#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3nse n PRO 68 N 0.00 2.24 0.00 1.61 -0.02 -1.26 -4.91 135.00 132.66 3nse n PRO 68 Ca 0.00 0.79 0.06 0.00 -2.02 0.00 0.00 63.50 62.33 3nse n PRO 68 Cb 0.00 -2.40 0.37 0.00 -0.02 0.00 0.00 33.50 31.45 3nse n PRO 68 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3nse n LYS 69 N 0.63 0.40 -3.44 -0.52 4.81 -1.26 -4.80 118.16 113.98 3nse n LYS 69 Ca 0.04 0.00 -0.19 0.00 -0.87 0.00 0.00 58.31 57.30 3nse n LYS 69 Cb 0.36 -1.49 -0.01 0.00 0.02 0.00 0.00 35.03 33.92 3nse n LYS 69 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 3nse s PHE 70 N -2.00 3.06 0.18 5.64 0.08 -1.26 -5.04 117.98 118.64 3nse s PHE 70 Ca 0.19 -0.25 -0.33 0.00 0.12 0.00 0.00 56.93 56.66 3nse s PHE 70 Cb 0.09 -2.02 -0.14 0.00 -0.57 0.00 0.00 43.02 40.37 3nse s PHE 70 CO 0.15 -0.04 1.53 -2.30 -0.10 0.00 0.00 175.22 174.45 3nse n PRO 71 N -1.64 2.09 -3.42 0.24 -0.02 -1.26 -4.79 135.00 126.20 3nse n PRO 71 Ca 0.01 0.75 -0.38 0.00 -2.02 0.00 0.00 63.50 61.86 3nse n PRO 71 Cb 0.58 -2.49 -0.08 0.00 -0.02 0.00 0.00 33.50 31.49 3nse n PRO 71 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3nse s ARG 72 N 0.59 4.17 -0.10 -0.52 3.52 -1.26 -1.86 118.95 123.49 3nse s ARG 72 Ca 0.76 0.16 0.04 0.00 -0.13 0.00 0.00 55.73 56.56 3nse s ARG 72 Cb -0.68 -3.53 -0.00 0.00 -1.56 0.00 0.00 34.95 29.18 3nse s ARG 72 CO 0.41 -0.00 -0.22 0.08 -0.81 0.00 0.00 175.30 174.75 3nse s VAL 73 N 1.21 2.22 0.09 7.11 1.01 0.68 -4.98 120.40 127.73 3nse s VAL 73 Ca 0.18 -0.97 0.09 0.00 0.00 0.00 0.00 61.98 61.28 3nse s VAL 73 Cb -0.14 -1.86 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 3nse s VAL 73 CO 0.07 0.56 -0.22 -0.75 0.00 0.00 0.00 175.10 174.76 3nse s LYS 74 N 0.28 1.74 -0.30 2.72 2.20 -1.26 -1.07 119.74 124.05 3nse s LYS 74 Ca -0.16 -1.17 -0.06 0.00 -0.36 0.00 0.00 55.97 54.21 3nse s LYS 74 Cb -0.17 -2.04 0.01 0.00 -1.51 0.00 0.00 37.83 34.12 3nse s LYS 74 CO 0.08 0.49 0.07 1.21 -0.36 0.00 0.00 175.35 176.84 3nse s ASN 75 N -1.79 5.08 0.42 1.43 3.84 -0.52 -1.63 114.94 121.76 3nse s ASN 75 Ca 0.15 -0.79 0.28 0.00 0.21 0.00 0.00 52.86 52.71 3nse s ASN 75 Cb -0.10 -1.86 0.99 0.00 -0.55 0.00 0.00 41.25 39.73 3nse s ASN 75 CO 0.06 -0.20 1.82 -0.50 -2.79 0.00 0.00 177.10 175.49 3nse h TRP 76 N 8.21 0.00 0.13 0.43 4.06 -1.26 0.19 115.95 127.72 3nse h TRP 76 Ca -0.30 0.00 -0.30 0.00 2.06 0.00 0.00 58.89 60.34 3nse h TRP 76 Cb 1.12 0.00 0.03 0.00 -1.00 0.00 0.00 29.16 29.31 3nse h TRP 76 CO 0.61 0.00 -1.27 1.49 -3.56 0.00 0.00 178.44 175.71 3nse h GLU 77 N 0.00 0.60 0.00 0.49 4.81 -1.94 -3.36 114.58 115.18 3nse h GLU 77 Ca 0.00 -0.83 -0.14 0.00 -0.13 0.00 0.00 59.36 58.26 3nse h GLU 77 Cb 0.61 0.28 -0.03 0.00 0.63 0.00 0.00 28.75 30.24 3nse h GLU 77 CO 0.00 1.38 -2.13 1.28 -0.73 0.00 0.00 179.01 178.81 3nse n LEU 78 N -3.77 0.02 0.00 1.64 4.77 -1.21 -5.00 117.00 113.45 3nse n LEU 78 Ca -0.14 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 3nse n LEU 78 Cb 1.00 0.19 0.00 0.00 -2.33 0.00 0.00 43.42 42.28 3nse n LEU 78 CO 0.58 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 3nse n GLY 79 N 1.45 0.75 3.83 -0.72 0.00 0.67 -5.05 105.19 106.12 3nse n GLY 79 Ca -0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 3nse n GLY 79 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3nse s SER 80 N -2.51 6.66 0.10 1.61 1.04 -1.20 -4.84 113.70 114.56 3nse s SER 80 Ca 0.00 1.66 0.10 0.00 0.48 0.00 0.00 55.95 58.19 3nse s SER 80 Cb 0.00 -2.53 -0.04 0.00 0.10 0.00 0.00 66.02 63.56 3nse s SER 80 CO 0.00 -0.56 -0.25 -0.63 0.98 0.00 0.00 173.24 172.78 3nse s ILE 81 N -2.39 2.09 0.05 -1.02 -1.09 -1.26 -1.43 121.20 116.14 3nse s ILE 81 Ca 0.61 -1.59 -0.11 0.00 -2.23 0.00 0.00 60.65 57.33 3nse s ILE 81 Cb -0.11 -1.84 0.01 0.00 -1.58 0.00 0.00 42.46 38.95 3nse s ILE 81 CO 0.24 0.14 0.24 0.42 -1.23 0.00 0.00 174.94 174.74 3nse s THR 82 N -0.99 0.10 -0.06 2.92 -4.23 -0.23 -4.99 115.64 108.15 3nse s THR 82 Ca 0.12 -0.83 0.04 0.00 -1.18 0.00 0.00 61.69 59.84 3nse s THR 82 Cb -0.10 -0.95 -0.02 0.00 1.34 0.00 0.00 72.50 72.77 3nse s THR 82 CO 0.04 -0.46 -0.19 -0.31 -0.54 0.00 0.00 174.62 173.17 3nse s TYR 83 N -2.67 2.59 -0.50 3.99 1.51 -1.26 -0.23 117.35 120.77 3nse s TYR 83 Ca -0.04 -0.45 -0.18 0.00 -1.01 0.00 0.00 57.07 55.39 3nse s TYR 83 Cb -0.01 -1.64 0.07 0.00 -0.11 0.00 0.00 41.96 40.28 3nse s TYR 83 CO -0.04 -0.04 0.54 0.34 -1.11 0.00 0.00 175.55 175.24 3nse s ASP 84 N -0.36 6.19 0.05 2.29 -1.08 -0.78 -4.66 116.67 118.32 3nse s ASP 84 Ca 0.03 -1.15 0.22 0.00 -0.52 0.00 0.00 52.55 51.13 3nse s ASP 84 Cb -0.12 -2.25 -0.20 0.00 -1.46 0.00 0.00 42.92 38.89 3nse s ASP 84 CO 0.02 -0.81 0.71 0.35 0.52 0.00 0.00 175.17 175.96 3nse n THR 85 N 5.44 0.19 0.19 1.71 -2.24 -0.45 -4.08 114.28 115.05 3nse n THR 85 Ca -0.09 -0.47 0.05 0.00 -2.27 0.00 0.00 64.05 61.27 3nse n THR 85 Cb 0.44 -0.03 0.50 0.00 -2.10 0.00 0.00 70.33 69.13 3nse n THR 85 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3nse h LEU 86 N 0.00 0.07 -2.82 3.22 5.85 -1.65 -2.22 115.31 117.77 3nse h LEU 86 Ca 0.00 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 3nse h LEU 86 Cb 0.95 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.96 3nse h LEU 86 CO 0.00 0.20 -0.00 0.00 -0.34 0.00 0.00 178.44 178.30 3nse h ALA 88 N 2.00 1.01 -0.02 0.00 0.00 -1.68 -2.26 119.26 118.31 3nse h ALA 88 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3nse h ALA 88 Cb 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3nse h ALA 88 CO 0.00 0.01 0.00 1.04 0.00 0.00 0.00 179.25 180.30 3nse n GLN 89 N -3.11 1.61 -2.15 0.00 1.13 0.02 -4.92 117.38 109.96 3nse n GLN 89 Ca -0.01 -0.88 -0.42 0.00 -1.94 0.00 0.00 57.00 53.75 3nse n GLN 89 Cb 0.23 -1.48 -0.03 0.00 0.11 0.00 0.00 30.24 29.07 3nse n GLN 89 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3nse s SER 90 N -1.97 6.81 0.00 1.08 0.15 -0.85 -4.91 113.70 114.01 3nse s SER 90 Ca 0.39 2.39 0.02 0.00 0.70 0.00 0.00 55.95 59.44 3nse s SER 90 Cb 0.21 -2.59 0.02 0.00 -1.71 0.00 0.00 66.02 61.95 3nse s SER 90 CO 0.33 -0.64 0.66 0.00 1.20 0.00 0.00 173.24 174.80 3nse n GLN 91 N 3.55 0.04 -4.80 5.44 1.13 -1.26 -4.99 117.38 116.49 3nse n GLN 91 Ca 0.10 -0.82 -0.30 0.00 -1.94 0.00 0.00 57.00 54.04 3nse n GLN 91 Cb 0.42 -1.04 -0.17 0.00 0.11 0.00 0.00 30.24 29.56 3nse n GLN 91 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 3nse s GLN 92 N -0.34 2.59 0.39 -1.09 2.00 -1.26 -5.12 119.66 116.83 3nse s GLN 92 Ca 0.03 -0.71 -0.25 0.00 -2.00 0.00 0.00 55.36 52.43 3nse s GLN 92 Cb 0.02 -2.06 -0.09 0.00 0.80 0.00 0.00 33.01 31.68 3nse s GLN 92 CO 0.03 0.05 1.12 -0.51 -0.50 0.00 0.00 175.29 175.48 3nse s ASP 93 N 0.66 6.64 0.25 6.67 1.11 -1.26 -4.43 116.67 126.32 3nse s ASP 93 Ca -0.13 2.23 0.01 0.00 0.18 0.00 0.00 52.55 54.84 3nse s ASP 93 Cb -0.16 -2.60 0.02 0.00 1.07 0.00 0.00 42.92 41.24 3nse s ASP 93 CO 0.03 -0.58 0.13 0.61 1.18 0.00 0.00 175.17 176.54 3nse n GLY 94 N 0.57 1.35 0.09 0.21 0.00 -1.26 -4.90 105.19 101.26 3nse n GLY 94 Ca 0.04 -2.06 0.12 0.00 0.00 0.00 0.00 46.02 44.13 3nse n GLY 94 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3nse h PRO 95 N 0.00 0.00 -7.25 1.61 0.13 -1.89 -3.48 132.00 121.12 3nse h PRO 95 Ca -0.04 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.59 3nse h PRO 95 Cb 0.18 0.00 0.04 0.00 0.13 0.00 0.00 31.00 31.35 3nse h PRO 95 CO 0.05 0.00 0.36 0.00 -0.23 0.00 0.00 178.00 178.19 3nse s THR 97 N -2.93 0.07 0.51 0.00 -4.23 -0.88 -5.02 115.64 103.15 3nse s THR 97 Ca 0.55 -1.42 0.36 0.00 -1.18 0.00 0.00 61.69 60.00 3nse s THR 97 Cb -0.11 -1.86 0.38 0.00 1.34 0.00 0.00 72.50 72.26 3nse s THR 97 CO 0.45 -0.30 2.22 -0.65 -0.54 0.00 0.00 174.62 175.80 3nse h PRO 98 N 2.56 0.00 -0.13 3.99 0.11 -2.05 -2.45 132.00 134.03 3nse h PRO 98 Ca -0.32 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.60 3nse h PRO 98 Cb 1.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 3nse h PRO 98 CO 0.49 0.03 -0.70 0.00 -0.21 0.00 0.00 178.00 177.61 3nse h ARG 99 N 0.00 0.57 -2.31 1.05 2.47 -2.02 -3.47 114.38 110.67 3nse h ARG 99 Ca -0.00 -0.44 -0.06 0.00 -1.26 0.00 0.00 59.98 58.22 3nse h ARG 99 Cb 0.16 0.08 -0.18 0.00 -1.65 0.00 0.00 29.97 28.38 3nse h ARG 99 CO 0.00 1.06 0.12 -0.98 0.56 0.00 0.00 179.97 180.73 3nse s ARG 100 N -3.76 1.03 -0.27 0.04 3.03 -0.92 -5.14 118.95 112.96 3nse s ARG 100 Ca -0.08 0.07 -0.12 0.00 2.03 0.00 0.00 55.73 57.64 3nse s ARG 100 Cb 0.10 0.48 -0.05 0.00 -1.03 0.00 0.00 34.95 34.46 3nse s ARG 100 CO 0.86 -0.34 0.24 0.00 -1.13 0.00 0.00 175.30 174.93 3nse n LEU 102 N 4.99 4.69 0.14 0.00 4.32 -1.26 -4.75 117.00 125.12 3nse n LEU 102 Ca -0.13 -4.09 0.13 0.00 -0.02 0.00 0.00 56.01 51.90 3nse n LEU 102 Cb 0.52 -0.60 0.44 0.00 -1.62 0.00 0.00 43.42 42.15 3nse n LEU 102 CO 0.35 1.51 0.88 1.23 -1.22 0.00 0.00 177.39 180.13 3nse h GLY 103 N 1.40 0.00 -0.27 -0.72 0.00 -1.93 -3.16 103.07 98.39 3nse h GLY 103 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.63 3nse h GLY 103 CO 0.60 0.00 -0.13 -1.14 0.00 0.00 0.00 176.54 175.88 3nse n SER 104 N -2.39 1.41 -4.72 0.19 3.41 -1.26 -4.88 113.62 105.38 3nse n SER 104 Ca 0.04 -1.27 -0.42 0.00 -0.26 0.00 0.00 58.87 56.96 3nse n SER 104 Cb 0.35 0.07 -0.03 0.00 -0.26 0.00 0.00 64.21 64.35 3nse n SER 104 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3nse s LEU 105 N -2.23 4.39 -0.02 1.04 1.43 -1.19 -4.97 118.68 117.14 3nse s LEU 105 Ca 0.31 1.89 -0.20 0.00 -1.03 0.00 0.00 54.13 55.10 3nse s LEU 105 Cb 0.20 -3.58 -0.12 0.00 0.03 0.00 0.00 46.19 42.72 3nse s LEU 105 CO 0.42 -0.34 0.85 0.58 0.23 0.00 0.00 176.35 178.09 3nse h VAL 106 N 4.47 0.14 -2.91 -1.59 2.07 -1.92 -3.37 116.25 113.14 3nse h VAL 106 Ca -0.42 -0.56 -0.72 0.00 0.82 0.00 0.00 66.70 65.82 3nse h VAL 106 Cb 1.22 0.22 -0.34 0.00 -1.52 0.00 0.00 31.29 30.87 3nse h VAL 106 CO 0.77 0.03 0.12 0.18 0.02 0.00 0.00 177.57 178.69 3nse n LEU 107 N -5.20 4.94 -4.85 2.57 4.77 -1.26 -4.99 117.00 112.99 3nse n LEU 107 Ca -0.09 -5.24 -0.32 0.00 -0.03 0.00 0.00 56.01 50.34 3nse n LEU 107 Cb 0.27 -1.08 -0.03 0.00 -2.33 0.00 0.00 43.42 40.25 3nse n LEU 107 CO 0.22 1.72 0.65 -2.16 -1.33 0.00 0.00 177.39 176.49 3nse s PRO 108 N -2.14 3.93 0.00 3.23 0.04 -1.26 -4.86 135.00 133.94 3nse s PRO 108 Ca 0.32 0.90 0.05 0.00 0.04 0.00 0.00 61.00 62.31 3nse s PRO 108 Cb 0.02 -2.17 0.23 0.00 0.04 0.00 0.00 34.50 32.63 3nse s PRO 108 CO -0.02 -0.24 0.97 0.54 0.04 0.00 0.00 177.00 178.29 3nse n ARG 109 N -1.54 0.07 0.16 4.56 1.74 -1.26 -1.58 116.66 118.81 3nse n ARG 109 Ca 0.06 0.23 0.12 0.00 -0.77 0.00 0.00 57.85 57.49 3nse n ARG 109 Cb 0.54 -1.50 0.14 0.00 -1.02 0.00 0.00 32.46 30.62 3nse n ARG 109 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 3nse h LYS 110 N 0.00 0.00 -0.33 5.56 1.79 -1.92 -3.32 116.57 118.35 3nse h LYS 110 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3nse h LYS 110 Cb 0.04 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.69 3nse h LYS 110 CO 0.00 0.00 0.00 -0.11 -1.08 0.00 0.00 179.45 178.26 3nse n LEU 111 N -2.79 3.24 -4.60 2.94 7.94 -0.61 -4.86 117.00 118.26 3nse n LEU 111 Ca 0.03 -1.48 -0.31 0.00 -1.11 0.00 0.00 56.01 53.13 3nse n LEU 111 Cb 0.52 -0.21 -0.10 0.00 0.53 0.00 0.00 43.42 44.16 3nse n LEU 111 CO 0.36 0.70 -0.39 -1.58 -1.11 0.00 0.00 177.39 175.37 3nse s GLN 112 N -1.39 2.43 -0.45 1.96 0.74 -1.24 -2.54 119.66 119.17 3nse s GLN 112 Ca 0.34 -0.82 0.03 0.00 0.05 0.00 0.00 55.36 54.96 3nse s GLN 112 Cb 0.20 -2.45 0.12 0.00 1.10 0.00 0.00 33.01 31.98 3nse s GLN 112 CO 0.28 0.57 0.19 0.95 -0.55 0.00 0.00 175.29 176.72 3nse s THR 113 N -1.11 2.58 0.64 -0.34 -4.23 -0.53 -4.93 115.64 107.72 3nse s THR 113 Ca 0.20 -2.86 -0.17 0.00 -1.18 0.00 0.00 61.69 57.68 3nse s THR 113 Cb -0.11 -2.82 -0.06 0.00 1.34 0.00 0.00 72.50 70.84 3nse s THR 113 CO 0.11 -0.72 0.57 -1.14 -0.54 0.00 0.00 174.62 172.89 3nse n ARG 114 N 3.65 0.45 -1.05 3.99 3.00 -1.26 -4.50 116.66 120.94 3nse n ARG 114 Ca 0.04 0.19 -0.29 0.00 -0.00 0.00 0.00 57.85 57.80 3nse n ARG 114 Cb 0.37 -1.80 0.20 0.00 0.00 0.00 0.00 32.46 31.22 3nse n ARG 114 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 3nse s PRO 115 N -2.46 -0.04 -0.12 -0.14 0.04 -1.26 -5.00 135.00 126.02 3nse s PRO 115 Ca 0.68 0.50 0.01 0.00 0.04 0.00 0.00 61.00 62.23 3nse s PRO 115 Cb -0.40 -1.68 0.02 0.00 0.04 0.00 0.00 34.50 32.48 3nse s PRO 115 CO 0.55 -3.04 -0.15 -1.54 0.04 0.00 0.00 177.00 172.86 3nse s SER 116 N -3.32 2.50 -0.01 6.66 1.04 -1.26 -4.96 113.70 114.35 3nse s SER 116 Ca 0.66 -0.44 0.15 0.00 0.48 0.00 0.00 55.95 56.80 3nse s SER 116 Cb -0.19 -1.11 0.43 0.00 0.10 0.00 0.00 66.02 65.25 3nse s SER 116 CO 0.59 -0.01 1.35 -0.81 0.98 0.00 0.00 173.24 175.34 3nse n PRO 117 N 4.37 2.18 -3.66 4.02 -0.04 -1.26 -4.86 135.00 135.76 3nse n PRO 117 Ca -0.18 -1.75 -0.14 0.00 -0.04 0.00 0.00 63.50 61.38 3nse n PRO 117 Cb 0.51 -1.40 -0.08 0.00 -0.04 0.00 0.00 33.50 32.48 3nse n PRO 117 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3nse s GLY 118 N -0.98 -0.42 0.86 0.55 0.00 -1.26 -4.96 107.32 101.12 3nse s GLY 118 Ca 0.32 1.38 -0.12 0.00 0.00 0.00 0.00 44.72 46.30 3nse s GLY 118 CO 0.21 1.13 1.18 2.56 0.00 0.00 0.00 173.10 178.19 3nse s PRO 119 N -0.20 1.29 0.21 2.90 0.04 -1.26 -4.94 135.00 133.04 3nse s PRO 119 Ca -0.04 1.68 -0.30 0.00 0.04 0.00 0.00 61.00 62.38 3nse s PRO 119 Cb -0.03 -1.75 -0.09 0.00 0.04 0.00 0.00 34.50 32.67 3nse s PRO 119 CO 0.03 -2.45 1.33 -1.25 0.04 0.00 0.00 177.00 174.69 3nse s PRO 120 N -4.38 4.37 -0.19 0.56 0.04 -1.26 -4.90 135.00 129.24 3nse s PRO 120 Ca 0.70 2.09 -0.39 0.00 0.04 0.00 0.00 61.00 63.44 3nse s PRO 120 Cb -0.26 -3.18 -0.16 0.00 0.04 0.00 0.00 34.50 30.94 3nse s PRO 120 CO 0.54 -0.27 1.65 -0.35 0.04 0.00 0.00 177.00 178.61 3nse n PRO 121 N 2.53 1.16 0.05 0.56 -0.04 -1.26 -4.72 135.00 133.27 3nse n PRO 121 Ca 0.06 0.42 0.01 0.00 -0.04 0.00 0.00 63.50 63.95 3nse n PRO 121 Cb 0.42 -2.10 0.04 0.00 -0.04 0.00 0.00 33.50 31.83 3nse n PRO 121 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3nse n ALA 122 N 4.73 0.24 -0.13 0.55 0.00 -1.26 -1.18 120.51 123.46 3nse n ALA 122 Ca 0.25 0.01 -0.18 0.00 0.00 0.00 0.00 53.44 53.52 3nse n ALA 122 Cb 0.14 -0.26 -0.12 0.00 0.00 0.00 0.00 19.45 19.22 3nse n ALA 122 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3nse n GLU 123 N -1.34 0.64 -0.08 0.00 4.71 -1.26 -3.17 120.64 120.15 3nse n GLU 123 Ca -0.00 0.15 -0.09 0.00 -0.01 0.00 0.00 57.16 57.21 3nse n GLU 123 Cb 0.44 -1.52 0.07 0.00 -1.01 0.00 0.00 31.44 29.42 3nse n GLU 123 CO 0.00 0.00 0.00 0.37 0.09 0.00 0.00 177.13 177.59 3nse h GLN 124 N -0.02 0.76 -0.27 3.49 4.15 -1.51 -1.57 115.11 120.16 3nse h GLN 124 Ca -0.58 -0.34 -0.13 0.00 0.77 0.00 0.00 58.65 58.37 3nse h GLN 124 Cb 1.89 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 29.55 3nse h GLN 124 CO -0.09 0.96 -0.38 1.25 -1.93 0.00 0.00 178.83 178.64 3nse h LEU 125 N 0.65 0.65 -0.06 -2.39 7.12 -1.62 -2.55 115.31 117.12 3nse h LEU 125 Ca 0.08 -0.28 -0.02 0.00 0.13 0.00 0.00 57.88 57.79 3nse h LEU 125 Cb 0.82 -0.18 -0.00 0.00 -0.53 0.00 0.00 40.66 40.77 3nse h LEU 125 CO 0.07 0.96 -0.03 0.25 -0.13 0.00 0.00 178.44 179.56 3nse h LEU 126 N 0.51 0.13 -1.21 2.25 7.12 -1.47 0.31 115.31 122.95 3nse h LEU 126 Ca 0.05 -0.42 0.03 0.00 0.13 0.00 0.00 57.88 57.67 3nse h LEU 126 Cb 0.89 -0.04 -0.05 0.00 -0.53 0.00 0.00 40.66 40.94 3nse h LEU 126 CO 0.08 0.52 0.54 0.77 -0.13 0.00 0.00 178.44 180.22 3nse h SER 127 N -0.26 0.89 -0.26 1.25 4.64 -1.28 0.31 113.55 118.84 3nse h SER 127 Ca 0.01 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 3nse h SER 127 Cb 0.47 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 3nse h SER 127 CO 0.01 0.62 -0.11 1.56 -0.87 0.00 0.00 176.83 178.04 3nse h GLN 128 N 1.04 0.53 -0.52 4.77 4.20 -1.37 -1.60 115.11 122.16 3nse h GLN 128 Ca 0.32 -0.23 -0.05 0.00 0.06 0.00 0.00 58.65 58.76 3nse h GLN 128 Cb -0.01 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 3nse h GLN 128 CO -0.09 0.78 0.14 0.00 -0.67 0.00 0.00 178.83 178.99 3nse h ALA 129 N 0.74 0.68 -0.71 3.87 0.00 -0.23 -1.69 119.26 121.91 3nse h ALA 129 Ca 0.06 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3nse h ALA 129 Cb 0.61 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 3nse h ALA 129 CO 0.04 0.36 0.41 0.00 0.00 0.00 0.00 179.25 180.05 3nse h ARG 130 N 0.71 0.97 -0.58 0.00 3.08 -0.37 -1.77 114.38 116.42 3nse h ARG 130 Ca 0.16 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 3nse h ARG 130 Cb 0.31 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 3nse h ARG 130 CO -0.00 0.71 0.18 0.22 -1.07 0.00 0.00 179.97 180.01 3nse h ASP 131 N 0.97 0.85 -0.46 7.04 3.58 -1.03 -1.91 116.42 125.46 3nse h ASP 131 Ca 0.25 -0.21 -0.04 0.00 0.42 0.00 0.00 57.03 57.45 3nse h ASP 131 Cb 0.00 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 40.81 3nse h ASP 131 CO -0.04 0.83 0.12 0.15 -2.88 0.00 0.00 179.24 177.41 3nse h PHE 132 N 0.82 0.77 -0.54 0.28 3.57 -1.01 -2.05 116.94 118.79 3nse h PHE 132 Ca 0.19 -0.09 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 3nse h PHE 132 Cb 0.29 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 3nse h PHE 132 CO 0.02 0.70 0.25 0.82 -2.23 0.00 0.00 178.31 177.87 3nse h ILE 133 N 0.61 1.18 -0.39 1.41 1.08 -1.12 0.43 117.51 120.71 3nse h ILE 133 Ca 0.14 -0.52 -0.11 0.00 -0.39 0.00 0.00 64.86 63.98 3nse h ILE 133 Cb 0.32 0.51 -0.01 0.00 -3.07 0.00 0.00 36.82 34.56 3nse h ILE 133 CO 0.00 0.21 -0.20 0.78 -0.69 0.00 0.00 178.15 178.25 3nse h ASN 134 N 0.75 0.76 -0.37 1.72 4.21 -1.16 0.21 115.58 121.70 3nse h ASN 134 Ca 0.19 -0.26 -0.06 0.00 1.21 0.00 0.00 56.30 57.38 3nse h ASN 134 Cb 0.09 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 37.07 3nse h ASN 134 CO -0.02 0.95 0.02 1.56 -1.29 0.00 0.00 177.43 178.65 3nse h GLN 135 N 0.67 0.65 0.10 0.81 4.20 -0.54 -1.10 115.11 119.89 3nse h GLN 135 Ca 0.10 -0.20 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 3nse h GLN 135 Cb 0.70 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.42 3nse h GLN 135 CO 0.05 0.74 -0.05 -0.92 -0.67 0.00 0.00 178.83 177.98 3nse h TYR 136 N 0.47 -0.13 0.00 2.96 3.20 -0.64 -1.71 116.97 121.13 3nse h TYR 136 Ca 0.11 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.93 3nse h TYR 136 Cb 0.44 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 3nse h TYR 136 CO 0.03 -0.04 -0.19 1.88 -1.64 0.00 0.00 178.16 178.20 3nse h TYR 137 N -0.18 0.00 -0.04 -3.82 0.05 -0.91 -2.18 116.97 109.88 3nse h TYR 137 Ca -0.01 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.60 3nse h TYR 137 Cb 0.14 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.87 3nse h TYR 137 CO -0.06 0.19 -0.73 0.77 -1.05 0.00 0.00 178.16 177.29 3nse h SER 138 N 0.00 0.29 0.57 3.88 0.02 -0.92 0.11 113.55 117.50 3nse h SER 138 Ca -0.00 -0.20 -0.07 0.00 -0.84 0.00 0.00 61.79 60.68 3nse h SER 138 Cb 0.38 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 3nse h SER 138 CO 0.03 0.92 -0.32 0.77 -1.14 0.00 0.00 176.83 177.09 3nse h SER 139 N 0.16 0.00 -0.19 3.07 4.64 -0.68 -2.20 113.55 118.35 3nse h SER 139 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3nse h SER 139 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3nse h SER 139 CO 0.11 0.32 0.00 2.30 -0.87 0.00 0.00 176.83 178.69 3nse n ILE 140 N -3.75 0.22 -3.19 0.95 -5.35 -1.06 -4.98 119.36 102.20 3nse n ILE 140 Ca -0.01 -0.59 -0.16 0.00 -0.27 0.00 0.00 62.75 61.71 3nse n ILE 140 Cb 0.41 1.20 0.05 0.00 -1.74 0.00 0.00 39.64 39.57 3nse n ILE 140 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 3nse n LYS 141 N 1.34 -5.22 -2.17 6.28 4.76 -0.70 -4.96 118.16 117.50 3nse n LYS 141 Ca 0.17 0.58 -0.12 0.00 -2.87 0.00 0.00 58.31 56.06 3nse n LYS 141 Cb 0.59 -4.85 0.04 0.00 -1.84 0.00 0.00 35.03 28.97 3nse n LYS 141 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3nse n ARG 142 N -3.53 2.67 -2.36 1.97 5.12 0.29 -5.02 116.66 115.80 3nse n ARG 142 Ca -0.01 -3.79 -0.42 0.00 -1.93 0.00 0.00 57.85 51.71 3nse n ARG 142 Cb 0.55 -1.90 -0.03 0.00 -1.16 0.00 0.00 32.46 29.92 3nse n ARG 142 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3nse s SER 143 N -3.57 6.98 0.00 0.55 0.15 -1.23 -2.72 113.70 113.86 3nse s SER 143 Ca 0.41 1.97 0.00 0.00 0.70 0.00 0.00 55.95 59.03 3nse s SER 143 Cb 0.38 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 62.12 3nse s SER 143 CO -0.00 -0.62 0.00 0.61 1.20 0.00 0.00 173.24 174.43 3nse n GLY 144 N 3.45 1.26 3.48 9.45 0.00 -1.26 -5.05 105.19 116.51 3nse n GLY 144 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 3nse n GLY 144 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3nse s SER 145 N -2.63 0.35 0.20 1.61 1.04 -1.10 -4.78 113.70 108.39 3nse s SER 145 Ca 0.00 0.88 -0.02 0.00 0.48 0.00 0.00 55.95 57.30 3nse s SER 145 Cb 0.00 -1.29 0.14 0.00 0.10 0.00 0.00 66.02 64.97 3nse s SER 145 CO 0.00 -4.50 1.51 0.06 0.98 0.00 0.00 173.24 171.29 3nse h GLN 146 N -2.83 0.50 -0.39 4.02 -0.00 -1.97 -1.84 115.11 112.59 3nse h GLN 146 Ca -0.48 -0.32 -0.10 0.00 -0.00 0.00 0.00 58.65 57.76 3nse h GLN 146 Cb 1.32 0.04 -0.02 0.00 -0.00 0.00 0.00 27.48 28.82 3nse h GLN 146 CO 0.37 0.92 -0.15 0.00 -0.00 0.00 0.00 178.83 179.98 3nse h ALA 147 N 1.01 1.01 -0.02 0.06 0.00 -1.92 -0.18 119.26 119.22 3nse h ALA 147 Ca 0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.59 3nse h ALA 147 Cb 1.10 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 3nse h ALA 147 CO 0.10 0.59 -0.00 1.25 0.00 0.00 0.00 179.25 181.19 3nse h HIS 148 N 0.65 0.03 -0.34 0.00 6.17 -1.74 -1.92 115.15 118.01 3nse h HIS 148 Ca 0.11 -0.01 -0.07 0.00 0.71 0.00 0.00 60.37 61.11 3nse h HIS 148 Cb 0.62 -0.01 -0.02 0.00 2.52 0.00 0.00 27.41 30.52 3nse h HIS 148 CO 0.03 0.39 -0.08 0.93 0.71 0.00 0.00 177.93 179.91 3nse h GLU 149 N -0.34 0.56 -0.35 5.26 4.39 -1.21 -2.07 114.58 120.82 3nse h GLU 149 Ca 0.00 -0.15 -0.16 0.00 0.34 0.00 0.00 59.36 59.39 3nse h GLU 149 Cb 0.38 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.97 3nse h GLU 149 CO 0.00 0.65 -0.40 0.93 -1.16 0.00 0.00 179.01 179.02 3nse h GLU 150 N 0.52 0.89 -0.67 2.33 5.08 -1.03 -2.53 114.58 119.17 3nse h GLU 150 Ca 0.10 -0.49 -0.07 0.00 -1.00 0.00 0.00 59.36 57.90 3nse h GLU 150 Cb 0.46 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 3nse h GLU 150 CO 0.02 1.13 0.14 -0.09 -1.00 0.00 0.00 179.01 179.21 3nse h ARG 151 N 0.68 1.10 -0.51 2.33 9.65 -1.10 0.05 114.38 126.58 3nse h ARG 151 Ca 0.05 -0.28 -0.01 0.00 -1.10 0.00 0.00 59.98 58.63 3nse h ARG 151 Cb 1.00 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 29.42 3nse h ARG 151 CO 0.10 0.99 0.27 -0.07 2.80 0.00 0.00 179.97 184.06 3nse h LEU 152 N 1.02 0.65 -0.90 3.80 3.38 -1.34 -0.30 115.31 121.62 3nse h LEU 152 Ca 0.21 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 3nse h LEU 152 Cb 0.41 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 3nse h LEU 152 CO 0.01 0.57 0.35 1.56 0.09 0.00 0.00 178.44 181.01 3nse h GLN 153 N 0.68 1.14 -0.33 1.13 4.20 -1.12 -1.88 115.11 118.94 3nse h GLN 153 Ca 0.18 -0.18 -0.09 0.00 0.06 0.00 0.00 58.65 58.62 3nse h GLN 153 Cb 0.07 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 3nse h GLN 153 CO -0.03 0.90 -0.17 1.49 -0.67 0.00 0.00 178.83 180.35 3nse h GLU 154 N 1.13 0.59 -0.12 1.46 4.81 -0.52 -1.64 114.58 120.29 3nse h GLU 154 Ca 0.27 -0.20 -0.08 0.00 -0.13 0.00 0.00 59.36 59.21 3nse h GLU 154 Cb 0.16 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.49 3nse h GLU 154 CO -0.03 0.74 -0.25 0.28 -0.73 0.00 0.00 179.01 179.02 3nse h VAL 155 N 0.53 1.38 0.00 0.32 2.07 -0.61 -1.95 116.25 117.98 3nse h VAL 155 Ca 0.09 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 66.09 3nse h VAL 155 Cb 0.60 2.06 0.00 0.00 -1.52 0.00 0.00 31.29 32.43 3nse h VAL 155 CO 0.04 0.45 0.00 -1.84 0.02 0.00 0.00 177.57 176.24 3nse n GLU 156 N -4.46 0.08 0.10 1.57 0.28 -0.75 -1.04 120.64 116.42 3nse n GLU 156 Ca -0.07 0.22 -0.23 0.00 -0.16 0.00 0.00 57.16 56.93 3nse n GLU 156 Cb 0.44 -1.62 -0.15 0.00 1.43 0.00 0.00 31.44 31.53 3nse n GLU 156 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3nse h ALA 157 N 2.57 0.06 0.12 -1.84 0.00 -1.22 -1.87 119.26 117.08 3nse h ALA 157 Ca 0.00 -1.05 -0.01 0.00 0.00 0.00 0.00 54.91 53.86 3nse h ALA 157 Cb 0.40 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3nse h ALA 157 CO 0.00 0.93 -0.06 0.93 0.00 0.00 0.00 179.25 181.05 3nse h GLU 158 N 0.12 -0.15 -0.56 0.00 5.08 -0.86 -2.80 114.58 115.40 3nse h GLU 158 Ca -0.30 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.06 3nse h GLU 158 Cb 2.11 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 31.37 3nse h GLU 158 CO 0.21 0.18 0.30 0.28 -1.00 0.00 0.00 179.01 178.98 3nse h VAL 159 N -0.51 1.17 -0.52 3.13 2.07 -0.26 0.69 116.25 122.03 3nse h VAL 159 Ca -0.02 -0.44 0.08 0.00 0.82 0.00 0.00 66.70 67.14 3nse h VAL 159 Cb 0.41 0.42 -0.06 0.00 -1.52 0.00 0.00 31.29 30.53 3nse h VAL 159 CO 0.03 0.19 0.17 0.00 0.02 0.00 0.00 177.57 177.98 3nse h ALA 160 N 1.56 0.64 0.00 1.67 0.00 -1.16 0.11 119.26 122.08 3nse h ALA 160 Ca 0.20 0.08 -0.34 0.00 0.00 0.00 0.00 54.91 54.84 3nse h ALA 160 Cb 0.03 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 3nse h ALA 160 CO -0.03 -0.23 -2.34 -1.13 0.00 0.00 0.00 179.25 175.52 3nse n SER 161 N -5.03 0.03 -0.01 0.00 3.41 -1.07 -4.62 113.62 106.34 3nse n SER 161 Ca 0.06 0.02 0.09 0.00 -0.26 0.00 0.00 58.87 58.78 3nse n SER 161 Cb 0.23 1.02 -0.13 0.00 -0.26 0.00 0.00 64.21 65.06 3nse n SER 161 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3nse n THR 162 N -2.73 0.00 0.00 6.66 -2.24 0.22 -4.99 114.28 111.19 3nse n THR 162 Ca -0.31 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 3nse n THR 162 Cb 1.12 0.19 0.00 0.00 -2.10 0.00 0.00 70.33 69.54 3nse n THR 162 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3nse n GLY 163 N 1.48 1.44 1.26 3.38 0.00 0.37 -4.97 105.19 108.15 3nse n GLY 163 Ca -0.03 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 3nse n GLY 163 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3nse n THR 164 N -2.00 0.00 -4.01 2.61 5.66 -1.26 -4.84 114.28 110.44 3nse n THR 164 Ca 0.00 -0.82 -0.13 0.00 -3.05 0.00 0.00 64.05 60.05 3nse n THR 164 Cb 0.00 0.45 -0.03 0.00 -1.55 0.00 0.00 70.33 69.20 3nse n THR 164 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3nse n TYR 165 N -0.23 -1.41 -4.04 1.09 4.11 -1.26 -1.78 117.16 113.64 3nse n TYR 165 Ca 0.02 -2.14 -0.14 0.00 -0.00 0.00 0.00 57.90 55.64 3nse n TYR 165 Cb 0.23 0.52 -0.13 0.00 -0.00 0.00 0.00 39.34 39.96 3nse n TYR 165 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.86 175.85 3nse s HIS 166 N -3.08 0.36 0.42 -3.48 3.76 -1.26 -5.07 115.29 106.94 3nse s HIS 166 Ca 0.26 -0.19 -0.15 0.00 -0.15 0.00 0.00 55.06 54.83 3nse s HIS 166 Cb -0.01 -0.23 -0.08 0.00 1.11 0.00 0.00 32.58 33.37 3nse s HIS 166 CO 0.19 -0.04 0.86 -0.51 -0.85 0.00 0.00 174.74 174.39 3nse s LEU 167 N -0.50 3.85 0.54 0.89 1.43 -1.26 -5.07 118.68 118.55 3nse s LEU 167 Ca -0.03 1.41 -0.08 0.00 -1.03 0.00 0.00 54.13 54.40 3nse s LEU 167 Cb -0.04 -4.28 -0.04 0.00 0.03 0.00 0.00 46.19 41.86 3nse s LEU 167 CO -0.00 -0.40 0.89 -0.13 0.23 0.00 0.00 176.35 176.94 3nse s ARG 168 N -3.57 3.60 0.16 1.70 0.52 -1.26 -4.89 118.95 115.21 3nse s ARG 168 Ca 0.56 0.47 -0.25 0.00 -0.52 0.00 0.00 55.73 55.99 3nse s ARG 168 Cb -0.10 -2.24 0.03 0.00 0.52 0.00 0.00 34.95 33.16 3nse s ARG 168 CO 0.24 -0.35 1.58 1.49 0.02 0.00 0.00 175.30 178.28 3nse h GLU 169 N 0.09 -0.26 -0.09 3.54 4.81 -2.00 -1.46 114.58 119.21 3nse h GLU 169 Ca -0.46 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 58.77 3nse h GLU 169 Cb 1.20 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.63 3nse h GLU 169 CO 0.62 -0.17 -0.05 0.66 -0.73 0.00 0.00 179.01 179.33 3nse h SER 170 N -0.27 0.11 -0.20 1.04 4.64 -1.99 -1.91 113.55 114.97 3nse h SER 170 Ca 0.16 -0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.37 3nse h SER 170 Cb 0.57 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.62 3nse h SER 170 CO -0.61 0.19 -0.21 -0.33 -0.87 0.00 0.00 176.83 174.99 3nse h GLU 171 N 0.12 0.64 -0.30 4.77 5.08 -1.66 -0.70 114.58 122.54 3nse h GLU 171 Ca 0.03 -0.24 -0.11 0.00 -1.00 0.00 0.00 59.36 58.04 3nse h GLU 171 Cb 0.18 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 3nse h GLU 171 CO 0.01 0.81 -0.25 1.25 -1.00 0.00 0.00 179.01 179.83 3nse h LEU 172 N 0.57 0.74 -0.76 1.33 5.85 -0.73 -0.97 115.31 121.34 3nse h LEU 172 Ca 0.08 -0.45 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 3nse h LEU 172 Cb 0.68 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 3nse h LEU 172 CO 0.05 1.04 0.44 0.58 -0.34 0.00 0.00 178.44 180.21 3nse h VAL 173 N 0.45 1.22 0.22 1.05 2.07 -1.22 -1.19 116.25 118.85 3nse h VAL 173 Ca 0.06 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 3nse h VAL 173 Cb 0.80 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 3nse h VAL 173 CO 0.06 0.23 -0.11 0.15 0.02 0.00 0.00 177.57 177.93 3nse h PHE 174 N 1.04 -0.28 -0.64 1.57 3.57 -1.01 -2.81 116.94 118.38 3nse h PHE 174 Ca 0.27 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.74 3nse h PHE 174 Cb -0.01 0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 3nse h PHE 174 CO -0.01 -0.04 0.30 0.78 -2.23 0.00 0.00 178.31 177.11 3nse h GLY 175 N -0.49 0.98 0.90 2.40 0.00 -1.07 -0.57 103.07 105.22 3nse h GLY 175 Ca -0.03 -0.47 -0.02 0.00 0.00 0.00 0.00 47.33 46.80 3nse h GLY 175 CO 0.05 0.45 0.09 0.00 0.00 0.00 0.00 176.54 177.13 3nse h ALA 176 N 1.42 0.38 -0.13 3.60 0.00 -1.24 0.37 119.26 123.66 3nse h ALA 176 Ca 0.22 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3nse h ALA 176 Cb 0.11 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3nse h ALA 176 CO -0.03 0.02 -0.19 0.87 0.00 0.00 0.00 179.25 179.92 3nse h LYS 177 N 0.31 0.22 -0.11 0.00 1.57 -1.25 -2.75 116.57 114.55 3nse h LYS 177 Ca 0.09 -0.06 -0.20 0.00 -1.87 0.00 0.00 60.65 58.61 3nse h LYS 177 Cb 0.25 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.53 3nse h LYS 177 CO -0.00 0.41 -0.74 0.37 -0.57 0.00 0.00 179.45 178.92 3nse h GLN 178 N 0.21 0.57 -0.80 3.15 5.75 -0.67 -1.63 115.11 121.69 3nse h GLN 178 Ca 0.04 -0.46 -0.05 0.00 -0.15 0.00 0.00 58.65 58.03 3nse h GLN 178 Cb 0.46 0.10 -0.04 0.00 1.07 0.00 0.00 27.48 29.07 3nse h GLN 178 CO 0.03 1.09 0.32 0.00 -2.65 0.00 0.00 178.83 177.62 3nse h ALA 179 N 0.78 1.05 -0.25 3.38 0.00 -0.65 0.22 119.26 123.78 3nse h ALA 179 Ca -0.04 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 3nse h ALA 179 Cb 1.34 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 3nse h ALA 179 CO 0.14 0.67 -0.11 2.35 0.00 0.00 0.00 179.25 182.30 3nse h TRP 180 N 1.17 0.59 -0.54 0.00 7.01 -1.49 -2.17 115.95 120.52 3nse h TRP 180 Ca 0.27 -0.14 0.05 0.00 2.11 0.00 0.00 58.89 61.17 3nse h TRP 180 Cb 0.22 -0.14 -0.03 0.00 -2.10 0.00 0.00 29.16 27.11 3nse h TRP 180 CO 0.02 0.77 0.36 -0.09 -2.79 0.00 0.00 178.44 176.71 3nse h ARG 181 N 0.25 0.54 -0.00 2.65 2.43 -0.86 -1.83 114.38 117.56 3nse h ARG 181 Ca 0.06 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3nse h ARG 181 Cb 0.61 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 3nse h ARG 181 CO 0.03 0.36 -0.16 0.09 -1.51 0.00 0.00 179.97 178.78 3nse n ASN 182 N -4.47 0.54 -4.58 -3.80 3.02 0.73 -4.86 115.26 101.83 3nse n ASN 182 Ca 0.07 -0.52 -0.41 0.00 -0.03 0.00 0.00 54.58 53.69 3nse n ASN 182 Cb 0.19 -0.04 -0.03 0.00 -0.61 0.00 0.00 39.78 39.30 3nse n ASN 182 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3nse s ALA 183 N -2.56 2.62 0.50 5.41 0.00 -0.69 -4.69 121.76 122.34 3nse s ALA 183 Ca 0.25 -0.25 0.24 0.00 0.00 0.00 0.00 51.96 52.20 3nse s ALA 183 Cb 0.20 -4.13 1.46 0.00 0.00 0.00 0.00 23.12 20.65 3nse s ALA 183 CO 0.51 -3.12 2.13 -1.35 0.00 0.00 0.00 175.76 173.93 3nse h PRO 184 N 13.18 0.00 -0.01 0.00 0.11 -1.89 -2.95 132.00 140.43 3nse h PRO 184 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3nse h PRO 184 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3nse h PRO 184 CO 1.13 0.08 -0.03 0.54 -0.21 0.00 0.00 178.00 179.51 3nse n ARG 185 N -3.98 1.59 -3.54 1.05 1.74 -1.26 -0.83 116.66 111.43 3nse n ARG 185 Ca -0.03 -0.93 -0.38 0.00 -0.77 0.00 0.00 57.85 55.75 3nse n ARG 185 Cb 0.17 -1.48 -0.09 0.00 -1.02 0.00 0.00 32.46 30.03 3nse n ARG 185 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3nse n VAL 187 N 4.53 0.14 -0.24 0.00 3.14 -1.26 -4.10 118.33 120.54 3nse n VAL 187 Ca -0.12 -0.11 0.06 0.00 -2.96 0.00 0.00 64.34 61.20 3nse n VAL 187 Cb 0.52 0.06 0.28 0.00 -1.06 0.00 0.00 33.84 33.64 3nse n VAL 187 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3nse n GLY 188 N 1.43 2.37 0.00 7.55 0.00 -1.26 -4.50 105.19 110.78 3nse n GLY 188 Ca 0.05 -0.65 0.02 0.00 0.00 0.00 0.00 46.02 45.44 3nse n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3nse n ARG 189 N 0.58 0.09 0.19 1.61 1.74 -1.26 -2.48 116.66 117.12 3nse n ARG 189 Ca 0.20 0.20 0.14 0.00 -0.77 0.00 0.00 57.85 57.61 3nse n ARG 189 Cb 0.84 -1.50 0.58 0.00 -1.02 0.00 0.00 32.46 31.36 3nse n ARG 189 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 3nse h ILE 190 N 0.00 0.00 -0.02 0.55 2.10 -1.86 -1.90 117.51 116.37 3nse h ILE 190 Ca 0.00 -0.31 0.00 0.00 1.08 0.00 0.00 64.86 65.63 3nse h ILE 190 Cb 0.04 1.13 0.00 0.00 -1.09 0.00 0.00 36.82 36.90 3nse h ILE 190 CO 0.00 0.00 -0.02 0.00 -1.08 0.00 0.00 178.15 177.05 3nse n GLN 191 N -2.55 1.89 -0.39 2.19 1.13 -1.03 -4.61 117.38 114.01 3nse n GLN 191 Ca 0.01 -1.34 0.31 0.00 -1.94 0.00 0.00 57.00 54.05 3nse n GLN 191 Cb 0.24 -1.47 0.60 0.00 0.11 0.00 0.00 30.24 29.72 3nse n GLN 191 CO 0.00 0.00 0.00 0.11 -1.44 0.00 0.00 177.06 175.73 3nse h TRP 192 N 3.26 0.53 0.00 1.08 5.08 -1.55 0.12 115.95 124.48 3nse h TRP 192 Ca 0.00 0.02 -0.05 0.00 1.08 0.00 0.00 58.89 59.94 3nse h TRP 192 Cb 0.71 -0.14 -0.01 0.00 -3.00 0.00 0.00 29.16 26.72 3nse h TRP 192 CO 0.00 -0.08 -0.23 0.78 -1.28 0.00 0.00 178.44 177.63 3nse h GLY 193 N 0.20 0.00 -7.79 11.11 0.00 -1.84 -3.38 103.07 101.36 3nse h GLY 193 Ca 0.72 0.00 -0.78 0.00 0.00 0.00 0.00 47.33 47.26 3nse h GLY 193 CO -0.34 0.00 0.05 1.25 0.00 0.00 0.00 176.54 177.51 3nse s LYS 194 N -3.72 3.51 -0.07 4.80 2.20 0.43 -5.01 119.74 121.88 3nse s LYS 194 Ca -0.00 -2.46 -0.03 0.00 -0.36 0.00 0.00 55.97 53.12 3nse s LYS 194 Cb 0.11 -4.37 0.04 0.00 -1.51 0.00 0.00 37.83 32.10 3nse s LYS 194 CO 0.64 -1.28 0.15 -1.17 -0.36 0.00 0.00 175.35 173.32 3nse s LEU 195 N 0.16 0.36 -0.38 5.43 2.96 -1.26 -4.66 118.68 121.29 3nse s LEU 195 Ca 0.18 0.30 -0.26 0.00 -0.22 0.00 0.00 54.13 54.13 3nse s LEU 195 Cb -0.11 0.30 0.02 0.00 0.50 0.00 0.00 46.19 46.89 3nse s LEU 195 CO -0.08 -0.19 0.93 -1.58 -1.32 0.00 0.00 176.35 174.11 3nse s GLN 196 N 1.70 3.80 -0.48 1.98 2.00 -0.64 -4.97 119.66 123.04 3nse s GLN 196 Ca -0.03 0.53 -0.16 0.00 -2.00 0.00 0.00 55.36 53.69 3nse s GLN 196 Cb -0.12 -3.82 0.07 0.00 0.80 0.00 0.00 33.01 29.94 3nse s GLN 196 CO -0.06 -0.99 0.44 0.08 -0.50 0.00 0.00 175.29 174.26 3nse s VAL 197 N 3.54 5.18 -0.38 1.34 1.01 -1.26 -1.06 120.40 128.77 3nse s VAL 197 Ca 0.38 -1.00 -0.22 0.00 0.00 0.00 0.00 61.98 61.15 3nse s VAL 197 Cb -0.12 -4.17 0.01 0.00 0.00 0.00 0.00 36.38 32.11 3nse s VAL 197 CO 0.20 -0.63 0.71 -0.36 0.00 0.00 0.00 175.10 175.02 3nse s PHE 198 N 1.80 3.11 -0.16 5.22 0.08 0.39 -5.00 117.98 123.41 3nse s PHE 198 Ca 0.06 0.37 -0.29 0.00 0.12 0.00 0.00 56.93 57.18 3nse s PHE 198 Cb -0.24 -3.32 -0.01 0.00 -0.57 0.00 0.00 43.02 38.88 3nse s PHE 198 CO 0.07 -0.73 1.10 0.34 -0.10 0.00 0.00 175.22 175.90 3nse s ASP 199 N 1.87 7.10 -0.09 1.36 -1.08 -1.26 -1.11 116.67 123.46 3nse s ASP 199 Ca 0.28 1.54 0.18 0.00 -0.52 0.00 0.00 52.55 54.03 3nse s ASP 199 Cb -0.14 -2.55 0.40 0.00 -1.46 0.00 0.00 42.92 39.18 3nse s ASP 199 CO 0.17 -0.61 1.18 0.00 0.52 0.00 0.00 175.17 176.43 3nse n ALA 200 N 5.86 2.90 1.38 3.66 0.00 0.92 -4.83 120.51 130.39 3nse n ALA 200 Ca 0.11 -2.72 0.04 0.00 0.00 0.00 0.00 53.44 50.88 3nse n ALA 200 Cb 0.47 -0.55 0.24 0.00 0.00 0.00 0.00 19.45 19.60 3nse n ALA 200 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3nse n ARG 201 N -0.29 0.69 0.00 0.00 1.74 -1.06 -2.08 116.66 115.66 3nse n ARG 201 Ca 0.12 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.27 3nse n ARG 201 Cb 0.91 -1.18 -0.01 0.00 -1.02 0.00 0.00 32.46 31.16 3nse n ARG 201 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3nse n ASP 202 N -0.68 1.40 -4.74 0.55 5.75 -1.26 -4.58 116.55 112.98 3nse n ASP 202 Ca 0.06 -1.20 -0.42 0.00 -0.01 0.00 0.00 54.79 53.22 3nse n ASP 202 Cb 0.03 0.55 -0.02 0.00 -1.03 0.00 0.00 41.12 40.64 3nse n ASP 202 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3nse n SER 204 N 2.90 0.46 -4.09 0.00 3.41 -1.26 -4.74 113.62 110.31 3nse n SER 204 Ca 0.11 -0.83 -0.08 0.00 -0.26 0.00 0.00 58.87 57.81 3nse n SER 204 Cb 0.37 0.15 -0.10 0.00 -0.26 0.00 0.00 64.21 64.38 3nse n SER 204 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3nse s SER 205 N -0.15 0.35 0.30 4.04 1.04 -1.26 -4.91 113.70 113.10 3nse s SER 205 Ca 0.00 -1.05 0.05 0.00 0.48 0.00 0.00 55.95 55.43 3nse s SER 205 Cb 0.00 0.27 0.47 0.00 0.10 0.00 0.00 66.02 66.86 3nse s SER 205 CO 0.00 -0.69 1.73 0.00 0.98 0.00 0.00 173.24 175.27 3nse h ALA 206 N 2.95 1.15 -0.35 5.32 0.00 -1.91 -1.54 119.26 124.89 3nse h ALA 206 Ca -0.34 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.21 3nse h ALA 206 Cb 1.18 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 3nse h ALA 206 CO 0.61 0.55 0.21 0.37 0.00 0.00 0.00 179.25 180.99 3nse h GLN 207 N 0.31 0.47 -0.35 0.00 5.75 -1.95 -1.97 115.11 117.38 3nse h GLN 207 Ca 0.04 -0.04 -0.08 0.00 -0.15 0.00 0.00 58.65 58.42 3nse h GLN 207 Cb 0.69 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 29.13 3nse h GLN 207 CO 0.05 0.35 -0.13 1.49 -2.65 0.00 0.00 178.83 177.94 3nse h GLU 208 N 0.45 0.61 -0.98 1.69 4.81 -1.90 -2.41 114.58 116.86 3nse h GLU 208 Ca 0.13 -0.19 0.07 0.00 -0.13 0.00 0.00 59.36 59.24 3nse h GLU 208 Cb -0.01 -0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.25 3nse h GLU 208 CO -0.02 0.73 0.62 0.52 -0.73 0.00 0.00 179.01 180.13 3nse h MET 209 N 0.56 1.08 -0.54 1.92 2.86 -0.63 -0.35 114.93 119.82 3nse h MET 209 Ca 0.10 -0.06 -0.09 0.00 -2.06 0.00 0.00 59.70 57.58 3nse h MET 209 Cb 0.55 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 3nse h MET 209 CO 0.03 0.71 -0.02 0.35 1.06 0.00 0.00 176.91 179.05 3nse h PHE 210 N 1.11 1.06 -0.14 -0.22 3.57 -0.90 -0.81 116.94 120.61 3nse h PHE 210 Ca 0.43 -0.19 -0.00 0.00 3.53 0.00 0.00 57.97 61.74 3nse h PHE 210 Cb 0.22 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 3nse h PHE 210 CO -0.01 0.97 0.07 1.15 -2.23 0.00 0.00 178.31 178.26 3nse h THR 211 N 0.84 1.12 -0.64 4.41 2.02 -0.96 0.27 112.91 119.96 3nse h THR 211 Ca 0.15 -0.34 0.05 0.00 0.77 0.00 0.00 66.41 67.05 3nse h THR 211 Cb 0.56 1.09 -0.05 0.00 -1.74 0.00 0.00 68.15 68.01 3nse h THR 211 CO 0.03 0.11 0.36 1.88 0.37 0.00 0.00 175.52 178.27 3nse h TYR 212 N 0.10 0.66 -0.59 3.16 0.05 -0.92 -0.17 116.97 119.26 3nse h TYR 212 Ca 0.05 0.02 -0.09 0.00 0.05 0.00 0.00 58.73 58.76 3nse h TYR 212 Cb 0.11 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.63 3nse h TYR 212 CO -0.03 0.33 0.00 0.82 -1.05 0.00 0.00 178.16 178.23 3nse h ILE 213 N 0.67 1.27 -0.30 -2.88 2.04 -0.95 -0.44 117.51 116.92 3nse h ILE 213 Ca 0.28 -1.14 -0.05 0.00 1.00 0.00 0.00 64.86 64.95 3nse h ILE 213 Cb 0.15 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 3nse h ILE 213 CO -0.17 0.41 -0.05 0.00 0.00 0.00 0.00 178.15 178.35 3nse h ASN 215 N 0.45 0.61 0.00 0.00 2.35 -0.64 -2.18 115.58 116.18 3nse h ASN 215 Ca 0.09 -0.38 -0.00 0.00 -0.55 0.00 0.00 56.30 55.47 3nse h ASN 215 Cb 0.38 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.57 3nse h ASN 215 CO 0.02 1.12 -0.00 -0.74 -1.65 0.00 0.00 177.43 176.17 3nse h HIS 216 N 0.37 -0.00 -1.01 1.19 2.76 -0.28 -1.23 115.15 116.94 3nse h HIS 216 Ca -0.02 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.16 3nse h HIS 216 Cb 1.26 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.17 3nse h HIS 216 CO 0.05 0.17 0.67 0.82 -1.30 0.00 0.00 177.93 178.35 3nse h ILE 217 N -0.18 1.26 -0.30 6.26 2.04 -0.88 0.62 117.51 126.32 3nse h ILE 217 Ca -0.00 -0.47 -0.09 0.00 1.00 0.00 0.00 64.86 65.30 3nse h ILE 217 Cb 0.18 -0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.02 3nse h ILE 217 CO 0.00 0.25 -0.16 0.11 0.00 0.00 0.00 178.15 178.35 3nse h LYS 218 N 1.37 0.63 -0.07 2.37 1.57 -1.25 -1.33 116.57 119.86 3nse h LYS 218 Ca 0.37 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 3nse h LYS 218 Cb -0.15 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.14 3nse h LYS 218 CO -0.08 0.87 0.00 -0.92 -0.57 0.00 0.00 179.45 178.75 3nse h TYR 219 N 0.38 0.13 -0.64 -1.35 5.03 -0.87 -2.36 116.97 117.30 3nse h TYR 219 Ca 0.06 -0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.26 3nse h TYR 219 Cb 0.69 -0.03 -0.02 0.00 1.55 0.00 0.00 36.73 38.91 3nse h TYR 219 CO 0.06 0.39 0.04 0.00 -1.32 0.00 0.00 178.16 177.33 3nse h ALA 220 N 0.73 0.86 -0.23 1.82 0.00 -0.93 -3.21 119.26 118.29 3nse h ALA 220 Ca 0.02 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 3nse h ALA 220 Cb 0.34 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3nse h ALA 220 CO 0.00 0.67 -0.11 1.15 0.00 0.00 0.00 179.25 180.97 3nse h THR 221 N 1.01 1.30 -7.12 0.00 2.02 -1.29 0.10 112.91 108.93 3nse h THR 221 Ca 0.19 -1.17 -0.62 0.00 0.77 0.00 0.00 66.41 65.58 3nse h THR 221 Cb 0.52 1.57 -0.31 0.00 -1.74 0.00 0.00 68.15 68.19 3nse h THR 221 CO 0.03 0.36 -0.92 -3.20 0.37 0.00 0.00 175.52 172.15 3nse n ASN 222 N -4.52 -1.05 -3.88 4.18 5.15 -0.89 -1.04 115.26 113.22 3nse n ASN 222 Ca -0.04 -1.23 -0.28 0.00 -0.60 0.00 0.00 54.58 52.42 3nse n ASN 222 Cb 0.33 -1.73 0.02 0.00 -0.53 0.00 0.00 39.78 37.88 3nse n ASN 222 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3nse n ARG 223 N -4.26 -5.16 0.00 1.20 1.74 -1.26 -2.65 116.66 106.27 3nse n ARG 223 Ca -0.03 0.58 0.00 0.00 -0.77 0.00 0.00 57.85 57.63 3nse n ARG 223 Cb 0.54 -5.34 0.00 0.00 -1.02 0.00 0.00 32.46 26.63 3nse n ARG 223 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3nse n GLY 224 N -1.67 2.59 3.12 -0.13 0.00 -0.21 -4.91 105.19 103.99 3nse n GLY 224 Ca -0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 3nse n GLY 224 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3nse n ASN 225 N 0.00 5.61 -4.64 1.61 5.15 -1.08 -0.55 115.26 121.36 3nse n ASN 225 Ca 0.00 -3.16 -0.39 0.00 -0.60 0.00 0.00 54.58 50.43 3nse n ASN 225 Cb 0.00 -1.42 0.04 0.00 -0.53 0.00 0.00 39.78 37.87 3nse n ASN 225 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3nse n LEU 226 N 3.23 3.64 -3.91 1.20 4.32 -1.24 -4.53 117.00 119.70 3nse n LEU 226 Ca 0.32 0.92 -0.21 0.00 -0.02 0.00 0.00 56.01 57.02 3nse n LEU 226 Cb 0.37 -1.41 -0.16 0.00 -1.62 0.00 0.00 43.42 40.59 3nse n LEU 226 CO 0.68 -1.47 -0.42 -0.13 -1.22 0.00 0.00 177.39 174.83 3nse s ARG 227 N -2.50 1.03 0.24 3.23 0.52 0.35 -5.02 118.95 116.80 3nse s ARG 227 Ca 0.70 -0.17 -0.30 0.00 -0.52 0.00 0.00 55.73 55.44 3nse s ARG 227 Cb -0.46 -0.99 -0.10 0.00 0.52 0.00 0.00 34.95 33.91 3nse s ARG 227 CO 0.51 -0.08 1.52 -1.12 0.02 0.00 0.00 175.30 176.16 3nse s SER 228 N 0.94 6.55 0.11 0.23 0.01 -1.26 -4.36 113.70 115.91 3nse s SER 228 Ca -0.10 2.75 -0.18 0.00 1.31 0.00 0.00 55.95 59.72 3nse s SER 228 Cb -0.14 -2.62 0.04 0.00 0.21 0.00 0.00 66.02 63.51 3nse s SER 228 CO 0.00 -0.80 0.44 0.00 0.41 0.00 0.00 173.24 173.29 3nse s ALA 229 N 0.29 -1.06 -0.08 1.44 0.00 -0.65 -1.62 121.76 120.08 3nse s ALA 229 Ca 0.63 0.14 -0.07 0.00 0.00 0.00 0.00 51.96 52.66 3nse s ALA 229 Cb -0.44 0.63 0.02 0.00 0.00 0.00 0.00 23.12 23.33 3nse s ALA 229 CO 0.41 -0.61 0.21 -1.50 0.00 0.00 0.00 175.76 174.27 3nse s ILE 230 N -3.44 -0.00 -0.19 0.00 2.07 -0.22 -0.49 121.20 118.92 3nse s ILE 230 Ca 0.01 0.02 -0.01 0.00 -1.41 0.00 0.00 60.65 59.25 3nse s ILE 230 Cb 0.01 -0.30 0.01 0.00 0.13 0.00 0.00 42.46 42.30 3nse s ILE 230 CO -0.10 0.01 -0.14 -0.89 -1.91 0.00 0.00 174.94 171.91 3nse s THR 231 N 0.23 2.61 -0.34 4.00 2.01 -0.73 -0.47 115.64 122.96 3nse s THR 231 Ca -0.01 -0.76 -0.12 0.00 0.31 0.00 0.00 61.69 61.11 3nse s THR 231 Cb -0.02 -2.14 -0.01 0.00 0.01 0.00 0.00 72.50 70.34 3nse s THR 231 CO -0.01 0.49 0.22 -0.69 -0.69 0.00 0.00 174.62 173.95 3nse s VAL 232 N 1.31 5.06 0.55 3.82 1.01 -0.27 -3.19 120.40 128.69 3nse s VAL 232 Ca 0.04 -0.33 -0.03 0.00 0.00 0.00 0.00 61.98 61.67 3nse s VAL 232 Cb -0.14 -3.62 0.02 0.00 0.00 0.00 0.00 36.38 32.64 3nse s VAL 232 CO -0.08 -0.02 0.82 -0.36 0.00 0.00 0.00 175.10 175.46 3nse s PHE 233 N 1.68 3.12 0.33 5.22 0.08 -0.83 -0.06 117.98 127.52 3nse s PHE 233 Ca 0.05 0.35 -0.26 0.00 0.12 0.00 0.00 56.93 57.20 3nse s PHE 233 Cb -0.17 -2.67 -0.14 0.00 -0.57 0.00 0.00 43.02 39.47 3nse s PHE 233 CO 0.09 -0.77 0.73 -2.30 -0.10 0.00 0.00 175.22 172.88 3nse n PRO 234 N -2.42 0.78 -1.35 0.24 -0.02 -1.25 -4.71 135.00 126.28 3nse n PRO 234 Ca 0.05 0.28 -0.29 0.00 -2.02 0.00 0.00 63.50 61.52 3nse n PRO 234 Cb 0.58 -1.55 0.15 0.00 -0.02 0.00 0.00 33.50 32.66 3nse n PRO 234 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 3nse s GLN 235 N -1.47 0.96 0.12 -0.52 -2.07 -1.26 -4.60 119.66 110.82 3nse s GLN 235 Ca 0.62 0.48 -0.31 0.00 -1.82 0.00 0.00 55.36 54.33 3nse s GLN 235 Cb -0.70 -1.80 -0.09 0.00 -1.09 0.00 0.00 33.01 29.32 3nse s GLN 235 CO 0.58 -2.36 1.57 1.03 -1.32 0.00 0.00 175.29 174.80 3nse s ARG 236 N -5.10 4.22 -0.13 9.60 0.52 0.99 -4.91 118.95 124.15 3nse s ARG 236 Ca 0.64 2.31 0.02 0.00 -0.52 0.00 0.00 55.73 58.18 3nse s ARG 236 Cb -0.17 -3.33 0.01 0.00 0.52 0.00 0.00 34.95 31.99 3nse s ARG 236 CO 0.56 -0.63 -0.19 0.00 0.02 0.00 0.00 175.30 175.06 3nse s ALA 237 N 1.68 2.01 0.38 2.13 0.00 -1.26 -4.80 121.76 121.90 3nse s ALA 237 Ca 0.71 -0.95 -0.28 0.00 0.00 0.00 0.00 51.96 51.44 3nse s ALA 237 Cb -0.41 -0.95 -0.10 0.00 0.00 0.00 0.00 23.12 21.66 3nse s ALA 237 CO 0.31 -0.09 1.43 -1.25 0.00 0.00 0.00 175.76 176.16 3nse s PRO 238 N 0.95 4.09 -0.54 0.00 0.04 -1.26 -2.37 135.00 135.91 3nse s PRO 238 Ca -0.05 2.45 -0.01 0.00 0.04 0.00 0.00 61.00 63.43 3nse s PRO 238 Cb -0.15 -2.93 0.00 0.00 0.04 0.00 0.00 34.50 31.46 3nse s PRO 238 CO -0.03 -0.50 0.12 0.41 0.04 0.00 0.00 177.00 177.03 3nse n GLY 239 N 0.56 0.20 3.62 0.56 0.00 -1.26 -5.00 105.19 103.87 3nse n GLY 239 Ca 0.02 -0.53 -0.12 0.00 0.00 0.00 0.00 46.02 45.39 3nse n GLY 239 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3nse s ARG 240 N -4.67 0.66 0.87 1.61 3.00 -1.00 -5.17 118.95 114.26 3nse s ARG 240 Ca 0.06 0.67 -0.11 0.00 -1.00 0.00 0.00 55.73 55.35 3nse s ARG 240 Cb -0.03 0.32 0.12 0.00 0.00 0.00 0.00 34.95 35.36 3nse s ARG 240 CO 0.07 -0.10 1.10 0.20 0.00 0.00 0.00 175.30 176.57 3nse s GLY 241 N 0.07 1.65 0.50 8.12 0.00 -1.26 -4.52 107.32 111.87 3nse s GLY 241 Ca 0.01 0.20 -0.06 0.00 0.00 0.00 0.00 44.72 44.87 3nse s GLY 241 CO -0.02 0.64 0.81 0.99 0.00 0.00 0.00 173.10 175.52 3nse s ASP 242 N -3.18 6.25 -0.22 1.64 1.01 -1.26 -4.51 116.67 116.40 3nse s ASP 242 Ca 0.64 0.98 -0.16 0.00 0.71 0.00 0.00 52.55 54.72 3nse s ASP 242 Cb -0.19 -2.26 -0.04 0.00 1.01 0.00 0.00 42.92 41.44 3nse s ASP 242 CO 0.57 -0.62 0.41 -0.36 0.21 0.00 0.00 175.17 175.39 3nse s PHE 243 N -2.80 3.34 -0.01 4.23 0.08 -1.26 -3.70 117.98 117.87 3nse s PHE 243 Ca 0.48 0.59 -0.02 0.00 0.12 0.00 0.00 56.93 58.11 3nse s PHE 243 Cb -0.10 -2.56 -0.00 0.00 -0.57 0.00 0.00 43.02 39.79 3nse s PHE 243 CO 0.46 -0.07 0.03 1.03 -0.10 0.00 0.00 175.22 176.57 3nse s ARG 244 N 1.54 0.13 -0.23 0.44 1.81 -0.77 -3.08 118.95 118.78 3nse s ARG 244 Ca 0.19 -0.10 -0.06 0.00 -1.72 0.00 0.00 55.73 54.04 3nse s ARG 244 Cb -0.15 0.05 -0.03 0.00 -0.45 0.00 0.00 34.95 34.38 3nse s ARG 244 CO 0.08 -0.02 0.03 0.42 -0.68 0.00 0.00 175.30 175.14 3nse s ILE 245 N -0.35 4.12 0.16 1.52 1.01 -1.26 -0.84 121.20 125.56 3nse s ILE 245 Ca -0.04 -0.24 -0.08 0.00 0.00 0.00 0.00 60.65 60.28 3nse s ILE 245 Cb -0.03 -2.90 -0.05 0.00 0.01 0.00 0.00 42.46 39.49 3nse s ILE 245 CO -0.00 0.39 1.48 -0.50 0.00 0.00 0.00 174.94 176.30 3nse h TRP 246 N 7.88 0.98 -4.03 3.97 4.06 -1.63 -3.42 115.95 123.75 3nse h TRP 246 Ca -0.38 -0.32 -0.52 0.00 2.06 0.00 0.00 58.89 59.73 3nse h TRP 246 Cb 1.17 -0.20 0.09 0.00 -1.00 0.00 0.00 29.16 29.23 3nse h TRP 246 CO 0.63 1.11 0.52 -0.80 -3.56 0.00 0.00 178.44 176.34 3nse s ASN 247 N -6.89 5.76 0.20 -3.49 -0.87 -1.26 -4.94 114.94 103.45 3nse s ASN 247 Ca -0.10 2.46 -0.02 0.00 -1.57 0.00 0.00 52.86 53.64 3nse s ASN 247 Cb 0.11 -2.61 0.13 0.00 -0.02 0.00 0.00 41.25 38.86 3nse s ASN 247 CO 0.87 -1.21 1.51 0.77 -2.57 0.00 0.00 177.10 176.47 3nse h SER 248 N 1.72 0.55 -4.58 -1.22 4.64 -1.91 -3.33 113.55 109.42 3nse h SER 248 Ca -0.50 -0.30 -0.24 0.00 -0.47 0.00 0.00 61.79 60.28 3nse h SER 248 Cb 1.27 -0.16 -0.16 0.00 -0.31 0.00 0.00 62.40 63.04 3nse h SER 248 CO 0.59 1.00 -0.70 -1.10 -0.87 0.00 0.00 176.83 175.75 3nse s GLN 249 N -3.94 0.81 0.32 4.77 -0.21 -1.26 -0.82 119.66 119.33 3nse s GLN 249 Ca -0.07 -1.26 0.04 0.00 0.02 0.00 0.00 55.36 54.09 3nse s GLN 249 Cb 0.11 -0.25 0.54 0.00 1.00 0.00 0.00 33.01 34.41 3nse s GLN 249 CO 0.83 0.00 1.82 -0.07 -2.12 0.00 0.00 175.29 175.75 3nse h LEU 250 N 3.18 0.48 -8.28 2.90 3.38 -1.49 -3.40 115.31 112.09 3nse h LEU 250 Ca -0.36 -0.12 -0.67 0.00 0.09 0.00 0.00 57.88 56.83 3nse h LEU 250 Cb 1.17 -0.13 -0.31 0.00 0.09 0.00 0.00 40.66 41.48 3nse h LEU 250 CO 0.61 0.62 -0.81 -0.69 0.09 0.00 0.00 178.44 178.26 3nse s VAL 251 N -4.78 2.61 -0.07 1.22 1.01 -1.26 -4.91 120.40 114.21 3nse s VAL 251 Ca -0.07 -0.77 -0.07 0.00 0.00 0.00 0.00 61.98 61.07 3nse s VAL 251 Cb 0.15 -2.12 0.02 0.00 0.00 0.00 0.00 36.38 34.43 3nse s VAL 251 CO 0.77 0.50 0.19 -0.13 0.00 0.00 0.00 175.10 176.44 3nse s ARG 252 N 1.10 0.25 0.06 2.72 1.81 -1.26 -4.93 118.95 118.70 3nse s ARG 252 Ca 0.00 0.22 -0.16 0.00 -1.72 0.00 0.00 55.73 54.08 3nse s ARG 252 Cb -0.14 0.12 -0.06 0.00 -0.45 0.00 0.00 34.95 34.41 3nse s ARG 252 CO -0.05 -0.03 0.48 0.71 -0.68 0.00 0.00 175.30 175.73 3nse s TYR 253 N -0.01 3.72 0.67 -0.53 2.02 -1.26 -0.69 117.35 121.26 3nse s TYR 253 Ca -0.01 1.08 -0.16 0.00 -0.37 0.00 0.00 57.07 57.60 3nse s TYR 253 Cb -0.02 -2.36 0.00 0.00 -0.40 0.00 0.00 41.96 39.19 3nse s TYR 253 CO 0.00 0.58 1.19 0.00 -1.57 0.00 0.00 175.55 175.75 3nse s ALA 254 N -1.19 2.34 -0.25 3.71 0.00 0.31 -4.35 121.76 122.33 3nse s ALA 254 Ca 0.29 0.86 -0.01 0.00 0.00 0.00 0.00 51.96 53.10 3nse s ALA 254 Cb -0.17 -3.43 0.08 0.00 0.00 0.00 0.00 23.12 19.59 3nse s ALA 254 CO 0.17 -1.50 0.04 0.20 0.00 0.00 0.00 175.76 174.67 3nse s GLY 255 N -1.98 1.02 -0.28 0.00 0.00 -1.25 -1.30 107.32 103.52 3nse s GLY 255 Ca 0.74 -1.27 -0.16 0.00 0.00 0.00 0.00 44.72 44.03 3nse s GLY 255 CO 0.40 1.36 0.44 -0.19 0.00 0.00 0.00 173.10 175.11 3nse s TYR 256 N 1.63 3.24 -0.48 1.90 2.02 0.17 -4.26 117.35 121.58 3nse s TYR 256 Ca 0.02 0.43 -0.28 0.00 -0.37 0.00 0.00 57.07 56.87 3nse s TYR 256 Cb -0.18 -2.68 0.01 0.00 -0.40 0.00 0.00 41.96 38.70 3nse s TYR 256 CO -0.14 -0.31 1.50 0.50 -1.57 0.00 0.00 175.55 175.53 3nse s ARG 257 N 2.20 3.36 0.99 -0.62 3.52 -1.26 -1.35 118.95 125.78 3nse s ARG 257 Ca 0.18 0.78 -0.12 0.00 -0.13 0.00 0.00 55.73 56.43 3nse s ARG 257 Cb -0.16 -4.12 0.18 0.00 -1.56 0.00 0.00 34.95 29.30 3nse s ARG 257 CO 0.10 -1.85 1.09 -0.65 -0.81 0.00 0.00 175.30 173.19 3nse s GLN 258 N 5.43 0.50 0.27 5.12 -1.52 0.09 -4.94 119.66 124.60 3nse s GLN 258 Ca 0.61 0.56 -0.03 0.00 -1.95 0.00 0.00 55.36 54.55 3nse s GLN 258 Cb -0.13 -1.74 0.36 0.00 -0.22 0.00 0.00 33.01 31.27 3nse s GLN 258 CO 0.29 -2.70 1.84 0.37 -0.25 0.00 0.00 175.29 174.84 3nse h GLN 259 N -1.87 0.95 -0.23 2.91 5.75 -1.94 -2.57 115.11 118.12 3nse h GLN 259 Ca -0.54 -0.16 0.00 0.00 -0.15 0.00 0.00 58.65 57.80 3nse h GLN 259 Cb 1.32 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 29.71 3nse h GLN 259 CO 0.57 0.79 0.00 -0.40 -2.65 0.00 0.00 178.83 177.14 3nse n ASP 260 N -4.30 0.98 0.00 -0.69 5.75 -1.26 -4.90 116.55 112.13 3nse n ASP 260 Ca 0.06 -2.02 0.00 0.00 -0.01 0.00 0.00 54.79 52.82 3nse n ASP 260 Cb 0.18 -0.15 0.00 0.00 -1.03 0.00 0.00 41.12 40.12 3nse n ASP 260 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3nse n GLY 261 N 0.71 3.13 2.37 6.12 0.00 -0.97 -5.04 105.19 111.51 3nse n GLY 261 Ca 0.06 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.87 3nse n GLY 261 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3nse n SER 262 N 0.13 -1.67 -3.94 1.61 3.41 -1.26 -4.66 113.62 107.24 3nse n SER 262 Ca 0.00 -0.96 -0.17 0.00 -0.26 0.00 0.00 58.87 57.47 3nse n SER 262 Cb 0.00 -0.68 -0.15 0.00 -0.26 0.00 0.00 64.21 63.12 3nse n SER 262 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3nse s VAL 263 N -2.36 0.47 -0.23 -3.33 1.01 -1.26 -0.74 120.40 113.96 3nse s VAL 263 Ca 0.48 -0.19 -0.08 0.00 0.00 0.00 0.00 61.98 62.18 3nse s VAL 263 Cb -0.05 -0.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.86 3nse s VAL 263 CO 0.37 0.16 0.10 -0.60 0.00 0.00 0.00 175.10 175.12 3nse s ARG 264 N 0.23 3.84 0.00 2.72 3.52 -0.46 -4.92 118.95 123.88 3nse s ARG 264 Ca -0.03 -0.39 0.00 0.00 -0.13 0.00 0.00 55.73 55.18 3nse s ARG 264 Cb -0.07 -3.37 0.00 0.00 -1.56 0.00 0.00 34.95 29.95 3nse s ARG 264 CO -0.00 -0.03 0.00 0.41 -0.81 0.00 0.00 175.30 174.87 3nse n GLY 265 N 4.49 0.84 3.35 8.12 0.00 -1.26 -0.65 105.19 120.08 3nse n GLY 265 Ca -0.16 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 43.93 3nse n GLY 265 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3nse s ASP 266 N -4.00 5.74 0.63 1.61 -1.08 -0.42 -4.70 116.67 114.44 3nse s ASP 266 Ca 0.00 -1.12 0.34 0.00 -0.52 0.00 0.00 52.55 51.25 3nse s ASP 266 Cb 0.00 -2.02 1.93 0.00 -1.46 0.00 0.00 42.92 41.37 3nse s ASP 266 CO 0.00 -0.43 2.18 -0.65 0.52 0.00 0.00 175.17 176.79 3nse h PRO 267 N 8.45 0.00 0.00 4.34 0.11 -1.83 -0.60 132.00 142.46 3nse h PRO 267 Ca -0.25 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.80 3nse h PRO 267 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 3nse h PRO 267 CO 0.70 0.00 -0.27 0.00 -0.21 0.00 0.00 178.00 178.22 3nse h ALA 268 N 1.80 1.01 -0.58 -0.75 0.00 -1.93 -3.20 119.26 115.60 3nse h ALA 268 Ca 0.03 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 3nse h ALA 268 Cb 0.29 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 3nse h ALA 268 CO -0.00 0.33 0.09 0.09 0.00 0.00 0.00 179.25 179.76 3nse n ASN 269 N -3.43 5.17 -0.14 0.00 3.02 -0.23 -4.62 115.26 115.03 3nse n ASN 269 Ca 0.00 -3.06 -0.09 0.00 -0.03 0.00 0.00 54.58 51.40 3nse n ASN 269 Cb 0.45 -0.69 -0.01 0.00 -0.61 0.00 0.00 39.78 38.93 3nse n ASN 269 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 3nse h VAL 270 N 3.24 1.20 -0.33 2.41 2.07 -1.65 -1.90 116.25 121.28 3nse h VAL 270 Ca 0.09 -0.62 -0.10 0.00 0.82 0.00 0.00 66.70 66.89 3nse h VAL 270 Cb 2.03 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 32.64 3nse h VAL 270 CO 0.54 0.22 -0.19 -0.08 0.02 0.00 0.00 177.57 178.08 3nse h GLU 271 N 0.51 0.71 -0.35 1.57 4.81 -1.88 -2.52 114.58 117.44 3nse h GLU 271 Ca 0.13 -0.33 -0.11 0.00 -0.13 0.00 0.00 59.36 58.93 3nse h GLU 271 Cb 0.20 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 3nse h GLU 271 CO -0.01 0.93 -0.24 0.97 -0.73 0.00 0.00 179.01 179.94 3nse h ILE 272 N 0.48 1.27 -0.83 2.32 6.09 -1.89 -1.65 117.51 123.31 3nse h ILE 272 Ca 0.07 -1.33 -0.03 0.00 -1.37 0.00 0.00 64.86 62.20 3nse h ILE 272 Cb 0.74 1.26 -0.04 0.00 0.47 0.00 0.00 36.82 39.25 3nse h ILE 272 CO 0.06 0.44 0.40 0.74 -3.07 0.00 0.00 178.15 176.71 3nse h THR 273 N 0.60 1.26 0.00 2.19 2.02 -1.28 -0.03 112.91 117.66 3nse h THR 273 Ca 0.08 -0.72 -0.09 0.00 0.77 0.00 0.00 66.41 66.46 3nse h THR 273 Cb 0.72 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 3nse h THR 273 CO 0.06 0.31 -0.41 -0.33 0.37 0.00 0.00 175.52 175.51 3nse h GLU 274 N 1.17 0.00 -0.03 6.66 5.08 -1.18 -1.81 114.58 124.47 3nse h GLU 274 Ca 0.28 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.40 3nse h GLU 274 Cb 0.12 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.38 3nse h GLU 274 CO -0.04 0.41 -0.97 -0.07 -1.00 0.00 0.00 179.01 177.34 3nse h LEU 275 N 0.00 0.81 -0.49 1.33 3.38 -0.62 -2.01 115.31 117.72 3nse h LEU 275 Ca -0.00 -0.63 -0.03 0.00 0.09 0.00 0.00 57.88 57.30 3nse h LEU 275 Cb 0.89 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 3nse h LEU 275 CO 0.05 1.43 0.17 0.00 0.09 0.00 0.00 178.44 180.18 3nse h ILE 277 N 0.65 1.23 0.00 0.00 2.04 -1.37 -0.67 117.51 119.39 3nse h ILE 277 Ca 0.16 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.28 3nse h ILE 277 Cb 0.24 0.67 -0.00 0.00 -0.74 0.00 0.00 36.82 36.99 3nse h ILE 277 CO -0.01 0.28 -0.03 1.56 0.00 0.00 0.00 178.15 179.94 3nse h GLN 278 N 0.76 0.00 -0.81 2.37 4.20 -1.01 -2.18 115.11 118.43 3nse h GLN 278 Ca 0.18 0.00 -0.46 0.00 0.06 0.00 0.00 58.65 58.44 3nse h GLN 278 Cb 0.23 0.00 -0.26 0.00 0.30 0.00 0.00 27.48 27.75 3nse h GLN 278 CO -0.01 0.03 0.42 0.72 -0.67 0.00 0.00 178.83 179.32 3nse n HIS 279 N -3.30 2.55 -0.27 2.96 8.25 -0.59 -4.93 115.22 119.88 3nse n HIS 279 Ca -0.02 -2.01 0.00 0.00 -0.26 0.00 0.00 57.72 55.44 3nse n HIS 279 Cb 0.17 -0.88 0.00 0.00 1.12 0.00 0.00 29.99 30.40 3nse n HIS 279 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3nse n GLY 280 N -1.08 0.97 3.71 -1.41 0.00 -0.82 -4.77 105.19 101.78 3nse n GLY 280 Ca 0.52 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.12 3nse n GLY 280 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3nse s TRP 281 N -2.72 3.34 -0.40 1.61 -0.00 -0.33 -4.98 118.94 115.46 3nse s TRP 281 Ca 0.00 1.24 -0.22 0.00 -0.00 0.00 0.00 56.10 57.11 3nse s TRP 281 Cb 0.00 -3.45 0.01 0.00 -0.00 0.00 0.00 33.47 30.04 3nse s TRP 281 CO 0.00 -1.41 0.74 0.99 -0.00 0.00 0.00 176.95 177.27 3nse s THR 282 N 1.39 4.75 0.77 5.86 2.01 -1.26 -4.33 115.64 124.83 3nse s THR 282 Ca 0.59 0.60 -0.11 0.00 0.31 0.00 0.00 61.69 63.08 3nse s THR 282 Cb -0.29 -4.22 0.05 0.00 0.01 0.00 0.00 72.50 68.06 3nse s THR 282 CO 0.28 -0.51 1.09 -2.16 -0.69 0.00 0.00 174.62 172.62 3nse s PRO 283 N 3.05 2.31 0.00 4.92 0.04 -1.26 -5.10 135.00 138.96 3nse s PRO 283 Ca 0.29 1.09 0.00 0.00 0.04 0.00 0.00 61.00 62.42 3nse s PRO 283 Cb -0.13 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.50 3nse s PRO 283 CO 0.19 -1.58 0.00 0.41 0.04 0.00 0.00 177.00 176.05 3nse n GLY 284 N -1.37 4.12 2.53 0.56 0.00 -1.26 -5.09 105.19 104.68 3nse n GLY 284 Ca 0.09 -2.02 -0.12 0.00 0.00 0.00 0.00 46.02 43.96 3nse n GLY 284 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3nse n ASN 285 N 0.00 -1.25 -4.29 1.61 5.15 -1.26 -5.06 115.26 110.17 3nse n ASN 285 Ca 0.00 -3.42 -0.15 0.00 -0.60 0.00 0.00 54.58 50.41 3nse n ASN 285 Cb 0.00 1.00 -0.10 0.00 -0.53 0.00 0.00 39.78 40.14 3nse n ASN 285 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3nse s GLY 286 N -1.68 1.40 0.42 8.20 0.00 -1.26 -5.04 107.32 109.36 3nse s GLY 286 Ca 0.29 -1.68 0.24 0.00 0.00 0.00 0.00 44.72 43.57 3nse s GLY 286 CO -0.07 -1.60 1.66 3.21 0.00 0.00 0.00 173.10 176.30 3nse h ARG 287 N 2.58 0.00 -1.66 2.90 3.08 -1.92 -3.38 114.38 115.98 3nse h ARG 287 Ca -0.37 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.16 3nse h ARG 287 Cb 1.22 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.85 3nse h ARG 287 CO 0.63 0.00 -0.91 1.19 -1.07 0.00 0.00 179.97 179.82 3nse n PHE 288 N -2.99 2.44 -3.12 3.04 3.72 -1.26 -4.27 117.46 115.03 3nse n PHE 288 Ca 0.04 -3.37 -0.41 0.00 -0.05 0.00 0.00 57.45 53.66 3nse n PHE 288 Cb 0.50 -0.31 -0.07 0.00 -0.94 0.00 0.00 39.48 38.66 3nse n PHE 288 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3nse s ASP 289 N -3.23 6.54 0.14 4.37 1.01 -1.26 -4.95 116.67 119.30 3nse s ASP 289 Ca 0.42 0.62 -0.31 0.00 0.71 0.00 0.00 52.55 53.99 3nse s ASP 289 Cb 0.38 -2.33 -0.08 0.00 1.01 0.00 0.00 42.92 41.90 3nse s ASP 289 CO -0.10 -0.39 1.36 -0.69 0.21 0.00 0.00 175.17 175.56 3nse s VAL 290 N 2.51 3.28 0.42 -1.27 1.01 -1.26 -0.53 120.40 124.56 3nse s VAL 290 Ca 0.25 0.96 -0.15 0.00 0.00 0.00 0.00 61.98 63.04 3nse s VAL 290 Cb -0.15 -3.61 -0.08 0.00 0.00 0.00 0.00 36.38 32.53 3nse s VAL 290 CO 0.09 0.10 0.85 -0.76 0.00 0.00 0.00 175.10 175.38 3nse s LEU 291 N 0.72 3.84 0.51 3.92 1.43 0.13 -4.86 118.68 124.37 3nse s LEU 291 Ca 0.62 1.37 -0.06 0.00 -1.03 0.00 0.00 54.13 55.03 3nse s LEU 291 Cb -0.37 -4.25 -0.04 0.00 0.03 0.00 0.00 46.19 41.57 3nse s LEU 291 CO 0.33 -0.41 0.83 -2.16 0.23 0.00 0.00 176.35 175.17 3nse s PRO 292 N -3.62 3.56 0.13 1.29 0.04 -1.26 -4.75 135.00 130.38 3nse s PRO 292 Ca 0.56 0.30 -0.23 0.00 0.04 0.00 0.00 61.00 61.67 3nse s PRO 292 Cb -0.10 -2.32 -0.07 0.00 0.04 0.00 0.00 34.50 32.04 3nse s PRO 292 CO 0.26 -0.27 0.70 -0.51 0.04 0.00 0.00 177.00 177.22 3nse s LEU 293 N -4.81 4.57 -0.60 -3.56 1.02 0.10 -4.88 118.68 110.53 3nse s LEU 293 Ca 0.49 1.51 -0.02 0.00 0.02 0.00 0.00 54.13 56.13 3nse s LEU 293 Cb -0.10 -3.15 0.15 0.00 0.02 0.00 0.00 46.19 43.11 3nse s LEU 293 CO 0.46 0.23 0.40 -0.22 0.02 0.00 0.00 176.35 177.25 3nse s LEU 294 N -1.13 5.12 -0.11 1.79 2.96 -1.26 -0.42 118.68 125.61 3nse s LEU 294 Ca 0.33 -2.83 -0.12 0.00 -0.22 0.00 0.00 54.13 51.30 3nse s LEU 294 Cb -0.22 -1.82 -0.05 0.00 0.50 0.00 0.00 46.19 44.60 3nse s LEU 294 CO 0.24 -0.36 0.26 -0.76 -1.32 0.00 0.00 176.35 174.41 3nse s LEU 295 N -0.02 4.34 -0.14 -0.68 1.43 -0.24 -1.60 118.68 121.76 3nse s LEU 295 Ca 0.16 0.58 0.01 0.00 -1.03 0.00 0.00 54.13 53.85 3nse s LEU 295 Cb -0.21 -2.31 0.02 0.00 0.03 0.00 0.00 46.19 43.72 3nse s LEU 295 CO -0.03 0.25 -0.16 -1.58 0.23 0.00 0.00 176.35 175.06 3nse s GLN 296 N -0.33 2.41 0.43 1.70 0.74 -0.02 -0.22 119.66 124.37 3nse s GLN 296 Ca 0.17 -0.61 -0.01 0.00 0.05 0.00 0.00 55.36 54.96 3nse s GLN 296 Cb -0.13 -2.14 -0.02 0.00 1.10 0.00 0.00 33.01 31.82 3nse s GLN 296 CO 0.06 -0.18 0.67 0.00 -0.55 0.00 0.00 175.29 175.28 3nse s ALA 297 N 1.31 3.62 -0.01 1.58 0.00 -1.26 -1.85 121.76 125.14 3nse s ALA 297 Ca 0.02 -0.86 -0.37 0.00 0.00 0.00 0.00 51.96 50.75 3nse s ALA 297 Cb -0.13 -2.26 -0.16 0.00 0.00 0.00 0.00 23.12 20.56 3nse s ALA 297 CO -0.08 -0.28 1.47 -2.30 0.00 0.00 0.00 175.76 174.57 3nse n PRO 298 N -2.05 1.21 -0.88 0.00 -0.02 -1.24 -2.33 135.00 129.69 3nse n PRO 298 Ca -0.01 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 3nse n PRO 298 Cb 0.57 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 3nse n PRO 298 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3nse n ASP 299 N 3.43 -4.50 -4.76 2.55 8.00 -1.26 -4.82 116.55 115.18 3nse n ASP 299 Ca 0.21 0.00 -0.25 0.00 0.71 0.00 0.00 54.79 55.46 3nse n ASP 299 Cb 0.18 -3.17 -0.06 0.00 -0.02 0.00 0.00 41.12 38.05 3nse n ASP 299 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3nse s GLU 300 N -1.71 2.75 0.63 -1.24 2.02 -0.98 -5.07 118.70 115.10 3nse s GLU 300 Ca 0.00 -1.03 -0.16 0.00 0.02 0.00 0.00 54.97 53.81 3nse s GLU 300 Cb 0.00 -2.52 -0.02 0.00 0.10 0.00 0.00 34.13 31.70 3nse s GLU 300 CO 0.00 0.44 1.10 0.00 0.02 0.00 0.00 175.26 176.82 3nse s ALA 301 N -1.92 2.56 0.32 5.21 0.00 -1.26 -4.56 121.76 122.11 3nse s ALA 301 Ca 0.31 0.56 -0.29 0.00 0.00 0.00 0.00 51.96 52.54 3nse s ALA 301 Cb -0.09 -3.31 -0.10 0.00 0.00 0.00 0.00 23.12 19.62 3nse s ALA 301 CO 0.23 -1.11 1.26 -1.25 0.00 0.00 0.00 175.76 174.89 3nse s PRO 302 N -3.96 4.41 -0.09 0.00 0.04 -1.26 -4.67 135.00 129.47 3nse s PRO 302 Ca 0.67 2.13 -0.03 0.00 0.04 0.00 0.00 61.00 63.82 3nse s PRO 302 Cb -0.20 -3.10 -0.03 0.00 0.04 0.00 0.00 34.50 31.21 3nse s PRO 302 CO 0.38 -0.11 0.02 -1.21 0.04 0.00 0.00 177.00 176.13 3nse s GLU 303 N -1.70 3.07 -0.05 4.56 2.02 0.70 -4.88 118.70 122.40 3nse s GLU 303 Ca 0.48 -0.36 -0.21 0.00 0.02 0.00 0.00 54.97 54.89 3nse s GLU 303 Cb -0.38 -2.86 -0.04 0.00 0.10 0.00 0.00 34.13 30.95 3nse s GLU 303 CO 0.50 0.71 0.62 -1.17 0.02 0.00 0.00 175.26 175.94 3nse s LEU 304 N -0.89 4.34 -0.04 1.80 2.96 -1.26 -1.08 118.68 124.51 3nse s LEU 304 Ca 0.13 1.10 0.01 0.00 -0.22 0.00 0.00 54.13 55.16 3nse s LEU 304 Cb -0.11 -2.95 0.02 0.00 0.50 0.00 0.00 46.19 43.64 3nse s LEU 304 CO 0.03 -0.02 -0.04 -0.36 -1.32 0.00 0.00 176.35 174.63 3nse s PHE 305 N 0.43 0.68 -0.25 5.38 0.08 0.43 -4.98 117.98 119.75 3nse s PHE 305 Ca 0.33 -0.17 -0.12 0.00 0.12 0.00 0.00 56.93 57.09 3nse s PHE 305 Cb -0.17 -0.60 -0.05 0.00 -0.57 0.00 0.00 43.02 41.63 3nse s PHE 305 CO 0.16 -0.16 0.25 0.08 -0.10 0.00 0.00 175.22 175.45 3nse s VAL 306 N 0.80 5.29 0.04 -0.44 1.01 -1.26 0.01 120.40 125.84 3nse s VAL 306 Ca -0.10 0.34 -0.31 0.00 0.00 0.00 0.00 61.98 61.91 3nse s VAL 306 Cb -0.13 -3.58 -0.06 0.00 0.00 0.00 0.00 36.38 32.60 3nse s VAL 306 CO 0.00 0.27 1.35 -0.76 0.00 0.00 0.00 175.10 175.96 3nse s LEU 307 N 1.46 4.34 0.19 3.92 1.43 -1.26 -4.96 118.68 123.79 3nse s LEU 307 Ca 0.11 2.14 -0.32 0.00 -1.03 0.00 0.00 54.13 55.03 3nse s LEU 307 Cb -0.15 -3.57 -0.12 0.00 0.03 0.00 0.00 46.19 42.38 3nse s LEU 307 CO 0.08 -0.65 1.72 -2.65 0.23 0.00 0.00 176.35 175.08 3nse n PRO 308 N 4.68 2.67 -0.25 1.29 -0.02 -1.26 -4.86 135.00 137.25 3nse n PRO 308 Ca 0.12 0.96 0.21 0.00 -2.02 0.00 0.00 63.50 62.77 3nse n PRO 308 Cb 0.44 -2.80 0.54 0.00 -0.02 0.00 0.00 33.50 31.66 3nse n PRO 308 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3nse h PRO 309 N 6.89 0.33 0.00 0.52 0.11 -1.93 0.23 132.00 138.15 3nse h PRO 309 Ca -0.44 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 3nse h PRO 309 Cb 1.21 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 3nse h PRO 309 CO 0.94 0.22 -0.02 1.05 -0.21 0.00 0.00 178.00 179.99 3nse h GLU 310 N 0.34 0.00 0.00 1.05 9.09 -2.04 -2.22 114.58 120.80 3nse h GLU 310 Ca 0.49 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 59.75 3nse h GLU 310 Cb 1.32 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 28.40 3nse h GLU 310 CO -0.17 0.02 -0.80 -0.07 0.05 0.00 0.00 179.01 178.03 3nse h LEU 311 N 0.00 0.00 -8.09 3.06 4.07 -1.30 -3.42 115.31 109.62 3nse h LEU 311 Ca -0.00 0.00 -0.73 0.00 0.08 0.00 0.00 57.88 57.23 3nse h LEU 311 Cb 0.32 0.00 -0.22 0.00 1.08 0.00 0.00 40.66 41.84 3nse h LEU 311 CO 0.00 0.69 0.03 -0.69 -1.08 0.00 0.00 178.44 177.39 3nse s VAL 312 N -2.86 5.03 0.01 1.22 1.01 -0.84 -4.85 120.40 119.13 3nse s VAL 312 Ca 0.02 -1.35 -0.30 0.00 0.00 0.00 0.00 61.98 60.35 3nse s VAL 312 Cb 0.08 -4.45 -0.04 0.00 0.00 0.00 0.00 36.38 31.98 3nse s VAL 312 CO 0.78 -1.05 1.05 -0.22 0.00 0.00 0.00 175.10 175.66 3nse s LEU 313 N 2.05 4.36 0.19 3.92 2.96 -1.26 -4.97 118.68 125.93 3nse s LEU 313 Ca 0.10 1.77 0.07 0.00 -0.22 0.00 0.00 54.13 55.85 3nse s LEU 313 Cb -0.24 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 42.83 3nse s LEU 313 CO 0.03 -0.34 -0.14 -1.61 -1.32 0.00 0.00 176.35 172.97 3nse s GLU 314 N 1.08 1.28 -0.17 1.98 2.02 -1.26 -1.57 118.70 122.06 3nse s GLU 314 Ca 0.54 -1.56 0.00 0.00 0.02 0.00 0.00 54.97 53.97 3nse s GLU 314 Cb -0.24 -1.04 0.04 0.00 0.10 0.00 0.00 34.13 32.99 3nse s GLU 314 CO 0.28 0.17 -0.08 0.08 0.02 0.00 0.00 175.26 175.73 3nse s VAL 315 N -2.99 1.36 0.07 2.63 1.01 0.43 -4.89 120.40 118.01 3nse s VAL 315 Ca 0.21 -0.75 -0.31 0.00 0.00 0.00 0.00 61.98 61.14 3nse s VAL 315 Cb -0.00 -1.45 -0.06 0.00 0.00 0.00 0.00 36.38 34.86 3nse s VAL 315 CO 0.06 0.20 1.22 -2.84 0.00 0.00 0.00 175.10 173.74 3nse s PRO 316 N 1.53 4.42 -0.05 2.72 0.02 -1.26 -1.81 135.00 140.56 3nse s PRO 316 Ca 0.01 1.81 -0.23 0.00 0.02 0.00 0.00 61.00 62.61 3nse s PRO 316 Cb -0.15 -3.33 -0.04 0.00 0.02 0.00 0.00 34.50 31.00 3nse s PRO 316 CO -0.08 -0.28 0.67 -0.51 -0.33 0.00 0.00 177.00 176.47 3nse s LEU 317 N 1.05 4.34 0.08 -5.54 1.43 0.09 -4.89 118.68 115.24 3nse s LEU 317 Ca 0.59 1.18 -0.00 0.00 -1.03 0.00 0.00 54.13 54.87 3nse s LEU 317 Cb -0.30 -3.04 -0.04 0.00 0.03 0.00 0.00 46.19 42.83 3nse s LEU 317 CO 0.29 -0.06 -0.03 -1.83 0.23 0.00 0.00 176.35 174.95 3nse s GLU 318 N 0.57 0.73 -0.06 1.70 -1.05 -1.26 -4.08 118.70 115.25 3nse s GLU 318 Ca 0.36 -1.29 -0.01 0.00 -0.15 0.00 0.00 54.97 53.88 3nse s GLU 318 Cb -0.18 0.06 -0.03 0.00 -0.44 0.00 0.00 34.13 33.54 3nse s GLU 318 CO 0.18 -0.09 0.01 -1.58 0.95 0.00 0.00 175.26 174.72 3nse s HIS 319 N -3.83 3.15 0.44 4.83 5.65 -1.26 -4.37 115.29 119.90 3nse s HIS 319 Ca 0.11 0.17 0.15 0.00 0.25 0.00 0.00 55.06 55.73 3nse s HIS 319 Cb 0.07 -1.75 1.05 0.00 -1.18 0.00 0.00 32.58 30.77 3nse s HIS 319 CO -0.07 0.47 1.96 -1.00 -0.65 0.00 0.00 174.74 175.46 3nse h PRO 320 N 4.87 0.38 0.00 2.88 0.13 -1.92 -3.35 132.00 135.00 3nse h PRO 320 Ca -0.50 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 3nse h PRO 320 Cb 1.19 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3nse h PRO 320 CO 0.56 0.25 -0.88 0.25 -0.23 0.00 0.00 178.00 177.95 3nse n THR 321 N -4.47 0.00 -2.49 1.56 -2.24 -1.26 -4.94 114.28 100.44 3nse n THR 321 Ca 0.11 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.49 3nse n THR 321 Cb 0.44 -0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 68.05 3nse n THR 321 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3nse s LEU 322 N -4.37 3.29 0.55 3.22 1.43 -1.26 -4.87 118.68 116.68 3nse s LEU 322 Ca 0.00 -0.76 0.22 0.00 -1.03 0.00 0.00 54.13 52.56 3nse s LEU 322 Cb 0.00 -2.56 1.47 0.00 0.03 0.00 0.00 46.19 45.13 3nse s LEU 322 CO 0.00 -1.81 2.16 -0.33 0.23 0.00 0.00 176.35 176.60 3nse h GLU 323 N 10.39 0.00 0.00 1.70 5.08 -1.92 -2.53 114.58 127.30 3nse h GLU 323 Ca -0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 3nse h GLU 323 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 3nse h GLU 323 CO 1.33 0.00 0.00 0.11 -1.00 0.00 0.00 179.01 179.45 3nse h TRP 324 N 0.00 0.00 -0.86 4.33 5.08 -1.95 -3.29 115.95 119.26 3nse h TRP 324 Ca 0.03 0.00 0.06 0.00 1.08 0.00 0.00 58.89 60.06 3nse h TRP 324 Cb 0.15 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.25 3nse h TRP 324 CO 0.00 0.00 0.54 0.35 -1.28 0.00 0.00 178.44 178.05 3nse h PHE 325 N 0.00 0.99 -0.63 0.12 3.04 -1.82 -1.36 116.94 117.28 3nse h PHE 325 Ca 0.00 0.03 0.06 0.00 3.98 0.00 0.00 57.97 62.04 3nse h PHE 325 Cb 0.64 -0.32 -0.04 0.00 2.56 0.00 0.00 35.95 38.79 3nse h PHE 325 CO 0.00 0.51 0.42 0.00 -2.02 0.00 0.00 178.31 177.21 3nse h ALA 326 N 1.40 1.79 0.00 2.41 0.00 -1.71 -0.92 119.26 122.23 3nse h ALA 326 Ca 0.37 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.26 3nse h ALA 326 Cb 0.16 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3nse h ALA 326 CO -0.17 0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.19 3nse h ALA 327 N 1.66 1.00 0.00 0.00 0.00 -1.45 -2.92 119.26 117.55 3nse h ALA 327 Ca 0.27 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 3nse h ALA 327 Cb 0.27 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 3nse h ALA 327 CO -0.08 0.00 -0.01 -0.07 0.00 0.00 0.00 179.25 179.09 3nse h LEU 328 N 0.00 0.00 0.44 0.00 4.07 -1.19 -3.46 115.31 115.16 3nse h LEU 328 Ca 0.00 0.00 -0.12 0.00 0.08 0.00 0.00 57.88 57.84 3nse h LEU 328 Cb 0.21 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 41.91 3nse h LEU 328 CO 0.00 0.01 -0.12 0.61 -1.08 0.00 0.00 178.44 177.86 3nse n GLY 329 N -0.27 0.65 3.87 0.83 0.00 -1.10 -5.02 105.19 104.14 3nse n GLY 329 Ca -0.00 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 3nse n GLY 329 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3nse s LEU 330 N -1.47 3.66 0.11 0.99 1.43 -1.26 -4.98 118.68 117.16 3nse s LEU 330 Ca 0.00 1.23 -0.26 0.00 -1.03 0.00 0.00 54.13 54.06 3nse s LEU 330 Cb 0.00 -4.16 0.08 0.00 0.03 0.00 0.00 46.19 42.14 3nse s LEU 330 CO 0.00 -0.54 1.06 0.00 0.23 0.00 0.00 176.35 177.10 3nse s ARG 331 N -4.25 0.98 -0.01 1.70 1.70 -1.26 -0.73 118.95 117.08 3nse s ARG 331 Ca 0.53 -0.56 -0.25 0.00 -0.47 0.00 0.00 55.73 54.98 3nse s ARG 331 Cb -0.10 0.33 0.05 0.00 -0.57 0.00 0.00 34.95 34.66 3nse s ARG 331 CO 0.37 -0.45 0.55 -0.46 -1.08 0.00 0.00 175.30 174.23 3nse s TRP 332 N -2.93 -0.48 0.59 5.89 -0.11 -0.75 -4.93 118.94 116.21 3nse s TRP 332 Ca 0.14 0.71 -0.13 0.00 1.22 0.00 0.00 56.10 58.04 3nse s TRP 332 Cb 0.00 0.33 -0.05 0.00 -1.50 0.00 0.00 33.47 32.25 3nse s TRP 332 CO 0.01 -0.58 1.02 1.52 -4.62 0.00 0.00 176.95 174.30 3nse s TYR 333 N -1.70 3.42 0.06 5.86 -0.85 -1.26 -0.43 117.35 122.44 3nse s TYR 333 Ca -0.09 1.40 -0.01 0.00 -0.52 0.00 0.00 57.07 57.84 3nse s TYR 333 Cb -0.01 -2.80 -0.27 0.00 0.38 0.00 0.00 41.96 39.26 3nse s TYR 333 CO 0.04 -0.70 1.07 0.00 -1.52 0.00 0.00 175.55 174.44 3nse h ALA 334 N 0.15 0.22 -2.42 9.51 0.00 -1.63 -3.46 119.26 121.63 3nse h ALA 334 Ca -0.45 -0.98 -0.66 0.00 0.00 0.00 0.00 54.91 52.82 3nse h ALA 334 Cb 1.19 0.07 -0.17 0.00 0.00 0.00 0.00 17.79 18.89 3nse h ALA 334 CO 0.61 1.09 -0.12 -1.17 0.00 0.00 0.00 179.25 179.66 3nse s LEU 335 N -6.98 4.54 -0.48 0.00 2.96 -1.26 -4.51 118.68 112.96 3nse s LEU 335 Ca -0.04 -0.31 -0.21 0.00 -0.22 0.00 0.00 54.13 53.35 3nse s LEU 335 Cb 0.08 -2.50 0.04 0.00 0.50 0.00 0.00 46.19 44.31 3nse s LEU 335 CO 0.86 -0.52 0.69 -2.16 -1.32 0.00 0.00 176.35 173.90 3nse s PRO 336 N 2.30 3.24 -0.29 0.98 0.04 -1.26 -4.68 135.00 135.34 3nse s PRO 336 Ca 0.16 -0.50 -0.01 0.00 0.04 0.00 0.00 61.00 60.69 3nse s PRO 336 Cb -0.16 -4.01 0.09 0.00 0.04 0.00 0.00 34.50 30.46 3nse s PRO 336 CO 0.14 -1.15 0.08 0.00 0.04 0.00 0.00 177.00 176.11 3nse s ALA 337 N 2.95 1.52 0.05 8.56 0.00 -1.26 -2.78 121.76 130.81 3nse s ALA 337 Ca 0.22 -1.56 -0.31 0.00 0.00 0.00 0.00 51.96 50.32 3nse s ALA 337 Cb -0.15 -1.57 -0.06 0.00 0.00 0.00 0.00 23.12 21.34 3nse s ALA 337 CO 0.17 -1.58 1.29 0.08 0.00 0.00 0.00 175.76 175.72 3nse s VAL 338 N 1.62 3.80 0.00 0.00 1.01 -0.24 -1.24 120.40 125.35 3nse s VAL 338 Ca 0.08 1.26 0.00 0.00 0.00 0.00 0.00 61.98 63.32 3nse s VAL 338 Cb -0.17 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.40 3nse s VAL 338 CO -0.22 0.07 0.29 -1.54 0.00 0.00 0.00 175.10 173.71 3nse n SER 339 N 4.31 0.59 -0.92 3.32 3.41 0.00 -1.33 113.62 122.99 3nse n SER 339 Ca 0.11 -0.84 0.09 0.00 -0.26 0.00 0.00 58.87 57.96 3nse n SER 339 Cb 0.45 0.21 0.19 0.00 -0.26 0.00 0.00 64.21 64.79 3nse n SER 339 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3nse n ASN 340 N -0.21 3.15 -4.86 4.04 2.04 -1.19 -4.48 115.26 113.76 3nse n ASN 340 Ca 0.00 -1.91 -0.33 0.00 -0.44 0.00 0.00 54.58 51.90 3nse n ASN 340 Cb 0.04 -0.24 -0.06 0.00 -2.53 0.00 0.00 39.78 36.99 3nse n ASN 340 CO 0.00 0.00 0.00 -0.04 -0.44 0.00 0.00 177.26 176.78 3nse s MET 341 N -1.17 3.87 -0.07 -3.83 -1.94 -1.26 -4.41 119.30 110.48 3nse s MET 341 Ca 0.32 0.38 -0.15 0.00 -1.71 0.00 0.00 55.69 54.53 3nse s MET 341 Cb 0.18 -2.68 -0.05 0.00 2.01 0.00 0.00 34.83 34.29 3nse s MET 341 CO 0.24 0.33 0.39 -1.17 -0.01 0.00 0.00 175.02 174.81 3nse s LEU 342 N -2.65 4.37 -0.31 -0.03 0.20 -0.24 -4.39 118.68 115.63 3nse s LEU 342 Ca 0.46 0.81 -0.11 0.00 0.69 0.00 0.00 54.13 55.99 3nse s LEU 342 Cb -0.12 -2.56 -0.02 0.00 -0.43 0.00 0.00 46.19 43.07 3nse s LEU 342 CO 0.20 0.19 0.19 -0.22 -0.29 0.00 0.00 176.35 176.42 3nse s LEU 343 N -0.30 4.22 -0.22 -0.68 2.96 -0.49 -0.97 118.68 123.20 3nse s LEU 343 Ca 0.23 -0.38 -0.05 0.00 -0.22 0.00 0.00 54.13 53.71 3nse s LEU 343 Cb -0.15 -2.07 -0.02 0.00 0.50 0.00 0.00 46.19 44.45 3nse s LEU 343 CO 0.10 -0.18 -0.01 -0.70 -1.32 0.00 0.00 176.35 174.25 3nse s GLU 344 N 1.68 3.49 -0.07 1.98 -6.30 -0.26 -0.07 118.70 119.15 3nse s GLU 344 Ca 0.06 -0.57 -0.01 0.00 -2.50 0.00 0.00 54.97 51.95 3nse s GLU 344 Cb -0.17 -3.10 0.03 0.00 0.00 0.00 0.00 34.13 30.88 3nse s GLU 344 CO 0.09 -0.16 -0.02 0.42 0.02 0.00 0.00 175.26 175.61 3nse s ILE 345 N 1.43 0.52 -1.71 -3.70 1.01 -0.50 -1.56 121.20 116.68 3nse s ILE 345 Ca 0.05 0.01 -0.18 0.00 0.00 0.00 0.00 60.65 60.52 3nse s ILE 345 Cb -0.15 -0.63 0.16 0.00 0.01 0.00 0.00 42.46 41.86 3nse s ILE 345 CO -0.00 0.27 0.76 0.61 0.00 0.00 0.00 174.94 176.58 3nse n GLY 346 N 4.92 -0.44 2.47 6.18 0.00 -1.26 -0.22 105.19 116.84 3nse n GLY 346 Ca -0.11 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3nse n GLY 346 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3nse n GLY 347 N -1.40 3.17 3.75 -0.02 0.00 -1.26 -3.22 105.19 106.22 3nse n GLY 347 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 3nse n GLY 347 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3nse s LEU 348 N 0.00 4.64 -0.21 0.99 1.43 0.69 -5.03 118.68 121.19 3nse s LEU 348 Ca 0.00 1.99 -0.03 0.00 -1.03 0.00 0.00 54.13 55.07 3nse s LEU 348 Cb 0.00 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 42.61 3nse s LEU 348 CO 0.00 0.12 -0.08 -1.61 0.23 0.00 0.00 176.35 175.01 3nse s GLU 349 N -1.21 3.30 -0.68 1.70 2.02 -1.26 -1.42 118.70 121.14 3nse s GLU 349 Ca 0.41 -0.67 -0.10 0.00 0.02 0.00 0.00 54.97 54.63 3nse s GLU 349 Cb -0.27 -2.89 0.18 0.00 0.10 0.00 0.00 34.13 31.25 3nse s GLU 349 CO 0.33 -0.17 0.58 -0.06 0.02 0.00 0.00 175.26 175.96 3nse s PHE 350 N 1.37 3.56 0.28 1.61 0.08 0.90 -0.00 117.98 125.77 3nse s PHE 350 Ca 0.05 -2.11 0.36 0.00 0.12 0.00 0.00 56.93 55.35 3nse s PHE 350 Cb -0.14 -3.59 1.84 0.00 -0.57 0.00 0.00 43.02 40.56 3nse s PHE 350 CO -0.05 -0.95 2.10 0.66 -0.10 0.00 0.00 175.22 176.88 3nse h SER 351 N 7.79 0.00 -3.23 1.36 4.64 -1.81 -1.29 113.55 121.01 3nse h SER 351 Ca -0.02 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.77 3nse h SER 351 Cb 1.03 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.72 3nse h SER 351 CO 0.79 0.00 -0.76 0.00 -0.87 0.00 0.00 176.83 175.98 3nse s ALA 352 N -3.86 1.09 -0.48 5.18 0.00 -1.18 -4.68 121.76 117.83 3nse s ALA 352 Ca -0.02 -0.90 0.06 0.00 0.00 0.00 0.00 51.96 51.10 3nse s ALA 352 Cb 0.11 -1.27 0.25 0.00 0.00 0.00 0.00 23.12 22.20 3nse s ALA 352 CO 0.40 -1.29 0.88 0.00 0.00 0.00 0.00 175.76 175.76 3nse n ALA 353 N 5.02 -1.11 -1.74 0.00 0.00 -1.26 -1.96 120.51 119.47 3nse n ALA 353 Ca -0.08 -1.54 -0.42 0.00 0.00 0.00 0.00 53.44 51.40 3nse n ALA 353 Cb 0.46 -1.29 -0.02 0.00 0.00 0.00 0.00 19.45 18.60 3nse n ALA 353 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3nse s PRO 354 N 0.53 4.11 0.11 0.00 0.04 -1.19 -4.69 135.00 133.90 3nse s PRO 354 Ca 0.31 2.61 0.07 0.00 0.04 0.00 0.00 61.00 64.04 3nse s PRO 354 Cb 0.23 -3.04 -0.04 0.00 0.04 0.00 0.00 34.50 31.70 3nse s PRO 354 CO -0.22 -0.70 -0.19 -0.59 0.04 0.00 0.00 177.00 175.34 3nse s PHE 355 N 0.48 1.65 0.07 0.56 -0.12 -0.44 -1.77 117.98 118.41 3nse s PHE 355 Ca 0.68 -0.45 -0.07 0.00 -0.05 0.00 0.00 56.93 57.04 3nse s PHE 355 Cb -0.49 -0.89 -0.01 0.00 -0.63 0.00 0.00 43.02 41.00 3nse s PHE 355 CO 0.42 0.19 0.14 -1.54 -0.05 0.00 0.00 175.22 174.38 3nse s SER 356 N -2.04 0.18 0.00 1.98 1.04 0.36 -1.08 113.70 114.13 3nse s SER 356 Ca 0.06 -0.65 0.00 0.00 0.48 0.00 0.00 55.95 55.84 3nse s SER 356 Cb -0.09 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.33 3nse s SER 356 CO 0.04 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.21 3nse n GLY 357 N 0.17 4.14 3.12 7.32 0.00 -1.12 -1.63 105.19 117.19 3nse n GLY 357 Ca -0.16 -0.42 -0.11 0.00 0.00 0.00 0.00 46.02 45.33 3nse n GLY 357 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3nse s TRP 358 N 2.95 0.09 0.69 1.61 -2.14 -1.26 -4.48 118.94 116.40 3nse s TRP 358 Ca 0.00 -0.25 -0.14 0.00 2.66 0.00 0.00 56.10 58.37 3nse s TRP 358 Cb 0.00 -0.07 0.02 0.00 -3.10 0.00 0.00 33.47 30.31 3nse s TRP 358 CO 0.00 -0.32 1.12 0.71 -2.66 0.00 0.00 176.95 175.80 3nse s TYR 359 N -1.83 2.53 -0.16 1.66 2.02 -1.26 -4.94 117.35 115.35 3nse s TYR 359 Ca -0.11 1.56 -0.05 0.00 -0.37 0.00 0.00 57.07 58.10 3nse s TYR 359 Cb -0.05 -3.19 -0.03 0.00 -0.40 0.00 0.00 41.96 38.28 3nse s TYR 359 CO -0.01 -1.83 -0.00 1.41 -1.57 0.00 0.00 175.55 173.55 3nse s MET 360 N -4.20 3.78 0.47 -0.62 -2.45 -1.26 -2.37 119.30 112.65 3nse s MET 360 Ca 0.67 -0.46 0.34 0.00 -1.25 0.00 0.00 55.69 54.99 3nse s MET 360 Cb -0.21 -3.02 1.48 0.00 1.25 0.00 0.00 34.83 34.33 3nse s MET 360 CO 0.44 0.25 1.64 0.66 1.05 0.00 0.00 175.02 179.07 3nse h SER 361 N 6.70 0.19 0.57 1.11 4.64 -1.06 -0.93 113.55 124.77 3nse h SER 361 Ca -0.33 0.09 -0.07 0.00 -0.47 0.00 0.00 61.79 61.02 3nse h SER 361 Cb 1.18 0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.34 3nse h SER 361 CO 0.65 -0.11 -0.31 0.71 -0.87 0.00 0.00 176.83 176.90 3nse h THR 362 N 0.08 0.93 -0.59 2.95 1.35 -1.95 -1.44 112.91 114.25 3nse h THR 362 Ca 0.80 -1.20 -0.04 0.00 -0.55 0.00 0.00 66.41 65.43 3nse h THR 362 Cb 2.70 1.71 -0.03 0.00 -1.73 0.00 0.00 68.15 70.80 3nse h THR 362 CO -0.29 0.31 0.22 -0.33 -0.25 0.00 0.00 175.52 175.17 3nse h GLU 363 N 0.00 0.86 0.00 4.72 5.08 -1.57 -0.89 114.58 122.78 3nse h GLU 363 Ca -0.00 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3nse h GLU 363 Cb 0.68 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.79 3nse h GLU 363 CO 0.04 0.72 -0.27 0.82 -1.00 0.00 0.00 179.01 179.32 3nse h ILE 364 N 0.84 0.00 -0.51 3.13 2.04 -1.63 -0.39 117.51 121.00 3nse h ILE 364 Ca 0.20 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.27 3nse h ILE 364 Cb 0.19 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.24 3nse h ILE 364 CO -0.02 0.00 0.21 1.23 0.00 0.00 0.00 178.15 179.58 3nse h GLY 365 N -0.77 0.77 0.00 5.37 0.00 -1.38 -0.29 103.07 106.77 3nse h GLY 365 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.96 3nse h GLY 365 CO 0.00 0.35 -0.63 2.41 0.00 0.00 0.00 176.54 178.67 3nse n THR 366 N -4.36 1.03 0.30 4.70 -1.04 -0.43 -3.93 114.28 110.55 3nse n THR 366 Ca 0.04 0.26 -0.12 0.00 -2.04 0.00 0.00 64.05 62.19 3nse n THR 366 Cb 0.15 -2.10 -0.06 0.00 -1.82 0.00 0.00 70.33 66.50 3nse n THR 366 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 3nse h ARG 367 N -0.70 -0.78 -0.37 -2.82 2.47 -1.39 -0.86 114.38 109.93 3nse h ARG 367 Ca 0.00 0.05 -0.01 0.00 -1.26 0.00 0.00 59.98 58.76 3nse h ARG 367 Cb 0.63 0.18 -0.02 0.00 -1.65 0.00 0.00 29.97 29.11 3nse h ARG 367 CO 0.00 -0.52 0.18 -0.91 0.56 0.00 0.00 179.97 179.28 3nse h ASN 368 N -1.21 0.48 0.65 7.04 2.35 -1.02 -1.92 115.58 121.95 3nse h ASN 368 Ca -0.08 -0.12 -0.27 0.00 -0.55 0.00 0.00 56.30 55.28 3nse h ASN 368 Cb 0.62 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.83 3nse h ASN 368 CO 0.14 0.47 -1.45 -0.07 -1.65 0.00 0.00 177.43 174.87 3nse h LEU 369 N 0.46 0.06 -0.08 1.61 3.38 -1.20 -2.70 115.31 116.85 3nse h LEU 369 Ca 0.13 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3nse h LEU 369 Cb 0.11 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.84 3nse h LEU 369 CO -0.02 1.08 -0.66 0.00 0.09 0.00 0.00 178.44 178.93 3nse s ASP 371 N -2.34 6.44 0.39 0.00 1.11 -0.72 -4.50 116.67 117.04 3nse s ASP 371 Ca 0.06 2.96 0.09 0.00 0.18 0.00 0.00 52.55 55.84 3nse s ASP 371 Cb 0.11 -2.66 0.85 0.00 1.07 0.00 0.00 42.92 42.29 3nse s ASP 371 CO 0.59 -0.79 1.96 1.55 1.18 0.00 0.00 175.17 179.65 3nse h PRO 372 N 3.08 0.60 -0.50 8.23 0.13 -1.94 -1.43 132.00 140.17 3nse h PRO 372 Ca -0.50 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.59 3nse h PRO 372 Cb 1.24 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3nse h PRO 372 CO 0.64 0.40 0.00 -2.39 -0.23 0.00 0.00 178.00 176.42 3nse n HIS 373 N -4.48 0.71 0.00 1.56 1.44 -1.26 -4.60 115.22 108.58 3nse n HIS 373 Ca 0.11 -0.32 0.00 0.00 -2.01 0.00 0.00 57.72 55.50 3nse n HIS 373 Cb 0.29 -0.07 0.00 0.00 0.12 0.00 0.00 29.99 30.33 3nse n HIS 373 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 3nse n ARG 374 N 0.71 2.22 0.28 -1.40 5.12 -0.56 -4.26 116.66 118.76 3nse n ARG 374 Ca 0.15 0.00 0.13 0.00 -1.93 0.00 0.00 57.85 56.20 3nse n ARG 374 Cb 0.46 0.00 0.83 0.00 -1.16 0.00 0.00 32.46 32.59 3nse n ARG 374 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 3nse h TYR 375 N 0.00 0.00 -6.82 -1.55 -1.99 -1.62 -3.43 116.97 101.55 3nse h TYR 375 Ca 0.00 0.00 -0.57 0.00 2.00 0.00 0.00 58.73 60.16 3nse h TYR 375 Cb 0.00 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 38.67 3nse h TYR 375 CO 0.00 0.00 -0.98 -1.71 -0.00 0.00 0.00 178.16 175.47 3nse n ASN 376 N -4.06 -2.50 -0.84 3.88 4.05 -0.83 -4.87 115.26 110.10 3nse n ASN 376 Ca -0.03 -1.22 0.11 0.00 0.45 0.00 0.00 54.58 53.90 3nse n ASN 376 Cb 0.09 -2.07 0.29 0.00 1.23 0.00 0.00 39.78 39.32 3nse n ASN 376 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 3nse n ILE 377 N -4.74 0.29 -0.16 -1.44 -5.35 -0.73 -4.56 119.36 102.67 3nse n ILE 377 Ca -0.19 -0.52 -0.02 0.00 -0.27 0.00 0.00 62.75 61.75 3nse n ILE 377 Cb 0.62 0.76 0.06 0.00 -1.74 0.00 0.00 39.64 39.33 3nse n ILE 377 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 3nse h LEU 378 N 3.43 -0.25 -0.55 7.28 5.85 -1.85 -2.03 115.31 127.19 3nse h LEU 378 Ca 0.00 0.13 -0.09 0.00 0.84 0.00 0.00 57.88 58.76 3nse h LEU 378 Cb 0.75 0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 3nse h LEU 378 CO 0.00 -0.09 -0.00 -0.08 -0.34 0.00 0.00 178.44 177.93 3nse h GLU 379 N 0.10 0.97 -0.01 1.25 4.81 -1.97 -1.58 114.58 118.14 3nse h GLU 379 Ca 0.25 -0.31 0.02 0.00 -0.13 0.00 0.00 59.36 59.19 3nse h GLU 379 Cb 0.38 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 3nse h GLU 379 CO -0.44 0.98 -0.09 -0.44 -0.73 0.00 0.00 179.01 178.29 3nse h ASP 380 N 0.85 -0.25 -0.25 1.04 3.32 -1.74 -0.19 116.42 119.20 3nse h ASP 380 Ca 0.15 0.04 -0.08 0.00 0.02 0.00 0.00 57.03 57.16 3nse h ASP 380 Cb 0.54 0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.19 3nse h ASP 380 CO 0.03 -0.13 -0.11 0.58 -1.72 0.00 0.00 179.24 177.89 3nse h VAL 381 N -0.15 1.25 -0.64 -1.35 2.07 -1.34 -2.14 116.25 113.94 3nse h VAL 381 Ca 0.04 -1.10 -0.08 0.00 0.82 0.00 0.00 66.70 66.37 3nse h VAL 381 Cb 0.20 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 3nse h VAL 381 CO -0.10 0.37 0.07 0.00 0.02 0.00 0.00 177.57 177.94 3nse h ALA 382 N 1.29 0.85 -0.45 1.67 0.00 -0.92 -0.55 119.26 121.15 3nse h ALA 382 Ca 0.10 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 3nse h ALA 382 Cb 0.54 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3nse h ALA 382 CO 0.03 0.64 0.05 0.28 0.00 0.00 0.00 179.25 180.26 3nse h VAL 383 N 0.99 1.22 -0.04 0.00 2.07 -0.81 -0.64 116.25 119.04 3nse h VAL 383 Ca 0.19 -0.84 -0.12 0.00 0.82 0.00 0.00 66.70 66.75 3nse h VAL 383 Cb 0.48 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 3nse h VAL 383 CO 0.02 0.30 -0.53 0.00 0.02 0.00 0.00 177.57 177.38 3nse n MET 385 N -3.92 1.08 -3.49 0.00 2.81 -0.26 -4.93 117.12 108.41 3nse n MET 385 Ca -0.02 -0.35 -0.18 0.00 -1.81 0.00 0.00 57.70 55.34 3nse n MET 385 Cb 0.55 -1.49 0.08 0.00 -0.71 0.00 0.00 33.22 31.64 3nse n MET 385 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3nse n ASP 386 N -0.65 -1.92 -4.95 7.83 2.03 -0.35 -5.02 116.55 113.51 3nse n ASP 386 Ca 0.19 -0.66 -0.24 0.00 0.52 0.00 0.00 54.79 54.60 3nse n ASP 386 Cb 0.23 -4.89 -0.03 0.00 -0.72 0.00 0.00 41.12 35.72 3nse n ASP 386 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3nse s LEU 387 N -6.45 4.32 -0.85 -2.67 1.43 -0.57 -5.03 118.68 108.86 3nse s LEU 387 Ca 0.01 0.14 -0.25 0.00 -1.03 0.00 0.00 54.13 53.01 3nse s LEU 387 Cb -0.01 -2.91 0.02 0.00 0.03 0.00 0.00 46.19 43.32 3nse s LEU 387 CO 0.75 -0.01 1.52 -0.62 0.23 0.00 0.00 176.35 178.22 3nse s ASP 388 N -3.55 6.01 0.00 2.29 -1.08 -1.26 -4.74 116.67 114.34 3nse s ASP 388 Ca 0.35 -0.75 0.10 0.00 -0.52 0.00 0.00 52.55 51.73 3nse s ASP 388 Cb -0.10 -2.56 0.35 0.00 -1.46 0.00 0.00 42.92 39.15 3nse s ASP 388 CO 0.29 -1.93 1.27 0.35 0.52 0.00 0.00 175.17 175.67 3nse n THR 389 N 6.91 0.30 0.06 1.71 -2.24 -1.26 -3.68 114.28 116.08 3nse n THR 389 Ca 0.22 -0.32 0.04 0.00 -2.27 0.00 0.00 64.05 61.72 3nse n THR 389 Cb 0.50 0.17 -0.05 0.00 -2.10 0.00 0.00 70.33 68.85 3nse n THR 389 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3nse n ARG 390 N 0.20 0.61 -4.88 -0.78 3.00 -1.26 -4.89 116.66 108.66 3nse n ARG 390 Ca 0.10 0.19 -0.26 0.00 -0.01 0.00 0.00 57.85 57.86 3nse n ARG 390 Cb 0.22 -1.82 -0.16 0.00 0.00 0.00 0.00 32.46 30.71 3nse n ARG 390 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 3nse s THR 391 N -3.09 1.47 0.16 0.55 -1.32 -1.24 -5.04 115.64 107.13 3nse s THR 391 Ca -0.02 -0.76 -0.14 0.00 -1.21 0.00 0.00 61.69 59.56 3nse s THR 391 Cb 0.09 -1.25 0.04 0.00 -1.51 0.00 0.00 72.50 69.87 3nse s THR 391 CO 0.80 0.42 1.72 0.71 -2.21 0.00 0.00 174.62 176.06 3nse h THR 392 N 5.01 1.21 0.00 5.08 1.35 -1.90 -3.12 112.91 120.54 3nse h THR 392 Ca -0.35 -0.64 0.00 0.00 -0.55 0.00 0.00 66.41 64.87 3nse h THR 392 Cb 1.16 0.67 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 3nse h THR 392 CO 0.48 0.25 0.00 -1.54 -0.25 0.00 0.00 175.52 174.45 3nse n SER 393 N -4.55 0.00 0.07 5.36 3.41 -1.26 -1.12 113.62 115.52 3nse n SER 393 Ca 0.02 0.19 0.13 0.00 -0.26 0.00 0.00 58.87 58.95 3nse n SER 393 Cb 0.15 -0.20 0.34 0.00 -0.26 0.00 0.00 64.21 64.24 3nse n SER 393 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3nse n SER 394 N -1.20 0.64 -3.31 4.04 3.41 -1.18 -4.94 113.62 111.08 3nse n SER 394 Ca 0.00 0.34 -0.24 0.00 -0.26 0.00 0.00 58.87 58.71 3nse n SER 394 Cb 0.00 -0.33 0.05 0.00 -0.26 0.00 0.00 64.21 63.67 3nse n SER 394 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3nse n LEU 395 N -2.04 -2.83 0.16 1.04 4.77 -0.28 -4.90 117.00 112.93 3nse n LEU 395 Ca 0.05 -0.42 0.04 0.00 -0.03 0.00 0.00 56.01 55.65 3nse n LEU 395 Cb 0.41 -2.90 0.44 0.00 -2.33 0.00 0.00 43.42 39.04 3nse n LEU 395 CO 0.32 0.39 0.90 4.11 -1.33 0.00 0.00 177.39 181.78 3nse h TRP 396 N -1.86 0.14 -0.26 -1.77 5.08 -1.84 -0.52 115.95 114.92 3nse h TRP 396 Ca -0.54 -0.01 -0.10 0.00 1.08 0.00 0.00 58.89 59.31 3nse h TRP 396 Cb 1.36 -0.04 -0.00 0.00 -3.00 0.00 0.00 29.16 27.48 3nse h TRP 396 CO 0.53 0.28 -0.23 0.87 -1.28 0.00 0.00 178.44 178.62 3nse h LYS 397 N 0.13 0.62 -0.61 0.12 1.57 -1.90 -1.84 116.57 114.65 3nse h LYS 397 Ca 0.03 -0.32 -0.06 0.00 -1.87 0.00 0.00 60.65 58.43 3nse h LYS 397 Cb 0.34 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.64 3nse h LYS 397 CO 0.02 0.91 0.14 -0.44 -0.57 0.00 0.00 179.45 179.52 3nse h ASP 398 N 0.34 0.92 -0.09 0.86 5.19 -1.83 -1.23 116.42 120.57 3nse h ASP 398 Ca 0.04 -0.24 -0.02 0.00 -0.62 0.00 0.00 57.03 56.20 3nse h ASP 398 Cb 0.79 -0.24 -0.00 0.00 0.18 0.00 0.00 39.33 40.05 3nse h ASP 398 CO 0.06 0.92 -0.01 0.11 -3.12 0.00 0.00 179.24 177.20 3nse h LYS 399 N 0.88 0.17 -0.26 3.56 1.57 -1.08 -2.56 116.57 118.86 3nse h LYS 399 Ca 0.19 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 3nse h LYS 399 Cb 0.36 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 3nse h LYS 399 CO 0.00 0.46 0.12 0.00 -0.57 0.00 0.00 179.45 179.46 3nse h ALA 400 N 0.71 0.33 -0.74 3.86 0.00 -1.28 -2.43 119.26 119.70 3nse h ALA 400 Ca 0.03 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 54.92 3nse h ALA 400 Cb 0.39 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 3nse h ALA 400 CO 0.01 -0.10 0.49 0.00 0.00 0.00 0.00 179.25 179.64 3nse h ALA 401 N 0.98 1.75 -0.32 0.00 0.00 -1.27 -0.37 119.26 120.03 3nse h ALA 401 Ca 0.09 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 3nse h ALA 401 Cb 0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3nse h ALA 401 CO -0.01 0.12 0.02 0.28 0.00 0.00 0.00 179.25 179.66 3nse h VAL 402 N 0.72 1.25 -0.12 0.00 2.07 -1.00 -2.00 116.25 117.17 3nse h VAL 402 Ca 0.33 -0.90 -0.10 0.00 0.82 0.00 0.00 66.70 66.85 3nse h VAL 402 Cb 0.35 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 3nse h VAL 402 CO -0.11 0.29 -0.37 -0.33 0.02 0.00 0.00 177.57 177.07 3nse h GLU 403 N 0.36 0.24 -0.47 1.57 4.39 -1.07 -1.33 114.58 118.28 3nse h GLU 403 Ca 0.09 -0.11 -0.13 0.00 0.34 0.00 0.00 59.36 59.55 3nse h GLU 403 Cb 0.40 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 3nse h GLU 403 CO 0.01 0.59 -0.23 0.82 -1.16 0.00 0.00 179.01 179.04 3nse h ILE 404 N 0.21 1.27 -0.29 3.13 2.04 -0.92 -0.90 117.51 122.04 3nse h ILE 404 Ca 0.02 -1.40 -0.13 0.00 1.00 0.00 0.00 64.86 64.36 3nse h ILE 404 Cb 0.76 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 3nse h ILE 404 CO 0.06 0.48 -0.34 0.78 0.00 0.00 0.00 178.15 179.12 3nse h ASN 405 N 0.84 0.68 -0.52 1.72 2.35 -1.07 -2.21 115.58 117.37 3nse h ASN 405 Ca 0.11 -0.28 -0.08 0.00 -0.55 0.00 0.00 56.30 55.50 3nse h ASN 405 Cb 0.81 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.97 3nse h ASN 405 CO 0.07 0.96 0.04 0.25 -1.65 0.00 0.00 177.43 177.10 3nse h LEU 406 N 0.55 0.91 -0.74 1.61 5.85 -1.10 -2.18 115.31 120.21 3nse h LEU 406 Ca 0.06 -0.22 -0.06 0.00 0.84 0.00 0.00 57.88 58.50 3nse h LEU 406 Cb 0.85 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 3nse h LEU 406 CO 0.07 0.94 0.23 0.00 -0.34 0.00 0.00 178.44 179.34 3nse h ALA 407 N 1.16 0.96 -0.21 1.25 0.00 -0.84 -0.21 119.26 121.38 3nse h ALA 407 Ca 0.17 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3nse h ALA 407 Cb 0.46 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3nse h ALA 407 CO 0.02 0.65 0.08 0.28 0.00 0.00 0.00 179.25 180.28 3nse h VAL 408 N 1.09 1.17 -0.55 0.00 2.07 -1.11 -0.49 116.25 118.43 3nse h VAL 408 Ca 0.24 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 3nse h VAL 408 Cb 0.31 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 3nse h VAL 408 CO -0.01 0.17 0.26 -0.07 0.02 0.00 0.00 177.57 177.94 3nse h LEU 409 N 0.18 0.73 -0.47 2.57 3.38 -1.23 -1.65 115.31 118.81 3nse h LEU 409 Ca 0.07 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 3nse h LEU 409 Cb 0.19 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3nse h LEU 409 CO -0.00 0.66 0.07 -0.74 0.09 0.00 0.00 178.44 178.52 3nse h HIS 410 N 0.74 0.84 -0.51 1.13 2.76 -0.93 -1.95 115.15 117.23 3nse h HIS 410 Ca 0.19 -0.12 -0.05 0.00 -2.20 0.00 0.00 60.37 58.19 3nse h HIS 410 Cb 0.13 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 28.84 3nse h HIS 410 CO -0.00 0.78 0.13 0.77 -1.30 0.00 0.00 177.93 178.31 3nse h SER 411 N 0.65 0.76 -0.36 3.26 0.02 -0.90 -1.79 113.55 115.20 3nse h SER 411 Ca 0.14 -0.23 -0.17 0.00 -0.84 0.00 0.00 61.79 60.70 3nse h SER 411 Cb 0.40 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.73 3nse h SER 411 CO 0.01 0.79 -0.44 -0.26 -1.14 0.00 0.00 176.83 175.79 3nse h PHE 412 N 0.70 1.13 -0.28 3.45 -1.00 -1.28 -1.70 116.94 117.95 3nse h PHE 412 Ca 0.16 -0.36 -0.09 0.00 2.81 0.00 0.00 57.97 60.49 3nse h PHE 412 Cb 0.32 -0.23 -0.01 0.00 3.61 0.00 0.00 35.95 39.64 3nse h PHE 412 CO 0.02 1.19 -0.22 1.96 -1.61 0.00 0.00 178.31 179.65 3nse h GLN 413 N 0.74 0.52 -0.06 1.51 4.20 -1.33 -0.49 115.11 120.21 3nse h GLN 413 Ca 0.05 -0.19 -0.02 0.00 0.06 0.00 0.00 58.65 58.55 3nse h GLN 413 Cb 1.04 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.78 3nse h GLN 413 CO 0.10 0.71 -0.04 1.25 -0.67 0.00 0.00 178.83 180.19 3nse h LEU 414 N 0.47 0.14 0.00 1.46 5.85 -1.27 -2.94 115.31 119.01 3nse h LEU 414 Ca 0.07 -0.44 0.00 0.00 0.84 0.00 0.00 57.88 58.35 3nse h LEU 414 Cb 0.64 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.63 3nse h LEU 414 CO 0.05 0.55 0.00 0.00 -0.34 0.00 0.00 178.44 178.69 3nse n ALA 415 N -2.35 2.34 -2.74 1.25 0.00 -0.64 -4.87 120.51 113.49 3nse n ALA 415 Ca -0.07 -0.11 -0.21 0.00 0.00 0.00 0.00 53.44 53.04 3nse n ALA 415 Cb 0.27 -1.28 0.02 0.00 0.00 0.00 0.00 19.45 18.45 3nse n ALA 415 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3nse n LYS 416 N -0.87 -3.47 -4.18 0.00 4.76 -0.86 -4.95 118.16 108.58 3nse n LYS 416 Ca 0.13 0.94 -0.35 0.00 -2.87 0.00 0.00 58.31 56.17 3nse n LYS 416 Cb 0.06 -5.70 -0.08 0.00 -1.84 0.00 0.00 35.03 27.47 3nse n LYS 416 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3nse s VAL 417 N -3.11 4.69 0.19 -0.18 1.01 -0.25 -4.31 120.40 118.44 3nse s VAL 417 Ca 0.17 -0.22 -0.31 0.00 0.00 0.00 0.00 61.98 61.62 3nse s VAL 417 Cb -0.08 -3.05 -0.10 0.00 0.00 0.00 0.00 36.38 33.16 3nse s VAL 417 CO 0.21 0.52 1.48 -0.89 0.00 0.00 0.00 175.10 176.42 3nse s THR 418 N -1.02 2.76 0.07 3.92 2.01 0.29 -4.33 115.64 119.34 3nse s THR 418 Ca 0.17 0.58 -0.25 0.00 0.31 0.00 0.00 61.69 62.50 3nse s THR 418 Cb -0.12 -3.37 0.07 0.00 0.01 0.00 0.00 72.50 69.08 3nse s THR 418 CO 0.07 0.07 0.60 -0.51 -0.69 0.00 0.00 174.62 174.16 3nse s ILE 419 N 0.64 0.01 -0.03 1.82 2.07 -1.26 -4.45 121.20 120.00 3nse s ILE 419 Ca 0.64 -0.07 0.01 0.00 -1.41 0.00 0.00 60.65 59.83 3nse s ILE 419 Cb -0.42 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.19 3nse s ILE 419 CO 0.36 -0.04 -0.04 0.54 -1.91 0.00 0.00 174.94 173.86 3nse s VAL 420 N -2.63 0.42 0.76 4.00 0.11 -1.00 -4.99 120.40 117.06 3nse s VAL 420 Ca -0.04 -0.09 -0.11 0.00 -2.93 0.00 0.00 61.98 58.80 3nse s VAL 420 Cb -0.01 -0.44 0.05 0.00 -1.53 0.00 0.00 36.38 34.45 3nse s VAL 420 CO -0.03 0.18 1.08 1.51 -3.33 0.00 0.00 175.10 174.51 3nse s ASP 421 N 0.69 4.81 0.51 3.54 1.47 -1.26 -0.43 116.67 126.00 3nse s ASP 421 Ca -0.08 1.48 0.26 0.00 1.18 0.00 0.00 52.55 55.39 3nse s ASP 421 Cb -0.12 -2.27 1.36 0.00 -0.34 0.00 0.00 42.92 41.56 3nse s ASP 421 CO -0.00 -1.79 2.04 1.12 0.68 0.00 0.00 175.17 177.22 3nse h HIS 422 N -0.96 0.00 0.13 2.11 -0.00 -1.97 -1.56 115.15 112.91 3nse h HIS 422 Ca -0.46 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 59.91 3nse h HIS 422 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.65 3nse h HIS 422 CO 0.54 0.14 -0.06 0.45 -0.00 0.00 0.00 177.93 178.99 3nse h HIS 423 N 0.00 -0.16 -0.71 6.12 3.86 -1.98 -2.74 115.15 119.53 3nse h HIS 423 Ca -0.00 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 3nse h HIS 423 Cb 0.39 0.05 -0.03 0.00 1.06 0.00 0.00 27.41 28.88 3nse h HIS 423 CO 0.00 0.31 0.31 0.00 0.86 0.00 0.00 177.93 179.41 3nse h ALA 424 N -0.12 0.92 -0.33 2.45 0.00 -1.94 -1.59 119.26 118.66 3nse h ALA 424 Ca -0.02 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.73 3nse h ALA 424 Cb 0.54 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3nse h ALA 424 CO 0.03 0.52 0.20 0.00 0.00 0.00 0.00 179.25 180.00 3nse h ALA 425 N 1.15 0.41 -0.14 0.00 0.00 -1.37 -1.46 119.26 117.86 3nse h ALA 425 Ca 0.24 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 3nse h ALA 425 Cb 0.17 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3nse h ALA 425 CO -0.02 -0.14 -0.51 1.79 0.00 0.00 0.00 179.25 180.36 3nse h THR 426 N 0.42 1.34 -0.19 0.00 1.35 -1.34 -1.60 112.91 112.88 3nse h THR 426 Ca 0.13 -1.75 -0.09 0.00 -0.55 0.00 0.00 66.41 64.15 3nse h THR 426 Cb -0.02 1.78 -0.01 0.00 -1.73 0.00 0.00 68.15 68.17 3nse h THR 426 CO -0.04 0.53 -0.26 0.58 -0.25 0.00 0.00 175.52 176.08 3nse h VAL 427 N 0.30 1.26 0.00 6.82 2.07 -1.01 -2.12 116.25 123.56 3nse h VAL 427 Ca 0.01 -1.22 -0.12 0.00 0.82 0.00 0.00 66.70 66.20 3nse h VAL 427 Cb 1.00 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 3nse h VAL 427 CO 0.09 0.38 -0.55 0.77 0.02 0.00 0.00 177.57 178.27 3nse h SER 428 N 0.32 0.00 0.64 0.57 4.64 -1.01 -3.03 113.55 115.68 3nse h SER 428 Ca 0.05 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.24 3nse h SER 428 Cb 0.63 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.71 3nse h SER 428 CO 0.05 0.55 -0.61 0.15 -0.87 0.00 0.00 176.83 176.10 3nse h PHE 429 N 0.00 0.00 -0.57 4.77 3.57 -0.86 -1.46 116.94 122.40 3nse h PHE 429 Ca -0.01 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.40 3nse h PHE 429 Cb 1.31 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.03 3nse h PHE 429 CO 0.00 0.61 -0.02 0.52 -2.23 0.00 0.00 178.31 177.19 3nse h MET 430 N 0.00 1.02 -0.48 1.11 2.86 -1.31 -0.33 114.93 117.80 3nse h MET 430 Ca -0.01 -0.34 -0.07 0.00 -2.06 0.00 0.00 59.70 57.23 3nse h MET 430 Cb 1.10 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.65 3nse h MET 430 CO 0.08 1.02 0.03 -0.22 1.06 0.00 0.00 176.91 178.89 3nse h LYS 431 N 0.91 0.78 -0.50 1.72 1.63 -1.38 -1.96 116.57 117.77 3nse h LYS 431 Ca 0.16 -0.19 -0.08 0.00 -0.85 0.00 0.00 60.65 59.69 3nse h LYS 431 Cb 0.58 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.09 3nse h LYS 431 CO 0.03 0.76 -0.01 1.25 -3.45 0.00 0.00 179.45 178.04 3nse h HIS 432 N 0.74 0.90 -0.75 1.91 2.76 -0.76 -1.92 115.15 118.03 3nse h HIS 432 Ca 0.15 -0.13 -0.05 0.00 -2.20 0.00 0.00 60.37 58.14 3nse h HIS 432 Cb 0.40 -0.24 -0.03 0.00 1.55 0.00 0.00 27.41 29.08 3nse h HIS 432 CO 0.02 0.83 0.27 -0.07 -1.30 0.00 0.00 177.93 177.68 3nse h LEU 433 N 0.78 1.05 -0.16 0.26 3.38 -0.36 0.13 115.31 120.39 3nse h LEU 433 Ca 0.15 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3nse h LEU 433 Cb 0.48 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3nse h LEU 433 CO 0.02 0.96 0.03 0.44 0.09 0.00 0.00 178.44 179.98 3nse h ASP 434 N 1.09 0.25 -0.21 -0.43 3.32 -1.12 -0.90 116.42 118.42 3nse h ASP 434 Ca 0.25 -0.26 0.04 0.00 0.02 0.00 0.00 57.03 57.07 3nse h ASP 434 Cb 0.25 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 3nse h ASP 434 CO -0.02 0.44 -0.00 0.78 -1.72 0.00 0.00 179.24 178.72 3nse h ASN 435 N 0.05 -0.09 0.53 6.45 2.35 -1.08 -1.94 115.58 121.85 3nse h ASN 435 Ca 0.05 0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.80 3nse h ASN 435 Cb 0.30 0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.75 3nse h ASN 435 CO 0.00 -0.02 -0.21 -0.33 -1.65 0.00 0.00 177.43 175.23 3nse h GLU 436 N 0.06 0.00 -0.22 0.81 4.39 -0.93 -0.23 114.58 118.46 3nse h GLU 436 Ca 0.10 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.76 3nse h GLU 436 Cb 0.13 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 3nse h GLU 436 CO -0.17 0.21 -0.01 0.37 -1.16 0.00 0.00 179.01 178.24 3nse h GLN 437 N 0.00 0.40 -0.25 2.33 5.75 -0.38 -0.23 115.11 122.73 3nse h GLN 437 Ca -0.00 -0.14 -0.12 0.00 -0.15 0.00 0.00 58.65 58.24 3nse h GLN 437 Cb 0.53 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 29.04 3nse h GLN 437 CO 0.03 0.60 -0.33 0.87 -2.65 0.00 0.00 178.83 177.35 3nse h LYS 438 N 0.16 0.66 0.27 1.69 1.57 -1.18 -0.50 116.57 119.25 3nse h LYS 438 Ca 0.06 -0.38 -0.01 0.00 -1.87 0.00 0.00 60.65 58.45 3nse h LYS 438 Cb 0.43 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.77 3nse h LYS 438 CO 0.01 0.99 -0.13 0.00 -0.57 0.00 0.00 179.45 179.76 3nse h ALA 439 N 0.66 -0.36 -0.00 3.86 0.00 -1.04 -3.39 119.26 118.98 3nse h ALA 439 Ca 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3nse h ALA 439 Cb 0.91 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3nse h ALA 439 CO 0.08 -0.50 -0.01 0.54 0.00 0.00 0.00 179.25 179.36 3nse n ARG 440 N -5.08 1.42 -2.22 0.00 1.74 -0.18 -5.03 116.66 107.32 3nse n ARG 440 Ca -0.09 -0.38 -0.01 0.00 -0.77 0.00 0.00 57.85 56.60 3nse n ARG 440 Cb 0.26 -0.87 0.00 0.00 -1.02 0.00 0.00 32.46 30.84 3nse n ARG 440 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3nse n GLY 441 N 0.33 0.51 0.00 -0.13 0.00 -0.20 -4.03 105.19 101.68 3nse n GLY 441 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.27 3nse n GLY 441 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3nse n GLY 442 N -0.85 1.55 3.31 -0.02 0.00 -1.09 -1.33 105.19 106.76 3nse n GLY 442 Ca -0.01 -1.63 -0.02 0.00 0.00 0.00 0.00 46.02 44.36 3nse n GLY 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3nse s PRO 444 N 2.79 4.19 -0.04 0.00 0.04 -1.26 -4.54 135.00 136.19 3nse s PRO 444 Ca 0.07 2.27 -0.02 0.00 0.04 0.00 0.00 61.00 63.36 3nse s PRO 444 Cb -0.14 -3.80 0.03 0.00 0.04 0.00 0.00 34.50 30.63 3nse s PRO 444 CO -0.18 -0.79 0.09 0.00 0.04 0.00 0.00 177.00 176.16 3nse s ALA 445 N 3.35 -0.15 -0.64 8.56 0.00 0.11 -4.10 121.76 128.89 3nse s ALA 445 Ca 0.74 0.41 -0.19 0.00 0.00 0.00 0.00 51.96 52.92 3nse s ALA 445 Cb -0.37 -0.28 0.10 0.00 0.00 0.00 0.00 23.12 22.57 3nse s ALA 445 CO 0.32 -0.10 0.79 0.34 0.00 0.00 0.00 175.76 177.10 3nse s ASP 446 N 0.74 6.24 0.26 0.00 -1.08 -0.01 -3.91 116.67 118.91 3nse s ASP 446 Ca -0.06 -1.46 -0.06 0.00 -0.52 0.00 0.00 52.55 50.46 3nse s ASP 446 Cb -0.08 -2.33 0.49 0.00 -1.46 0.00 0.00 42.92 39.54 3nse s ASP 446 CO -0.03 -1.15 1.63 -0.25 0.52 0.00 0.00 175.17 175.89 3nse h TRP 447 N 9.17 -0.05 -0.25 -5.34 7.01 -1.92 0.20 115.95 124.77 3nse h TRP 447 Ca -0.24 0.06 0.01 0.00 2.11 0.00 0.00 58.89 60.83 3nse h TRP 447 Cb 1.08 0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 28.27 3nse h TRP 447 CO 0.89 -0.27 0.16 0.00 -2.79 0.00 0.00 178.44 176.44 3nse h ALA 448 N 1.75 1.87 0.00 2.65 0.00 -1.92 -1.73 119.26 121.89 3nse h ALA 448 Ca 0.44 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.29 3nse h ALA 448 Cb 0.80 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 3nse h ALA 448 CO -0.71 0.10 -1.30 0.91 0.00 0.00 0.00 179.25 178.26 3nse n TRP 449 N -4.50 0.79 0.09 0.00 7.02 -0.08 -4.23 117.44 116.53 3nse n TRP 449 Ca 0.01 0.24 -0.22 0.00 -1.02 0.00 0.00 57.50 56.51 3nse n TRP 449 Cb 0.10 -0.91 -0.14 0.00 -2.42 0.00 0.00 31.31 27.94 3nse n TRP 449 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 3nse h ILE 450 N 0.00 1.33 -3.17 -0.99 1.08 -0.75 -3.44 117.51 111.57 3nse h ILE 450 Ca -0.05 -2.50 -0.54 0.00 -0.39 0.00 0.00 64.86 61.38 3nse h ILE 450 Cb 1.16 2.87 -0.01 0.00 -3.07 0.00 0.00 36.82 37.77 3nse h ILE 450 CO 0.01 0.75 0.59 -0.69 -0.69 0.00 0.00 178.15 178.12 3nse s VAL 451 N -2.80 4.19 0.67 1.67 1.01 -0.69 -4.93 120.40 119.51 3nse s VAL 451 Ca -0.10 1.55 -0.17 0.00 0.00 0.00 0.00 61.98 63.26 3nse s VAL 451 Cb 0.04 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.43 3nse s VAL 451 CO 0.91 0.08 1.25 -2.84 0.00 0.00 0.00 175.10 174.50 3nse s PRO 452 N 1.48 2.46 0.13 2.72 0.02 -1.26 -4.92 135.00 135.62 3nse s PRO 452 Ca 0.57 1.92 0.13 0.00 0.02 0.00 0.00 61.00 63.65 3nse s PRO 452 Cb -0.27 -1.85 0.62 0.00 0.02 0.00 0.00 34.50 33.02 3nse s PRO 452 CO 0.27 -1.63 1.41 -0.35 -0.33 0.00 0.00 177.00 176.36 3nse n PRO 453 N -2.15 0.07 -4.10 5.54 -0.04 -1.26 -4.24 135.00 128.82 3nse n PRO 453 Ca 0.15 0.46 -0.10 0.00 -0.04 0.00 0.00 63.50 63.96 3nse n PRO 453 Cb 0.49 -1.68 -0.10 0.00 -0.04 0.00 0.00 33.50 32.16 3nse n PRO 453 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3nse s ILE 454 N -3.19 0.48 -1.24 0.52 -4.36 -1.26 -4.89 121.20 107.25 3nse s ILE 454 Ca 0.02 -1.58 -0.04 0.00 -0.26 0.00 0.00 60.65 58.79 3nse s ILE 454 Cb 0.06 -1.22 0.03 0.00 1.25 0.00 0.00 42.46 42.57 3nse s ILE 454 CO 0.19 -0.74 0.27 -1.20 0.24 0.00 0.00 174.94 173.69 3nse n SER 455 N 0.54 -4.23 -0.10 4.36 7.64 -1.26 -4.91 113.62 115.66 3nse n SER 455 Ca -0.16 -0.10 -0.03 0.00 1.01 0.00 0.00 58.87 59.59 3nse n SER 455 Cb 0.59 -3.53 -0.02 0.00 -1.01 0.00 0.00 64.21 60.24 3nse n SER 455 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3nse n GLY 456 N -1.05 -2.78 0.00 0.23 0.00 -1.26 -1.00 105.19 99.32 3nse n GLY 456 Ca -0.10 0.69 0.09 0.00 0.00 0.00 0.00 46.02 46.70 3nse n GLY 456 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3nse n SER 457 N -3.51 0.00 0.08 1.61 3.41 -1.26 -2.32 113.62 111.64 3nse n SER 457 Ca 0.00 -0.66 0.12 0.00 -0.26 0.00 0.00 58.87 58.08 3nse n SER 457 Cb 0.06 0.00 0.22 0.00 -0.26 0.00 0.00 64.21 64.23 3nse n SER 457 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3nse h LEU 458 N 0.00 0.00 -9.86 1.04 4.07 -1.45 -3.46 115.31 105.65 3nse h LEU 458 Ca 0.00 -0.13 -0.61 0.00 0.08 0.00 0.00 57.88 57.22 3nse h LEU 458 Cb 0.00 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 41.69 3nse h LEU 458 CO 0.00 0.07 -0.52 0.42 -1.08 0.00 0.00 178.44 177.32 3nse s THR 459 N -3.17 5.10 0.38 0.22 -4.23 -0.98 -5.04 115.64 107.93 3nse s THR 459 Ca 0.07 -0.58 0.06 0.00 -1.18 0.00 0.00 61.69 60.05 3nse s THR 459 Cb 0.12 -3.52 0.27 0.00 1.34 0.00 0.00 72.50 70.72 3nse s THR 459 CO 0.69 0.08 2.02 1.55 -0.54 0.00 0.00 174.62 178.42 3nse h PRO 460 N 2.92 0.66 0.00 3.99 0.13 -1.88 -3.07 132.00 134.75 3nse h PRO 460 Ca -0.46 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 64.62 3nse h PRO 460 Cb 1.17 -0.15 -0.00 0.00 0.13 0.00 0.00 31.00 32.15 3nse h PRO 460 CO 0.71 0.44 -0.04 -0.39 -0.23 0.00 0.00 178.00 178.49 3nse h VAL 461 N 0.68 0.48 -0.87 1.56 -1.51 -1.90 -2.84 116.25 111.85 3nse h VAL 461 Ca 0.21 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 65.50 3nse h VAL 461 Cb 0.01 1.12 -0.04 0.00 -2.13 0.00 0.00 31.29 30.25 3nse h VAL 461 CO -0.05 0.04 0.56 0.15 -1.23 0.00 0.00 177.57 177.04 3nse h PHE 462 N 0.00 1.11 -0.12 5.19 3.04 -1.74 -2.44 116.94 121.98 3nse h PHE 462 Ca -0.00 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.97 3nse h PHE 462 Cb 0.12 -0.37 0.00 0.00 2.56 0.00 0.00 35.95 38.26 3nse h PHE 462 CO 0.00 0.71 0.00 0.72 -2.02 0.00 0.00 178.31 177.72 3nse n HIS 463 N -4.46 0.16 -3.72 0.41 -0.00 -1.07 -4.78 115.22 101.76 3nse n HIS 463 Ca 0.09 -0.08 -0.37 0.00 -0.00 0.00 0.00 57.72 57.36 3nse n HIS 463 Cb 0.03 0.00 -0.12 0.00 -0.00 0.00 0.00 29.99 29.90 3nse n HIS 463 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.34 175.20 3nse s GLN 464 N -1.84 3.65 0.38 -0.41 2.00 -0.92 -0.74 119.66 121.78 3nse s GLN 464 Ca 0.20 -0.49 -0.25 0.00 -2.00 0.00 0.00 55.36 52.82 3nse s GLN 464 Cb 0.10 -3.40 -0.09 0.00 0.80 0.00 0.00 33.01 30.43 3nse s GLN 464 CO 0.15 -0.22 1.13 -1.21 -0.50 0.00 0.00 175.29 174.64 3nse s GLU 465 N 1.63 4.16 0.10 1.67 2.02 -0.65 -5.01 118.70 122.62 3nse s GLU 465 Ca 0.06 1.74 0.04 0.00 0.02 0.00 0.00 54.97 56.83 3nse s GLU 465 Cb -0.15 -2.70 -0.03 0.00 0.10 0.00 0.00 34.13 31.34 3nse s GLU 465 CO 0.05 -0.20 -0.12 -1.64 0.02 0.00 0.00 175.26 173.37 3nse s MET 466 N -2.25 0.87 -0.12 1.61 -1.94 -1.26 -4.69 119.30 111.52 3nse s MET 466 Ca 0.56 -1.13 0.01 0.00 -1.71 0.00 0.00 55.69 53.42 3nse s MET 466 Cb -0.28 -0.66 -0.01 0.00 2.01 0.00 0.00 34.83 35.89 3nse s MET 466 CO 0.36 0.12 -0.15 0.08 -0.01 0.00 0.00 175.02 175.41 3nse s VAL 467 N -2.14 2.89 -0.12 -6.03 1.01 -1.26 -4.94 120.40 109.80 3nse s VAL 467 Ca 0.04 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.30 3nse s VAL 467 Cb -0.05 -2.20 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 3nse s VAL 467 CO 0.01 0.53 -0.13 0.21 0.00 0.00 0.00 175.10 175.72 3nse s ASN 468 N 0.29 4.03 0.20 3.32 3.04 -1.25 -0.72 114.94 123.86 3nse s ASN 468 Ca -0.11 -0.31 -0.22 0.00 0.04 0.00 0.00 52.86 52.26 3nse s ASN 468 Cb -0.16 -1.53 0.05 0.00 -1.54 0.00 0.00 41.25 38.07 3nse s ASN 468 CO 0.06 0.19 0.66 -0.72 -3.04 0.00 0.00 177.10 174.25 3nse s TYR 469 N 0.23 -0.39 -0.23 0.43 1.13 -1.26 -4.96 117.35 112.30 3nse s TYR 469 Ca -0.08 0.08 -0.12 0.00 -1.41 0.00 0.00 57.07 55.54 3nse s TYR 469 Cb -0.15 0.62 -0.05 0.00 -1.10 0.00 0.00 41.96 41.28 3nse s TYR 469 CO 0.05 -0.99 0.22 0.42 -2.51 0.00 0.00 175.55 172.74 3nse s ILE 470 N -3.79 5.32 0.06 -3.49 1.01 -1.26 -4.83 121.20 114.21 3nse s ILE 470 Ca 0.05 0.33 0.08 0.00 0.00 0.00 0.00 60.65 61.11 3nse s ILE 470 Cb -0.03 -3.56 -0.03 0.00 0.01 0.00 0.00 42.46 38.85 3nse s ILE 470 CO -0.05 0.33 -0.21 -0.76 0.00 0.00 0.00 174.94 174.25 3nse s LEU 471 N 1.07 2.19 0.02 2.97 1.43 -1.26 -4.06 118.68 121.04 3nse s LEU 471 Ca 0.11 -0.56 0.06 0.00 -1.03 0.00 0.00 54.13 52.71 3nse s LEU 471 Cb -0.14 -0.97 -0.03 0.00 0.03 0.00 0.00 46.19 45.08 3nse s LEU 471 CO 0.05 0.14 -0.15 -0.55 0.23 0.00 0.00 176.35 176.07 3nse s SER 472 N -1.33 4.01 0.81 2.29 0.15 -1.26 -4.09 113.70 114.27 3nse s SER 472 Ca 0.07 -0.33 -0.15 0.00 0.70 0.00 0.00 55.95 56.25 3nse s SER 472 Cb -0.09 -0.75 0.01 0.00 -1.71 0.00 0.00 66.02 63.49 3nse s SER 472 CO 0.02 0.27 0.68 -2.65 1.20 0.00 0.00 173.24 172.77 3nse n PRO 473 N 1.65 0.13 -3.59 5.44 -0.02 -1.26 -5.00 135.00 132.35 3nse n PRO 473 Ca -0.16 0.10 -0.11 0.00 -2.02 0.00 0.00 63.50 61.31 3nse n PRO 473 Cb 0.52 -2.01 -0.04 0.00 -0.02 0.00 0.00 33.50 31.95 3nse n PRO 473 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3nse s ALA 474 N -2.09 -1.09 -0.25 3.55 0.00 -0.60 -4.04 121.76 117.24 3nse s ALA 474 Ca 0.65 0.12 -0.09 0.00 0.00 0.00 0.00 51.96 52.64 3nse s ALA 474 Cb -0.30 0.69 -0.04 0.00 0.00 0.00 0.00 23.12 23.48 3nse s ALA 474 CO 0.58 -0.65 0.12 -0.06 0.00 0.00 0.00 175.76 175.75 3nse s PHE 475 N -3.63 3.16 0.27 0.00 0.08 -1.26 -1.10 117.98 115.49 3nse s PHE 475 Ca 0.02 -0.14 0.09 0.00 0.12 0.00 0.00 56.93 57.01 3nse s PHE 475 Cb 0.01 -2.28 -0.05 0.00 -0.57 0.00 0.00 43.02 40.13 3nse s PHE 475 CO -0.11 -0.21 -0.13 1.03 -0.10 0.00 0.00 175.22 175.69 3nse s ARG 476 N 1.52 1.56 0.53 0.44 0.52 -0.15 -4.96 118.95 118.41 3nse s ARG 476 Ca 0.06 -1.74 -0.13 0.00 -0.52 0.00 0.00 55.73 53.40 3nse s ARG 476 Cb -0.15 -1.42 -0.06 0.00 0.52 0.00 0.00 34.95 33.84 3nse s ARG 476 CO 0.06 0.19 0.95 0.71 0.02 0.00 0.00 175.30 177.23 3nse s TYR 477 N -2.78 3.52 0.03 -0.53 2.02 -1.05 -1.08 117.35 117.48 3nse s TYR 477 Ca 0.28 1.29 -0.02 0.00 -0.37 0.00 0.00 57.07 58.26 3nse s TYR 477 Cb -0.01 -2.68 -0.02 0.00 -0.40 0.00 0.00 41.96 38.85 3nse s TYR 477 CO 0.12 -0.43 -0.00 1.14 -1.57 0.00 0.00 175.55 174.81 3nse s GLN 478 N -4.46 0.46 0.70 -0.62 -2.07 -1.26 -1.45 119.66 110.95 3nse s GLN 478 Ca 0.56 -0.82 -0.15 0.00 -1.82 0.00 0.00 55.36 53.12 3nse s GLN 478 Cb -0.10 0.17 0.02 0.00 -1.09 0.00 0.00 33.01 32.01 3nse s GLN 478 CO 0.40 -0.09 1.15 -2.14 -1.32 0.00 0.00 175.29 173.29 3nse s PRO 479 N -2.45 2.45 0.29 9.60 0.02 -1.26 -4.97 135.00 138.68 3nse s PRO 479 Ca -0.07 1.56 -0.29 0.00 0.02 0.00 0.00 61.00 62.22 3nse s PRO 479 Cb -0.03 -1.89 -0.10 0.00 0.02 0.00 0.00 34.50 32.51 3nse s PRO 479 CO -0.04 -1.55 1.28 -0.51 -0.33 0.00 0.00 177.00 175.84 3nse s ASP 480 N -2.33 6.88 0.61 2.53 1.01 -1.26 -4.90 116.67 119.21 3nse s ASP 480 Ca 0.70 2.54 0.41 0.00 0.71 0.00 0.00 52.55 56.91 3nse s ASP 480 Cb -0.24 -2.63 2.16 0.00 1.01 0.00 0.00 42.92 43.21 3nse s ASP 480 CO 0.44 -0.47 2.24 1.55 0.21 0.00 0.00 175.17 179.13 3nse h PRO 481 N 4.04 0.00 -0.01 8.23 0.13 -1.94 -3.53 132.00 138.92 3nse h PRO 481 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3nse h PRO 481 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3nse h PRO 481 CO 0.69 0.00 0.00 -2.67 -0.23 0.00 0.00 178.00 175.79