#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h1p n TYR 58 N 0.00 0.00 -4.06 -1.42 4.01 -1.26 -5.38 117.16 109.05 3h1p n TYR 58 Ca 0.00 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.47 3h1p n TYR 58 Cb 0.00 -0.78 -0.05 0.00 -0.31 0.00 0.00 39.34 38.19 3h1p n TYR 58 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3h1p s GLN 59 N -2.49 2.94 0.18 -0.72 -0.21 -1.26 -0.17 119.66 117.94 3h1p s GLN 59 Ca -0.08 -0.81 -0.31 0.00 0.02 0.00 0.00 55.36 54.18 3h1p s GLN 59 Cb 0.06 -2.69 -0.09 0.00 1.00 0.00 0.00 33.01 31.29 3h1p s GLN 59 CO 0.69 0.50 1.39 0.71 -2.12 0.00 0.00 175.29 176.46 3h1p s TYR 60 N -1.68 3.18 -0.10 0.91 2.02 0.77 -4.81 117.35 117.64 3h1p s TYR 60 Ca 0.31 1.04 -0.30 0.00 -0.37 0.00 0.00 57.07 57.75 3h1p s TYR 60 Cb -0.11 -3.71 -0.08 0.00 -0.40 0.00 0.00 41.96 37.67 3h1p s TYR 60 CO 0.24 -2.35 2.07 -1.71 -1.57 0.00 0.00 175.55 172.23 3h1p n ASN 61 N 3.05 3.62 -0.89 2.29 5.15 -1.26 -4.83 115.26 122.39 3h1p n ASN 61 Ca 0.08 0.61 0.07 0.00 -0.60 0.00 0.00 54.58 54.75 3h1p n ASN 61 Cb 0.42 -1.50 0.22 0.00 -0.53 0.00 0.00 39.78 38.38 3h1p n ASN 61 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 3h1p n MET 62 N 7.94 3.00 -2.87 1.20 2.81 -1.26 -4.82 117.12 123.11 3h1p n MET 62 Ca 0.25 -2.39 -0.44 0.00 -1.81 0.00 0.00 57.70 53.32 3h1p n MET 62 Cb 0.40 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.41 3h1p n MET 62 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3h1p n ASN 63 N 0.51 5.23 -4.19 7.83 5.15 -1.26 -4.83 115.26 123.70 3h1p n ASN 63 Ca 0.17 -3.00 -0.11 0.00 -0.60 0.00 0.00 54.58 51.03 3h1p n ASN 63 Cb 0.60 -1.55 -0.10 0.00 -0.53 0.00 0.00 39.78 38.21 3h1p n ASN 63 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 3h1p s PHE 64 N 1.24 1.02 0.06 1.20 0.40 -1.26 -5.05 117.98 115.59 3h1p s PHE 64 Ca 0.42 -1.19 -0.22 0.00 -0.60 0.00 0.00 56.93 55.34 3h1p s PHE 64 Cb -0.01 -0.57 -0.14 0.00 0.51 0.00 0.00 43.02 42.81 3h1p s PHE 64 CO 0.00 -0.44 1.56 1.49 0.70 0.00 0.00 175.22 178.53 3h1p h GLU 65 N 2.77 0.13 -6.16 0.44 4.81 -1.82 -3.44 114.58 111.31 3h1p h GLU 65 Ca -0.36 -0.03 -0.58 0.00 -0.13 0.00 0.00 59.36 58.26 3h1p h GLU 65 Cb 1.21 -0.02 -0.16 0.00 0.63 0.00 0.00 28.75 30.41 3h1p h GLU 65 CO 0.60 0.30 -0.78 -1.59 -0.73 0.00 0.00 179.01 176.81 3h1p s LYS 66 N -5.34 1.50 0.04 1.92 -2.85 -0.41 -5.05 119.74 109.55 3h1p s LYS 66 Ca -0.14 -1.60 -0.19 0.00 -1.00 0.00 0.00 55.97 53.03 3h1p s LYS 66 Cb 0.05 -1.60 -0.15 0.00 -2.06 0.00 0.00 37.83 34.07 3h1p s LYS 66 CO 0.69 0.31 1.30 1.25 0.10 0.00 0.00 175.35 179.00 3h1p h LEU 67 N 2.76 0.48 0.00 2.77 5.85 -1.84 -1.25 115.31 124.07 3h1p h LEU 67 Ca -0.42 -0.55 0.00 0.00 0.84 0.00 0.00 57.88 57.75 3h1p h LEU 67 Cb 1.23 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.12 3h1p h LEU 67 CO 0.55 0.93 0.00 0.61 -0.34 0.00 0.00 178.44 180.20 3h1p n GLY 68 N 0.40 0.31 3.79 3.75 0.00 -1.26 -1.50 105.19 110.68 3h1p n GLY 68 Ca -0.07 -1.80 -0.36 0.00 0.00 0.00 0.00 46.02 43.79 3h1p n GLY 68 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h1p s LYS 69 N -1.50 4.45 -0.28 1.61 2.47 -1.25 -1.43 119.74 123.81 3h1p s LYS 69 Ca 0.00 1.28 -0.03 0.00 -1.56 0.00 0.00 55.97 55.66 3h1p s LYS 69 Cb 0.00 -2.60 0.09 0.00 -1.46 0.00 0.00 37.83 33.86 3h1p s LYS 69 CO 0.00 0.16 0.10 0.00 0.16 0.00 0.00 175.35 175.77 3h1p s ILE 71 N 1.90 5.05 -0.19 0.00 1.01 -0.34 -1.27 121.20 127.36 3h1p s ILE 71 Ca 0.07 1.38 -0.00 0.00 0.00 0.00 0.00 60.65 62.10 3h1p s ILE 71 Cb -0.17 -4.01 0.01 0.00 0.01 0.00 0.00 42.46 38.30 3h1p s ILE 71 CO -0.27 0.24 -0.16 -0.63 0.00 0.00 0.00 174.94 174.11 3h1p s ILE 72 N 0.95 2.38 -0.37 2.92 1.01 0.02 -0.09 121.20 128.02 3h1p s ILE 72 Ca 0.35 -0.83 -0.11 0.00 0.00 0.00 0.00 60.65 60.06 3h1p s ILE 72 Cb -0.17 -2.02 0.03 0.00 0.01 0.00 0.00 42.46 40.30 3h1p s ILE 72 CO 0.16 0.51 0.21 -0.63 0.00 0.00 0.00 174.94 175.19 3h1p s ILE 73 N 1.28 4.60 -0.56 2.92 1.01 -0.16 0.51 121.20 130.80 3h1p s ILE 73 Ca 0.04 -0.83 -0.05 0.00 0.00 0.00 0.00 60.65 59.81 3h1p s ILE 73 Cb -0.14 -3.56 0.15 0.00 0.01 0.00 0.00 42.46 38.92 3h1p s ILE 73 CO -0.10 -0.22 0.39 0.21 0.00 0.00 0.00 174.94 175.22 3h1p s ASN 74 N 1.56 5.49 -0.42 3.58 2.47 0.05 -1.35 114.94 126.32 3h1p s ASN 74 Ca 0.02 -2.43 -0.18 0.00 0.42 0.00 0.00 52.86 50.69 3h1p s ASN 74 Cb -0.19 -1.92 0.02 0.00 -1.45 0.00 0.00 41.25 37.71 3h1p s ASN 74 CO 0.07 -0.50 0.46 0.20 -3.72 0.00 0.00 177.10 173.61 3h1p s ASN 75 N 1.54 6.22 -0.06 -4.21 0.01 -0.21 -0.71 114.94 117.51 3h1p s ASN 75 Ca 0.12 -0.58 0.03 0.00 -0.71 0.00 0.00 52.86 51.72 3h1p s ASN 75 Cb -0.21 -2.24 -0.05 0.00 0.41 0.00 0.00 41.25 39.16 3h1p s ASN 75 CO -0.04 -0.59 -0.02 1.17 -1.51 0.00 0.00 177.10 176.12 3h1p n LYS 76 N 5.68 1.72 -4.82 -0.60 4.81 -1.26 -4.49 118.16 119.21 3h1p n LYS 76 Ca -0.07 0.02 -0.33 0.00 -0.87 0.00 0.00 58.31 57.06 3h1p n LYS 76 Cb 0.48 -1.13 -0.14 0.00 0.02 0.00 0.00 35.03 34.26 3h1p n LYS 76 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 3h1p s ASN 77 N -4.11 4.06 0.09 3.14 0.01 -1.26 -1.39 114.94 115.49 3h1p s ASN 77 Ca -0.05 -0.25 0.09 0.00 -0.71 0.00 0.00 52.86 51.94 3h1p s ASN 77 Cb 0.02 -1.24 -0.03 0.00 0.41 0.00 0.00 41.25 40.40 3h1p s ASN 77 CO 0.18 0.26 -0.24 -0.36 -1.51 0.00 0.00 177.10 175.43 3h1p s PHE 78 N -0.20 2.08 0.36 2.20 0.40 -1.26 -4.65 117.98 116.92 3h1p s PHE 78 Ca 0.00 -0.40 -0.28 0.00 -0.60 0.00 0.00 56.93 55.66 3h1p s PHE 78 Cb -0.13 -1.17 -0.11 0.00 0.51 0.00 0.00 43.02 42.12 3h1p s PHE 78 CO 0.03 0.22 1.48 -0.25 0.70 0.00 0.00 175.22 177.40 3h1p n ASP 79 N 1.26 3.68 0.02 1.36 8.00 -0.25 -4.88 116.55 125.75 3h1p n ASP 79 Ca -0.18 1.22 0.05 0.00 0.71 0.00 0.00 54.79 56.59 3h1p n ASP 79 Cb 0.53 -1.60 0.46 0.00 -0.02 0.00 0.00 41.12 40.48 3h1p n ASP 79 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 3h1p h LYS 80 N 3.12 0.47 0.00 -1.24 3.64 -1.89 -2.03 116.57 118.63 3h1p h LYS 80 Ca -0.50 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 3h1p h LYS 80 Cb 1.25 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 3h1p h LYS 80 CO 0.66 0.31 0.00 1.33 -2.27 0.00 0.00 179.45 179.47 3h1p n VAL 81 N -4.48 1.29 0.78 2.00 0.24 -1.26 0.20 118.33 117.10 3h1p n VAL 81 Ca 0.03 0.50 0.12 0.00 -2.04 0.00 0.00 64.34 62.96 3h1p n VAL 81 Cb 0.09 -1.45 0.30 0.00 -1.47 0.00 0.00 33.84 31.31 3h1p n VAL 81 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3h1p n THR 82 N -1.91 0.22 -0.92 3.34 -2.24 -0.76 -4.92 114.28 107.08 3h1p n THR 82 Ca 0.00 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 3h1p n THR 82 Cb 0.08 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.18 3h1p n THR 82 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h1p n GLY 83 N 1.41 0.39 3.85 3.38 0.00 0.13 -5.01 105.19 109.34 3h1p n GLY 83 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 3h1p n GLY 83 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h1p s MET 84 N -0.70 3.84 0.54 1.61 -1.94 -1.26 -5.09 119.30 116.29 3h1p s MET 84 Ca 0.00 0.30 -0.05 0.00 -1.71 0.00 0.00 55.69 54.23 3h1p s MET 84 Cb 0.00 -3.11 -0.01 0.00 2.01 0.00 0.00 34.83 33.73 3h1p s MET 84 CO 0.00 0.63 0.83 0.20 -0.01 0.00 0.00 175.02 176.67 3h1p s GLY 85 N -1.41 1.57 0.26 -0.03 0.00 -1.26 -4.65 107.32 101.80 3h1p s GLY 85 Ca 0.28 -0.69 -0.30 0.00 0.00 0.00 0.00 44.72 44.02 3h1p s GLY 85 CO 0.15 -0.46 1.14 -0.62 0.00 0.00 0.00 173.10 173.31 3h1p n VAL 86 N -2.41 1.58 -3.33 1.40 0.31 -1.26 -4.67 118.33 109.94 3h1p n VAL 86 Ca 0.03 -0.39 -0.43 0.00 -0.01 0.00 0.00 64.34 63.54 3h1p n VAL 86 Cb 0.57 -1.11 -0.01 0.00 -0.91 0.00 0.00 33.84 32.38 3h1p n VAL 86 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3h1p n ARG 87 N 1.15 3.54 -1.87 5.55 1.74 -0.48 -5.04 116.66 121.24 3h1p n ARG 87 Ca 0.11 -4.49 -0.37 0.00 -0.77 0.00 0.00 57.85 52.33 3h1p n ARG 87 Cb 0.31 -2.51 0.05 0.00 -1.02 0.00 0.00 32.46 29.29 3h1p n ARG 87 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 3h1p s ASN 88 N 0.34 4.92 0.00 0.55 0.01 -1.26 -2.51 114.94 117.00 3h1p s ASN 88 Ca 0.31 2.53 0.00 0.00 -0.71 0.00 0.00 52.86 54.99 3h1p s ASN 88 Cb -0.06 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 38.99 3h1p s ASN 88 CO -0.05 -1.78 0.00 0.61 -1.51 0.00 0.00 177.10 174.37 3h1p n GLY 89 N 0.72 1.53 0.18 0.66 0.00 -0.97 -4.14 105.19 103.17 3h1p n GLY 89 Ca 0.14 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.01 3h1p n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1p h THR 90 N 0.00 1.34 -0.80 2.61 1.03 -1.79 -2.98 112.91 112.32 3h1p h THR 90 Ca 0.00 -2.26 -0.01 0.00 -0.01 0.00 0.00 66.41 64.13 3h1p h THR 90 Cb 0.00 2.28 -0.04 0.00 -1.07 0.00 0.00 68.15 69.33 3h1p h THR 90 CO 0.00 0.69 0.48 0.44 -0.01 0.00 0.00 175.52 177.12 3h1p h ASP 91 N 0.34 0.97 -0.81 0.00 3.32 -1.92 -0.85 116.42 117.46 3h1p h ASP 91 Ca -0.08 -0.07 0.14 0.00 0.02 0.00 0.00 57.03 57.04 3h1p h ASP 91 Cb 1.54 -0.25 -0.09 0.00 0.22 0.00 0.00 39.33 40.75 3h1p h ASP 91 CO 0.17 0.76 0.38 0.11 -1.72 0.00 0.00 179.24 178.94 3h1p h LYS 92 N 1.10 0.53 -0.11 3.56 1.57 -1.93 -1.67 116.57 119.63 3h1p h LYS 92 Ca 0.29 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 59.01 3h1p h LYS 92 Cb -0.03 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.16 3h1p h LYS 92 CO -0.05 0.35 -0.01 -0.44 -0.57 0.00 0.00 179.45 178.73 3h1p h ASP 93 N 0.55 0.20 -0.62 0.86 3.32 -1.05 -1.22 116.42 118.47 3h1p h ASP 93 Ca 0.44 -0.34 0.08 0.00 0.02 0.00 0.00 57.03 57.23 3h1p h ASP 93 Cb 0.64 -0.06 -0.06 0.00 0.22 0.00 0.00 39.33 40.08 3h1p h ASP 93 CO -0.38 0.50 0.28 0.00 -1.72 0.00 0.00 179.24 177.92 3h1p h ALA 94 N 0.72 0.81 -0.02 3.45 0.00 -0.93 -0.06 119.26 123.24 3h1p h ALA 94 Ca 0.03 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3h1p h ALA 94 Cb 0.40 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 3h1p h ALA 94 CO 0.01 -0.10 0.01 0.93 0.00 0.00 0.00 179.25 180.10 3h1p h GLU 95 N 0.52 0.02 -0.38 0.00 4.39 -1.22 0.26 114.58 118.17 3h1p h GLU 95 Ca 0.30 -0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.87 3h1p h GLU 95 Cb 0.29 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 3h1p h GLU 95 CO -0.24 0.06 -0.27 0.00 -1.16 0.00 0.00 179.01 177.39 3h1p h ALA 96 N 0.96 0.81 -0.29 3.43 0.00 -0.84 -0.18 119.26 123.15 3h1p h ALA 96 Ca 0.01 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 3h1p h ALA 96 Cb 0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3h1p h ALA 96 CO -0.00 0.65 0.07 -0.07 0.00 0.00 0.00 179.25 179.90 3h1p h LEU 97 N 0.68 0.44 0.48 0.00 3.38 -0.99 -0.54 115.31 118.77 3h1p h LEU 97 Ca 0.08 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 3h1p h LEU 97 Cb 0.80 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.44 3h1p h LEU 97 CO 0.07 0.55 -0.23 0.15 0.09 0.00 0.00 178.44 179.07 3h1p h PHE 98 N 0.30 -0.60 -0.67 1.13 3.57 -0.62 0.11 116.94 120.16 3h1p h PHE 98 Ca 0.09 -0.01 0.14 0.00 3.53 0.00 0.00 57.97 61.71 3h1p h PHE 98 Cb 0.29 0.20 -0.13 0.00 2.79 0.00 0.00 35.95 39.10 3h1p h PHE 98 CO 0.01 -0.35 -0.13 0.87 -2.23 0.00 0.00 178.31 176.48 3h1p h LYS 99 N -0.70 0.02 -0.27 1.11 1.57 -1.04 -0.90 116.57 116.37 3h1p h LYS 99 Ca -0.07 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 3h1p h LYS 99 Cb 0.52 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 3h1p h LYS 99 CO 0.11 0.01 0.13 0.00 -0.57 0.00 0.00 179.45 179.13 3h1p h PHE 101 N 0.29 0.00 -0.05 0.00 -1.00 -0.64 -2.57 116.94 112.98 3h1p h PHE 101 Ca 0.09 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.87 3h1p h PHE 101 Cb 0.13 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.69 3h1p h PHE 101 CO -0.02 0.44 0.02 -0.09 -1.61 0.00 0.00 178.31 177.05 3h1p h ARG 102 N 0.00 0.07 -0.71 1.51 2.43 -0.94 -1.59 114.38 115.16 3h1p h ARG 102 Ca -0.00 -0.01 0.14 0.00 -0.81 0.00 0.00 59.98 59.29 3h1p h ARG 102 Cb 0.87 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.36 3h1p h ARG 102 CO 0.06 0.23 0.48 0.77 -1.51 0.00 0.00 179.97 179.99 3h1p h SER 103 N -0.10 0.35 0.85 -3.80 0.02 -1.13 0.36 113.55 110.10 3h1p h SER 103 Ca 0.02 0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 60.93 3h1p h SER 103 Cb 0.18 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 3h1p h SER 103 CO -0.00 0.19 -0.23 -0.07 -1.14 0.00 0.00 176.83 175.57 3h1p h LEU 104 N 0.38 0.00 0.00 5.07 3.38 -1.02 -3.46 115.31 119.65 3h1p h LEU 104 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 3h1p h LEU 104 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 3h1p h LEU 104 CO -0.10 0.23 0.00 0.61 0.09 0.00 0.00 178.44 179.27 3h1p n GLY 105 N 0.07 1.01 3.81 0.83 0.00 0.12 -4.94 105.19 106.10 3h1p n GLY 105 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3h1p n GLY 105 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h1p s PHE 106 N -2.00 3.36 -0.86 1.61 0.08 -0.64 -4.13 117.98 115.39 3h1p s PHE 106 Ca 0.00 1.63 -0.25 0.00 0.12 0.00 0.00 56.93 58.43 3h1p s PHE 106 Cb 0.00 -2.86 0.02 0.00 -0.57 0.00 0.00 43.02 39.61 3h1p s PHE 106 CO 0.00 -0.07 1.50 -0.51 -0.10 0.00 0.00 175.22 176.04 3h1p s ASP 107 N -2.10 6.07 -0.01 1.36 1.01 -0.52 -4.38 116.67 118.09 3h1p s ASP 107 Ca 0.60 -0.80 -0.23 0.00 0.71 0.00 0.00 52.55 52.83 3h1p s ASP 107 Cb -0.10 -2.56 -0.05 0.00 1.01 0.00 0.00 42.92 41.22 3h1p s ASP 107 CO 0.14 -1.88 0.70 0.54 0.21 0.00 0.00 175.17 174.88 3h1p s VAL 108 N 6.37 4.91 -0.09 -1.27 0.11 -1.26 -1.89 120.40 127.28 3h1p s VAL 108 Ca 0.48 1.46 0.04 0.00 -2.93 0.00 0.00 61.98 61.03 3h1p s VAL 108 Cb -0.05 -4.04 -0.01 0.00 -1.53 0.00 0.00 36.38 30.75 3h1p s VAL 108 CO 0.03 0.33 -0.22 -0.63 -3.33 0.00 0.00 175.10 171.29 3h1p s ILE 109 N 0.27 2.31 -0.25 7.04 1.01 -0.40 -4.96 121.20 126.22 3h1p s ILE 109 Ca 0.36 -0.95 -0.03 0.00 0.00 0.00 0.00 60.65 60.03 3h1p s ILE 109 Cb -0.19 -1.89 0.01 0.00 0.01 0.00 0.00 42.46 40.41 3h1p s ILE 109 CO 0.20 0.56 -0.02 -0.69 0.00 0.00 0.00 174.94 174.98 3h1p s VAL 110 N 0.13 3.27 0.19 2.92 1.01 -1.26 -0.80 120.40 125.86 3h1p s VAL 110 Ca -0.11 -0.78 0.04 0.00 0.00 0.00 0.00 61.98 61.13 3h1p s VAL 110 Cb -0.16 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.58 3h1p s VAL 110 CO 0.06 0.24 0.28 -0.31 0.00 0.00 0.00 175.10 175.37 3h1p s TYR 111 N 1.41 3.38 -0.01 5.22 1.51 0.18 -4.97 117.35 124.07 3h1p s TYR 111 Ca 0.03 0.03 0.02 0.00 -1.01 0.00 0.00 57.07 56.13 3h1p s TYR 111 Cb -0.16 -1.58 -0.00 0.00 -0.11 0.00 0.00 41.96 40.11 3h1p s TYR 111 CO -0.03 0.49 -0.05 -0.80 -1.11 0.00 0.00 175.55 174.05 3h1p s ASN 112 N -3.52 0.66 -1.24 2.29 0.01 -1.26 -0.77 114.94 111.11 3h1p s ASN 112 Ca 0.34 -0.10 -0.26 0.00 -0.71 0.00 0.00 52.86 52.13 3h1p s ASN 112 Cb -0.10 -0.11 0.02 0.00 0.41 0.00 0.00 41.25 41.47 3h1p s ASN 112 CO 0.27 0.05 0.64 0.47 -1.51 0.00 0.00 177.10 177.02 3h1p n ASP 113 N 3.10 -3.76 -4.80 -1.22 8.00 0.11 -4.94 116.55 113.04 3h1p n ASP 113 Ca -0.15 -1.20 -0.36 0.00 0.71 0.00 0.00 54.79 53.79 3h1p n ASP 113 Cb 0.57 -2.24 -0.06 0.00 -0.02 0.00 0.00 41.12 39.37 3h1p n ASP 113 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h1p s SER 115 N -1.65 1.79 0.20 0.00 1.04 -1.26 -1.26 113.70 112.56 3h1p s SER 115 Ca 0.47 0.75 0.01 0.00 0.48 0.00 0.00 55.95 57.67 3h1p s SER 115 Cb -0.18 -1.11 0.12 0.00 0.10 0.00 0.00 66.02 64.96 3h1p s SER 115 CO 0.22 -3.60 1.48 0.00 0.98 0.00 0.00 173.24 172.32 3h1p h ALA 117 N 1.03 0.43 -0.45 0.00 0.00 -2.00 -2.47 119.26 115.80 3h1p h ALA 117 Ca -0.02 -0.38 0.09 0.00 0.00 0.00 0.00 54.91 54.60 3h1p h ALA 117 Cb 1.24 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.83 3h1p h ALA 117 CO 0.11 0.40 -0.33 -0.22 0.00 0.00 0.00 179.25 179.21 3h1p h LYS 118 N 0.43 -0.22 -0.63 0.00 1.63 -1.93 -1.32 116.57 114.53 3h1p h LYS 118 Ca 0.05 0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.87 3h1p h LYS 118 Cb 0.80 0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 32.45 3h1p h LYS 118 CO 0.06 -0.15 0.38 0.52 -3.45 0.00 0.00 179.45 176.81 3h1p h MET 119 N -0.23 0.84 0.01 1.90 2.86 -1.20 0.17 114.93 119.28 3h1p h MET 119 Ca 0.19 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.76 3h1p h MET 119 Cb 0.54 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.02 3h1p h MET 119 CO -0.58 0.59 -0.01 1.96 1.06 0.00 0.00 176.91 179.94 3h1p h GLN 120 N 0.86 -0.02 -0.17 1.72 1.08 -1.27 -2.95 115.11 114.36 3h1p h GLN 120 Ca 0.23 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.40 3h1p h GLN 120 Cb -0.04 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.39 3h1p h GLN 120 CO -0.04 0.37 0.02 0.22 -0.95 0.00 0.00 178.83 178.44 3h1p h ASP 121 N -0.41 0.28 0.14 1.46 3.58 -0.80 0.18 116.42 120.84 3h1p h ASP 121 Ca -0.00 -0.28 -0.09 0.00 0.42 0.00 0.00 57.03 57.07 3h1p h ASP 121 Cb 0.39 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.36 3h1p h ASP 121 CO 0.00 0.49 -0.33 0.17 -2.88 0.00 0.00 179.24 176.70 3h1p h LEU 122 N 0.06 0.29 -0.11 2.28 -0.00 -0.79 -1.03 115.31 116.00 3h1p h LEU 122 Ca 0.05 -0.10 -0.23 0.00 -0.00 0.00 0.00 57.88 57.60 3h1p h LEU 122 Cb 0.34 -0.08 0.01 0.00 -0.00 0.00 0.00 40.66 40.93 3h1p h LEU 122 CO 0.01 0.61 -0.81 -0.07 -0.00 0.00 0.00 178.44 178.17 3h1p h LEU 123 N 0.25 0.90 -0.30 0.17 3.38 -1.41 -2.12 115.31 116.19 3h1p h LEU 123 Ca 0.03 -0.66 0.03 0.00 0.09 0.00 0.00 57.88 57.38 3h1p h LEU 123 Cb 0.70 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 3h1p h LEU 123 CO 0.05 1.42 0.10 0.50 0.09 0.00 0.00 178.44 180.61 3h1p h LYS 124 N 0.46 0.22 -0.79 1.13 3.64 -0.34 -2.23 116.57 118.66 3h1p h LYS 124 Ca -0.07 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.35 3h1p h LYS 124 Cb 1.45 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 33.16 3h1p h LYS 124 CO 0.17 0.15 0.49 0.87 -2.27 0.00 0.00 179.45 178.85 3h1p h LYS 125 N 0.23 0.87 -0.01 1.90 1.57 -1.23 -1.59 116.57 118.32 3h1p h LYS 125 Ca 0.13 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 3h1p h LYS 125 Cb 0.10 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 3h1p h LYS 125 CO -0.14 0.58 -0.17 0.00 -0.57 0.00 0.00 179.45 179.15 3h1p h ALA 126 N 1.37 1.71 0.00 3.86 0.00 -0.97 0.11 119.26 125.34 3h1p h ALA 126 Ca 0.34 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3h1p h ALA 126 Cb 0.14 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3h1p h ALA 126 CO -0.16 0.22 -0.04 0.66 0.00 0.00 0.00 179.25 179.93 3h1p h SER 127 N 0.02 0.00 0.15 0.00 4.64 -0.73 -2.95 113.55 114.67 3h1p h SER 127 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3h1p h SER 127 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3h1p h SER 127 CO 0.02 0.00 -0.16 -0.62 -0.87 0.00 0.00 176.83 175.20 3h1p n GLU 128 N -2.74 1.12 -1.49 4.77 1.02 0.31 -4.56 120.64 119.07 3h1p n GLU 128 Ca 0.04 -0.64 -0.29 0.00 -0.02 0.00 0.00 57.16 56.25 3h1p n GLU 128 Cb 0.49 -1.49 0.18 0.00 -0.02 0.00 0.00 31.44 30.60 3h1p n GLU 128 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3h1p s GLU 129 N -2.32 0.29 -0.33 3.49 2.02 -0.68 -5.03 118.70 116.14 3h1p s GLU 129 Ca 0.29 0.02 -0.15 0.00 0.02 0.00 0.00 54.97 55.15 3h1p s GLU 129 Cb 0.20 -1.76 -0.02 0.00 0.10 0.00 0.00 34.13 32.65 3h1p s GLU 129 CO 0.45 -2.72 0.34 0.34 0.02 0.00 0.00 175.26 173.69 3h1p s ASP 130 N -4.18 6.16 -0.04 -0.19 -1.08 -1.26 -4.88 116.67 111.20 3h1p s ASP 130 Ca 0.68 -0.18 0.15 0.00 -0.52 0.00 0.00 52.55 52.68 3h1p s ASP 130 Cb -0.11 -2.19 0.45 0.00 -1.46 0.00 0.00 42.92 39.62 3h1p s ASP 130 CO 0.54 -0.29 1.38 1.41 0.52 0.00 0.00 175.17 178.73 3h1p n HIS 131 N 5.33 0.76 -0.42 -5.34 8.25 -1.26 -4.67 115.22 117.87 3h1p n HIS 131 Ca -0.10 -0.57 0.37 0.00 -0.26 0.00 0.00 57.72 57.16 3h1p n HIS 131 Cb 0.50 -0.10 0.71 0.00 1.12 0.00 0.00 29.99 32.22 3h1p n HIS 131 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 3h1p h THR 132 N 2.64 0.30 -0.58 1.59 2.02 -1.92 0.43 112.91 117.39 3h1p h THR 132 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 3h1p h THR 132 Cb 0.98 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 3h1p h THR 132 CO 0.07 0.01 0.00 0.59 0.37 0.00 0.00 175.52 176.56 3h1p n ASN 133 N -4.28 4.26 -4.70 4.18 3.02 -1.26 -4.94 115.26 111.54 3h1p n ASN 133 Ca 0.31 -2.35 -0.35 0.00 -0.03 0.00 0.00 54.58 52.16 3h1p n ASN 133 Cb 1.38 -0.51 -0.09 0.00 -0.61 0.00 0.00 39.78 39.95 3h1p n ASN 133 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h1p s ALA 134 N -1.65 3.42 0.01 5.41 0.00 0.15 -1.29 121.76 127.82 3h1p s ALA 134 Ca 0.46 -0.76 0.25 0.00 0.00 0.00 0.00 51.96 51.91 3h1p s ALA 134 Cb 0.28 -1.69 0.86 0.00 0.00 0.00 0.00 23.12 22.57 3h1p s ALA 134 CO 0.23 0.48 1.80 0.00 0.00 0.00 0.00 175.76 178.27 3h1p h ALA 135 N 5.57 0.98 -2.31 0.00 0.00 -0.63 -3.48 119.26 119.38 3h1p h ALA 135 Ca -0.47 -0.15 0.24 0.00 0.00 0.00 0.00 54.91 54.52 3h1p h ALA 135 Cb 1.19 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 3h1p h ALA 135 CO 0.59 0.21 0.70 0.00 0.00 0.00 0.00 179.25 180.76 3h1p s PHE 137 N -2.19 0.71 -0.05 0.00 5.36 -0.91 -3.92 117.98 116.97 3h1p s PHE 137 Ca 0.23 -0.60 -0.05 0.00 -0.96 0.00 0.00 56.93 55.55 3h1p s PHE 137 Cb -0.01 -0.42 0.01 0.00 -0.34 0.00 0.00 43.02 42.26 3h1p s PHE 137 CO 0.02 -0.10 0.15 0.00 -1.46 0.00 0.00 175.22 173.83 3h1p s ALA 138 N -1.90 -0.37 -0.02 11.12 0.00 -0.46 -1.83 121.76 128.30 3h1p s ALA 138 Ca -0.05 0.40 0.02 0.00 0.00 0.00 0.00 51.96 52.33 3h1p s ALA 138 Cb -0.06 -0.23 0.01 0.00 0.00 0.00 0.00 23.12 22.83 3h1p s ALA 138 CO -0.01 -0.08 -0.06 0.00 0.00 0.00 0.00 175.76 175.62 3h1p s ILE 140 N 0.26 1.61 -0.12 0.00 1.01 0.87 -0.99 121.20 123.83 3h1p s ILE 140 Ca -0.03 -0.70 -0.02 0.00 0.00 0.00 0.00 60.65 59.90 3h1p s ILE 140 Cb -0.07 -1.46 -0.03 0.00 0.01 0.00 0.00 42.46 40.91 3h1p s ILE 140 CO -0.00 0.46 -0.07 -0.76 0.00 0.00 0.00 174.94 174.57 3h1p s LEU 141 N 1.02 3.10 -0.24 2.97 1.43 0.14 -0.99 118.68 126.11 3h1p s LEU 141 Ca -0.05 -0.15 -0.00 0.00 -1.03 0.00 0.00 54.13 52.90 3h1p s LEU 141 Cb -0.15 -1.71 0.07 0.00 0.03 0.00 0.00 46.19 44.43 3h1p s LEU 141 CO -0.03 0.22 0.00 -0.76 0.23 0.00 0.00 176.35 176.02 3h1p s LEU 142 N 0.02 2.33 0.00 1.79 1.43 -0.46 -0.30 118.68 123.49 3h1p s LEU 142 Ca -0.01 -1.24 -0.15 0.00 -1.03 0.00 0.00 54.13 51.70 3h1p s LEU 142 Cb -0.14 -1.02 0.05 0.00 0.03 0.00 0.00 46.19 45.12 3h1p s LEU 142 CO 0.03 -0.29 0.74 -0.24 0.23 0.00 0.00 176.35 176.82 3h1p n SER 143 N 4.76 -1.39 -4.84 2.29 2.88 -0.58 -1.05 113.62 115.69 3h1p n SER 143 Ca -0.08 -1.79 -0.32 0.00 -1.33 0.00 0.00 58.87 55.35 3h1p n SER 143 Cb 0.44 2.28 -0.01 0.00 -0.75 0.00 0.00 64.21 66.17 3h1p n SER 143 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 3h1p s HIS 144 N -3.22 3.38 0.36 0.66 3.76 -1.26 -3.99 115.29 114.97 3h1p s HIS 144 Ca 0.16 1.44 -0.14 0.00 -0.15 0.00 0.00 55.06 56.38 3h1p s HIS 144 Cb -0.02 -2.83 0.04 0.00 1.11 0.00 0.00 32.58 30.88 3h1p s HIS 144 CO 0.05 -0.61 0.71 0.20 -0.85 0.00 0.00 174.74 174.24 3h1p s GLY 145 N -3.23 0.52 0.26 -2.22 0.00 -1.25 -0.89 107.32 100.49 3h1p s GLY 145 Ca 0.59 -0.84 -0.17 0.00 0.00 0.00 0.00 44.72 44.30 3h1p s GLY 145 CO 0.37 -0.42 0.61 -0.54 0.00 0.00 0.00 173.10 173.12 3h1p s GLU 146 N -2.74 1.65 -0.02 2.90 2.02 -0.80 -4.19 118.70 117.52 3h1p s GLU 146 Ca 0.18 -1.08 -0.34 0.00 0.02 0.00 0.00 54.97 53.75 3h1p s GLU 146 Cb -0.04 0.55 -0.13 0.00 0.10 0.00 0.00 34.13 34.61 3h1p s GLU 146 CO 0.12 -0.73 1.77 -1.91 0.02 0.00 0.00 175.26 174.53 3h1p n GLU 147 N -0.42 2.08 -1.03 1.61 2.13 -1.20 -1.74 120.64 122.07 3h1p n GLU 147 Ca -0.04 0.76 -0.01 0.00 0.66 0.00 0.00 57.16 58.53 3h1p n GLU 147 Cb 0.61 -2.57 -0.00 0.00 0.27 0.00 0.00 31.44 29.75 3h1p n GLU 147 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 3h1p n ASN 148 N 5.48 -3.74 -3.72 4.31 4.13 -1.26 -5.00 115.26 115.46 3h1p n ASN 148 Ca 0.21 0.02 -0.12 0.00 1.68 0.00 0.00 54.58 56.37 3h1p n ASN 148 Cb 0.28 -1.32 -0.10 0.00 -1.54 0.00 0.00 39.78 37.10 3h1p n ASN 148 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3h1p s VAL 149 N -1.82 -0.01 0.15 2.41 1.01 -0.71 -1.04 120.40 120.39 3h1p s VAL 149 Ca 0.00 0.03 0.11 0.00 0.00 0.00 0.00 61.98 62.12 3h1p s VAL 149 Cb 0.00 -0.59 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 3h1p s VAL 149 CO 0.00 0.01 -0.25 0.27 0.00 0.00 0.00 175.10 175.13 3h1p s ILE 150 N 0.57 2.24 -0.01 2.22 -5.25 -0.10 -1.90 121.20 118.97 3h1p s ILE 150 Ca -0.03 -1.84 -0.26 0.00 -0.99 0.00 0.00 60.65 57.53 3h1p s ILE 150 Cb -0.05 -2.01 -0.04 0.00 2.95 0.00 0.00 42.46 43.32 3h1p s ILE 150 CO -0.03 -0.00 0.81 -0.31 -1.79 0.00 0.00 174.94 173.62 3h1p s TYR 151 N -1.30 3.66 0.29 1.37 1.51 -0.07 -1.29 117.35 121.51 3h1p s TYR 151 Ca 0.16 1.47 -0.05 0.00 -1.01 0.00 0.00 57.07 57.64 3h1p s TYR 151 Cb -0.09 -2.91 0.07 0.00 -0.11 0.00 0.00 41.96 38.91 3h1p s TYR 151 CO 0.07 0.11 0.38 0.41 -1.11 0.00 0.00 175.55 175.42 3h1p n GLY 152 N 2.81 -1.31 0.11 0.71 0.00 -0.79 -4.58 105.19 102.14 3h1p n GLY 152 Ca 0.01 -1.67 0.12 0.00 0.00 0.00 0.00 46.02 44.48 3h1p n GLY 152 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3h1p h LYS 153 N 0.00 0.00 0.00 1.61 2.10 -1.44 -3.21 116.57 115.63 3h1p h LYS 153 Ca -0.13 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.41 3h1p h LYS 153 Cb 0.35 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.66 3h1p h LYS 153 CO 0.09 0.00 -0.77 0.22 -2.00 0.00 0.00 179.45 176.98 3h1p h ASP 154 N 0.00 0.00 0.00 7.07 1.82 -1.91 -0.65 116.42 122.74 3h1p h ASP 154 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 3h1p h ASP 154 Cb 0.79 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.80 3h1p h ASP 154 CO 0.00 0.48 0.00 0.61 -1.61 0.00 0.00 179.24 178.72 3h1p n GLY 155 N 1.27 -0.08 3.06 -0.78 0.00 -1.21 -4.95 105.19 102.50 3h1p n GLY 155 Ca -0.01 -1.13 -0.18 0.00 0.00 0.00 0.00 46.02 44.69 3h1p n GLY 155 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h1p s VAL 156 N -3.70 0.80 -0.00 1.61 0.11 -1.26 -1.88 120.40 116.07 3h1p s VAL 156 Ca 0.00 -0.64 -0.01 0.00 -2.93 0.00 0.00 61.98 58.40 3h1p s VAL 156 Cb 0.00 -0.71 -0.00 0.00 -1.53 0.00 0.00 36.38 34.14 3h1p s VAL 156 CO 0.00 0.07 0.01 0.28 -3.33 0.00 0.00 175.10 172.13 3h1p s THR 157 N -0.54 0.01 0.18 5.04 -1.32 -0.41 -4.92 115.64 113.68 3h1p s THR 157 Ca 0.01 -0.12 -0.31 0.00 -1.21 0.00 0.00 61.69 60.07 3h1p s THR 157 Cb -0.06 -0.07 -0.09 0.00 -1.51 0.00 0.00 72.50 70.78 3h1p s THR 157 CO 0.00 -0.07 1.37 -2.84 -2.21 0.00 0.00 174.62 170.87 3h1p s PRO 158 N -0.19 4.34 0.27 7.08 0.02 -1.26 -0.92 135.00 144.33 3h1p s PRO 158 Ca -0.02 2.11 -0.01 0.00 0.02 0.00 0.00 61.00 63.10 3h1p s PRO 158 Cb -0.01 -3.20 0.48 0.00 0.02 0.00 0.00 34.50 31.79 3h1p s PRO 158 CO -0.00 -0.36 1.83 0.82 -0.33 0.00 0.00 177.00 178.97 3h1p h ILE 159 N 3.89 0.94 -0.94 2.83 2.04 -1.41 -2.16 117.51 122.70 3h1p h ILE 159 Ca -0.44 -0.33 0.12 0.00 1.00 0.00 0.00 64.86 65.21 3h1p h ILE 159 Cb 1.21 -0.10 -0.08 0.00 -0.74 0.00 0.00 36.82 37.11 3h1p h ILE 159 CO 0.81 0.18 0.60 0.50 0.00 0.00 0.00 178.15 180.24 3h1p h LYS 160 N 0.96 0.86 -0.11 2.37 3.64 -1.92 -0.48 116.57 121.90 3h1p h LYS 160 Ca 0.46 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.68 3h1p h LYS 160 Cb 0.40 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 3h1p h LYS 160 CO -0.24 0.57 -0.38 -0.44 -2.27 0.00 0.00 179.45 176.68 3h1p h ASP 161 N 0.88 0.23 -0.00 4.20 3.32 -1.77 -1.17 116.42 122.11 3h1p h ASP 161 Ca 0.46 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.42 3h1p h ASP 161 Cb 0.53 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.02 3h1p h ASP 161 CO -0.23 0.60 -0.00 -0.07 -1.72 0.00 0.00 179.24 177.83 3h1p h LEU 162 N 0.19 0.00 0.00 1.55 3.38 -1.09 -3.25 115.31 116.09 3h1p h LEU 162 Ca 0.02 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.64 3h1p h LEU 162 Cb 0.77 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.52 3h1p h LEU 162 CO 0.06 0.36 -0.11 0.71 0.09 0.00 0.00 178.44 179.55 3h1p h THR 163 N -0.35 0.00 0.00 0.22 1.35 -1.25 -3.32 112.91 109.56 3h1p h THR 163 Ca 0.00 -0.50 -0.05 0.00 -0.55 0.00 0.00 66.41 65.31 3h1p h THR 163 Cb 0.35 1.43 -0.01 0.00 -1.73 0.00 0.00 68.15 68.20 3h1p h THR 163 CO 0.00 0.00 -0.23 0.00 -0.25 0.00 0.00 175.52 175.04 3h1p h ALA 164 N 2.50 1.00 -0.32 6.62 0.00 -1.24 -2.27 119.26 125.54 3h1p h ALA 164 Ca 0.00 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 54.80 3h1p h ALA 164 Cb 0.75 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 3h1p h ALA 164 CO 0.00 0.28 0.42 0.45 0.00 0.00 0.00 179.25 180.41 3h1p h HIS 165 N 0.00 0.00 -0.62 0.00 3.86 -1.73 0.18 115.15 116.84 3h1p h HIS 165 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3h1p h HIS 165 Cb 0.79 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.26 3h1p h HIS 165 CO 0.00 0.00 0.00 1.19 0.86 0.00 0.00 177.93 179.98 3h1p n PHE 166 N -3.54 1.19 -0.72 2.45 3.01 -0.85 -3.88 117.46 115.12 3h1p n PHE 166 Ca 0.05 -0.58 -0.32 0.00 1.01 0.00 0.00 57.45 57.62 3h1p n PHE 166 Cb 0.57 -0.15 0.15 0.00 -0.01 0.00 0.00 39.48 40.04 3h1p n PHE 166 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3h1p n ARG 167 N 1.13 -0.49 -0.33 -1.08 1.74 0.64 -4.55 116.66 113.73 3h1p n ARG 167 Ca 0.24 -0.09 -0.00 0.00 -0.77 0.00 0.00 57.85 57.22 3h1p n ARG 167 Cb 0.76 -2.12 0.17 0.00 -1.02 0.00 0.00 32.46 30.24 3h1p n ARG 167 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 3h1p h GLY 168 N -1.79 1.32 1.15 -0.13 0.00 -1.33 -1.55 103.07 100.75 3h1p h GLY 168 Ca -0.44 -0.48 0.00 0.00 0.00 0.00 0.00 47.33 46.41 3h1p h GLY 168 CO 0.38 0.44 0.00 2.09 0.00 0.00 0.00 176.54 179.46 3h1p n ASP 169 N -4.41 0.00 0.00 0.19 5.75 -1.26 -3.48 116.55 113.33 3h1p n ASP 169 Ca 0.12 -0.57 0.00 0.00 -0.01 0.00 0.00 54.79 54.33 3h1p n ASP 169 Cb 0.05 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.07 3h1p n ASP 169 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3h1p n ARG 170 N -1.08 1.38 -3.41 0.11 1.74 -0.65 -4.75 116.66 109.99 3h1p n ARG 170 Ca 0.16 -0.08 -0.26 0.00 -0.77 0.00 0.00 57.85 56.90 3h1p n ARG 170 Cb 0.11 -0.40 -0.09 0.00 -1.02 0.00 0.00 32.46 31.06 3h1p n ARG 170 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3h1p n SER 171 N -0.22 0.96 0.15 0.55 2.88 -0.78 -4.79 113.62 112.36 3h1p n SER 171 Ca 0.00 -2.78 0.18 0.00 -1.33 0.00 0.00 58.87 54.94 3h1p n SER 171 Cb 0.07 -0.63 0.78 0.00 -0.75 0.00 0.00 64.21 63.68 3h1p n SER 171 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 3h1p h LYS 172 N 4.82 0.00 -0.00 -1.46 1.57 -1.81 -1.60 116.57 118.09 3h1p h LYS 172 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3h1p h LYS 172 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.15 3h1p h LYS 172 CO 0.53 0.00 -0.02 0.25 -0.57 0.00 0.00 179.45 179.64 3h1p n THR 173 N -3.86 0.00 1.00 -0.16 -2.24 -1.26 -2.27 114.28 105.50 3h1p n THR 173 Ca 0.04 -0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.94 3h1p n THR 173 Cb 0.44 -0.47 0.08 0.00 -2.10 0.00 0.00 70.33 68.28 3h1p n THR 173 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3h1p n LEU 174 N -1.37 2.76 -4.63 3.22 4.77 -0.61 -4.13 117.00 117.01 3h1p n LEU 174 Ca 0.11 -0.94 -0.54 0.00 -0.03 0.00 0.00 56.01 54.61 3h1p n LEU 174 Cb 0.29 -0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.31 3h1p n LEU 174 CO 0.25 0.47 1.03 -0.11 -1.33 0.00 0.00 177.39 177.70 3h1p n LEU 175 N 1.02 1.84 -0.12 2.23 7.94 -0.96 -0.42 117.00 128.53 3h1p n LEU 175 Ca 0.13 1.11 -0.02 0.00 -1.11 0.00 0.00 56.01 56.12 3h1p n LEU 175 Cb 0.57 -1.17 -0.01 0.00 0.53 0.00 0.00 43.42 43.35 3h1p n LEU 175 CO 0.18 -0.87 -0.01 -0.62 -1.11 0.00 0.00 177.39 174.96 3h1p n GLU 176 N 3.43 -0.69 -4.48 1.96 1.02 -1.26 -5.02 120.64 115.60 3h1p n GLU 176 Ca 0.21 0.30 -0.29 0.00 -0.02 0.00 0.00 57.16 57.36 3h1p n GLU 176 Cb 0.17 -3.90 -0.13 0.00 -0.02 0.00 0.00 31.44 27.56 3h1p n GLU 176 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3h1p s LYS 177 N -1.11 1.64 0.29 3.49 1.02 0.44 -4.98 119.74 120.53 3h1p s LYS 177 Ca 0.00 -1.23 -0.29 0.00 0.02 0.00 0.00 55.97 54.47 3h1p s LYS 177 Cb 0.00 -2.00 -0.10 0.00 -0.52 0.00 0.00 37.83 35.21 3h1p s LYS 177 CO 0.00 0.48 1.34 -1.25 -0.92 0.00 0.00 175.35 175.00 3h1p s PRO 178 N -1.89 4.33 -0.26 -1.68 0.04 -1.26 -4.86 135.00 129.42 3h1p s PRO 178 Ca 0.15 2.22 0.02 0.00 0.04 0.00 0.00 61.00 63.43 3h1p s PRO 178 Cb -0.10 -3.10 0.07 0.00 0.04 0.00 0.00 34.50 31.41 3h1p s PRO 178 CO 0.06 -0.26 -0.07 0.15 0.04 0.00 0.00 177.00 176.93 3h1p s LYS 179 N -1.21 1.92 -0.10 4.56 1.02 -0.51 -2.15 119.74 123.28 3h1p s LYS 179 Ca 0.53 -1.30 -0.03 0.00 0.02 0.00 0.00 55.97 55.19 3h1p s LYS 179 Cb -0.40 -2.82 -0.03 0.00 -0.52 0.00 0.00 37.83 34.06 3h1p s LYS 179 CO 0.49 -0.63 0.03 -0.51 -0.92 0.00 0.00 175.35 173.80 3h1p s LEU 180 N 1.18 3.74 -0.08 3.17 1.43 -0.76 -2.17 118.68 125.19 3h1p s LEU 180 Ca -0.05 0.20 0.01 0.00 -1.03 0.00 0.00 54.13 53.26 3h1p s LEU 180 Cb -0.19 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.17 3h1p s LEU 180 CO -0.06 0.37 -0.08 -0.36 0.23 0.00 0.00 176.35 176.45 3h1p s PHE 181 N -0.83 1.28 -0.17 0.29 0.40 -0.24 -0.49 117.98 118.21 3h1p s PHE 181 Ca 0.13 -0.53 -0.03 0.00 -0.60 0.00 0.00 56.93 55.90 3h1p s PHE 181 Cb -0.12 -1.04 -0.02 0.00 0.51 0.00 0.00 43.02 42.35 3h1p s PHE 181 CO 0.03 -0.36 -0.05 -0.06 0.70 0.00 0.00 175.22 175.47 3h1p s PHE 182 N 1.25 2.97 -0.22 0.36 0.40 -0.16 -0.41 117.98 122.16 3h1p s PHE 182 Ca -0.04 -0.53 0.01 0.00 -0.60 0.00 0.00 56.93 55.77 3h1p s PHE 182 Cb -0.14 -1.98 0.05 0.00 0.51 0.00 0.00 43.02 41.46 3h1p s PHE 182 CO -0.03 -0.21 -0.08 0.42 0.70 0.00 0.00 175.22 176.03 3h1p s ILE 183 N 0.68 1.60 -0.50 0.64 1.01 -0.30 0.28 121.20 124.62 3h1p s ILE 183 Ca -0.03 -1.14 -0.14 0.00 0.00 0.00 0.00 60.65 59.35 3h1p s ILE 183 Cb -0.15 -1.78 0.12 0.00 0.01 0.00 0.00 42.46 40.66 3h1p s ILE 183 CO 0.02 0.02 0.43 -1.58 0.00 0.00 0.00 174.94 173.84 3h1p s GLN 184 N 1.38 2.83 0.02 2.79 2.00 0.59 -0.50 119.66 128.77 3h1p s GLN 184 Ca -0.04 -1.66 -0.27 0.00 -2.00 0.00 0.00 55.36 51.39 3h1p s GLN 184 Cb -0.18 -4.15 0.07 0.00 0.80 0.00 0.00 33.01 29.55 3h1p s GLN 184 CO -0.07 -1.23 0.62 0.00 -0.50 0.00 0.00 175.29 174.11 3h1p s ALA 185 N 1.53 -1.62 0.62 1.58 0.00 -1.26 -1.53 121.76 121.09 3h1p s ALA 185 Ca 0.04 0.95 -0.17 0.00 0.00 0.00 0.00 51.96 52.78 3h1p s ALA 185 Cb -0.28 0.29 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 3h1p s ALA 185 CO 0.02 -0.49 1.14 0.00 0.00 0.00 0.00 175.76 176.44 3h1p n ARG 187 N -1.97 1.71 0.00 0.00 1.74 0.12 -2.05 116.66 116.20 3h1p n ARG 187 Ca 0.12 -3.28 0.00 0.00 -0.77 0.00 0.00 57.85 53.92 3h1p n ARG 187 Cb 0.51 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 30.44 3h1p n ARG 187 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h1p n GLY 188 N -0.82 0.66 0.05 -0.13 0.00 -1.16 -0.05 105.19 103.73 3h1p n GLY 188 Ca 0.21 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.51 3h1p n GLY 188 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h1p n THR 189 N 7.11 0.38 -2.13 2.61 -2.24 -0.51 -3.36 114.28 116.14 3h1p n THR 189 Ca 0.00 -0.39 -0.38 0.00 -2.27 0.00 0.00 64.05 61.01 3h1p n THR 189 Cb 0.00 0.75 -0.00 0.00 -2.10 0.00 0.00 70.33 68.98 3h1p n THR 189 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3h1p s GLU 190 N -0.42 3.71 -0.02 -0.78 2.02 0.30 -4.69 118.70 118.82 3h1p s GLU 190 Ca 0.01 1.94 0.02 0.00 0.02 0.00 0.00 54.97 56.96 3h1p s GLU 190 Cb 0.01 -2.47 -0.03 0.00 0.10 0.00 0.00 34.13 31.74 3h1p s GLU 190 CO 0.00 -0.64 -0.04 -0.51 0.02 0.00 0.00 175.26 174.09 3h1p s LEU 191 N -2.95 3.29 -0.30 1.80 1.43 -1.26 -1.26 118.68 119.42 3h1p s LEU 191 Ca 0.63 -0.06 -0.16 0.00 -1.03 0.00 0.00 54.13 53.51 3h1p s LEU 191 Cb -0.33 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.04 3h1p s LEU 191 CO 0.40 0.31 0.42 -0.62 0.23 0.00 0.00 176.35 177.09 3h1p s ASP 192 N -1.25 6.27 0.43 2.29 -1.08 -1.26 -4.99 116.67 117.09 3h1p s ASP 192 Ca 0.16 0.13 0.24 0.00 -0.52 0.00 0.00 52.55 52.56 3h1p s ASP 192 Cb -0.11 -2.23 0.62 0.00 -1.46 0.00 0.00 42.92 39.74 3h1p s ASP 192 CO 0.06 -0.30 1.70 0.44 0.52 0.00 0.00 175.17 177.59 3h1p h ASP 193 N 8.29 0.00 -4.06 -0.34 3.32 -1.92 0.24 116.42 121.95 3h1p h ASP 193 Ca -0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.75 3h1p h ASP 193 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 3h1p h ASP 193 CO 0.69 0.15 0.00 0.61 -1.72 0.00 0.00 179.24 178.98 3h1p n GLY 194 N 0.70 -1.49 3.57 2.75 0.00 -1.26 -4.65 105.19 104.80 3h1p n GLY 194 Ca 0.02 -1.55 -0.15 0.00 0.00 0.00 0.00 46.02 44.34 3h1p n GLY 194 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3h1p s ILE 195 N -1.56 0.00 -0.07 -0.61 1.10 -1.26 -5.10 121.20 113.70 3h1p s ILE 195 Ca 0.00 -0.01 -0.06 0.00 -0.51 0.00 0.00 60.65 60.07 3h1p s ILE 195 Cb 0.00 -0.96 -0.24 0.00 0.15 0.00 0.00 42.46 41.40 3h1p s ILE 195 CO 0.00 -0.01 3.39 1.67 -2.11 0.00 0.00 174.94 177.88 3h1p n GLN 196 N 2.14 1.94 0.00 3.50 -0.06 -1.26 -5.24 117.38 118.40 3h1p n GLN 196 Ca -0.16 -0.99 0.00 0.00 -2.00 0.00 0.00 57.00 53.86 3h1p n GLN 196 Cb 0.56 -2.00 0.00 0.00 -4.06 0.00 0.00 30.24 24.73 3h1p n GLN 196 CO 0.00 0.00 0.00 0.98 -0.20 0.00 0.00 177.06 177.84 3h1p n TYR 211 N 2.59 0.00 -2.73 3.69 -0.00 -1.26 -5.37 117.16 114.08 3h1p n TYR 211 Ca 0.42 0.00 -0.43 0.00 -0.00 0.00 0.00 57.90 57.89 3h1p n TYR 211 Cb 0.83 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 40.14 3h1p n TYR 211 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.86 177.01 3h1p s LYS 212 N 0.00 4.27 0.06 2.98 1.02 -1.26 -5.07 119.74 121.74 3h1p s LYS 212 Ca 0.00 1.25 -0.14 0.00 0.02 0.00 0.00 55.97 57.10 3h1p s LYS 212 Cb 0.00 -3.62 -0.06 0.00 -0.52 0.00 0.00 37.83 33.63 3h1p s LYS 212 CO 0.00 -0.54 0.46 0.00 -0.92 0.00 0.00 175.35 174.34 3h1p s ALA 213 N 2.89 3.67 0.27 5.17 0.00 -1.26 -5.02 121.76 127.47 3h1p s ALA 213 Ca 0.42 -0.21 -0.31 0.00 0.00 0.00 0.00 51.96 51.86 3h1p s ALA 213 Cb -0.16 -2.41 -0.12 0.00 0.00 0.00 0.00 23.12 20.43 3h1p s ALA 213 CO 0.08 0.49 1.58 -2.30 0.00 0.00 0.00 175.76 175.61 3h1p n PRO 214 N 1.33 2.59 0.32 0.00 -0.02 -1.26 -4.84 135.00 133.11 3h1p n PRO 214 Ca -0.10 0.92 0.20 0.00 -2.02 0.00 0.00 63.50 62.51 3h1p n PRO 214 Cb 0.52 -2.69 1.10 0.00 -0.02 0.00 0.00 33.50 32.41 3h1p n PRO 214 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 3h1p h VAL 215 N 3.36 0.15 -0.02 -1.45 -1.51 -1.96 -1.67 116.25 113.15 3h1p h VAL 215 Ca -0.46 -0.06 0.00 0.00 -1.23 0.00 0.00 66.70 64.95 3h1p h VAL 215 Cb 1.23 1.05 0.00 0.00 -2.13 0.00 0.00 31.29 31.44 3h1p h VAL 215 CO 0.81 0.01 -0.14 -0.62 -1.23 0.00 0.00 177.57 176.40 3h1p n GLU 216 N -3.28 1.61 -1.42 5.19 -0.58 -1.26 -0.96 120.64 119.94 3h1p n GLU 216 Ca -0.03 -1.15 -0.33 0.00 -0.42 0.00 0.00 57.16 55.23 3h1p n GLU 216 Cb 0.09 -1.48 0.09 0.00 -0.57 0.00 0.00 31.44 29.58 3h1p n GLU 216 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h1p s ALA 217 N -2.19 2.15 -1.27 0.62 0.00 -0.63 -4.10 121.76 116.35 3h1p s ALA 217 Ca 0.29 0.68 0.00 0.00 0.00 0.00 0.00 51.96 52.93 3h1p s ALA 217 Cb 0.20 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.92 3h1p s ALA 217 CO 0.41 -1.80 0.00 -0.25 0.00 0.00 0.00 175.76 174.11 3h1p n ASP 218 N -2.91 -4.37 -4.94 0.00 8.00 -0.30 -4.80 116.55 107.23 3h1p n ASP 218 Ca 0.12 0.20 -0.24 0.00 0.71 0.00 0.00 54.79 55.57 3h1p n ASP 218 Cb 0.51 -3.21 -0.02 0.00 -0.02 0.00 0.00 41.12 38.38 3h1p n ASP 218 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3h1p s PHE 219 N -2.54 3.48 -0.06 1.24 0.40 -1.26 -1.42 117.98 117.82 3h1p s PHE 219 Ca 0.00 0.23 -0.02 0.00 -0.60 0.00 0.00 56.93 56.54 3h1p s PHE 219 Cb 0.00 -1.78 0.04 0.00 0.51 0.00 0.00 43.02 41.79 3h1p s PHE 219 CO 0.00 0.32 0.12 -1.17 0.70 0.00 0.00 175.22 175.19 3h1p s LEU 220 N -3.80 0.68 -0.18 -0.37 0.20 -0.92 -0.28 118.68 114.00 3h1p s LEU 220 Ca 0.37 0.24 -0.00 0.00 0.69 0.00 0.00 54.13 55.44 3h1p s LEU 220 Cb -0.10 0.25 0.01 0.00 -0.43 0.00 0.00 46.19 45.92 3h1p s LEU 220 CO 0.31 -0.16 -0.16 -0.36 -0.29 0.00 0.00 176.35 175.69 3h1p s PHE 221 N 1.32 2.81 -0.57 5.38 0.40 -0.06 -1.08 117.98 126.18 3h1p s PHE 221 Ca -0.07 -1.39 -0.10 0.00 -0.60 0.00 0.00 56.93 54.77 3h1p s PHE 221 Cb -0.12 -1.95 0.15 0.00 0.51 0.00 0.00 43.02 41.60 3h1p s PHE 221 CO -0.05 -0.69 0.46 0.00 0.70 0.00 0.00 175.22 175.63 3h1p s ALA 222 N 1.24 3.58 0.29 5.36 0.00 0.45 -0.02 121.76 132.67 3h1p s ALA 222 Ca 0.03 -2.81 -0.14 0.00 0.00 0.00 0.00 51.96 49.04 3h1p s ALA 222 Cb -0.14 -2.97 -0.08 0.00 0.00 0.00 0.00 23.12 19.92 3h1p s ALA 222 CO -0.08 -2.02 0.69 0.71 0.00 0.00 0.00 175.76 175.05 3h1p s TYR 223 N 0.91 3.41 -0.08 0.00 1.51 -0.07 -1.15 117.35 121.89 3h1p s TYR 223 Ca 0.10 1.15 0.30 0.00 -1.01 0.00 0.00 57.07 57.61 3h1p s TYR 223 Cb -0.23 -2.48 1.31 0.00 -0.11 0.00 0.00 41.96 40.46 3h1p s TYR 223 CO -0.02 0.16 1.90 0.66 -1.11 0.00 0.00 175.55 177.13 3h1p h SER 224 N 2.43 0.00 -5.22 2.29 4.64 -1.09 -2.11 113.55 114.49 3h1p h SER 224 Ca -0.48 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.80 3h1p h SER 224 Cb 1.17 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.18 3h1p h SER 224 CO 0.66 0.00 -0.08 0.28 -0.87 0.00 0.00 176.83 176.83 3h1p s THR 225 N -3.57 0.00 0.43 2.95 -1.32 -1.26 -3.46 115.64 109.40 3h1p s THR 225 Ca 0.02 -1.36 -0.10 0.00 -1.21 0.00 0.00 61.69 59.04 3h1p s THR 225 Cb 0.09 -2.20 -0.06 0.00 -1.51 0.00 0.00 72.50 68.83 3h1p s THR 225 CO 0.46 0.00 0.79 0.68 -2.21 0.00 0.00 174.62 174.34 3h1p s VAL 226 N -3.97 4.80 0.47 5.08 -7.23 -1.11 -4.20 120.40 114.23 3h1p s VAL 226 Ca 0.21 0.57 -0.23 0.00 -1.81 0.00 0.00 61.98 60.72 3h1p s VAL 226 Cb -0.01 -3.76 -0.09 0.00 0.56 0.00 0.00 36.38 33.07 3h1p s VAL 226 CO 0.09 -0.61 1.01 -2.65 -0.31 0.00 0.00 175.10 172.62 3h1p n PRO 227 N -1.55 1.27 0.00 4.82 -0.02 -1.26 -2.37 135.00 135.89 3h1p n PRO 227 Ca 0.02 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 3h1p n PRO 227 Cb 0.54 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 3h1p n PRO 227 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3h1p n GLY 228 N 1.19 2.93 3.92 -1.23 0.00 0.92 -4.99 105.19 107.95 3h1p n GLY 228 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.85 3h1p n GLY 228 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3h1p s TYR 229 N -2.22 3.48 0.98 1.61 1.51 -1.00 -0.54 117.35 121.17 3h1p s TYR 229 Ca 0.00 0.43 -0.12 0.00 -1.01 0.00 0.00 57.07 56.37 3h1p s TYR 229 Cb 0.00 -1.93 0.18 0.00 -0.11 0.00 0.00 41.96 40.09 3h1p s TYR 229 CO 0.00 0.27 1.09 0.71 -1.11 0.00 0.00 175.55 176.50 3h1p s TYR 230 N -2.03 2.10 0.05 2.71 2.02 -0.39 0.13 117.35 121.94 3h1p s TYR 230 Ca 0.40 1.12 0.05 0.00 -0.37 0.00 0.00 57.07 58.27 3h1p s TYR 230 Cb -0.11 -3.21 -0.02 0.00 -0.40 0.00 0.00 41.96 38.22 3h1p s TYR 230 CO 0.31 -2.81 -0.13 0.45 -1.57 0.00 0.00 175.55 171.79 3h1p s SER 231 N -3.34 1.56 -0.12 2.29 0.15 -1.26 -4.69 113.70 108.28 3h1p s SER 231 Ca 0.65 -0.50 -0.07 0.00 0.70 0.00 0.00 55.95 56.73 3h1p s SER 231 Cb -0.19 -0.07 -0.04 0.00 -1.71 0.00 0.00 66.02 64.01 3h1p s SER 231 CO 0.58 -0.02 0.12 0.26 1.20 0.00 0.00 173.24 175.38 3h1p s TRP 232 N -1.00 3.54 -0.06 3.44 0.52 -1.26 -4.79 118.94 119.32 3h1p s TRP 232 Ca -0.01 0.47 0.00 0.00 0.02 0.00 0.00 56.10 56.59 3h1p s TRP 232 Cb -0.08 -1.94 0.02 0.00 -1.15 0.00 0.00 33.47 30.32 3h1p s TRP 232 CO 0.01 0.68 -0.04 0.50 0.02 0.00 0.00 176.95 178.12 3h1p s ARG 233 N -0.92 0.93 -0.40 4.98 3.52 -1.26 -2.42 118.95 123.38 3h1p s ARG 233 Ca 0.14 -0.10 -0.24 0.00 -0.13 0.00 0.00 55.73 55.40 3h1p s ARG 233 Cb -0.12 -1.00 0.02 0.00 -1.56 0.00 0.00 34.95 32.28 3h1p s ARG 233 CO 0.03 -0.14 0.83 0.45 -0.81 0.00 0.00 175.30 175.66 3h1p s SER 234 N 1.22 6.53 0.51 -2.12 0.15 -0.16 -4.90 113.70 114.93 3h1p s SER 234 Ca -0.06 0.24 0.30 0.00 0.70 0.00 0.00 55.95 57.13 3h1p s SER 234 Cb -0.14 -2.41 1.42 0.00 -1.71 0.00 0.00 66.02 63.18 3h1p s SER 234 CO -0.02 -0.85 1.84 -0.65 1.20 0.00 0.00 173.24 174.76 3h1p h PRO 235 N 8.70 0.09 0.00 5.44 0.11 -1.84 0.30 132.00 144.79 3h1p h PRO 235 Ca -0.24 -0.01 -0.28 0.00 0.11 0.00 0.00 66.00 65.58 3h1p h PRO 235 Cb 1.09 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.13 3h1p h PRO 235 CO 0.95 0.06 -1.93 0.41 -0.21 0.00 0.00 178.00 177.28 3h1p n GLY 236 N -1.68 -1.04 0.00 -0.55 0.00 -1.26 -2.30 105.19 98.36 3h1p n GLY 236 Ca 0.22 -0.20 0.05 0.00 0.00 0.00 0.00 46.02 46.09 3h1p n GLY 236 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h1p n ARG 237 N -2.85 1.19 0.00 1.61 1.74 -0.63 -5.00 116.66 112.72 3h1p n ARG 237 Ca -0.21 -0.07 0.00 0.00 -0.77 0.00 0.00 57.85 56.81 3h1p n ARG 237 Cb 1.02 -1.15 0.00 0.00 -1.02 0.00 0.00 32.46 31.31 3h1p n ARG 237 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h1p n GLY 238 N 1.78 2.36 3.72 -0.13 0.00 0.95 -4.87 105.19 108.99 3h1p n GLY 238 Ca -0.01 -2.08 -0.35 0.00 0.00 0.00 0.00 46.02 43.58 3h1p n GLY 238 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h1p s SER 239 N 0.00 4.20 0.05 1.61 1.04 -1.26 -0.99 113.70 118.35 3h1p s SER 239 Ca 0.00 2.49 -0.18 0.00 0.48 0.00 0.00 55.95 58.75 3h1p s SER 239 Cb 0.00 -2.60 -0.16 0.00 0.10 0.00 0.00 66.02 63.36 3h1p s SER 239 CO 0.00 -2.27 1.27 -0.50 0.98 0.00 0.00 173.24 172.73 3h1p h TRP 240 N -0.07 0.69 -0.27 5.02 6.55 -1.86 -1.42 115.95 124.59 3h1p h TRP 240 Ca -0.49 -0.27 0.06 0.00 0.95 0.00 0.00 58.89 59.14 3h1p h TRP 240 Cb 1.32 -0.12 -0.06 0.00 -0.86 0.00 0.00 29.16 29.43 3h1p h TRP 240 CO 0.44 1.03 -0.15 0.35 -1.05 0.00 0.00 178.44 179.06 3h1p h PHE 241 N 0.15 -0.38 -0.23 0.49 3.57 -1.90 0.47 116.94 119.11 3h1p h PHE 241 Ca -0.01 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 3h1p h PHE 241 Cb 1.03 0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.98 3h1p h PHE 241 CO 0.10 -0.23 -0.01 0.28 -2.23 0.00 0.00 178.31 176.22 3h1p h VAL 242 N -0.12 1.26 -0.01 1.41 2.07 -1.93 0.11 116.25 119.04 3h1p h VAL 242 Ca 0.15 -0.94 0.03 0.00 0.82 0.00 0.00 66.70 66.76 3h1p h VAL 242 Cb 0.34 1.41 -0.05 0.00 -1.52 0.00 0.00 31.29 31.47 3h1p h VAL 242 CO -0.35 0.29 -0.39 1.56 0.02 0.00 0.00 177.57 178.70 3h1p h GLN 243 N 0.18 -0.52 -0.28 1.57 4.20 -0.99 -0.25 115.11 119.02 3h1p h GLN 243 Ca 0.06 0.04 0.06 0.00 0.06 0.00 0.00 58.65 58.87 3h1p h GLN 243 Cb 0.43 0.12 -0.06 0.00 0.30 0.00 0.00 27.48 28.27 3h1p h GLN 243 CO 0.01 -0.35 -0.10 0.00 -0.67 0.00 0.00 178.83 177.72 3h1p h ALA 244 N 0.06 0.14 -0.39 3.87 0.00 -0.65 -1.82 119.26 120.47 3h1p h ALA 244 Ca 0.05 0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.14 3h1p h ALA 244 Cb 0.63 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.63 3h1p h ALA 244 CO -0.31 -0.50 0.05 1.25 0.00 0.00 0.00 179.25 179.74 3h1p h LEU 245 N -0.05 -0.06 -0.05 0.00 5.85 -0.03 -0.73 115.31 120.24 3h1p h LEU 245 Ca 0.14 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 3h1p h LEU 245 Cb 0.27 0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.42 3h1p h LEU 245 CO -0.32 0.00 -0.01 0.00 -0.34 0.00 0.00 178.44 177.77 3h1p h SER 247 N -0.25 -1.72 -0.33 0.00 0.87 -1.04 0.31 113.55 111.39 3h1p h SER 247 Ca 0.01 0.24 -0.06 0.00 -1.23 0.00 0.00 61.79 60.75 3h1p h SER 247 Cb 0.40 0.73 -0.02 0.00 -0.44 0.00 0.00 62.40 63.07 3h1p h SER 247 CO 0.00 -0.38 0.01 0.40 -0.53 0.00 0.00 176.83 176.34 3h1p h ILE 248 N -0.33 1.22 -0.25 2.23 1.08 -0.83 -2.74 117.51 117.88 3h1p h ILE 248 Ca 0.11 -0.90 -0.13 0.00 -0.39 0.00 0.00 64.86 63.55 3h1p h ILE 248 Cb 0.58 0.89 -0.01 0.00 -3.07 0.00 0.00 36.82 35.22 3h1p h ILE 248 CO -0.63 0.31 -0.40 -0.07 -0.69 0.00 0.00 178.15 176.68 3h1p h LEU 249 N 0.64 0.62 -0.75 1.44 3.38 0.65 0.11 115.31 121.40 3h1p h LEU 249 Ca 0.13 -0.28 0.06 0.00 0.09 0.00 0.00 57.88 57.89 3h1p h LEU 249 Cb 0.39 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.91 3h1p h LEU 249 CO 0.01 0.95 0.44 -0.33 0.09 0.00 0.00 178.44 179.60 3h1p h GLU 250 N 0.48 0.78 0.00 1.13 5.08 -0.16 0.54 114.58 122.43 3h1p h GLU 250 Ca 0.04 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 3h1p h GLU 250 Cb 0.90 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 3h1p h GLU 250 CO 0.08 0.51 -0.98 0.93 -1.00 0.00 0.00 179.01 178.56 3h1p h GLU 251 N 0.80 0.00 0.00 2.33 5.08 -1.21 -3.42 114.58 118.17 3h1p h GLU 251 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 3h1p h GLU 251 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3h1p h GLU 251 CO -0.18 0.18 0.00 0.72 -1.00 0.00 0.00 179.01 178.73 3h1p n HIS 252 N -2.88 0.00 -0.30 4.33 8.25 0.34 -4.86 115.22 120.11 3h1p n HIS 252 Ca -0.03 -0.01 0.23 0.00 -0.26 0.00 0.00 57.72 57.64 3h1p n HIS 252 Cb 0.68 -0.00 0.53 0.00 1.12 0.00 0.00 29.99 32.33 3h1p n HIS 252 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 3h1p h GLY 253 N 0.00 0.99 -1.37 -1.41 0.00 -0.01 -1.38 103.07 99.89 3h1p h GLY 253 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.15 3h1p h GLY 253 CO 0.00 -0.08 -0.16 0.28 0.00 0.00 0.00 176.54 176.57 3h1p n LYS 254 N -4.55 1.72 0.00 4.80 4.01 -1.26 -4.22 118.16 118.66 3h1p n LYS 254 Ca 0.23 -1.42 0.00 0.00 -0.51 0.00 0.00 58.31 56.61 3h1p n LYS 254 Cb 0.86 -1.40 0.00 0.00 -0.51 0.00 0.00 35.03 33.98 3h1p n LYS 254 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 3h1p n ASP 255 N 0.69 0.01 -4.77 4.39 5.68 -0.66 -4.35 116.55 117.54 3h1p n ASP 255 Ca 0.11 -0.18 -0.29 0.00 -0.50 0.00 0.00 54.79 53.92 3h1p n ASP 255 Cb 0.48 0.27 -0.06 0.00 -1.14 0.00 0.00 41.12 40.67 3h1p n ASP 255 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 3h1p s LEU 256 N -0.54 3.76 0.54 -2.12 1.43 -0.61 -5.11 118.68 116.03 3h1p s LEU 256 Ca 0.00 -0.06 -0.19 0.00 -1.03 0.00 0.00 54.13 52.85 3h1p s LEU 256 Cb 0.00 -2.43 -0.06 0.00 0.03 0.00 0.00 46.19 43.73 3h1p s LEU 256 CO 0.00 0.14 1.09 -0.70 0.23 0.00 0.00 176.35 177.11 3h1p s GLU 257 N -2.58 3.44 0.27 1.70 -6.30 -1.26 -4.63 118.70 109.33 3h1p s GLU 257 Ca 0.29 1.44 -0.01 0.00 -2.50 0.00 0.00 54.97 54.20 3h1p s GLU 257 Cb -0.12 -2.03 0.49 0.00 0.00 0.00 0.00 34.13 32.48 3h1p s GLU 257 CO 0.22 -0.74 1.83 0.97 0.02 0.00 0.00 175.26 177.55 3h1p h ILE 258 N 1.08 0.92 -0.39 -3.70 6.09 -1.62 -0.15 117.51 119.74 3h1p h ILE 258 Ca -0.49 -0.32 -0.06 0.00 -1.37 0.00 0.00 64.86 62.62 3h1p h ILE 258 Cb 1.24 -0.10 -0.02 0.00 0.47 0.00 0.00 36.82 38.41 3h1p h ILE 258 CO 0.57 0.17 -0.01 0.24 -3.07 0.00 0.00 178.15 176.05 3h1p h MET 259 N 0.94 0.63 -0.60 2.19 2.86 -1.92 -0.32 114.93 118.70 3h1p h MET 259 Ca 0.46 -0.15 -0.07 0.00 -2.06 0.00 0.00 59.70 57.88 3h1p h MET 259 Cb 0.43 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 3h1p h MET 259 CO -0.26 0.66 0.11 1.96 1.06 0.00 0.00 176.91 180.45 3h1p h GLN 260 N 0.59 0.98 -0.15 1.72 4.20 -1.46 0.21 115.11 121.21 3h1p h GLN 260 Ca 0.12 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.58 3h1p h GLN 260 Cb 0.40 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 3h1p h GLN 260 CO 0.02 0.92 0.09 0.82 -0.67 0.00 0.00 178.83 180.01 3h1p h ILE 261 N 0.89 1.07 0.00 2.54 2.04 -0.63 -1.37 117.51 122.06 3h1p h ILE 261 Ca 0.18 -0.16 -0.14 0.00 1.00 0.00 0.00 64.86 65.74 3h1p h ILE 261 Cb 0.40 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 3h1p h ILE 261 CO 0.01 0.06 -0.68 -0.07 0.00 0.00 0.00 178.15 177.47 3h1p h LEU 262 N 0.18 0.00 -0.49 1.44 3.38 -0.87 -0.38 115.31 118.56 3h1p h LEU 262 Ca 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 3h1p h LEU 262 Cb 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3h1p h LEU 262 CO -0.01 0.68 0.28 0.74 0.09 0.00 0.00 178.44 180.21 3h1p h THR 263 N 0.00 1.16 -0.15 0.22 2.02 -0.40 0.21 112.91 115.96 3h1p h THR 263 Ca -0.01 -0.41 -0.05 0.00 0.77 0.00 0.00 66.41 66.72 3h1p h THR 263 Cb 1.22 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 68.17 3h1p h THR 263 CO 0.09 0.17 -0.12 0.03 0.37 0.00 0.00 175.52 176.06 3h1p h ARG 264 N 0.65 0.24 -0.24 6.66 3.08 -0.70 -0.99 114.38 123.08 3h1p h ARG 264 Ca 0.17 -0.05 -0.17 0.00 0.07 0.00 0.00 59.98 60.00 3h1p h ARG 264 Cb 0.03 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 3h1p h ARG 264 CO -0.03 0.38 -0.54 0.28 -1.07 0.00 0.00 179.97 178.99 3h1p h VAL 265 N 0.23 1.30 -0.27 2.04 2.07 -0.50 -1.82 116.25 119.31 3h1p h VAL 265 Ca 0.05 -1.75 0.06 0.00 0.82 0.00 0.00 66.70 65.88 3h1p h VAL 265 Cb 0.37 1.69 -0.06 0.00 -1.52 0.00 0.00 31.29 31.76 3h1p h VAL 265 CO 0.02 0.56 -0.15 0.78 0.02 0.00 0.00 177.57 178.80 3h1p h ASN 266 N 0.55 -0.50 -0.79 0.57 2.35 0.40 -1.47 115.58 116.70 3h1p h ASN 266 Ca 0.01 0.11 0.01 0.00 -0.55 0.00 0.00 56.30 55.89 3h1p h ASN 266 Cb 1.11 0.27 -0.04 0.00 0.05 0.00 0.00 38.32 39.71 3h1p h ASN 266 CO 0.11 -0.19 0.52 -0.78 -1.65 0.00 0.00 177.43 175.44 3h1p h ASP 267 N -0.12 0.90 -0.11 5.81 3.58 -1.04 -2.10 116.42 123.34 3h1p h ASP 267 Ca 0.14 -0.02 -0.08 0.00 0.42 0.00 0.00 57.03 57.49 3h1p h ASP 267 Cb 0.34 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.17 3h1p h ASP 267 CO -0.35 0.65 -0.24 -0.09 -2.88 0.00 0.00 179.24 176.33 3h1p h ARG 268 N 1.06 0.36 -0.67 0.28 2.43 -0.83 0.30 114.38 117.31 3h1p h ARG 268 Ca 0.29 -0.24 -0.06 0.00 -0.81 0.00 0.00 59.98 59.17 3h1p h ARG 268 Cb -0.11 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.44 3h1p h ARG 268 CO -0.06 0.84 0.19 0.28 -1.51 0.00 0.00 179.97 179.70 3h1p h VAL 269 N -0.07 1.25 0.12 0.20 2.07 -1.16 0.36 116.25 119.02 3h1p h VAL 269 Ca 0.00 -0.89 -0.01 0.00 0.82 0.00 0.00 66.70 66.62 3h1p h VAL 269 Cb 0.83 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 3h1p h VAL 269 CO 0.05 0.34 -0.06 0.00 0.02 0.00 0.00 177.57 177.93 3h1p h ALA 270 N 1.20 -0.16 0.00 1.67 0.00 -1.29 -3.28 119.26 117.40 3h1p h ALA 270 Ca 0.22 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 3h1p h ALA 270 Cb 0.32 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3h1p h ALA 270 CO -0.00 -0.39 -0.06 0.00 0.00 0.00 0.00 179.25 178.80 3h1p h ARG 271 N -0.57 0.00 -0.00 0.00 3.08 -0.29 -3.39 114.38 113.21 3h1p h ARG 271 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3h1p h ARG 271 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.50 3h1p h ARG 271 CO 0.03 0.06 -0.40 1.58 -1.07 0.00 0.00 179.97 180.16 3h1p n HIS 272 N -3.13 0.00 -4.32 3.04 -0.00 0.10 -4.99 115.22 105.93 3h1p n HIS 272 Ca 0.02 0.00 -0.21 0.00 0.46 0.00 0.00 57.72 57.99 3h1p n HIS 272 Cb 0.45 0.00 -0.13 0.00 -0.12 0.00 0.00 29.99 30.20 3h1p n HIS 272 CO 0.00 0.00 0.00 -0.06 0.46 0.00 0.00 176.34 176.74 3h1p s PHE 273 N -1.80 1.44 -0.19 1.57 0.40 -1.23 -5.06 117.98 113.10 3h1p s PHE 273 Ca 0.04 -0.41 -0.10 0.00 -0.60 0.00 0.00 56.93 55.86 3h1p s PHE 273 Cb 0.07 -0.82 0.07 0.00 0.51 0.00 0.00 43.02 42.84 3h1p s PHE 273 CO 0.35 0.09 0.45 -2.00 0.70 0.00 0.00 175.22 174.82 3h1p s GLU 274 N -1.52 0.43 0.34 0.44 2.12 -1.26 -4.77 118.70 114.48 3h1p s GLU 274 Ca 0.02 0.89 -0.29 0.00 0.36 0.00 0.00 54.97 55.96 3h1p s GLU 274 Cb -0.09 0.06 -0.11 0.00 0.26 0.00 0.00 34.13 34.25 3h1p s GLU 274 CO 0.02 -0.17 1.44 -1.54 -0.54 0.00 0.00 175.26 174.47 3h1p s SER 275 N 1.62 6.52 -0.16 -1.70 1.04 -0.20 -4.80 113.70 116.02 3h1p s SER 275 Ca -0.09 2.88 -0.00 0.00 0.48 0.00 0.00 55.95 59.22 3h1p s SER 275 Cb -0.08 -2.65 -0.00 0.00 0.10 0.00 0.00 66.02 63.38 3h1p s SER 275 CO -0.14 -0.75 -0.13 -1.10 0.98 0.00 0.00 173.24 172.10 3h1p s GLN 276 N -1.64 3.27 -0.05 4.02 -0.21 -1.26 0.80 119.66 124.60 3h1p s GLN 276 Ca 0.53 -0.72 -0.25 0.00 0.02 0.00 0.00 55.36 54.95 3h1p s GLN 276 Cb -0.44 -2.69 0.05 0.00 1.00 0.00 0.00 33.01 30.94 3h1p s GLN 276 CO 0.56 0.02 0.55 0.45 -2.12 0.00 0.00 175.29 174.75 3h1p s SER 277 N 0.84 -0.50 -0.01 5.90 0.15 -1.26 -4.94 113.70 113.88 3h1p s SER 277 Ca -0.04 0.53 -0.17 0.00 0.70 0.00 0.00 55.95 56.97 3h1p s SER 277 Cb -0.15 0.50 -0.10 0.00 -1.71 0.00 0.00 66.02 64.57 3h1p s SER 277 CO -0.00 -0.53 0.79 0.44 1.20 0.00 0.00 173.24 175.14 3h1p h ASP 278 N 3.42 -0.53 -1.52 5.45 3.32 -1.99 -3.42 116.42 121.16 3h1p h ASP 278 Ca -0.28 0.02 -0.68 0.00 0.02 0.00 0.00 57.03 56.11 3h1p h ASP 278 Cb 1.15 0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.84 3h1p h ASP 278 CO 0.38 -0.18 1.15 -0.67 -1.72 0.00 0.00 179.24 178.20 3h1p n ASP 279 N -4.78 2.60 0.13 6.45 -0.08 -1.26 -4.85 116.55 114.76 3h1p n ASP 279 Ca -0.08 0.81 0.13 0.00 -1.51 0.00 0.00 54.79 54.14 3h1p n ASP 279 Cb 0.25 -1.25 0.41 0.00 2.34 0.00 0.00 41.12 42.87 3h1p n ASP 279 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3h1p h PRO 280 N 9.65 0.00 -0.74 -0.67 0.13 -1.96 -0.87 132.00 137.55 3h1p h PRO 280 Ca -0.40 0.00 0.17 0.00 -0.87 0.00 0.00 66.00 64.90 3h1p h PRO 280 Cb 1.31 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.39 3h1p h PRO 280 CO 0.98 0.00 0.50 1.25 -0.23 0.00 0.00 178.00 180.50 3h1p h HIS 281 N 0.00 0.32 -0.44 1.56 2.76 -1.96 -2.70 115.15 114.69 3h1p h HIS 281 Ca 0.00 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 3h1p h HIS 281 Cb 0.68 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.54 3h1p h HIS 281 CO 0.00 0.11 0.00 1.19 -1.30 0.00 0.00 177.93 177.93 3h1p n PHE 282 N -4.44 0.59 -3.42 5.26 3.72 -0.35 -4.99 117.46 113.84 3h1p n PHE 282 Ca 0.14 -0.44 -0.38 0.00 -0.05 0.00 0.00 57.45 56.73 3h1p n PHE 282 Cb 0.62 -0.01 -0.06 0.00 -0.94 0.00 0.00 39.48 39.09 3h1p n PHE 282 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3h1p s HIS 283 N -1.04 3.67 -1.52 1.38 2.46 -1.02 -4.37 115.29 114.85 3h1p s HIS 283 Ca 0.32 0.99 0.00 0.00 0.47 0.00 0.00 55.06 56.84 3h1p s HIS 283 Cb 0.17 -2.40 0.00 0.00 -0.13 0.00 0.00 32.58 30.22 3h1p s HIS 283 CO 0.22 0.49 0.00 0.39 -2.47 0.00 0.00 174.74 173.37 3h1p n GLU 284 N 2.40 -1.06 -1.51 2.88 1.02 0.24 -4.93 120.64 119.68 3h1p n GLU 284 Ca -0.11 0.96 -0.30 0.00 -0.02 0.00 0.00 57.16 57.69 3h1p n GLU 284 Cb 0.52 -5.13 0.08 0.00 -0.02 0.00 0.00 31.44 26.88 3h1p n GLU 284 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3h1p s LYS 285 N -3.55 2.41 0.44 3.49 -0.14 -1.26 -4.55 119.74 116.59 3h1p s LYS 285 Ca 0.00 0.84 0.04 0.00 -1.36 0.00 0.00 55.97 55.49 3h1p s LYS 285 Cb 0.00 -1.94 -0.04 0.00 -1.68 0.00 0.00 37.83 34.17 3h1p s LYS 285 CO 0.00 -1.44 0.02 0.15 -0.76 0.00 0.00 175.35 173.32 3h1p s LYS 286 N -5.07 2.03 -0.04 1.68 -0.14 0.84 -1.03 119.74 118.01 3h1p s LYS 286 Ca 0.60 -2.22 -0.08 0.00 -1.36 0.00 0.00 55.97 52.90 3h1p s LYS 286 Cb -0.15 -1.41 0.01 0.00 -1.68 0.00 0.00 37.83 34.60 3h1p s LYS 286 CO 0.55 -0.24 0.19 -1.14 -0.76 0.00 0.00 175.35 173.95 3h1p s GLN 287 N -3.80 0.38 -0.03 1.68 0.74 -1.26 -4.05 119.66 113.32 3h1p s GLN 287 Ca 0.21 -0.03 0.00 0.00 0.05 0.00 0.00 55.36 55.60 3h1p s GLN 287 Cb 0.06 0.17 0.03 0.00 1.10 0.00 0.00 33.01 34.36 3h1p s GLN 287 CO 0.11 -0.08 -0.01 -1.50 -0.55 0.00 0.00 175.29 173.26 3h1p s ILE 288 N -0.63 0.26 0.91 -2.34 1.10 -1.26 -3.64 121.20 115.61 3h1p s ILE 288 Ca -0.07 0.04 -0.14 0.00 -0.51 0.00 0.00 60.65 59.97 3h1p s ILE 288 Cb -0.04 -0.35 0.18 0.00 0.15 0.00 0.00 42.46 42.39 3h1p s ILE 288 CO 0.01 0.17 1.27 -2.84 -2.11 0.00 0.00 174.94 171.44 3h1p s PRO 289 N 1.06 0.93 -0.22 3.50 0.02 -1.23 -2.77 135.00 136.30 3h1p s PRO 289 Ca -0.09 -0.42 -0.04 0.00 0.02 0.00 0.00 61.00 60.48 3h1p s PRO 289 Cb -0.14 -1.91 0.11 0.00 0.02 0.00 0.00 34.50 32.58 3h1p s PRO 289 CO -0.01 -2.20 0.30 0.00 -0.33 0.00 0.00 177.00 174.76 3h1p s VAL 291 N 2.44 4.74 -0.25 0.00 1.01 -1.26 -0.89 120.40 126.19 3h1p s VAL 291 Ca 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.02 3h1p s VAL 291 Cb -0.15 -3.18 0.03 0.00 0.00 0.00 0.00 36.38 33.07 3h1p s VAL 291 CO -0.14 0.39 -0.07 -0.69 0.00 0.00 0.00 175.10 174.59 3h1p s VAL 292 N 0.99 2.76 -0.19 2.92 1.01 0.98 -4.99 120.40 123.87 3h1p s VAL 292 Ca 0.05 -1.08 -0.01 0.00 0.00 0.00 0.00 61.98 60.94 3h1p s VAL 292 Cb -0.14 -2.41 0.00 0.00 0.00 0.00 0.00 36.38 33.84 3h1p s VAL 292 CO 0.03 0.20 -0.12 -0.55 0.00 0.00 0.00 175.10 174.66 3h1p s SER 293 N 1.30 3.72 -0.22 3.32 0.15 -1.26 -0.88 113.70 119.82 3h1p s SER 293 Ca -0.00 -0.51 0.15 0.00 0.70 0.00 0.00 55.95 56.28 3h1p s SER 293 Cb -0.17 -1.61 0.73 0.00 -1.71 0.00 0.00 66.02 63.27 3h1p s SER 293 CO -0.05 0.00 1.65 0.23 1.20 0.00 0.00 173.24 176.27 3h1p n MET 294 N 4.62 4.29 -2.24 5.44 2.81 0.61 -5.01 117.12 127.64 3h1p n MET 294 Ca -0.19 -3.07 -0.33 0.00 -1.81 0.00 0.00 57.70 52.29 3h1p n MET 294 Cb 0.51 -2.14 -0.01 0.00 -0.71 0.00 0.00 33.22 30.87 3h1p n MET 294 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3h1p s LEU 295 N -2.79 3.62 0.00 4.03 1.43 -1.19 -1.15 118.68 122.63 3h1p s LEU 295 Ca 0.51 1.81 0.11 0.00 -1.03 0.00 0.00 54.13 55.54 3h1p s LEU 295 Cb 0.39 -4.54 0.06 0.00 0.03 0.00 0.00 46.19 42.13 3h1p s LEU 295 CO 0.14 -0.97 0.79 0.35 0.23 0.00 0.00 176.35 176.89 3h1p n THR 296 N -1.65 0.00 -3.84 5.49 -2.24 -1.26 -4.87 114.28 105.90 3h1p n THR 296 Ca 0.09 -0.46 -0.09 0.00 -2.27 0.00 0.00 64.05 61.31 3h1p n THR 296 Cb 0.53 1.20 -0.06 0.00 -2.10 0.00 0.00 70.33 69.90 3h1p n THR 296 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3h1p s LYS 297 N -1.14 1.07 0.52 -0.78 -0.14 -1.26 -5.02 119.74 112.99 3h1p s LYS 297 Ca 0.12 -0.99 -0.20 0.00 -1.36 0.00 0.00 55.97 53.54 3h1p s LYS 297 Cb 0.09 0.40 -0.06 0.00 -1.68 0.00 0.00 37.83 36.58 3h1p s LYS 297 CO 0.19 -0.39 1.14 -1.21 -0.76 0.00 0.00 175.35 174.32 3h1p s GLU 298 N -3.89 3.46 -0.19 1.68 2.02 0.76 -4.72 118.70 117.82 3h1p s GLU 298 Ca 0.10 1.66 0.00 0.00 0.02 0.00 0.00 54.97 56.75 3h1p s GLU 298 Cb 0.03 -2.11 0.04 0.00 0.10 0.00 0.00 34.13 32.19 3h1p s GLU 298 CO -0.06 -0.77 -0.08 -1.17 0.02 0.00 0.00 175.26 173.20 3h1p s LEU 299 N -3.59 2.11 0.05 1.80 2.96 -1.26 -0.16 118.68 120.58 3h1p s LEU 299 Ca 0.70 -0.84 0.04 0.00 -0.22 0.00 0.00 54.13 53.81 3h1p s LEU 299 Cb -0.25 -1.14 -0.04 0.00 0.50 0.00 0.00 46.19 45.27 3h1p s LEU 299 CO 0.29 -0.16 -0.04 -0.31 -1.32 0.00 0.00 176.35 174.80 3h1p s TYR 300 N 1.47 2.92 -0.51 5.38 2.02 -1.26 -1.36 117.35 126.01 3h1p s TYR 300 Ca -0.01 -0.04 0.24 0.00 -0.37 0.00 0.00 57.07 56.89 3h1p s TYR 300 Cb -0.16 -1.56 0.28 0.00 -0.40 0.00 0.00 41.96 40.11 3h1p s TYR 300 CO -0.08 0.43 1.31 0.74 -1.57 0.00 0.00 175.55 176.38 3h1p h PHE 301 N 4.01 0.00 -3.31 2.71 0.04 -1.82 -3.45 116.94 115.12 3h1p h PHE 301 Ca -0.48 0.00 -0.58 0.00 2.80 0.00 0.00 57.97 59.71 3h1p h PHE 301 Cb 1.17 0.00 -0.09 0.00 2.20 0.00 0.00 35.95 39.23 3h1p h PHE 301 CO 0.59 0.00 -0.23 -1.12 -0.60 0.00 0.00 178.31 176.96 3h1p s SER 302 N -4.82 6.57 0.54 2.17 0.01 -1.26 -4.94 113.70 111.97 3h1p s SER 302 Ca 0.05 0.67 0.29 0.00 1.31 0.00 0.00 55.95 58.27 3h1p s SER 302 Cb 0.11 -2.24 1.45 0.00 0.21 0.00 0.00 66.02 65.56 3h1p s SER 302 CO 0.73 0.04 1.93 1.56 0.41 0.00 0.00 173.24 177.91 3h1p h GLN 303 N 6.71 0.00 0.00 12.44 4.20 -1.88 -3.50 115.11 133.08 3h1p h GLN 303 Ca -0.41 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.30 3h1p h GLN 303 Cb 1.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.95 3h1p h GLN 303 CO 0.76 0.00 0.00 -2.39 -0.67 0.00 0.00 178.83 176.53