#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cpm s VAL 75 N 0.00 -0.42 -0.25 5.18 -7.23 -1.26 -5.07 120.40 111.35 3cpm s VAL 75 Ca 0.00 0.03 -0.10 0.00 -1.81 0.00 0.00 61.98 60.10 3cpm s VAL 75 Cb 0.00 -0.63 -0.05 0.00 0.56 0.00 0.00 36.38 36.26 3cpm s VAL 75 CO 0.00 -0.08 0.15 -1.10 -0.31 0.00 0.00 175.10 173.76 3cpm s GLN 76 N 2.41 3.96 0.06 4.82 -0.21 -1.26 -4.89 119.66 124.55 3cpm s GLN 76 Ca 0.06 -0.33 -0.09 0.00 0.02 0.00 0.00 55.36 55.02 3cpm s GLN 76 Cb -0.14 -3.53 0.00 0.00 1.00 0.00 0.00 33.01 30.34 3cpm s GLN 76 CO -0.12 -0.05 0.20 -0.59 -2.12 0.00 0.00 175.29 172.61 3cpm s PHE 77 N 1.35 0.08 0.00 0.91 -0.12 -1.26 -5.02 117.98 113.93 3cpm s PHE 77 Ca 0.07 -0.37 0.01 0.00 -0.05 0.00 0.00 56.93 56.59 3cpm s PHE 77 Cb -0.15 -0.03 -0.04 0.00 -0.63 0.00 0.00 43.02 42.17 3cpm s PHE 77 CO 0.07 -0.47 0.02 -1.21 -0.05 0.00 0.00 175.22 173.58 3cpm s GLU 78 N -3.01 2.85 0.15 1.99 8.01 -1.26 -5.12 118.70 122.31 3cpm s GLU 78 Ca -0.02 -0.59 -0.01 0.00 0.01 0.00 0.00 54.97 54.37 3cpm s GLU 78 Cb 0.01 -2.72 0.03 0.00 -4.31 0.00 0.00 34.13 27.14 3cpm s GLU 78 CO -0.06 0.63 0.21 0.25 0.01 0.00 0.00 175.26 176.29 3cpm n THR 79 N 1.28 0.00 0.00 3.63 -2.24 -1.26 -3.97 114.28 111.71 3cpm n THR 79 Ca -0.14 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 3cpm n THR 79 Cb 0.53 -1.43 0.00 0.00 -2.10 0.00 0.00 70.33 67.33 3cpm n THR 79 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3cpm n PRO 80 N -1.40 0.00 -1.80 -0.78 -0.02 -1.26 -4.99 135.00 124.75 3cpm n PRO 80 Ca 0.03 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.20 3cpm n PRO 80 Cb 0.11 0.00 0.03 0.00 -0.02 0.00 0.00 33.50 33.62 3cpm n PRO 80 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3cpm s LEU 81 N 0.00 3.29 -0.01 2.45 1.43 -1.25 -5.06 118.68 119.53 3cpm s LEU 81 Ca 0.00 1.66 0.06 0.00 -1.03 0.00 0.00 54.13 54.82 3cpm s LEU 81 Cb 0.00 -4.51 -0.02 0.00 0.03 0.00 0.00 46.19 41.70 3cpm s LEU 81 CO 0.00 -1.25 -0.20 -0.75 0.23 0.00 0.00 176.35 174.38 3cpm s LYS 82 N -4.68 1.60 0.11 1.70 2.20 -1.26 -4.91 119.74 114.50 3cpm s LYS 82 Ca 0.60 -0.76 -0.30 0.00 -0.36 0.00 0.00 55.97 55.14 3cpm s LYS 82 Cb -0.14 -1.58 -0.06 0.00 -1.51 0.00 0.00 37.83 34.54 3cpm s LYS 82 CO 0.47 0.43 1.06 0.42 -0.36 0.00 0.00 175.35 177.38 3cpm s ILE 83 N -0.53 4.23 -0.18 5.43 -1.09 -1.26 -4.35 121.20 123.46 3cpm s ILE 83 Ca 0.08 1.78 -0.17 0.00 -2.23 0.00 0.00 60.65 60.10 3cpm s ILE 83 Cb -0.08 -4.14 -0.04 0.00 -1.58 0.00 0.00 42.46 36.63 3cpm s ILE 83 CO -0.00 0.24 0.47 -0.69 -1.23 0.00 0.00 174.94 173.72 3cpm s VAL 84 N 0.28 5.16 0.00 2.92 1.01 0.67 -5.00 120.40 125.45 3cpm s VAL 84 Ca 0.51 0.86 -0.00 0.00 0.00 0.00 0.00 61.98 63.35 3cpm s VAL 84 Cb -0.26 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 3cpm s VAL 84 CO 0.31 0.24 0.08 -1.61 0.00 0.00 0.00 175.10 174.13 3cpm s GLU 85 N 1.28 3.06 0.55 2.72 2.02 -1.26 -4.44 118.70 122.63 3cpm s GLU 85 Ca 0.23 -0.50 -0.20 0.00 0.02 0.00 0.00 54.97 54.51 3cpm s GLU 85 Cb -0.15 -2.85 -0.06 0.00 0.10 0.00 0.00 34.13 31.17 3cpm s GLU 85 CO 0.09 0.64 1.11 0.98 0.02 0.00 0.00 175.26 178.10 3cpm n TYR 86 N 1.11 1.39 -0.31 1.61 9.36 -0.49 -1.62 117.16 128.21 3cpm n TYR 86 Ca -0.12 0.45 -0.07 0.00 3.32 0.00 0.00 57.90 61.48 3cpm n TYR 86 Cb 0.53 -2.23 0.17 0.00 -0.63 0.00 0.00 39.34 37.17 3cpm n TYR 86 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3cpm n PRO 87 N -0.84 2.43 -1.62 2.98 -0.04 -1.26 -4.74 135.00 131.90 3cpm n PRO 87 Ca 0.12 -1.91 -0.54 0.00 -0.04 0.00 0.00 63.50 61.13 3cpm n PRO 87 Cb 0.45 -1.83 -0.06 0.00 -0.04 0.00 0.00 33.50 32.01 3cpm n PRO 87 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 3cpm n ASP 88 N -0.17 1.72 -0.11 3.54 -0.08 -0.64 -4.65 116.55 116.16 3cpm n ASP 88 Ca 0.30 1.11 0.26 0.00 -1.51 0.00 0.00 54.79 54.94 3cpm n ASP 88 Cb 1.08 -1.15 0.72 0.00 2.34 0.00 0.00 41.12 44.11 3cpm n ASP 88 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3cpm h PRO 89 N 5.15 0.00 -0.19 -0.67 0.11 -2.00 -2.23 132.00 132.18 3cpm h PRO 89 Ca -0.48 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.69 3cpm h PRO 89 Cb 1.34 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.44 3cpm h PRO 89 CO 0.82 0.00 0.21 0.82 -0.21 0.00 0.00 178.00 179.64 3cpm h ILE 90 N 0.00 0.46 0.00 4.15 2.04 -1.93 0.58 117.51 122.81 3cpm h ILE 90 Ca 0.36 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.22 3cpm h ILE 90 Cb 1.49 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 38.40 3cpm h ILE 90 CO -0.00 0.00 0.00 0.18 0.00 0.00 0.00 178.15 178.33 3cpm n LEU 91 N -3.79 0.00 0.00 1.44 4.77 -0.84 -3.13 117.00 115.45 3cpm n LEU 91 Ca 0.02 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 3cpm n LEU 91 Cb 0.33 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3cpm n LEU 91 CO 0.27 -0.05 -0.13 0.54 -1.33 0.00 0.00 177.39 176.70 3cpm n ARG 92 N -1.30 4.52 0.00 3.23 5.12 0.07 -4.44 116.66 123.86 3cpm n ARG 92 Ca 0.12 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.04 3cpm n ARG 92 Cb 0.21 -0.58 0.00 0.00 -1.16 0.00 0.00 32.46 30.93 3cpm n ARG 92 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3cpm n ALA 93 N -0.99 0.87 -1.01 7.54 0.00 -0.48 -4.76 120.51 121.68 3cpm n ALA 93 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3cpm n ALA 93 Cb 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 18.84 3cpm n ALA 93 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3cpm n LYS 94 N -0.89 -2.10 -4.07 0.00 4.81 -1.26 -4.99 118.16 109.64 3cpm n LYS 94 Ca 0.00 1.74 -0.35 0.00 -0.87 0.00 0.00 58.31 58.83 3cpm n LYS 94 Cb 0.03 -1.61 -0.11 0.00 0.02 0.00 0.00 35.03 33.36 3cpm n LYS 94 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 3cpm s ASN 95 N -0.46 5.18 0.33 3.14 -0.87 -1.26 -4.85 114.94 116.15 3cpm s ASN 95 Ca 0.00 -0.08 -0.27 0.00 -1.57 0.00 0.00 52.86 50.94 3cpm s ASN 95 Cb 0.00 -1.89 -0.09 0.00 -0.02 0.00 0.00 41.25 39.25 3cpm s ASN 95 CO 0.00 0.11 1.04 -0.54 -2.57 0.00 0.00 177.10 175.14 3cpm s LYS 96 N 0.72 4.48 0.68 -0.60 1.02 -0.06 -4.59 119.74 121.40 3cpm s LYS 96 Ca 0.01 1.60 -0.16 0.00 0.02 0.00 0.00 55.97 57.45 3cpm s LYS 96 Cb -0.14 -2.91 0.01 0.00 -0.52 0.00 0.00 37.83 34.27 3cpm s LYS 96 CO 0.02 0.12 1.17 1.03 -0.92 0.00 0.00 175.35 176.77 3cpm s ARG 97 N -1.88 2.54 -0.25 1.68 0.52 -1.26 -1.32 118.95 118.99 3cpm s ARG 97 Ca 0.50 1.63 -0.15 0.00 -0.52 0.00 0.00 55.73 57.19 3cpm s ARG 97 Cb -0.26 -1.90 -0.04 0.00 0.52 0.00 0.00 34.95 33.28 3cpm s ARG 97 CO 0.33 -1.50 0.38 0.42 0.02 0.00 0.00 175.30 174.95 3cpm s ILE 98 N -2.05 5.19 -0.09 1.52 1.01 -1.26 -4.80 121.20 120.71 3cpm s ILE 98 Ca 0.72 0.61 0.14 0.00 0.00 0.00 0.00 60.65 62.12 3cpm s ILE 98 Cb -0.26 -3.70 0.29 0.00 0.01 0.00 0.00 42.46 38.80 3cpm s ILE 98 CO 0.41 0.19 1.14 -0.90 0.00 0.00 0.00 174.94 175.79 3cpm n ASP 99 N 5.02 1.36 -3.53 3.58 3.85 -1.26 -4.91 116.55 120.65 3cpm n ASP 99 Ca -0.08 -2.84 -0.25 0.00 -0.71 0.00 0.00 54.79 50.91 3cpm n ASP 99 Cb 0.51 -0.38 -0.15 0.00 -1.35 0.00 0.00 41.12 39.75 3cpm n ASP 99 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 3cpm s ILE 100 N -1.72 -0.16 -0.74 2.12 1.01 -1.26 -5.09 121.20 115.36 3cpm s ILE 100 Ca 0.27 -0.43 -0.12 0.00 0.00 0.00 0.00 60.65 60.37 3cpm s ILE 100 Cb 0.27 -0.80 0.19 0.00 0.01 0.00 0.00 42.46 42.12 3cpm s ILE 100 CO -0.05 -0.47 0.65 -0.36 0.00 0.00 0.00 174.94 174.72 3cpm s PHE 101 N 2.18 3.63 0.06 3.97 0.40 -1.26 -4.81 117.98 122.16 3cpm s PHE 101 Ca 0.07 -2.07 0.01 0.00 -0.60 0.00 0.00 56.93 54.33 3cpm s PHE 101 Cb -0.16 -3.67 -0.00 0.00 0.51 0.00 0.00 43.02 39.70 3cpm s PHE 101 CO -0.24 -0.96 0.02 -0.40 0.70 0.00 0.00 175.22 174.34 3cpm n ASP 102 N 4.04 1.04 -0.08 1.36 5.68 -1.26 -4.87 116.55 122.46 3cpm n ASP 102 Ca 0.09 -1.34 -0.07 0.00 -0.50 0.00 0.00 54.79 52.97 3cpm n ASP 102 Cb 0.44 0.16 -0.00 0.00 -1.14 0.00 0.00 41.12 40.58 3cpm n ASP 102 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3cpm h GLU 103 N 0.00 0.06 -0.71 0.11 4.39 -1.95 -2.13 114.58 114.35 3cpm h GLU 103 Ca -0.05 -0.00 0.14 0.00 0.34 0.00 0.00 59.36 59.79 3cpm h GLU 103 Cb 0.19 -0.01 -0.10 0.00 -0.10 0.00 0.00 28.75 28.73 3cpm h GLU 103 CO 0.08 0.04 0.20 -0.97 -1.16 0.00 0.00 179.01 177.20 3cpm h ASN 104 N 0.06 0.09 -0.70 1.42 -0.73 -1.97 0.22 115.58 113.97 3cpm h ASN 104 Ca 0.14 0.13 0.00 0.00 1.87 0.00 0.00 56.30 58.44 3cpm h ASN 104 Cb 0.20 0.15 -0.03 0.00 0.27 0.00 0.00 38.32 38.91 3cpm h ASN 104 CO -0.26 0.01 0.44 0.25 -0.37 0.00 0.00 177.43 177.51 3cpm h LEU 105 N 0.32 0.83 -0.40 0.34 6.46 -1.71 -0.89 115.31 120.26 3cpm h LEU 105 Ca 0.39 -0.05 -0.06 0.00 -0.12 0.00 0.00 57.88 58.05 3cpm h LEU 105 Cb 0.63 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.34 3cpm h LEU 105 CO -0.45 0.63 0.01 0.50 -0.62 0.00 0.00 178.44 178.51 3cpm h LYS 106 N 0.96 0.69 -0.49 1.25 3.64 -0.52 -2.45 116.57 119.65 3cpm h LYS 106 Ca 0.25 -0.21 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 3cpm h LYS 106 Cb -0.06 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 3cpm h LYS 106 CO -0.05 0.78 0.25 -0.91 -2.27 0.00 0.00 179.45 177.25 3cpm h ASN 107 N 0.52 0.60 0.36 4.20 -0.26 -0.38 -2.74 115.58 117.88 3cpm h ASN 107 Ca 0.11 -0.04 -0.02 0.00 -0.56 0.00 0.00 56.30 55.79 3cpm h ASN 107 Cb 0.46 -0.15 0.00 0.00 -1.06 0.00 0.00 38.32 37.57 3cpm h ASN 107 CO 0.02 0.50 -0.17 0.25 -1.06 0.00 0.00 177.43 176.96 3cpm h LEU 108 N 0.68 -0.41 -0.59 1.61 6.46 -0.93 -1.52 115.31 120.61 3cpm h LEU 108 Ca 0.17 -0.09 0.12 0.00 -0.12 0.00 0.00 57.88 57.96 3cpm h LEU 108 Cb 0.04 0.11 -0.10 0.00 -0.73 0.00 0.00 40.66 39.98 3cpm h LEU 108 CO -0.03 -0.15 -0.01 0.58 -0.62 0.00 0.00 178.44 178.22 3cpm h VAL 109 N -0.66 0.52 -0.65 1.05 2.07 -1.25 0.31 116.25 117.63 3cpm h VAL 109 Ca -0.05 -0.04 -0.05 0.00 0.82 0.00 0.00 66.70 67.38 3cpm h VAL 109 Cb 0.47 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 3cpm h VAL 109 CO 0.08 0.02 0.21 -0.78 0.02 0.00 0.00 177.57 177.12 3cpm h ASP 110 N 0.11 0.92 0.46 0.57 1.82 -1.44 -0.90 116.42 117.96 3cpm h ASP 110 Ca 0.30 -0.15 -0.08 0.00 -0.39 0.00 0.00 57.03 56.71 3cpm h ASP 110 Cb 0.48 -0.24 -0.01 0.00 0.68 0.00 0.00 39.33 40.24 3cpm h ASP 110 CO -0.51 0.85 -0.40 0.00 -1.61 0.00 0.00 179.24 177.57 3cpm h ALA 111 N 1.27 1.26 -0.17 -0.78 0.00 0.15 -1.68 119.26 119.32 3cpm h ALA 111 Ca 0.21 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 3cpm h ALA 111 Cb 0.26 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3cpm h ALA 111 CO -0.01 0.51 -0.30 0.52 0.00 0.00 0.00 179.25 179.97 3cpm h MET 112 N 0.00 0.49 -0.37 0.00 2.86 0.43 -2.51 114.93 115.83 3cpm h MET 112 Ca -0.00 -0.31 -0.02 0.00 -2.06 0.00 0.00 59.70 57.31 3cpm h MET 112 Cb 0.75 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.42 3cpm h MET 112 CO 0.05 0.91 0.14 0.74 1.06 0.00 0.00 176.91 179.82 3cpm h PHE 113 N 0.13 0.51 0.63 -0.22 0.04 -1.00 -0.88 116.94 116.15 3cpm h PHE 113 Ca 0.01 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.73 3cpm h PHE 113 Cb 0.89 -0.16 0.01 0.00 2.20 0.00 0.00 35.95 38.88 3cpm h PHE 113 CO 0.09 0.41 -0.30 -0.44 -0.60 0.00 0.00 178.31 177.47 3cpm h ASP 114 N 0.52 -0.72 0.34 2.17 3.32 -1.11 -0.36 116.42 120.58 3cpm h ASP 114 Ca 0.13 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 3cpm h ASP 114 Cb 0.11 0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 3cpm h ASP 114 CO -0.01 -0.46 -0.25 1.62 -1.72 0.00 0.00 179.24 178.42 3cpm h VAL 115 N -0.93 1.02 0.31 -1.35 3.04 -1.30 0.21 116.25 117.25 3cpm h VAL 115 Ca -0.09 -0.91 -0.02 0.00 -1.01 0.00 0.00 66.70 64.68 3cpm h VAL 115 Cb 0.68 1.51 0.00 0.00 -2.01 0.00 0.00 31.29 31.47 3cpm h VAL 115 CO 0.14 0.25 -0.15 -0.03 -1.01 0.00 0.00 177.57 176.77 3cpm h MET 116 N 0.00 -0.40 -0.75 4.17 1.85 -0.94 -1.46 114.93 117.41 3cpm h MET 116 Ca -0.00 0.03 -0.04 0.00 -0.61 0.00 0.00 59.70 59.08 3cpm h MET 116 Cb 0.49 0.09 -0.03 0.00 0.43 0.00 0.00 31.60 32.58 3cpm h MET 116 CO 0.03 -0.11 0.31 1.88 -0.40 0.00 0.00 176.91 178.62 3cpm h TYR 117 N -0.69 1.11 -0.45 1.39 0.05 -0.80 0.36 116.97 117.94 3cpm h TYR 117 Ca -0.04 -0.07 0.04 0.00 0.05 0.00 0.00 58.73 58.71 3cpm h TYR 117 Cb 0.48 -0.34 -0.04 0.00 1.01 0.00 0.00 36.73 37.84 3cpm h TYR 117 CO 0.01 0.84 0.21 -0.22 -1.05 0.00 0.00 178.16 177.94 3cpm h LYS 118 N 1.08 0.40 -0.52 4.88 3.64 -0.50 -0.93 116.57 124.61 3cpm h LYS 118 Ca 0.25 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 3cpm h LYS 118 Cb 0.18 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3cpm h LYS 118 CO -0.02 0.26 0.00 0.25 -2.27 0.00 0.00 179.45 177.67 3cpm n THR 119 N -4.94 0.64 -3.80 1.00 -2.24 -0.56 -4.90 114.28 99.49 3cpm n THR 119 Ca 0.03 -0.42 -0.27 0.00 -2.27 0.00 0.00 64.05 61.12 3cpm n THR 119 Cb 0.14 -0.09 0.01 0.00 -2.10 0.00 0.00 70.33 68.30 3cpm n THR 119 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3cpm n ASP 120 N 0.26 -2.44 -4.97 3.42 8.00 -0.36 -4.98 116.55 115.48 3cpm n ASP 120 Ca 0.09 -0.97 -0.22 0.00 0.71 0.00 0.00 54.79 54.40 3cpm n ASP 120 Cb 0.39 -3.38 0.05 0.00 -0.02 0.00 0.00 41.12 38.15 3cpm n ASP 120 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3cpm n GLY 121 N -1.79 2.23 0.00 0.44 0.00 0.12 -5.00 105.19 101.19 3cpm n GLY 121 Ca -0.22 -2.25 0.00 0.00 0.00 0.00 0.00 46.02 43.54 3cpm n GLY 121 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3cpm n ILE 122 N -2.13 0.00 -3.64 -0.61 0.13 -1.26 -4.51 119.36 107.34 3cpm n ILE 122 Ca 0.10 0.00 -0.12 0.00 -1.10 0.00 0.00 62.75 61.63 3cpm n ILE 122 Cb 0.62 0.33 -0.06 0.00 -0.84 0.00 0.00 39.64 39.70 3cpm n ILE 122 CO 0.00 0.00 0.00 -0.83 2.80 0.00 0.00 176.55 178.52 3cpm s GLY 123 N -1.39 -0.29 -0.27 4.50 0.00 -1.26 -0.99 107.32 107.61 3cpm s GLY 123 Ca 0.00 0.24 -0.22 0.00 0.00 0.00 0.00 44.72 44.74 3cpm s GLY 123 CO 0.00 -0.02 0.71 -2.27 0.00 0.00 0.00 173.10 171.52 3cpm s LEU 124 N -2.22 -0.81 0.11 0.66 2.96 -0.07 -4.89 118.68 114.42 3cpm s LEU 124 Ca -0.03 1.47 0.08 0.00 -0.22 0.00 0.00 54.13 55.43 3cpm s LEU 124 Cb -0.00 2.44 -0.04 0.00 0.50 0.00 0.00 46.19 49.09 3cpm s LEU 124 CO -0.05 -0.25 -0.13 -0.94 -1.32 0.00 0.00 176.35 173.66 3cpm s SER 125 N 0.78 4.18 0.31 3.68 1.04 -1.26 -1.38 113.70 121.05 3cpm s SER 125 Ca -0.03 -0.46 0.07 0.00 0.48 0.00 0.00 55.95 56.02 3cpm s SER 125 Cb -0.05 -0.72 0.82 0.00 0.10 0.00 0.00 66.02 66.17 3cpm s SER 125 CO -0.06 0.18 1.73 0.00 0.98 0.00 0.00 173.24 176.07 3cpm h ALA 126 N 3.68 1.68 -0.75 5.32 0.00 -1.57 0.49 119.26 128.11 3cpm h ALA 126 Ca -0.49 0.13 0.18 0.00 0.00 0.00 0.00 54.91 54.72 3cpm h ALA 126 Cb 1.17 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.94 3cpm h ALA 126 CO 0.50 -0.25 0.51 -1.35 0.00 0.00 0.00 179.25 178.66 3cpm h PRO 127 N 0.57 0.25 0.00 0.00 0.11 -1.38 0.20 132.00 131.75 3cpm h PRO 127 Ca 0.61 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.71 3cpm h PRO 127 Cb 1.13 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3cpm h PRO 127 CO -0.47 0.17 0.00 1.04 -0.21 0.00 0.00 178.00 178.52 3cpm n GLN 128 N -4.43 0.13 -0.06 1.05 6.02 0.16 -2.14 117.38 118.11 3cpm n GLN 128 Ca 0.15 0.17 0.06 0.00 -0.01 0.00 0.00 57.00 57.37 3cpm n GLN 128 Cb 0.64 -1.50 0.08 0.00 1.02 0.00 0.00 30.24 30.48 3cpm n GLN 128 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 3cpm n VAL 129 N -1.38 1.44 -0.27 5.09 0.24 0.62 -0.24 118.33 123.83 3cpm n VAL 129 Ca 0.06 -1.66 0.00 0.00 -2.04 0.00 0.00 64.34 60.70 3cpm n VAL 129 Cb 0.15 0.10 0.00 0.00 -1.47 0.00 0.00 33.84 32.62 3cpm n VAL 129 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3cpm n GLY 130 N -1.00 0.65 3.45 7.63 0.00 -0.91 -4.68 105.19 110.33 3cpm n GLY 130 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 3cpm n GLY 130 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cpm s LEU 131 N 0.00 3.27 -1.25 0.99 1.02 -0.70 -4.97 118.68 117.05 3cpm s LEU 131 Ca 0.00 -0.20 -0.05 0.00 0.02 0.00 0.00 54.13 53.90 3cpm s LEU 131 Cb 0.00 -1.83 0.18 0.00 0.02 0.00 0.00 46.19 44.55 3cpm s LEU 131 CO 0.00 0.06 2.15 0.59 0.02 0.00 0.00 176.35 179.17 3cpm n ASN 132 N 4.28 7.36 -4.35 2.29 4.13 -1.26 -1.17 115.26 126.54 3cpm n ASN 132 Ca -0.17 -3.25 -0.18 0.00 1.68 0.00 0.00 54.58 52.65 3cpm n ASN 132 Cb 0.52 -1.34 -0.10 0.00 -1.54 0.00 0.00 39.78 37.32 3cpm n ASN 132 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 3cpm s VAL 133 N -1.59 1.54 -1.30 2.41 -7.23 -1.26 -0.88 120.40 112.09 3cpm s VAL 133 Ca 0.48 -2.15 -0.14 0.00 -1.81 0.00 0.00 61.98 58.36 3cpm s VAL 133 Cb 0.16 -2.15 0.11 0.00 0.56 0.00 0.00 36.38 35.07 3cpm s VAL 133 CO -0.07 -0.52 1.79 0.00 -0.31 0.00 0.00 175.10 175.99 3cpm n GLN 134 N -0.40 3.27 -4.31 4.82 6.02 -0.43 -4.54 117.38 121.80 3cpm n GLN 134 Ca -0.07 -3.36 -0.19 0.00 -0.01 0.00 0.00 57.00 53.37 3cpm n GLN 134 Cb 0.62 -3.20 -0.15 0.00 1.02 0.00 0.00 30.24 28.52 3cpm n GLN 134 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3cpm s LEU 135 N 2.09 1.83 -0.00 1.08 2.96 -1.26 -1.53 118.68 123.85 3cpm s LEU 135 Ca 0.46 -0.15 -0.06 0.00 -0.22 0.00 0.00 54.13 54.16 3cpm s LEU 135 Cb 0.05 -0.45 0.00 0.00 0.50 0.00 0.00 46.19 46.29 3cpm s LEU 135 CO 0.01 0.06 0.12 -0.32 -1.32 0.00 0.00 176.35 174.90 3cpm s MET 136 N 0.11 0.42 0.06 1.98 -2.45 -0.71 -1.68 119.30 117.03 3cpm s MET 136 Ca -0.01 -0.34 -0.05 0.00 -1.25 0.00 0.00 55.69 54.04 3cpm s MET 136 Cb -0.07 0.17 -0.02 0.00 1.25 0.00 0.00 34.83 36.17 3cpm s MET 136 CO 0.00 -0.09 0.07 0.14 1.05 0.00 0.00 175.02 176.19 3cpm s VAL 137 N -1.18 0.18 -0.22 10.11 -7.23 -0.48 -0.29 120.40 121.29 3cpm s VAL 137 Ca -0.13 -1.45 -0.35 0.00 -1.81 0.00 0.00 61.98 58.24 3cpm s VAL 137 Cb -0.07 -1.34 0.15 0.00 0.56 0.00 0.00 36.38 35.68 3cpm s VAL 137 CO 0.01 -0.80 1.26 0.72 -0.31 0.00 0.00 175.10 175.98 3cpm s PHE 138 N -3.67 -0.10 -0.23 2.82 -0.12 -0.57 -0.89 117.98 115.22 3cpm s PHE 138 Ca 0.04 0.08 -0.04 0.00 -0.05 0.00 0.00 56.93 56.96 3cpm s PHE 138 Cb 0.05 0.51 0.13 0.00 -0.63 0.00 0.00 43.02 43.07 3cpm s PHE 138 CO -0.09 -0.14 0.40 1.21 -0.05 0.00 0.00 175.22 176.54 3cpm s ASN 139 N -1.98 0.05 0.29 1.98 3.84 -0.16 -1.13 114.94 117.82 3cpm s ASN 139 Ca 0.10 0.44 0.03 0.00 0.21 0.00 0.00 52.86 53.63 3cpm s ASN 139 Cb -0.01 1.21 0.72 0.00 -0.55 0.00 0.00 41.25 42.62 3cpm s ASN 139 CO -0.04 -0.28 1.66 -0.65 -2.79 0.00 0.00 177.10 175.00 3cpm h PRO 140 N 8.17 0.24 -0.05 0.43 0.11 -1.78 -1.50 132.00 137.62 3cpm h PRO 140 Ca -0.19 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.91 3cpm h PRO 140 Cb 1.14 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 3cpm h PRO 140 CO 0.24 0.16 0.03 0.00 -0.21 0.00 0.00 178.00 178.22 3cpm h ALA 141 N 1.76 0.07 0.00 -0.75 0.00 -1.90 -3.47 119.26 114.97 3cpm h ALA 141 Ca 0.56 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.45 3cpm h ALA 141 Cb 1.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3cpm h ALA 141 CO -0.62 -0.43 0.00 0.41 0.00 0.00 0.00 179.25 178.61 3cpm n GLY 142 N -1.06 0.76 3.24 0.00 0.00 -0.57 -5.04 105.19 102.52 3cpm n GLY 142 Ca -0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 3cpm n GLY 142 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3cpm s GLU 143 N -0.42 2.16 0.62 1.61 0.41 -1.26 -4.69 118.70 117.13 3cpm s GLU 143 Ca 0.00 -0.82 -0.19 0.00 -0.41 0.00 0.00 54.97 53.55 3cpm s GLU 143 Cb 0.00 -1.92 -0.02 0.00 -1.78 0.00 0.00 34.13 30.41 3cpm s GLU 143 CO 0.00 0.40 1.26 -2.30 -0.49 0.00 0.00 175.26 174.13 3cpm n PRO 144 N 2.82 1.18 -2.31 0.39 -0.02 -1.26 -2.39 135.00 133.42 3cpm n PRO 144 Ca -0.17 0.46 -0.05 0.00 -2.02 0.00 0.00 63.50 61.72 3cpm n PRO 144 Cb 0.52 -2.49 -0.00 0.00 -0.02 0.00 0.00 33.50 31.51 3cpm n PRO 144 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cpm n GLY 145 N 0.95 -0.38 2.32 -1.23 0.00 -1.26 -4.74 105.19 100.85 3cpm n GLY 145 Ca 0.15 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.17 3cpm n GLY 145 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3cpm n GLU 146 N -2.46 1.08 0.00 1.61 2.13 -1.01 -5.10 120.64 116.90 3cpm n GLU 146 Ca -0.06 -2.72 0.00 0.00 0.66 0.00 0.00 57.16 55.04 3cpm n GLU 146 Cb 0.50 -0.83 0.00 0.00 0.27 0.00 0.00 31.44 31.38 3cpm n GLU 146 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3cpm n GLY 147 N -0.31 2.28 2.58 8.31 0.00 -1.26 -4.64 105.19 112.14 3cpm n GLY 147 Ca 0.03 0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 3cpm n GLY 147 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3cpm s LYS 148 N 4.43 0.13 -0.24 1.61 2.36 -1.26 -5.00 119.74 121.78 3cpm s LYS 148 Ca 0.00 -0.31 -0.27 0.00 -2.55 0.00 0.00 55.97 52.84 3cpm s LYS 148 Cb 0.00 -1.45 0.00 0.00 -1.05 0.00 0.00 37.83 35.33 3cpm s LYS 148 CO 0.00 -0.86 0.95 -1.21 1.55 0.00 0.00 175.35 175.79 3cpm s GLU 149 N 2.13 4.22 -0.12 4.03 2.02 -1.26 -4.23 118.70 125.48 3cpm s GLU 149 Ca 0.06 1.17 0.02 0.00 0.02 0.00 0.00 54.97 56.24 3cpm s GLU 149 Cb -0.16 -3.65 0.01 0.00 0.10 0.00 0.00 34.13 30.44 3cpm s GLU 149 CO -0.24 -0.60 -0.16 0.42 0.02 0.00 0.00 175.26 174.70 3cpm s ILE 150 N 3.07 1.61 0.01 -1.63 1.01 -0.28 -5.01 121.20 119.98 3cpm s ILE 150 Ca 0.40 -0.70 0.08 0.00 0.00 0.00 0.00 60.65 60.43 3cpm s ILE 150 Cb -0.15 -1.47 -0.03 0.00 0.01 0.00 0.00 42.46 40.83 3cpm s ILE 150 CO 0.07 0.46 -0.24 0.54 0.00 0.00 0.00 174.94 175.77 3cpm s VAL 151 N 1.03 2.27 -0.05 2.92 0.11 -1.26 -1.51 120.40 123.90 3cpm s VAL 151 Ca -0.05 -1.20 0.00 0.00 -2.93 0.00 0.00 61.98 57.81 3cpm s VAL 151 Cb -0.15 -1.85 0.02 0.00 -1.53 0.00 0.00 36.38 32.87 3cpm s VAL 151 CO -0.03 0.47 -0.03 -0.76 -3.33 0.00 0.00 175.10 171.42 3cpm s LEU 152 N -0.97 1.12 -0.13 2.54 1.43 0.60 -4.91 118.68 118.37 3cpm s LEU 152 Ca 0.11 -0.12 -0.04 0.00 -1.03 0.00 0.00 54.13 53.06 3cpm s LEU 152 Cb -0.10 -0.46 -0.03 0.00 0.03 0.00 0.00 46.19 45.63 3cpm s LEU 152 CO 0.01 -0.10 0.01 -0.69 0.23 0.00 0.00 176.35 175.81 3cpm s VAL 153 N 1.24 4.32 -1.25 -1.59 1.01 -0.48 -1.73 120.40 121.91 3cpm s VAL 153 Ca -0.06 -0.22 -0.27 0.00 0.00 0.00 0.00 61.98 61.43 3cpm s VAL 153 Cb -0.14 -2.87 0.03 0.00 0.00 0.00 0.00 36.38 33.41 3cpm s VAL 153 CO -0.02 0.55 0.61 0.59 0.00 0.00 0.00 175.10 176.82 3cpm n ASN 154 N 2.81 -3.54 -4.77 3.32 3.02 -0.58 -1.01 115.26 114.52 3cpm n ASN 154 Ca -0.18 -1.24 -0.41 0.00 -0.03 0.00 0.00 54.58 52.73 3cpm n ASN 154 Cb 0.53 -2.00 -0.03 0.00 -0.61 0.00 0.00 39.78 37.67 3cpm n ASN 154 CO 0.00 0.00 0.00 -2.84 -2.62 0.00 0.00 177.26 171.80 3cpm s PRO 155 N -7.16 4.47 -0.06 3.52 0.02 -1.26 -4.50 135.00 130.03 3cpm s PRO 155 Ca 0.41 2.05 0.02 0.00 0.02 0.00 0.00 61.00 63.51 3cpm s PRO 155 Cb -0.21 -3.12 0.01 0.00 0.02 0.00 0.00 34.50 31.20 3cpm s PRO 155 CO 0.95 -0.03 -0.11 0.15 -0.33 0.00 0.00 177.00 177.64 3cpm s LYS 156 N -1.65 1.47 -0.49 5.54 1.02 0.16 -4.97 119.74 120.82 3cpm s LYS 156 Ca 0.47 -0.36 -0.24 0.00 0.02 0.00 0.00 55.97 55.86 3cpm s LYS 156 Cb -0.37 -1.26 0.03 0.00 -0.52 0.00 0.00 37.83 35.72 3cpm s LYS 156 CO 0.48 0.03 0.88 0.42 -0.92 0.00 0.00 175.35 176.24 3cpm s ILE 157 N 0.62 4.51 0.06 2.17 1.01 -1.26 -0.80 121.20 127.51 3cpm s ILE 157 Ca -0.12 0.44 -0.13 0.00 0.00 0.00 0.00 60.65 60.84 3cpm s ILE 157 Cb -0.15 -4.43 -0.29 0.00 0.01 0.00 0.00 42.46 37.60 3cpm s ILE 157 CO 0.03 -0.90 1.12 0.11 0.00 0.00 0.00 174.94 175.29 3cpm h LYS 158 N 9.13 0.58 -2.63 2.79 1.79 -1.18 -3.47 116.57 123.57 3cpm h LYS 158 Ca -0.25 -0.78 -0.09 0.00 -2.18 0.00 0.00 60.65 57.35 3cpm h LYS 158 Cb 1.08 0.26 -0.19 0.00 -1.58 0.00 0.00 32.23 31.79 3cpm h LYS 158 CO 1.03 1.35 -0.08 0.15 -1.08 0.00 0.00 179.45 180.82 3cpm s LYS 159 N -2.96 0.84 0.05 3.15 1.02 -1.12 -4.99 119.74 115.74 3cpm s LYS 159 Ca -0.09 -0.03 0.01 0.00 0.02 0.00 0.00 55.97 55.89 3cpm s LYS 159 Cb 0.06 0.38 -0.03 0.00 -0.52 0.00 0.00 37.83 37.72 3cpm s LYS 159 CO 0.93 -0.25 -0.06 1.52 -0.92 0.00 0.00 175.35 176.57 3cpm s TYR 160 N -1.36 0.59 0.69 3.18 -0.85 -1.26 0.59 117.35 118.92 3cpm s TYR 160 Ca -0.12 -0.68 -0.17 0.00 -0.52 0.00 0.00 57.07 55.58 3cpm s TYR 160 Cb -0.03 -0.37 -0.02 0.00 0.38 0.00 0.00 41.96 41.92 3cpm s TYR 160 CO 0.06 -0.17 0.89 0.45 -1.52 0.00 0.00 175.55 175.26 3cpm n SER 161 N 0.97 0.25 -1.37 -0.18 2.88 0.29 -4.92 113.62 111.54 3cpm n SER 161 Ca -0.20 0.69 0.12 0.00 -1.33 0.00 0.00 58.87 58.15 3cpm n SER 161 Cb 0.57 -1.37 0.33 0.00 -0.75 0.00 0.00 64.21 62.99 3cpm n SER 161 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 3cpm n ASP 162 N -1.19 3.99 -4.33 -3.46 5.75 -1.26 -4.72 116.55 111.32 3cpm n ASP 162 Ca 0.13 -2.03 -0.33 0.00 -0.01 0.00 0.00 54.79 52.55 3cpm n ASP 162 Cb 0.49 -0.50 -0.15 0.00 -1.03 0.00 0.00 41.12 39.93 3cpm n ASP 162 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3cpm s LYS 163 N -1.06 3.31 -0.05 0.11 1.02 -1.26 -5.07 119.74 116.73 3cpm s LYS 163 Ca 0.49 -0.72 -0.09 0.00 0.02 0.00 0.00 55.97 55.67 3cpm s LYS 163 Cb 0.26 -2.59 -0.05 0.00 -0.52 0.00 0.00 37.83 34.94 3cpm s LYS 163 CO 0.33 0.17 0.25 -0.51 -0.92 0.00 0.00 175.35 174.67 3cpm s LEU 164 N 0.44 4.41 0.03 3.17 1.43 -1.26 -1.25 118.68 125.65 3cpm s LEU 164 Ca -0.11 0.64 0.02 0.00 -1.03 0.00 0.00 54.13 53.65 3cpm s LEU 164 Cb -0.16 -2.36 -0.02 0.00 0.03 0.00 0.00 46.19 43.68 3cpm s LEU 164 CO 0.05 0.35 -0.07 0.68 0.23 0.00 0.00 176.35 177.59 3cpm s VAL 165 N -1.11 0.54 0.41 -1.59 -7.23 -0.57 -4.91 120.40 105.95 3cpm s VAL 165 Ca 0.21 -0.78 -0.02 0.00 -1.81 0.00 0.00 61.98 59.57 3cpm s VAL 165 Cb -0.14 -0.55 -0.03 0.00 0.56 0.00 0.00 36.38 36.22 3cpm s VAL 165 CO 0.10 -0.18 0.66 -2.16 -0.31 0.00 0.00 175.10 173.21 3cpm s PRO 166 N -1.05 3.50 -0.29 4.82 0.04 -1.26 -1.95 135.00 138.82 3cpm s PRO 166 Ca -0.05 -0.08 -0.22 0.00 0.04 0.00 0.00 61.00 60.69 3cpm s PRO 166 Cb -0.07 -2.52 0.13 0.00 0.04 0.00 0.00 34.50 32.08 3cpm s PRO 166 CO 0.00 -0.03 1.04 0.12 0.04 0.00 0.00 177.00 178.17 3cpm s PHE 167 N -2.52 -0.49 -0.40 0.56 5.36 -0.75 -4.97 117.98 114.77 3cpm s PHE 167 Ca 0.44 1.10 -0.28 0.00 -0.96 0.00 0.00 56.93 57.22 3cpm s PHE 167 Cb -0.10 0.37 0.02 0.00 -0.34 0.00 0.00 43.02 42.97 3cpm s PHE 167 CO 0.40 -0.24 1.07 -0.51 -1.46 0.00 0.00 175.22 174.48 3cpm s ASP 168 N 0.59 6.75 -0.01 6.13 1.01 -1.26 -0.76 116.67 129.11 3cpm s ASP 168 Ca -0.01 0.69 -0.03 0.00 0.71 0.00 0.00 52.55 53.91 3cpm s ASP 168 Cb -0.05 -2.53 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 3cpm s ASP 168 CO -0.10 -1.03 0.18 -1.61 0.21 0.00 0.00 175.17 172.82 3cpm s GLU 169 N 3.94 3.42 0.40 8.23 2.02 -0.24 -4.85 118.70 131.62 3cpm s GLU 169 Ca 0.45 -0.33 0.07 0.00 0.02 0.00 0.00 54.97 55.18 3cpm s GLU 169 Cb -0.10 -3.08 -0.06 0.00 0.10 0.00 0.00 34.13 30.98 3cpm s GLU 169 CO 0.23 0.68 0.09 0.20 0.02 0.00 0.00 175.26 176.47 3cpm s GLY 170 N -1.91 2.37 -0.21 -1.39 0.00 -1.26 -2.87 107.32 102.05 3cpm s GLY 170 Ca 0.27 -2.17 -0.17 0.00 0.00 0.00 0.00 44.72 42.65 3cpm s GLY 170 CO 0.18 -1.99 0.54 0.00 0.00 0.00 0.00 173.10 171.83 3cpm h LEU 172 N 5.80 0.00 -0.92 0.00 4.07 -1.96 -1.35 115.31 120.95 3cpm h LEU 172 Ca -0.30 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.66 3cpm h LEU 172 Cb 1.18 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.92 3cpm h LEU 172 CO 0.19 0.02 0.00 -1.20 -1.08 0.00 0.00 178.44 176.36 3cpm n SER 173 N -3.20 1.41 -3.25 -0.43 7.64 -1.26 -4.19 113.62 110.34 3cpm n SER 173 Ca -0.02 -1.54 -0.25 0.00 1.01 0.00 0.00 58.87 58.08 3cpm n SER 173 Cb 0.17 -0.04 -0.07 0.00 -1.01 0.00 0.00 64.21 63.26 3cpm n SER 173 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3cpm n PHE 174 N 0.12 0.46 -1.49 1.43 3.72 -0.51 -1.40 117.46 119.79 3cpm n PHE 174 Ca 0.18 -3.68 -0.60 0.00 -0.05 0.00 0.00 57.45 53.30 3cpm n PHE 174 Cb 0.32 -0.37 -0.10 0.00 -0.94 0.00 0.00 39.48 38.39 3cpm n PHE 174 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 3cpm n PRO 175 N 1.35 0.00 -1.28 -1.08 -0.02 -1.25 -1.14 135.00 131.58 3cpm n PRO 175 Ca 0.23 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.62 3cpm n PRO 175 Cb 0.50 -1.37 -0.04 0.00 -0.02 0.00 0.00 33.50 32.57 3cpm n PRO 175 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cpm n GLY 176 N 4.37 0.93 3.72 -1.23 0.00 -1.26 -4.97 105.19 106.74 3cpm n GLY 176 Ca 0.33 -0.03 -0.36 0.00 0.00 0.00 0.00 46.02 45.97 3cpm n GLY 176 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cpm s ILE 177 N -1.86 5.37 -0.03 -0.61 1.01 -0.29 -5.07 121.20 119.71 3cpm s ILE 177 Ca 0.00 0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.98 3cpm s ILE 177 Cb 0.00 -3.53 0.03 0.00 0.01 0.00 0.00 42.46 38.96 3cpm s ILE 177 CO 0.00 0.41 -0.01 -0.31 0.00 0.00 0.00 174.94 175.03 3cpm s TYR 178 N 0.46 0.45 0.08 3.97 1.51 -1.26 -4.22 117.35 118.34 3cpm s TYR 178 Ca 0.11 -0.06 -0.09 0.00 -1.01 0.00 0.00 57.07 56.02 3cpm s TYR 178 Cb -0.12 -0.49 0.00 0.00 -0.11 0.00 0.00 41.96 41.24 3cpm s TYR 178 CO 0.01 -0.15 0.20 0.00 -1.11 0.00 0.00 175.55 174.49 3cpm s ALA 179 N 1.01 -0.27 0.13 3.71 0.00 -1.14 -4.94 121.76 120.26 3cpm s ALA 179 Ca -0.10 -0.55 -0.30 0.00 0.00 0.00 0.00 51.96 51.01 3cpm s ALA 179 Cb -0.14 0.46 -0.07 0.00 0.00 0.00 0.00 23.12 23.38 3cpm s ALA 179 CO -0.01 -0.49 1.16 -2.00 0.00 0.00 0.00 175.76 174.42 3cpm s GLU 180 N -3.68 4.50 -0.01 0.00 2.12 -1.26 -1.07 118.70 119.29 3cpm s GLU 180 Ca 0.03 1.77 0.04 0.00 0.36 0.00 0.00 54.97 57.18 3cpm s GLU 180 Cb 0.04 -3.30 -0.01 0.00 0.26 0.00 0.00 34.13 31.12 3cpm s GLU 180 CO -0.10 -0.11 -0.12 0.08 -0.54 0.00 0.00 175.26 174.47 3cpm s VAL 181 N 0.37 1.00 -0.22 3.70 1.01 0.06 -4.68 120.40 121.64 3cpm s VAL 181 Ca 0.54 -0.53 -0.07 0.00 0.00 0.00 0.00 61.98 61.92 3cpm s VAL 181 Cb -0.30 -0.85 -0.03 0.00 0.00 0.00 0.00 36.38 35.20 3cpm s VAL 181 CO 0.33 0.29 0.07 -0.69 0.00 0.00 0.00 175.10 175.09 3cpm s VAL 182 N -0.20 4.53 0.09 2.92 1.01 -1.26 -1.81 120.40 125.68 3cpm s VAL 182 Ca 0.03 -0.11 -0.02 0.00 0.00 0.00 0.00 61.98 61.88 3cpm s VAL 182 Cb -0.06 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 3cpm s VAL 182 CO -0.00 0.39 0.04 -0.13 0.00 0.00 0.00 175.10 175.39 3cpm s ARG 183 N 1.07 0.78 0.57 2.72 0.52 -0.82 -4.93 118.95 118.86 3cpm s ARG 183 Ca 0.04 -1.29 -0.21 0.00 -0.52 0.00 0.00 55.73 53.76 3cpm s ARG 183 Cb -0.14 0.24 -0.04 0.00 0.52 0.00 0.00 34.95 35.53 3cpm s ARG 183 CO 0.03 -0.20 1.32 -2.30 0.02 0.00 0.00 175.30 174.17 3cpm n PRO 184 N -0.00 1.51 0.24 3.54 -0.02 -1.26 -1.51 135.00 137.50 3cpm n PRO 184 Ca -0.10 0.56 0.15 0.00 -2.02 0.00 0.00 63.50 62.09 3cpm n PRO 184 Cb 0.62 -2.54 0.49 0.00 -0.02 0.00 0.00 33.50 32.05 3cpm n PRO 184 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 3cpm h GLN 185 N 1.17 0.00 -3.57 -0.52 3.07 -1.46 -3.45 115.11 110.35 3cpm h GLN 185 Ca -0.51 0.00 -0.07 0.00 0.09 0.00 0.00 58.65 58.17 3cpm h GLN 185 Cb 1.32 0.00 -0.13 0.00 0.08 0.00 0.00 27.48 28.75 3cpm h GLN 185 CO 0.56 0.00 -0.18 -1.54 0.09 0.00 0.00 178.83 177.75 3cpm s SER 186 N -5.75 -0.09 0.15 0.06 1.04 -1.26 -3.50 113.70 104.34 3cpm s SER 186 Ca 0.04 -0.49 -0.07 0.00 0.48 0.00 0.00 55.95 55.90 3cpm s SER 186 Cb 0.08 0.43 -0.01 0.00 0.10 0.00 0.00 66.02 66.62 3cpm s SER 186 CO 0.58 -0.83 0.23 0.68 0.98 0.00 0.00 173.24 174.87 3cpm s VAL 187 N -3.84 0.08 -0.15 5.02 -7.23 -0.14 0.10 120.40 114.25 3cpm s VAL 187 Ca 0.05 -1.47 0.01 0.00 -1.81 0.00 0.00 61.98 58.77 3cpm s VAL 187 Cb 0.03 -1.81 0.02 0.00 0.56 0.00 0.00 36.38 35.17 3cpm s VAL 187 CO -0.10 -0.38 -0.17 -0.75 -0.31 0.00 0.00 175.10 173.38 3cpm s LYS 188 N -3.97 2.59 0.21 4.82 2.20 0.20 -0.71 119.74 125.09 3cpm s LYS 188 Ca 0.17 -0.68 0.11 0.00 -0.36 0.00 0.00 55.97 55.20 3cpm s LYS 188 Cb 0.04 -2.24 -0.04 0.00 -1.51 0.00 0.00 37.83 34.08 3cpm s LYS 188 CO -0.01 -0.15 -0.17 0.42 -0.36 0.00 0.00 175.35 175.08 3cpm s ILE 189 N 1.20 2.72 -0.04 5.43 1.09 -0.36 -0.58 121.20 130.66 3cpm s ILE 189 Ca 0.00 -1.98 0.04 0.00 -1.10 0.00 0.00 60.65 57.61 3cpm s ILE 189 Cb -0.14 -2.35 -0.00 0.00 -1.06 0.00 0.00 42.46 38.91 3cpm s ILE 189 CO -0.08 -0.19 -0.16 -1.81 -0.10 0.00 0.00 174.94 172.61 3cpm s ASP 190 N -2.95 2.00 0.28 3.58 1.11 0.02 -2.48 116.67 118.23 3cpm s ASP 190 Ca 0.25 -0.33 -0.14 0.00 0.18 0.00 0.00 52.55 52.51 3cpm s ASP 190 Cb -0.08 -0.60 0.05 0.00 1.07 0.00 0.00 42.92 43.37 3cpm s ASP 190 CO 0.13 0.13 0.72 0.00 1.18 0.00 0.00 175.17 177.33 3cpm n ALA 191 N 3.24 -1.72 -2.43 5.23 0.00 -0.72 0.37 120.51 124.48 3cpm n ALA 191 Ca -0.19 -1.00 -0.23 0.00 0.00 0.00 0.00 53.44 52.02 3cpm n ALA 191 Cb 0.53 0.74 -0.11 0.00 0.00 0.00 0.00 19.45 20.61 3cpm n ALA 191 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3cpm s ARG 192 N -2.07 1.48 0.32 0.00 0.52 -0.18 -0.79 118.95 118.24 3cpm s ARG 192 Ca 0.15 -1.60 0.03 0.00 -0.52 0.00 0.00 55.73 53.79 3cpm s ARG 192 Cb -0.04 -1.55 0.06 0.00 0.52 0.00 0.00 34.95 33.94 3cpm s ARG 192 CO 0.08 0.30 0.44 -0.40 0.02 0.00 0.00 175.30 175.75 3cpm n ASP 193 N -0.18 0.90 0.20 0.23 5.75 0.43 -1.39 116.55 122.48 3cpm n ASP 193 Ca -0.09 -1.69 0.14 0.00 -0.01 0.00 0.00 54.79 53.15 3cpm n ASP 193 Cb 0.59 -0.26 0.64 0.00 -1.03 0.00 0.00 41.12 41.05 3cpm n ASP 193 CO 0.00 0.00 0.00 0.16 -0.11 0.00 0.00 177.20 177.25 3cpm h ILE 194 N -0.18 0.00 -0.01 2.12 3.07 -1.93 -1.08 117.51 119.50 3cpm h ILE 194 Ca -0.15 -0.25 0.00 0.00 1.55 0.00 0.00 64.86 66.01 3cpm h ILE 194 Cb 0.62 1.04 0.00 0.00 -0.27 0.00 0.00 36.82 38.21 3cpm h ILE 194 CO 0.19 0.00 -0.22 0.35 -1.05 0.00 0.00 178.15 177.42 3cpm n THR 195 N -2.57 0.00 -0.44 0.16 -2.24 -1.26 -4.41 114.28 103.53 3cpm n THR 195 Ca 0.01 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3cpm n THR 195 Cb 0.20 0.54 0.00 0.00 -2.10 0.00 0.00 70.33 68.97 3cpm n THR 195 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3cpm n GLY 196 N 1.31 0.74 3.74 3.38 0.00 -0.41 -4.91 105.19 109.04 3cpm n GLY 196 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 3cpm n GLY 196 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3cpm s GLU 197 N -0.56 4.77 0.52 1.61 0.41 -1.26 -4.68 118.70 119.51 3cpm s GLU 197 Ca 0.00 1.51 -0.14 0.00 -0.41 0.00 0.00 54.97 55.93 3cpm s GLU 197 Cb 0.00 -3.31 -0.07 0.00 -1.78 0.00 0.00 34.13 28.98 3cpm s GLU 197 CO 0.00 0.36 0.96 1.03 -0.49 0.00 0.00 175.26 177.13 3cpm s ARG 198 N -0.73 3.83 0.14 1.61 0.52 -1.26 -0.43 118.95 122.63 3cpm s ARG 198 Ca 0.44 0.82 -0.21 0.00 -0.52 0.00 0.00 55.73 56.26 3cpm s ARG 198 Cb -0.26 -2.16 0.06 0.00 0.52 0.00 0.00 34.95 33.11 3cpm s ARG 198 CO 0.32 -0.31 0.54 -0.59 0.02 0.00 0.00 175.30 175.28 3cpm s PHE 199 N -2.73 -0.44 0.01 -0.53 -0.12 0.03 -4.90 117.98 109.30 3cpm s PHE 199 Ca 0.57 0.23 0.02 0.00 -0.05 0.00 0.00 56.93 57.69 3cpm s PHE 199 Cb -0.10 0.46 -0.01 0.00 -0.63 0.00 0.00 43.02 42.74 3cpm s PHE 199 CO 0.37 -0.80 -0.07 -1.12 -0.05 0.00 0.00 175.22 173.55 3cpm s SER 200 N -2.71 0.81 0.19 1.98 0.01 -1.26 -1.75 113.70 110.97 3cpm s SER 200 Ca 0.01 -0.21 -0.10 0.00 1.31 0.00 0.00 55.95 56.96 3cpm s SER 200 Cb -0.00 -0.06 -0.00 0.00 0.21 0.00 0.00 66.02 66.16 3cpm s SER 200 CO -0.12 0.03 0.35 0.27 0.41 0.00 0.00 173.24 174.17 3cpm s ILE 201 N -0.41 0.04 -0.10 1.44 -4.36 -1.04 -5.02 121.20 111.76 3cpm s ILE 201 Ca 0.00 -1.35 0.03 0.00 -0.26 0.00 0.00 60.65 59.08 3cpm s ILE 201 Cb -0.04 -1.91 -0.00 0.00 1.25 0.00 0.00 42.46 41.75 3cpm s ILE 201 CO -0.00 -0.20 -0.22 -0.44 0.24 0.00 0.00 174.94 174.32 3cpm s SER 202 N -2.98 3.29 0.11 4.36 0.01 -1.26 -1.22 113.70 116.01 3cpm s SER 202 Ca 0.18 -0.51 0.10 0.00 1.31 0.00 0.00 55.95 57.03 3cpm s SER 202 Cb 0.02 -1.42 -0.04 0.00 0.21 0.00 0.00 66.02 64.79 3cpm s SER 202 CO 0.02 0.17 -0.23 -0.76 0.41 0.00 0.00 173.24 172.85 3cpm s LEU 203 N 0.31 2.48 0.00 2.44 1.43 0.12 -5.00 118.68 120.46 3cpm s LEU 203 Ca -0.16 -0.64 -0.02 0.00 -1.03 0.00 0.00 54.13 52.27 3cpm s LEU 203 Cb -0.17 -1.38 0.01 0.00 0.03 0.00 0.00 46.19 44.68 3cpm s LEU 203 CO 0.08 0.19 0.31 -1.54 0.23 0.00 0.00 176.35 175.62 3cpm n SER 204 N 0.96 -0.86 0.00 2.29 3.41 -1.26 -0.97 113.62 117.18 3cpm n SER 204 Ca -0.17 -2.04 0.00 0.00 -0.26 0.00 0.00 58.87 56.40 3cpm n SER 204 Cb 0.53 1.57 0.00 0.00 -0.26 0.00 0.00 64.21 66.04 3cpm n SER 204 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3cpm n ARG 205 N -0.32 0.00 -0.16 4.33 1.74 -1.23 -1.78 116.66 119.24 3cpm n ARG 205 Ca -0.01 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.98 3cpm n ARG 205 Cb 0.33 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.77 3cpm n ARG 205 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3cpm h LEU 206 N 0.00 0.68 -1.27 0.55 5.85 -1.99 -2.58 115.31 116.54 3cpm h LEU 206 Ca 0.00 -0.21 0.05 0.00 0.84 0.00 0.00 57.88 58.55 3cpm h LEU 206 Cb 0.00 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.80 3cpm h LEU 206 CO 0.00 0.71 0.52 -0.65 -0.34 0.00 0.00 178.44 178.68 3cpm h PRO 207 N 0.61 0.89 -0.53 5.25 0.11 -1.96 0.13 132.00 136.51 3cpm h PRO 207 Ca 0.15 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.09 3cpm h PRO 207 Cb 0.28 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.17 3cpm h PRO 207 CO -0.00 0.59 -0.13 0.00 -0.21 0.00 0.00 178.00 178.24 3cpm h ALA 208 N 1.55 0.77 -0.17 -0.75 0.00 -1.18 -0.72 119.26 118.76 3cpm h ALA 208 Ca 0.32 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3cpm h ALA 208 Cb 0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3cpm h ALA 208 CO -0.10 0.67 -0.02 -0.09 0.00 0.00 0.00 179.25 179.70 3cpm h ARG 209 N 0.89 0.31 -0.82 0.00 9.65 -0.87 -2.31 114.38 121.23 3cpm h ARG 209 Ca 0.13 -0.11 -0.02 0.00 -1.10 0.00 0.00 59.98 58.88 3cpm h ARG 209 Cb 0.70 -0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 29.22 3cpm h ARG 209 CO 0.05 0.56 0.42 0.82 2.80 0.00 0.00 179.97 184.63 3cpm h ILE 210 N 0.03 1.25 -0.27 1.20 2.04 -0.75 -2.64 117.51 118.38 3cpm h ILE 210 Ca 0.04 -0.66 0.03 0.00 1.00 0.00 0.00 64.86 65.27 3cpm h ILE 210 Cb 0.44 0.17 -0.03 0.00 -0.74 0.00 0.00 36.82 36.66 3cpm h ILE 210 CO 0.01 0.29 0.08 0.15 0.00 0.00 0.00 178.15 178.68 3cpm h PHE 211 N 1.16 0.14 -0.66 1.37 3.57 -0.97 -1.87 116.94 119.67 3cpm h PHE 211 Ca 0.29 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.73 3cpm h PHE 211 Cb 0.08 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 3cpm h PHE 211 CO 0.01 0.06 0.13 1.96 -2.23 0.00 0.00 178.31 178.24 3cpm h GLN 212 N 0.19 1.08 -0.64 1.11 4.20 -1.29 0.26 115.11 120.02 3cpm h GLN 212 Ca 0.12 -0.28 0.03 0.00 0.06 0.00 0.00 58.65 58.58 3cpm h GLN 212 Cb 0.10 -0.13 -0.04 0.00 0.30 0.00 0.00 27.48 27.70 3cpm h GLN 212 CO -0.13 0.98 0.39 1.25 -0.67 0.00 0.00 178.83 180.65 3cpm h HIS 213 N 1.01 0.74 -0.00 2.96 2.76 -1.29 -1.36 115.15 119.97 3cpm h HIS 213 Ca 0.20 0.02 -0.18 0.00 -2.20 0.00 0.00 60.37 58.22 3cpm h HIS 213 Cb 0.41 -0.24 -0.02 0.00 1.55 0.00 0.00 27.41 29.11 3cpm h HIS 213 CO 0.03 0.42 -0.82 0.93 -1.30 0.00 0.00 177.93 177.19 3cpm h GLU 214 N 0.78 0.09 -0.69 5.26 4.39 -1.01 -3.02 114.58 120.39 3cpm h GLU 214 Ca 0.26 -0.10 -0.06 0.00 0.34 0.00 0.00 59.36 59.80 3cpm h GLU 214 Cb 0.02 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.66 3cpm h GLU 214 CO -0.10 0.86 0.19 -0.92 -1.16 0.00 0.00 179.01 177.88 3cpm h TYR 215 N 0.05 1.11 -0.79 4.33 3.20 -0.15 -2.29 116.97 122.43 3cpm h TYR 215 Ca -0.02 -0.12 0.01 0.00 3.14 0.00 0.00 58.73 61.74 3cpm h TYR 215 Cb 1.43 -0.32 -0.04 0.00 1.54 0.00 0.00 36.73 39.34 3cpm h TYR 215 CO 0.01 0.90 0.52 -0.44 -1.64 0.00 0.00 178.16 177.51 3cpm h ASP 216 N 1.03 0.89 -0.99 -2.11 3.32 -1.17 -0.62 116.42 116.76 3cpm h ASP 216 Ca 0.22 -0.02 0.12 0.00 0.02 0.00 0.00 57.03 57.38 3cpm h ASP 216 Cb 0.32 -0.22 -0.08 0.00 0.22 0.00 0.00 39.33 39.58 3cpm h ASP 216 CO -0.00 0.64 0.62 0.45 -1.72 0.00 0.00 179.24 179.23 3cpm h HIS 217 N 1.05 1.10 0.00 4.55 3.86 -1.28 0.55 115.15 124.98 3cpm h HIS 217 Ca 0.30 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.53 3cpm h HIS 217 Cb -0.09 -0.35 -0.00 0.00 1.06 0.00 0.00 27.41 28.03 3cpm h HIS 217 CO -0.02 0.43 -0.02 -0.07 0.86 0.00 0.00 177.93 179.11 3cpm h LEU 218 N 0.95 0.00 -2.48 2.43 3.38 -0.75 -0.99 115.31 117.84 3cpm h LEU 218 Ca 0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.46 3cpm h LEU 218 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 3cpm h LEU 218 CO -0.26 0.02 0.00 -0.62 0.09 0.00 0.00 178.44 177.67 3cpm n GLU 219 N -3.14 2.67 -1.13 1.13 -0.58 0.15 -4.23 120.64 115.53 3cpm n GLU 219 Ca -0.00 -2.40 -0.04 0.00 -0.42 0.00 0.00 57.16 54.30 3cpm n GLU 219 Cb 0.26 -1.56 -0.02 0.00 -0.57 0.00 0.00 31.44 29.55 3cpm n GLU 219 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3cpm n GLY 220 N 1.47 0.65 3.70 0.62 0.00 -0.38 -4.91 105.19 106.34 3cpm n GLY 220 Ca 0.22 -0.27 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 3cpm n GLY 220 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3cpm s VAL 221 N -1.91 5.28 0.02 1.61 1.01 0.99 -4.52 120.40 122.88 3cpm s VAL 221 Ca 0.00 0.53 -0.03 0.00 0.00 0.00 0.00 61.98 62.49 3cpm s VAL 221 Cb 0.00 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 3cpm s VAL 221 CO 0.00 0.34 0.21 -0.76 0.00 0.00 0.00 175.10 174.88 3cpm s LEU 222 N 0.84 4.36 0.54 3.92 1.02 -1.26 -2.88 118.68 125.22 3cpm s LEU 222 Ca 0.16 0.36 0.27 0.00 0.02 0.00 0.00 54.13 54.94 3cpm s LEU 222 Cb -0.14 -2.73 1.44 0.00 0.02 0.00 0.00 46.19 44.78 3cpm s LEU 222 CO 0.05 0.23 1.98 2.19 0.02 0.00 0.00 176.35 180.82 3cpm h PHE 223 N 3.62 0.00 0.00 0.29 -0.00 -1.97 0.26 116.94 119.13 3cpm h PHE 223 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.49 3cpm h PHE 223 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.13 3cpm h PHE 223 CO 0.65 0.00 0.00 0.27 -0.00 0.00 0.00 178.31 179.23 3cpm h PHE 224 N 0.00 0.00 -0.04 6.09 -5.15 -1.97 -2.50 116.94 113.37 3cpm h PHE 224 Ca 0.26 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 57.99 3cpm h PHE 224 Cb 1.09 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.26 3cpm h PHE 224 CO 0.00 0.00 -0.13 -0.44 -2.00 0.00 0.00 178.31 175.74 3cpm h ASP 225 N 0.00 0.06 -0.46 -0.68 3.32 -0.87 -2.61 116.42 115.18 3cpm h ASP 225 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3cpm h ASP 225 Cb 0.54 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.08 3cpm h ASP 225 CO 0.00 0.20 0.00 0.54 -1.72 0.00 0.00 179.24 178.26 3cpm n ARG 226 N -4.35 2.56 -2.43 3.56 1.74 -0.94 -4.96 116.66 111.83 3cpm n ARG 226 Ca -0.02 -2.37 -0.31 0.00 -0.77 0.00 0.00 57.85 54.38 3cpm n ARG 226 Cb 0.22 -1.53 -0.02 0.00 -1.02 0.00 0.00 32.46 30.11 3cpm n ARG 226 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 3cpm s MET 227 N -1.39 3.81 0.94 5.56 -1.94 -0.98 -4.59 119.30 120.71 3cpm s MET 227 Ca 0.41 0.74 -0.12 0.00 -1.71 0.00 0.00 55.69 55.00 3cpm s MET 227 Cb 0.23 -2.21 0.16 0.00 2.01 0.00 0.00 34.83 35.02 3cpm s MET 227 CO 0.32 -0.26 1.09 0.95 -0.01 0.00 0.00 175.02 177.11 3cpm s THR 228 N -2.68 2.37 0.22 2.05 -4.23 -1.26 -4.80 115.64 107.32 3cpm s THR 228 Ca 0.55 0.12 -0.07 0.00 -1.18 0.00 0.00 61.69 61.11 3cpm s THR 228 Cb -0.10 -2.63 0.19 0.00 1.34 0.00 0.00 72.50 71.30 3cpm s THR 228 CO 0.37 -0.16 1.82 0.44 -0.54 0.00 0.00 174.62 176.55 3cpm h ASP 229 N -1.70 1.12 -0.20 3.99 5.19 -1.97 -0.97 116.42 121.88 3cpm h ASP 229 Ca -0.52 -0.13 -0.02 0.00 -0.62 0.00 0.00 57.03 55.74 3cpm h ASP 229 Cb 1.31 -0.29 -0.01 0.00 0.18 0.00 0.00 39.33 40.52 3cpm h ASP 229 CO 0.56 0.94 0.06 1.56 -3.12 0.00 0.00 179.24 179.25 3cpm h GLN 230 N 1.22 0.31 -0.13 3.56 4.20 -2.00 -1.15 115.11 121.12 3cpm h GLN 230 Ca 0.29 -0.07 -0.08 0.00 0.06 0.00 0.00 58.65 58.86 3cpm h GLN 230 Cb 0.12 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 3cpm h GLN 230 CO -0.04 0.40 -0.29 -0.39 -0.67 0.00 0.00 178.83 177.85 3cpm h VAL 231 N 0.15 1.25 -0.56 -0.54 -1.51 -1.90 -2.66 116.25 110.48 3cpm h VAL 231 Ca 0.06 -1.21 -0.03 0.00 -1.23 0.00 0.00 66.70 64.30 3cpm h VAL 231 Cb 0.22 1.48 -0.02 0.00 -2.13 0.00 0.00 31.29 30.84 3cpm h VAL 231 CO -0.00 0.37 0.23 0.25 -1.23 0.00 0.00 177.57 177.19 3cpm h LEU 232 N 0.21 0.77 -1.10 4.19 5.85 -0.80 -2.19 115.31 122.24 3cpm h LEU 232 Ca 0.03 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.61 3cpm h LEU 232 Cb 0.63 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.41 3cpm h LEU 232 CO 0.05 0.72 0.61 0.44 -0.34 0.00 0.00 178.44 179.92 3cpm h ASP 233 N 0.77 1.03 0.00 1.25 3.32 -0.89 -1.63 116.42 120.28 3cpm h ASP 233 Ca 0.19 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.22 3cpm h ASP 233 Cb 0.18 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3cpm h ASP 233 CO -0.02 0.73 0.12 0.77 -1.72 0.00 0.00 179.24 179.12 3cpm h SER 234 N 1.21 0.00 0.00 6.45 4.64 -1.11 -2.18 113.55 122.55 3cpm h SER 234 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 3cpm h SER 234 Cb -0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 3cpm h SER 234 CO -0.10 0.00 -0.15 2.30 -0.87 0.00 0.00 176.83 178.01 3cpm n ILE 235 N -2.42 0.71 -0.10 0.95 -5.35 -0.68 -4.84 119.36 107.63 3cpm n ILE 235 Ca -0.02 -0.81 -0.06 0.00 -0.27 0.00 0.00 62.75 61.59 3cpm n ILE 235 Cb 0.16 0.41 0.01 0.00 -1.74 0.00 0.00 39.64 38.48 3cpm n ILE 235 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 3cpm h ARG 236 N 0.00 0.22 -0.96 6.28 3.08 -0.70 -1.57 114.38 120.72 3cpm h ARG 236 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 3cpm h ARG 236 Cb 1.02 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.98 3cpm h ARG 236 CO 0.00 0.14 0.60 0.93 -1.07 0.00 0.00 179.97 180.57 3cpm h GLU 237 N 0.22 1.29 -0.13 0.04 4.39 -1.88 -0.31 114.58 118.20 3cpm h GLU 237 Ca 0.16 -0.10 0.02 0.00 0.34 0.00 0.00 59.36 59.78 3cpm h GLU 237 Cb 0.16 -0.28 -0.02 0.00 -0.10 0.00 0.00 28.75 28.51 3cpm h GLU 237 CO -0.19 0.88 -0.00 0.93 -1.16 0.00 0.00 179.01 179.47 3cpm h GLU 238 N 1.31 0.04 -0.17 2.33 3.07 -1.69 0.27 114.58 119.74 3cpm h GLU 238 Ca 0.35 -0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 59.12 3cpm h GLU 238 Cb -0.09 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 27.80 3cpm h GLU 238 CO -0.07 0.03 -0.25 -0.07 -1.40 0.00 0.00 179.01 177.25 3cpm h LEU 239 N 0.04 0.31 -0.83 1.33 3.38 -0.99 -2.49 115.31 116.07 3cpm h LEU 239 Ca 0.06 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 3cpm h LEU 239 Cb 0.08 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 3cpm h LEU 239 CO -0.11 0.56 -0.07 -0.08 0.09 0.00 0.00 178.44 178.84 3cpm h GLU 240 N 0.28 0.81 -0.13 1.13 4.81 -0.43 -2.15 114.58 118.90 3cpm h GLU 240 Ca 0.04 -0.25 -0.08 0.00 -0.13 0.00 0.00 59.36 58.94 3cpm h GLU 240 Cb 0.60 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 3cpm h GLU 240 CO 0.04 0.86 -0.28 0.00 -0.73 0.00 0.00 179.01 178.90 3cpm h ALA 241 N 1.18 1.28 -0.03 2.92 0.00 -0.51 -2.04 119.26 122.07 3cpm h ALA 241 Ca 0.13 -0.32 -0.17 0.00 0.00 0.00 0.00 54.91 54.55 3cpm h ALA 241 Cb 0.54 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3cpm h ALA 241 CO 0.03 0.48 -0.74 -0.07 0.00 0.00 0.00 179.25 178.96 3cpm h LEU 242 N 0.22 0.25 -0.56 0.00 3.38 -1.23 -0.75 115.31 116.62 3cpm h LEU 242 Ca 0.03 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.73 3cpm h LEU 242 Cb 0.61 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 3cpm h LEU 242 CO 0.04 0.90 -0.07 -0.33 0.09 0.00 0.00 178.44 179.07 3cpm h GLU 243 N 0.13 1.04 -0.12 1.13 5.08 -1.01 0.18 114.58 121.01 3cpm h GLU 243 Ca -0.02 -0.37 -0.08 0.00 -1.00 0.00 0.00 59.36 57.89 3cpm h GLU 243 Cb 1.31 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.48 3cpm h GLU 243 CO 0.11 1.06 -0.24 0.87 -1.00 0.00 0.00 179.01 179.81 3cpm h LYS 244 N 0.92 0.38 -0.71 2.33 1.79 -1.33 -2.08 116.57 117.87 3cpm h LYS 244 Ca 0.15 -0.24 0.07 0.00 -2.18 0.00 0.00 60.65 58.45 3cpm h LYS 244 Cb 0.64 0.03 -0.05 0.00 -1.58 0.00 0.00 32.23 31.27 3cpm h LYS 244 CO 0.04 0.84 0.47 -0.22 -1.08 0.00 0.00 179.45 179.50 3cpm h LYS 245 N -0.03 0.69 -0.18 3.15 1.63 -1.01 0.22 116.57 121.03 3cpm h LYS 245 Ca 0.01 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.75 3cpm h LYS 245 Cb 0.82 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 32.29 3cpm h LYS 245 CO 0.05 0.45 0.04 -0.92 -3.45 0.00 0.00 179.45 175.63 3cpm h TYR 246 N 0.71 0.31 -0.55 1.91 3.20 -0.84 0.54 116.97 122.25 3cpm h TYR 246 Ca 0.31 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 62.12 3cpm h TYR 246 Cb 0.31 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 3cpm h TYR 246 CO -0.00 0.43 0.27 0.93 -1.64 0.00 0.00 178.16 178.15 3cpm h GLU 247 N 0.10 0.79 -0.60 1.82 5.08 -0.51 0.09 114.58 121.35 3cpm h GLU 247 Ca 0.06 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.22 3cpm h GLU 247 Cb 0.28 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 3cpm h GLU 247 CO 0.00 0.65 0.07 1.49 -1.00 0.00 0.00 179.01 180.22 3cpm h GLU 248 N 0.74 1.01 0.02 2.33 4.81 -0.48 0.27 114.58 123.28 3cpm h GLU 248 Ca 0.19 -0.28 -0.00 0.00 -0.13 0.00 0.00 59.36 59.13 3cpm h GLU 248 Cb 0.11 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3cpm h GLU 248 CO -0.02 0.96 -0.01 -0.22 -0.73 0.00 0.00 179.01 178.99 3cpm h LYS 249 N 0.91 -0.02 0.08 1.92 3.64 -0.68 -3.37 116.57 119.06 3cpm h LYS 249 Ca 0.18 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.28 3cpm h LYS 249 Cb 0.46 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.27 3cpm h LYS 249 CO 0.02 0.62 -1.39 1.79 -2.27 0.00 0.00 179.45 178.22 3cpm h THR 250 N -0.68 1.30 0.00 1.00 1.35 -1.04 -3.48 112.91 111.35 3cpm h THR 250 Ca -0.00 -2.97 0.00 0.00 -0.55 0.00 0.00 66.41 62.89 3cpm h THR 250 Cb 0.65 2.77 0.00 0.00 -1.73 0.00 0.00 68.15 69.84 3cpm h THR 250 CO 0.00 0.82 0.00 0.61 -0.25 0.00 0.00 175.52 176.71 3cpm n GLY 251 N 1.56 0.75 3.64 5.82 0.00 0.95 -5.05 105.19 112.86 3cpm n GLY 251 Ca -0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.62 3cpm n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cpm s LEU 252 N 0.00 3.28 0.19 0.99 1.43 -1.24 -5.03 118.68 118.30 3cpm s LEU 252 Ca 0.00 -0.31 -0.30 0.00 -1.03 0.00 0.00 54.13 52.49 3cpm s LEU 252 Cb 0.00 -2.01 -0.08 0.00 0.03 0.00 0.00 46.19 44.13 3cpm s LEU 252 CO 0.00 0.15 1.09 -2.84 0.23 0.00 0.00 176.35 174.98 3cpm s PRO 253 N -2.46 4.61 0.33 1.29 0.02 -1.26 -3.96 135.00 133.57 3cpm s PRO 253 Ca 0.25 1.71 -0.12 0.00 0.02 0.00 0.00 61.00 62.86 3cpm s PRO 253 Cb -0.11 -3.27 -0.08 0.00 0.02 0.00 0.00 34.50 31.07 3cpm s PRO 253 CO 0.17 0.11 0.70 -1.54 -0.33 0.00 0.00 177.00 176.11 3cpm s SER 254 N -0.24 6.66 -0.05 2.53 1.04 -1.26 -4.93 113.70 117.44 3cpm s SER 254 Ca 0.48 1.15 -0.04 0.00 0.48 0.00 0.00 55.95 58.02 3cpm s SER 254 Cb -0.29 -2.32 -0.15 0.00 0.10 0.00 0.00 66.02 63.35 3cpm s SER 254 CO 0.35 -0.24 3.09 -2.65 0.98 0.00 0.00 173.24 174.78 3cpm n PRO 255 N -0.61 1.79 0.00 4.02 -0.02 -1.26 -4.89 135.00 134.03 3cpm n PRO 255 Ca 0.02 -0.90 0.00 0.00 -2.02 0.00 0.00 63.50 60.60 3cpm n PRO 255 Cb 0.53 -1.75 0.00 0.00 -0.02 0.00 0.00 33.50 32.26 3cpm n PRO 255 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3cpm n GLU 256 N 2.02 1.63 -0.37 -0.52 0.00 -1.26 -5.11 120.64 117.03 3cpm n GLU 256 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.49 3cpm n GLU 256 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.21 3cpm n GLU 256 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00