1i76 s TYR 216 Cb 0.06 -3.85 1.17 0.00 0.35 0.00 0.00 41.96 39.69 1i76 s TYR 216 CO 0.07 -2.82 1.66 -2.30 -1.34 0.00 0.00 175.55 170.82 1i76 n PRO 217 N -0.45 0.85 -4.83 4.97 -0.02 -1.26 -4.73 135.00 129.53 1i76 n PRO 217 Ca 0.07 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.28 1i76 n PRO 217 Cb 0.43 -1.36 -0.17 0.00 -0.02 0.00 0.00 33.50 32.39 1i76 n PRO 217 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1i76 s ASN 218 N -1.76 2.26 0.43 2.55 0.02 -1.26 -5.11 114.94 112.06 1i76 s ASN 218 Ca 0.29 -0.39 -0.26 0.00 -1.02 0.00 0.00 52.86 51.49 1i76 s ASN 218 Cb 0.13 -0.95 -0.09 0.00 0.02 0.00 0.00 41.25 40.36 1i76 s ASN 218 CO 0.23 0.10 1.39 -0.47 0.02 0.00 0.00 177.10 178.37 1i76 s TYR 219 N 0.43 2.59 -0.14 2.20 6.14 -1.26 -5.05 117.35 122.27 1i76 s TYR 219 Ca -0.14 1.30 -0.23 0.00 0.64 0.00 0.00 57.07 58.64 1i76 s TYR 219 Cb -0.16 -3.85 0.06 0.00 0.42 0.00 0.00 41.96 38.43 1i76 s TYR 219 CO 0.05 -2.66 0.58 0.00 0.64 0.00 0.00 175.55 174.16 1i76 s ALA 220 N -1.21 -1.47 0.43 3.97 0.00 -1.26 -5.15 121.76 117.07 1i76 s ALA 220 Ca 0.59 1.37 -0.24 0.00 0.00 0.00 0.00 51.96 53.67 1i76 s ALA 220 Cb -0.42 -0.51 -0.08 0.00 0.00 0.00 0.00 23.12 22.11 1i76 s ALA 220 CO 0.55 -0.31 1.21 0.12 0.00 0.00 0.00 175.76 177.32 1i76 s PHE 221 N -0.41 2.89 0.05 0.00 5.36 -1.26 -5.05 117.98 119.55 1i76 s PHE 221 Ca -0.06 1.51 0.00 0.00 -0.96 0.00 0.00 56.93 57.43 1i76 s PHE 221 Cb -0.03 -3.47 -0.03 0.00 -0.34 0.00 0.00 43.02 39.15 1i76 s PHE 221 CO 0.04 -1.65 -0.05 -0.98 -1.46 0.00 0.00 175.22 171.12 1i76 s ARG 222 N -2.48 0.55 0.21 10.12 3.03 -1.26 -5.12 118.95 124.00 1i76 s ARG 222 Ca 0.60 -0.96 -0.32 0.00 2.03 0.00 0.00 55.73 57.08 1i76 s ARG 222 Cb -0.32 -0.01 -0.13 0.00 -1.03 0.00 0.00 34.95 33.46 1i76 s ARG 222 CO 0.40 -0.04 1.53 0.39 -1.13 0.00 0.00 175.30 176.44 1i76 n GLU 223 N 0.81 2.22 -0.00 3.89 -0.58 -1.26 -4.89 120.64 120.83 1i76 n GLU 223 Ca -0.18 0.80 0.08 0.00 -0.42 0.00 0.00 57.16 57.43 1i76 n GLU 223 Cb 0.58 -2.53 -0.10 0.00 -0.57 0.00 0.00 31.44 28.82 1i76 n GLU 223 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1i76 n THR 224 N 2.71 0.00 0.20 2.62 -2.24 -1.26 -4.44 114.28 111.88 1i76 n THR 224 Ca 0.14 -0.12 0.05 0.00 -2.27 0.00 0.00 64.05 61.85 1i76 n THR 224 Cb 0.31 0.96 0.41 0.00 -2.10 0.00 0.00 70.33 69.91 1i76 n THR 224 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1i76 h SER 225 N 0.00 0.00 -0.54 3.42 4.64 -2.00 -3.06 113.55 116.01 1i76 h SER 225 Ca 0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 1i76 h SER 225 Cb 0.41 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.10 1i76 h SER 225 CO 0.00 0.34 -1.12 0.59 -0.87 0.00 0.00 176.83 175.77 1i76 n ASN 226 N -3.81 1.69 -4.78 4.97 3.02 -1.26 -5.12 115.26 109.97 1i76 n ASN 226 Ca -0.01 -2.20 -0.37 0.00 -0.03 0.00 0.00 54.58 51.96 1i76 n ASN 226 Cb 0.42 -0.48 -0.04 0.00 -0.61 0.00 0.00 39.78 39.06 1i76 n ASN 226 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1i76 s TYR 227 N -3.69 3.37 0.03 3.10 5.04 -1.16 -5.04 117.35 119.00 1i76 s TYR 227 Ca 0.28 1.67 -0.02 0.00 -2.44 0.00 0.00 57.07 56.56 1i76 s TYR 227 Cb 0.35 -3.13 -0.02 0.00 0.35 0.00 0.00 41.96 39.50 1i76 s TYR 227 CO -0.03 -0.51 0.02 -1.54 -1.34 0.00 0.00 175.55 172.15 1i76 s SER 228 N -1.45 0.28 0.13 4.32 1.04 -1.26 -5.00 113.70 111.77 1i76 s SER 228 Ca 0.54 -0.63 -0.35 0.00 0.48 0.00 0.00 55.95 56.00 1i76 s SER 228 Cb -0.23 0.17 -0.15 0.00 0.10 0.00 0.00 66.02 65.91 1i76 s SER 228 CO 0.30 -0.45 1.46 -0.11 0.98 0.00 0.00 173.24 175.42 1i76 n LEU 229 N 0.94 2.45 -4.65 2.42 7.94 -1.26 -4.95 117.00 119.89 1i76 n LEU 229 Ca -0.20 1.10 -0.35 0.00 -1.11 0.00 0.00 56.01 55.45 1i76 n LEU 229 Cb 0.58 -1.32 0.10 0.00 0.53 0.00 0.00 43.42 43.30 1i76 n LEU 229 CO 0.23 -0.64 0.66 -2.65 -1.11 0.00 0.00 177.39 173.88 1i76 n PRO 230 N 2.95 0.48 -0.26 1.96 -0.02 -1.26 -4.75 135.00 134.10 1i76 n PRO 230 Ca 0.17 0.23 0.08 0.00 -2.02 0.00 0.00 63.50 61.96 1i76 n PRO 230 Cb 0.25 -2.34 0.32 0.00 -0.02 0.00 0.00 33.50 31.71 1i76 n PRO 230 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1i76 h GLN 231 N -0.37 0.80 -0.42 -0.52 5.75 -1.92 -1.52 115.11 116.91 1i76 h GLN 231 Ca -0.47 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 57.95 1i76 h GLN 231 Cb 1.32 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 29.67 1i76 h GLN 231 CO 0.47 0.53 0.15 0.22 -2.65 0.00 0.00 178.83 177.55 1i76 h ASP 232 N 0.83 0.55 0.67 -0.69 3.58 -1.92 -0.89 116.42 118.55 1i76 h ASP 232 Ca 0.40 -0.07 -0.22 0.00 0.42 0.00 0.00 57.03 57.57 1i76 h ASP 232 Cb 0.43 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.32 1i76 h ASP 232 CO -0.16 0.52 -0.98 0.44 -2.88 0.00 0.00 179.24 176.18 1i76 h ASP 233 N 0.60 0.24 -0.18 2.28 3.32 -1.65 -1.43 116.42 119.61 1i76 h ASP 233 Ca 0.15 -0.22 0.01 0.00 0.02 0.00 0.00 57.03 56.99 1i76 h ASP 233 Cb 0.16 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1i76 h ASP 233 CO -0.01 1.08 0.08 0.40 -1.72 0.00 0.00 179.24 179.07 1i76 h ILE 234 N 0.08 0.98 -0.91 0.35 2.04 -1.06 -0.38 117.51 118.61 1i76 h ILE 234 Ca -0.06 -0.06 0.07 0.00 1.00 0.00 0.00 64.86 65.81 1i76 h ILE 234 Cb 1.65 0.79 -0.07 0.00 -0.74 0.00 0.00 36.82 38.46 1i76 h ILE 234 CO 0.15 0.03 0.57 0.44 0.00 0.00 0.00 178.15 179.34 1i76 h ASP 235 N 0.18 0.90 -0.18 1.72 3.32 -0.95 -1.06 116.42 120.34 1i76 h ASP 235 Ca 0.07 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 1i76 h ASP 235 Cb 0.03 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.40 1i76 h ASP 235 CO -0.06 0.56 -0.12 1.23 -1.72 0.00 0.00 179.24 179.13 1i76 h GLY 236 N 1.03 0.43 1.69 2.75 0.00 -0.77 -1.33 103.07 106.87 1i76 h GLY 236 Ca 0.40 -0.41 -0.12 0.00 0.00 0.00 0.00 47.33 47.20 1i76 h GLY 236 CO -0.18 0.37 -0.44 1.19 0.00 0.00 0.00 176.54 177.48 1i76 h ILE 237 N 0.07 1.32 -0.55 2.60 2.10 -0.88 -2.80 117.51 119.37 1i76 h ILE 237 Ca 0.04 -1.62 -0.07 0.00 1.08 0.00 0.00 64.86 64.28 1i76 h ILE 237 Cb 0.63 1.70 -0.02 0.00 -1.09 0.00 0.00 36.82 38.04 1i76 h ILE 237 CO 0.03 0.49 0.05 1.56 -1.08 0.00 0.00 178.15 179.21 1i76 h GLN 238 N 0.28 0.90 -0.10 2.19 1.08 -1.14 -0.54 115.11 117.78 1i76 h GLN 238 Ca 0.02 -0.23 -0.02 0.00 -1.45 0.00 0.00 58.65 56.97 1i76 h GLN 238 Cb 0.90 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 28.21 1i76 h GLN 238 CO 0.07 0.86 -0.03 0.00 -0.95 0.00 0.00 178.83 178.79 1i76 h ALA 239 N 1.20 1.77 0.00 3.87 0.00 -0.97 0.36 119.26 125.50 1i76 h ALA 239 Ca 0.17 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 1i76 h ALA 239 Cb 0.43 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1i76 h ALA 239 CO 0.01 0.17 -0.94 0.82 0.00 0.00 0.00 179.25 179.32 1i76 h ILE 240 N 0.14 0.94 -0.01 0.00 2.04 -1.32 -3.43 117.51 115.87 1i76 h ILE 240 Ca 0.03 -2.05 0.00 0.00 1.00 0.00 0.00 64.86 63.84 1i76 h ILE 240 Cb 0.15 2.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.35 1i76 h ILE 240 CO 0.01 0.32 -0.22 -1.22 0.00 0.00 0.00 178.15 177.03 1i76 n TYR 241 N -4.49 0.00 -0.66 1.37 4.01 -0.25 -5.10 117.16 112.04 1i76 n TYR 241 Ca -0.25 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.49 1i76 n TYR 241 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.62 1i76 n TYR 241 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81