#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q5i s VAL 65 N 0.00 2.22 -0.93 1.39 0.11 -1.26 -4.92 120.40 117.00 2q5i s VAL 65 Ca 0.00 0.15 -0.24 0.00 -2.93 0.00 0.00 61.98 58.96 2q5i s VAL 65 Cb 0.00 -3.07 0.04 0.00 -1.53 0.00 0.00 36.38 31.82 2q5i s VAL 65 CO 0.00 -0.02 1.43 -0.62 -3.33 0.00 0.00 175.10 172.57 2q5i s ASP 66 N -1.28 6.33 0.18 3.54 -1.08 -1.26 -4.87 116.67 118.24 2q5i s ASP 66 Ca 0.77 -1.12 -0.12 0.00 -0.52 0.00 0.00 52.55 51.56 2q5i s ASP 66 Cb -0.37 -2.57 0.10 0.00 -1.46 0.00 0.00 42.92 38.63 2q5i s ASP 66 CO 0.41 -1.67 1.81 -0.09 0.52 0.00 0.00 175.17 176.15 2q5i h ARG 67 N 10.02 0.87 -0.49 4.34 2.43 -1.99 -1.18 114.38 128.38 2q5i h ARG 67 Ca 0.06 -0.09 0.06 0.00 -0.81 0.00 0.00 59.98 59.20 2q5i h ARG 67 Cb 1.02 -0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.35 2q5i h ARG 67 CO 1.38 0.65 0.21 0.00 -1.51 0.00 0.00 179.97 180.69 2q5i h ALA 68 N 1.18 0.62 -0.20 2.80 0.00 -1.98 0.54 119.26 122.21 2q5i h ALA 68 Ca 0.23 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2q5i h ALA 68 Cb 0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2q5i h ALA 68 CO -0.04 -0.16 -0.03 -0.22 0.00 0.00 0.00 179.25 178.79 2q5i h LYS 69 N 0.41 0.37 -0.06 0.00 3.64 -1.89 -0.82 116.57 118.23 2q5i h LYS 69 Ca 0.23 -0.14 0.01 0.00 -1.27 0.00 0.00 60.65 59.48 2q5i h LYS 69 Cb 0.19 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 2q5i h LYS 69 CO -0.20 0.61 -0.02 1.98 -2.27 0.00 0.00 179.45 179.55 2q5i h MET 70 N 0.10 -0.01 -0.57 1.90 4.05 -0.93 -1.92 114.93 117.57 2q5i h MET 70 Ca 0.05 0.00 0.07 0.00 -0.28 0.00 0.00 59.70 59.54 2q5i h MET 70 Cb 0.46 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.23 2q5i h MET 70 CO 0.02 -0.00 0.38 0.93 0.23 0.00 0.00 176.91 178.46 2q5i h GLU 71 N -0.01 0.49 -0.23 0.39 5.08 0.19 0.11 114.58 120.60 2q5i h GLU 71 Ca 0.03 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 2q5i h GLU 71 Cb 0.05 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 2q5i h GLU 71 CO -0.07 0.32 -0.02 0.22 -1.00 0.00 0.00 179.01 178.46 2q5i h ASP 72 N 0.51 0.43 -0.08 1.42 3.58 -0.61 -0.94 116.42 120.72 2q5i h ASP 72 Ca 0.25 -0.33 -0.00 0.00 0.42 0.00 0.00 57.03 57.36 2q5i h ASP 72 Cb 0.33 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 41.26 2q5i h ASP 72 CO -0.07 0.66 0.03 0.74 -2.88 0.00 0.00 179.24 177.72 2q5i h THR 73 N 0.19 1.14 -0.89 2.25 2.02 -0.55 0.13 112.91 117.19 2q5i h THR 73 Ca 0.06 -0.40 0.09 0.00 0.77 0.00 0.00 66.41 66.93 2q5i h THR 73 Cb 0.45 1.26 -0.07 0.00 -1.74 0.00 0.00 68.15 68.04 2q5i h THR 73 CO 0.02 0.12 0.54 -0.07 0.37 0.00 0.00 175.52 176.49 2q5i h LEU 74 N -0.02 0.80 -0.11 2.58 3.38 -0.77 0.12 115.31 121.29 2q5i h LEU 74 Ca 0.03 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 2q5i h LEU 74 Cb 0.16 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2q5i h LEU 74 CO -0.00 0.47 -0.20 0.50 0.09 0.00 0.00 178.44 179.30 2q5i h LYS 75 N 0.92 0.33 -0.30 1.13 3.64 -1.01 -0.97 116.57 120.31 2q5i h LYS 75 Ca 0.42 -0.21 -0.05 0.00 -1.27 0.00 0.00 60.65 59.54 2q5i h LYS 75 Cb 0.32 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 2q5i h LYS 75 CO -0.22 0.80 0.01 -0.09 -2.27 0.00 0.00 179.45 177.67 2q5i h ARG 76 N -0.10 0.52 -0.01 1.90 2.43 -0.13 -2.64 114.38 116.35 2q5i h ARG 76 Ca 0.01 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 2q5i h ARG 76 Cb 0.78 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.28 2q5i h ARG 76 CO 0.05 0.66 -0.04 0.54 -1.51 0.00 0.00 179.97 179.66 2q5i n ARG 77 N -4.58 1.12 -3.08 0.20 5.12 0.36 -4.95 116.66 110.85 2q5i n ARG 77 Ca -0.03 -0.40 -0.13 0.00 -1.93 0.00 0.00 57.85 55.36 2q5i n ARG 77 Cb 0.25 -1.49 0.06 0.00 -1.16 0.00 0.00 32.46 30.12 2q5i n ARG 77 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2q5i n PHE 78 N -0.59 -1.67 0.21 -1.55 7.35 -0.94 -4.72 117.46 115.55 2q5i n PHE 78 Ca 0.19 0.70 -0.14 0.00 -0.76 0.00 0.00 57.45 57.43 2q5i n PHE 78 Cb 0.25 -4.22 -0.08 0.00 0.35 0.00 0.00 39.48 35.78 2q5i n PHE 78 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 2q5i h PHE 79 N -1.47 -0.50 -3.18 -5.13 0.04 -1.46 -3.06 116.94 102.16 2q5i h PHE 79 Ca -0.43 -0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.28 2q5i h PHE 79 Cb 1.25 0.17 -0.14 0.00 2.20 0.00 0.00 35.95 39.43 2q5i h PHE 79 CO 0.33 -0.20 -0.02 1.52 -0.60 0.00 0.00 178.31 179.34 2q5i s TYR 80 N -5.06 -0.29 0.22 -0.55 1.13 -1.24 -1.72 117.35 109.84 2q5i s TYR 80 Ca -0.15 0.09 -0.18 0.00 -1.41 0.00 0.00 57.07 55.42 2q5i s TYR 80 Cb 0.03 0.31 0.03 0.00 -1.10 0.00 0.00 41.96 41.22 2q5i s TYR 80 CO 0.56 -0.69 0.57 0.34 -2.51 0.00 0.00 175.55 173.82 2q5i s ASP 81 N -2.54 -0.27 0.24 -0.18 3.68 -0.38 -4.26 116.67 112.96 2q5i s ASP 81 Ca 0.00 -0.53 -0.31 0.00 2.13 0.00 0.00 52.55 53.84 2q5i s ASP 81 Cb 0.01 0.62 -0.13 0.00 -1.45 0.00 0.00 42.92 41.97 2q5i s ASP 81 CO -0.09 -1.13 1.55 1.67 0.13 0.00 0.00 175.17 177.30 2q5i n GLN 82 N -0.38 2.41 -2.45 4.34 7.27 -1.26 -0.83 117.38 126.47 2q5i n GLN 82 Ca -0.08 0.86 -0.37 0.00 0.07 0.00 0.00 57.00 57.48 2q5i n GLN 82 Cb 0.62 -2.61 -0.03 0.00 2.41 0.00 0.00 30.24 30.63 2q5i n GLN 82 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2q5i s ALA 83 N 0.28 3.05 -1.48 1.69 0.00 -0.85 -3.65 121.76 120.81 2q5i s ALA 83 Ca 0.69 0.78 -0.07 0.00 0.00 0.00 0.00 51.96 53.36 2q5i s ALA 83 Cb -0.58 -3.31 0.03 0.00 0.00 0.00 0.00 23.12 19.26 2q5i s ALA 83 CO 0.45 -0.36 0.67 1.19 0.00 0.00 0.00 175.76 177.71 2q5i n PHE 84 N -0.21 -2.05 -0.15 0.00 3.01 -1.26 -2.67 117.46 114.12 2q5i n PHE 84 Ca 0.06 0.59 -0.02 0.00 1.01 0.00 0.00 57.45 59.08 2q5i n PHE 84 Cb 0.49 -4.17 0.06 0.00 -0.01 0.00 0.00 39.48 35.85 2q5i n PHE 84 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2q5i h ALA 85 N 1.00 0.49 0.00 4.37 0.00 -1.90 0.61 119.26 123.82 2q5i h ALA 85 Ca -0.52 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2q5i h ALA 85 Cb 1.35 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2q5i h ALA 85 CO 0.57 -0.36 0.00 -0.84 0.00 0.00 0.00 179.25 178.61 2q5i h ILE 86 N 0.15 0.00 -0.49 0.00 3.07 -1.92 -0.17 117.51 118.15 2q5i h ILE 86 Ca 0.25 -0.30 0.00 0.00 1.55 0.00 0.00 64.86 66.36 2q5i h ILE 86 Cb 0.36 1.23 0.00 0.00 -0.27 0.00 0.00 36.82 38.14 2q5i h ILE 86 CO -0.38 0.00 0.00 -1.22 -1.05 0.00 0.00 178.15 175.50 2q5i n TYR 87 N -2.93 0.65 0.00 0.16 4.02 -0.27 -4.90 117.16 113.88 2q5i n TYR 87 Ca -0.00 -0.32 0.00 0.00 -0.01 0.00 0.00 57.90 57.56 2q5i n TYR 87 Cb 0.21 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.53 2q5i n TYR 87 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2q5i n GLY 88 N 1.40 0.49 0.00 2.72 0.00 -0.08 -5.00 105.19 104.72 2q5i n GLY 88 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2q5i n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q5i n GLY 89 N -1.40 -1.59 2.76 -0.02 0.00 0.20 -4.89 105.19 100.24 2q5i n GLY 89 Ca 0.00 -1.56 -0.19 0.00 0.00 0.00 0.00 46.02 44.28 2q5i n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q5i s VAL 90 N -2.44 0.09 0.37 1.61 1.01 -1.09 -4.92 120.40 115.03 2q5i s VAL 90 Ca 0.00 0.22 -0.26 0.00 0.00 0.00 0.00 61.98 61.93 2q5i s VAL 90 Cb 0.00 -0.26 -0.09 0.00 0.00 0.00 0.00 36.38 36.03 2q5i s VAL 90 CO 0.00 0.17 1.17 -0.94 0.00 0.00 0.00 175.10 175.50 2q5i s SER 91 N 1.55 6.70 0.00 3.32 1.04 -1.26 -2.80 113.70 122.25 2q5i s SER 91 Ca -0.02 2.36 0.00 0.00 0.48 0.00 0.00 55.95 58.77 2q5i s SER 91 Cb -0.13 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.37 2q5i s SER 91 CO -0.03 -0.55 0.00 0.61 0.98 0.00 0.00 173.24 174.25 2q5i n GLY 92 N 0.74 1.41 3.26 7.32 0.00 -1.26 -4.83 105.19 111.82 2q5i n GLY 92 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2q5i n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2q5i s LEU 93 N 0.00 2.09 -0.01 0.99 1.43 -1.12 -0.88 118.68 121.18 2q5i s LEU 93 Ca 0.00 -0.52 0.01 0.00 -1.03 0.00 0.00 54.13 52.59 2q5i s LEU 93 Cb 0.00 -1.39 0.01 0.00 0.03 0.00 0.00 46.19 44.84 2q5i s LEU 93 CO 0.00 0.21 -0.02 -0.31 0.23 0.00 0.00 176.35 176.46 2q5i s TYR 94 N 0.02 0.29 0.17 0.29 1.51 -1.26 -2.01 117.35 116.35 2q5i s TYR 94 Ca -0.09 -0.04 -0.11 0.00 -1.01 0.00 0.00 57.07 55.83 2q5i s TYR 94 Cb -0.15 -0.25 -0.07 0.00 -0.11 0.00 0.00 41.96 41.38 2q5i s TYR 94 CO 0.06 -0.05 0.50 -0.51 -1.11 0.00 0.00 175.55 174.44 2q5i s ASP 95 N 0.29 6.67 -0.16 2.29 1.01 -0.01 -4.80 116.67 121.95 2q5i s ASP 95 Ca -0.03 0.91 -0.03 0.00 0.71 0.00 0.00 52.55 54.11 2q5i s ASP 95 Cb -0.05 -2.22 -0.02 0.00 1.01 0.00 0.00 42.92 41.63 2q5i s ASP 95 CO -0.01 0.04 -0.05 -0.36 0.21 0.00 0.00 175.17 175.00 2q5i s PHE 96 N -1.62 2.97 0.86 4.23 0.40 -1.26 -1.25 117.98 122.30 2q5i s PHE 96 Ca 0.41 -0.46 -0.08 0.00 -0.60 0.00 0.00 56.93 56.20 2q5i s PHE 96 Cb -0.13 -1.97 0.19 0.00 0.51 0.00 0.00 43.02 41.62 2q5i s PHE 96 CO 0.20 -0.16 1.17 0.41 0.70 0.00 0.00 175.22 177.55 2q5i n GLY 97 N 3.77 -0.43 0.40 4.36 0.00 -0.70 -4.63 105.19 107.96 2q5i n GLY 97 Ca -0.18 -1.87 -0.07 0.00 0.00 0.00 0.00 46.02 43.90 2q5i n GLY 97 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2q5i h PRO 98 N 0.00 -0.12 -0.39 1.61 0.11 -1.88 0.17 132.00 131.51 2q5i h PRO 98 Ca -0.38 0.01 -0.12 0.00 0.11 0.00 0.00 66.00 65.62 2q5i h PRO 98 Cb 1.21 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2q5i h PRO 98 CO 0.33 -0.08 -0.23 -0.39 -0.21 0.00 0.00 178.00 177.42 2q5i h VAL 99 N -0.12 1.27 -0.33 3.15 -1.51 -1.85 -1.28 116.25 115.57 2q5i h VAL 99 Ca 0.21 -1.34 0.04 0.00 -1.23 0.00 0.00 66.70 64.39 2q5i h VAL 99 Cb 0.54 1.21 -0.04 0.00 -2.13 0.00 0.00 31.29 30.87 2q5i h VAL 99 CO -0.82 0.45 0.08 1.23 -1.23 0.00 0.00 177.57 177.28 2q5i h GLY 100 N 0.96 0.39 1.22 5.19 0.00 -1.21 -0.63 103.07 109.00 2q5i h GLY 100 Ca 0.09 -0.04 -0.05 0.00 0.00 0.00 0.00 47.33 47.33 2q5i h GLY 100 CO 0.06 -0.00 0.19 0.00 0.00 0.00 0.00 176.54 176.78 2q5i h ALA 102 N 1.26 0.29 -0.13 0.00 0.00 -0.67 0.14 119.26 120.15 2q5i h ALA 102 Ca 0.21 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2q5i h ALA 102 Cb 0.29 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2q5i h ALA 102 CO -0.01 -0.25 0.01 1.25 0.00 0.00 0.00 179.25 180.25 2q5i h LEU 103 N 0.30 0.23 -0.28 0.00 5.85 -0.92 -1.22 115.31 119.27 2q5i h LEU 103 Ca 0.09 -0.30 0.05 0.00 0.84 0.00 0.00 57.88 58.56 2q5i h LEU 103 Cb -0.02 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 40.90 2q5i h LEU 103 CO -0.03 0.47 -0.01 0.50 -0.34 0.00 0.00 178.44 179.03 2q5i h LYS 104 N -0.02 0.07 -0.44 1.25 3.64 -0.93 -0.32 116.57 119.82 2q5i h LYS 104 Ca 0.04 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.39 2q5i h LYS 104 Cb 0.35 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 2q5i h LYS 104 CO 0.01 0.05 0.17 -0.91 -2.27 0.00 0.00 179.45 176.49 2q5i h ASN 105 N 0.07 0.57 -0.35 4.20 2.35 -0.62 -1.74 115.58 120.07 2q5i h ASN 105 Ca 0.13 -0.06 -0.17 0.00 -0.55 0.00 0.00 56.30 55.65 2q5i h ASN 105 Cb 0.18 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.40 2q5i h ASN 105 CO -0.23 0.53 -0.42 0.78 -1.65 0.00 0.00 177.43 176.44 2q5i h ASN 106 N 0.63 0.98 -0.68 5.81 -0.26 -0.55 -0.59 115.58 120.92 2q5i h ASN 106 Ca 0.15 -0.47 0.02 0.00 -0.56 0.00 0.00 56.30 55.45 2q5i h ASN 106 Cb 0.14 -0.28 -0.04 0.00 -1.06 0.00 0.00 38.32 37.09 2q5i h ASN 106 CO -0.01 1.27 0.44 0.40 -1.06 0.00 0.00 177.43 178.46 2q5i h ILE 107 N 0.73 1.12 -0.28 2.81 2.04 -0.81 0.36 117.51 123.48 2q5i h ILE 107 Ca 0.05 -0.30 -0.09 0.00 1.00 0.00 0.00 64.86 65.53 2q5i h ILE 107 Cb 1.02 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 2q5i h ILE 107 CO 0.10 0.16 -0.15 0.40 0.00 0.00 0.00 178.15 178.66 2q5i h ILE 108 N 0.87 1.30 -0.68 -0.67 2.04 -1.20 -1.15 117.51 118.02 2q5i h ILE 108 Ca 0.27 -1.26 -0.04 0.00 1.00 0.00 0.00 64.86 64.83 2q5i h ILE 108 Cb -0.03 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.53 2q5i h ILE 108 CO -0.09 0.40 0.29 -0.61 0.00 0.00 0.00 178.15 178.14 2q5i h GLN 109 N 0.35 1.01 -0.83 2.37 5.75 -0.93 -0.50 115.11 122.33 2q5i h GLN 109 Ca 0.06 -0.17 -0.02 0.00 -0.15 0.00 0.00 58.65 58.36 2q5i h GLN 109 Cb 0.68 -0.17 -0.04 0.00 1.07 0.00 0.00 27.48 29.02 2q5i h GLN 109 CO 0.05 0.83 0.42 1.15 -2.65 0.00 0.00 178.83 178.63 2q5i h THR 110 N 0.96 1.25 -0.63 2.39 2.02 -0.85 -2.54 112.91 115.51 2q5i h THR 110 Ca 0.23 -0.67 0.00 0.00 0.77 0.00 0.00 66.41 66.74 2q5i h THR 110 Cb 0.19 0.17 -0.03 0.00 -1.74 0.00 0.00 68.15 66.74 2q5i h THR 110 CO -0.02 0.29 0.40 -0.25 0.37 0.00 0.00 175.52 176.31 2q5i h TRP 111 N 1.16 0.82 -0.35 3.16 7.01 -0.63 -1.27 115.95 125.85 2q5i h TRP 111 Ca 0.29 0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.32 2q5i h TRP 111 Cb 0.08 -0.27 -0.03 0.00 -2.10 0.00 0.00 29.16 26.84 2q5i h TRP 111 CO 0.01 0.54 0.18 0.00 -2.79 0.00 0.00 178.44 176.37 2q5i h ARG 112 N 0.86 0.35 -0.52 2.65 3.08 -0.71 -0.45 114.38 119.64 2q5i h ARG 112 Ca 0.23 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 60.16 2q5i h ARG 112 Cb -0.06 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 2q5i h ARG 112 CO -0.05 0.23 -0.05 1.96 -1.07 0.00 0.00 179.97 181.00 2q5i h GLN 113 N 0.36 0.95 -0.11 0.04 1.08 -1.36 0.52 115.11 116.59 2q5i h GLN 113 Ca 0.15 -0.33 -0.13 0.00 -1.45 0.00 0.00 58.65 56.89 2q5i h GLN 113 Cb 0.06 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.40 2q5i h GLN 113 CO -0.10 0.99 -0.51 1.25 -0.95 0.00 0.00 178.83 179.51 2q5i h HIS 114 N 0.82 0.36 0.00 2.96 2.76 -0.82 -2.57 115.15 118.66 2q5i h HIS 114 Ca 0.14 -0.12 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 2q5i h HIS 114 Cb 0.60 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 29.48 2q5i h HIS 114 CO 0.04 0.74 -0.21 1.19 -1.30 0.00 0.00 177.93 178.39 2q5i n PHE 115 N -3.95 0.00 0.05 5.26 3.01 -0.21 -4.44 117.46 117.17 2q5i n PHE 115 Ca -0.02 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.33 2q5i n PHE 115 Cb 0.55 -0.10 -0.06 0.00 -0.01 0.00 0.00 39.48 39.86 2q5i n PHE 115 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 2q5i h ILE 116 N -0.21 0.84 -0.11 4.37 2.04 -1.37 -0.38 117.51 122.70 2q5i h ILE 116 Ca 0.00 0.00 -0.20 0.00 1.00 0.00 0.00 64.86 65.66 2q5i h ILE 116 Cb 0.21 0.84 0.01 0.00 -0.74 0.00 0.00 36.82 37.14 2q5i h ILE 116 CO 0.00 0.00 -0.72 -0.61 0.00 0.00 0.00 178.15 176.82 2q5i h GLN 117 N -0.11 0.68 -0.35 2.37 5.75 -1.06 0.93 115.11 123.32 2q5i h GLN 117 Ca 0.02 -0.58 -0.09 0.00 -0.15 0.00 0.00 58.65 57.86 2q5i h GLN 117 Cb 0.14 0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.80 2q5i h GLN 117 CO -0.06 1.19 -0.14 1.49 -2.65 0.00 0.00 178.83 178.67 2q5i h GLU 118 N 0.35 0.63 -0.38 1.69 4.57 -1.35 -3.04 114.58 117.05 2q5i h GLU 118 Ca -0.06 -0.20 0.00 0.00 -1.18 0.00 0.00 59.36 57.92 2q5i h GLU 118 Cb 1.36 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.89 2q5i h GLU 118 CO 0.15 0.74 0.00 0.39 -1.18 0.00 0.00 179.01 179.11 2q5i n GLU 119 N -4.17 2.47 -3.95 1.92 -0.58 -0.16 -4.98 120.64 111.18 2q5i n GLU 119 Ca 0.01 -2.08 -0.28 0.00 -0.42 0.00 0.00 57.16 54.40 2q5i n GLU 119 Cb 0.36 -1.35 -0.02 0.00 -0.57 0.00 0.00 31.44 29.86 2q5i n GLU 119 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2q5i n GLN 120 N 0.88 -2.68 -2.35 3.49 1.13 -0.33 -4.91 117.38 112.60 2q5i n GLN 120 Ca 0.14 0.37 -0.38 0.00 -1.94 0.00 0.00 57.00 55.19 2q5i n GLN 120 Cb 0.47 -4.30 -0.02 0.00 0.11 0.00 0.00 30.24 26.49 2q5i n GLN 120 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2q5i s ILE 121 N -3.92 3.29 -0.46 5.09 1.01 0.18 -4.87 121.20 121.52 2q5i s ILE 121 Ca 0.08 1.07 -0.29 0.00 0.00 0.00 0.00 60.65 61.51 2q5i s ILE 121 Cb -0.03 -3.59 0.03 0.00 0.01 0.00 0.00 42.46 38.87 2q5i s ILE 121 CO 0.90 0.09 1.16 -0.76 0.00 0.00 0.00 174.94 176.33 2q5i s LEU 122 N -2.47 3.65 0.09 2.97 1.43 0.51 -4.90 118.68 119.96 2q5i s LEU 122 Ca 0.57 0.53 -0.22 0.00 -1.03 0.00 0.00 54.13 53.98 2q5i s LEU 122 Cb -0.29 -3.55 -0.07 0.00 0.03 0.00 0.00 46.19 42.31 2q5i s LEU 122 CO 0.36 -1.25 0.66 -0.70 0.23 0.00 0.00 176.35 175.65 2q5i s GLU 123 N 4.46 4.37 0.04 1.70 2.12 -1.26 -1.09 118.70 129.04 2q5i s GLU 123 Ca 0.49 0.91 -0.01 0.00 0.36 0.00 0.00 54.97 56.72 2q5i s GLU 123 Cb -0.08 -3.27 -0.03 0.00 0.26 0.00 0.00 34.13 31.01 2q5i s GLU 123 CO 0.31 0.55 -0.02 0.96 -0.54 0.00 0.00 175.26 176.52 2q5i s ILE 124 N -0.92 0.19 -0.33 -3.70 -4.36 -0.36 -4.91 121.20 106.83 2q5i s ILE 124 Ca 0.32 -1.60 0.01 0.00 -0.26 0.00 0.00 60.65 59.12 2q5i s ILE 124 Cb -0.21 -1.26 0.10 0.00 1.25 0.00 0.00 42.46 42.34 2q5i s ILE 124 CO 0.22 -0.89 0.09 -0.62 0.24 0.00 0.00 174.94 173.98 2q5i s ASP 125 N -2.62 4.26 0.42 4.36 2.15 -1.26 -4.31 116.67 119.68 2q5i s ASP 125 Ca 0.02 -1.85 0.02 0.00 0.43 0.00 0.00 52.55 51.17 2q5i s ASP 125 Cb 0.04 -1.13 -0.00 0.00 -0.30 0.00 0.00 42.92 41.53 2q5i s ASP 125 CO -0.08 -0.40 0.62 0.00 -0.17 0.00 0.00 175.17 175.14 2q5i s THR 127 N -2.46 3.80 -0.03 0.00 -4.23 -1.26 -4.99 115.64 106.46 2q5i s THR 127 Ca 0.48 0.83 -0.13 0.00 -1.18 0.00 0.00 61.69 61.69 2q5i s THR 127 Cb -0.10 -3.37 -0.32 0.00 1.34 0.00 0.00 72.50 70.05 2q5i s THR 127 CO 0.36 -0.53 0.75 0.24 -0.54 0.00 0.00 174.62 174.91 2q5i h MET 128 N 0.32 0.43 -6.78 3.99 2.86 -1.95 -3.45 114.93 110.34 2q5i h MET 128 Ca -0.47 -0.74 -0.53 0.00 -2.06 0.00 0.00 59.70 55.91 2q5i h MET 128 Cb 1.22 0.28 0.08 0.00 0.06 0.00 0.00 31.60 33.23 2q5i h MET 128 CO 0.57 1.35 0.86 -0.51 1.06 0.00 0.00 176.91 180.24 2q5i s LEU 129 N -7.40 4.35 -0.06 1.22 1.43 -1.26 -0.99 118.68 115.97 2q5i s LEU 129 Ca -0.14 2.88 -0.02 0.00 -1.03 0.00 0.00 54.13 55.81 2q5i s LEU 129 Cb 0.05 -3.63 0.04 0.00 0.03 0.00 0.00 46.19 42.68 2q5i s LEU 129 CO 0.88 -0.86 0.11 -0.89 0.23 0.00 0.00 176.35 175.81 2q5i s THR 130 N 0.03 -0.13 0.51 5.49 2.01 0.07 -4.89 115.64 118.74 2q5i s THR 130 Ca 0.63 0.29 -0.20 0.00 0.31 0.00 0.00 61.69 62.72 2q5i s THR 130 Cb -0.46 -0.20 -0.07 0.00 0.01 0.00 0.00 72.50 71.77 2q5i s THR 130 CO 0.46 0.12 1.09 -2.16 -0.69 0.00 0.00 174.62 173.44 2q5i s PRO 131 N 1.68 3.62 0.18 4.92 0.04 -1.26 -0.27 135.00 143.91 2q5i s PRO 131 Ca -0.03 1.50 -0.15 0.00 0.04 0.00 0.00 61.00 62.37 2q5i s PRO 131 Cb -0.12 -2.09 0.17 0.00 0.04 0.00 0.00 34.50 32.50 2q5i s PRO 131 CO -0.05 -0.61 1.67 1.49 0.04 0.00 0.00 177.00 179.55 2q5i h GLU 132 N 1.46 0.06 -0.91 4.56 4.81 -1.55 -2.74 114.58 120.28 2q5i h GLU 132 Ca -0.50 -0.00 0.12 0.00 -0.13 0.00 0.00 59.36 58.85 2q5i h GLU 132 Cb 1.24 -0.01 -0.08 0.00 0.63 0.00 0.00 28.75 30.52 2q5i h GLU 132 CO 0.58 0.04 0.54 -1.35 -0.73 0.00 0.00 179.01 178.10 2q5i h PRO 133 N 0.07 0.83 -0.68 0.92 0.11 -1.92 0.28 132.00 131.61 2q5i h PRO 133 Ca 0.24 -0.05 0.14 0.00 0.11 0.00 0.00 66.00 66.43 2q5i h PRO 133 Cb 0.36 -0.19 -0.13 0.00 0.11 0.00 0.00 31.00 31.16 2q5i h PRO 133 CO -0.44 0.55 -0.18 0.28 -0.21 0.00 0.00 178.00 178.00 2q5i h VAL 134 N 0.86 0.31 0.00 3.15 2.07 -1.87 -1.80 116.25 118.97 2q5i h VAL 134 Ca 0.46 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.98 2q5i h VAL 134 Cb 0.48 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2q5i h VAL 134 CO -0.28 0.00 -0.33 -0.07 0.02 0.00 0.00 177.57 176.91 2q5i h LEU 135 N -0.01 0.00 0.21 2.57 3.38 -1.11 -3.01 115.31 117.34 2q5i h LEU 135 Ca 0.32 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 2q5i h LEU 135 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2q5i h LEU 135 CO -0.70 0.03 -0.10 0.50 0.09 0.00 0.00 178.44 178.26 2q5i h LYS 136 N 0.00 -0.27 -0.76 1.13 1.63 -0.44 -2.00 116.57 115.86 2q5i h LYS 136 Ca 0.00 0.02 0.12 0.00 -0.85 0.00 0.00 60.65 59.94 2q5i h LYS 136 Cb 0.85 0.06 -0.08 0.00 -0.60 0.00 0.00 32.23 32.45 2q5i h LYS 136 CO 0.00 -0.03 0.35 1.15 -3.45 0.00 0.00 179.45 177.48 2q5i h THR 137 N -0.48 0.75 0.00 1.00 2.02 -1.30 0.24 112.91 115.15 2q5i h THR 137 Ca -0.03 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 66.96 2q5i h THR 137 Cb 0.36 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 2q5i h THR 137 CO 0.05 0.10 0.00 -1.54 0.37 0.00 0.00 175.52 174.50 2q5i n SER 138 N -4.91 0.00 -0.00 4.18 3.41 -1.14 -4.84 113.62 110.31 2q5i n SER 138 Ca 0.14 0.47 -0.00 0.00 -0.26 0.00 0.00 58.87 59.22 2q5i n SER 138 Cb 0.36 -0.49 -0.00 0.00 -0.26 0.00 0.00 64.21 63.82 2q5i n SER 138 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2q5i n GLY 139 N 0.42 0.45 0.23 5.00 0.00 0.85 -4.92 105.19 107.22 2q5i n GLY 139 Ca 0.05 -0.45 -0.14 0.00 0.00 0.00 0.00 46.02 45.47 2q5i n GLY 139 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2q5i h HIS 140 N 0.00 0.99 -0.92 1.61 3.86 -1.57 -1.48 115.15 117.64 2q5i h HIS 140 Ca -0.00 -0.38 0.11 0.00 -1.16 0.00 0.00 60.37 58.94 2q5i h HIS 140 Cb 0.01 -0.18 -0.08 0.00 1.06 0.00 0.00 27.41 28.22 2q5i h HIS 140 CO 0.00 1.19 0.56 0.28 0.86 0.00 0.00 177.93 180.82 2q5i h VAL 141 N 0.58 0.91 0.00 2.45 2.07 -1.79 -0.40 116.25 120.07 2q5i h VAL 141 Ca -0.00 -0.31 -0.20 0.00 0.82 0.00 0.00 66.70 67.00 2q5i h VAL 141 Cb 1.21 -0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 2q5i h VAL 141 CO 0.13 0.17 -1.68 0.47 0.02 0.00 0.00 177.57 176.67 2q5i n ASP 142 N -4.67 0.62 0.00 0.57 10.43 -1.22 -4.66 116.55 117.61 2q5i n ASP 142 Ca 0.16 0.28 0.00 0.00 2.57 0.00 0.00 54.79 57.80 2q5i n ASP 142 Cb 0.32 0.47 0.00 0.00 1.84 0.00 0.00 41.12 43.75 2q5i n ASP 142 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 2q5i n LYS 143 N -2.82 -0.43 -2.50 -1.24 5.02 -0.56 -4.84 118.16 110.79 2q5i n LYS 143 Ca -0.14 -0.32 -0.41 0.00 -2.02 0.00 0.00 58.31 55.41 2q5i n LYS 143 Cb 0.89 -0.81 0.01 0.00 -0.02 0.00 0.00 35.03 35.10 2q5i n LYS 143 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2q5i n PHE 144 N -0.03 2.62 -4.07 2.13 7.35 -0.18 -4.95 117.46 120.33 2q5i n PHE 144 Ca 0.00 -2.66 -0.10 0.00 -0.76 0.00 0.00 57.45 53.93 2q5i n PHE 144 Cb 0.08 -1.49 -0.11 0.00 0.35 0.00 0.00 39.48 38.31 2q5i n PHE 144 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2q5i s ALA 145 N -2.44 0.53 -0.07 3.13 0.00 -1.26 -0.99 121.76 120.66 2q5i s ALA 145 Ca 0.41 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 51.39 2q5i s ALA 145 Cb 0.14 0.17 -0.03 0.00 0.00 0.00 0.00 23.12 23.40 2q5i s ALA 145 CO -0.05 -0.22 -0.09 -0.51 0.00 0.00 0.00 175.76 174.90 2q5i s ASP 146 N -2.31 4.49 0.20 0.00 1.01 -0.83 -4.90 116.67 114.33 2q5i s ASP 146 Ca -0.01 -0.08 -0.31 0.00 0.71 0.00 0.00 52.55 52.85 2q5i s ASP 146 Cb -0.01 -1.17 -0.11 0.00 1.01 0.00 0.00 42.92 42.65 2q5i s ASP 146 CO -0.04 0.33 1.57 -0.36 0.21 0.00 0.00 175.17 176.88 2q5i s PHE 147 N -0.64 2.99 -0.03 4.23 0.40 -1.26 -2.03 117.98 121.64 2q5i s PHE 147 Ca 0.10 0.67 0.06 0.00 -0.60 0.00 0.00 56.93 57.16 2q5i s PHE 147 Cb -0.11 -3.96 -0.01 0.00 0.51 0.00 0.00 43.02 39.44 2q5i s PHE 147 CO 0.02 -3.45 -0.20 1.41 0.70 0.00 0.00 175.22 173.70 2q5i s MET 148 N 0.65 1.74 0.00 0.44 1.75 0.58 -0.29 119.30 124.17 2q5i s MET 148 Ca 0.68 -0.71 0.06 0.00 -1.25 0.00 0.00 55.69 54.48 2q5i s MET 148 Cb -0.45 -1.62 -0.02 0.00 2.84 0.00 0.00 34.83 35.59 2q5i s MET 148 CO 0.36 0.38 -0.20 0.08 -0.65 0.00 0.00 175.02 174.99 2q5i s VAL 149 N -0.33 1.60 0.09 10.11 1.01 -0.03 -1.09 120.40 131.77 2q5i s VAL 149 Ca 0.04 -0.95 0.05 0.00 0.00 0.00 0.00 61.98 61.12 2q5i s VAL 149 Cb -0.09 -1.35 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 2q5i s VAL 149 CO 0.00 0.38 -0.13 -1.59 0.00 0.00 0.00 175.10 173.77 2q5i s LYS 150 N -0.67 0.88 0.04 2.72 -2.85 -1.26 -0.04 119.74 118.57 2q5i s LYS 150 Ca 0.08 -1.10 -0.31 0.00 -1.00 0.00 0.00 55.97 53.64 2q5i s LYS 150 Cb -0.08 -0.74 -0.07 0.00 -2.06 0.00 0.00 37.83 34.88 2q5i s LYS 150 CO -0.00 0.14 1.47 0.34 0.10 0.00 0.00 175.35 177.40 2q5i s ASP 151 N -2.19 6.77 0.51 0.03 3.68 -0.23 -0.66 116.67 124.58 2q5i s ASP 151 Ca 0.04 2.27 0.16 0.00 2.13 0.00 0.00 52.55 57.14 2q5i s ASP 151 Cb -0.06 -2.57 1.23 0.00 -1.45 0.00 0.00 42.92 40.07 2q5i s ASP 151 CO 0.02 -0.76 2.13 -0.37 0.13 0.00 0.00 175.17 176.32 2q5i h VAL 152 N 4.74 1.02 0.00 1.11 -1.51 -1.70 -1.92 116.25 117.99 2q5i h VAL 152 Ca -0.40 -0.09 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 2q5i h VAL 152 Cb 1.19 1.05 0.00 0.00 -2.13 0.00 0.00 31.29 31.40 2q5i h VAL 152 CO 0.90 0.03 0.00 0.29 -1.23 0.00 0.00 177.57 177.56 2q5i n LYS 153 N -4.50 0.00 0.17 5.19 5.02 -1.26 -4.70 118.16 118.07 2q5i n LYS 153 Ca -0.03 0.08 0.05 0.00 -2.02 0.00 0.00 58.31 56.38 2q5i n LYS 153 Cb 0.11 -0.44 0.20 0.00 -0.02 0.00 0.00 35.03 34.88 2q5i n LYS 153 CO 0.00 0.00 0.00 -2.95 -0.52 0.00 0.00 177.40 173.93 2q5i h ASN 154 N 0.00 0.00 0.00 4.39 -1.07 -1.99 -3.48 115.58 113.44 2q5i h ASN 154 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 2q5i h ASN 154 Cb 0.00 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.25 2q5i h ASN 154 CO 0.00 0.42 0.00 0.61 0.07 0.00 0.00 177.43 178.53 2q5i n GLY 155 N 0.71 0.77 3.77 9.14 0.00 -0.72 -5.03 105.19 113.83 2q5i n GLY 155 Ca 0.01 -0.28 -0.37 0.00 0.00 0.00 0.00 46.02 45.38 2q5i n GLY 155 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2q5i s GLU 156 N -0.72 3.88 -0.02 1.61 2.12 -1.26 -4.61 118.70 119.68 2q5i s GLU 156 Ca 0.00 1.79 -0.03 0.00 0.36 0.00 0.00 54.97 57.09 2q5i s GLU 156 Cb 0.00 -2.51 -0.04 0.00 0.26 0.00 0.00 34.13 31.84 2q5i s GLU 156 CO 0.00 -0.46 0.18 0.00 -0.54 0.00 0.00 175.26 174.44 2q5i s PHE 158 N -1.29 0.28 -0.17 0.00 0.40 0.94 -4.93 117.98 113.21 2q5i s PHE 158 Ca 0.26 -0.07 -0.29 0.00 -0.60 0.00 0.00 56.93 56.22 2q5i s PHE 158 Cb -0.13 -0.18 -0.02 0.00 0.51 0.00 0.00 43.02 43.20 2q5i s PHE 158 CO 0.17 -0.01 1.45 0.50 0.70 0.00 0.00 175.22 178.03 2q5i s ARG 159 N -0.14 4.05 0.12 0.44 3.52 -1.26 -0.85 118.95 124.83 2q5i s ARG 159 Ca 0.01 1.72 -0.20 0.00 -0.13 0.00 0.00 55.73 57.13 2q5i s ARG 159 Cb -0.02 -3.91 -0.08 0.00 -1.56 0.00 0.00 34.95 29.39 2q5i s ARG 159 CO -0.00 -0.96 1.77 0.00 -0.81 0.00 0.00 175.30 175.30 2q5i h ALA 160 N 9.36 0.22 -0.79 6.12 0.00 -0.98 -2.76 119.26 130.44 2q5i h ALA 160 Ca -0.31 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.67 2q5i h ALA 160 Cb 1.13 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.78 2q5i h ALA 160 CO 0.98 -0.30 0.44 0.38 0.00 0.00 0.00 179.25 180.76 2q5i h ASP 161 N 0.24 0.64 -0.18 0.00 -0.00 -1.91 -1.99 116.42 113.20 2q5i h ASP 161 Ca 0.07 0.04 -0.15 0.00 -0.00 0.00 0.00 57.03 56.99 2q5i h ASP 161 Cb -0.03 -0.08 -0.01 0.00 -0.00 0.00 0.00 39.33 39.22 2q5i h ASP 161 CO -0.02 0.37 -0.42 0.45 -0.00 0.00 0.00 179.24 179.62 2q5i h HIS 162 N 0.76 0.88 -0.38 4.15 3.86 -1.91 -2.36 115.15 120.16 2q5i h HIS 162 Ca 0.37 -0.27 -0.08 0.00 -1.16 0.00 0.00 60.37 59.23 2q5i h HIS 162 Cb 0.32 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.59 2q5i h HIS 162 CO -0.07 1.03 -0.08 1.25 0.86 0.00 0.00 177.93 180.93 2q5i h LEU 163 N 0.59 0.73 -0.21 2.43 5.85 -1.13 -1.43 115.31 122.14 2q5i h LEU 163 Ca 0.04 -0.35 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 2q5i h LEU 163 Cb 0.98 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 2q5i h LEU 163 CO 0.09 0.91 0.08 0.25 -0.34 0.00 0.00 178.44 179.43 2q5i h LEU 164 N 0.53 0.29 -1.23 2.25 6.46 -1.42 -2.15 115.31 120.05 2q5i h LEU 164 Ca 0.10 -0.18 0.08 0.00 -0.12 0.00 0.00 57.88 57.76 2q5i h LEU 164 Cb 0.58 -0.08 -0.06 0.00 -0.73 0.00 0.00 40.66 40.38 2q5i h LEU 164 CO 0.03 0.39 0.56 0.50 -0.62 0.00 0.00 178.44 179.30 2q5i h LYS 165 N 0.17 0.86 -0.34 1.25 3.64 -1.25 -0.42 116.57 120.48 2q5i h LYS 165 Ca 0.07 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.30 2q5i h LYS 165 Cb 0.20 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 2q5i h LYS 165 CO -0.00 0.57 -0.16 0.00 -2.27 0.00 0.00 179.45 177.59 2q5i h ALA 166 N 1.55 0.48 -0.54 5.00 0.00 -1.13 -2.13 119.26 122.49 2q5i h ALA 166 Ca 0.39 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2q5i h ALA 166 Cb 0.33 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2q5i h ALA 166 CO -0.15 0.39 0.26 1.25 0.00 0.00 0.00 179.25 181.00 2q5i h HIS 167 N 0.49 0.77 -0.29 0.00 -0.00 -0.62 -0.60 115.15 114.90 2q5i h HIS 167 Ca 0.08 -0.04 -0.09 0.00 -0.00 0.00 0.00 60.37 60.32 2q5i h HIS 167 Cb 0.69 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.41 27.86 2q5i h HIS 167 CO 0.06 0.60 -0.19 -0.07 -0.00 0.00 0.00 177.93 178.33 2q5i h LEU 168 N 0.72 0.66 -1.47 0.26 3.38 -1.14 -2.16 115.31 115.56 2q5i h LEU 168 Ca 0.19 -0.43 0.02 0.00 0.09 0.00 0.00 57.88 57.74 2q5i h LEU 168 Cb 0.11 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2q5i h LEU 168 CO -0.02 0.96 0.38 1.56 0.09 0.00 0.00 178.44 181.40 2q5i h GLN 169 N 0.38 0.69 0.35 1.13 4.20 -1.26 0.15 115.11 120.75 2q5i h GLN 169 Ca 0.06 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 2q5i h GLN 169 Cb 0.73 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.36 2q5i h GLN 169 CO 0.05 0.46 -0.17 -0.22 -0.67 0.00 0.00 178.83 178.28 2q5i h LYS 170 N 0.71 -0.45 -0.44 1.46 1.63 -0.92 -2.64 116.57 115.91 2q5i h LYS 170 Ca 0.22 0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 60.05 2q5i h LYS 170 Cb 0.01 0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.72 2q5i h LYS 170 CO -0.05 -0.24 0.27 -0.07 -3.45 0.00 0.00 179.45 175.90 2q5i h LEU 171 N -0.57 0.53 -2.87 5.20 3.38 -1.00 -2.42 115.31 117.56 2q5i h LEU 171 Ca -0.05 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2q5i h LEU 171 Cb 0.42 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 2q5i h LEU 171 CO 0.08 0.44 0.01 0.24 0.09 0.00 0.00 178.44 179.30 2q5i h MET 172 N 0.59 0.00 0.00 1.13 2.86 -0.69 0.31 114.93 119.13 2q5i h MET 172 Ca 0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 2q5i h MET 172 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 2q5i h MET 172 CO -0.03 0.00 -0.32 0.43 1.06 0.00 0.00 176.91 178.05 2q5i n SER 173 N -3.21 0.51 -4.75 1.22 7.64 -0.92 -4.91 113.62 109.20 2q5i n SER 173 Ca -0.03 0.21 -0.41 0.00 1.01 0.00 0.00 58.87 59.66 2q5i n SER 173 Cb 0.08 -0.17 -0.03 0.00 -1.01 0.00 0.00 64.21 63.08 2q5i n SER 173 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2q5i s ASP 174 N -3.70 6.94 0.19 6.43 -1.08 0.10 -4.94 116.67 120.60 2q5i s ASP 174 Ca 0.10 2.48 0.09 0.00 -0.52 0.00 0.00 52.55 54.70 2q5i s ASP 174 Cb 0.15 -2.63 -0.01 0.00 -1.46 0.00 0.00 42.92 38.97 2q5i s ASP 174 CO 0.65 -0.44 1.39 0.11 0.52 0.00 0.00 175.17 177.40 2q5i h LYS 175 N 4.28 0.00 0.00 4.34 1.79 -1.91 -3.09 116.57 121.99 2q5i h LYS 175 Ca -0.47 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 2q5i h LYS 175 Cb 1.22 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 2q5i h LYS 175 CO 0.70 0.82 0.00 1.63 -1.08 0.00 0.00 179.45 181.53 2q5i n LYS 176 N -3.43 0.08 -2.72 3.15 5.02 -1.26 -4.78 118.16 114.22 2q5i n LYS 176 Ca 0.00 0.27 -0.40 0.00 -2.02 0.00 0.00 58.31 56.15 2q5i n LYS 176 Cb 0.83 -1.64 -0.05 0.00 -0.02 0.00 0.00 35.03 34.14 2q5i n LYS 176 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2q5i s SER 178 N -0.87 5.84 0.06 0.00 1.04 -1.26 -4.95 113.70 113.55 2q5i s SER 178 Ca 0.43 1.12 -0.20 0.00 0.48 0.00 0.00 55.95 57.78 2q5i s SER 178 Cb -0.26 -2.11 -0.12 0.00 0.10 0.00 0.00 66.02 63.64 2q5i s SER 178 CO 0.32 -1.04 1.45 0.58 0.98 0.00 0.00 173.24 175.54 2q5i h VAL 179 N -0.34 1.28 0.00 5.02 2.07 -1.98 -2.34 116.25 119.96 2q5i h VAL 179 Ca -0.45 -1.00 -0.05 0.00 0.82 0.00 0.00 66.70 66.02 2q5i h VAL 179 Cb 1.23 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 32.57 2q5i h VAL 179 CO 0.62 0.30 -0.23 -0.08 0.02 0.00 0.00 177.57 178.21 2q5i h GLU 180 N 0.06 0.00 -0.31 1.57 4.81 -1.99 -1.96 114.58 116.76 2q5i h GLU 180 Ca 0.05 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.17 2q5i h GLU 180 Cb 0.48 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 2q5i h GLU 180 CO 0.02 0.23 -0.24 -0.22 -0.73 0.00 0.00 179.01 178.06 2q5i h LYS 181 N 0.00 0.70 -0.29 1.92 1.63 -1.91 -2.01 116.57 116.62 2q5i h LYS 181 Ca -0.00 -0.35 -0.02 0.00 -0.85 0.00 0.00 60.65 59.43 2q5i h LYS 181 Cb 0.51 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.13 2q5i h LYS 181 CO 0.03 0.96 0.11 0.87 -3.45 0.00 0.00 179.45 177.96 2q5i h LYS 182 N 0.46 0.44 0.00 1.90 1.57 -0.85 -1.59 116.57 118.50 2q5i h LYS 182 Ca 0.06 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 2q5i h LYS 182 Cb 0.80 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.04 2q5i h LYS 182 CO 0.06 0.47 -0.16 0.66 -0.57 0.00 0.00 179.45 179.92 2q5i h SER 183 N 0.31 0.00 -0.58 0.86 4.64 -1.43 0.23 113.55 117.58 2q5i h SER 183 Ca 0.10 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.32 2q5i h SER 183 Cb 0.20 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.27 2q5i h SER 183 CO -0.01 0.16 0.00 -0.08 -0.87 0.00 0.00 176.83 176.03 2q5i h GLU 184 N 0.00 1.03 0.04 4.77 4.81 -0.82 -2.61 114.58 121.80 2q5i h GLU 184 Ca -0.00 -0.33 -0.22 0.00 -0.13 0.00 0.00 59.36 58.68 2q5i h GLU 184 Cb 0.35 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 2q5i h GLU 184 CO 0.02 1.01 -1.03 0.52 -0.73 0.00 0.00 179.01 178.80 2q5i h MET 185 N 0.92 0.12 -0.85 1.92 2.86 -0.31 -2.59 114.93 117.00 2q5i h MET 185 Ca 0.17 -0.18 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2q5i h MET 185 Cb 0.55 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.23 2q5i h MET 185 CO 0.03 1.04 0.54 0.93 1.06 0.00 0.00 176.91 180.52 2q5i h GLU 186 N 0.04 1.13 -0.03 1.72 5.08 -0.59 -0.86 114.58 121.07 2q5i h GLU 186 Ca -0.05 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 58.12 2q5i h GLU 186 Cb 1.75 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 30.74 2q5i h GLU 186 CO 0.15 0.77 -0.48 0.66 -1.00 0.00 0.00 179.01 179.11 2q5i h SER 187 N 1.15 0.07 -0.38 1.42 4.64 -1.46 -2.12 113.55 116.89 2q5i h SER 187 Ca 0.31 -0.03 -0.04 0.00 -0.47 0.00 0.00 61.79 61.56 2q5i h SER 187 Cb -0.10 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 61.95 2q5i h SER 187 CO -0.06 0.54 0.08 0.58 -0.87 0.00 0.00 176.83 177.10 2q5i h VAL 188 N 0.06 1.23 -0.85 0.95 2.07 -1.00 -2.83 116.25 115.87 2q5i h VAL 188 Ca 0.00 -0.80 0.03 0.00 0.82 0.00 0.00 66.70 66.75 2q5i h VAL 188 Cb 0.86 1.03 -0.05 0.00 -1.52 0.00 0.00 31.29 31.62 2q5i h VAL 188 CO 0.07 0.27 0.56 -0.07 0.02 0.00 0.00 177.57 178.42 2q5i h LEU 189 N 0.46 0.93 0.00 2.57 3.38 -0.98 -1.92 115.31 119.76 2q5i h LEU 189 Ca 0.12 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2q5i h LEU 189 Cb 0.33 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2q5i h LEU 189 CO 0.00 0.65 0.00 0.00 0.09 0.00 0.00 178.44 179.19 2q5i n ALA 190 N -2.41 1.67 -0.61 1.53 0.00 -0.81 -2.52 120.51 117.36 2q5i n ALA 190 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2q5i n ALA 190 Cb 0.08 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.41 2q5i n ALA 190 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2q5i n GLN 191 N -1.13 0.87 -0.31 0.00 6.02 -0.75 -4.91 117.38 117.18 2q5i n GLN 191 Ca 0.05 -0.76 0.08 0.00 -0.01 0.00 0.00 57.00 56.36 2q5i n GLN 191 Cb 0.04 -0.69 0.19 0.00 1.02 0.00 0.00 30.24 30.79 2q5i n GLN 191 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2q5i h LEU 192 N 0.00 -0.57 -0.81 1.08 3.38 -1.21 -0.16 115.31 117.02 2q5i h LEU 192 Ca 0.00 0.25 -0.11 0.00 0.09 0.00 0.00 57.88 58.11 2q5i h LEU 192 Cb 0.71 0.47 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 2q5i h LEU 192 CO 0.00 -0.28 -0.51 0.44 0.09 0.00 0.00 178.44 178.19 2q5i h ASP 193 N 0.04 0.00 0.08 -0.43 3.32 -1.91 -3.17 116.42 114.35 2q5i h ASP 193 Ca 0.48 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.35 2q5i h ASP 193 Cb 0.86 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.41 2q5i h ASP 193 CO -0.85 0.51 -0.66 0.78 -1.72 0.00 0.00 179.24 177.30 2q5i h ASN 194 N 0.00 0.63 -2.34 6.45 2.35 -1.34 -3.46 115.58 117.87 2q5i h ASN 194 Ca -0.01 -0.38 -0.57 0.00 -0.55 0.00 0.00 56.30 54.80 2q5i h ASN 194 Cb 1.02 -0.18 0.05 0.00 0.05 0.00 0.00 38.32 39.26 2q5i h ASN 194 CO 0.07 1.12 0.88 -1.22 -1.65 0.00 0.00 177.43 176.63 2q5i n TYR 195 N -3.91 2.39 -1.48 1.19 0.53 -1.09 -4.99 117.16 109.81 2q5i n TYR 195 Ca -0.04 0.18 -0.15 0.00 -1.02 0.00 0.00 57.90 56.86 2q5i n TYR 195 Cb 0.67 -2.59 0.10 0.00 -1.03 0.00 0.00 39.34 36.49 2q5i n TYR 195 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2q5i n GLY 196 N 3.65 -1.31 0.25 2.72 0.00 -1.26 -4.79 105.19 104.45 2q5i n GLY 196 Ca 0.17 -1.69 -0.14 0.00 0.00 0.00 0.00 46.02 44.36 2q5i n GLY 196 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2q5i h GLN 197 N 0.00 -0.46 0.56 1.61 -0.00 -1.95 -0.85 115.11 114.02 2q5i h GLN 197 Ca -0.22 0.03 -0.03 0.00 -0.00 0.00 0.00 58.65 58.43 2q5i h GLN 197 Cb 0.60 0.11 0.01 0.00 0.00 0.00 0.00 27.48 28.20 2q5i h GLN 197 CO 0.16 -0.31 -0.27 0.37 0.00 0.00 0.00 178.83 178.78 2q5i h GLN 198 N -0.48 -0.73 0.00 1.69 5.75 -1.94 0.97 115.11 120.37 2q5i h GLN 198 Ca -0.01 0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.50 2q5i h GLN 198 Cb 0.43 0.16 -0.00 0.00 1.07 0.00 0.00 27.48 29.14 2q5i h GLN 198 CO -0.02 -0.47 -0.15 1.05 -2.65 0.00 0.00 178.83 176.59 2q5i h GLU 199 N -0.79 0.00 -0.06 1.69 4.11 -1.94 0.20 114.58 117.78 2q5i h GLU 199 Ca -0.08 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.11 2q5i h GLU 199 Cb 0.59 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.86 2q5i h GLU 199 CO 0.13 0.15 -0.91 1.25 0.07 0.00 0.00 179.01 179.69 2q5i h LEU 200 N 0.00 0.86 -0.94 3.06 5.85 -0.93 -1.86 115.31 121.35 2q5i h LEU 200 Ca -0.00 -0.63 0.04 0.00 0.84 0.00 0.00 57.88 58.13 2q5i h LEU 200 Cb 0.39 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.11 2q5i h LEU 200 CO 0.02 1.43 0.61 0.00 -0.34 0.00 0.00 178.44 180.15 2q5i h ALA 201 N 0.54 1.26 -0.41 1.25 0.00 0.51 -1.85 119.26 120.56 2q5i h ALA 201 Ca -0.09 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.65 2q5i h ALA 201 Cb 1.55 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2q5i h ALA 201 CO 0.18 0.46 -0.28 -0.44 0.00 0.00 0.00 179.25 179.17 2q5i h ASP 202 N 1.16 0.95 -0.90 0.00 3.32 -1.00 -2.62 116.42 117.33 2q5i h ASP 202 Ca 0.38 -0.43 0.08 0.00 0.02 0.00 0.00 57.03 57.08 2q5i h ASP 202 Cb 0.04 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 39.27 2q5i h ASP 202 CO -0.13 1.17 0.58 -0.07 -1.72 0.00 0.00 179.24 179.07 2q5i h LEU 203 N 0.72 0.86 -0.67 1.55 3.38 -1.05 0.12 115.31 120.22 2q5i h LEU 203 Ca 0.08 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.94 2q5i h LEU 203 Cb 0.86 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2q5i h LEU 203 CO 0.08 0.53 -0.29 -0.26 0.09 0.00 0.00 178.44 178.58 2q5i h PHE 204 N 0.96 0.83 0.30 1.13 -1.00 -1.07 -2.27 116.94 115.82 2q5i h PHE 204 Ca 0.40 -0.21 -0.01 0.00 2.81 0.00 0.00 57.97 60.96 2q5i h PHE 204 Cb 0.30 -0.19 0.00 0.00 3.61 0.00 0.00 35.95 39.67 2q5i h PHE 204 CO -0.00 0.92 -0.14 0.28 -1.61 0.00 0.00 178.31 177.76 2q5i h VAL 205 N 0.61 0.51 -0.91 -0.55 2.07 -1.08 -1.99 116.25 114.92 2q5i h VAL 205 Ca 0.07 -0.81 0.22 0.00 0.82 0.00 0.00 66.70 67.00 2q5i h VAL 205 Cb 0.80 0.83 -0.12 0.00 -1.52 0.00 0.00 31.29 31.28 2q5i h VAL 205 CO 0.07 0.12 0.44 0.78 0.02 0.00 0.00 177.57 179.00 2q5i h ASN 206 N -0.95 0.43 0.05 0.57 2.35 -0.81 0.38 115.58 117.60 2q5i h ASN 206 Ca -0.04 0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 2q5i h ASN 206 Cb 0.50 0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.97 2q5i h ASN 206 CO 0.07 0.05 -0.16 -1.22 -1.65 0.00 0.00 177.43 174.51 2q5i n TYR 207 N -4.99 0.00 -3.48 1.19 4.02 -0.86 -4.99 117.16 108.06 2q5i n TYR 207 Ca 0.22 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.89 2q5i n TYR 207 Cb 0.65 -0.03 0.06 0.00 -0.02 0.00 0.00 39.34 39.99 2q5i n TYR 207 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2q5i n ASN 208 N 0.18 -5.48 -4.73 7.72 5.15 0.12 -4.94 115.26 113.28 2q5i n ASN 208 Ca 0.14 -0.85 -0.40 0.00 -0.60 0.00 0.00 54.58 52.87 2q5i n ASN 208 Cb 0.43 -4.32 -0.04 0.00 -0.53 0.00 0.00 39.78 35.31 2q5i n ASN 208 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2q5i s VAL 209 N -3.45 4.76 0.44 3.44 1.01 -0.80 -5.06 120.40 120.74 2q5i s VAL 209 Ca 0.41 1.76 0.04 0.00 0.00 0.00 0.00 61.98 64.19 2q5i s VAL 209 Cb -0.10 -4.18 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 2q5i s VAL 209 CO 0.80 0.30 0.03 -0.54 0.00 0.00 0.00 175.10 175.69 2q5i s LYS 210 N 0.28 2.01 0.13 2.72 3.01 -1.26 -4.33 119.74 122.30 2q5i s LYS 210 Ca 0.42 -2.21 -0.31 0.00 -1.01 0.00 0.00 55.97 52.86 2q5i s LYS 210 Cb -0.21 -1.34 -0.10 0.00 -1.01 0.00 0.00 37.83 35.18 2q5i s LYS 210 CO 0.24 -0.26 1.61 0.45 0.51 0.00 0.00 175.35 177.91 2q5i s SER 211 N -3.73 6.58 0.55 2.83 0.15 -0.56 -4.90 113.70 114.62 2q5i s SER 211 Ca 0.22 2.59 0.33 0.00 0.70 0.00 0.00 55.95 59.79 2q5i s SER 211 Cb 0.05 -2.58 1.35 0.00 -1.71 0.00 0.00 66.02 63.13 2q5i s SER 211 CO 0.11 -0.86 1.98 1.55 1.20 0.00 0.00 173.24 177.22 2q5i h PRO 212 N 7.35 0.00 0.00 5.44 0.13 -1.96 -0.12 132.00 142.84 2q5i h PRO 212 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2q5i h PRO 212 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2q5i h PRO 212 CO 0.92 0.00 -0.22 0.82 -0.23 0.00 0.00 178.00 179.29 2q5i h ILE 213 N 0.00 0.00 0.13 -3.56 2.04 -1.99 -3.43 117.51 110.70 2q5i h ILE 213 Ca -0.00 -0.75 -0.35 0.00 1.00 0.00 0.00 64.86 64.76 2q5i h ILE 213 Cb 0.52 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 2q5i h ILE 213 CO 0.00 0.00 -1.86 0.71 0.00 0.00 0.00 178.15 177.00 2q5i h THR 214 N -0.75 0.78 0.00 -0.27 1.35 -1.98 -3.48 112.91 108.56 2q5i h THR 214 Ca 0.00 -2.46 0.00 0.00 -0.55 0.00 0.00 66.41 63.40 2q5i h THR 214 Cb 0.22 2.60 0.00 0.00 -1.73 0.00 0.00 68.15 69.24 2q5i h THR 214 CO 0.00 0.85 0.00 0.61 -0.25 0.00 0.00 175.52 176.73 2q5i n GLY 215 N 1.89 0.89 3.84 5.82 0.00 -0.06 -5.00 105.19 112.57 2q5i n GLY 215 Ca -0.27 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.45 2q5i n GLY 215 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2q5i s ASN 216 N -2.01 3.98 0.54 1.61 0.02 -1.26 -4.53 114.94 113.29 2q5i s ASN 216 Ca 0.00 0.87 -0.20 0.00 -1.02 0.00 0.00 52.86 52.51 2q5i s ASN 216 Cb 0.00 -1.41 -0.05 0.00 0.02 0.00 0.00 41.25 39.81 2q5i s ASN 216 CO 0.00 -2.25 1.19 -1.81 0.02 0.00 0.00 177.10 174.25 2q5i s ASP 217 N -4.29 5.59 0.02 -1.22 1.01 -1.26 -1.50 116.67 115.02 2q5i s ASP 217 Ca 0.63 2.33 0.01 0.00 0.71 0.00 0.00 52.55 56.24 2q5i s ASP 217 Cb -0.13 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.17 2q5i s ASP 217 CO 0.51 -1.31 0.05 -0.76 0.21 0.00 0.00 175.17 173.87 2q5i s LEU 218 N -3.69 3.75 0.82 1.23 1.43 -1.26 -1.84 118.68 119.12 2q5i s LEU 218 Ca 0.72 0.06 -0.11 0.00 -1.03 0.00 0.00 54.13 53.77 2q5i s LEU 218 Cb -0.29 -2.24 0.08 0.00 0.03 0.00 0.00 46.19 43.78 2q5i s LEU 218 CO 0.33 0.25 1.09 -0.94 0.23 0.00 0.00 176.35 177.31 2q5i s SER 219 N -1.85 4.13 0.48 2.29 1.04 0.17 -4.87 113.70 115.08 2q5i s SER 219 Ca 0.23 1.65 -0.23 0.00 0.48 0.00 0.00 55.95 58.08 2q5i s SER 219 Cb -0.12 -2.35 -0.07 0.00 0.10 0.00 0.00 66.02 63.58 2q5i s SER 219 CO 0.15 -2.25 1.26 -2.84 0.98 0.00 0.00 173.24 170.54 2q5i s PRO 220 N -4.94 3.60 0.27 4.02 0.02 -1.26 -4.47 135.00 132.25 2q5i s PRO 220 Ca 0.62 2.01 -0.30 0.00 0.02 0.00 0.00 61.00 63.34 2q5i s PRO 220 Cb -0.17 -2.43 -0.13 0.00 0.02 0.00 0.00 34.50 31.78 2q5i s PRO 220 CO 0.56 -0.75 1.37 -2.30 -0.33 0.00 0.00 177.00 175.56 2q5i n PRO 221 N -0.53 2.07 -4.15 5.54 -0.02 -1.26 -4.79 135.00 131.86 2q5i n PRO 221 Ca 0.07 0.73 -0.16 0.00 -2.02 0.00 0.00 63.50 62.13 2q5i n PRO 221 Cb 0.46 -2.37 -0.12 0.00 -0.02 0.00 0.00 33.50 31.45 2q5i n PRO 221 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2q5i s VAL 222 N -0.37 0.72 -0.15 -1.45 -7.23 -0.25 -4.91 120.40 106.76 2q5i s VAL 222 Ca 0.64 -0.96 -0.29 0.00 -1.81 0.00 0.00 61.98 59.56 2q5i s VAL 222 Cb -0.62 -0.72 -0.02 0.00 0.56 0.00 0.00 36.38 35.59 2q5i s VAL 222 CO 0.53 -0.20 1.27 -0.55 -0.31 0.00 0.00 175.10 175.84 2q5i s SER 223 N -1.28 6.95 -0.30 4.85 0.15 -1.26 -0.31 113.70 122.50 2q5i s SER 223 Ca -0.05 1.73 -0.04 0.00 0.70 0.00 0.00 55.95 58.30 2q5i s SER 223 Cb -0.08 -2.54 0.04 0.00 -1.71 0.00 0.00 66.02 61.73 2q5i s SER 223 CO 0.01 -0.75 0.03 0.12 1.20 0.00 0.00 173.24 173.85 2q5i s PHE 224 N 3.35 3.22 0.34 3.44 5.36 -0.86 -4.93 117.98 127.89 2q5i s PHE 224 Ca 0.56 -1.60 -0.28 0.00 -0.96 0.00 0.00 56.93 54.64 2q5i s PHE 224 Cb -0.22 -2.16 -0.10 0.00 -0.34 0.00 0.00 43.02 40.20 2q5i s PHE 224 CO 0.16 -0.75 1.28 1.21 -1.46 0.00 0.00 175.22 175.66 2q5i s ASN 225 N 1.33 6.74 0.00 6.13 3.84 -1.26 -1.97 114.94 129.75 2q5i s ASN 225 Ca -0.03 2.63 0.25 0.00 0.21 0.00 0.00 52.86 55.93 2q5i s ASN 225 Cb -0.19 -2.64 0.57 0.00 -0.55 0.00 0.00 41.25 38.43 2q5i s ASN 225 CO -0.00 -0.55 1.47 0.18 -2.79 0.00 0.00 177.10 175.41 2q5i n LEU 226 N 0.70 2.37 -4.76 3.21 4.77 -0.16 -4.91 117.00 118.22 2q5i n LEU 226 Ca 0.01 -0.81 -0.40 0.00 -0.03 0.00 0.00 56.01 54.78 2q5i n LEU 226 Cb 0.43 -0.02 -0.06 0.00 -2.33 0.00 0.00 43.42 41.44 2q5i n LEU 226 CO 0.58 0.41 0.50 -0.04 -1.33 0.00 0.00 177.39 177.50 2q5i s MET 227 N -1.97 4.57 0.05 3.23 -1.94 -1.26 0.15 119.30 122.13 2q5i s MET 227 Ca 0.33 1.17 -0.31 0.00 -1.71 0.00 0.00 55.69 55.17 2q5i s MET 227 Cb 0.20 -3.30 -0.06 0.00 2.01 0.00 0.00 34.83 33.68 2q5i s MET 227 CO 0.31 0.46 1.35 -0.06 -0.01 0.00 0.00 175.02 177.07 2q5i s PHE 228 N -0.74 3.13 -0.01 -0.03 0.08 -1.26 -4.85 117.98 114.29 2q5i s PHE 228 Ca 0.38 0.98 -0.04 0.00 0.12 0.00 0.00 56.93 58.36 2q5i s PHE 228 Cb -0.23 -3.61 -0.04 0.00 -0.57 0.00 0.00 43.02 38.57 2q5i s PHE 228 CO 0.26 -2.16 0.20 0.21 -0.10 0.00 0.00 175.22 173.63 2q5i s LYS 229 N 1.63 3.47 0.16 0.44 2.20 -1.26 -2.14 119.74 124.24 2q5i s LYS 229 Ca 0.63 -0.25 -0.01 0.00 -0.36 0.00 0.00 55.97 55.98 2q5i s LYS 229 Cb -0.33 -3.10 0.01 0.00 -1.51 0.00 0.00 37.83 32.90 2q5i s LYS 229 CO 0.28 0.68 0.23 0.25 -0.36 0.00 0.00 175.35 176.43 2q5i n THR 230 N 1.06 0.00 -4.36 3.43 -2.24 -0.53 -4.96 114.28 106.69 2q5i n THR 230 Ca -0.12 -0.77 -0.26 0.00 -2.27 0.00 0.00 64.05 60.64 2q5i n THR 230 Cb 0.53 0.49 -0.17 0.00 -2.10 0.00 0.00 70.33 69.08 2q5i n THR 230 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2q5i s PHE 231 N -4.23 1.54 -0.10 4.78 0.40 -1.26 -1.35 117.98 117.76 2q5i s PHE 231 Ca 0.13 -0.66 -0.20 0.00 -0.60 0.00 0.00 56.93 55.59 2q5i s PHE 231 Cb -0.01 -1.17 -0.04 0.00 0.51 0.00 0.00 43.02 42.31 2q5i s PHE 231 CO 0.09 -0.38 0.57 0.42 0.70 0.00 0.00 175.22 176.62 2q5i s ILE 232 N 1.03 5.13 0.08 0.64 1.01 -0.20 -4.90 121.20 123.99 2q5i s ILE 232 Ca -0.07 1.16 0.00 0.00 0.00 0.00 0.00 60.65 61.73 2q5i s ILE 232 Cb -0.15 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.41 2q5i s ILE 232 CO -0.01 0.29 0.00 0.61 0.00 0.00 0.00 174.94 175.84 2q5i n GLY 233 N 3.20 -2.17 3.92 6.18 0.00 -1.26 -4.37 105.19 110.69 2q5i n GLY 233 Ca -0.05 -1.44 -0.27 0.00 0.00 0.00 0.00 46.02 44.27 2q5i n GLY 233 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2q5i s PRO 234 N -1.28 2.09 4.66 1.61 0.04 -1.26 -4.84 135.00 136.01 2q5i s PRO 234 Ca 0.00 -0.11 0.00 0.00 0.04 0.00 0.00 61.00 60.93 2q5i s PRO 234 Cb 0.00 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2q5i s PRO 234 CO 0.00 -1.39 0.00 0.41 0.04 0.00 0.00 177.00 176.06 2q5i n GLY 235 N -3.09 0.76 2.43 0.56 0.00 -1.26 -4.55 105.19 100.04 2q5i n GLY 235 Ca 0.08 -0.81 -0.02 0.00 0.00 0.00 0.00 46.02 45.27 2q5i n GLY 235 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2q5i n GLY 236 N 0.00 1.68 0.01 -0.02 0.00 -1.26 -4.97 105.19 100.63 2q5i n GLY 236 Ca 0.00 -0.14 0.10 0.00 0.00 0.00 0.00 46.02 45.98 2q5i n GLY 236 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2q5i n ASN 237 N -1.30 0.32 -4.04 1.61 0.23 -1.26 -4.60 115.26 106.22 2q5i n ASN 237 Ca -0.17 -0.03 -0.33 0.00 -0.53 0.00 0.00 54.58 53.51 2q5i n ASN 237 Cb 0.83 1.91 -0.08 0.00 -2.08 0.00 0.00 39.78 40.36 2q5i n ASN 237 CO 0.00 0.00 0.00 0.80 -0.93 0.00 0.00 177.26 177.13 2q5i n MET 238 N -2.19 2.40 -2.32 -3.83 0.00 -1.26 -5.08 117.12 104.85 2q5i n MET 238 Ca -0.03 -4.49 -0.35 0.00 0.00 0.00 0.00 57.70 52.83 2q5i n MET 238 Cb 0.53 -2.37 -0.01 0.00 0.00 0.00 0.00 33.22 31.37 2q5i n MET 238 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 2q5i s PRO 239 N -1.44 3.46 0.12 2.12 0.04 -1.26 -1.03 135.00 137.00 2q5i s PRO 239 Ca 0.27 1.53 -0.03 0.00 0.04 0.00 0.00 61.00 62.81 2q5i s PRO 239 Cb -0.06 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.47 2q5i s PRO 239 CO -0.14 -0.75 0.20 0.41 0.04 0.00 0.00 177.00 176.77 2q5i n GLY 240 N 0.00 2.26 3.15 0.56 0.00 -0.46 -1.37 105.19 109.33 2q5i n GLY 240 Ca 0.11 -1.28 -0.08 0.00 0.00 0.00 0.00 46.02 44.77 2q5i n GLY 240 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2q5i s TYR 241 N -5.53 0.47 0.05 1.61 2.02 0.63 -1.45 117.35 115.15 2q5i s TYR 241 Ca 0.07 -0.94 -0.29 0.00 -0.37 0.00 0.00 57.07 55.54 2q5i s TYR 241 Cb -0.01 -0.29 -0.05 0.00 -0.40 0.00 0.00 41.96 41.21 2q5i s TYR 241 CO 0.05 -0.47 0.95 -0.51 -1.57 0.00 0.00 175.55 174.00 2q5i s LEU 242 N -2.93 4.43 0.27 -1.29 1.43 -0.91 -0.75 118.68 118.94 2q5i s LEU 242 Ca 0.10 1.69 -0.30 0.00 -1.03 0.00 0.00 54.13 54.59 2q5i s LEU 242 Cb 0.07 -3.54 -0.12 0.00 0.03 0.00 0.00 46.19 42.63 2q5i s LEU 242 CO -0.08 -0.14 1.54 -2.11 0.23 0.00 0.00 176.35 175.79 2q5i n ARG 243 N 3.29 2.49 0.00 1.70 1.85 -0.16 -4.53 116.66 121.29 2q5i n ARG 243 Ca 0.03 0.88 0.13 0.00 -1.00 0.00 0.00 57.85 57.90 2q5i n ARG 243 Cb 0.50 -2.63 0.48 0.00 -1.05 0.00 0.00 32.46 29.76 2q5i n ARG 243 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 2q5i n PRO 244 N 2.15 0.08 -3.66 2.89 -0.04 -1.26 -1.49 135.00 133.67 2q5i n PRO 244 Ca 0.10 -0.03 -0.09 0.00 -0.04 0.00 0.00 63.50 63.44 2q5i n PRO 244 Cb 0.35 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.29 2q5i n PRO 244 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2q5i s GLU 245 N -2.94 1.55 -0.00 0.54 -1.05 -1.26 -4.55 118.70 110.99 2q5i s GLU 245 Ca 0.15 -0.75 0.21 0.00 -0.15 0.00 0.00 54.97 54.43 2q5i s GLU 245 Cb 0.19 0.60 -0.19 0.00 -0.44 0.00 0.00 34.13 34.29 2q5i s GLU 245 CO 0.59 -0.70 0.93 0.25 0.95 0.00 0.00 175.26 177.28 2q5i n THR 246 N -0.42 0.00 -0.29 1.83 -2.24 -1.26 -4.53 114.28 107.37 2q5i n THR 246 Ca -0.10 -0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.72 2q5i n THR 246 Cb 0.62 0.95 0.25 0.00 -2.10 0.00 0.00 70.33 70.05 2q5i n THR 246 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2q5i h ALA 247 N 3.00 1.54 -0.37 6.98 0.00 -1.97 -2.72 119.26 125.71 2q5i h ALA 247 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2q5i h ALA 247 Cb 0.50 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2q5i h ALA 247 CO 0.00 0.32 0.09 1.96 0.00 0.00 0.00 179.25 181.63 2q5i h GLN 248 N 1.00 0.53 -0.79 0.00 1.08 -2.00 -1.56 115.11 113.37 2q5i h GLN 248 Ca 0.39 -0.08 -0.02 0.00 -1.45 0.00 0.00 58.65 57.49 2q5i h GLN 248 Cb 0.22 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.52 2q5i h GLN 248 CO -0.15 0.49 0.43 0.78 -0.95 0.00 0.00 178.83 179.43 2q5i h GLY 249 N 0.75 1.19 1.25 3.46 0.00 -1.79 0.62 103.07 108.54 2q5i h GLY 249 Ca 0.12 -0.55 -0.09 0.00 0.00 0.00 0.00 47.33 46.82 2q5i h GLY 249 CO -0.00 0.52 -0.03 -2.22 0.00 0.00 0.00 176.54 174.81 2q5i h ILE 250 N 1.10 1.26 -0.27 2.60 2.04 -1.35 -2.09 117.51 120.80 2q5i h ILE 250 Ca 0.28 -1.11 -0.05 0.00 1.00 0.00 0.00 64.86 64.98 2q5i h ILE 250 Cb 0.05 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 2q5i h ILE 250 CO -0.04 0.39 -0.02 -0.26 0.00 0.00 0.00 178.15 178.22 2q5i h PHE 251 N 0.83 0.55 -0.02 1.37 0.04 -0.85 -2.46 116.94 116.40 2q5i h PHE 251 Ca 0.15 -0.10 0.01 0.00 2.80 0.00 0.00 57.97 60.83 2q5i h PHE 251 Cb 0.53 -0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.54 2q5i h PHE 251 CO 0.03 0.66 0.02 -0.07 -0.60 0.00 0.00 178.31 178.35 2q5i h LEU 252 N 0.27 0.00 -3.38 1.54 3.38 -0.76 -1.23 115.31 115.13 2q5i h LEU 252 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2q5i h LEU 252 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2q5i h LEU 252 CO 0.02 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.14 2q5i n ASN 253 N -4.18 5.40 -0.20 -0.43 3.02 -0.80 -4.67 115.26 113.40 2q5i n ASN 253 Ca -0.03 -2.80 -0.06 0.00 -0.03 0.00 0.00 54.58 51.66 2q5i n ASN 253 Cb 0.11 -0.66 0.03 0.00 -0.61 0.00 0.00 39.78 38.65 2q5i n ASN 253 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 2q5i h PHE 254 N 3.92 0.73 0.14 3.10 3.57 -0.76 -1.28 116.94 126.36 2q5i h PHE 254 Ca 0.00 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 2q5i h PHE 254 Cb 1.83 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 40.32 2q5i h PHE 254 CO 1.00 0.47 -0.09 0.87 -2.23 0.00 0.00 178.31 178.33 2q5i h LYS 255 N 0.78 -0.21 -0.74 1.11 1.79 -1.83 0.17 116.57 117.64 2q5i h LYS 255 Ca 0.21 0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.72 2q5i h LYS 255 Cb -0.07 0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 30.59 2q5i h LYS 255 CO -0.04 -0.14 0.47 0.00 -1.08 0.00 0.00 179.45 178.66 2q5i h ARG 256 N -0.22 0.91 -0.51 3.15 3.08 -1.85 -0.03 114.38 118.92 2q5i h ARG 256 Ca -0.01 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 59.86 2q5i h ARG 256 Cb 0.19 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 2q5i h ARG 256 CO 0.01 0.60 -0.15 -0.07 -1.07 0.00 0.00 179.97 179.29 2q5i h LEU 257 N 0.94 1.01 -0.25 3.04 3.38 -1.08 0.83 115.31 123.18 2q5i h LEU 257 Ca 0.29 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 2q5i h LEU 257 Cb -0.03 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2q5i h LEU 257 CO -0.09 1.14 0.02 0.25 0.09 0.00 0.00 178.44 179.86 2q5i h LEU 258 N 0.88 0.41 -0.03 1.67 5.85 -0.52 -0.79 115.31 122.77 2q5i h LEU 258 Ca 0.13 -0.28 0.03 0.00 0.84 0.00 0.00 57.88 58.59 2q5i h LEU 258 Cb 0.72 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 2q5i h LEU 258 CO 0.06 0.59 -0.13 -0.08 -0.34 0.00 0.00 178.44 178.53 2q5i h GLU 259 N 0.21 -0.20 -0.88 1.25 4.81 -0.95 0.22 114.58 119.05 2q5i h GLU 259 Ca 0.07 0.01 0.23 0.00 -0.13 0.00 0.00 59.36 59.54 2q5i h GLU 259 Cb 0.36 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.74 2q5i h GLU 259 CO 0.01 -0.13 0.60 0.35 -0.73 0.00 0.00 179.01 179.11 2q5i h PHE 260 N -0.20 0.28 -0.50 0.92 3.57 -0.61 0.24 116.94 120.64 2q5i h PHE 260 Ca 0.06 0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.39 2q5i h PHE 260 Cb 0.28 -0.09 -0.10 0.00 2.79 0.00 0.00 35.95 38.83 2q5i h PHE 260 CO -0.20 0.07 0.22 -1.71 -2.23 0.00 0.00 178.31 174.45 2q5i n ASN 261 N -4.41 3.72 -2.71 0.41 2.85 -0.32 -4.90 115.26 109.91 2q5i n ASN 261 Ca 0.19 -2.81 -0.21 0.00 -0.11 0.00 0.00 54.58 51.64 2q5i n ASN 261 Cb 0.81 -0.67 0.01 0.00 1.24 0.00 0.00 39.78 41.17 2q5i n ASN 261 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2q5i n GLN 262 N -0.09 -3.11 -0.85 1.20 1.13 0.85 -2.10 117.38 114.41 2q5i n GLN 262 Ca 0.28 0.89 0.00 0.00 -1.94 0.00 0.00 57.00 56.23 2q5i n GLN 262 Cb 1.06 -5.63 0.00 0.00 0.11 0.00 0.00 30.24 25.78 2q5i n GLN 262 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2q5i n GLY 263 N -1.20 0.30 3.91 1.08 0.00 0.71 -4.97 105.19 105.02 2q5i n GLY 263 Ca -0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 2q5i n GLY 263 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2q5i s LYS 264 N -0.90 3.59 0.03 1.61 2.47 -0.89 -4.69 119.74 120.96 2q5i s LYS 264 Ca 0.00 -0.11 0.04 0.00 -1.56 0.00 0.00 55.97 54.33 2q5i s LYS 264 Cb 0.00 -2.70 -0.02 0.00 -1.46 0.00 0.00 37.83 33.65 2q5i s LYS 264 CO 0.00 0.25 -0.11 -1.17 0.16 0.00 0.00 175.35 174.49 2q5i s LEU 265 N -3.56 2.16 0.71 5.43 2.96 -1.26 -4.59 118.68 120.53 2q5i s LEU 265 Ca 0.42 -0.41 -0.11 0.00 -0.22 0.00 0.00 54.13 53.81 2q5i s LEU 265 Cb -0.11 -0.44 0.02 0.00 0.50 0.00 0.00 46.19 46.17 2q5i s LEU 265 CO 0.30 -0.02 1.09 -2.16 -1.32 0.00 0.00 176.35 174.24 2q5i s PRO 266 N -1.06 2.71 0.15 0.98 0.04 -1.26 -4.94 135.00 131.62 2q5i s PRO 266 Ca -0.01 0.35 -0.19 0.00 0.04 0.00 0.00 61.00 61.19 2q5i s PRO 266 Cb -0.07 -2.04 0.04 0.00 0.04 0.00 0.00 34.50 32.47 2q5i s PRO 266 CO 0.01 -1.10 0.49 -0.59 0.04 0.00 0.00 177.00 175.85 2q5i s PHE 267 N -3.36 -0.29 0.04 0.56 -0.12 -1.00 -5.03 117.98 108.78 2q5i s PHE 267 Ca 0.58 -0.00 0.05 0.00 -0.05 0.00 0.00 56.93 57.51 2q5i s PHE 267 Cb -0.11 0.39 -0.02 0.00 -0.63 0.00 0.00 43.02 42.65 2q5i s PHE 267 CO 0.51 -0.80 -0.14 0.00 -0.05 0.00 0.00 175.22 174.73 2q5i s ALA 268 N -3.80 1.18 0.16 1.99 0.00 -1.26 -0.72 121.76 119.29 2q5i s ALA 268 Ca 0.04 -0.83 0.09 0.00 0.00 0.00 0.00 51.96 51.25 2q5i s ALA 268 Cb 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.90 2q5i s ALA 268 CO -0.10 0.22 -0.19 0.00 0.00 0.00 0.00 175.76 175.69 2q5i s ALA 269 N -0.86 2.02 0.02 0.00 0.00 -0.58 -0.36 121.76 122.01 2q5i s ALA 269 Ca 0.01 -1.47 -0.03 0.00 0.00 0.00 0.00 51.96 50.48 2q5i s ALA 269 Cb -0.08 -0.21 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 2q5i s ALA 269 CO 0.01 0.27 0.03 0.00 0.00 0.00 0.00 175.76 176.08 2q5i s ALA 270 N -1.88 0.02 -0.01 0.00 0.00 -0.25 -0.50 121.76 119.13 2q5i s ALA 270 Ca 0.15 -0.54 0.04 0.00 0.00 0.00 0.00 51.96 51.61 2q5i s ALA 270 Cb -0.07 0.17 -0.01 0.00 0.00 0.00 0.00 23.12 23.22 2q5i s ALA 270 CO 0.06 -0.22 -0.14 -0.65 0.00 0.00 0.00 175.76 174.81 2q5i s GLN 271 N -1.90 1.18 -0.28 0.00 -0.21 -0.75 -1.22 119.66 116.48 2q5i s GLN 271 Ca -0.11 -0.50 -0.00 0.00 0.02 0.00 0.00 55.36 54.76 2q5i s GLN 271 Cb -0.06 -1.13 0.05 0.00 1.00 0.00 0.00 33.01 32.87 2q5i s GLN 271 CO -0.02 0.29 -0.05 0.42 -2.12 0.00 0.00 175.29 173.82 2q5i s ILE 272 N -0.28 2.74 0.11 1.08 1.09 -1.26 -1.40 121.20 123.27 2q5i s ILE 272 Ca 0.04 -1.37 -0.24 0.00 -1.10 0.00 0.00 60.65 57.98 2q5i s ILE 272 Cb -0.06 -2.54 0.08 0.00 -1.06 0.00 0.00 42.46 38.89 2q5i s ILE 272 CO -0.00 -0.01 1.13 0.61 -0.10 0.00 0.00 174.94 176.56 2q5i n GLY 273 N 4.58 0.45 3.86 6.18 0.00 -0.32 -4.97 105.19 114.97 2q5i n GLY 273 Ca -0.14 -1.11 -0.36 0.00 0.00 0.00 0.00 46.02 44.41 2q5i n GLY 273 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2q5i s ASN 274 N -3.61 6.69 0.27 1.61 0.01 -1.26 0.34 114.94 118.99 2q5i s ASN 274 Ca 0.26 0.85 0.03 0.00 -0.71 0.00 0.00 52.86 53.29 2q5i s ASN 274 Cb -0.02 -2.20 -0.06 0.00 0.41 0.00 0.00 41.25 39.38 2q5i s ASN 274 CO 0.03 0.22 0.03 -0.44 -1.51 0.00 0.00 177.10 175.43 2q5i s SER 275 N -1.54 1.97 0.01 -1.22 0.01 -0.44 -4.91 113.70 107.59 2q5i s SER 275 Ca 0.30 -1.29 0.02 0.00 1.31 0.00 0.00 55.95 56.29 2q5i s SER 275 Cb -0.15 -0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.06 2q5i s SER 275 CO 0.16 -0.56 -0.06 -0.36 0.41 0.00 0.00 173.24 172.83 2q5i s PHE 276 N -3.40 0.56 -0.25 2.43 0.40 -0.55 -2.16 117.98 115.01 2q5i s PHE 276 Ca 0.32 -0.24 -0.02 0.00 -0.60 0.00 0.00 56.93 56.39 2q5i s PHE 276 Cb 0.07 -0.35 0.12 0.00 0.51 0.00 0.00 43.02 43.37 2q5i s PHE 276 CO 0.12 -0.03 0.28 0.50 0.70 0.00 0.00 175.22 176.78 2q5i s ARG 277 N -0.65 0.28 -1.17 0.44 3.52 -0.43 -4.10 118.95 116.83 2q5i s ARG 277 Ca -0.02 0.09 -0.19 0.00 -0.13 0.00 0.00 55.73 55.47 2q5i s ARG 277 Cb -0.05 -0.84 -0.04 0.00 -1.56 0.00 0.00 34.95 32.46 2q5i s ARG 277 CO 0.00 -0.83 1.95 -1.71 -0.81 0.00 0.00 175.30 173.89 2q5i n ASN 278 N 5.32 3.58 -4.77 -2.12 5.15 0.39 -4.22 115.26 118.59 2q5i n ASN 278 Ca -0.04 -2.78 -0.41 0.00 -0.60 0.00 0.00 54.58 50.76 2q5i n ASN 278 Cb 0.48 -1.56 -0.00 0.00 -0.53 0.00 0.00 39.78 38.17 2q5i n ASN 278 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2q5i s GLU 279 N 4.81 4.06 0.08 1.20 2.56 -1.26 -4.75 118.70 125.40 2q5i s GLU 279 Ca 0.57 2.44 -0.29 0.00 0.00 0.00 0.00 54.97 57.70 2q5i s GLU 279 Cb 0.08 -2.91 -0.17 0.00 2.00 0.00 0.00 34.13 33.12 2q5i s GLU 279 CO 0.07 -0.52 1.66 0.82 -0.56 0.00 0.00 175.26 176.73 2q5i h ILE 280 N 2.82 0.63 -1.79 -3.70 5.03 -1.99 -3.41 117.51 115.10 2q5i h ILE 280 Ca -0.50 -0.02 -0.37 0.00 -0.12 0.00 0.00 64.86 63.84 2q5i h ILE 280 Cb 1.24 0.64 -0.29 0.00 -3.03 0.00 0.00 36.82 35.39 2q5i h ILE 280 CO 0.64 0.00 -0.72 -0.44 -0.68 0.00 0.00 178.15 176.95 2q5i s SER 281 N -4.75 0.43 0.01 1.72 0.01 -1.26 -5.02 113.70 104.84 2q5i s SER 281 Ca -0.16 -2.08 -0.30 0.00 1.31 0.00 0.00 55.95 54.72 2q5i s SER 281 Cb 0.04 0.66 -0.05 0.00 0.21 0.00 0.00 66.02 66.88 2q5i s SER 281 CO 0.63 -0.17 1.31 -2.16 0.41 0.00 0.00 173.24 173.26 2q5i s PRO 282 N 0.84 4.33 -0.10 12.44 0.04 -1.26 -4.90 135.00 146.40 2q5i s PRO 282 Ca 0.26 1.87 0.19 0.00 0.04 0.00 0.00 61.00 63.35 2q5i s PRO 282 Cb -0.05 -3.49 0.37 0.00 0.04 0.00 0.00 34.50 31.37 2q5i s PRO 282 CO -0.09 -0.46 1.16 0.54 0.04 0.00 0.00 177.00 178.19 2q5i n ARG 283 N 4.87 0.56 -2.27 4.56 1.74 -1.26 -4.48 116.66 120.39 2q5i n ARG 283 Ca 0.12 -2.10 -0.18 0.00 -0.77 0.00 0.00 57.85 54.91 2q5i n ARG 283 Cb 0.45 -0.26 0.03 0.00 -1.02 0.00 0.00 32.46 31.66 2q5i n ARG 283 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2q5i n SER 284 N -0.07 4.04 0.00 0.55 7.64 -1.26 -5.08 113.62 119.43 2q5i n SER 284 Ca -0.03 -3.32 0.00 0.00 1.01 0.00 0.00 58.87 56.53 2q5i n SER 284 Cb 0.95 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 2q5i n SER 284 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2q5i n GLY 285 N -0.64 2.23 0.21 0.23 0.00 -1.26 -1.82 105.19 104.13 2q5i n GLY 285 Ca 0.34 -0.27 0.15 0.00 0.00 0.00 0.00 46.02 46.24 2q5i n GLY 285 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2q5i h LEU 286 N 0.00 0.00 -0.31 0.99 3.38 -1.98 -3.19 115.31 114.20 2q5i h LEU 286 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2q5i h LEU 286 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2q5i h LEU 286 CO 0.00 0.00 0.02 0.40 0.09 0.00 0.00 178.44 178.95 2q5i h ILE 287 N 0.00 1.25 -3.51 1.22 5.03 -1.72 -3.38 117.51 116.39 2q5i h ILE 287 Ca 0.00 -0.89 -0.70 0.00 -0.12 0.00 0.00 64.86 63.15 2q5i h ILE 287 Cb 0.18 1.23 -0.35 0.00 -3.03 0.00 0.00 36.82 34.85 2q5i h ILE 287 CO 0.00 0.29 -0.45 -0.13 -0.68 0.00 0.00 178.15 177.18 2q5i s ARG 288 N -5.07 2.30 0.26 2.37 1.81 -1.21 -4.95 118.95 114.46 2q5i s ARG 288 Ca -0.13 -2.18 0.11 0.00 -1.72 0.00 0.00 55.73 51.81 2q5i s ARG 288 Cb 0.08 -3.67 -0.05 0.00 -0.45 0.00 0.00 34.95 30.87 2q5i s ARG 288 CO 0.76 -1.13 -0.14 0.14 -0.68 0.00 0.00 175.30 174.25 2q5i s VAL 289 N 0.53 2.78 -0.59 3.52 -7.23 -1.26 -4.51 120.40 113.64 2q5i s VAL 289 Ca 0.13 -2.19 0.23 0.00 -1.81 0.00 0.00 61.98 58.33 2q5i s VAL 289 Cb -0.22 -2.45 -0.13 0.00 0.56 0.00 0.00 36.38 34.15 2q5i s VAL 289 CO -0.04 -0.35 0.99 0.54 -0.31 0.00 0.00 175.10 175.94 2q5i n ARG 290 N -0.57 0.30 -3.82 4.82 1.74 -0.06 -4.69 116.66 114.37 2q5i n ARG 290 Ca -0.06 -0.01 -0.14 0.00 -0.77 0.00 0.00 57.85 56.86 2q5i n ARG 290 Cb 0.59 -1.59 -0.15 0.00 -1.02 0.00 0.00 32.46 30.29 2q5i n ARG 290 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2q5i s GLU 291 N -3.21 0.02 -0.12 5.56 2.12 -1.26 -1.32 118.70 120.49 2q5i s GLU 291 Ca 0.03 0.12 -0.30 0.00 0.36 0.00 0.00 54.97 55.18 2q5i s GLU 291 Cb 0.14 -0.21 0.09 0.00 0.26 0.00 0.00 34.13 34.42 2q5i s GLU 291 CO 0.81 -0.11 0.80 -0.59 -0.54 0.00 0.00 175.26 175.63 2q5i s PHE 292 N 0.74 -0.57 -0.01 5.30 -0.71 -0.92 -4.90 117.98 116.90 2q5i s PHE 292 Ca -0.06 1.07 -0.23 0.00 -1.04 0.00 0.00 56.93 56.66 2q5i s PHE 292 Cb -0.09 0.40 -0.05 0.00 -1.21 0.00 0.00 43.02 42.08 2q5i s PHE 292 CO -0.02 -0.48 0.68 0.99 -1.34 0.00 0.00 175.22 175.05 2q5i s THR 293 N -0.91 4.91 0.18 -4.49 2.01 -1.26 -1.33 115.64 114.75 2q5i s THR 293 Ca -0.06 1.42 0.10 0.00 0.31 0.00 0.00 61.69 63.46 2q5i s THR 293 Cb -0.01 -4.02 -0.04 0.00 0.01 0.00 0.00 72.50 68.44 2q5i s THR 293 CO 0.05 0.34 -0.16 -0.04 -0.69 0.00 0.00 174.62 174.12 2q5i s MET 294 N 0.22 1.80 -0.22 4.92 -1.94 0.15 -2.96 119.30 121.28 2q5i s MET 294 Ca 0.35 -1.37 0.01 0.00 -1.71 0.00 0.00 55.69 52.98 2q5i s MET 294 Cb -0.19 -2.02 0.05 0.00 2.01 0.00 0.00 34.83 34.68 2q5i s MET 294 CO 0.19 0.42 -0.07 0.00 -0.01 0.00 0.00 175.02 175.55 2q5i s ALA 295 N -1.63 1.95 -0.03 3.03 0.00 -0.86 -1.17 121.76 123.05 2q5i s ALA 295 Ca 0.22 -1.27 0.06 0.00 0.00 0.00 0.00 51.96 50.98 2q5i s ALA 295 Cb -0.09 -1.36 -0.01 0.00 0.00 0.00 0.00 23.12 21.66 2q5i s ALA 295 CO 0.12 -1.02 -0.22 -1.21 0.00 0.00 0.00 175.76 173.43 2q5i s GLU 296 N 1.41 1.99 -0.02 0.00 2.02 -0.50 -0.56 118.70 123.04 2q5i s GLU 296 Ca -0.04 -0.80 0.06 0.00 0.02 0.00 0.00 54.97 54.21 2q5i s GLU 296 Cb -0.18 -1.83 -0.03 0.00 0.10 0.00 0.00 34.13 32.20 2q5i s GLU 296 CO -0.07 0.43 -0.18 0.42 0.02 0.00 0.00 175.26 175.88 2q5i s ILE 297 N -0.37 2.74 -0.27 -1.63 1.01 0.05 -1.81 121.20 120.93 2q5i s ILE 297 Ca 0.04 -0.94 0.02 0.00 0.00 0.00 0.00 60.65 59.77 2q5i s ILE 297 Cb -0.10 -2.07 0.07 0.00 0.01 0.00 0.00 42.46 40.37 2q5i s ILE 297 CO 0.01 0.52 -0.04 -1.61 0.00 0.00 0.00 174.94 173.82 2q5i s GLU 298 N -0.89 1.68 -0.46 2.79 0.41 0.34 -3.16 118.70 119.41 2q5i s GLU 298 Ca 0.12 -1.25 -0.15 0.00 -0.41 0.00 0.00 54.97 53.29 2q5i s GLU 298 Cb -0.10 -2.73 0.07 0.00 -1.78 0.00 0.00 34.13 29.59 2q5i s GLU 298 CO 0.01 -0.68 0.37 -1.58 -0.49 0.00 0.00 175.26 172.89 2q5i s HIS 299 N 1.25 3.26 0.04 1.61 5.65 -0.28 -1.53 115.29 125.29 2q5i s HIS 299 Ca -0.02 -1.01 -0.22 0.00 0.25 0.00 0.00 55.06 54.05 2q5i s HIS 299 Cb -0.19 -3.13 -0.06 0.00 -1.18 0.00 0.00 32.58 28.02 2q5i s HIS 299 CO -0.08 -0.80 0.67 -0.06 -0.65 0.00 0.00 174.74 173.82 2q5i s PHE 300 N 1.61 3.74 -0.07 3.88 0.08 0.10 -1.77 117.98 125.56 2q5i s PHE 300 Ca 0.04 1.35 -0.09 0.00 0.12 0.00 0.00 56.93 58.35 2q5i s PHE 300 Cb -0.24 -2.68 0.02 0.00 -0.57 0.00 0.00 43.02 39.55 2q5i s PHE 300 CO 0.06 0.38 0.23 0.54 -0.10 0.00 0.00 175.22 176.33 2q5i s VAL 301 N -0.39 0.02 -0.01 -0.44 0.11 -0.68 -2.38 120.40 116.63 2q5i s VAL 301 Ca 0.34 -0.14 -0.30 0.00 -2.93 0.00 0.00 61.98 58.94 2q5i s VAL 301 Cb -0.20 -0.38 -0.06 0.00 -1.53 0.00 0.00 36.38 34.22 2q5i s VAL 301 CO 0.20 -0.08 1.47 -0.62 -3.33 0.00 0.00 175.10 172.75 2q5i s ASP 302 N -0.23 6.79 0.57 3.54 -1.08 -1.26 -1.03 116.67 123.96 2q5i s ASP 302 Ca -0.03 2.17 0.27 0.00 -0.52 0.00 0.00 52.55 54.43 2q5i s ASP 302 Cb -0.03 -2.56 1.57 0.00 -1.46 0.00 0.00 42.92 40.44 2q5i s ASP 302 CO 0.01 -0.78 2.09 1.55 0.52 0.00 0.00 175.17 178.55 2q5i h PRO 303 N 8.21 0.00 -0.07 4.34 0.13 -1.94 -1.20 132.00 141.46 2q5i h PRO 303 Ca -0.38 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.69 2q5i h PRO 303 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2q5i h PRO 303 CO 0.92 0.00 -0.19 0.66 -0.23 0.00 0.00 178.00 179.16 2q5i h SER 304 N 0.00 0.30 -1.34 1.44 4.64 -2.00 -3.32 113.55 113.27 2q5i h SER 304 Ca 0.11 -0.59 -0.64 0.00 -0.47 0.00 0.00 61.79 60.20 2q5i h SER 304 Cb 0.52 -0.09 -0.18 0.00 -0.31 0.00 0.00 62.40 62.34 2q5i h SER 304 CO -0.00 0.83 1.14 -0.62 -0.87 0.00 0.00 176.83 177.31 2q5i n GLU 305 N -4.55 3.40 -2.40 4.77 -0.58 -0.47 -4.81 120.64 116.00 2q5i n GLU 305 Ca -0.08 -3.07 -0.40 0.00 -0.42 0.00 0.00 57.16 53.19 2q5i n GLU 305 Cb 0.41 -2.34 0.01 0.00 -0.57 0.00 0.00 31.44 28.96 2q5i n GLU 305 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 2q5i n LYS 306 N 0.83 4.91 -3.88 3.49 4.81 -1.12 -4.55 118.16 122.65 2q5i n LYS 306 Ca 0.53 -4.23 -0.19 0.00 -0.87 0.00 0.00 58.31 53.55 2q5i n LYS 306 Cb 0.39 -2.47 -0.17 0.00 0.02 0.00 0.00 35.03 32.80 2q5i n LYS 306 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2q5i s ASP 307 N -0.91 0.81 -0.28 3.14 2.15 -1.26 -4.45 116.67 115.86 2q5i s ASP 307 Ca 0.44 -0.03 -0.20 0.00 0.43 0.00 0.00 52.55 53.19 2q5i s ASP 307 Cb 0.22 -0.28 -0.02 0.00 -0.30 0.00 0.00 42.92 42.55 2q5i s ASP 307 CO -0.16 -0.13 0.61 -2.28 -0.17 0.00 0.00 175.17 173.04 2q5i s HIS 308 N 1.35 3.25 0.44 -5.34 5.65 -1.26 -4.91 115.29 114.48 2q5i s HIS 308 Ca -0.05 0.68 0.19 0.00 0.25 0.00 0.00 55.06 56.14 2q5i s HIS 308 Cb -0.13 -2.88 1.15 0.00 -1.18 0.00 0.00 32.58 29.54 2q5i s HIS 308 CO -0.02 -0.38 1.88 -1.35 -0.65 0.00 0.00 174.74 174.22 2q5i h PRO 309 N 8.04 0.32 -0.48 2.88 0.11 -1.99 -1.10 132.00 139.79 2q5i h PRO 309 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2q5i h PRO 309 Cb 1.12 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2q5i h PRO 309 CO 0.77 0.21 0.00 1.63 -0.21 0.00 0.00 178.00 180.40 2q5i n LYS 310 N -4.46 2.17 -0.27 1.05 5.02 -1.26 -4.50 118.16 115.90 2q5i n LYS 310 Ca 0.17 -1.67 0.09 0.00 -2.02 0.00 0.00 58.31 54.89 2q5i n LYS 310 Cb 0.69 -1.40 0.33 0.00 -0.02 0.00 0.00 35.03 34.63 2q5i n LYS 310 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2q5i h PHE 311 N 2.65 0.89 0.00 2.13 3.57 -1.50 -1.32 116.94 123.36 2q5i h PHE 311 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2q5i h PHE 311 Cb 0.68 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.13 2q5i h PHE 311 CO 0.34 0.38 0.00 0.94 -2.23 0.00 0.00 178.31 177.73 2q5i n GLN 312 N -4.54 0.03 0.24 1.11 -0.06 -1.26 -0.94 117.38 111.96 2q5i n GLN 312 Ca 0.16 0.29 0.14 0.00 -2.00 0.00 0.00 57.00 55.59 2q5i n GLN 312 Cb 0.37 -1.50 0.47 0.00 -4.06 0.00 0.00 30.24 25.52 2q5i n GLN 312 CO 0.00 0.00 0.00 -0.91 -0.20 0.00 0.00 177.06 175.95 2q5i h ASN 313 N 0.00 0.00 0.00 1.69 -0.26 -1.59 -3.31 115.58 112.11 2q5i h ASN 313 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2q5i h ASN 313 Cb 0.16 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.42 2q5i h ASN 313 CO 0.00 0.07 0.00 1.33 -1.06 0.00 0.00 177.43 177.77 2q5i n VAL 314 N -3.16 0.00 0.22 2.81 0.24 -0.11 -4.77 118.33 113.55 2q5i n VAL 314 Ca 0.01 -0.48 0.12 0.00 -2.04 0.00 0.00 64.34 61.95 2q5i n VAL 314 Cb 0.41 1.02 0.71 0.00 -1.47 0.00 0.00 33.84 34.52 2q5i n VAL 314 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2q5i h ALA 315 N 0.00 1.99 -0.00 2.33 0.00 -1.55 -2.12 119.26 119.91 2q5i h ALA 315 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2q5i h ALA 315 Cb 0.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2q5i h ALA 315 CO 0.00 -0.14 -0.22 -0.25 0.00 0.00 0.00 179.25 178.64 2q5i n ASP 316 N -4.33 0.56 -4.76 0.00 8.00 -1.26 -0.30 116.55 114.46 2q5i n ASP 316 Ca -0.00 -0.46 -0.41 0.00 0.71 0.00 0.00 54.79 54.63 2q5i n ASP 316 Cb 0.20 -0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.28 2q5i n ASP 316 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2q5i s LEU 317 N -2.66 4.38 -0.29 0.64 1.43 -0.80 -4.76 118.68 116.63 2q5i s LEU 317 Ca 0.22 2.80 -0.06 0.00 -1.03 0.00 0.00 54.13 56.05 2q5i s LEU 317 Cb 0.19 -3.64 0.01 0.00 0.03 0.00 0.00 46.19 42.77 2q5i s LEU 317 CO 0.54 -0.70 0.07 -1.00 0.23 0.00 0.00 176.35 175.48 2q5i s HIS 318 N -0.69 3.14 0.03 0.29 3.76 -1.26 -0.40 115.29 120.15 2q5i s HIS 318 Ca 0.54 -1.00 -0.01 0.00 -0.15 0.00 0.00 55.06 54.45 2q5i s HIS 318 Cb -0.43 -2.24 -0.02 0.00 1.11 0.00 0.00 32.58 31.00 2q5i s HIS 318 CO 0.52 -0.58 -0.01 -0.48 -0.85 0.00 0.00 174.74 173.34 2q5i s LEU 319 N 1.49 2.23 -0.20 0.89 0.05 -0.43 -4.90 118.68 117.82 2q5i s LEU 319 Ca 0.03 -0.62 -0.29 0.00 0.05 0.00 0.00 54.13 53.30 2q5i s LEU 319 Cb -0.17 0.19 -0.02 0.00 -2.05 0.00 0.00 46.19 44.14 2q5i s LEU 319 CO 0.02 -0.40 1.43 -0.31 -0.55 0.00 0.00 176.35 176.54 2q5i s TYR 320 N -2.17 2.47 -0.07 3.48 1.51 -1.26 -1.51 117.35 119.80 2q5i s TYR 320 Ca -0.09 0.72 0.01 0.00 -1.01 0.00 0.00 57.07 56.70 2q5i s TYR 320 Cb -0.05 -3.80 -0.03 0.00 -0.11 0.00 0.00 41.96 37.97 2q5i s TYR 320 CO -0.03 -2.37 -0.09 -0.51 -1.11 0.00 0.00 175.55 171.44 2q5i s LEU 321 N 4.27 3.06 -0.44 -1.29 1.43 0.21 -1.10 118.68 124.82 2q5i s LEU 321 Ca 0.63 -0.07 0.02 0.00 -1.03 0.00 0.00 54.13 53.67 2q5i s LEU 321 Cb -0.23 -1.66 0.13 0.00 0.03 0.00 0.00 46.19 44.46 2q5i s LEU 321 CO 0.23 0.35 0.23 -0.47 0.23 0.00 0.00 176.35 176.92 2q5i s TYR 322 N -0.72 2.15 0.87 0.29 5.04 0.91 -0.58 117.35 125.31 2q5i s TYR 322 Ca 0.11 -2.50 -0.11 0.00 -2.44 0.00 0.00 57.07 52.13 2q5i s TYR 322 Cb -0.11 -2.02 0.12 0.00 0.35 0.00 0.00 41.96 40.30 2q5i s TYR 322 CO 0.01 -0.78 1.09 -1.54 -1.34 0.00 0.00 175.55 172.99 2q5i s SER 323 N 0.34 3.62 0.34 4.32 1.04 -1.26 -1.39 113.70 120.70 2q5i s SER 323 Ca 0.17 1.64 0.04 0.00 0.48 0.00 0.00 55.95 58.28 2q5i s SER 323 Cb -0.24 -2.31 0.60 0.00 0.10 0.00 0.00 66.02 64.17 2q5i s SER 323 CO -0.01 -2.57 1.87 0.00 0.98 0.00 0.00 173.24 173.51 2q5i h ALA 324 N -1.50 1.36 -0.10 5.32 0.00 -1.82 -2.49 119.26 120.04 2q5i h ALA 324 Ca -0.48 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.21 2q5i h ALA 324 Cb 1.27 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 2q5i h ALA 324 CO 0.52 0.44 0.00 0.87 0.00 0.00 0.00 179.25 181.09 2q5i h LYS 325 N 0.50 0.17 -0.95 0.00 1.57 -1.94 -1.96 116.57 113.96 2q5i h LYS 325 Ca 0.11 -0.05 0.10 0.00 -1.87 0.00 0.00 60.65 58.94 2q5i h LYS 325 Cb 0.34 -0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.56 2q5i h LYS 325 CO 0.01 0.42 0.61 0.00 -0.57 0.00 0.00 179.45 179.92 2q5i h ALA 326 N 0.74 1.57 -0.39 3.86 0.00 -1.85 0.32 119.26 123.51 2q5i h ALA 326 Ca 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.78 2q5i h ALA 326 Cb 0.34 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2q5i h ALA 326 CO 0.00 0.23 -0.37 1.96 0.00 0.00 0.00 179.25 181.07 2q5i h GLN 327 N 0.97 0.94 -0.08 0.00 4.20 -1.41 0.18 115.11 119.90 2q5i h GLN 327 Ca 0.45 -0.49 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 2q5i h GLN 327 Cb 0.41 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.20 2q5i h GLN 327 CO -0.21 1.14 -0.09 0.28 -0.67 0.00 0.00 178.83 179.29 2q5i h VAL 328 N 0.77 1.37 0.00 -0.54 2.07 -0.45 -3.01 116.25 116.45 2q5i h VAL 328 Ca 0.07 -1.26 -0.00 0.00 0.82 0.00 0.00 66.70 66.33 2q5i h VAL 328 Cb 0.96 2.02 -0.00 0.00 -1.52 0.00 0.00 31.29 32.75 2q5i h VAL 328 CO 0.09 0.35 -0.00 0.77 0.02 0.00 0.00 177.57 178.80 2q5i h SER 329 N -0.22 0.00 -1.07 0.57 4.64 -0.47 -3.47 113.55 113.52 2q5i h SER 329 Ca 0.01 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.29 2q5i h SER 329 Cb 0.61 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.71 2q5i h SER 329 CO 0.02 0.00 -0.07 0.61 -0.87 0.00 0.00 176.83 176.52 2q5i n GLY 330 N 0.00 0.59 3.87 -0.77 0.00 0.32 -5.06 105.19 104.15 2q5i n GLY 330 Ca 0.00 -0.66 -0.22 0.00 0.00 0.00 0.00 46.02 45.14 2q5i n GLY 330 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2q5i s GLN 331 N -4.75 2.44 0.84 1.61 -2.07 0.36 -5.02 119.66 113.08 2q5i s GLN 331 Ca 0.04 -1.66 -0.13 0.00 -1.82 0.00 0.00 55.36 51.79 2q5i s GLN 331 Cb -0.02 -2.29 0.10 0.00 -1.09 0.00 0.00 33.01 29.71 2q5i s GLN 331 CO 0.05 -0.29 1.19 -1.12 -1.32 0.00 0.00 175.29 173.80 2q5i s SER 332 N -4.16 4.20 0.52 12.60 0.01 -1.26 -4.46 113.70 121.15 2q5i s SER 332 Ca 0.45 0.73 -0.20 0.00 1.31 0.00 0.00 55.95 58.24 2q5i s SER 332 Cb -0.02 -1.17 -0.07 0.00 0.21 0.00 0.00 66.02 64.98 2q5i s SER 332 CO 0.27 -2.10 1.12 0.00 0.41 0.00 0.00 173.24 172.94 2q5i s ALA 333 N -3.59 2.76 -0.09 1.44 0.00 -1.26 -4.93 121.76 116.09 2q5i s ALA 333 Ca 0.64 0.80 0.02 0.00 0.00 0.00 0.00 51.96 53.42 2q5i s ALA 333 Cb -0.10 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 19.65 2q5i s ALA 333 CO 0.50 -0.67 -0.14 1.03 0.00 0.00 0.00 175.76 176.48 2q5i s ARG 334 N -3.20 2.96 -0.46 0.00 0.52 0.25 -4.91 118.95 114.12 2q5i s ARG 334 Ca 0.71 -0.70 -0.26 0.00 -0.52 0.00 0.00 55.73 54.95 2q5i s ARG 334 Cb -0.23 -2.50 0.03 0.00 0.52 0.00 0.00 34.95 32.77 2q5i s ARG 334 CO 0.27 0.40 0.97 0.21 0.02 0.00 0.00 175.30 177.17 2q5i s LYS 335 N -0.15 3.61 0.22 3.54 2.20 -1.26 0.65 119.74 128.56 2q5i s LYS 335 Ca -0.01 0.30 0.11 0.00 -0.36 0.00 0.00 55.97 56.01 2q5i s LYS 335 Cb -0.14 -3.91 -0.05 0.00 -1.51 0.00 0.00 37.83 32.23 2q5i s LYS 335 CO 0.03 -1.23 -0.21 -1.64 -0.36 0.00 0.00 175.35 171.94 2q5i s MET 336 N 3.89 1.54 -0.01 4.03 -1.94 -0.57 -4.87 119.30 121.37 2q5i s MET 336 Ca 0.40 -1.61 -0.30 0.00 -1.71 0.00 0.00 55.69 52.47 2q5i s MET 336 Cb -0.10 -1.73 -0.04 0.00 2.01 0.00 0.00 34.83 34.97 2q5i s MET 336 CO 0.27 0.35 1.22 0.50 -0.01 0.00 0.00 175.02 177.35 2q5i s ARG 337 N -3.04 4.37 0.24 2.03 3.52 -1.26 -1.32 118.95 123.50 2q5i s ARG 337 Ca 0.24 1.74 -0.06 0.00 -0.13 0.00 0.00 55.73 57.51 2q5i s ARG 337 Cb -0.06 -3.48 0.43 0.00 -1.56 0.00 0.00 34.95 30.27 2q5i s ARG 337 CO 0.11 -0.39 1.68 1.25 -0.81 0.00 0.00 175.30 177.14 2q5i h LEU 338 N 7.71 -0.08 -0.35 -0.88 6.46 -0.65 0.80 115.31 128.32 2q5i h LEU 338 Ca -0.37 0.15 0.04 0.00 -0.12 0.00 0.00 57.88 57.58 2q5i h LEU 338 Cb 1.18 0.23 -0.04 0.00 -0.73 0.00 0.00 40.66 41.30 2q5i h LEU 338 CO 0.86 -0.07 0.12 1.23 -0.62 0.00 0.00 178.44 179.95 2q5i h GLY 339 N 0.22 0.43 0.96 3.75 0.00 -0.93 -2.39 103.07 105.12 2q5i h GLY 339 Ca 0.40 -0.07 0.01 0.00 0.00 0.00 0.00 47.33 47.67 2q5i h GLY 339 CO -0.53 0.03 0.33 -0.55 0.00 0.00 0.00 176.54 175.81 2q5i h ASP 340 N 0.26 0.55 -0.88 0.19 3.32 -1.16 -1.67 116.42 117.03 2q5i h ASP 340 Ca 0.16 -0.01 0.13 0.00 0.02 0.00 0.00 57.03 57.33 2q5i h ASP 340 Cb 0.13 -0.13 -0.09 0.00 0.22 0.00 0.00 39.33 39.47 2q5i h ASP 340 CO -0.16 0.40 0.50 0.00 -1.72 0.00 0.00 179.24 178.25 2q5i h ALA 341 N 1.20 1.33 -0.23 3.45 0.00 -0.83 0.84 119.26 125.02 2q5i h ALA 341 Ca 0.19 0.06 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 2q5i h ALA 341 Cb -0.05 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.65 2q5i h ALA 341 CO -0.06 0.03 -0.47 0.28 0.00 0.00 0.00 179.25 179.03 2q5i h VAL 342 N 0.76 1.31 -0.71 0.00 2.07 -0.97 -0.46 116.25 118.24 2q5i h VAL 342 Ca 0.46 -1.69 -0.04 0.00 0.82 0.00 0.00 66.70 66.26 2q5i h VAL 342 Cb 0.56 1.79 -0.03 0.00 -1.52 0.00 0.00 31.29 32.09 2q5i h VAL 342 CO -0.31 0.53 0.29 -0.33 0.02 0.00 0.00 177.57 177.77 2q5i h GLU 343 N 0.44 1.05 -0.00 1.57 4.39 -0.52 -2.80 114.58 118.72 2q5i h GLU 343 Ca 0.01 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.53 2q5i h GLU 343 Cb 1.08 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.55 2q5i h GLU 343 CO 0.10 0.85 -0.01 1.04 -1.16 0.00 0.00 179.01 179.84 2q5i n GLN 344 N -4.29 0.26 -0.10 2.33 6.02 0.22 -4.91 117.38 116.91 2q5i n GLN 344 Ca 0.06 -0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 2q5i n GLN 344 Cb 0.18 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.94 2q5i n GLN 344 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2q5i n GLY 345 N 1.37 0.62 0.13 1.08 0.00 -1.06 -4.97 105.19 102.35 2q5i n GLY 345 Ca 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.02 2q5i n GLY 345 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2q5i h VAL 346 N 0.00 1.20 -3.29 1.61 2.07 -1.34 -3.37 116.25 113.13 2q5i h VAL 346 Ca 0.00 -0.66 -0.59 0.00 0.82 0.00 0.00 66.70 66.27 2q5i h VAL 346 Cb 0.00 1.26 -0.11 0.00 -1.52 0.00 0.00 31.29 30.92 2q5i h VAL 346 CO 0.00 0.21 -0.39 -0.63 0.02 0.00 0.00 177.57 176.78 2q5i s ILE 347 N -5.30 5.34 0.21 4.57 1.09 -0.98 -5.00 121.20 121.14 2q5i s ILE 347 Ca -0.14 0.41 -0.09 0.00 -1.10 0.00 0.00 60.65 59.73 2q5i s ILE 347 Cb 0.07 -3.57 0.16 0.00 -1.06 0.00 0.00 42.46 38.06 2q5i s ILE 347 CO 0.72 0.40 1.85 -1.13 -0.10 0.00 0.00 174.94 176.68 2q5i h ASN 348 N 6.71 0.76 -5.15 3.58 -0.73 -1.90 -3.39 115.58 115.46 2q5i h ASN 348 Ca -0.41 0.00 -0.02 0.00 1.87 0.00 0.00 56.30 57.74 2q5i h ASN 348 Cb 1.16 -0.16 -0.08 0.00 0.27 0.00 0.00 38.32 39.50 2q5i h ASN 348 CO 0.76 0.53 -0.00 0.54 -0.37 0.00 0.00 177.43 178.88 2q5i s ASN 349 N -5.77 -0.16 0.10 1.15 2.20 -1.26 -5.00 114.94 106.19 2q5i s ASN 349 Ca -0.13 -0.76 0.27 0.00 -0.94 0.00 0.00 52.86 51.30 2q5i s ASN 349 Cb 0.16 0.62 1.01 0.00 -2.00 0.00 0.00 41.25 41.04 2q5i s ASN 349 CO 0.77 -1.17 1.82 0.35 -2.94 0.00 0.00 177.10 175.93 2q5i n THR 350 N -0.39 0.36 0.00 0.54 -2.24 -1.26 -1.03 114.28 110.26 2q5i n THR 350 Ca -0.04 -0.09 -0.09 0.00 -2.27 0.00 0.00 64.05 61.56 2q5i n THR 350 Cb 0.61 -0.61 -0.07 0.00 -2.10 0.00 0.00 70.33 68.16 2q5i n THR 350 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2q5i h VAL 351 N 0.00 0.90 -0.57 2.28 2.07 -1.91 0.60 116.25 119.62 2q5i h VAL 351 Ca 0.00 -1.39 0.08 0.00 0.82 0.00 0.00 66.70 66.20 2q5i h VAL 351 Cb 0.58 1.61 -0.06 0.00 -1.52 0.00 0.00 31.29 31.89 2q5i h VAL 351 CO 0.00 0.27 0.24 0.25 0.02 0.00 0.00 177.57 178.34 2q5i h LEU 352 N -0.92 0.27 -0.25 2.57 5.85 -1.94 -2.79 115.31 118.10 2q5i h LEU 352 Ca -0.01 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.80 2q5i h LEU 352 Cb 0.53 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 2q5i h LEU 352 CO 0.02 0.18 0.03 1.23 -0.34 0.00 0.00 178.44 179.56 2q5i h GLY 353 N 0.44 0.27 0.31 3.75 0.00 -1.12 -1.61 103.07 105.12 2q5i h GLY 353 Ca 0.27 -0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.65 2q5i h GLY 353 CO -0.25 -0.02 -0.19 -1.82 0.00 0.00 0.00 176.54 174.25 2q5i h TYR 354 N 0.12 -0.51 -0.45 5.60 3.20 -0.63 -2.10 116.97 122.21 2q5i h TYR 354 Ca 0.12 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.96 2q5i h TYR 354 Cb 0.13 0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.63 2q5i h TYR 354 CO -0.17 -0.27 0.03 0.74 -1.64 0.00 0.00 178.16 176.85 2q5i h PHE 355 N -0.22 0.75 -0.33 -3.82 -1.00 -1.27 -0.53 116.94 110.52 2q5i h PHE 355 Ca 0.12 -0.09 0.06 0.00 2.81 0.00 0.00 57.97 60.87 2q5i h PHE 355 Cb 0.39 -0.21 -0.06 0.00 3.61 0.00 0.00 35.95 39.68 2q5i h PHE 355 CO -0.33 0.69 -0.06 0.82 -1.61 0.00 0.00 178.31 177.82 2q5i h ILE 356 N 0.68 0.70 -0.41 -0.55 1.08 -0.82 0.37 117.51 118.56 2q5i h ILE 356 Ca 0.14 -0.01 -0.08 0.00 -0.39 0.00 0.00 64.86 64.52 2q5i h ILE 356 Cb 0.37 0.67 -0.02 0.00 -3.07 0.00 0.00 36.82 34.77 2q5i h ILE 356 CO 0.01 0.00 -0.08 1.23 -0.69 0.00 0.00 178.15 178.62 2q5i h GLY 357 N 0.03 0.75 1.12 5.37 0.00 -0.75 0.56 103.07 110.15 2q5i h GLY 357 Ca 0.16 -0.54 -0.15 0.00 0.00 0.00 0.00 47.33 46.80 2q5i h GLY 357 CO -0.32 0.49 -0.34 3.21 0.00 0.00 0.00 176.54 179.58 2q5i h ARG 358 N 0.64 0.94 -0.42 4.80 2.47 -0.58 -0.23 114.38 122.01 2q5i h ARG 358 Ca 0.12 -0.48 0.00 0.00 -1.26 0.00 0.00 59.98 58.36 2q5i h ARG 358 Cb 0.52 0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.83 2q5i h ARG 358 CO 0.03 1.14 0.27 0.82 0.56 0.00 0.00 179.97 182.79 2q5i h ILE 359 N 0.77 1.12 -0.12 2.04 2.04 -0.05 -0.80 117.51 122.50 2q5i h ILE 359 Ca 0.07 -0.22 0.03 0.00 1.00 0.00 0.00 64.86 65.74 2q5i h ILE 359 Cb 0.94 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 2q5i h ILE 359 CO 0.09 0.11 -0.05 0.22 0.00 0.00 0.00 178.15 178.52 2q5i h TYR 360 N 0.57 -0.10 -0.79 1.37 3.20 -0.65 -1.11 116.97 119.46 2q5i h TYR 360 Ca 0.15 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 2q5i h TYR 360 Cb -0.05 0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.25 2q5i h TYR 360 CO -0.04 -0.08 0.45 -0.07 -1.64 0.00 0.00 178.16 176.78 2q5i h LEU 361 N -0.03 0.98 -0.14 2.82 3.38 -0.90 -1.97 115.31 119.44 2q5i h LEU 361 Ca 0.07 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2q5i h LEU 361 Cb 0.12 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2q5i h LEU 361 CO -0.14 0.78 0.07 0.22 0.09 0.00 0.00 178.44 179.46 2q5i h TYR 362 N 1.09 0.21 -0.71 1.13 3.20 -0.75 -0.66 116.97 120.48 2q5i h TYR 362 Ca 0.28 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.07 2q5i h TYR 362 Cb 0.01 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.19 2q5i h TYR 362 CO 0.00 0.26 0.19 -0.07 -1.64 0.00 0.00 178.16 176.90 2q5i h LEU 363 N 0.10 1.06 -0.56 2.82 3.38 -1.09 -2.08 115.31 118.94 2q5i h LEU 363 Ca 0.05 -0.22 -0.16 0.00 0.09 0.00 0.00 57.88 57.64 2q5i h LEU 363 Cb 0.13 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2q5i h LEU 363 CO -0.01 1.01 -0.62 0.00 0.09 0.00 0.00 178.44 178.91 2q5i h THR 364 N 1.07 1.37 0.00 0.22 1.03 -1.30 -1.53 112.91 113.77 2q5i h THR 364 Ca 0.23 -1.98 -0.08 0.00 -0.01 0.00 0.00 66.41 64.56 2q5i h THR 364 Cb 0.35 1.98 -0.01 0.00 -1.07 0.00 0.00 68.15 69.39 2q5i h THR 364 CO -0.00 0.59 -0.38 0.50 -0.01 0.00 0.00 175.52 176.22 2q5i h LYS 365 N 0.26 0.00 -0.01 0.00 3.64 -0.76 -3.11 116.57 116.59 2q5i h LYS 365 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2q5i h LYS 365 Cb 1.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 2q5i h LYS 365 CO 0.10 0.38 -0.37 1.55 -2.27 0.00 0.00 179.45 178.84 2q5i n VAL 366 N -3.86 0.00 0.00 2.00 3.14 -0.82 -4.84 118.33 113.96 2q5i n VAL 366 Ca -0.01 -0.18 0.00 0.00 -2.96 0.00 0.00 64.34 61.19 2q5i n VAL 366 Cb 0.44 0.78 0.00 0.00 -1.06 0.00 0.00 33.84 34.01 2q5i n VAL 366 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2q5i n GLY 367 N 1.38 0.69 3.76 7.55 0.00 -1.08 -4.70 105.19 112.78 2q5i n GLY 367 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 2q5i n GLY 367 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2q5i s ILE 368 N -1.30 3.45 -0.08 -0.61 -1.09 -0.60 -4.67 121.20 116.30 2q5i s ILE 368 Ca 0.00 1.42 -0.25 0.00 -2.23 0.00 0.00 60.65 59.58 2q5i s ILE 368 Cb 0.00 -3.88 -0.03 0.00 -1.58 0.00 0.00 42.46 36.97 2q5i s ILE 368 CO 0.00 0.30 0.79 -0.44 -1.23 0.00 0.00 174.94 174.36 2q5i s SER 369 N -0.94 7.05 0.31 3.58 0.01 -1.26 -4.37 113.70 118.07 2q5i s SER 369 Ca 0.47 1.27 0.04 0.00 1.31 0.00 0.00 55.95 59.04 2q5i s SER 369 Cb -0.31 -2.45 0.65 0.00 0.21 0.00 0.00 66.02 64.11 2q5i s SER 369 CO 0.40 -0.23 1.85 -0.65 0.41 0.00 0.00 173.24 175.03 2q5i h PRO 370 N 6.94 0.86 0.00 12.44 0.11 -1.94 -0.92 132.00 149.50 2q5i h PRO 370 Ca -0.38 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2q5i h PRO 370 Cb 1.18 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.10 2q5i h PRO 370 CO 0.78 0.57 0.00 0.38 -0.21 0.00 0.00 178.00 179.52 2q5i h ASP 371 N 0.89 0.00 -0.54 -2.05 2.03 -2.02 -2.28 116.42 112.45 2q5i h ASP 371 Ca 0.47 0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 56.42 2q5i h ASP 371 Cb 0.55 0.00 -0.23 0.00 -0.83 0.00 0.00 39.33 38.82 2q5i h ASP 371 CO -0.24 0.00 -0.24 0.29 -1.03 0.00 0.00 179.24 178.02 2q5i n LYS 372 N -2.98 2.51 -4.20 4.15 5.02 -0.37 -4.98 118.16 117.31 2q5i n LYS 372 Ca -0.01 -3.54 -0.19 0.00 -2.02 0.00 0.00 58.31 52.55 2q5i n LYS 372 Cb 0.21 -2.02 -0.16 0.00 -0.02 0.00 0.00 35.03 33.05 2q5i n LYS 372 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2q5i s LEU 373 N -3.45 1.51 0.08 -0.35 2.96 -0.86 -1.21 118.68 117.36 2q5i s LEU 373 Ca 0.49 -0.13 -0.09 0.00 -0.22 0.00 0.00 54.13 54.18 2q5i s LEU 373 Cb 0.42 -0.44 0.00 0.00 0.50 0.00 0.00 46.19 46.67 2q5i s LEU 373 CO 0.00 -0.02 0.20 0.00 -1.32 0.00 0.00 176.35 175.22 2q5i s ARG 374 N 0.64 0.84 -0.21 1.98 1.70 -0.33 -4.44 118.95 119.12 2q5i s ARG 374 Ca -0.09 -0.91 -0.03 0.00 -0.47 0.00 0.00 55.73 54.24 2q5i s ARG 374 Cb -0.12 0.34 -0.00 0.00 -0.57 0.00 0.00 34.95 34.60 2q5i s ARG 374 CO 0.00 -0.27 -0.08 -0.06 -1.08 0.00 0.00 175.30 173.82 2q5i s PHE 375 N -3.70 2.92 -0.20 5.89 0.40 -0.26 -0.24 117.98 122.78 2q5i s PHE 375 Ca 0.04 -1.09 -0.05 0.00 -0.60 0.00 0.00 56.93 55.23 2q5i s PHE 375 Cb 0.04 -2.06 -0.02 0.00 0.51 0.00 0.00 43.02 41.49 2q5i s PHE 375 CO -0.10 -0.60 -0.01 0.50 0.70 0.00 0.00 175.22 175.71 2q5i s ARG 376 N 1.43 3.58 0.30 0.44 3.52 -0.02 -0.06 118.95 128.14 2q5i s ARG 376 Ca 0.06 -0.54 -0.28 0.00 -0.13 0.00 0.00 55.73 54.84 2q5i s ARG 376 Cb -0.14 -3.06 -0.09 0.00 -1.56 0.00 0.00 34.95 30.10 2q5i s ARG 376 CO -0.05 -0.01 1.03 -1.14 -0.81 0.00 0.00 175.30 174.32 2q5i s GLN 377 N 1.04 4.58 0.51 5.12 0.74 -0.48 -0.71 119.66 130.46 2q5i s GLN 377 Ca 0.02 1.60 -0.20 0.00 0.05 0.00 0.00 55.36 56.83 2q5i s GLN 377 Cb -0.14 -3.02 -0.07 0.00 1.10 0.00 0.00 33.01 30.88 2q5i s GLN 377 CO 0.01 0.22 1.10 -1.01 -0.55 0.00 0.00 175.29 175.06 2q5i s HIS 378 N -1.33 2.82 0.88 1.67 3.76 0.52 -4.27 115.29 119.33 2q5i s HIS 378 Ca 0.47 1.56 -0.13 0.00 -0.15 0.00 0.00 55.06 56.81 2q5i s HIS 378 Cb -0.27 -3.22 0.12 0.00 1.11 0.00 0.00 32.58 30.33 2q5i s HIS 378 CO 0.34 -1.29 1.19 -1.64 -0.85 0.00 0.00 174.74 172.49 2q5i s MET 379 N -3.19 1.39 0.17 1.40 1.00 -1.26 -4.62 119.30 114.18 2q5i s MET 379 Ca 0.70 0.06 -0.06 0.00 0.00 0.00 0.00 55.69 56.39 2q5i s MET 379 Cb -0.22 -1.89 0.04 0.00 0.00 0.00 0.00 34.83 32.77 2q5i s MET 379 CO 0.25 -1.99 1.46 0.93 0.00 0.00 0.00 175.02 175.68 2q5i h GLU 380 N -1.34 0.63 0.00 2.03 5.08 -1.96 -3.21 114.58 115.81 2q5i h GLU 380 Ca -0.47 -0.42 -0.00 0.00 -1.00 0.00 0.00 59.36 57.47 2q5i h GLU 380 Cb 1.31 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.62 2q5i h GLU 380 CO 0.59 1.04 -0.01 -2.95 -1.00 0.00 0.00 179.01 176.68 2q5i h ASN 381 N 0.48 0.00 0.17 1.42 -1.07 -2.02 -2.80 115.58 111.76 2q5i h ASN 381 Ca 0.00 0.00 -0.18 0.00 0.07 0.00 0.00 56.30 56.19 2q5i h ASN 381 Cb 1.15 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.40 2q5i h ASN 381 CO 0.11 0.01 -0.69 -0.33 0.07 0.00 0.00 177.43 176.60 2q5i h GLU 382 N 0.00 0.47 0.00 4.14 5.08 -1.95 -3.45 114.58 118.87 2q5i h GLU 382 Ca -0.00 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 2q5i h GLU 382 Cb 0.06 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2q5i h GLU 382 CO 0.00 0.99 0.00 0.00 -1.00 0.00 0.00 179.01 179.00 2q5i n MET 383 N -3.87 0.00 -1.86 2.33 0.00 -1.06 -5.10 117.12 107.55 2q5i n MET 383 Ca -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 57.70 57.55 2q5i n MET 383 Cb 0.69 0.00 0.01 0.00 0.00 0.00 0.00 33.22 33.92 2q5i n MET 383 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 2q5i n TYR 386 N -0.04 -0.72 -1.94 3.17 4.02 -1.26 -4.81 117.16 115.58 2q5i n TYR 386 Ca 0.00 0.30 0.00 0.00 -0.01 0.00 0.00 57.90 58.19 2q5i n TYR 386 Cb 0.00 -0.52 0.00 0.00 -0.02 0.00 0.00 39.34 38.80 2q5i n TYR 386 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2q5i n ALA 387 N -0.20 0.00 -3.54 -0.72 0.00 -1.26 -5.06 120.51 109.73 2q5i n ALA 387 Ca -0.03 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.33 2q5i n ALA 387 Cb 0.19 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.62 2q5i n ALA 387 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2q5i s ASP 389 N -2.20 6.19 -0.10 0.00 2.15 -0.93 -4.95 116.67 116.82 2q5i s ASP 389 Ca 0.05 -1.47 0.02 0.00 0.43 0.00 0.00 52.55 51.59 2q5i s ASP 389 Cb -0.01 -2.27 -0.01 0.00 -0.30 0.00 0.00 42.92 40.33 2q5i s ASP 389 CO -0.06 -0.99 -0.18 0.00 -0.17 0.00 0.00 175.17 173.76 2q5i s TRP 391 N 0.19 2.71 -0.20 0.00 0.52 -0.80 -0.36 118.94 121.00 2q5i s TRP 391 Ca -0.11 -1.39 -0.09 0.00 0.02 0.00 0.00 56.10 54.53 2q5i s TRP 391 Cb -0.16 -1.85 -0.05 0.00 -1.15 0.00 0.00 33.47 30.26 2q5i s TRP 391 CO 0.06 -0.65 0.10 -0.51 0.02 0.00 0.00 176.95 175.97 2q5i s ASP 392 N 0.95 5.92 0.02 2.95 -0.00 0.11 -0.99 116.67 125.63 2q5i s ASP 392 Ca -0.04 0.14 -0.30 0.00 -0.00 0.00 0.00 52.55 52.35 2q5i s ASP 392 Cb -0.15 -2.03 -0.06 0.00 -0.00 0.00 0.00 42.92 40.67 2q5i s ASP 392 CO -0.05 0.16 1.49 0.00 -0.00 0.00 0.00 175.17 176.77 2q5i s ALA 393 N 0.50 3.62 -0.02 5.23 0.00 0.13 -0.84 121.76 130.37 2q5i s ALA 393 Ca 0.06 1.00 0.05 0.00 0.00 0.00 0.00 51.96 53.06 2q5i s ALA 393 Cb -0.12 -3.63 -0.01 0.00 0.00 0.00 0.00 23.12 19.36 2q5i s ALA 393 CO -0.00 -0.98 -0.16 -1.21 0.00 0.00 0.00 175.76 173.41 2q5i s GLU 394 N 2.49 1.39 0.06 0.00 2.02 0.67 -0.74 118.70 124.59 2q5i s GLU 394 Ca 0.67 -0.55 0.05 0.00 0.02 0.00 0.00 54.97 55.16 2q5i s GLU 394 Cb -0.34 -1.30 -0.04 0.00 0.10 0.00 0.00 34.13 32.55 2q5i s GLU 394 CO 0.28 0.29 -0.08 -1.54 0.02 0.00 0.00 175.26 174.24 2q5i s SER 395 N -0.21 4.51 -0.30 -0.19 1.04 -0.49 -1.19 113.70 116.88 2q5i s SER 395 Ca 0.03 -0.28 -0.23 0.00 0.48 0.00 0.00 55.95 55.95 2q5i s SER 395 Cb -0.08 -0.95 -0.00 0.00 0.10 0.00 0.00 66.02 65.09 2q5i s SER 395 CO 0.00 0.22 0.79 -0.75 0.98 0.00 0.00 173.24 174.48 2q5i s LYS 396 N -1.87 3.99 0.38 4.02 2.36 -0.35 -1.55 119.74 126.72 2q5i s LYS 396 Ca 0.20 0.63 0.03 0.00 -2.55 0.00 0.00 55.97 54.28 2q5i s LYS 396 Cb -0.11 -3.72 -0.01 0.00 -1.05 0.00 0.00 37.83 32.94 2q5i s LYS 396 CO 0.11 -0.65 0.12 0.25 1.55 0.00 0.00 175.35 176.73 2q5i n THR 397 N 5.49 0.00 0.31 3.43 -2.24 -0.56 -4.96 114.28 115.75 2q5i n THR 397 Ca 0.04 -2.18 0.17 0.00 -2.27 0.00 0.00 64.05 59.80 2q5i n THR 397 Cb 0.48 0.75 0.71 0.00 -2.10 0.00 0.00 70.33 70.17 2q5i n THR 397 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2q5i h SER 398 N 1.46 0.00 -0.29 3.42 4.64 -1.96 -0.29 113.55 120.53 2q5i h SER 398 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 2q5i h SER 398 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2q5i h SER 398 CO 0.48 0.00 0.00 -1.22 -0.87 0.00 0.00 176.83 175.22 2q5i n TYR 399 N -2.85 0.38 -2.09 4.77 4.02 -1.26 -5.06 117.16 115.07 2q5i n TYR 399 Ca 0.00 -0.19 0.00 0.00 -0.01 0.00 0.00 57.90 57.70 2q5i n TYR 399 Cb 0.24 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.56 2q5i n TYR 399 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2q5i n GLY 400 N 1.09 -1.85 3.68 2.72 0.00 -0.12 -4.86 105.19 105.86 2q5i n GLY 400 Ca 0.13 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 44.02 2q5i n GLY 400 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2q5i s TRP 401 N 0.00 2.64 0.02 1.61 0.52 -1.26 -1.49 118.94 120.98 2q5i s TRP 401 Ca 0.00 0.63 0.05 0.00 0.02 0.00 0.00 56.10 56.80 2q5i s TRP 401 Cb 0.00 -3.76 -0.02 0.00 -1.15 0.00 0.00 33.47 28.55 2q5i s TRP 401 CO 0.00 -2.92 -0.15 0.96 0.02 0.00 0.00 176.95 174.86 2q5i s ILE 402 N 2.72 1.21 0.16 2.03 -4.36 -0.59 -4.93 121.20 117.43 2q5i s ILE 402 Ca 0.67 -0.84 -0.30 0.00 -0.26 0.00 0.00 60.65 59.91 2q5i s ILE 402 Cb -0.33 -1.05 -0.07 0.00 1.25 0.00 0.00 42.46 42.26 2q5i s ILE 402 CO 0.28 0.19 1.18 -1.83 0.24 0.00 0.00 174.94 174.99 2q5i s GLU 403 N -0.76 4.50 0.00 0.37 -1.05 -1.26 -1.40 118.70 119.11 2q5i s GLU 403 Ca 0.04 1.82 0.00 0.00 -0.15 0.00 0.00 54.97 56.68 2q5i s GLU 403 Cb -0.07 -3.27 0.00 0.00 -0.44 0.00 0.00 34.13 30.35 2q5i s GLU 403 CO 0.00 -0.09 0.00 0.44 0.95 0.00 0.00 175.26 176.57 2q5i n ILE 404 N 2.75 0.00 -3.69 1.83 -5.35 0.08 -4.96 119.36 110.03 2q5i n ILE 404 Ca 0.05 0.00 -0.18 0.00 -0.27 0.00 0.00 62.75 62.35 2q5i n ILE 404 Cb 0.45 0.06 -0.17 0.00 -1.74 0.00 0.00 39.64 38.24 2q5i n ILE 404 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2q5i s VAL 405 N -1.49 -0.13 0.32 7.28 1.01 -1.16 -1.37 120.40 124.87 2q5i s VAL 405 Ca 0.00 0.36 -0.12 0.00 0.00 0.00 0.00 61.98 62.23 2q5i s VAL 405 Cb 0.00 -0.17 -0.07 0.00 0.00 0.00 0.00 36.38 36.13 2q5i s VAL 405 CO 0.00 0.15 0.69 -0.83 0.00 0.00 0.00 175.10 175.11 2q5i s GLY 406 N 1.94 2.16 -0.37 4.51 0.00 0.31 0.22 107.32 116.09 2q5i s GLY 406 Ca 0.01 -0.15 0.03 0.00 0.00 0.00 0.00 44.72 44.61 2q5i s GLY 406 CO -0.04 0.03 0.36 0.00 0.00 0.00 0.00 173.10 173.45 2q5i s ALA 408 N 1.43 3.79 -0.24 0.00 0.00 -1.19 -1.91 121.76 123.64 2q5i s ALA 408 Ca 0.17 -0.45 -0.04 0.00 0.00 0.00 0.00 51.96 51.64 2q5i s ALA 408 Cb -0.16 -2.18 0.00 0.00 0.00 0.00 0.00 23.12 20.79 2q5i s ALA 408 CO -0.04 0.58 -0.03 0.34 0.00 0.00 0.00 175.76 176.61 2q5i s ASP 409 N -1.37 4.41 0.07 0.00 -1.08 -0.45 -0.12 116.67 118.13 2q5i s ASP 409 Ca 0.24 -0.54 0.06 0.00 -0.52 0.00 0.00 52.55 51.80 2q5i s ASP 409 Cb -0.14 -1.74 -0.03 0.00 -1.46 0.00 0.00 42.92 39.55 2q5i s ASP 409 CO 0.13 -0.07 -0.17 -0.13 0.52 0.00 0.00 175.17 175.45 2q5i s ARG 410 N 1.45 1.02 -0.14 4.34 0.52 -0.27 -2.20 118.95 123.67 2q5i s ARG 410 Ca 0.04 -0.96 -0.08 0.00 -0.52 0.00 0.00 55.73 54.21 2q5i s ARG 410 Cb -0.15 -1.12 -0.06 0.00 0.52 0.00 0.00 34.95 34.14 2q5i s ARG 410 CO -0.03 0.27 -0.20 0.43 0.02 0.00 0.00 175.30 175.79 2q5i n SER 411 N 1.46 1.16 -4.54 0.23 7.64 -1.26 -1.57 113.62 116.74 2q5i n SER 411 Ca -0.19 0.20 -0.34 0.00 1.01 0.00 0.00 58.87 59.54 2q5i n SER 411 Cb 0.54 -0.47 -0.11 0.00 -1.01 0.00 0.00 64.21 63.16 2q5i n SER 411 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2q5i n TYR 413 N 3.64 -0.07 0.13 0.00 0.18 -1.26 -4.76 117.16 115.01 2q5i n TYR 413 Ca -0.17 0.00 0.04 0.00 1.88 0.00 0.00 57.90 59.65 2q5i n TYR 413 Cb 0.52 0.00 0.47 0.00 -0.38 0.00 0.00 39.34 39.95 2q5i n TYR 413 CO 0.00 0.00 0.00 -0.44 -2.08 0.00 0.00 176.86 174.34 2q5i h ASP 414 N 0.00 0.22 -0.98 9.48 3.32 -1.96 -2.76 116.42 123.73 2q5i h ASP 414 Ca 0.00 -0.02 0.18 0.00 0.02 0.00 0.00 57.03 57.20 2q5i h ASP 414 Cb 0.00 -0.06 -0.09 0.00 0.22 0.00 0.00 39.33 39.40 2q5i h ASP 414 CO 0.00 0.26 0.61 0.25 -1.72 0.00 0.00 179.24 178.64 2q5i h LEU 415 N 0.24 0.74 -0.29 1.55 5.85 -1.96 -0.18 115.31 121.26 2q5i h LEU 415 Ca 0.06 0.08 -0.20 0.00 0.84 0.00 0.00 57.88 58.66 2q5i h LEU 415 Cb 0.16 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 2q5i h LEU 415 CO 0.00 0.30 -0.87 0.28 -0.34 0.00 0.00 178.44 177.81 2q5i h SER 416 N 0.74 0.27 -0.03 1.25 0.02 -1.82 -2.59 113.55 111.39 2q5i h SER 416 Ca 0.54 -0.22 -0.00 0.00 -0.84 0.00 0.00 61.79 61.27 2q5i h SER 416 Cb 0.87 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 63.32 2q5i h SER 416 CO -0.32 1.01 0.00 0.00 -1.14 0.00 0.00 176.83 176.39 2q5i h HIS 418 N -0.22 0.67 0.51 0.00 -0.00 -1.24 -0.53 115.15 114.33 2q5i h HIS 418 Ca 0.01 -0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.36 2q5i h HIS 418 Cb 0.29 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 27.47 2q5i h HIS 418 CO 0.02 0.46 -0.38 0.00 -0.00 0.00 0.00 177.93 178.03 2q5i h ALA 419 N 1.62 -0.91 0.00 2.45 0.00 -1.34 -1.68 119.26 119.39 2q5i h ALA 419 Ca 0.18 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 2q5i h ALA 419 Cb 0.00 0.51 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2q5i h ALA 419 CO -0.03 -1.03 -0.55 0.07 0.00 0.00 0.00 179.25 177.70 2q5i h ARG 420 N -0.87 0.00 -0.90 0.00 0.11 -1.42 0.12 114.38 111.41 2q5i h ARG 420 Ca -0.06 0.00 0.02 0.00 0.10 0.00 0.00 59.98 60.05 2q5i h ARG 420 Cb 0.74 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.77 2q5i h ARG 420 CO 0.01 0.55 0.59 0.00 0.10 0.00 0.00 179.97 181.23 2q5i h ALA 421 N 1.45 1.39 -0.00 0.08 0.00 -1.00 -3.23 119.26 117.95 2q5i h ALA 421 Ca -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2q5i h ALA 421 Cb 1.16 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2q5i h ALA 421 CO 0.07 0.54 -0.52 0.25 0.00 0.00 0.00 179.25 179.59 2q5i n THR 422 N -4.42 0.00 -2.21 0.00 -2.24 -0.64 -4.99 114.28 99.78 2q5i n THR 422 Ca 0.11 -0.24 -0.20 0.00 -2.27 0.00 0.00 64.05 61.45 2q5i n THR 422 Cb 0.06 1.07 -0.03 0.00 -2.10 0.00 0.00 70.33 69.33 2q5i n THR 422 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2q5i n LYS 423 N -0.88 -1.58 -3.94 -0.78 5.02 0.36 -5.00 118.16 111.35 2q5i n LYS 423 Ca 0.04 1.04 -0.35 0.00 -2.02 0.00 0.00 58.31 57.02 2q5i n LYS 423 Cb 0.25 -5.62 -0.14 0.00 -0.02 0.00 0.00 35.03 29.50 2q5i n LYS 423 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2q5i s VAL 424 N -2.96 3.05 -0.17 -0.18 1.01 -0.93 -5.02 120.40 115.20 2q5i s VAL 424 Ca 0.00 -0.79 -0.29 0.00 0.00 0.00 0.00 61.98 60.89 2q5i s VAL 424 Cb 0.00 -2.46 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 2q5i s VAL 424 CO 0.00 0.31 1.73 -2.16 0.00 0.00 0.00 175.10 174.98 2q5i s PRO 425 N 1.39 3.81 -0.97 2.72 0.04 -1.26 -4.42 135.00 136.31 2q5i s PRO 425 Ca 0.03 1.88 -0.02 0.00 0.04 0.00 0.00 61.00 62.93 2q5i s PRO 425 Cb -0.15 -4.08 0.29 0.00 0.04 0.00 0.00 34.50 30.59 2q5i s PRO 425 CO -0.04 -1.29 1.25 1.28 0.04 0.00 0.00 177.00 178.23 2q5i n LEU 426 N 8.54 5.62 -4.20 -3.56 4.77 -1.26 -4.96 117.00 121.95 2q5i n LEU 426 Ca 0.20 -5.26 -0.12 0.00 -0.03 0.00 0.00 56.01 50.80 2q5i n LEU 426 Cb 0.44 -1.13 -0.10 0.00 -2.33 0.00 0.00 43.42 40.30 2q5i n LEU 426 CO 0.65 1.75 -0.33 0.68 -1.33 0.00 0.00 177.39 178.81 2q5i s VAL 427 N -2.56 0.52 0.09 4.08 -7.23 -1.26 -4.86 120.40 109.18 2q5i s VAL 427 Ca 0.33 -1.95 0.02 0.00 -1.81 0.00 0.00 61.98 58.58 2q5i s VAL 427 Cb 0.06 -2.00 -0.04 0.00 0.56 0.00 0.00 36.38 34.96 2q5i s VAL 427 CO 0.05 -0.57 0.14 0.00 -0.31 0.00 0.00 175.10 174.42 2q5i s ALA 428 N -3.76 3.72 -0.24 1.32 0.00 0.65 -4.94 121.76 118.52 2q5i s ALA 428 Ca 0.21 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 51.19 2q5i s ALA 428 Cb 0.06 -1.56 0.06 0.00 0.00 0.00 0.00 23.12 21.68 2q5i s ALA 428 CO 0.01 0.71 -0.08 -2.00 0.00 0.00 0.00 175.76 174.41 2q5i s GLU 429 N -2.61 1.91 -0.30 0.00 2.12 -1.26 0.36 118.70 118.91 2q5i s GLU 429 Ca 0.32 -1.13 -0.07 0.00 0.36 0.00 0.00 54.97 54.45 2q5i s GLU 429 Cb -0.12 -2.71 0.02 0.00 0.26 0.00 0.00 34.13 31.58 2q5i s GLU 429 CO 0.24 -0.58 0.08 -1.59 -0.54 0.00 0.00 175.26 172.88 2q5i s LYS 430 N 1.27 2.97 0.34 4.30 -2.85 -0.90 -4.94 119.74 119.93 2q5i s LYS 430 Ca -0.07 -0.94 -0.04 0.00 -1.00 0.00 0.00 55.97 53.92 2q5i s LYS 430 Cb -0.19 -3.38 -0.05 0.00 -2.06 0.00 0.00 37.83 32.15 2q5i s LYS 430 CO -0.06 -0.50 0.60 -1.25 0.10 0.00 0.00 175.35 174.25 2q5i s PRO 431 N 1.47 3.59 0.10 1.78 0.04 -1.26 -1.83 135.00 138.89 2q5i s PRO 431 Ca 0.02 -0.02 0.00 0.00 0.04 0.00 0.00 61.00 61.03 2q5i s PRO 431 Cb -0.18 -2.59 0.00 0.00 0.04 0.00 0.00 34.50 31.77 2q5i s PRO 431 CO 0.02 0.11 0.00 0.98 0.04 0.00 0.00 177.00 178.16 2q5i n TYR 512 N -1.39 -2.94 -3.34 0.56 9.36 -1.26 -4.98 117.16 113.17 2q5i n TYR 512 Ca -0.02 1.77 -0.13 0.00 3.32 0.00 0.00 57.90 62.84 2q5i n TYR 512 Cb 0.55 -3.03 -0.07 0.00 -0.63 0.00 0.00 39.34 36.16 2q5i n TYR 512 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 2q5i s VAL 513 N -0.32 -0.51 -0.14 2.97 -7.23 -1.26 -5.15 120.40 108.76 2q5i s VAL 513 Ca 0.00 -0.53 -0.09 0.00 -1.81 0.00 0.00 61.98 59.55 2q5i s VAL 513 Cb 0.00 -0.84 -0.04 0.00 0.56 0.00 0.00 36.38 36.06 2q5i s VAL 513 CO 0.00 -0.40 0.15 -0.70 -0.31 0.00 0.00 175.10 173.84 2q5i s GLU 514 N 2.13 3.76 -0.24 4.82 2.12 -0.76 -4.94 118.70 125.58 2q5i s GLU 514 Ca 0.12 -0.13 -0.29 0.00 0.36 0.00 0.00 54.97 55.03 2q5i s GLU 514 Cb -0.13 -3.28 0.01 0.00 0.26 0.00 0.00 34.13 30.98 2q5i s GLU 514 CO -0.22 0.59 1.11 -2.00 -0.54 0.00 0.00 175.26 174.20 2q5i s GLU 515 N -0.48 4.19 -0.26 4.30 2.12 -1.26 -2.11 118.70 125.20 2q5i s GLU 515 Ca 0.13 1.35 -0.04 0.00 0.36 0.00 0.00 54.97 56.77 2q5i s GLU 515 Cb -0.12 -3.71 0.01 0.00 0.26 0.00 0.00 34.13 30.58 2q5i s GLU 515 CO 0.02 -0.74 -0.01 0.08 -0.54 0.00 0.00 175.26 174.07 2q5i s VAL 516 N 3.45 3.39 -0.52 3.70 1.01 0.16 -4.96 120.40 126.62 2q5i s VAL 516 Ca 0.47 -0.76 -0.17 0.00 0.00 0.00 0.00 61.98 61.52 2q5i s VAL 516 Cb -0.16 -2.68 0.08 0.00 0.00 0.00 0.00 36.38 33.63 2q5i s VAL 516 CO 0.11 0.22 0.55 0.68 0.00 0.00 0.00 175.10 176.66 2q5i s VAL 517 N 1.43 5.03 0.67 2.92 -7.23 -1.26 -0.25 120.40 121.71 2q5i s VAL 517 Ca 0.03 -0.95 -0.16 0.00 -1.81 0.00 0.00 61.98 59.09 2q5i s VAL 517 Cb -0.16 -4.29 0.00 0.00 0.56 0.00 0.00 36.38 32.49 2q5i s VAL 517 CO -0.02 -0.81 1.17 -2.84 -0.31 0.00 0.00 175.10 172.29 2q5i s PRO 518 N 2.16 2.62 0.67 4.82 0.02 -1.26 -4.80 135.00 139.23 2q5i s PRO 518 Ca 0.09 1.63 -0.09 0.00 0.02 0.00 0.00 61.00 62.65 2q5i s PRO 518 Cb -0.24 -1.91 0.03 0.00 0.02 0.00 0.00 34.50 32.40 2q5i s PRO 518 CO 0.08 -1.44 1.02 -0.80 -0.33 0.00 0.00 177.00 175.53 2q5i s ASN 519 N -2.13 5.30 -0.01 2.53 -0.87 -0.20 -4.87 114.94 114.69 2q5i s ASN 519 Ca 0.72 0.83 0.02 0.00 -1.57 0.00 0.00 52.86 52.86 2q5i s ASN 519 Cb -0.26 -1.64 -0.00 0.00 -0.02 0.00 0.00 41.25 39.33 2q5i s ASN 519 CO 0.40 -1.34 -0.05 0.68 -2.57 0.00 0.00 177.10 174.22 2q5i s VAL 520 N -3.23 0.44 -0.20 1.60 -7.23 -0.61 -1.68 120.40 109.50 2q5i s VAL 520 Ca 0.57 -0.21 -0.09 0.00 -1.81 0.00 0.00 61.98 60.44 2q5i s VAL 520 Cb -0.11 -0.39 -0.04 0.00 0.56 0.00 0.00 36.38 36.40 2q5i s VAL 520 CO 0.48 0.14 0.10 -0.63 -0.31 0.00 0.00 175.10 174.87 2q5i s ILE 521 N 0.03 5.08 -0.67 -0.62 -1.09 -0.73 -1.12 121.20 122.08 2q5i s ILE 521 Ca 0.00 0.07 0.05 0.00 -2.23 0.00 0.00 60.65 58.55 2q5i s ILE 521 Cb -0.04 -3.31 0.20 0.00 -1.58 0.00 0.00 42.46 37.73 2q5i s ILE 521 CO -0.00 0.44 0.58 -0.62 -1.23 0.00 0.00 174.94 174.10 2q5i n GLU 522 N 3.63 1.99 -1.81 2.79 1.02 0.83 -1.13 120.64 127.95 2q5i n GLU 522 Ca -0.16 -4.49 -0.42 0.00 -0.02 0.00 0.00 57.16 52.07 2q5i n GLU 522 Cb 0.52 -2.24 -0.03 0.00 -0.02 0.00 0.00 31.44 29.67 2q5i n GLU 522 CO 0.00 0.00 0.00 -2.14 1.18 0.00 0.00 177.13 176.17 2q5i s PRO 523 N -1.76 4.16 -0.19 3.49 0.02 -1.19 -3.17 135.00 136.36 2q5i s PRO 523 Ca 0.30 2.44 0.00 0.00 0.02 0.00 0.00 61.00 63.76 2q5i s PRO 523 Cb 0.03 -4.04 0.05 0.00 0.02 0.00 0.00 34.50 30.56 2q5i s PRO 523 CO -0.12 -0.90 -0.08 0.45 -0.33 0.00 0.00 177.00 176.03 2q5i s SER 524 N 3.83 3.28 -0.25 2.53 0.15 0.11 -0.77 113.70 122.58 2q5i s SER 524 Ca 0.82 -0.86 -0.07 0.00 0.70 0.00 0.00 55.95 56.53 2q5i s SER 524 Cb -0.39 -1.11 -0.03 0.00 -1.71 0.00 0.00 66.02 62.78 2q5i s SER 524 CO 0.36 -0.18 0.07 -0.36 1.20 0.00 0.00 173.24 174.34 2q5i s PHE 525 N 1.48 3.09 -0.87 3.44 0.40 0.28 -0.53 117.98 125.27 2q5i s PHE 525 Ca -0.01 -0.39 -0.18 0.00 -0.60 0.00 0.00 56.93 55.75 2q5i s PHE 525 Cb -0.16 -2.23 0.14 0.00 0.51 0.00 0.00 43.02 41.27 2q5i s PHE 525 CO -0.08 -0.33 1.03 0.20 0.70 0.00 0.00 175.22 176.74 2q5i s GLY 526 N 1.56 2.01 0.20 4.36 0.00 -0.47 -2.03 107.32 112.94 2q5i s GLY 526 Ca 0.06 -2.77 -0.11 0.00 0.00 0.00 0.00 44.72 41.90 2q5i s GLY 526 CO 0.04 1.86 1.78 1.41 0.00 0.00 0.00 173.10 178.18 2q5i h LEU 527 N 9.99 0.37 -0.51 0.66 3.38 -1.82 -1.15 115.31 126.23 2q5i h LEU 527 Ca 0.09 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.16 2q5i h LEU 527 Cb 1.03 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.71 2q5i h LEU 527 CO 1.05 0.24 0.23 1.23 0.09 0.00 0.00 178.44 181.28 2q5i h GLY 528 N 0.51 0.70 1.59 0.83 0.00 -1.91 -0.64 103.07 104.15 2q5i h GLY 528 Ca 0.27 -0.14 -0.08 0.00 0.00 0.00 0.00 47.33 47.38 2q5i h GLY 528 CO -0.21 0.06 -0.14 3.21 0.00 0.00 0.00 176.54 179.46 2q5i h ARG 529 N 0.44 0.50 -0.37 4.80 3.08 -1.63 -0.37 114.38 120.83 2q5i h ARG 529 Ca 0.23 -0.15 -0.03 0.00 0.07 0.00 0.00 59.98 60.10 2q5i h ARG 529 Cb 0.20 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 2q5i h ARG 529 CO -0.20 0.63 0.10 0.82 -1.07 0.00 0.00 179.97 180.26 2q5i h ILE 530 N 0.46 1.22 -0.14 2.04 2.04 -0.56 -1.73 117.51 120.85 2q5i h ILE 530 Ca 0.08 -0.74 -0.01 0.00 1.00 0.00 0.00 64.86 65.20 2q5i h ILE 530 Cb 0.52 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2q5i h ILE 530 CO 0.03 0.26 0.06 -0.03 0.00 0.00 0.00 178.15 178.47 2q5i h MET 531 N 0.46 0.20 -0.82 2.37 4.05 -0.89 -1.25 114.93 119.05 2q5i h MET 531 Ca 0.12 -0.03 0.06 0.00 -0.28 0.00 0.00 59.70 59.56 2q5i h MET 531 Cb 0.29 -0.03 -0.05 0.00 -0.80 0.00 0.00 31.60 31.00 2q5i h MET 531 CO -0.00 0.28 0.54 -0.92 0.23 0.00 0.00 176.91 177.04 2q5i h TYR 532 N 0.07 0.93 -0.39 1.39 3.20 -1.00 -0.64 116.97 120.53 2q5i h TYR 532 Ca 0.05 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.85 2q5i h TYR 532 Cb 0.15 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 2q5i h TYR 532 CO -0.02 0.50 -0.11 1.15 -1.64 0.00 0.00 178.16 178.04 2q5i h THR 533 N 0.93 1.28 -0.93 1.81 2.02 -1.00 -2.21 112.91 114.81 2q5i h THR 533 Ca 0.35 -1.21 0.07 0.00 0.77 0.00 0.00 66.41 66.39 2q5i h THR 533 Cb 0.18 1.26 -0.07 0.00 -1.74 0.00 0.00 68.15 67.78 2q5i h THR 533 CO -0.12 0.40 0.58 0.58 0.37 0.00 0.00 175.52 177.34 2q5i h VAL 534 N 0.56 1.03 -0.03 3.16 2.07 -0.37 1.00 116.25 123.67 2q5i h VAL 534 Ca 0.10 -0.35 0.01 0.00 0.82 0.00 0.00 66.70 67.27 2q5i h VAL 534 Cb 0.64 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 2q5i h VAL 534 CO 0.04 0.19 -0.04 -0.26 0.02 0.00 0.00 177.57 177.52 2q5i h PHE 535 N 1.03 -0.11 -0.22 1.57 0.04 -0.77 0.75 116.94 119.25 2q5i h PHE 535 Ca 0.41 0.01 -0.09 0.00 2.80 0.00 0.00 57.97 61.10 2q5i h PHE 535 Cb 0.22 0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.41 2q5i h PHE 535 CO -0.02 -0.07 -0.24 0.93 -0.60 0.00 0.00 178.31 178.31 2q5i h GLU 536 N -0.06 0.41 0.00 1.51 5.08 -0.83 -1.14 114.58 119.54 2q5i h GLU 536 Ca 0.03 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.21 2q5i h GLU 536 Cb 0.10 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2q5i h GLU 536 CO -0.07 0.63 -0.52 0.45 -1.00 0.00 0.00 179.01 178.50 2q5i h HIS 537 N 0.36 0.00 -0.00 4.33 3.86 -0.55 -3.35 115.15 119.80 2q5i h HIS 537 Ca 0.06 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 2q5i h HIS 537 Cb 0.63 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.10 2q5i h HIS 537 CO 0.02 0.15 -0.54 0.25 0.86 0.00 0.00 177.93 178.67 2q5i n THR 538 N -2.98 0.00 -2.13 2.45 -2.24 0.23 -4.91 114.28 104.71 2q5i n THR 538 Ca 0.01 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 61.14 2q5i n THR 538 Cb 0.60 1.01 -0.03 0.00 -2.10 0.00 0.00 70.33 69.82 2q5i n THR 538 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2q5i s PHE 539 N -2.09 2.74 0.10 4.78 2.19 -0.44 -0.19 117.98 125.07 2q5i s PHE 539 Ca 0.05 0.67 0.03 0.00 0.33 0.00 0.00 56.93 58.00 2q5i s PHE 539 Cb 0.09 -3.76 -0.04 0.00 -1.31 0.00 0.00 43.02 38.00 2q5i s PHE 539 CO 0.48 -2.89 -0.08 -1.01 1.83 0.00 0.00 175.22 173.55 2q5i s HIS 540 N 2.40 0.95 -0.17 10.12 3.76 0.50 -4.97 115.29 127.88 2q5i s HIS 540 Ca 0.67 -0.80 -0.00 0.00 -0.15 0.00 0.00 55.06 54.78 2q5i s HIS 540 Cb -0.34 -0.53 0.00 0.00 1.11 0.00 0.00 32.58 32.82 2q5i s HIS 540 CO 0.28 -0.08 -0.15 0.08 -0.85 0.00 0.00 174.74 174.02 2q5i s VAL 541 N -3.10 2.59 0.68 -0.90 1.01 -1.26 -1.21 120.40 118.21 2q5i s VAL 541 Ca 0.09 -0.78 -0.16 0.00 0.00 0.00 0.00 61.98 61.12 2q5i s VAL 541 Cb 0.02 -2.11 0.01 0.00 0.00 0.00 0.00 36.38 34.30 2q5i s VAL 541 CO -0.03 0.51 1.21 -0.13 0.00 0.00 0.00 175.10 176.66 2q5i s ARG 542 N 1.06 2.45 -0.91 2.72 1.81 0.19 -4.92 118.95 121.35 2q5i s ARG 542 Ca -0.01 1.77 -0.25 0.00 -1.72 0.00 0.00 55.73 55.53 2q5i s ARG 542 Cb -0.14 -1.87 0.04 0.00 -0.45 0.00 0.00 34.95 32.53 2q5i s ARG 542 CO -0.04 -1.60 1.40 -2.00 -0.68 0.00 0.00 175.30 172.38 2q5i s GLU 543 N -3.74 3.40 0.22 3.54 2.12 -1.26 -4.55 118.70 118.44 2q5i s GLU 543 Ca 0.75 -0.75 -0.22 0.00 0.36 0.00 0.00 54.97 55.12 2q5i s GLU 543 Cb -0.29 -4.90 0.06 0.00 0.26 0.00 0.00 34.13 29.26 2q5i s GLU 543 CO 0.41 -2.22 0.94 0.20 -0.54 0.00 0.00 175.26 174.05 2q5i s GLY 544 N 4.63 0.04 0.11 -1.50 0.00 -1.26 -5.04 107.32 104.31 2q5i s GLY 544 Ca 0.43 -0.28 -0.03 0.00 0.00 0.00 0.00 44.72 44.84 2q5i s GLY 544 CO -0.00 0.94 1.25 -0.55 0.00 0.00 0.00 173.10 174.74 2q5i h ASP 545 N 2.00 0.42 0.73 1.64 5.19 -2.01 -3.29 116.42 121.10 2q5i h ASP 545 Ca -0.27 -0.39 0.00 0.00 -0.62 0.00 0.00 57.03 55.76 2q5i h ASP 545 Cb 1.23 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.61 2q5i h ASP 545 CO 0.33 1.23 0.00 1.21 -3.12 0.00 0.00 179.24 178.89 2q5i n GLU 546 N -3.63 0.00 -3.67 3.56 2.13 -1.26 -4.92 120.64 112.85 2q5i n GLU 546 Ca -0.07 0.14 -0.24 0.00 0.66 0.00 0.00 57.16 57.65 2q5i n GLU 546 Cb 0.91 -1.50 0.03 0.00 0.27 0.00 0.00 31.44 31.15 2q5i n GLU 546 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 2q5i n GLN 547 N -1.50 -3.37 -2.24 5.31 1.13 -1.24 -4.94 117.38 110.53 2q5i n GLN 547 Ca 0.05 0.58 -0.37 0.00 -1.94 0.00 0.00 57.00 55.32 2q5i n GLN 547 Cb 0.25 -4.88 -0.01 0.00 0.11 0.00 0.00 30.24 25.71 2q5i n GLN 547 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2q5i s ARG 548 N -5.86 3.73 0.24 -1.09 0.52 -1.26 -4.85 118.95 110.37 2q5i s ARG 548 Ca 0.19 1.79 0.10 0.00 -0.52 0.00 0.00 55.73 57.29 2q5i s ARG 548 Cb -0.06 -2.40 -0.05 0.00 0.52 0.00 0.00 34.95 32.97 2q5i s ARG 548 CO 0.83 -0.58 -0.18 0.95 0.02 0.00 0.00 175.30 176.34 2q5i s THR 549 N -1.54 2.12 0.11 0.02 -4.23 -1.26 0.53 115.64 111.38 2q5i s THR 549 Ca 0.64 -2.28 -0.13 0.00 -1.18 0.00 0.00 61.69 58.74 2q5i s THR 549 Cb -0.29 -2.15 0.02 0.00 1.34 0.00 0.00 72.50 71.41 2q5i s THR 549 CO 0.35 -0.47 0.31 0.72 -0.54 0.00 0.00 174.62 174.99 2q5i s PHE 550 N -2.65 -0.05 -0.19 3.99 -0.71 -0.35 -3.65 117.98 114.37 2q5i s PHE 550 Ca 0.26 -0.31 -0.06 0.00 -1.04 0.00 0.00 56.93 55.77 2q5i s PHE 550 Cb -0.03 0.12 -0.03 0.00 -1.21 0.00 0.00 43.02 41.86 2q5i s PHE 550 CO 0.11 -0.62 0.04 -0.06 -1.34 0.00 0.00 175.22 173.34 2q5i s PHE 551 N -3.77 3.15 -0.23 3.49 0.40 -1.20 -0.37 117.98 119.45 2q5i s PHE 551 Ca 0.03 -0.14 -0.05 0.00 -0.60 0.00 0.00 56.93 56.18 2q5i s PHE 551 Cb 0.03 -2.09 -0.09 0.00 0.51 0.00 0.00 43.02 41.39 2q5i s PHE 551 CO -0.11 -0.02 3.12 -1.13 0.70 0.00 0.00 175.22 177.78 2q5i n SER 552 N 3.87 5.87 -4.72 1.36 3.41 0.73 -4.32 113.62 119.82 2q5i n SER 552 Ca -0.17 -2.85 -0.43 0.00 -0.26 0.00 0.00 58.87 55.17 2q5i n SER 552 Cb 0.52 -1.31 -0.02 0.00 -0.26 0.00 0.00 64.21 63.14 2q5i n SER 552 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2q5i n PHE 553 N 1.62 2.69 -1.40 7.33 0.99 -1.26 -4.92 117.46 122.51 2q5i n PHE 553 Ca 0.44 0.20 -0.36 0.00 -0.00 0.00 0.00 57.45 57.73 2q5i n PHE 553 Cb 0.72 -2.60 0.08 0.00 -1.00 0.00 0.00 39.48 36.68 2q5i n PHE 553 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.76 174.46 2q5i n PRO 554 N 2.91 0.57 0.08 -1.08 -0.02 -1.26 -4.65 135.00 131.55 2q5i n PRO 554 Ca 0.12 0.25 0.09 0.00 -2.02 0.00 0.00 63.50 61.95 2q5i n PRO 554 Cb 0.35 -2.21 0.56 0.00 -0.02 0.00 0.00 33.50 32.18 2q5i n PRO 554 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2q5i h ALA 555 N -0.13 1.99 0.00 3.55 0.00 -1.93 -0.99 119.26 121.75 2q5i h ALA 555 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2q5i h ALA 555 Cb 1.34 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2q5i h ALA 555 CO 0.47 -0.05 0.00 -0.39 0.00 0.00 0.00 179.25 179.29 2q5i h VAL 556 N 0.24 0.00 0.00 0.00 -1.51 -1.90 -3.28 116.25 109.80 2q5i h VAL 556 Ca 0.13 -0.38 0.00 0.00 -1.23 0.00 0.00 66.70 65.22 2q5i h VAL 556 Cb 0.23 1.26 0.00 0.00 -2.13 0.00 0.00 31.29 30.66 2q5i h VAL 556 CO -0.03 0.00 -0.81 1.33 -1.23 0.00 0.00 177.57 176.83 2q5i n VAL 557 N -2.70 0.00 -1.63 7.19 0.24 -0.69 -4.76 118.33 115.99 2q5i n VAL 557 Ca 0.01 -0.23 -0.45 0.00 -2.04 0.00 0.00 64.34 61.63 2q5i n VAL 557 Cb 0.27 0.65 -0.02 0.00 -1.47 0.00 0.00 33.84 33.27 2q5i n VAL 557 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2q5i n ALA 558 N -1.44 0.32 -0.28 2.33 0.00 -0.46 -4.53 120.51 116.44 2q5i n ALA 558 Ca -0.00 0.41 0.09 0.00 0.00 0.00 0.00 53.44 53.94 2q5i n ALA 558 Cb 0.11 -2.14 0.23 0.00 0.00 0.00 0.00 19.45 17.65 2q5i n ALA 558 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2q5i h PRO 559 N 3.09 0.13 -4.04 0.00 0.11 -1.82 -3.39 132.00 126.09 2q5i h PRO 559 Ca -0.43 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.56 2q5i h PRO 559 Cb 1.31 -0.03 -0.15 0.00 0.11 0.00 0.00 31.00 32.24 2q5i h PRO 559 CO 0.68 0.09 -0.57 -0.59 -0.21 0.00 0.00 178.00 177.40 2q5i s PHE 560 N -6.03 0.36 0.09 0.65 -0.12 -1.26 -4.79 117.98 106.88 2q5i s PHE 560 Ca -0.13 -0.83 0.00 0.00 -0.05 0.00 0.00 56.93 55.93 2q5i s PHE 560 Cb 0.25 -0.25 -0.25 0.00 -0.63 0.00 0.00 43.02 42.13 2q5i s PHE 560 CO 0.76 -0.42 1.20 0.87 -0.05 0.00 0.00 175.22 177.58 2q5i h LYS 561 N 3.14 0.16 -3.08 1.99 1.57 -1.71 -3.29 116.57 115.35 2q5i h LYS 561 Ca -0.34 -0.27 -0.35 0.00 -1.87 0.00 0.00 60.65 57.82 2q5i h LYS 561 Cb 1.17 0.10 -0.38 0.00 0.08 0.00 0.00 32.23 33.20 2q5i h LYS 561 CO 0.60 1.13 -0.69 0.00 -0.57 0.00 0.00 179.45 179.92 2q5i s SER 563 N 2.23 7.33 -0.32 0.00 0.15 -0.20 -2.55 113.70 120.34 2q5i s SER 563 Ca 0.04 1.58 -0.02 0.00 0.70 0.00 0.00 55.95 58.25 2q5i s SER 563 Cb -0.13 -2.51 0.06 0.00 -1.71 0.00 0.00 66.02 61.72 2q5i s SER 563 CO -0.06 -0.01 0.03 -0.69 1.20 0.00 0.00 173.24 173.71 2q5i s VAL 564 N -0.08 3.09 -0.34 4.45 1.01 -0.92 -0.75 120.40 126.87 2q5i s VAL 564 Ca 0.42 -1.45 -0.05 0.00 0.00 0.00 0.00 61.98 60.89 2q5i s VAL 564 Cb -0.22 -2.82 0.05 0.00 0.00 0.00 0.00 36.38 33.39 2q5i s VAL 564 CO 0.26 -0.19 0.09 -1.48 0.00 0.00 0.00 175.10 173.78 2q5i s LEU 565 N 1.25 4.32 0.21 3.92 0.05 -0.54 -0.54 118.68 127.34 2q5i s LEU 565 Ca -0.03 -1.27 -0.18 0.00 0.05 0.00 0.00 54.13 52.70 2q5i s LEU 565 Cb -0.20 -1.83 -0.08 0.00 -2.05 0.00 0.00 46.19 42.03 2q5i s LEU 565 CO -0.01 -0.34 0.68 -2.16 -0.55 0.00 0.00 176.35 173.97 2q5i s PRO 566 N 1.34 4.17 0.37 1.48 0.04 -1.26 -1.15 135.00 139.98 2q5i s PRO 566 Ca -0.02 0.76 0.18 0.00 0.04 0.00 0.00 61.00 61.96 2q5i s PRO 566 Cb -0.20 -2.87 0.64 0.00 0.04 0.00 0.00 34.50 32.12 2q5i s PRO 566 CO 0.01 0.40 1.72 -0.07 0.04 0.00 0.00 177.00 179.10 2q5i h LEU 567 N 3.39 0.00 -8.41 -3.56 4.07 -1.07 -3.45 115.31 106.28 2q5i h LEU 567 Ca -0.48 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.28 2q5i h LEU 567 Cb 1.19 0.00 -0.15 0.00 1.08 0.00 0.00 40.66 42.78 2q5i h LEU 567 CO 0.65 0.39 -0.69 -0.55 -1.08 0.00 0.00 178.44 177.17 2q5i s SER 568 N -6.47 0.94 -0.12 -0.43 0.15 -1.26 -5.05 113.70 101.45 2q5i s SER 568 Ca 0.00 -1.03 0.17 0.00 0.70 0.00 0.00 55.95 55.80 2q5i s SER 568 Cb 0.11 0.13 0.30 0.00 -1.71 0.00 0.00 66.02 64.85 2q5i s SER 568 CO 0.69 -0.52 1.17 1.67 1.20 0.00 0.00 173.24 177.46 2q5i n GLN 569 N -0.02 1.62 -1.18 5.44 -0.06 -1.26 -4.81 117.38 117.10 2q5i n GLN 569 Ca -0.12 -2.52 -0.30 0.00 -2.00 0.00 0.00 57.00 52.06 2q5i n GLN 569 Cb 0.61 -1.50 0.21 0.00 -4.06 0.00 0.00 30.24 25.51 2q5i n GLN 569 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 2q5i s ASN 570 N -2.61 1.66 0.62 1.69 6.03 -1.26 -4.75 114.94 116.33 2q5i s ASN 570 Ca 0.31 0.78 0.41 0.00 -1.03 0.00 0.00 52.86 53.33 2q5i s ASN 570 Cb 0.26 -1.15 2.14 0.00 -3.03 0.00 0.00 41.25 39.47 2q5i s ASN 570 CO 0.04 -3.68 2.25 -0.61 -2.03 0.00 0.00 177.10 173.07 2q5i h GLN 571 N -2.28 0.00 0.00 3.55 4.15 -2.01 -1.40 115.11 117.12 2q5i h GLN 571 Ca -0.48 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 58.82 2q5i h GLN 571 Cb 1.30 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.98 2q5i h GLN 571 CO 0.43 0.00 -0.56 0.93 -1.93 0.00 0.00 178.83 177.69 2q5i h GLU 572 N 0.00 0.00 0.00 1.69 4.39 -1.98 -3.35 114.58 115.33 2q5i h GLU 572 Ca 0.00 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.51 2q5i h GLU 572 Cb 0.11 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 2q5i h GLU 572 CO 0.00 0.55 -1.74 1.19 -1.16 0.00 0.00 179.01 177.85 2q5i n PHE 573 N -3.23 0.59 -0.21 4.33 3.01 -0.55 -4.56 117.46 116.83 2q5i n PHE 573 Ca 0.02 0.20 -0.08 0.00 1.01 0.00 0.00 57.45 58.59 2q5i n PHE 573 Cb 0.76 -0.97 0.02 0.00 -0.01 0.00 0.00 39.48 39.29 2q5i n PHE 573 CO 0.00 0.00 0.00 0.52 1.01 0.00 0.00 176.76 178.29 2q5i h MET 574 N 0.00 0.98 -0.91 -1.08 2.86 -1.62 -2.32 114.93 112.85 2q5i h MET 574 Ca -0.23 -0.26 0.18 0.00 -2.06 0.00 0.00 59.70 57.34 2q5i h MET 574 Cb 1.64 -0.12 -0.07 0.00 0.06 0.00 0.00 31.60 33.11 2q5i h MET 574 CO 0.03 0.92 0.59 -1.35 1.06 0.00 0.00 176.91 178.17 2q5i h PRO 575 N 0.89 0.52 0.11 -0.22 0.11 -1.80 0.19 132.00 131.79 2q5i h PRO 575 Ca 0.18 -0.03 -0.29 0.00 0.11 0.00 0.00 66.00 65.97 2q5i h PRO 575 Cb 0.41 -0.12 0.03 0.00 0.11 0.00 0.00 31.00 31.43 2q5i h PRO 575 CO 0.01 0.34 -1.22 0.74 -0.21 0.00 0.00 178.00 177.66 2q5i h PHE 576 N 0.53 0.97 -0.08 0.65 -1.00 -1.73 -2.37 116.94 113.91 2q5i h PHE 576 Ca 0.47 -0.60 -0.03 0.00 2.81 0.00 0.00 57.97 60.63 2q5i h PHE 576 Cb 1.00 -0.08 -0.00 0.00 3.61 0.00 0.00 35.95 40.48 2q5i h PHE 576 CO -0.00 1.44 -0.06 0.28 -1.61 0.00 0.00 178.31 178.36 2q5i h VAL 577 N 0.27 1.35 -0.40 -0.55 2.07 -1.03 -1.61 116.25 116.36 2q5i h VAL 577 Ca -0.18 -1.16 0.05 0.00 0.82 0.00 0.00 66.70 66.24 2q5i h VAL 577 Cb 1.89 1.95 -0.05 0.00 -1.52 0.00 0.00 31.29 33.56 2q5i h VAL 577 CO 0.23 0.32 0.11 0.50 0.02 0.00 0.00 177.57 178.75 2q5i h LYS 578 N -0.23 0.24 -0.43 1.57 3.64 -0.74 0.77 116.57 121.40 2q5i h LYS 578 Ca 0.01 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2q5i h LYS 578 Cb 0.55 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 2q5i h LYS 578 CO 0.02 0.16 0.22 1.49 -2.27 0.00 0.00 179.45 179.07 2q5i h GLU 579 N 0.25 0.62 -0.68 1.90 4.57 -1.43 -0.92 114.58 118.88 2q5i h GLU 579 Ca 0.19 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.27 2q5i h GLU 579 Cb 0.20 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 2q5i h GLU 579 CO -0.22 0.52 0.39 1.25 -1.18 0.00 0.00 179.01 179.77 2q5i h LEU 580 N 0.56 0.84 -0.31 1.64 5.85 -0.76 -0.04 115.31 123.09 2q5i h LEU 580 Ca 0.15 -0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2q5i h LEU 580 Cb 0.09 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 2q5i h LEU 580 CO -0.02 0.68 0.06 -0.07 -0.34 0.00 0.00 178.44 178.75 2q5i h LEU 581 N 0.93 0.48 -0.63 2.25 3.38 -0.55 0.16 115.31 121.33 2q5i h LEU 581 Ca 0.24 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2q5i h LEU 581 Cb 0.01 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 2q5i h LEU 581 CO -0.04 0.60 0.31 -0.33 0.09 0.00 0.00 178.44 179.06 2q5i h GLU 582 N 0.33 0.90 -0.03 1.13 5.08 -0.95 -0.74 114.58 120.30 2q5i h GLU 582 Ca 0.09 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2q5i h GLU 582 Cb 0.32 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 2q5i h GLU 582 CO 0.00 0.71 0.01 0.00 -1.00 0.00 0.00 179.01 178.74 2q5i h ALA 583 N 1.14 0.04 -0.70 3.43 0.00 -0.86 0.79 119.26 123.09 2q5i h ALA 583 Ca 0.22 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.16 2q5i h ALA 583 Cb 0.11 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.82 2q5i h ALA 583 CO -0.03 -0.41 0.35 -0.07 0.00 0.00 0.00 179.25 179.09 2q5i h LEU 584 N -0.06 0.46 0.05 0.00 3.38 -0.81 -0.18 115.31 118.15 2q5i h LEU 584 Ca 0.01 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 2q5i h LEU 584 Cb 0.10 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2q5i h LEU 584 CO -0.00 0.27 -0.03 0.74 0.09 0.00 0.00 178.44 179.50 2q5i h THR 585 N 0.60 0.92 -0.70 0.22 2.02 -0.82 -0.55 112.91 114.60 2q5i h THR 585 Ca 0.34 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.71 2q5i h THR 585 Cb 0.35 0.92 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 2q5i h THR 585 CO -0.26 0.00 0.49 0.03 0.37 0.00 0.00 175.52 176.15 2q5i h ARG 586 N -0.09 0.12 -0.37 6.66 3.08 -0.07 0.85 114.38 124.57 2q5i h ARG 586 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2q5i h ARG 586 Cb 0.08 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2q5i h ARG 586 CO -0.00 0.08 0.00 0.72 -1.07 0.00 0.00 179.97 179.70 2q5i n HIS 587 N -4.38 0.48 -2.21 3.04 8.25 -0.15 -4.95 115.22 115.29 2q5i n HIS 587 Ca 0.14 -0.24 -0.16 0.00 -0.26 0.00 0.00 57.72 57.20 2q5i n HIS 587 Cb 0.69 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.78 2q5i n HIS 587 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2q5i n GLY 588 N 1.29 -0.08 3.42 -1.41 0.00 0.29 -4.90 105.19 103.80 2q5i n GLY 588 Ca 0.17 -0.22 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 2q5i n GLY 588 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q5i s VAL 589 N -2.78 4.42 0.59 1.61 1.01 -0.31 -5.02 120.40 119.92 2q5i s VAL 589 Ca 0.00 -0.48 -0.16 0.00 0.00 0.00 0.00 61.98 61.34 2q5i s VAL 589 Cb 0.00 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 2q5i s VAL 589 CO 0.00 0.09 1.06 -0.94 0.00 0.00 0.00 175.10 175.31 2q5i s SER 590 N 1.58 5.77 0.24 3.32 1.04 -1.26 -4.14 113.70 120.25 2q5i s SER 590 Ca 0.04 1.85 -0.22 0.00 0.48 0.00 0.00 55.95 58.11 2q5i s SER 590 Cb -0.17 -2.54 0.04 0.00 0.10 0.00 0.00 66.02 63.45 2q5i s SER 590 CO 0.05 -1.18 0.81 -1.38 0.98 0.00 0.00 173.24 172.52 2q5i s HIS 591 N -2.38 -0.14 -0.27 5.02 -0.00 -1.26 -1.79 115.29 114.47 2q5i s HIS 591 Ca 0.64 -0.28 -0.13 0.00 -0.00 0.00 0.00 55.06 55.30 2q5i s HIS 591 Cb -0.17 0.70 0.09 0.00 -0.00 0.00 0.00 32.58 33.20 2q5i s HIS 591 CO 0.36 -1.12 0.63 0.21 -0.00 0.00 0.00 174.74 174.81 2q5i s LYS 592 N -3.57 0.60 0.11 -0.38 2.20 -1.06 -4.97 119.74 112.67 2q5i s LYS 592 Ca 0.12 1.24 -0.31 0.00 -0.36 0.00 0.00 55.97 56.66 2q5i s LYS 592 Cb -0.04 0.38 -0.09 0.00 -1.51 0.00 0.00 37.83 36.56 2q5i s LYS 592 CO 0.06 -0.17 1.60 0.08 -0.36 0.00 0.00 175.35 176.55 2q5i s VAL 593 N 2.10 2.92 -0.24 4.02 1.01 -1.26 -2.16 120.40 126.79 2q5i s VAL 593 Ca -0.08 0.52 -0.26 0.00 0.00 0.00 0.00 61.98 62.16 2q5i s VAL 593 Cb -0.08 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.96 2q5i s VAL 593 CO -0.18 0.02 0.90 -0.62 0.00 0.00 0.00 175.10 175.22 2q5i s ASP 594 N 1.83 6.92 -0.20 3.32 3.68 0.29 -4.90 116.67 127.61 2q5i s ASP 594 Ca 0.71 1.14 0.12 0.00 2.13 0.00 0.00 52.55 56.66 2q5i s ASP 594 Cb -0.41 -2.47 0.43 0.00 -1.45 0.00 0.00 42.92 39.02 2q5i s ASP 594 CO 0.31 -0.57 1.21 0.47 0.13 0.00 0.00 175.17 176.72 2q5i n ASP 595 N 6.13 2.07 -4.64 -0.34 9.92 -1.26 -4.55 116.55 123.88 2q5i n ASP 595 Ca 0.08 -3.68 -0.24 0.00 -0.53 0.00 0.00 54.79 50.41 2q5i n ASP 595 Cb 0.47 -0.48 0.11 0.00 -0.64 0.00 0.00 41.12 40.58 2q5i n ASP 595 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 2q5i s SER 596 N -3.18 4.27 0.51 -2.24 1.04 -1.26 -5.10 113.70 107.74 2q5i s SER 596 Ca 0.39 -0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.61 2q5i s SER 596 Cb 0.38 -0.17 0.01 0.00 0.10 0.00 0.00 66.02 66.34 2q5i s SER 596 CO -0.06 -1.92 0.74 -0.94 0.98 0.00 0.00 173.24 172.04 2q5i s SER 597 N -4.72 5.56 0.00 7.02 1.04 -1.26 -5.04 113.70 116.30 2q5i s SER 597 Ca 0.66 0.20 0.00 0.00 0.48 0.00 0.00 55.95 57.30 2q5i s SER 597 Cb -0.06 -1.27 0.00 0.00 0.10 0.00 0.00 66.02 64.79 2q5i s SER 597 CO 0.45 -0.93 0.00 0.61 0.98 0.00 0.00 173.24 174.35 2q5i n GLY 598 N -2.25 -0.06 3.72 7.32 0.00 -1.26 -4.46 105.19 108.21 2q5i n GLY 598 Ca 0.04 -1.91 -0.33 0.00 0.00 0.00 0.00 46.02 43.82 2q5i n GLY 598 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2q5i s SER 599 N -0.83 4.04 0.30 1.61 1.04 -1.26 -4.68 113.70 113.91 2q5i s SER 599 Ca 0.00 2.18 0.02 0.00 0.48 0.00 0.00 55.95 58.63 2q5i s SER 599 Cb 0.00 -2.57 0.73 0.00 0.10 0.00 0.00 66.02 64.28 2q5i s SER 599 CO 0.00 -2.36 1.61 -0.29 0.98 0.00 0.00 173.24 173.17 2q5i h ILE 600 N -0.79 0.16 -0.49 -1.02 2.10 -1.99 0.28 117.51 115.75 2q5i h ILE 600 Ca -0.46 -0.03 -0.11 0.00 1.08 0.00 0.00 64.86 65.35 2q5i h ILE 600 Cb 1.27 0.07 -0.02 0.00 -1.09 0.00 0.00 36.82 37.05 2q5i h ILE 600 CO 0.48 0.02 -0.12 1.23 -1.08 0.00 0.00 178.15 178.68 2q5i h GLY 601 N 0.09 0.99 1.48 8.18 0.00 -1.99 -0.89 103.07 110.93 2q5i h GLY 601 Ca 0.57 -0.78 -0.10 0.00 0.00 0.00 0.00 47.33 47.02 2q5i h GLY 601 CO -0.79 0.71 -0.23 -0.09 0.00 0.00 0.00 176.54 176.14 2q5i h ARG 602 N 0.82 0.60 0.07 4.80 2.43 -1.46 -1.34 114.38 120.30 2q5i h ARG 602 Ca 0.13 -0.23 -0.00 0.00 -0.81 0.00 0.00 59.98 59.07 2q5i h ARG 602 Cb 0.65 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 2q5i h ARG 602 CO 0.04 0.79 -0.03 0.00 -1.51 0.00 0.00 179.97 179.26 2q5i h ARG 603 N 0.53 -0.09 -0.46 0.20 2.47 -0.66 -2.92 114.38 113.44 2q5i h ARG 603 Ca 0.08 0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.79 2q5i h ARG 603 Cb 0.69 0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 29.01 2q5i h ARG 603 CO 0.05 0.19 0.24 1.88 0.56 0.00 0.00 179.97 182.90 2q5i h TYR 604 N -0.37 0.61 -0.96 3.04 0.05 -1.15 -2.44 116.97 115.76 2q5i h TYR 604 Ca -0.01 -0.01 0.10 0.00 0.05 0.00 0.00 58.73 58.86 2q5i h TYR 604 Cb 0.32 -0.20 -0.07 0.00 1.01 0.00 0.00 36.73 37.79 2q5i h TYR 604 CO 0.02 0.44 0.61 0.00 -1.05 0.00 0.00 178.16 178.18 2q5i h ALA 605 N 1.63 1.55 -0.04 3.88 0.00 -1.06 0.39 119.26 125.60 2q5i h ALA 605 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2q5i h ALA 605 Cb 0.03 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2q5i h ALA 605 CO -0.03 0.25 -0.02 0.00 0.00 0.00 0.00 179.25 179.46 2q5i h ARG 606 N 0.99 0.09 -0.73 0.00 3.08 -1.29 -1.62 114.38 114.90 2q5i h ARG 606 Ca 0.45 -0.04 0.15 0.00 0.07 0.00 0.00 59.98 60.62 2q5i h ARG 606 Cb 0.39 -0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.33 2q5i h ARG 606 CO -0.21 0.46 0.21 1.15 -1.07 0.00 0.00 179.97 180.51 2q5i h THR 607 N -0.30 0.56 -0.60 2.04 2.02 -1.19 -1.94 112.91 113.50 2q5i h THR 607 Ca 0.01 -0.11 -0.07 0.00 0.77 0.00 0.00 66.41 67.01 2q5i h THR 607 Cb 0.44 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 67.04 2q5i h THR 607 CO 0.01 0.06 0.10 0.44 0.37 0.00 0.00 175.52 176.49 2q5i h ASP 608 N 0.31 0.92 -0.07 4.18 3.32 -0.08 -2.54 116.42 122.45 2q5i h ASP 608 Ca 0.41 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 2q5i h ASP 608 Cb 0.68 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.98 2q5i h ASP 608 CO -0.48 0.92 0.04 -0.08 -1.72 0.00 0.00 179.24 177.92 2q5i h GLU 609 N 0.91 0.12 -0.62 3.56 4.81 -0.48 0.13 114.58 123.00 2q5i h GLU 609 Ca 0.19 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 2q5i h GLU 609 Cb 0.40 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.75 2q5i h GLU 609 CO 0.01 0.10 0.00 0.44 -0.73 0.00 0.00 179.01 178.83 2q5i n ILE 610 N -4.51 0.82 -1.17 2.32 -5.35 -1.17 -4.38 119.36 105.93 2q5i n ILE 610 Ca -0.02 -0.90 0.00 0.00 -0.27 0.00 0.00 62.75 61.56 2q5i n ILE 610 Cb 0.10 0.64 0.00 0.00 -1.74 0.00 0.00 39.64 38.64 2q5i n ILE 610 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2q5i n GLY 611 N 1.61 0.48 3.71 3.28 0.00 0.44 -4.53 105.19 110.18 2q5i n GLY 611 Ca 0.23 -0.92 -0.42 0.00 0.00 0.00 0.00 46.02 44.91 2q5i n GLY 611 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q5i s VAL 612 N -2.00 3.05 0.06 1.61 1.01 -0.97 -4.50 120.40 118.65 2q5i s VAL 612 Ca 0.00 0.69 -0.20 0.00 0.00 0.00 0.00 61.98 62.47 2q5i s VAL 612 Cb 0.00 -3.44 -0.11 0.00 0.00 0.00 0.00 36.38 32.83 2q5i s VAL 612 CO 0.00 0.04 1.47 0.00 0.00 0.00 0.00 175.10 176.60 2q5i h ALA 613 N 7.19 0.26 -2.33 5.51 0.00 -1.59 -3.44 119.26 124.86 2q5i h ALA 613 Ca -0.42 -0.23 -0.36 0.00 0.00 0.00 0.00 54.91 53.90 2q5i h ALA 613 Cb 1.20 -0.07 -0.14 0.00 0.00 0.00 0.00 17.79 18.78 2q5i h ALA 613 CO 0.90 0.02 -0.60 -0.06 0.00 0.00 0.00 179.25 179.50 2q5i s PHE 614 N -4.82 1.54 -0.16 0.00 0.08 0.51 -1.97 117.98 113.16 2q5i s PHE 614 Ca -0.14 -1.22 -0.14 0.00 0.12 0.00 0.00 56.93 55.55 2q5i s PHE 614 Cb 0.06 -0.89 0.04 0.00 -0.57 0.00 0.00 43.02 41.67 2q5i s PHE 614 CO 0.74 -0.38 0.43 0.20 -0.10 0.00 0.00 175.22 176.11 2q5i s GLY 615 N -3.32 -0.32 -0.22 4.36 0.00 -0.87 -1.03 107.32 105.92 2q5i s GLY 615 Ca 0.37 1.22 0.01 0.00 0.00 0.00 0.00 44.72 46.33 2q5i s GLY 615 CO 0.14 1.08 -0.08 0.14 0.00 0.00 0.00 173.10 174.38 2q5i s VAL 616 N 0.30 1.62 -0.12 1.40 1.01 0.07 -0.42 120.40 124.26 2q5i s VAL 616 Ca -0.01 -1.16 -0.21 0.00 0.00 0.00 0.00 61.98 60.60 2q5i s VAL 616 Cb -0.03 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 2q5i s VAL 616 CO -0.00 0.02 0.62 -0.89 0.00 0.00 0.00 175.10 174.84 2q5i s THR 617 N 1.37 5.08 -0.29 3.92 2.01 -0.39 -1.46 115.64 125.88 2q5i s THR 617 Ca -0.04 1.23 -0.05 0.00 0.31 0.00 0.00 61.69 63.13 2q5i s THR 617 Cb -0.18 -3.95 0.02 0.00 0.01 0.00 0.00 72.50 68.40 2q5i s THR 617 CO -0.07 0.23 0.05 -0.63 -0.69 0.00 0.00 174.62 173.51 2q5i s ILE 618 N 1.10 3.68 0.26 1.82 1.01 -0.30 -2.12 121.20 126.64 2q5i s ILE 618 Ca 0.32 -0.84 0.00 0.00 0.00 0.00 0.00 60.65 60.13 2q5i s ILE 618 Cb -0.16 -2.92 0.00 0.00 0.01 0.00 0.00 42.46 39.39 2q5i s ILE 618 CO 0.13 0.07 0.03 -0.90 0.00 0.00 0.00 174.94 174.27 2q5i n ASP 619 N 4.81 2.59 -0.17 3.58 5.68 -1.26 -0.38 116.55 131.39 2q5i n ASP 619 Ca -0.15 -2.09 -0.03 0.00 -0.50 0.00 0.00 54.79 52.02 2q5i n ASP 619 Cb 0.47 0.15 0.17 0.00 -1.14 0.00 0.00 41.12 40.77 2q5i n ASP 619 CO 0.00 0.00 0.00 -0.26 -1.33 0.00 0.00 177.20 175.61 2q5i h PHE 620 N 1.05 0.95 -0.79 2.11 -1.00 -1.98 -1.78 116.94 115.49 2q5i h PHE 620 Ca -0.21 -0.08 -0.01 0.00 2.81 0.00 0.00 57.97 60.49 2q5i h PHE 620 Cb 0.64 -0.28 -0.04 0.00 3.61 0.00 0.00 35.95 39.88 2q5i h PHE 620 CO 0.00 0.76 0.45 -0.44 -1.61 0.00 0.00 178.31 177.47 2q5i h ASP 621 N 0.90 0.97 -0.59 2.17 5.19 -1.96 0.23 116.42 123.34 2q5i h ASP 621 Ca 0.20 -0.07 0.07 0.00 -0.62 0.00 0.00 57.03 56.62 2q5i h ASP 621 Cb 0.25 -0.24 -0.06 0.00 0.18 0.00 0.00 39.33 39.45 2q5i h ASP 621 CO -0.01 0.76 0.27 0.74 -3.12 0.00 0.00 179.24 177.88 2q5i h THR 622 N 1.10 0.87 0.03 0.35 2.02 -1.46 0.12 112.91 115.94 2q5i h THR 622 Ca 0.28 -0.17 -0.23 0.00 0.77 0.00 0.00 66.41 67.06 2q5i h THR 622 Cb -0.00 0.33 -0.03 0.00 -1.74 0.00 0.00 68.15 66.72 2q5i h THR 622 CO -0.05 0.09 -1.11 0.58 0.37 0.00 0.00 175.52 175.40 2q5i h VAL 623 N 0.49 1.60 0.00 3.16 2.07 -1.10 -3.39 116.25 119.09 2q5i h VAL 623 Ca 0.28 -3.29 -0.30 0.00 0.82 0.00 0.00 66.70 64.20 2q5i h VAL 623 Cb 0.26 2.83 -0.06 0.00 -1.52 0.00 0.00 31.29 32.81 2q5i h VAL 623 CO -0.23 0.92 -2.14 0.59 0.02 0.00 0.00 177.57 176.74 2q5i n ASN 624 N -3.36 1.60 -4.75 0.57 3.02 0.76 -4.94 115.26 108.16 2q5i n ASN 624 Ca -0.03 -0.05 -0.40 0.00 -0.03 0.00 0.00 54.58 54.07 2q5i n ASN 624 Cb 0.97 0.38 -0.05 0.00 -0.61 0.00 0.00 39.78 40.46 2q5i n ASN 624 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2q5i s LYS 625 N -2.40 4.46 -0.06 3.52 3.01 0.39 -5.04 119.74 123.62 2q5i s LYS 625 Ca -0.16 1.00 -0.19 0.00 -1.01 0.00 0.00 55.97 55.60 2q5i s LYS 625 Cb 0.06 -3.36 -0.05 0.00 -1.01 0.00 0.00 37.83 33.47 2q5i s LYS 625 CO 0.58 0.29 0.53 -0.08 0.51 0.00 0.00 175.35 177.18 2q5i s THR 626 N -0.03 5.06 0.73 2.17 -1.32 -1.26 -3.47 115.64 117.51 2q5i s THR 626 Ca 0.37 1.09 -0.11 0.00 -1.21 0.00 0.00 61.69 61.83 2q5i s THR 626 Cb -0.20 -3.86 0.03 0.00 -1.51 0.00 0.00 72.50 66.95 2q5i s THR 626 CO 0.22 0.38 1.08 -2.84 -2.21 0.00 0.00 174.62 171.25 2q5i s PRO 627 N 0.16 2.68 -0.55 7.08 0.02 -1.26 -5.09 135.00 138.04 2q5i s PRO 627 Ca 0.28 0.68 -0.25 0.00 0.02 0.00 0.00 61.00 61.74 2q5i s PRO 627 Cb -0.17 -1.98 0.04 0.00 0.02 0.00 0.00 34.50 32.41 2q5i s PRO 627 CO 0.14 -1.21 0.96 -1.01 -0.33 0.00 0.00 177.00 175.54 2q5i s HIS 628 N -3.19 2.79 0.21 6.54 3.76 -1.23 -4.95 115.29 119.22 2q5i s HIS 628 Ca 0.59 0.05 0.10 0.00 -0.15 0.00 0.00 55.06 55.64 2q5i s HIS 628 Cb -0.13 -4.10 -0.04 0.00 1.11 0.00 0.00 32.58 29.42 2q5i s HIS 628 CO 0.54 -1.35 -0.12 0.95 -0.85 0.00 0.00 174.74 173.91 2q5i s THR 629 N 4.01 3.01 0.04 1.30 -4.23 -1.26 -0.21 115.64 118.30 2q5i s THR 629 Ca 0.32 -1.85 -0.01 0.00 -1.18 0.00 0.00 61.69 58.97 2q5i s THR 629 Cb -0.12 -2.51 -0.03 0.00 1.34 0.00 0.00 72.50 71.17 2q5i s THR 629 CO 0.20 -0.19 -0.02 0.00 -0.54 0.00 0.00 174.62 174.08 2q5i s ALA 630 N -1.89 0.36 0.03 3.99 0.00 -0.16 -3.95 121.76 120.14 2q5i s ALA 630 Ca 0.26 -1.00 -0.29 0.00 0.00 0.00 0.00 51.96 50.93 2q5i s ALA 630 Cb -0.08 0.24 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 2q5i s ALA 630 CO 0.15 -0.32 0.92 0.99 0.00 0.00 0.00 175.76 177.51 2q5i s THR 631 N -3.21 4.76 -0.18 0.00 2.01 -0.90 -2.73 115.64 115.39 2q5i s THR 631 Ca 0.00 1.95 -0.05 0.00 0.31 0.00 0.00 61.69 63.91 2q5i s THR 631 Cb 0.03 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.24 2q5i s THR 631 CO -0.07 0.24 -0.01 -0.22 -0.69 0.00 0.00 174.62 173.87 2q5i s LEU 632 N 0.58 3.34 -0.11 4.42 2.96 0.05 -1.26 118.68 128.66 2q5i s LEU 632 Ca 0.48 -0.12 0.04 0.00 -0.22 0.00 0.00 54.13 54.30 2q5i s LEU 632 Cb -0.21 -1.83 0.00 0.00 0.50 0.00 0.00 46.19 44.65 2q5i s LEU 632 CO 0.27 0.13 -0.23 -0.60 -1.32 0.00 0.00 176.35 174.60 2q5i s ARG 633 N 0.60 3.05 -0.12 1.98 3.52 0.43 -0.72 118.95 127.71 2q5i s ARG 633 Ca -0.01 -0.87 -0.23 0.00 -0.13 0.00 0.00 55.73 54.50 2q5i s ARG 633 Cb -0.14 -2.34 -0.03 0.00 -1.56 0.00 0.00 34.95 30.88 2q5i s ARG 633 CO 0.02 0.14 0.69 0.34 -0.81 0.00 0.00 175.30 175.67 2q5i s ASP 634 N 0.45 6.89 0.09 -2.12 -1.08 -0.39 -2.04 116.67 118.46 2q5i s ASP 634 Ca -0.16 1.07 -0.27 0.00 -0.52 0.00 0.00 52.55 52.67 2q5i s ASP 634 Cb -0.17 -2.39 -0.15 0.00 -1.46 0.00 0.00 42.92 38.75 2q5i s ASP 634 CO 0.06 -0.18 1.68 -0.09 0.52 0.00 0.00 175.17 177.15 2q5i h ARG 635 N 7.01 -0.42 0.52 4.34 2.43 -1.68 0.27 114.38 126.85 2q5i h ARG 635 Ca -0.37 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 58.80 2q5i h ARG 635 Cb 1.17 0.10 0.01 0.00 -0.42 0.00 0.00 29.97 30.82 2q5i h ARG 635 CO 0.77 -0.28 -0.25 -0.44 -1.51 0.00 0.00 179.97 178.26 2q5i h ASP 636 N -0.44 -0.59 1.38 -3.80 3.32 -1.93 -3.15 116.42 111.20 2q5i h ASP 636 Ca -0.03 0.01 -0.13 0.00 0.02 0.00 0.00 57.03 56.91 2q5i h ASP 636 Cb 0.37 0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 2q5i h ASP 636 CO 0.02 -0.40 -0.62 0.77 -1.72 0.00 0.00 179.24 177.29 2q5i h SER 637 N -0.73 0.00 0.00 6.45 4.64 -1.99 -3.47 113.55 118.45 2q5i h SER 637 Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2q5i h SER 637 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 2q5i h SER 637 CO 0.12 0.59 0.00 0.23 -0.87 0.00 0.00 176.83 176.90 2q5i n MET 638 N -3.23 -1.00 -2.52 4.77 2.81 0.96 -5.00 117.12 113.90 2q5i n MET 638 Ca 0.01 0.25 -0.35 0.00 -1.81 0.00 0.00 57.70 55.80 2q5i n MET 638 Cb 0.77 -4.06 -0.03 0.00 -0.71 0.00 0.00 33.22 29.19 2q5i n MET 638 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2q5i s ARG 639 N -1.05 3.95 0.18 0.03 0.52 -1.25 -4.73 118.95 116.61 2q5i s ARG 639 Ca 0.00 1.46 0.08 0.00 -0.52 0.00 0.00 55.73 56.75 2q5i s ARG 639 Cb 0.00 -2.31 -0.04 0.00 0.52 0.00 0.00 34.95 33.12 2q5i s ARG 639 CO 0.00 -0.32 -0.17 -0.65 0.02 0.00 0.00 175.30 174.19 2q5i s GLN 640 N -2.87 1.30 0.07 3.54 -0.21 -1.25 -1.26 119.66 118.97 2q5i s GLN 640 Ca 0.63 -1.49 -0.02 0.00 0.02 0.00 0.00 55.36 54.51 2q5i s GLN 640 Cb -0.20 -1.25 -0.04 0.00 1.00 0.00 0.00 33.01 32.53 2q5i s GLN 640 CO 0.24 0.24 0.01 0.42 -2.12 0.00 0.00 175.29 174.08 2q5i s ILE 641 N -2.43 0.19 -0.22 1.08 -1.09 0.11 -1.90 121.20 116.93 2q5i s ILE 641 Ca 0.19 -1.77 -0.01 0.00 -2.23 0.00 0.00 60.65 56.82 2q5i s ILE 641 Cb -0.04 -1.60 0.06 0.00 -1.58 0.00 0.00 42.46 39.30 2q5i s ILE 641 CO 0.07 -0.87 0.00 -0.60 -1.23 0.00 0.00 174.94 172.32 2q5i s ARG 642 N -3.94 1.08 0.24 2.79 6.06 -0.56 -0.77 118.95 123.84 2q5i s ARG 642 Ca 0.10 -0.74 0.05 0.00 -2.50 0.00 0.00 55.73 52.64 2q5i s ARG 642 Cb 0.08 -2.32 -0.05 0.00 0.06 0.00 0.00 34.95 32.71 2q5i s ARG 642 CO -0.08 -0.66 -0.04 0.00 -2.50 0.00 0.00 175.30 172.02 2q5i s ALA 643 N 1.63 1.98 0.26 6.12 0.00 -1.11 -4.09 121.76 126.54 2q5i s ALA 643 Ca -0.02 -1.78 -0.30 0.00 0.00 0.00 0.00 51.96 49.85 2q5i s ALA 643 Cb -0.18 0.32 -0.11 0.00 0.00 0.00 0.00 23.12 23.15 2q5i s ALA 643 CO -0.09 -0.16 1.54 -2.00 0.00 0.00 0.00 175.76 175.05 2q5i s GLU 644 N -3.79 4.19 0.44 0.00 2.12 -1.26 -0.99 118.70 119.41 2q5i s GLU 644 Ca 0.27 2.45 0.24 0.00 0.36 0.00 0.00 54.97 58.29 2q5i s GLU 644 Cb 0.04 -3.07 1.25 0.00 0.26 0.00 0.00 34.13 32.61 2q5i s GLU 644 CO 0.09 -0.55 1.78 0.97 -0.54 0.00 0.00 175.26 177.01 2q5i h ILE 645 N 3.54 0.48 0.00 -3.70 6.09 -0.89 0.18 117.51 123.22 2q5i h ILE 645 Ca -0.46 -0.09 -0.12 0.00 -1.37 0.00 0.00 64.86 62.82 2q5i h ILE 645 Cb 1.22 0.20 -0.02 0.00 0.47 0.00 0.00 36.82 38.69 2q5i h ILE 645 CO 0.81 0.05 -0.58 0.77 -3.07 0.00 0.00 178.15 176.13 2q5i h SER 646 N 0.26 0.00 1.37 2.19 4.64 -1.89 -3.26 113.55 116.86 2q5i h SER 646 Ca 0.59 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.79 2q5i h SER 646 Cb 1.75 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.82 2q5i h SER 646 CO -0.21 0.58 -0.56 -0.33 -0.87 0.00 0.00 176.83 175.44 2q5i h GLU 647 N 0.00 0.00 -0.89 4.77 5.08 -1.00 -3.39 114.58 119.15 2q5i h GLU 647 Ca -0.01 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2q5i h GLU 647 Cb 1.10 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.31 2q5i h GLU 647 CO 0.08 0.56 0.53 -0.07 -1.00 0.00 0.00 179.01 179.10 2q5i h LEU 648 N 0.00 1.08 -0.49 1.33 3.38 -1.55 -2.78 115.31 116.29 2q5i h LEU 648 Ca -0.01 -0.07 0.09 0.00 0.09 0.00 0.00 57.88 57.99 2q5i h LEU 648 Cb 1.39 -0.27 -0.08 0.00 0.09 0.00 0.00 40.66 41.79 2q5i h LEU 648 CO 0.07 0.84 0.01 -0.65 0.09 0.00 0.00 178.44 178.80 2q5i h PRO 649 N 1.24 0.12 0.00 1.13 0.11 -1.77 0.15 132.00 132.97 2q5i h PRO 649 Ca 0.32 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 66.33 2q5i h PRO 649 Cb -0.03 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 2q5i h PRO 649 CO -0.06 0.08 -0.46 0.66 -0.21 0.00 0.00 178.00 178.02 2q5i h SER 650 N 0.13 0.00 -0.30 -2.05 4.64 -1.80 -1.89 113.55 112.28 2q5i h SER 650 Ca 0.25 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.43 2q5i h SER 650 Cb 0.36 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2q5i h SER 650 CO -0.40 0.46 -0.33 0.40 -0.87 0.00 0.00 176.83 176.09 2q5i h ILE 651 N 0.00 1.30 -0.41 0.95 2.04 -0.98 -2.40 117.51 118.01 2q5i h ILE 651 Ca -0.00 -1.51 -0.10 0.00 1.00 0.00 0.00 64.86 64.25 2q5i h ILE 651 Cb 0.81 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 38.46 2q5i h ILE 651 CO 0.06 0.49 -0.12 0.58 0.00 0.00 0.00 178.15 179.15 2q5i h VAL 652 N 0.50 1.28 -0.46 1.67 2.07 -0.66 -2.18 116.25 118.46 2q5i h VAL 652 Ca 0.04 -1.23 0.05 0.00 0.82 0.00 0.00 66.70 66.38 2q5i h VAL 652 Cb 0.91 1.21 -0.05 0.00 -1.52 0.00 0.00 31.29 31.85 2q5i h VAL 652 CO 0.08 0.41 0.20 -0.61 0.02 0.00 0.00 177.57 177.68 2q5i h GLN 653 N 0.63 0.39 -0.52 1.57 4.15 -1.34 0.19 115.11 120.17 2q5i h GLN 653 Ca 0.10 -0.02 -0.12 0.00 0.77 0.00 0.00 58.65 59.38 2q5i h GLN 653 Cb 0.66 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 28.24 2q5i h GLN 653 CO 0.05 0.26 -0.14 -0.44 -1.93 0.00 0.00 178.83 176.62 2q5i h ASP 654 N 0.40 1.01 0.43 -0.69 3.32 -1.38 0.22 116.42 119.73 2q5i h ASP 654 Ca 0.21 -0.35 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 2q5i h ASP 654 Cb 0.16 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.44 2q5i h ASP 654 CO -0.18 1.14 -0.21 -0.07 -1.72 0.00 0.00 179.24 178.20 2q5i h LEU 655 N 0.89 -0.51 -1.27 1.55 3.38 -1.03 -0.02 115.31 118.29 2q5i h LEU 655 Ca 0.13 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.22 2q5i h LEU 655 Cb 0.71 0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.54 2q5i h LEU 655 CO 0.05 -0.36 0.55 0.00 0.09 0.00 0.00 178.44 178.77 2q5i h ALA 656 N -0.01 1.70 -0.28 1.53 0.00 -0.47 -1.69 119.26 120.04 2q5i h ALA 656 Ca -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2q5i h ALA 656 Cb 0.46 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2q5i h ALA 656 CO 0.09 0.12 0.00 0.09 0.00 0.00 0.00 179.25 179.55 2q5i n ASN 657 N -4.52 2.04 -0.63 0.00 5.03 0.05 -4.58 115.26 112.66 2q5i n ASN 657 Ca 0.14 -1.85 -0.08 0.00 0.87 0.00 0.00 54.58 53.66 2q5i n ASN 657 Cb 0.32 -0.19 -0.04 0.00 -1.02 0.00 0.00 39.78 38.86 2q5i n ASN 657 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2q5i n GLY 658 N 1.17 0.95 0.20 7.41 0.00 -0.63 -4.87 105.19 109.43 2q5i n GLY 658 Ca 0.15 -0.30 0.09 0.00 0.00 0.00 0.00 46.02 45.97 2q5i n GLY 658 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2q5i h ASN 659 N 0.00 0.00 -4.74 1.61 -0.26 -1.28 -3.46 115.58 107.46 2q5i h ASN 659 Ca -0.17 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.40 2q5i h ASN 659 Cb 0.74 0.00 -0.22 0.00 -1.06 0.00 0.00 38.32 37.77 2q5i h ASN 659 CO 0.25 0.26 -0.67 -0.63 -1.06 0.00 0.00 177.43 175.57 2q5i s ILE 660 N -3.40 0.09 0.36 2.81 1.09 -1.12 -5.00 121.20 116.03 2q5i s ILE 660 Ca 0.02 -0.70 -0.01 0.00 -1.10 0.00 0.00 60.65 58.86 2q5i s ILE 660 Cb 0.09 -0.24 -0.04 0.00 -1.06 0.00 0.00 42.46 41.21 2q5i s ILE 660 CO 0.66 -0.39 0.59 -0.89 -0.10 0.00 0.00 174.94 174.81 2q5i s THR 661 N -1.16 5.07 0.17 2.92 2.01 -1.26 -4.33 115.64 119.05 2q5i s THR 661 Ca -0.13 -0.31 -0.14 0.00 0.31 0.00 0.00 61.69 61.42 2q5i s THR 661 Cb -0.08 -3.85 0.06 0.00 0.01 0.00 0.00 72.50 68.64 2q5i s THR 661 CO -0.00 -0.58 1.78 -0.25 -0.69 0.00 0.00 174.62 174.87 2q5i h TRP 662 N 0.77 0.40 -0.80 4.92 2.91 -2.00 -1.71 115.95 120.45 2q5i h TRP 662 Ca -0.49 0.02 0.18 0.00 1.13 0.00 0.00 58.89 59.73 2q5i h TRP 662 Cb 1.21 -0.11 -0.12 0.00 -0.51 0.00 0.00 29.16 29.63 2q5i h TRP 662 CO 0.53 0.20 0.25 0.00 -1.03 0.00 0.00 178.44 178.38 2q5i h ALA 663 N 1.25 1.13 0.02 2.65 0.00 -1.99 -0.39 119.26 121.93 2q5i h ALA 663 Ca 0.20 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.30 2q5i h ALA 663 Cb 0.12 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2q5i h ALA 663 CO -0.15 -0.35 -0.11 -0.44 0.00 0.00 0.00 179.25 178.21 2q5i h ASP 664 N 0.31 -0.32 -0.53 0.00 3.32 -1.74 -0.88 116.42 116.58 2q5i h ASP 664 Ca 0.47 0.05 0.10 0.00 0.02 0.00 0.00 57.03 57.67 2q5i h ASP 664 Cb 0.85 0.13 -0.09 0.00 0.22 0.00 0.00 39.33 40.45 2q5i h ASP 664 CO -0.53 -0.16 0.01 0.58 -1.72 0.00 0.00 179.24 177.42 2q5i h VAL 665 N -0.20 0.59 -0.59 -1.35 2.07 -0.40 -1.79 116.25 114.59 2q5i h VAL 665 Ca 0.04 -0.04 -0.04 0.00 0.82 0.00 0.00 66.70 67.47 2q5i h VAL 665 Cb 0.24 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 2q5i h VAL 665 CO -0.10 0.02 0.20 -0.33 0.02 0.00 0.00 177.57 177.38 2q5i h GLU 666 N 0.13 0.88 0.00 1.57 5.08 -0.72 0.14 114.58 121.66 2q5i h GLU 666 Ca 0.27 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.44 2q5i h GLU 666 Cb 0.41 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 2q5i h GLU 666 CO -0.43 0.75 -0.14 0.00 -1.00 0.00 0.00 179.01 178.18 2q5i h ALA 667 N 1.36 1.26 0.00 3.43 0.00 -0.34 -3.27 119.26 121.70 2q5i h ALA 667 Ca 0.20 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.80 2q5i h ALA 667 Cb 0.23 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2q5i h ALA 667 CO -0.01 0.18 -2.05 0.54 0.00 0.00 0.00 179.25 177.91 2q5i n ARG 668 N -3.63 0.90 -4.29 0.00 1.74 -0.63 -5.02 116.66 105.73 2q5i n ARG 668 Ca -0.02 -0.08 -0.23 0.00 -0.77 0.00 0.00 57.85 56.76 2q5i n ARG 668 Cb 0.27 -1.45 -0.12 0.00 -1.02 0.00 0.00 32.46 30.14 2q5i n ARG 668 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2q5i s TYR 669 N -2.81 1.73 0.17 -1.55 1.51 0.40 -5.10 117.35 111.71 2q5i s TYR 669 Ca -0.08 -0.44 -0.31 0.00 -1.01 0.00 0.00 57.07 55.23 2q5i s TYR 669 Cb 0.08 -0.92 -0.09 0.00 -0.11 0.00 0.00 41.96 40.92 2q5i s TYR 669 CO 0.74 0.22 1.43 -1.25 -1.11 0.00 0.00 175.55 175.58 2q5i s PRO 670 N -2.17 4.30 0.58 -1.71 0.04 -1.26 -4.61 135.00 130.17 2q5i s PRO 670 Ca 0.08 2.19 -0.18 0.00 0.04 0.00 0.00 61.00 63.13 2q5i s PRO 670 Cb -0.09 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.23 2q5i s PRO 670 CO 0.05 -0.44 1.15 -0.51 0.04 0.00 0.00 177.00 177.29 2q5i s LEU 671 N 0.54 3.65 -0.11 -3.56 1.43 -1.26 -1.50 118.68 117.87 2q5i s LEU 671 Ca 0.63 2.21 -0.11 0.00 -1.03 0.00 0.00 54.13 55.83 2q5i s LEU 671 Cb -0.40 -4.58 0.03 0.00 0.03 0.00 0.00 46.19 41.27 2q5i s LEU 671 CO 0.35 -1.42 0.30 0.12 0.23 0.00 0.00 176.35 175.94 2q5i s PHE 672 N -1.82 -0.33 0.00 0.29 5.36 -0.80 -4.76 117.98 115.92 2q5i s PHE 672 Ca 0.73 0.80 0.00 0.00 -0.96 0.00 0.00 56.93 57.50 2q5i s PHE 672 Cb -0.25 0.11 0.00 0.00 -0.34 0.00 0.00 43.02 42.54 2q5i s PHE 672 CO 0.31 -0.17 0.31 -1.91 -1.46 0.00 0.00 175.22 172.31