#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k8l s THR 45 N 0.00 2.13 0.24 -0.99 -1.32 0.01 -4.91 115.64 110.79 3k8l s THR 45 Ca 0.00 -1.79 -0.26 0.00 -1.21 0.00 0.00 61.69 58.42 3k8l s THR 45 Cb 0.00 -1.92 -0.09 0.00 -1.51 0.00 0.00 72.50 68.98 3k8l s THR 45 CO 0.00 -0.03 0.87 0.00 -2.21 0.00 0.00 174.62 173.25 3k8l s ALA 46 N -1.31 3.35 0.19 11.08 0.00 -1.26 0.93 121.76 134.74 3k8l s ALA 46 Ca 0.14 0.46 -0.27 0.00 0.00 0.00 0.00 51.96 52.29 3k8l s ALA 46 Cb -0.09 -3.08 -0.08 0.00 0.00 0.00 0.00 23.12 19.87 3k8l s ALA 46 CO 0.07 0.24 0.84 -0.51 0.00 0.00 0.00 175.76 176.40 3k8l s LEU 47 N -1.48 4.61 -0.26 0.00 1.43 -1.08 -4.83 118.68 117.07 3k8l s LEU 47 Ca 0.42 1.76 0.02 0.00 -1.03 0.00 0.00 54.13 55.30 3k8l s LEU 47 Cb -0.22 -3.42 0.06 0.00 0.03 0.00 0.00 46.19 42.64 3k8l s LEU 47 CO 0.27 0.18 -0.07 0.42 0.23 0.00 0.00 176.35 177.37 3k8l s THR 48 N -1.09 1.97 0.23 5.49 -4.23 -1.26 -5.00 115.64 111.75 3k8l s THR 48 Ca 0.38 -1.58 -0.30 0.00 -1.18 0.00 0.00 61.69 59.01 3k8l s THR 48 Cb -0.24 -2.17 -0.09 0.00 1.34 0.00 0.00 72.50 71.34 3k8l s THR 48 CO 0.28 -0.12 1.36 0.00 -0.54 0.00 0.00 174.62 175.60 3k8l s ALA 49 N 1.18 3.57 -0.38 3.99 0.00 -1.26 -4.66 121.76 124.19 3k8l s ALA 49 Ca -0.06 1.20 0.11 0.00 0.00 0.00 0.00 51.96 53.21 3k8l s ALA 49 Cb -0.20 -3.51 0.32 0.00 0.00 0.00 0.00 23.12 19.73 3k8l s ALA 49 CO -0.06 -0.62 0.66 -1.13 0.00 0.00 0.00 175.76 174.61 3k8l n SER 50 N 2.40 0.67 -4.78 0.00 3.41 0.14 -4.96 113.62 110.50 3k8l n SER 50 Ca 0.06 -2.91 -0.34 0.00 -0.26 0.00 0.00 58.87 55.42 3k8l n SER 50 Cb 0.42 -0.63 0.01 0.00 -0.26 0.00 0.00 64.21 63.75 3k8l n SER 50 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 3k8l s PRO 51 N -2.02 3.31 0.87 4.33 0.04 -1.26 -4.86 135.00 135.42 3k8l s PRO 51 Ca 0.38 1.42 -0.11 0.00 0.04 0.00 0.00 61.00 62.73 3k8l s PRO 51 Cb 0.29 -2.02 0.12 0.00 0.04 0.00 0.00 34.50 32.93 3k8l s PRO 51 CO -0.09 -0.85 1.17 -0.51 0.04 0.00 0.00 177.00 176.76 3k8l s ASP 52 N -2.22 3.23 0.07 6.66 1.11 -1.26 -4.93 116.67 119.32 3k8l s ASP 52 Ca 0.68 2.25 -0.31 0.00 0.18 0.00 0.00 52.55 55.36 3k8l s ASP 52 Cb -0.20 -2.57 -0.06 0.00 1.07 0.00 0.00 42.92 41.15 3k8l s ASP 52 CO 0.31 -2.91 1.31 -0.89 1.18 0.00 0.00 175.17 174.18 3k8l s THR 53 N -2.46 3.69 0.02 -1.27 2.01 -1.26 -4.97 115.64 111.40 3k8l s THR 53 Ca 0.69 1.19 -0.30 0.00 0.31 0.00 0.00 61.69 63.57 3k8l s THR 53 Cb -0.25 -3.76 -0.06 0.00 0.01 0.00 0.00 72.50 68.44 3k8l s THR 53 CO 0.55 0.07 1.37 0.86 -0.69 0.00 0.00 174.62 176.78 3k8l s TRP 54 N 1.36 2.99 -1.94 4.92 -0.00 -1.26 -4.89 118.94 120.11 3k8l s TRP 54 Ca 0.62 0.90 0.02 0.00 -0.00 0.00 0.00 56.10 57.64 3k8l s TRP 54 Cb -0.33 -3.63 0.05 0.00 -0.00 0.00 0.00 33.47 29.56 3k8l s TRP 54 CO 0.29 -2.28 1.02 -0.40 -0.00 0.00 0.00 176.95 175.57 3k8l n ASP 55 N 4.99 0.35 -0.41 5.86 5.68 -1.26 -4.87 116.55 126.89 3k8l n ASP 55 Ca 0.12 -2.00 -0.05 0.00 -0.50 0.00 0.00 54.79 52.36 3k8l n ASP 55 Cb 0.44 -0.06 -0.02 0.00 -1.14 0.00 0.00 41.12 40.33 3k8l n ASP 55 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3k8l n GLU 56 N -0.32 -0.42 -3.59 0.11 1.02 -1.26 -5.02 120.64 111.16 3k8l n GLU 56 Ca 0.02 0.66 -0.38 0.00 -0.02 0.00 0.00 57.16 57.44 3k8l n GLU 56 Cb 0.06 -4.38 -0.11 0.00 -0.02 0.00 0.00 31.44 26.99 3k8l n GLU 56 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3k8l s THR 57 N -2.18 5.22 -1.12 2.62 2.01 -1.26 -5.01 115.64 115.92 3k8l s THR 57 Ca 0.00 0.06 -0.22 0.00 0.31 0.00 0.00 61.69 61.84 3k8l s THR 57 Cb 0.00 -3.52 -0.01 0.00 0.01 0.00 0.00 72.50 68.97 3k8l s THR 57 CO 0.00 0.20 1.80 -0.54 -0.69 0.00 0.00 174.62 175.39 3k8l s LYS 58 N 1.74 3.09 0.24 4.92 1.02 -1.26 -4.67 119.74 124.82 3k8l s LYS 58 Ca 0.07 -1.16 0.04 0.00 0.02 0.00 0.00 55.97 54.94 3k8l s LYS 58 Cb -0.16 -5.30 0.28 0.00 -0.52 0.00 0.00 37.83 32.13 3k8l s LYS 58 CO 0.10 -3.08 1.58 0.00 -0.92 0.00 0.00 175.35 173.04 3k8l h ARG 59 N 9.56 0.26 -7.59 1.68 3.08 -1.85 -3.45 114.38 116.06 3k8l h ARG 59 Ca 0.24 -0.17 -0.45 0.00 0.07 0.00 0.00 59.98 59.68 3k8l h ARG 59 Cb 0.95 0.02 0.14 0.00 0.08 0.00 0.00 29.97 31.16 3k8l h ARG 59 CO 1.32 0.75 0.33 0.00 -1.07 0.00 0.00 179.97 181.30 3k8l s ALA 60 N -3.84 1.89 -0.62 0.04 0.00 -1.26 -4.75 121.76 113.22 3k8l s ALA 60 Ca -0.04 -0.79 0.06 0.00 0.00 0.00 0.00 51.96 51.19 3k8l s ALA 60 Cb 0.12 -2.93 0.27 0.00 0.00 0.00 0.00 23.12 20.58 3k8l s ALA 60 CO 0.80 -2.41 0.79 -3.47 0.00 0.00 0.00 175.76 171.47 3k8l n ASP 61 N -3.83 3.87 -4.66 0.00 2.03 -1.26 -4.84 116.55 107.85 3k8l n ASP 61 Ca 0.10 -3.49 -0.39 0.00 0.52 0.00 0.00 54.79 51.53 3k8l n ASP 61 Cb 0.60 -0.64 -0.07 0.00 -0.72 0.00 0.00 41.12 40.28 3k8l n ASP 61 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3k8l s ILE 62 N -2.95 5.14 0.10 5.18 1.01 -1.26 -3.78 121.20 124.63 3k8l s ILE 62 Ca 0.42 0.85 0.06 0.00 0.00 0.00 0.00 60.65 61.99 3k8l s ILE 62 Cb 0.18 -3.80 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 3k8l s ILE 62 CO -0.04 0.20 -0.06 -0.44 0.00 0.00 0.00 174.94 174.60 3k8l s SER 63 N 1.13 4.67 -0.17 3.58 0.01 -0.54 -0.06 113.70 122.33 3k8l s SER 63 Ca 0.22 -0.30 0.01 0.00 1.31 0.00 0.00 55.95 57.19 3k8l s SER 63 Cb -0.15 -1.00 0.02 0.00 0.21 0.00 0.00 66.02 65.10 3k8l s SER 63 CO 0.09 0.18 -0.18 -0.47 0.41 0.00 0.00 173.24 173.26 3k8l s TYR 64 N -1.26 2.59 -0.12 2.43 5.04 -0.15 0.19 117.35 126.07 3k8l s TYR 64 Ca 0.23 -1.51 -0.19 0.00 -2.44 0.00 0.00 57.07 53.16 3k8l s TYR 64 Cb -0.11 -1.82 -0.04 0.00 0.35 0.00 0.00 41.96 40.34 3k8l s TYR 64 CO 0.16 -0.76 0.54 -1.14 -1.34 0.00 0.00 175.55 173.00 3k8l s GLN 65 N 1.34 4.34 0.08 4.97 0.74 0.61 -1.44 119.66 130.30 3k8l s GLN 65 Ca 0.05 0.54 0.03 0.00 0.05 0.00 0.00 55.36 56.03 3k8l s GLN 65 Cb -0.13 -3.46 -0.04 0.00 1.10 0.00 0.00 33.01 30.48 3k8l s GLN 65 CO -0.12 0.08 -0.08 -0.48 -0.55 0.00 0.00 175.29 174.14 3k8l s LEU 66 N 0.85 2.40 -0.36 3.68 0.05 -0.82 -0.75 118.68 123.73 3k8l s LEU 66 Ca 0.28 -0.81 -0.08 0.00 0.05 0.00 0.00 54.13 53.57 3k8l s LEU 66 Cb -0.16 -0.19 0.04 0.00 -2.05 0.00 0.00 46.19 43.83 3k8l s LEU 66 CO 0.12 -0.32 0.15 -0.76 -0.55 0.00 0.00 176.35 174.99 3k8l s LEU 67 N -2.44 4.51 0.33 1.48 1.02 -1.26 -2.82 118.68 119.50 3k8l s LEU 67 Ca 0.04 -1.13 0.11 0.00 0.02 0.00 0.00 54.13 53.17 3k8l s LEU 67 Cb -0.02 -1.93 0.95 0.00 0.02 0.00 0.00 46.19 45.22 3k8l s LEU 67 CO -0.01 -0.36 1.70 -0.07 0.02 0.00 0.00 176.35 177.62 3k8l h LEU 68 N 8.30 0.57 -0.84 1.79 3.38 -1.94 0.98 115.31 127.55 3k8l h LEU 68 Ca -0.24 0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 3k8l h LEU 68 Cb 1.09 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.93 3k8l h LEU 68 CO 0.63 -0.01 -0.07 0.10 0.09 0.00 0.00 178.44 179.19 3k8l h TYR 69 N 0.45 0.00 -0.03 1.13 -0.00 -1.92 -2.96 116.97 113.66 3k8l h TYR 69 Ca 0.67 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.40 3k8l h TYR 69 Cb 1.40 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.13 3k8l h TYR 69 CO -0.02 0.07 0.00 -1.13 -0.00 0.00 0.00 178.16 177.07 3k8l n SER 70 N -3.15 1.55 0.00 0.10 3.41 -0.08 -1.42 113.62 114.02 3k8l n SER 70 Ca 0.02 -1.31 0.00 0.00 -0.26 0.00 0.00 58.87 57.32 3k8l n SER 70 Cb 0.43 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 3k8l n SER 70 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 3k8l n PHE 71 N 0.24 0.00 -3.74 7.33 7.35 0.14 -2.20 117.46 126.58 3k8l n PHE 71 Ca 0.03 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.56 3k8l n PHE 71 Cb 0.15 -0.22 -0.16 0.00 0.35 0.00 0.00 39.48 39.60 3k8l n PHE 71 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3k8l s ALA 72 N -3.52 0.08 -0.28 3.13 0.00 -1.26 -4.29 121.76 115.63 3k8l s ALA 72 Ca 0.00 0.32 -0.11 0.00 0.00 0.00 0.00 51.96 52.17 3k8l s ALA 72 Cb 0.00 -0.39 -0.05 0.00 0.00 0.00 0.00 23.12 22.68 3k8l s ALA 72 CO 0.00 -0.23 0.18 0.34 0.00 0.00 0.00 175.76 176.05 3k8l s ASP 73 N 1.42 6.01 0.00 0.00 2.15 0.05 -1.39 116.67 124.91 3k8l s ASP 73 Ca -0.05 -0.00 0.13 0.00 0.43 0.00 0.00 52.55 53.06 3k8l s ASP 73 Cb -0.13 -2.11 0.03 0.00 -0.30 0.00 0.00 42.92 40.41 3k8l s ASP 73 CO -0.03 -0.04 0.80 -1.54 -0.17 0.00 0.00 175.17 174.19 3k8l n SER 74 N 4.99 1.63 -0.00 -0.34 3.41 -1.26 -4.16 113.62 117.89 3k8l n SER 74 Ca -0.14 -1.32 0.03 0.00 -0.26 0.00 0.00 58.87 57.19 3k8l n SER 74 Cb 0.52 0.34 -0.04 0.00 -0.26 0.00 0.00 64.21 64.76 3k8l n SER 74 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3k8l n ASP 75 N 0.08 0.82 0.00 4.04 3.85 -1.26 -4.99 116.55 119.10 3k8l n ASP 75 Ca 0.06 -0.56 0.00 0.00 -0.71 0.00 0.00 54.79 53.58 3k8l n ASP 75 Cb 0.30 1.06 0.00 0.00 -1.35 0.00 0.00 41.12 41.12 3k8l n ASP 75 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3k8l n GLY 76 N 1.32 1.10 0.00 6.12 0.00 -1.26 -4.94 105.19 107.52 3k8l n GLY 76 Ca 0.01 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 3k8l n GLY 76 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3k8l n ASP 77 N 0.00 0.00 0.00 1.61 5.68 -1.26 -4.81 116.55 117.77 3k8l n ASP 77 Ca 0.00 -0.18 0.00 0.00 -0.50 0.00 0.00 54.79 54.11 3k8l n ASP 77 Cb 0.00 -0.13 0.00 0.00 -1.14 0.00 0.00 41.12 39.85 3k8l n ASP 77 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3k8l n GLY 78 N -0.18 0.66 3.38 6.12 0.00 -1.26 -4.98 105.19 108.92 3k8l n GLY 78 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 3k8l n GLY 78 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3k8l s TYR 79 N -2.59 2.67 0.81 1.61 5.04 -1.26 -0.62 117.35 123.01 3k8l s TYR 79 Ca 0.00 -0.50 -0.13 0.00 -2.44 0.00 0.00 57.07 54.00 3k8l s TYR 79 Cb 0.00 -1.70 0.09 0.00 0.35 0.00 0.00 41.96 40.70 3k8l s TYR 79 CO 0.00 -0.07 1.20 0.20 -1.34 0.00 0.00 175.55 175.54 3k8l s GLY 80 N -0.18 2.13 0.33 8.97 0.00 -0.51 -4.45 107.32 113.61 3k8l s GLY 80 Ca -0.01 0.83 -0.14 0.00 0.00 0.00 0.00 44.72 45.40 3k8l s GLY 80 CO 0.03 1.25 0.65 0.51 0.00 0.00 0.00 173.10 175.54 3k8l s ASP 81 N -2.19 0.12 0.20 1.64 -4.77 -0.48 -4.53 116.67 106.66 3k8l s ASP 81 Ca 0.73 -1.06 -0.07 0.00 -3.30 0.00 0.00 52.55 48.85 3k8l s ASP 81 Cb -0.28 0.73 0.14 0.00 -1.09 0.00 0.00 42.92 42.42 3k8l s ASP 81 CO 0.51 -1.43 1.65 -0.07 0.70 0.00 0.00 175.17 176.54 3k8l h LEU 82 N 2.07 0.95 -1.26 2.11 3.38 -1.44 -2.80 115.31 118.31 3k8l h LEU 82 Ca -0.27 -0.29 -0.07 0.00 0.09 0.00 0.00 57.88 57.34 3k8l h LEU 82 Cb 1.25 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 3k8l h LEU 82 CO 0.35 1.04 -0.25 0.78 0.09 0.00 0.00 178.44 180.45 3k8l h ASN 83 N 0.87 0.18 -0.57 -0.43 2.35 -1.87 -2.19 115.58 113.91 3k8l h ASN 83 Ca 0.15 -0.05 -0.03 0.00 -0.55 0.00 0.00 56.30 55.81 3k8l h ASN 83 Cb 0.60 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.89 3k8l h ASN 83 CO 0.04 0.44 0.24 1.23 -1.65 0.00 0.00 177.43 177.73 3k8l h GLY 84 N 0.93 0.94 0.79 2.83 0.00 -1.63 -0.89 103.07 106.04 3k8l h GLY 84 Ca 0.03 -0.48 -0.08 0.00 0.00 0.00 0.00 47.33 46.80 3k8l h GLY 84 CO 0.04 0.45 -0.20 -2.08 0.00 0.00 0.00 176.54 174.75 3k8l h VAL 85 N 0.87 1.34 -0.88 4.60 2.07 -1.38 -2.84 116.25 120.03 3k8l h VAL 85 Ca 0.21 -1.38 0.05 0.00 0.82 0.00 0.00 66.70 66.40 3k8l h VAL 85 Cb 0.16 1.84 -0.05 0.00 -1.52 0.00 0.00 31.29 31.72 3k8l h VAL 85 CO -0.02 0.41 0.57 0.74 0.02 0.00 0.00 177.57 179.30 3k8l h THR 86 N 0.08 1.10 0.00 2.57 2.02 -1.04 -0.38 112.91 117.26 3k8l h THR 86 Ca 0.02 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.85 3k8l h THR 86 Cb 0.75 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 3k8l h THR 86 CO 0.05 0.19 0.00 0.00 0.37 0.00 0.00 175.52 176.13 3k8l n GLN 87 N -4.47 0.32 -0.16 6.66 6.02 -0.37 -2.90 117.38 122.48 3k8l n GLN 87 Ca 0.12 0.02 0.05 0.00 -0.01 0.00 0.00 57.00 57.19 3k8l n GLN 87 Cb 0.16 -1.50 0.14 0.00 1.02 0.00 0.00 30.24 30.06 3k8l n GLN 87 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3k8l n LYS 88 N -1.33 2.71 0.00 -1.09 4.76 -0.20 -4.62 118.16 118.39 3k8l n LYS 88 Ca 0.12 -1.98 0.05 0.00 -2.87 0.00 0.00 58.31 53.63 3k8l n LYS 88 Cb 0.24 -1.26 0.44 0.00 -1.84 0.00 0.00 35.03 32.61 3k8l n LYS 88 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 3k8l h LEU 89 N 2.01 0.45 -1.24 -0.35 3.38 -1.28 -1.13 115.31 117.14 3k8l h LEU 89 Ca 0.00 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 3k8l h LEU 89 Cb 0.71 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 3k8l h LEU 89 CO 0.00 0.32 -0.26 0.44 0.09 0.00 0.00 178.44 179.03 3k8l h ASP 90 N 0.52 0.19 -0.07 -0.43 3.32 -1.84 0.14 116.42 118.26 3k8l h ASP 90 Ca 0.16 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 3k8l h ASP 90 Cb -0.01 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.49 3k8l h ASP 90 CO -0.04 0.46 -0.07 0.22 -1.72 0.00 0.00 179.24 178.09 3k8l h TYR 91 N 0.17 0.21 -0.79 4.55 3.20 -1.56 -1.75 116.97 120.99 3k8l h TYR 91 Ca 0.03 -0.06 -0.02 0.00 3.14 0.00 0.00 58.73 61.81 3k8l h TYR 91 Cb 0.56 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.75 3k8l h TYR 91 CO 0.01 0.62 0.40 -0.07 -1.64 0.00 0.00 178.16 177.48 3k8l h LEU 92 N -0.26 1.01 -1.17 2.82 3.38 -1.12 -1.81 115.31 118.15 3k8l h LEU 92 Ca 0.01 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 3k8l h LEU 92 Cb 0.59 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3k8l h LEU 92 CO 0.02 0.83 -0.32 -1.13 0.09 0.00 0.00 178.44 177.93 3k8l h ASN 93 N 1.11 0.16 0.47 -0.43 -1.24 -0.68 -1.45 115.58 113.52 3k8l h ASN 93 Ca 0.28 -0.05 -0.08 0.00 0.71 0.00 0.00 56.30 57.16 3k8l h ASN 93 Cb 0.08 -0.04 -0.01 0.00 0.73 0.00 0.00 38.32 39.07 3k8l h ASN 93 CO -0.04 0.48 -0.36 -0.61 -1.29 0.00 0.00 177.43 175.61 3k8l h GLN 94 N 0.14 0.00 0.00 6.67 4.15 -0.49 0.06 115.11 125.64 3k8l h GLN 94 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.44 3k8l h GLN 94 Cb 0.65 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.34 3k8l h GLN 94 CO 0.05 0.36 0.00 1.28 -1.93 0.00 0.00 178.83 178.59 3k8l n LEU 95 N -3.92 0.00 -2.11 -2.39 4.77 -0.56 -4.89 117.00 107.89 3k8l n LEU 95 Ca -0.02 0.08 -0.17 0.00 -0.03 0.00 0.00 56.01 55.87 3k8l n LEU 95 Cb 0.42 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 3k8l n LEU 95 CO 0.38 -0.01 -0.15 0.61 -1.33 0.00 0.00 177.39 176.89 3k8l n GLY 96 N 0.86 -0.32 3.81 -0.72 0.00 0.01 -4.79 105.19 104.04 3k8l n GLY 96 Ca 0.19 -0.13 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 3k8l n GLY 96 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k8l s VAL 97 N -2.91 4.39 -0.31 1.61 -7.23 -1.18 -4.69 120.40 110.08 3k8l s VAL 97 Ca 0.07 1.50 0.16 0.00 -1.81 0.00 0.00 61.98 61.90 3k8l s VAL 97 Cb -0.03 -3.69 -0.21 0.00 0.56 0.00 0.00 36.38 33.00 3k8l s VAL 97 CO 0.09 -0.20 0.47 1.17 -0.31 0.00 0.00 175.10 176.33 3k8l n LYS 98 N -0.33 1.06 -3.71 4.82 4.81 0.92 -4.75 118.16 120.97 3k8l n LYS 98 Ca 0.05 -0.09 -0.14 0.00 -0.87 0.00 0.00 58.31 57.27 3k8l n LYS 98 Cb 0.53 -1.32 -0.08 0.00 0.02 0.00 0.00 35.03 34.18 3k8l n LYS 98 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3k8l s ALA 99 N -2.84 -0.98 -0.12 3.14 0.00 -1.16 -0.50 121.76 119.30 3k8l s ALA 99 Ca -0.01 0.49 0.03 0.00 0.00 0.00 0.00 51.96 52.47 3k8l s ALA 99 Cb 0.11 0.09 0.00 0.00 0.00 0.00 0.00 23.12 23.32 3k8l s ALA 99 CO 0.65 -0.30 -0.22 -0.51 0.00 0.00 0.00 175.76 175.38 3k8l s LEU 100 N -1.39 2.19 -0.33 0.00 1.02 -0.21 -0.98 118.68 118.98 3k8l s LEU 100 Ca -0.12 -0.54 -0.11 0.00 0.02 0.00 0.00 54.13 53.38 3k8l s LEU 100 Cb -0.04 -1.45 -0.00 0.00 0.02 0.00 0.00 46.19 44.72 3k8l s LEU 100 CO 0.04 0.13 0.19 0.86 0.02 0.00 0.00 176.35 177.60 3k8l s TRP 101 N 0.50 3.20 0.03 0.29 -0.00 -0.52 0.04 118.94 122.48 3k8l s TRP 101 Ca -0.14 -0.56 -0.09 0.00 -0.00 0.00 0.00 56.10 55.31 3k8l s TRP 101 Cb -0.17 -2.41 -0.05 0.00 -0.00 0.00 0.00 33.47 30.84 3k8l s TRP 101 CO 0.05 -0.47 0.34 -0.51 -0.00 0.00 0.00 176.95 176.35 3k8l s LEU 102 N 1.63 4.38 0.98 5.86 1.43 -0.39 -1.95 118.68 130.61 3k8l s LEU 102 Ca 0.04 0.71 -0.12 0.00 -1.03 0.00 0.00 54.13 53.73 3k8l s LEU 102 Cb -0.18 -2.76 0.18 0.00 0.03 0.00 0.00 46.19 43.46 3k8l s LEU 102 CO 0.07 0.24 1.08 -0.94 0.23 0.00 0.00 176.35 177.03 3k8l s SER 103 N -1.61 2.60 -0.11 2.29 1.04 -1.13 -2.74 113.70 114.04 3k8l s SER 103 Ca 0.29 1.60 -0.40 0.00 0.48 0.00 0.00 55.95 57.92 3k8l s SER 103 Cb -0.14 -2.26 -0.18 0.00 0.10 0.00 0.00 66.02 63.54 3k8l s SER 103 CO 0.16 -3.21 1.38 -2.65 0.98 0.00 0.00 173.24 169.91 3k8l n PRO 104 N -4.26 0.60 0.00 4.02 -0.02 -1.26 -4.53 135.00 129.54 3k8l n PRO 104 Ca 0.07 0.22 0.11 0.00 -2.02 0.00 0.00 63.50 61.87 3k8l n PRO 104 Cb 0.54 -1.80 0.01 0.00 -0.02 0.00 0.00 33.50 32.23 3k8l n PRO 104 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 3k8l n ILE 105 N 2.88 0.00 -2.16 4.25 3.06 -1.26 -4.76 119.36 121.37 3k8l n ILE 105 Ca 0.23 -0.06 -0.27 0.00 -2.50 0.00 0.00 62.75 60.15 3k8l n ILE 105 Cb 0.10 0.87 0.06 0.00 0.54 0.00 0.00 39.64 41.21 3k8l n ILE 105 CO 0.00 0.00 0.00 -1.00 -2.50 0.00 0.00 176.55 173.05 3k8l s HIS 106 N -2.87 3.06 0.35 9.51 0.09 -1.25 0.37 115.29 124.55 3k8l s HIS 106 Ca 0.12 0.62 -0.28 0.00 -0.00 0.00 0.00 55.06 55.51 3k8l s HIS 106 Cb 0.17 -3.11 -0.11 0.00 -0.00 0.00 0.00 32.58 29.54 3k8l s HIS 106 CO 0.76 -1.28 1.40 -2.14 -0.00 0.00 0.00 174.74 173.48 3k8l s PRO 107 N -5.25 4.23 0.00 8.40 0.02 -1.26 -4.10 135.00 137.05 3k8l s PRO 107 Ca 0.59 2.39 0.00 0.00 0.02 0.00 0.00 61.00 64.00 3k8l s PRO 107 Cb -0.11 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.39 3k8l s PRO 107 CO 0.46 -0.37 0.00 0.00 -0.33 0.00 0.00 177.00 176.77 3k8l n MET 109 N 0.00 0.77 -4.27 0.00 2.81 -0.93 -4.86 117.12 110.64 3k8l n MET 109 Ca 0.00 0.08 -0.24 0.00 -1.81 0.00 0.00 57.70 55.73 3k8l n MET 109 Cb 0.00 -1.39 -0.08 0.00 -0.71 0.00 0.00 33.22 31.05 3k8l n MET 109 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 3k8l s SER 110 N -5.60 4.56 0.49 7.83 0.01 -1.26 -5.01 113.70 114.71 3k8l s SER 110 Ca -0.21 -0.58 0.20 0.00 1.31 0.00 0.00 55.95 56.67 3k8l s SER 110 Cb 0.06 -0.87 1.24 0.00 0.21 0.00 0.00 66.02 66.67 3k8l s SER 110 CO 0.50 0.03 1.99 0.10 0.41 0.00 0.00 173.24 176.27 3k8l h TYR 111 N 2.18 0.18 0.00 2.43 -0.00 -2.01 -1.26 116.97 118.49 3k8l h TYR 111 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.28 3k8l h TYR 111 Cb 1.23 -0.06 0.00 0.00 0.00 0.00 0.00 36.73 37.91 3k8l h TYR 111 CO 0.66 0.08 0.00 1.12 -0.00 0.00 0.00 178.16 180.02 3k8l h HIS 112 N 0.16 0.00 0.00 0.10 2.07 -1.97 -3.47 115.15 112.03 3k8l h HIS 112 Ca 0.25 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.77 3k8l h HIS 112 Cb 0.78 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.76 3k8l h HIS 112 CO -0.00 0.00 0.00 0.41 -3.07 0.00 0.00 177.93 175.27 3k8l n GLY 113 N 0.30 0.91 0.00 6.13 0.00 -0.48 -4.38 105.19 107.67 3k8l n GLY 113 Ca 0.02 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.15 3k8l n GLY 113 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3k8l n TYR 114 N -2.16 0.00 -3.44 1.61 4.01 -1.26 -3.91 117.16 112.00 3k8l n TYR 114 Ca 0.00 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.47 3k8l n TYR 114 Cb 0.00 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 38.95 3k8l n TYR 114 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 3k8l n ASP 115 N -0.84 3.20 -4.77 7.72 3.85 -1.26 -4.75 116.55 119.70 3k8l n ASP 115 Ca 0.16 -3.32 -0.37 0.00 -0.71 0.00 0.00 54.79 50.55 3k8l n ASP 115 Cb 0.07 -0.67 -0.01 0.00 -1.35 0.00 0.00 41.12 39.16 3k8l n ASP 115 CO 0.00 0.00 0.00 0.68 -1.01 0.00 0.00 177.20 176.87 3k8l s VAL 116 N -2.19 3.11 -0.49 2.12 -7.23 -1.25 -2.18 120.40 112.30 3k8l s VAL 116 Ca 0.38 0.86 0.05 0.00 -1.81 0.00 0.00 61.98 61.46 3k8l s VAL 116 Cb 0.13 -3.45 -0.00 0.00 0.56 0.00 0.00 36.38 33.62 3k8l s VAL 116 CO -0.04 0.01 0.46 0.35 -0.31 0.00 0.00 175.10 175.57 3k8l n THR 117 N -0.35 0.00 -3.15 5.32 -2.24 0.64 -1.50 114.28 113.00 3k8l n THR 117 Ca 0.07 -0.44 0.04 0.00 -2.27 0.00 0.00 64.05 61.44 3k8l n THR 117 Cb 0.48 1.06 -0.01 0.00 -2.10 0.00 0.00 70.33 69.76 3k8l n THR 117 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3k8l s ASP 118 N -0.94 -1.19 0.10 3.42 -1.08 -1.24 -4.33 116.67 111.41 3k8l s ASP 118 Ca 0.04 0.68 0.25 0.00 -0.52 0.00 0.00 52.55 53.00 3k8l s ASP 118 Cb 0.04 1.97 0.96 0.00 -1.46 0.00 0.00 42.92 44.44 3k8l s ASP 118 CO 0.13 -0.22 1.76 -1.22 0.52 0.00 0.00 175.17 176.15 3k8l n TYR 119 N 5.43 0.37 1.11 -5.34 4.02 -1.26 -3.50 117.16 118.00 3k8l n TYR 119 Ca -0.02 0.12 0.12 0.00 -0.01 0.00 0.00 57.90 58.12 3k8l n TYR 119 Cb 0.52 -0.70 0.16 0.00 -0.02 0.00 0.00 39.34 39.31 3k8l n TYR 119 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 3k8l n THR 120 N -1.82 0.00 -4.67 -0.72 -2.24 -1.26 -4.86 114.28 98.72 3k8l n THR 120 Ca 0.05 -0.26 -0.30 0.00 -2.27 0.00 0.00 64.05 61.27 3k8l n THR 120 Cb 0.32 0.99 -0.08 0.00 -2.10 0.00 0.00 70.33 69.46 3k8l n THR 120 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3k8l s LYS 121 N -2.37 2.07 -0.16 -0.78 1.02 -1.23 -5.05 119.74 113.25 3k8l s LYS 121 Ca 0.23 -2.29 -0.05 0.00 0.02 0.00 0.00 55.97 53.89 3k8l s LYS 121 Cb 0.19 -1.28 -0.03 0.00 -0.52 0.00 0.00 37.83 36.19 3k8l s LYS 121 CO 0.49 -0.34 -0.00 0.08 -0.92 0.00 0.00 175.35 174.66 3k8l s VAL 122 N -2.96 4.23 -0.16 3.17 1.01 -1.26 -3.95 120.40 120.48 3k8l s VAL 122 Ca 0.15 -0.24 -0.35 0.00 0.00 0.00 0.00 61.98 61.54 3k8l s VAL 122 Cb 0.03 -2.86 -0.12 0.00 0.00 0.00 0.00 36.38 33.43 3k8l s VAL 122 CO 0.08 0.49 1.91 -3.20 0.00 0.00 0.00 175.10 174.39 3k8l n ASN 123 N 3.41 3.13 0.07 3.32 2.85 0.16 -4.61 115.26 123.58 3k8l n ASN 123 Ca -0.17 0.89 0.20 0.00 -0.11 0.00 0.00 54.58 55.39 3k8l n ASN 123 Cb 0.52 -1.33 0.74 0.00 1.24 0.00 0.00 39.78 40.95 3k8l n ASN 123 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3k8l h PRO 124 N 9.56 0.00 0.00 1.20 0.11 -1.90 0.13 132.00 141.10 3k8l h PRO 124 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3k8l h PRO 124 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3k8l h PRO 124 CO 0.96 0.00 0.00 0.94 -0.21 0.00 0.00 178.00 179.69 3k8l n GLN 125 N -4.04 0.14 0.00 1.05 7.27 -1.26 -2.88 117.38 117.65 3k8l n GLN 125 Ca 0.08 0.25 0.09 0.00 0.07 0.00 0.00 57.00 57.48 3k8l n GLN 125 Cb 0.57 -1.71 -0.02 0.00 2.41 0.00 0.00 30.24 31.48 3k8l n GLN 125 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 3k8l n LEU 126 N -1.96 1.53 0.00 1.69 4.77 0.43 -4.86 117.00 118.61 3k8l n LEU 126 Ca 0.04 -0.70 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 3k8l n LEU 126 Cb 0.30 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 3k8l n LEU 126 CO 0.23 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 3k8l n GLY 127 N 1.26 0.89 3.86 -0.72 0.00 -1.13 -1.18 105.19 108.17 3k8l n GLY 127 Ca 0.06 -1.97 -0.21 0.00 0.00 0.00 0.00 46.02 43.90 3k8l n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k8l s THR 128 N -1.69 2.56 0.28 2.61 -4.23 -1.26 -4.16 115.64 109.74 3k8l s THR 128 Ca 0.00 -1.39 -0.03 0.00 -1.18 0.00 0.00 61.69 59.10 3k8l s THR 128 Cb 0.00 -2.94 0.24 0.00 1.34 0.00 0.00 72.50 71.14 3k8l s THR 128 CO 0.00 0.00 1.93 -0.33 -0.54 0.00 0.00 174.62 175.68 3k8l h GLU 129 N 1.04 1.10 0.00 3.99 4.39 -1.97 -1.81 114.58 121.32 3k8l h GLU 129 Ca -0.41 -0.09 -0.12 0.00 0.34 0.00 0.00 59.36 59.08 3k8l h GLU 129 Cb 1.27 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 29.67 3k8l h GLU 129 CO 0.59 0.77 -0.56 0.66 -1.16 0.00 0.00 179.01 179.30 3k8l h SER 130 N 1.12 0.00 -0.67 1.42 4.64 -1.99 -2.55 113.55 115.52 3k8l h SER 130 Ca 0.29 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.56 3k8l h SER 130 Cb -0.06 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.00 3k8l h SER 130 CO -0.06 0.56 0.19 0.44 -0.87 0.00 0.00 176.83 177.10 3k8l h ASP 131 N 0.00 0.99 0.07 4.97 3.32 -1.74 -1.29 116.42 122.75 3k8l h ASP 131 Ca -0.01 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 56.82 3k8l h ASP 131 Cb 1.02 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.31 3k8l h ASP 131 CO 0.07 0.95 -0.03 0.15 -1.72 0.00 0.00 179.24 178.66 3k8l h PHE 132 N 0.99 -0.09 0.00 4.55 3.57 -1.15 -1.75 116.94 123.06 3k8l h PHE 132 Ca 0.21 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.70 3k8l h PHE 132 Cb 0.32 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 3k8l h PHE 132 CO 0.02 0.07 -0.08 -0.44 -2.23 0.00 0.00 178.31 175.65 3k8l h ASP 133 N -0.23 0.00 -0.28 0.41 3.32 -1.34 -0.74 116.42 117.57 3k8l h ASP 133 Ca -0.01 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.93 3k8l h ASP 133 Cb 0.19 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.74 3k8l h ASP 133 CO 0.02 0.08 -0.26 -0.09 -1.72 0.00 0.00 179.24 177.26 3k8l h ARG 134 N 0.00 0.67 -0.35 3.56 1.12 -0.89 -2.00 114.38 116.49 3k8l h ARG 134 Ca -0.00 -0.35 0.02 0.00 -1.11 0.00 0.00 59.98 58.54 3k8l h ARG 134 Cb 0.17 0.01 -0.02 0.00 -0.01 0.00 0.00 29.97 30.12 3k8l h ARG 134 CO 0.01 0.95 0.20 1.25 -3.11 0.00 0.00 179.97 179.27 3k8l h LEU 135 N 0.41 0.32 -1.05 3.80 5.85 -0.26 -0.41 115.31 123.95 3k8l h LEU 135 Ca 0.05 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 3k8l h LEU 135 Cb 0.82 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.75 3k8l h LEU 135 CO 0.07 0.23 0.49 0.58 -0.34 0.00 0.00 178.44 179.47 3k8l h VAL 136 N 0.41 1.24 -0.10 1.05 2.07 -1.26 0.12 116.25 119.78 3k8l h VAL 136 Ca 0.14 -0.54 -0.03 0.00 0.82 0.00 0.00 66.70 67.10 3k8l h VAL 136 Cb 0.02 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 29.85 3k8l h VAL 136 CO -0.08 0.25 -0.04 0.74 0.02 0.00 0.00 177.57 178.47 3k8l h THR 137 N 1.16 1.31 -0.34 2.57 2.02 -0.82 -2.27 112.91 116.54 3k8l h THR 137 Ca 0.30 -1.02 -0.10 0.00 0.77 0.00 0.00 66.41 66.35 3k8l h THR 137 Cb -0.03 1.79 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 3k8l h THR 137 CO -0.05 0.29 -0.22 -0.33 0.37 0.00 0.00 175.52 175.57 3k8l h GLU 138 N -0.15 0.65 -0.19 6.66 4.39 -0.87 -2.07 114.58 123.00 3k8l h GLU 138 Ca 0.02 -0.25 -0.02 0.00 0.34 0.00 0.00 59.36 59.46 3k8l h GLU 138 Cb 0.47 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 3k8l h GLU 138 CO 0.01 0.82 0.04 0.00 -1.16 0.00 0.00 179.01 178.73 3k8l h ALA 139 N 1.19 0.25 -0.51 3.43 0.00 -0.78 -2.96 119.26 119.88 3k8l h ALA 139 Ca 0.08 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 3k8l h ALA 139 Cb 0.69 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3k8l h ALA 139 CO 0.05 -0.11 0.17 0.45 0.00 0.00 0.00 179.25 179.81 3k8l h HIS 140 N 0.11 0.75 0.00 0.00 3.86 -1.31 0.21 115.15 118.77 3k8l h HIS 140 Ca 0.06 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 3k8l h HIS 140 Cb 0.27 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.51 3k8l h HIS 140 CO 0.01 0.61 0.00 -0.91 0.86 0.00 0.00 177.93 178.50 3k8l h ASN 141 N 0.73 0.00 -0.36 2.45 2.35 -1.21 -1.87 115.58 117.67 3k8l h ASN 141 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 3k8l h ASN 141 Cb 0.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.57 3k8l h ASN 141 CO -0.01 0.00 0.00 0.54 -1.65 0.00 0.00 177.43 176.31 3k8l n ARG 142 N -2.87 3.25 -2.07 0.81 1.74 -0.51 -4.96 116.66 112.05 3k8l n ARG 142 Ca -0.01 -2.73 -0.15 0.00 -0.77 0.00 0.00 57.85 54.20 3k8l n ARG 142 Cb 0.15 -1.79 -0.02 0.00 -1.02 0.00 0.00 32.46 29.79 3k8l n ARG 142 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k8l n GLY 143 N 0.03 0.18 3.32 -0.13 0.00 -0.70 -4.99 105.19 102.91 3k8l n GLY 143 Ca 0.21 -0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 3k8l n GLY 143 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k8l s ILE 144 N -2.68 2.96 0.55 -0.61 1.01 -0.05 -4.69 121.20 117.69 3k8l s ILE 144 Ca 0.00 -0.67 -0.06 0.00 0.00 0.00 0.00 60.65 59.91 3k8l s ILE 144 Cb 0.00 -2.26 -0.01 0.00 0.01 0.00 0.00 42.46 40.19 3k8l s ILE 144 CO 0.00 0.51 0.87 -0.54 0.00 0.00 0.00 174.94 175.78 3k8l s LYS 145 N 0.69 3.25 -0.15 2.79 1.02 0.34 -3.16 119.74 124.51 3k8l s LYS 145 Ca -0.06 0.17 0.01 0.00 0.02 0.00 0.00 55.97 56.10 3k8l s LYS 145 Cb -0.15 -2.29 0.02 0.00 -0.52 0.00 0.00 37.83 34.89 3k8l s LYS 145 CO 0.02 -0.49 -0.16 0.42 -0.92 0.00 0.00 175.35 174.22 3k8l s ILE 146 N -2.92 1.70 -0.10 2.17 -1.09 -1.26 -1.04 121.20 118.67 3k8l s ILE 146 Ca 0.51 -0.72 0.01 0.00 -2.23 0.00 0.00 60.65 58.22 3k8l s ILE 146 Cb -0.10 -1.57 -0.02 0.00 -1.58 0.00 0.00 42.46 39.18 3k8l s ILE 146 CO 0.46 0.48 -0.13 -0.31 -1.23 0.00 0.00 174.94 174.22 3k8l s TYR 147 N 1.38 2.79 0.07 3.97 2.02 0.11 -1.23 117.35 126.45 3k8l s TYR 147 Ca 0.04 -0.40 0.00 0.00 -0.37 0.00 0.00 57.07 56.34 3k8l s TYR 147 Cb -0.13 -1.76 -0.04 0.00 -0.40 0.00 0.00 41.96 39.62 3k8l s TYR 147 CO -0.10 -0.02 0.21 -0.51 -1.57 0.00 0.00 175.55 173.56 3k8l s LEU 148 N -0.12 4.35 -0.48 -1.29 1.43 -0.77 -1.27 118.68 120.53 3k8l s LEU 148 Ca -0.01 0.26 -0.23 0.00 -1.03 0.00 0.00 54.13 53.12 3k8l s LEU 148 Cb -0.14 -2.95 0.03 0.00 0.03 0.00 0.00 46.19 43.17 3k8l s LEU 148 CO 0.03 0.16 0.81 -0.62 0.23 0.00 0.00 176.35 176.97 3k8l s ASP 149 N -2.55 6.37 -0.28 2.29 -1.08 -1.11 -0.35 116.67 119.96 3k8l s ASP 149 Ca 0.35 -0.28 -0.09 0.00 -0.52 0.00 0.00 52.55 52.02 3k8l s ASP 149 Cb -0.13 -2.39 -0.02 0.00 -1.46 0.00 0.00 42.92 38.92 3k8l s ASP 149 CO 0.28 -1.00 0.12 -0.47 0.52 0.00 0.00 175.17 174.62 3k8l s TYR 150 N 3.39 3.14 -0.73 -5.34 5.04 -0.25 -4.46 117.35 118.13 3k8l s TYR 150 Ca 0.28 -0.40 -0.17 0.00 -2.44 0.00 0.00 57.07 54.34 3k8l s TYR 150 Cb -0.13 -2.30 0.15 0.00 0.35 0.00 0.00 41.96 40.03 3k8l s TYR 150 CO 0.20 -0.37 0.79 0.08 -1.34 0.00 0.00 175.55 174.91 3k8l s VAL 151 N 1.64 5.11 -1.14 3.14 1.01 -1.26 -2.36 120.40 126.54 3k8l s VAL 151 Ca 0.06 -1.66 0.23 0.00 0.00 0.00 0.00 61.98 60.60 3k8l s VAL 151 Cb -0.16 -4.52 -0.11 0.00 0.00 0.00 0.00 36.38 31.58 3k8l s VAL 151 CO 0.06 -1.14 1.11 0.23 0.00 0.00 0.00 175.10 175.35 3k8l n MET 152 N 5.46 0.16 0.08 2.72 2.81 -1.26 -4.34 117.12 122.76 3k8l n MET 152 Ca 0.04 -0.12 -0.09 0.00 -1.81 0.00 0.00 57.70 55.71 3k8l n MET 152 Cb 0.45 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.43 3k8l n MET 152 CO 0.00 0.00 0.00 -0.97 1.51 0.00 0.00 175.97 176.51 3k8l h ASN 153 N 0.30 0.26 -5.03 7.83 -1.24 -1.88 -3.44 115.58 112.40 3k8l h ASN 153 Ca 0.00 -0.22 0.07 0.00 0.71 0.00 0.00 56.30 56.85 3k8l h ASN 153 Cb 0.53 -0.08 -0.07 0.00 0.73 0.00 0.00 38.32 39.43 3k8l h ASN 153 CO 0.00 1.05 0.26 -1.38 -1.29 0.00 0.00 177.43 176.07 3k8l s HIS 154 N -3.11 -0.25 0.38 0.67 -3.43 -1.26 -1.00 115.29 107.29 3k8l s HIS 154 Ca -0.03 -0.14 0.06 0.00 -0.80 0.00 0.00 55.06 54.15 3k8l s HIS 154 Cb 0.10 0.67 -0.07 0.00 -1.43 0.00 0.00 32.58 31.84 3k8l s HIS 154 CO 0.83 -1.11 0.02 0.95 -2.00 0.00 0.00 174.74 173.44 3k8l s THR 155 N -3.80 1.75 0.78 -5.38 -4.23 -0.97 -4.77 115.64 99.01 3k8l s THR 155 Ca 0.09 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.49 3k8l s THR 155 Cb -0.05 -2.93 0.06 0.00 1.34 0.00 0.00 72.50 70.92 3k8l s THR 155 CO 0.03 -0.00 1.08 -0.83 -0.54 0.00 0.00 174.62 174.36 3k8l s GLY 156 N -3.64 1.65 0.00 3.99 0.00 -0.56 -1.79 107.32 106.97 3k8l s GLY 156 Ca 0.35 0.01 0.26 0.00 0.00 0.00 0.00 44.72 45.35 3k8l s GLY 156 CO 0.17 0.40 1.88 -1.30 0.00 0.00 0.00 173.10 174.25 3k8l n THR 157 N -3.43 0.17 1.17 0.90 -2.24 -0.09 -2.55 114.28 108.21 3k8l n THR 157 Ca 0.08 0.04 0.13 0.00 -2.27 0.00 0.00 64.05 62.03 3k8l n THR 157 Cb 0.54 -0.60 0.37 0.00 -2.10 0.00 0.00 70.33 68.54 3k8l n THR 157 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k8l n ALA 158 N -1.36 3.18 -1.83 6.98 0.00 -1.26 -4.49 120.51 121.74 3k8l n ALA 158 Ca 0.11 -0.36 -0.42 0.00 0.00 0.00 0.00 53.44 52.77 3k8l n ALA 158 Cb 0.24 -1.16 -0.02 0.00 0.00 0.00 0.00 19.45 18.51 3k8l n ALA 158 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3k8l s HIS 159 N -2.69 2.91 0.58 0.00 5.04 -1.05 -4.84 115.29 115.23 3k8l s HIS 159 Ca 0.20 0.84 0.28 0.00 -1.54 0.00 0.00 55.06 54.84 3k8l s HIS 159 Cb 0.19 -3.95 1.59 0.00 0.04 0.00 0.00 32.58 30.45 3k8l s HIS 159 CO 0.58 -3.22 2.07 -1.00 -2.34 0.00 0.00 174.74 170.82 3k8l h PRO 160 N 5.26 0.00 -0.48 2.88 0.13 -1.91 -0.11 132.00 137.77 3k8l h PRO 160 Ca -0.46 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 3k8l h PRO 160 Cb 1.22 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 3k8l h PRO 160 CO 0.81 0.00 0.28 -1.49 -0.23 0.00 0.00 178.00 177.37 3k8l h TRP 161 N 0.00 0.64 -0.34 1.56 6.55 -1.91 -0.68 115.95 121.78 3k8l h TRP 161 Ca 0.12 -0.01 -0.14 0.00 0.95 0.00 0.00 58.89 59.81 3k8l h TRP 161 Cb 0.61 -0.21 -0.01 0.00 -0.86 0.00 0.00 29.16 28.69 3k8l h TRP 161 CO 0.00 0.46 -0.32 0.35 -1.05 0.00 0.00 178.44 177.88 3k8l h PHE 162 N 0.64 0.97 -0.78 0.49 3.57 -1.37 0.28 116.94 120.75 3k8l h PHE 162 Ca 0.17 -0.29 0.11 0.00 3.53 0.00 0.00 57.97 61.49 3k8l h PHE 162 Cb 0.02 -0.20 -0.08 0.00 2.79 0.00 0.00 35.95 38.47 3k8l h PHE 162 CO -0.02 1.07 0.40 1.15 -2.23 0.00 0.00 178.31 178.68 3k8l h THR 163 N 0.59 0.83 0.05 4.41 2.02 -1.10 0.11 112.91 119.82 3k8l h THR 163 Ca 0.06 -0.22 -0.00 0.00 0.77 0.00 0.00 66.41 67.01 3k8l h THR 163 Cb 0.90 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 3k8l h THR 163 CO 0.08 0.12 -0.02 -0.33 0.37 0.00 0.00 175.52 175.74 3k8l h GLU 164 N 0.66 -0.06 -0.95 6.66 4.39 -0.94 -2.99 114.58 121.34 3k8l h GLU 164 Ca 0.39 0.00 0.01 0.00 0.34 0.00 0.00 59.36 60.10 3k8l h GLU 164 Cb 0.44 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.06 3k8l h GLU 164 CO -0.29 0.47 0.62 0.00 -1.16 0.00 0.00 179.01 178.66 3k8l h ALA 165 N 0.26 1.31 0.00 3.43 0.00 -0.67 -2.33 119.26 121.26 3k8l h ALA 165 Ca -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3k8l h ALA 165 Cb 0.56 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3k8l h ALA 165 CO 0.01 0.64 0.00 -1.13 0.00 0.00 0.00 179.25 178.77 3k8l n SER 166 N -4.38 0.47 -0.10 0.00 3.41 0.36 -3.68 113.62 109.71 3k8l n SER 166 Ca 0.11 0.57 -0.10 0.00 -0.26 0.00 0.00 58.87 59.19 3k8l n SER 166 Cb 0.02 -0.69 0.04 0.00 -0.26 0.00 0.00 64.21 63.33 3k8l n SER 166 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3k8l h SER 167 N 0.00 0.87 -4.69 4.04 4.64 -1.26 -3.47 113.55 113.68 3k8l h SER 167 Ca 0.00 -0.35 0.07 0.00 -0.47 0.00 0.00 61.79 61.04 3k8l h SER 167 Cb 0.52 -0.24 -0.15 0.00 -0.31 0.00 0.00 62.40 62.22 3k8l h SER 167 CO 0.00 1.09 0.43 -0.94 -0.87 0.00 0.00 176.83 176.54 3k8l s SER 168 N -6.78 -0.42 0.00 4.97 1.04 -1.24 -5.01 113.70 106.26 3k8l s SER 168 Ca -0.10 0.06 0.18 0.00 0.48 0.00 0.00 55.95 56.58 3k8l s SER 168 Cb 0.12 0.43 0.94 0.00 0.10 0.00 0.00 66.02 67.61 3k8l s SER 168 CO 0.85 -0.67 1.56 -1.54 0.98 0.00 0.00 173.24 174.42 3k8l n SER 169 N -0.15 0.00 -0.36 7.02 3.41 -1.26 -2.53 113.62 119.75 3k8l n SER 169 Ca -0.11 -0.01 0.10 0.00 -0.26 0.00 0.00 58.87 58.59 3k8l n SER 169 Cb 0.62 -0.27 -0.03 0.00 -0.26 0.00 0.00 64.21 64.27 3k8l n SER 169 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3k8l n GLU 170 N -1.27 1.14 -1.75 4.33 -0.58 -1.26 -4.95 120.64 116.30 3k8l n GLU 170 Ca 0.09 -0.73 -0.38 0.00 -0.42 0.00 0.00 57.16 55.72 3k8l n GLU 170 Cb 0.14 -1.43 0.05 0.00 -0.57 0.00 0.00 31.44 29.63 3k8l n GLU 170 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3k8l s SER 171 N -2.46 5.16 0.55 1.62 0.15 -1.05 -4.88 113.70 112.80 3k8l s SER 171 Ca 0.15 2.78 0.35 0.00 0.70 0.00 0.00 55.95 59.94 3k8l s SER 171 Cb 0.16 -2.64 1.61 0.00 -1.71 0.00 0.00 66.02 63.45 3k8l s SER 171 CO 0.60 -1.64 2.06 -0.65 1.20 0.00 0.00 173.24 174.80 3k8l h PRO 172 N 1.36 0.00 -0.02 5.44 0.11 -1.92 -2.52 132.00 134.45 3k8l h PRO 172 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3k8l h PRO 172 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3k8l h PRO 172 CO 0.57 0.00 -0.10 0.66 -0.21 0.00 0.00 178.00 178.92 3k8l n TYR 173 N -3.00 0.00 -0.20 0.65 4.01 -1.26 -4.58 117.16 112.78 3k8l n TYR 173 Ca -0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.73 3k8l n TYR 173 Cb 0.23 -0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.32 3k8l n TYR 173 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 3k8l h ARG 174 N 3.88 0.03 0.00 -0.72 9.65 -1.69 -0.67 114.38 124.85 3k8l h ARG 174 Ca 0.00 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3k8l h ARG 174 Cb 0.88 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.45 3k8l h ARG 174 CO 0.00 0.02 0.00 -1.71 2.80 0.00 0.00 179.97 181.08 3k8l n ASN 175 N -5.38 0.00 0.23 -3.80 5.15 -1.26 -2.97 115.26 107.23 3k8l n ASN 175 Ca 0.07 0.01 0.11 0.00 -0.60 0.00 0.00 54.58 54.17 3k8l n ASN 175 Cb 0.32 -0.20 0.46 0.00 -0.53 0.00 0.00 39.78 39.83 3k8l n ASN 175 CO 0.00 0.00 0.00 1.88 1.40 0.00 0.00 177.26 180.54 3k8l h TYR 176 N 0.00 0.00 -2.37 1.20 0.99 -1.38 -3.41 116.97 112.00 3k8l h TYR 176 Ca 0.00 0.00 -0.56 0.00 2.00 0.00 0.00 58.73 60.17 3k8l h TYR 176 Cb 0.06 0.00 -0.13 0.00 1.00 0.00 0.00 36.73 37.66 3k8l h TYR 176 CO 0.00 0.20 -0.54 0.71 -0.00 0.00 0.00 178.16 178.53 3k8l s TYR 177 N -3.62 1.85 -0.34 4.88 2.02 -1.16 0.96 117.35 121.94 3k8l s TYR 177 Ca 0.01 -1.16 -0.11 0.00 -0.37 0.00 0.00 57.07 55.44 3k8l s TYR 177 Cb 0.10 -1.25 -0.00 0.00 -0.40 0.00 0.00 41.96 40.40 3k8l s TYR 177 CO 0.63 -0.15 0.19 -1.12 -1.57 0.00 0.00 175.55 173.54 3k8l s SER 178 N -3.62 5.75 0.07 2.29 0.01 -1.25 -4.67 113.70 112.28 3k8l s SER 178 Ca 0.24 -0.62 0.08 0.00 1.31 0.00 0.00 55.95 56.97 3k8l s SER 178 Cb 0.04 -2.05 -0.03 0.00 0.21 0.00 0.00 66.02 64.19 3k8l s SER 178 CO 0.13 -0.26 -0.21 -0.36 0.41 0.00 0.00 173.24 172.95 3k8l s PHE 179 N 1.63 2.47 -0.17 2.43 0.08 -1.26 -1.69 117.98 121.47 3k8l s PHE 179 Ca 0.04 -0.31 -0.25 0.00 0.12 0.00 0.00 56.93 56.54 3k8l s PHE 179 Cb -0.18 -1.39 0.06 0.00 -0.57 0.00 0.00 43.02 40.94 3k8l s PHE 179 CO 0.08 0.27 0.64 0.45 -0.10 0.00 0.00 175.22 176.55 3k8l s SER 180 N -1.63 -0.64 0.22 1.36 0.15 -0.39 -4.97 113.70 107.79 3k8l s SER 180 Ca 0.15 1.05 0.16 0.00 0.70 0.00 0.00 55.95 58.01 3k8l s SER 180 Cb -0.10 1.03 0.01 0.00 -1.71 0.00 0.00 66.02 65.25 3k8l s SER 180 CO 0.06 -0.36 1.26 -0.33 1.20 0.00 0.00 173.24 175.07 3k8l h GLU 181 N 4.39 0.00 -1.78 5.44 4.39 -1.87 0.62 114.58 125.76 3k8l h GLU 181 Ca -0.28 0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.10 3k8l h GLU 181 Cb 1.16 0.00 -0.29 0.00 -0.10 0.00 0.00 28.75 29.52 3k8l h GLU 181 CO 0.20 0.40 -0.65 0.34 -1.16 0.00 0.00 179.01 178.15 3k8l s ASP 182 N -6.21 0.69 0.14 1.42 2.15 -1.26 -4.80 116.67 108.81 3k8l s ASP 182 Ca 0.02 -1.46 -0.21 0.00 0.43 0.00 0.00 52.55 51.33 3k8l s ASP 182 Cb 0.08 0.80 0.02 0.00 -0.30 0.00 0.00 42.92 43.52 3k8l s ASP 182 CO 0.76 -0.24 1.66 -0.65 -0.17 0.00 0.00 175.17 176.53 3k8l h PRO 183 N 7.03 -0.16 -0.44 4.34 0.11 -1.98 -0.92 132.00 139.99 3k8l h PRO 183 Ca 0.05 0.01 0.09 0.00 0.11 0.00 0.00 66.00 66.26 3k8l h PRO 183 Cb 1.08 0.04 -0.08 0.00 0.11 0.00 0.00 31.00 32.14 3k8l h PRO 183 CO 0.18 -0.10 -0.07 -0.22 -0.21 0.00 0.00 178.00 177.57 3k8l h LYS 184 N -0.16 0.03 -0.13 1.05 3.64 -1.97 0.14 116.57 119.17 3k8l h LYS 184 Ca 0.13 -0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.28 3k8l h LYS 184 Cb 0.35 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.17 3k8l h LYS 184 CO -0.32 0.02 -0.80 1.15 -2.27 0.00 0.00 179.45 177.24 3k8l h THR 185 N 0.03 1.29 -0.38 1.00 2.02 -1.96 -2.95 112.91 111.98 3k8l h THR 185 Ca 0.22 -2.03 -0.05 0.00 0.77 0.00 0.00 66.41 65.32 3k8l h THR 185 Cb 0.33 2.04 -0.01 0.00 -1.74 0.00 0.00 68.15 68.76 3k8l h THR 185 CO -0.43 0.64 0.04 0.44 0.37 0.00 0.00 175.52 176.57 3k8l h ASP 186 N 0.49 0.62 0.86 4.18 3.32 -0.80 -2.18 116.42 122.91 3k8l h ASP 186 Ca -0.06 -0.28 -0.04 0.00 0.02 0.00 0.00 57.03 56.67 3k8l h ASP 186 Cb 1.42 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.81 3k8l h ASP 186 CO 0.16 0.74 -0.46 0.40 -1.72 0.00 0.00 179.24 178.36 3k8l h ILE 187 N 0.47 0.00 -0.98 0.35 1.08 -0.80 0.11 117.51 117.73 3k8l h ILE 187 Ca 0.11 0.00 0.25 0.00 -0.39 0.00 0.00 64.86 64.84 3k8l h ILE 187 Cb 0.41 0.00 -0.07 0.00 -3.07 0.00 0.00 36.82 34.09 3k8l h ILE 187 CO 0.01 0.00 0.66 0.00 -0.69 0.00 0.00 178.15 178.14 3k8l h ALA 188 N -1.34 2.48 -0.21 1.87 0.00 -1.56 0.73 119.26 121.22 3k8l h ALA 188 Ca -0.12 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3k8l h ALA 188 Cb 0.95 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3k8l h ALA 188 CO 0.16 -0.80 0.00 0.00 0.00 0.00 0.00 179.25 178.61 3k8l n ALA 189 N -2.58 2.48 -3.61 0.00 0.00 -0.82 -4.63 120.51 111.35 3k8l n ALA 189 Ca 0.22 -0.42 -0.24 0.00 0.00 0.00 0.00 53.44 53.00 3k8l n ALA 189 Cb 0.89 -1.02 0.08 0.00 0.00 0.00 0.00 19.45 19.39 3k8l n ALA 189 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k8l n GLY 190 N 0.92 -0.53 0.01 0.00 0.00 0.25 -4.92 105.19 100.92 3k8l n GLY 190 Ca 0.10 0.25 0.11 0.00 0.00 0.00 0.00 46.02 46.47 3k8l n GLY 190 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3k8l n LYS 191 N -4.94 0.41 -3.30 1.61 3.00 0.35 -4.79 118.16 110.50 3k8l n LYS 191 Ca -0.01 -0.11 -0.45 0.00 -0.00 0.00 0.00 58.31 57.74 3k8l n LYS 191 Cb 0.57 -1.53 -0.06 0.00 0.00 0.00 0.00 35.03 34.01 3k8l n LYS 191 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 3k8l s ILE 192 N -3.32 5.13 0.34 3.15 -1.09 -1.25 -4.96 121.20 119.20 3k8l s ILE 192 Ca -0.02 -1.12 0.14 0.00 -2.23 0.00 0.00 60.65 57.42 3k8l s ILE 192 Cb 0.15 -4.26 0.33 0.00 -1.58 0.00 0.00 42.46 37.10 3k8l s ILE 192 CO 0.89 -0.77 1.65 0.00 -1.23 0.00 0.00 174.94 175.48 3k8l h ALA 193 N 8.88 1.89 0.00 9.38 0.00 -1.93 0.15 119.26 137.63 3k8l h ALA 193 Ca -0.29 0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3k8l h ALA 193 Cb 1.10 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3k8l h ALA 193 CO 0.97 -0.62 0.00 -1.33 0.00 0.00 0.00 179.25 178.27 3k8l n MET 194 N -5.11 0.29 -3.42 0.00 2.81 -1.26 -4.22 117.12 106.21 3k8l n MET 194 Ca 0.31 0.03 -0.27 0.00 -1.81 0.00 0.00 57.70 55.97 3k8l n MET 194 Cb 0.99 -1.50 -0.10 0.00 -0.71 0.00 0.00 33.22 31.90 3k8l n MET 194 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 3k8l n ILE 195 N -1.34 -0.85 -0.32 2.02 5.41 0.51 -1.37 119.36 123.42 3k8l n ILE 195 Ca 0.11 -3.64 0.00 0.00 1.00 0.00 0.00 62.75 60.22 3k8l n ILE 195 Cb 0.24 -1.74 0.00 0.00 -0.71 0.00 0.00 39.64 37.43 3k8l n ILE 195 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 3k8l n THR 196 N 2.60 0.25 -1.43 1.39 -2.24 -1.25 -4.56 114.28 109.04 3k8l n THR 196 Ca 0.28 -0.47 0.05 0.00 -2.27 0.00 0.00 64.05 61.64 3k8l n THR 196 Cb 0.47 1.08 0.20 0.00 -2.10 0.00 0.00 70.33 69.97 3k8l n THR 196 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k8l n GLN 197 N -0.12 1.65 0.00 -0.78 1.13 -1.26 -4.60 117.38 113.40 3k8l n GLN 197 Ca 0.00 -3.12 0.00 0.00 -1.94 0.00 0.00 57.00 51.94 3k8l n GLN 197 Cb 0.17 -1.65 0.00 0.00 0.11 0.00 0.00 30.24 28.87 3k8l n GLN 197 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3k8l n GLU 198 N -1.15 0.19 0.00 -1.09 1.02 -1.26 -4.99 120.64 113.35 3k8l n GLU 198 Ca 0.21 -0.41 0.00 0.00 -0.02 0.00 0.00 57.16 56.94 3k8l n GLU 198 Cb 0.76 -0.56 0.00 0.00 -0.02 0.00 0.00 31.44 31.62 3k8l n GLU 198 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3k8l n GLY 199 N -0.04 0.91 0.42 0.62 0.00 -1.26 -2.39 105.19 103.46 3k8l n GLY 199 Ca 0.00 -0.81 0.22 0.00 0.00 0.00 0.00 46.02 45.44 3k8l n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k8l h ALA 200 N -0.88 2.43 0.00 4.61 0.00 -1.87 0.64 119.26 124.18 3k8l h ALA 200 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3k8l h ALA 200 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3k8l h ALA 200 CO 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 179.25 178.54 3k8l n ALA 201 N -2.58 1.03 0.31 0.00 0.00 -1.00 -1.27 120.51 116.99 3k8l n ALA 201 Ca 0.19 0.13 0.17 0.00 0.00 0.00 0.00 53.44 53.94 3k8l n ALA 201 Cb 0.79 -1.21 0.76 0.00 0.00 0.00 0.00 19.45 19.79 3k8l n ALA 201 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3k8l h GLY 202 N 0.01 0.00 -4.81 0.00 0.00 -0.82 -3.43 103.07 94.02 3k8l h GLY 202 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 3k8l h GLY 202 CO 0.00 0.00 0.10 -0.47 0.00 0.00 0.00 176.54 176.17 3k8l s TYR 203 N -3.70 3.66 -0.25 5.60 5.04 -0.40 -5.03 117.35 122.27 3k8l s TYR 203 Ca 0.00 1.33 -0.03 0.00 -2.44 0.00 0.00 57.07 55.94 3k8l s TYR 203 Cb 0.10 -2.77 0.11 0.00 0.35 0.00 0.00 41.96 39.75 3k8l s TYR 203 CO 0.46 0.21 0.24 1.21 -1.34 0.00 0.00 175.55 176.33 3k8l s ASN 204 N 0.26 1.85 0.45 4.32 2.47 -1.26 -5.04 114.94 118.00 3k8l s ASN 204 Ca 0.37 -0.61 0.30 0.00 0.42 0.00 0.00 52.86 53.34 3k8l s ASN 204 Cb -0.19 0.31 1.41 0.00 -1.45 0.00 0.00 41.25 41.33 3k8l s ASN 204 CO 0.20 -0.37 1.66 0.00 -3.72 0.00 0.00 177.10 174.87 3k8l h ALA 205 N 8.31 2.79 0.00 1.71 0.00 -1.96 0.43 119.26 130.54 3k8l h ALA 205 Ca -0.16 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3k8l h ALA 205 Cb 1.10 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3k8l h ALA 205 CO 0.33 -1.35 0.00 0.00 0.00 0.00 0.00 179.25 178.23 3k8l n ALA 206 N -2.57 1.62 -0.64 0.00 0.00 -1.26 -2.53 120.51 115.13 3k8l n ALA 206 Ca 0.35 -0.05 0.08 0.00 0.00 0.00 0.00 53.44 53.82 3k8l n ALA 206 Cb 1.37 -1.21 0.31 0.00 0.00 0.00 0.00 19.45 19.92 3k8l n ALA 206 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3k8l n GLU 207 N -1.45 3.50 -4.23 0.00 1.02 0.15 -4.31 120.64 115.33 3k8l n GLU 207 Ca 0.04 -2.76 -0.19 0.00 -0.02 0.00 0.00 57.16 54.23 3k8l n GLU 207 Cb 0.14 -1.80 -0.16 0.00 -0.02 0.00 0.00 31.44 29.60 3k8l n GLU 207 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3k8l s TRP 208 N -1.97 0.76 0.10 -0.32 0.52 -1.05 -0.71 118.94 116.28 3k8l s TRP 208 Ca 0.45 -0.20 0.06 0.00 0.02 0.00 0.00 56.10 56.43 3k8l s TRP 208 Cb 0.30 -0.62 -0.03 0.00 -1.15 0.00 0.00 33.47 31.96 3k8l s TRP 208 CO 0.19 -0.15 -0.15 -0.06 0.02 0.00 0.00 176.95 176.80 3k8l s PHE 209 N 0.61 1.40 0.26 -1.98 0.08 -0.86 -4.94 117.98 112.55 3k8l s PHE 209 Ca -0.08 -0.50 -0.27 0.00 0.12 0.00 0.00 56.93 56.20 3k8l s PHE 209 Cb -0.12 -0.75 -0.09 0.00 -0.57 0.00 0.00 43.02 41.49 3k8l s PHE 209 CO 0.00 0.13 0.89 1.14 -0.10 0.00 0.00 175.22 177.28 3k8l s GLN 210 N -2.25 4.64 0.08 0.44 -2.07 -1.26 -0.82 119.66 118.41 3k8l s GLN 210 Ca 0.05 1.30 -0.18 0.00 -1.82 0.00 0.00 55.36 54.72 3k8l s GLN 210 Cb -0.07 -3.05 -0.09 0.00 -1.09 0.00 0.00 33.01 28.71 3k8l s GLN 210 CO 0.03 0.42 1.46 0.28 -1.32 0.00 0.00 175.29 176.16 3k8l h VAL 211 N 2.93 1.29 -1.89 3.63 2.07 -1.40 -3.47 116.25 119.41 3k8l h VAL 211 Ca -0.46 -1.16 0.19 0.00 0.82 0.00 0.00 66.70 66.09 3k8l h VAL 211 Cb 1.20 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 32.44 3k8l h VAL 211 CO 0.66 0.36 0.52 -1.54 0.02 0.00 0.00 177.57 177.59 3k8l n SER 212 N -4.50 -0.85 -0.76 0.57 3.41 -1.26 -5.01 113.62 105.23 3k8l n SER 212 Ca -0.04 -1.27 0.06 0.00 -0.26 0.00 0.00 58.87 57.37 3k8l n SER 212 Cb 0.33 1.34 0.18 0.00 -0.26 0.00 0.00 64.21 65.80 3k8l n SER 212 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3k8l n ASP 213 N -0.82 2.19 -4.78 4.04 8.00 -1.26 -4.53 116.55 119.40 3k8l n ASP 213 Ca 0.02 -2.01 -0.36 0.00 0.71 0.00 0.00 54.79 53.15 3k8l n ASP 213 Cb 0.37 -0.28 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 3k8l n ASP 213 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3k8l s GLU 214 N -1.47 3.85 0.13 -1.24 2.12 -1.26 -4.96 118.70 115.88 3k8l s GLU 214 Ca 0.27 1.52 -0.06 0.00 0.36 0.00 0.00 54.97 57.07 3k8l s GLU 214 Cb 0.14 -2.29 -0.02 0.00 0.26 0.00 0.00 34.13 32.22 3k8l s GLU 214 CO 0.18 -0.41 0.17 0.95 -0.54 0.00 0.00 175.26 175.61 3k8l s THR 215 N -1.76 0.10 0.73 -1.70 -4.23 -1.26 -4.44 115.64 103.08 3k8l s THR 215 Ca 0.64 -1.55 -0.11 0.00 -1.18 0.00 0.00 61.69 59.49 3k8l s THR 215 Cb -0.22 -1.80 0.03 0.00 1.34 0.00 0.00 72.50 71.86 3k8l s THR 215 CO 0.26 -0.46 1.08 0.00 -0.54 0.00 0.00 174.62 174.96 3k8l s ALA 216 N -3.97 2.44 0.68 3.99 0.00 -1.26 -4.99 121.76 118.64 3k8l s ALA 216 Ca 0.17 0.24 0.02 0.00 0.00 0.00 0.00 51.96 52.38 3k8l s ALA 216 Cb 0.05 -3.24 0.11 0.00 0.00 0.00 0.00 23.12 20.04 3k8l s ALA 216 CO -0.02 -1.50 0.93 0.00 0.00 0.00 0.00 175.76 175.18 3k8l s ALA 217 N -2.87 3.93 -0.08 0.00 0.00 -1.26 -4.73 121.76 116.75 3k8l s ALA 217 Ca 0.61 -1.79 0.01 0.00 0.00 0.00 0.00 51.96 50.79 3k8l s ALA 217 Cb -0.16 -1.89 0.02 0.00 0.00 0.00 0.00 23.12 21.08 3k8l s ALA 217 CO 0.53 -1.28 -0.10 0.08 0.00 0.00 0.00 175.76 174.98 3k8l s VAL 218 N -3.01 1.09 -0.00 0.00 1.01 -0.80 -5.00 120.40 113.68 3k8l s VAL 218 Ca 0.65 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.22 3k8l s VAL 218 Cb -0.06 -1.04 0.01 0.00 0.00 0.00 0.00 36.38 35.29 3k8l s VAL 218 CO 0.43 0.36 0.00 -0.75 0.00 0.00 0.00 175.10 175.14 3k8l s LYS 219 N 1.04 0.03 0.00 2.72 2.20 -1.26 -1.76 119.74 122.71 3k8l s LYS 219 Ca -0.08 0.02 0.00 0.00 -0.36 0.00 0.00 55.97 55.56 3k8l s LYS 219 Cb -0.15 -0.08 0.00 0.00 -1.51 0.00 0.00 37.83 36.09 3k8l s LYS 219 CO -0.01 -0.03 0.00 0.41 -0.36 0.00 0.00 175.35 175.37 3k8l n GLY 220 N 3.30 2.80 3.62 5.54 0.00 -0.79 -5.00 105.19 114.67 3k8l n GLY 220 Ca -0.15 -1.21 -0.43 0.00 0.00 0.00 0.00 46.02 44.22 3k8l n GLY 220 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3k8l s LEU 221 N 0.00 3.84 0.04 0.99 2.96 -1.26 -1.27 118.68 123.98 3k8l s LEU 221 Ca 0.00 0.78 0.05 0.00 -0.22 0.00 0.00 54.13 54.74 3k8l s LEU 221 Cb 0.00 -3.50 -0.02 0.00 0.50 0.00 0.00 46.19 43.17 3k8l s LEU 221 CO 0.00 -1.01 -0.14 -0.76 -1.32 0.00 0.00 176.35 173.13 3k8l s LEU 222 N 3.90 2.17 -0.22 -0.68 1.43 -0.69 -1.40 118.68 123.19 3k8l s LEU 222 Ca 0.45 -0.46 -0.05 0.00 -1.03 0.00 0.00 54.13 53.05 3k8l s LEU 222 Cb -0.10 -0.59 -0.02 0.00 0.03 0.00 0.00 46.19 45.51 3k8l s LEU 222 CO 0.21 0.03 -0.02 -0.75 0.23 0.00 0.00 176.35 176.05 3k8l s LYS 223 N -1.14 3.47 -0.18 1.70 2.20 0.86 -1.54 119.74 125.11 3k8l s LYS 223 Ca 0.01 -0.58 -0.08 0.00 -0.36 0.00 0.00 55.97 54.96 3k8l s LYS 223 Cb -0.08 -3.07 -0.04 0.00 -1.51 0.00 0.00 37.83 33.13 3k8l s LYS 223 CO 0.01 -0.14 0.08 -0.06 -0.36 0.00 0.00 175.35 174.88 3k8l s PHE 224 N 1.38 3.31 -0.13 4.03 0.08 0.13 -0.86 117.98 125.93 3k8l s PHE 224 Ca 0.05 0.17 0.02 0.00 0.12 0.00 0.00 56.93 57.29 3k8l s PHE 224 Cb -0.14 -2.08 0.01 0.00 -0.57 0.00 0.00 43.02 40.24 3k8l s PHE 224 CO -0.01 0.24 -0.18 0.99 -0.10 0.00 0.00 175.22 176.16 3k8l s THR 225 N 0.24 1.73 -0.11 0.64 2.01 0.17 -1.49 115.64 118.84 3k8l s THR 225 Ca 0.05 -0.78 -0.03 0.00 0.31 0.00 0.00 61.69 61.25 3k8l s THR 225 Cb -0.12 -1.57 -0.03 0.00 0.01 0.00 0.00 72.50 70.79 3k8l s THR 225 CO -0.00 0.49 -0.00 -0.76 -0.69 0.00 0.00 174.62 173.65 3k8l s LEU 226 N 1.00 3.53 -0.37 4.42 1.43 0.11 -1.43 118.68 127.39 3k8l s LEU 226 Ca -0.05 0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.16 3k8l s LEU 226 Cb -0.15 -1.82 0.10 0.00 0.03 0.00 0.00 46.19 44.35 3k8l s LEU 226 CO -0.03 0.32 0.09 -0.62 0.23 0.00 0.00 176.35 176.34 3k8l s ASP 227 N -0.51 4.83 0.00 2.29 -1.08 0.27 -0.94 116.67 121.53 3k8l s ASP 227 Ca 0.09 -2.20 0.22 0.00 -0.52 0.00 0.00 52.55 50.13 3k8l s ASP 227 Cb -0.12 -1.67 0.62 0.00 -1.46 0.00 0.00 42.92 40.29 3k8l s ASP 227 CO 0.02 -0.40 1.49 1.87 0.52 0.00 0.00 175.17 178.67 3k8l n TRP 228 N 4.22 0.29 -0.34 -5.34 -0.00 0.82 -1.64 117.44 115.46 3k8l n TRP 228 Ca 0.03 -0.15 0.19 0.00 -0.00 0.00 0.00 57.50 57.58 3k8l n TRP 228 Cb 0.41 0.00 0.42 0.00 -0.00 0.00 0.00 31.31 32.15 3k8l n TRP 228 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 177.69 178.46 3k8l h SER 229 N 3.08 0.61 -2.26 5.87 0.02 -1.83 0.60 113.55 119.64 3k8l h SER 229 Ca 0.00 0.12 -0.79 0.00 -0.84 0.00 0.00 61.79 60.29 3k8l h SER 229 Cb 0.68 0.03 -0.29 0.00 0.14 0.00 0.00 62.40 62.96 3k8l h SER 229 CO 0.00 0.09 0.85 -3.20 -1.14 0.00 0.00 176.83 173.43 3k8l n ASN 230 N -4.82 7.03 0.00 3.07 5.15 -1.26 -4.95 115.26 119.49 3k8l n ASN 230 Ca 0.27 -3.69 0.00 0.00 -0.60 0.00 0.00 54.58 50.56 3k8l n ASN 230 Cb 0.80 -1.10 0.00 0.00 -0.53 0.00 0.00 39.78 38.94 3k8l n ASN 230 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3k8l n ALA 231 N -0.07 0.00 0.22 5.20 0.00 0.20 -0.20 120.51 125.86 3k8l n ALA 231 Ca 0.45 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.99 3k8l n ALA 231 Cb 0.28 0.00 0.66 0.00 0.00 0.00 0.00 19.45 20.38 3k8l n ALA 231 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3k8l h PRO 232 N 0.00 0.00 -2.55 0.00 0.13 -1.92 -3.30 132.00 124.36 3k8l h PRO 232 Ca 0.00 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.53 3k8l h PRO 232 Cb 0.00 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 30.74 3k8l h PRO 232 CO 0.00 0.00 -0.85 0.43 -0.23 0.00 0.00 178.00 177.35 3k8l n SER 233 N -4.49 0.82 -4.69 1.44 7.64 0.72 -4.79 113.62 110.28 3k8l n SER 233 Ca -0.01 -2.70 -0.32 0.00 1.01 0.00 0.00 58.87 56.86 3k8l n SER 233 Cb 0.18 -0.63 0.15 0.00 -1.01 0.00 0.00 64.21 62.90 3k8l n SER 233 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 3k8l s PRO 234 N -0.62 1.25 -0.06 1.43 0.02 -1.22 -4.72 135.00 131.08 3k8l s PRO 234 Ca 0.31 1.56 0.06 0.00 0.02 0.00 0.00 61.00 62.95 3k8l s PRO 234 Cb 0.03 -1.75 -0.01 0.00 0.02 0.00 0.00 34.50 32.79 3k8l s PRO 234 CO -0.18 -2.46 -0.24 0.42 -0.33 0.00 0.00 177.00 174.21 3k8l s ILE 235 N -2.56 2.01 -0.04 2.83 -1.09 -0.65 -1.89 121.20 119.80 3k8l s ILE 235 Ca 0.68 -1.04 0.06 0.00 -2.23 0.00 0.00 60.65 58.12 3k8l s ILE 235 Cb -0.24 -1.70 -0.02 0.00 -1.58 0.00 0.00 42.46 38.93 3k8l s ILE 235 CO 0.56 0.56 -0.23 -0.22 -1.23 0.00 0.00 174.94 174.37 3k8l s LEU 236 N -0.13 2.18 -0.04 2.97 2.96 -0.55 -0.56 118.68 125.50 3k8l s LEU 236 Ca -0.04 -0.44 -0.00 0.00 -0.22 0.00 0.00 54.13 53.43 3k8l s LEU 236 Cb -0.14 -1.39 0.03 0.00 0.50 0.00 0.00 46.19 45.19 3k8l s LEU 236 CO 0.04 0.29 0.00 -0.69 -1.32 0.00 0.00 176.35 174.67 3k8l s VAL 237 N -0.42 0.23 -0.08 1.68 1.01 -0.51 -0.39 120.40 121.91 3k8l s VAL 237 Ca 0.04 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.14 3k8l s VAL 237 Cb -0.12 -0.35 -0.02 0.00 0.00 0.00 0.00 36.38 35.89 3k8l s VAL 237 CO 0.01 0.18 -0.11 0.54 0.00 0.00 0.00 175.10 175.72 3k8l s VAL 238 N 1.33 3.31 0.23 2.92 0.11 -1.26 -0.65 120.40 126.39 3k8l s VAL 238 Ca -0.05 -0.61 0.01 0.00 -2.93 0.00 0.00 61.98 58.39 3k8l s VAL 238 Cb -0.13 -2.35 -0.04 0.00 -1.53 0.00 0.00 36.38 32.33 3k8l s VAL 238 CO -0.02 0.57 0.16 -0.94 -3.33 0.00 0.00 175.10 171.54 3k8l s SER 239 N -0.45 0.49 0.18 3.54 1.04 -0.04 -0.83 113.70 117.63 3k8l s SER 239 Ca 0.06 -1.46 -0.31 0.00 0.48 0.00 0.00 55.95 54.72 3k8l s SER 239 Cb -0.12 0.40 -0.09 0.00 0.10 0.00 0.00 66.02 66.31 3k8l s SER 239 CO 0.02 -0.88 1.41 -0.89 0.98 0.00 0.00 173.24 173.89 3k8l s THR 240 N -4.01 2.99 0.53 2.02 2.01 -1.26 -0.10 115.64 117.82 3k8l s THR 240 Ca 0.39 0.76 -0.01 0.00 0.31 0.00 0.00 61.69 63.15 3k8l s THR 240 Cb 0.06 -3.49 0.02 0.00 0.01 0.00 0.00 72.50 69.10 3k8l s THR 240 CO 0.15 0.09 0.77 -0.83 -0.69 0.00 0.00 174.62 174.11 3k8l s GLY 241 N 0.72 1.67 0.00 4.40 0.00 -0.49 -4.51 107.32 109.10 3k8l s GLY 241 Ca 0.62 -1.08 0.00 0.00 0.00 0.00 0.00 44.72 44.26 3k8l s GLY 241 CO 0.36 -0.83 0.00 -1.30 0.00 0.00 0.00 173.10 171.33 3k8l n THR 242 N -2.32 0.00 -3.76 0.90 -2.24 -1.26 -4.82 114.28 100.77 3k8l n THR 242 Ca 0.05 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.69 3k8l n THR 242 Cb 0.59 -0.51 -0.15 0.00 -2.10 0.00 0.00 70.33 68.16 3k8l n THR 242 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3k8l s LYS 243 N -1.98 0.06 0.17 -0.78 2.36 -1.26 -5.13 119.74 113.18 3k8l s LYS 243 Ca 0.00 0.32 -0.30 0.00 -2.55 0.00 0.00 55.97 53.44 3k8l s LYS 243 Cb 0.00 -0.18 -0.08 0.00 -1.05 0.00 0.00 37.83 36.52 3k8l s LYS 243 CO 0.00 -0.16 1.20 0.00 1.55 0.00 0.00 175.35 177.95 3k8l s ALA 244 N 1.10 3.44 0.60 3.13 0.00 -1.26 -4.76 121.76 124.00 3k8l s ALA 244 Ca -0.09 0.95 -0.13 0.00 0.00 0.00 0.00 51.96 52.69 3k8l s ALA 244 Cb -0.11 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 3k8l s ALA 244 CO -0.05 -0.39 1.03 -0.51 0.00 0.00 0.00 175.76 175.84 3k8l s ASP 245 N 0.27 6.16 0.36 0.00 1.01 -0.52 -4.99 116.67 118.96 3k8l s ASP 245 Ca 0.54 1.53 -0.18 0.00 0.71 0.00 0.00 52.55 55.14 3k8l s ASP 245 Cb -0.32 -2.49 -0.10 0.00 1.01 0.00 0.00 42.92 41.02 3k8l s ASP 245 CO 0.35 -0.91 0.83 -1.61 0.21 0.00 0.00 175.17 174.04 3k8l s GLU 246 N -4.76 4.14 -0.06 8.23 0.41 -1.26 -4.91 118.70 120.49 3k8l s GLU 246 Ca 0.57 0.90 -0.37 0.00 -0.41 0.00 0.00 54.97 55.66 3k8l s GLU 246 Cb -0.12 -2.39 -0.15 0.00 -1.78 0.00 0.00 34.13 29.70 3k8l s GLU 246 CO 0.47 0.11 1.64 -0.25 -0.49 0.00 0.00 175.26 176.73 3k8l n ASP 247 N -0.34 2.56 -4.70 -0.19 8.00 -1.26 -4.74 116.55 115.88 3k8l n ASP 247 Ca 0.04 1.06 -0.61 0.00 0.71 0.00 0.00 54.79 56.00 3k8l n ASP 247 Cb 0.53 -1.26 -0.08 0.00 -0.02 0.00 0.00 41.12 40.29 3k8l n ASP 247 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3k8l n ASN 248 N 4.55 1.73 0.24 -2.24 2.85 -1.26 -4.82 115.26 116.31 3k8l n ASN 248 Ca 0.22 1.12 0.12 0.00 -0.11 0.00 0.00 54.58 55.94 3k8l n ASN 248 Cb 0.21 -1.04 0.56 0.00 1.24 0.00 0.00 39.78 40.75 3k8l n ASN 248 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3k8l h PRO 249 N 5.87 0.00 -5.88 1.20 0.13 -1.98 -3.39 132.00 127.95 3k8l h PRO 249 Ca -0.46 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.08 3k8l h PRO 249 Cb 1.35 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.36 3k8l h PRO 249 CO 0.92 0.15 0.91 0.34 -0.23 0.00 0.00 178.00 180.09 3k8l s ASP 250 N -6.03 6.25 -0.05 1.44 -1.08 -1.26 -4.88 116.67 111.06 3k8l s ASP 250 Ca 0.00 -0.91 0.07 0.00 -0.52 0.00 0.00 52.55 51.19 3k8l s ASP 250 Cb 0.10 -2.50 0.28 0.00 -1.46 0.00 0.00 42.92 39.34 3k8l s ASP 250 CO 0.60 -1.59 1.08 0.35 0.52 0.00 0.00 175.17 176.14 3k8l n THR 251 N 6.21 0.72 -1.76 1.71 -2.24 -1.26 -4.94 114.28 112.71 3k8l n THR 251 Ca 0.06 -0.45 -0.39 0.00 -2.27 0.00 0.00 64.05 60.99 3k8l n THR 251 Cb 0.48 -0.13 0.03 0.00 -2.10 0.00 0.00 70.33 68.60 3k8l n THR 251 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k8l n GLY 252 N 0.57 0.97 0.02 3.38 0.00 -1.26 -4.93 105.19 103.93 3k8l n GLY 252 Ca 0.10 0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.36 3k8l n GLY 252 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k8l n THR 253 N -0.48 0.08 -1.93 2.61 -2.24 -1.26 -4.70 114.28 106.36 3k8l n THR 253 Ca 0.07 -0.16 -0.42 0.00 -2.27 0.00 0.00 64.05 61.27 3k8l n THR 253 Cb 0.42 0.42 -0.03 0.00 -2.10 0.00 0.00 70.33 69.04 3k8l n THR 253 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3k8l s ASP 254 N -3.58 6.61 -2.07 3.42 -4.77 -1.26 -2.42 116.67 112.59 3k8l s ASP 254 Ca 0.05 2.33 0.00 0.00 -3.30 0.00 0.00 52.55 51.63 3k8l s ASP 254 Cb 0.15 -2.53 0.00 0.00 -1.09 0.00 0.00 42.92 39.45 3k8l s ASP 254 CO 0.81 -0.96 0.00 0.59 0.70 0.00 0.00 175.17 176.31 3k8l n ASN 255 N 7.26 -5.31 -4.79 2.11 3.02 -1.26 -4.95 115.26 111.35 3k8l n ASN 255 Ca 0.18 0.44 -0.36 0.00 -0.03 0.00 0.00 54.58 54.81 3k8l n ASN 255 Cb 0.42 -4.68 -0.05 0.00 -0.61 0.00 0.00 39.78 34.87 3k8l n ASN 255 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k8l s ALA 256 N -2.73 3.07 -0.01 5.41 0.00 -1.02 -5.06 121.76 121.42 3k8l s ALA 256 Ca 0.00 0.63 0.07 0.00 0.00 0.00 0.00 51.96 52.66 3k8l s ALA 256 Cb 0.00 -3.24 -0.02 0.00 0.00 0.00 0.00 23.12 19.86 3k8l s ALA 256 CO 0.00 -0.14 -0.22 0.15 0.00 0.00 0.00 175.76 175.56 3k8l s LYS 257 N -2.61 1.76 0.12 0.00 -0.14 -1.26 -4.46 119.74 113.15 3k8l s LYS 257 Ca 0.58 -0.79 0.07 0.00 -1.36 0.00 0.00 55.97 54.47 3k8l s LYS 257 Cb -0.19 -1.71 -0.04 0.00 -1.68 0.00 0.00 37.83 34.21 3k8l s LYS 257 CO 0.24 0.47 -0.17 0.71 -0.76 0.00 0.00 175.35 175.84 3k8l s TYR 258 N -0.52 1.57 -0.21 3.18 2.02 0.12 -0.51 117.35 122.99 3k8l s TYR 258 Ca 0.08 -0.48 -0.08 0.00 -0.37 0.00 0.00 57.07 56.23 3k8l s TYR 258 Cb -0.08 -0.83 -0.04 0.00 -0.40 0.00 0.00 41.96 40.60 3k8l s TYR 258 CO -0.01 0.19 0.08 -1.17 -1.57 0.00 0.00 175.55 173.07 3k8l s LEU 259 N -2.22 3.71 -0.13 -1.29 2.96 0.14 -1.69 118.68 120.18 3k8l s LEU 259 Ca 0.08 -0.02 0.02 0.00 -0.22 0.00 0.00 54.13 53.98 3k8l s LEU 259 Cb -0.07 -1.97 0.02 0.00 0.50 0.00 0.00 46.19 44.67 3k8l s LEU 259 CO 0.04 0.09 -0.17 -0.47 -1.32 0.00 0.00 176.35 174.52 3k8l s TYR 260 N 0.90 2.22 0.33 5.38 5.04 -0.39 -1.29 117.35 129.53 3k8l s TYR 260 Ca 0.04 -1.13 -0.12 0.00 -2.44 0.00 0.00 57.07 53.43 3k8l s TYR 260 Cb -0.14 -1.58 0.05 0.00 0.35 0.00 0.00 41.96 40.64 3k8l s TYR 260 CO 0.03 -0.57 0.65 2.48 -1.34 0.00 0.00 175.55 176.80 3k8l n TYR 261 N 4.33 -2.10 -2.47 4.97 0.18 -0.82 -0.59 117.16 120.65 3k8l n TYR 261 Ca -0.19 -1.59 0.00 0.00 1.88 0.00 0.00 57.90 58.00 3k8l n TYR 261 Cb 0.51 0.76 0.00 0.00 -0.38 0.00 0.00 39.34 40.23 3k8l n TYR 261 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3k8l n GLY 262 N -0.45 1.78 3.12 -7.48 0.00 -1.25 -1.43 105.19 99.47 3k8l n GLY 262 Ca -0.07 -0.40 -0.43 0.00 0.00 0.00 0.00 46.02 45.12 3k8l n GLY 262 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k8l n GLU 263 N 10.06 3.32 -3.55 1.61 1.02 -1.26 -4.47 120.64 127.36 3k8l n GLU 263 Ca 0.00 -3.37 -0.22 0.00 -0.02 0.00 0.00 57.16 53.55 3k8l n GLU 263 Cb 0.00 -3.14 0.08 0.00 -0.02 0.00 0.00 31.44 28.37 3k8l n GLU 263 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3k8l n ASP 264 N 5.62 -5.15 -4.67 1.62 2.03 -1.23 -4.97 116.55 109.81 3k8l n ASP 264 Ca 0.43 -0.56 -0.39 0.00 0.52 0.00 0.00 54.79 54.79 3k8l n ASP 264 Cb 0.40 -5.06 -0.07 0.00 -0.72 0.00 0.00 41.12 35.68 3k8l n ASP 264 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3k8l s ILE 265 N -3.33 5.15 -0.21 5.18 -1.09 -0.52 -4.98 121.20 121.39 3k8l s ILE 265 Ca 0.42 0.85 -0.00 0.00 -2.23 0.00 0.00 60.65 59.68 3k8l s ILE 265 Cb -0.19 -3.79 0.06 0.00 -1.58 0.00 0.00 42.46 36.96 3k8l s ILE 265 CO 0.73 0.21 -0.03 0.00 -1.23 0.00 0.00 174.94 174.63 3k8l s LYS 267 N 1.55 2.69 0.03 0.00 -0.14 -0.41 -4.94 119.74 118.52 3k8l s LYS 267 Ca -0.04 -0.72 -0.25 0.00 -1.36 0.00 0.00 55.97 53.60 3k8l s LYS 267 Cb -0.18 -2.40 -0.05 0.00 -1.68 0.00 0.00 37.83 33.52 3k8l s LYS 267 CO -0.07 0.50 0.76 0.21 -0.76 0.00 0.00 175.35 176.00 3k8l s LYS 268 N -0.43 4.49 1.03 1.68 2.20 -1.26 0.28 119.74 127.73 3k8l s LYS 268 Ca 0.05 1.05 -0.13 0.00 -0.36 0.00 0.00 55.97 56.58 3k8l s LYS 268 Cb -0.12 -3.38 0.21 0.00 -1.51 0.00 0.00 37.83 33.03 3k8l s LYS 268 CO 0.02 0.24 1.09 -0.06 -0.36 0.00 0.00 175.35 176.28 3k8l s PHE 269 N 0.10 2.00 -0.18 4.03 0.40 0.33 -4.53 117.98 120.13 3k8l s PHE 269 Ca 0.39 0.97 -0.07 0.00 -0.60 0.00 0.00 56.93 57.62 3k8l s PHE 269 Cb -0.20 -3.26 -0.04 0.00 0.51 0.00 0.00 43.02 40.03 3k8l s PHE 269 CO 0.22 -3.05 0.04 0.71 0.70 0.00 0.00 175.22 173.85 3k8l s TYR 270 N -2.93 3.21 -0.22 0.36 1.51 -0.28 -4.84 117.35 114.16 3k8l s TYR 270 Ca 0.66 -0.00 -0.29 0.00 -1.01 0.00 0.00 57.07 56.42 3k8l s TYR 270 Cb -0.19 -2.05 0.00 0.00 -0.11 0.00 0.00 41.96 39.61 3k8l s TYR 270 CO 0.58 0.12 1.13 0.34 -1.11 0.00 0.00 175.55 176.60 3k8l s ASP 271 N 0.37 7.02 -0.14 2.29 -1.08 -1.26 -1.44 116.67 122.42 3k8l s ASP 271 Ca 0.02 1.44 0.16 0.00 -0.52 0.00 0.00 52.55 53.65 3k8l s ASP 271 Cb -0.13 -2.54 0.65 0.00 -1.46 0.00 0.00 42.92 39.44 3k8l s ASP 271 CO 0.01 -0.74 1.57 0.29 0.52 0.00 0.00 175.17 176.82 3k8l n LYS 272 N 6.51 3.71 -0.87 4.34 4.76 0.41 -4.99 118.16 132.03 3k8l n LYS 272 Ca 0.13 -2.85 0.03 0.00 -2.87 0.00 0.00 58.31 52.75 3k8l n LYS 272 Cb 0.46 -1.89 -0.02 0.00 -1.84 0.00 0.00 35.03 31.74 3k8l n LYS 272 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3k8l n GLY 273 N 0.55 -3.39 2.70 0.72 0.00 -1.25 -4.79 105.19 99.73 3k8l n GLY 273 Ca 0.24 -1.10 -0.15 0.00 0.00 0.00 0.00 46.02 45.01 3k8l n GLY 273 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3k8l n ASN 274 N -2.48 -4.68 -3.13 1.61 3.02 -1.26 -3.14 115.26 105.19 3k8l n ASN 274 Ca -0.02 -0.26 -0.23 0.00 -0.03 0.00 0.00 54.58 54.05 3k8l n ASN 274 Cb 0.31 -3.43 0.02 0.00 -0.61 0.00 0.00 39.78 36.07 3k8l n ASN 274 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3k8l n ASN 275 N -1.20 -5.29 -4.20 6.41 3.02 -1.26 -4.69 115.26 108.05 3k8l n ASN 275 Ca -0.04 -0.32 -0.33 0.00 -0.03 0.00 0.00 54.58 53.87 3k8l n ASN 275 Cb 0.56 -4.30 -0.16 0.00 -0.61 0.00 0.00 39.78 35.27 3k8l n ASN 275 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3k8l s ILE 276 N -3.09 2.24 0.06 2.41 -1.09 -1.19 -0.13 121.20 120.41 3k8l s ILE 276 Ca 0.34 -0.92 0.09 0.00 -2.23 0.00 0.00 60.65 57.92 3k8l s ILE 276 Cb -0.16 -1.91 -0.03 0.00 -1.58 0.00 0.00 42.46 38.78 3k8l s ILE 276 CO 0.41 0.54 -0.25 -0.31 -1.23 0.00 0.00 174.94 174.10 3k8l s TYR 277 N 0.78 2.19 -0.05 3.97 1.51 -0.11 -0.45 117.35 125.19 3k8l s TYR 277 Ca -0.07 -0.40 -0.08 0.00 -1.01 0.00 0.00 57.07 55.51 3k8l s TYR 277 Cb -0.16 -1.29 0.01 0.00 -0.11 0.00 0.00 41.96 40.42 3k8l s TYR 277 CO -0.01 0.15 0.20 -2.00 -1.11 0.00 0.00 175.55 172.78 3k8l s GLU 278 N -1.37 0.35 -0.28 -0.62 2.12 -0.52 0.09 118.70 118.48 3k8l s GLU 278 Ca 0.11 0.04 -0.22 0.00 0.36 0.00 0.00 54.97 55.26 3k8l s GLU 278 Cb -0.10 0.16 0.09 0.00 0.26 0.00 0.00 34.13 34.54 3k8l s GLU 278 CO 0.03 -0.07 0.79 -1.17 -0.54 0.00 0.00 175.26 174.30 3k8l s LEU 279 N -0.47 -0.73 -0.08 2.70 2.96 -0.55 -1.12 118.68 121.39 3k8l s LEU 279 Ca -0.06 1.32 0.05 0.00 -0.22 0.00 0.00 54.13 55.22 3k8l s LEU 279 Cb -0.04 2.29 -0.01 0.00 0.50 0.00 0.00 46.19 48.94 3k8l s LEU 279 CO 0.01 -0.22 -0.24 -0.89 -1.32 0.00 0.00 176.35 173.69 3k8l s THR 280 N 0.72 2.14 0.20 3.68 2.01 -1.26 0.21 115.64 123.34 3k8l s THR 280 Ca -0.02 -1.02 -0.07 0.00 0.31 0.00 0.00 61.69 60.88 3k8l s THR 280 Cb -0.05 -1.79 -0.02 0.00 0.01 0.00 0.00 72.50 70.65 3k8l s THR 280 CO -0.06 0.56 0.29 0.68 -0.69 0.00 0.00 174.62 175.40 3k8l s VAL 281 N 0.03 0.03 -1.22 3.82 -7.23 -0.59 -1.44 120.40 113.80 3k8l s VAL 281 Ca -0.09 -1.61 -0.14 0.00 -1.81 0.00 0.00 61.98 58.33 3k8l s VAL 281 Cb -0.15 -2.18 0.16 0.00 0.56 0.00 0.00 36.38 34.77 3k8l s VAL 281 CO 0.06 -0.12 1.49 0.47 -0.31 0.00 0.00 175.10 176.69 3k8l n ASP 282 N -0.28 5.19 -4.74 4.85 8.00 -1.26 -1.71 116.55 126.60 3k8l n ASP 282 Ca -0.02 -2.98 -0.38 0.00 0.71 0.00 0.00 54.79 52.12 3k8l n ASP 282 Cb 0.64 -1.58 0.05 0.00 -0.02 0.00 0.00 41.12 40.20 3k8l n ASP 282 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3k8l s PHE 283 N 1.75 2.20 -0.30 1.24 5.36 -0.40 -4.83 117.98 123.01 3k8l s PHE 283 Ca 0.44 1.40 -0.05 0.00 -0.96 0.00 0.00 56.93 57.76 3k8l s PHE 283 Cb -0.02 -3.79 0.19 0.00 -0.34 0.00 0.00 43.02 39.07 3k8l s PHE 283 CO 0.01 -2.96 0.85 -2.00 -1.46 0.00 0.00 175.22 169.66 3k8l s GLU 284 N -3.05 0.33 -0.10 10.12 2.12 -1.24 -1.88 118.70 124.99 3k8l s GLU 284 Ca 0.75 0.37 -0.07 0.00 0.36 0.00 0.00 54.97 56.38 3k8l s GLU 284 Cb -0.40 0.18 0.04 0.00 0.26 0.00 0.00 34.13 34.21 3k8l s GLU 284 CO 0.46 -0.56 0.26 0.45 -0.54 0.00 0.00 175.26 175.32 3k8l s SER 285 N 2.90 -0.28 0.11 -1.70 0.15 -0.72 -3.94 113.70 110.22 3k8l s SER 285 Ca 0.18 0.54 0.12 0.00 0.70 0.00 0.00 55.95 57.48 3k8l s SER 285 Cb -0.07 0.48 -0.14 0.00 -1.71 0.00 0.00 66.02 64.58 3k8l s SER 285 CO -0.23 -0.13 1.09 0.71 1.20 0.00 0.00 173.24 175.88 3k8l h THR 286 N 5.30 1.10 0.00 6.45 1.35 -1.92 -2.14 112.91 123.05 3k8l h THR 286 Ca -0.33 -2.73 0.00 0.00 -0.55 0.00 0.00 66.41 62.80 3k8l h THR 286 Cb 1.18 2.50 0.00 0.00 -1.73 0.00 0.00 68.15 70.10 3k8l h THR 286 CO 0.36 0.63 -0.89 -2.67 -0.25 0.00 0.00 175.52 172.69 3k8l n TRP 287 N -3.17 0.00 0.00 4.73 4.27 -1.26 -4.66 117.44 117.35 3k8l n TRP 287 Ca -0.05 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.56 3k8l n TRP 287 Cb 0.90 -0.01 0.00 0.00 -1.36 0.00 0.00 31.31 30.84 3k8l n TRP 287 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 3k8l n GLY 288 N 1.43 0.24 3.75 -1.67 0.00 -1.26 -4.67 105.19 103.01 3k8l n GLY 288 Ca 0.03 -1.86 -0.08 0.00 0.00 0.00 0.00 46.02 44.11 3k8l n GLY 288 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3k8l s LEU 289 N 0.00 -0.01 0.09 0.99 0.05 0.29 -4.08 118.68 116.01 3k8l s LEU 289 Ca 0.00 -0.76 -0.04 0.00 0.05 0.00 0.00 54.13 53.37 3k8l s LEU 289 Cb 0.00 2.34 -0.02 0.00 -2.05 0.00 0.00 46.19 46.46 3k8l s LEU 289 CO 0.00 -1.28 0.09 -0.76 -0.55 0.00 0.00 176.35 173.86 3k8l s LEU 290 N -2.97 1.83 -0.11 1.48 1.43 0.24 -0.97 118.68 119.61 3k8l s LEU 290 Ca 0.16 -0.91 0.01 0.00 -1.03 0.00 0.00 54.13 52.36 3k8l s LEU 290 Cb -0.04 0.61 -0.02 0.00 0.03 0.00 0.00 46.19 46.77 3k8l s LEU 290 CO 0.08 -0.70 -0.14 -0.63 0.23 0.00 0.00 176.35 175.19 3k8l s ILE 291 N -3.93 2.97 0.18 -0.59 -1.09 -0.71 -1.26 121.20 116.77 3k8l s ILE 291 Ca 0.11 -0.70 0.11 0.00 -2.23 0.00 0.00 60.65 57.93 3k8l s ILE 291 Cb 0.06 -2.23 -0.04 0.00 -1.58 0.00 0.00 42.46 38.67 3k8l s ILE 291 CO -0.07 0.54 -0.23 -0.13 -1.23 0.00 0.00 174.94 173.82 3k8l s ARG 292 N 0.18 1.46 -0.06 2.79 0.52 -0.68 -0.28 118.95 122.88 3k8l s ARG 292 Ca -0.08 -1.49 0.14 0.00 -0.52 0.00 0.00 55.73 53.78 3k8l s ARG 292 Cb -0.15 -1.74 0.42 0.00 0.52 0.00 0.00 34.95 34.01 3k8l s ARG 292 CO 0.05 0.37 1.35 0.25 0.02 0.00 0.00 175.30 177.35 3k8l n THR 293 N 0.31 1.42 -3.62 0.02 -2.24 -0.83 -0.70 114.28 108.64 3k8l n THR 293 Ca -0.13 -1.24 -0.15 0.00 -2.27 0.00 0.00 64.05 60.25 3k8l n THR 293 Cb 0.56 0.27 -0.07 0.00 -2.10 0.00 0.00 70.33 68.99 3k8l n THR 293 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3k8l s SER 294 N -1.23 -0.43 -0.09 3.42 0.15 -1.26 -4.72 113.70 109.54 3k8l s SER 294 Ca 0.32 0.36 0.12 0.00 0.70 0.00 0.00 55.95 57.45 3k8l s SER 294 Cb 0.21 0.44 0.21 0.00 -1.71 0.00 0.00 66.02 65.17 3k8l s SER 294 CO 0.16 -0.57 1.11 -0.46 1.20 0.00 0.00 173.24 174.67 3k8l n ASN 295 N 0.93 1.45 -4.81 5.45 6.94 -1.26 -4.89 115.26 119.07 3k8l n ASN 295 Ca -0.20 -2.74 -0.31 0.00 -0.02 0.00 0.00 54.58 51.32 3k8l n ASN 295 Cb 0.57 -0.35 0.06 0.00 -2.36 0.00 0.00 39.78 37.70 3k8l n ASN 295 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3k8l s ALA 296 N -1.81 2.53 0.23 -2.53 0.00 -1.26 -4.95 121.76 113.97 3k8l s ALA 296 Ca 0.22 0.01 -0.07 0.00 0.00 0.00 0.00 51.96 52.12 3k8l s ALA 296 Cb 0.20 -3.16 0.27 0.00 0.00 0.00 0.00 23.12 20.43 3k8l s ALA 296 CO 0.00 -1.40 1.86 1.03 0.00 0.00 0.00 175.76 177.25 3k8l h SER 297 N -0.85 0.85 -3.31 0.00 0.87 -2.06 -3.40 113.55 105.65 3k8l h SER 297 Ca -0.45 0.00 -0.57 0.00 -1.23 0.00 0.00 61.79 59.54 3k8l h SER 297 Cb 1.23 -0.18 -0.07 0.00 -0.44 0.00 0.00 62.40 62.94 3k8l h SER 297 CO 0.57 0.57 -0.07 0.12 -0.53 0.00 0.00 176.83 177.50 3k8l s PHE 298 N -6.09 3.59 -0.57 2.24 5.36 -1.26 -5.04 117.98 116.21 3k8l s PHE 298 Ca -0.13 1.04 -0.22 0.00 -0.96 0.00 0.00 56.93 56.67 3k8l s PHE 298 Cb 0.17 -2.59 0.06 0.00 -0.34 0.00 0.00 43.02 40.32 3k8l s PHE 298 CO 0.79 0.24 0.84 -1.58 -1.46 0.00 0.00 175.22 174.05 3k8l s TRP 299 N 0.30 2.85 0.70 10.12 0.52 -1.26 -4.98 118.94 127.20 3k8l s TRP 299 Ca 0.29 -0.39 -0.14 0.00 0.02 0.00 0.00 56.10 55.88 3k8l s TRP 299 Cb -0.17 -3.97 0.02 0.00 -1.15 0.00 0.00 33.47 28.20 3k8l s TRP 299 CO 0.14 -1.34 1.12 -2.14 0.02 0.00 0.00 176.95 174.75 3k8l s PRO 300 N 3.49 2.51 0.29 4.98 0.02 -1.26 -4.95 135.00 140.08 3k8l s PRO 300 Ca 0.22 1.41 -0.30 0.00 0.02 0.00 0.00 61.00 62.35 3k8l s PRO 300 Cb -0.17 -1.91 -0.11 0.00 0.02 0.00 0.00 34.50 32.34 3k8l s PRO 300 CO 0.14 -1.48 1.48 -1.54 -0.33 0.00 0.00 177.00 175.27 3k8l s SER 301 N -2.66 6.54 0.00 2.53 1.04 -1.26 -2.85 113.70 117.03 3k8l s SER 301 Ca 0.67 2.81 0.00 0.00 0.48 0.00 0.00 55.95 59.91 3k8l s SER 301 Cb -0.21 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.27 3k8l s SER 301 CO 0.46 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 174.51 3k8l n GLY 302 N 1.82 1.18 0.86 7.32 0.00 -1.26 -4.90 105.19 110.20 3k8l n GLY 302 Ca 0.06 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.19 3k8l n GLY 302 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k8l n THR 303 N -2.00 0.26 -3.84 2.61 -2.24 -1.13 -4.84 114.28 103.08 3k8l n THR 303 Ca 0.00 -0.52 -0.36 0.00 -2.27 0.00 0.00 64.05 60.90 3k8l n THR 303 Cb 0.00 0.84 -0.13 0.00 -2.10 0.00 0.00 70.33 68.95 3k8l n THR 303 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3k8l s LYS 304 N -1.74 3.63 -0.14 -0.78 2.20 -1.26 -1.96 119.74 119.69 3k8l s LYS 304 Ca 0.35 -0.50 0.00 0.00 -0.36 0.00 0.00 55.97 55.46 3k8l s LYS 304 Cb 0.20 -3.24 -0.01 0.00 -1.51 0.00 0.00 37.83 33.28 3k8l s LYS 304 CO 0.30 -0.13 -0.14 0.71 -0.36 0.00 0.00 175.35 175.73 3k8l s TYR 305 N 1.43 2.79 0.00 4.03 1.51 0.62 -4.20 117.35 123.53 3k8l s TYR 305 Ca 0.05 -0.77 0.00 0.00 -1.01 0.00 0.00 57.07 55.34 3k8l s TYR 305 Cb -0.15 -1.86 0.00 0.00 -0.11 0.00 0.00 41.96 39.85 3k8l s TYR 305 CO 0.02 -0.30 0.00 0.41 -1.11 0.00 0.00 175.55 174.57 3k8l n GLY 306 N 3.70 4.18 3.84 0.71 0.00 0.11 -1.74 105.19 116.00 3k8l n GLY 306 Ca -0.18 -0.85 -0.35 0.00 0.00 0.00 0.00 46.02 44.64 3k8l n GLY 306 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k8l s ALA 307 N -1.44 3.51 0.41 4.61 0.00 -0.57 -1.70 121.76 126.58 3k8l s ALA 307 Ca 0.00 -0.05 0.37 0.00 0.00 0.00 0.00 51.96 52.28 3k8l s ALA 307 Cb 0.00 -2.62 1.85 0.00 0.00 0.00 0.00 23.12 22.36 3k8l s ALA 307 CO 0.00 0.41 2.17 0.66 0.00 0.00 0.00 175.76 179.01 3k8l h SER 308 N 3.30 0.00 -5.01 0.00 4.64 -1.88 -1.39 113.55 113.21 3k8l h SER 308 Ca -0.48 0.00 0.10 0.00 -0.47 0.00 0.00 61.79 60.94 3k8l h SER 308 Cb 1.19 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.18 3k8l h SER 308 CO 0.66 0.02 0.39 -0.94 -0.87 0.00 0.00 176.83 176.09 3k8l s SER 309 N -5.55 -0.32 0.55 4.97 1.04 -1.26 -4.78 113.70 108.34 3k8l s SER 309 Ca -0.02 -0.25 0.22 0.00 0.48 0.00 0.00 55.95 56.37 3k8l s SER 309 Cb 0.12 0.52 1.51 0.00 0.10 0.00 0.00 66.02 68.26 3k8l s SER 309 CO 0.49 -0.91 2.20 0.28 0.98 0.00 0.00 173.24 176.28 3k8l h SER 310 N 2.00 0.00 -0.12 7.02 0.02 -1.91 -2.69 113.55 117.87 3k8l h SER 310 Ca -0.24 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.59 3k8l h SER 310 Cb 1.25 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.78 3k8l h SER 310 CO 0.29 0.00 -0.31 0.77 -1.14 0.00 0.00 176.83 176.43 3k8l h SER 311 N 0.00 0.63 -2.68 3.07 4.64 -1.97 -3.42 113.55 113.82 3k8l h SER 311 Ca -0.00 -0.25 -0.58 0.00 -0.47 0.00 0.00 61.79 60.50 3k8l h SER 311 Cb 0.00 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 61.89 3k8l h SER 311 CO 0.00 0.90 1.26 -1.61 -0.87 0.00 0.00 176.83 176.51 3k8l s GLU 312 N -4.41 3.41 0.30 4.77 0.41 -1.02 -4.98 118.70 117.18 3k8l s GLU 312 Ca -0.08 1.48 0.07 0.00 -0.41 0.00 0.00 54.97 56.04 3k8l s GLU 312 Cb 0.13 -4.18 -0.03 0.00 -1.78 0.00 0.00 34.13 28.27 3k8l s GLU 312 CO 0.82 -1.77 0.22 0.15 -0.49 0.00 0.00 175.26 174.19 3k8l s LYS 313 N 5.51 2.75 -0.26 1.61 3.01 -1.26 -4.64 119.74 126.46 3k8l s LYS 313 Ca 0.79 -1.23 -0.09 0.00 -1.01 0.00 0.00 55.97 54.43 3k8l s LYS 313 Cb -0.23 -2.47 -0.04 0.00 -1.01 0.00 0.00 37.83 34.08 3k8l s LYS 313 CO 0.33 0.24 0.14 -1.17 0.51 0.00 0.00 175.35 175.40 3k8l s LEU 314 N -3.90 3.80 0.09 3.17 2.96 0.54 -4.82 118.68 120.51 3k8l s LEU 314 Ca 0.37 -0.07 0.07 0.00 -0.22 0.00 0.00 54.13 54.28 3k8l s LEU 314 Cb -0.06 -2.04 -0.04 0.00 0.50 0.00 0.00 46.19 44.55 3k8l s LEU 314 CO 0.25 -0.03 -0.13 0.00 -1.32 0.00 0.00 176.35 175.12 3k8l s ALA 315 N 1.60 2.82 0.46 5.97 0.00 -1.26 -1.47 121.76 129.89 3k8l s ALA 315 Ca 0.07 -1.24 -0.25 0.00 0.00 0.00 0.00 51.96 50.54 3k8l s ALA 315 Cb -0.15 -0.82 -0.08 0.00 0.00 0.00 0.00 23.12 22.06 3k8l s ALA 315 CO 0.07 0.61 1.38 1.28 0.00 0.00 0.00 175.76 179.11 3k8l n LEU 316 N 0.96 4.96 -3.79 0.00 4.77 -1.26 -2.91 117.00 119.73 3k8l n LEU 316 Ca -0.15 1.09 -0.30 0.00 -0.03 0.00 0.00 56.01 56.63 3k8l n LEU 316 Cb 0.52 -1.58 -0.00 0.00 -2.33 0.00 0.00 43.42 40.04 3k8l n LEU 316 CO 0.31 -0.34 0.01 0.59 -1.33 0.00 0.00 177.39 176.62 3k8l n ASN 317 N -0.25 -3.98 -3.79 -1.43 3.02 -0.01 -4.96 115.26 103.86 3k8l n ASN 317 Ca 0.06 -0.70 -0.17 0.00 -0.03 0.00 0.00 54.58 53.75 3k8l n ASN 317 Cb 0.42 -3.24 -0.16 0.00 -0.61 0.00 0.00 39.78 36.18 3k8l n ASN 317 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3k8l s LYS 318 N -6.48 0.16 0.00 3.52 2.47 -1.15 -5.05 119.74 113.22 3k8l s LYS 318 Ca 0.59 0.14 -0.34 0.00 -1.56 0.00 0.00 55.97 54.81 3k8l s LYS 318 Cb -0.31 -0.42 -0.12 0.00 -1.46 0.00 0.00 37.83 35.52 3k8l s LYS 318 CO 0.73 -0.17 1.79 -0.25 0.16 0.00 0.00 175.35 177.60 3k8l n ASP 319 N 4.29 3.40 -4.45 1.43 8.00 -1.26 -4.66 116.55 123.30 3k8l n ASP 319 Ca -0.24 1.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.92 3k8l n ASP 319 Cb 0.50 -1.40 -0.13 0.00 -0.02 0.00 0.00 41.12 40.07 3k8l n ASP 319 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3k8l s PHE 320 N 3.03 2.99 -0.54 1.24 5.36 0.47 -4.96 117.98 125.58 3k8l s PHE 320 Ca 0.88 -0.46 -0.29 0.00 -0.96 0.00 0.00 56.93 56.10 3k8l s PHE 320 Cb -0.67 -1.99 0.03 0.00 -0.34 0.00 0.00 43.02 40.05 3k8l s PHE 320 CO 0.46 -0.17 1.19 0.15 -1.46 0.00 0.00 175.22 175.39 3k8l s LYS 321 N 0.65 3.59 0.37 10.12 1.02 -1.26 -1.49 119.74 132.74 3k8l s LYS 321 Ca -0.02 0.40 -0.13 0.00 0.02 0.00 0.00 55.97 56.24 3k8l s LYS 321 Cb -0.14 -3.98 -0.08 0.00 -0.52 0.00 0.00 37.83 33.11 3k8l s LYS 321 CO 0.02 -1.58 0.76 -0.51 -0.92 0.00 0.00 175.35 173.13 3k8l s LEU 322 N 4.83 3.94 -0.05 3.17 1.43 -0.79 -4.63 118.68 126.57 3k8l s LEU 322 Ca 0.46 1.23 -0.15 0.00 -1.03 0.00 0.00 54.13 54.64 3k8l s LEU 322 Cb -0.08 -4.07 0.03 0.00 0.03 0.00 0.00 46.19 42.10 3k8l s LEU 322 CO 0.28 -0.31 0.34 0.28 0.23 0.00 0.00 176.35 177.17 3k8l s THR 323 N -2.19 0.04 -0.42 5.49 -1.32 -0.69 -4.14 115.64 112.42 3k8l s THR 323 Ca 0.53 -0.31 0.05 0.00 -1.21 0.00 0.00 61.69 60.74 3k8l s THR 323 Cb -0.10 -0.59 0.13 0.00 -1.51 0.00 0.00 72.50 70.43 3k8l s THR 323 CO 0.24 -0.17 1.10 -0.46 -2.21 0.00 0.00 174.62 173.12 3k8l n ASN 324 N 1.76 2.38 -4.77 8.08 6.94 -1.26 -0.71 115.26 127.68 3k8l n ASN 324 Ca -0.19 -1.98 -0.39 0.00 -0.02 0.00 0.00 54.58 52.00 3k8l n ASN 324 Cb 0.56 -0.10 -0.02 0.00 -2.36 0.00 0.00 39.78 37.87 3k8l n ASN 324 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3k8l s ALA 325 N -0.98 3.25 0.00 -2.53 0.00 -1.26 -4.70 121.76 115.54 3k8l s ALA 325 Ca 0.10 1.08 0.00 0.00 0.00 0.00 0.00 51.96 53.14 3k8l s ALA 325 Cb 0.05 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.75 3k8l s ALA 325 CO 0.07 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 175.63 3k8l n GLY 326 N 0.72 3.00 3.00 0.00 0.00 -1.26 -3.37 105.19 107.27 3k8l n GLY 326 Ca 0.03 -0.05 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 3k8l n GLY 326 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3k8l s ASN 327 N -4.00 4.63 0.38 1.61 2.47 -1.26 -4.92 114.94 113.86 3k8l s ASN 327 Ca 0.00 -2.67 -0.26 0.00 0.42 0.00 0.00 52.86 50.34 3k8l s ASN 327 Cb 0.00 -1.68 -0.11 0.00 -1.45 0.00 0.00 41.25 38.01 3k8l s ASN 327 CO 0.00 -0.31 1.24 -2.65 -3.72 0.00 0.00 177.10 171.65 3k8l n PRO 328 N 3.59 1.92 -1.86 0.43 -0.02 -1.22 -4.99 135.00 132.86 3k8l n PRO 328 Ca 0.05 0.68 -0.32 0.00 -2.02 0.00 0.00 63.50 61.89 3k8l n PRO 328 Cb 0.36 -2.30 0.02 0.00 -0.02 0.00 0.00 33.50 31.57 3k8l n PRO 328 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k8l s ALA 329 N -1.16 2.82 0.62 3.55 0.00 -0.53 -4.78 121.76 122.30 3k8l s ALA 329 Ca 0.59 0.15 -0.19 0.00 0.00 0.00 0.00 51.96 52.51 3k8l s ALA 329 Cb -0.55 -3.17 -0.02 0.00 0.00 0.00 0.00 23.12 19.39 3k8l s ALA 329 CO 0.60 -0.89 1.30 -0.80 0.00 0.00 0.00 175.76 175.97 3k8l s ASN 330 N -3.50 4.78 -0.34 0.00 0.01 -1.26 -1.52 114.94 113.12 3k8l s ASN 330 Ca 0.59 2.63 -0.18 0.00 -0.71 0.00 0.00 52.86 55.19 3k8l s ASN 330 Cb -0.13 -2.62 -0.01 0.00 0.41 0.00 0.00 41.25 38.90 3k8l s ASN 330 CO 0.47 -1.89 0.52 -0.63 -1.51 0.00 0.00 177.10 174.06 3k8l s ILE 331 N -1.40 5.02 0.10 0.60 1.01 -0.15 -4.52 121.20 121.87 3k8l s ILE 331 Ca 0.80 0.41 0.07 0.00 0.00 0.00 0.00 60.65 61.94 3k8l s ILE 331 Cb -0.37 -3.95 -0.04 0.00 0.01 0.00 0.00 42.46 38.11 3k8l s ILE 331 CO 0.40 -0.18 -0.12 -0.04 0.00 0.00 0.00 174.94 175.00 3k8l s MET 332 N 2.39 2.06 0.48 2.79 -1.94 -1.26 -0.54 119.30 123.28 3k8l s MET 332 Ca 0.19 -1.05 -0.19 0.00 -1.71 0.00 0.00 55.69 52.93 3k8l s MET 332 Cb -0.15 -2.26 -0.09 0.00 2.01 0.00 0.00 34.83 34.34 3k8l s MET 332 CO 0.13 0.50 1.00 -0.06 -0.01 0.00 0.00 175.02 176.58 3k8l s PHE 333 N -1.19 3.18 -1.10 -0.03 0.40 -1.26 -0.34 117.98 117.64 3k8l s PHE 333 Ca 0.20 1.56 0.02 0.00 -0.60 0.00 0.00 56.93 58.12 3k8l s PHE 333 Cb -0.11 -2.94 0.10 0.00 0.51 0.00 0.00 43.02 40.58 3k8l s PHE 333 CO 0.12 -0.54 1.03 -0.40 0.70 0.00 0.00 175.22 176.14 3k8l n ASP 334 N -1.07 0.00 0.04 1.36 5.68 -0.54 -0.50 116.55 121.52 3k8l n ASP 334 Ca 0.08 0.44 0.13 0.00 -0.50 0.00 0.00 54.79 54.94 3k8l n ASP 334 Cb 0.53 -0.45 0.38 0.00 -1.14 0.00 0.00 41.12 40.44 3k8l n ASP 334 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3k8l n SER 335 N -1.45 0.46 -4.38 -1.12 3.41 -1.26 -4.58 113.62 104.70 3k8l n SER 335 Ca 0.01 0.23 -0.45 0.00 -0.26 0.00 0.00 58.87 58.40 3k8l n SER 335 Cb 0.02 -0.21 -0.04 0.00 -0.26 0.00 0.00 64.21 63.72 3k8l n SER 335 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3k8l s GLN 336 N -3.06 3.05 0.12 4.33 -0.21 0.35 -4.65 119.66 119.58 3k8l s GLN 336 Ca 0.11 -1.30 0.04 0.00 0.02 0.00 0.00 55.36 54.23 3k8l s GLN 336 Cb 0.16 -4.27 -0.04 0.00 1.00 0.00 0.00 33.01 29.86 3k8l s GLN 336 CO 0.63 -1.56 -0.11 -0.65 -2.12 0.00 0.00 175.29 171.48 3k8l s GLN 337 N 2.77 0.94 0.33 2.91 -1.52 -1.26 -4.83 119.66 118.99 3k8l s GLN 337 Ca 0.12 -1.26 -0.20 0.00 -1.95 0.00 0.00 55.36 52.08 3k8l s GLN 337 Cb -0.24 -0.61 -0.10 0.00 -0.22 0.00 0.00 33.01 31.85 3k8l s GLN 337 CO 0.06 0.09 0.83 0.42 -0.25 0.00 0.00 175.29 176.45 3k8l s ILE 338 N -2.68 4.49 -0.15 1.08 1.01 -1.26 -4.48 121.20 119.21 3k8l s ILE 338 Ca 0.09 1.32 -0.07 0.00 0.00 0.00 0.00 60.65 62.00 3k8l s ILE 338 Cb -0.01 -3.73 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 3k8l s ILE 338 CO 0.01 -0.09 0.10 -0.89 0.00 0.00 0.00 174.94 174.07 3k8l s THR 339 N -1.88 5.16 0.23 2.92 2.01 -1.26 -4.49 115.64 118.32 3k8l s THR 339 Ca 0.53 0.09 0.09 0.00 0.31 0.00 0.00 61.69 62.71 3k8l s THR 339 Cb -0.13 -3.28 -0.04 0.00 0.01 0.00 0.00 72.50 69.06 3k8l s THR 339 CO 0.18 0.54 -0.05 -0.31 -0.69 0.00 0.00 174.62 174.29 3k8l s TYR 340 N -0.35 2.67 0.06 4.92 2.02 0.21 -0.99 117.35 125.89 3k8l s TYR 340 Ca 0.10 -0.22 0.05 0.00 -0.37 0.00 0.00 57.07 56.63 3k8l s TYR 340 Cb -0.12 -1.24 -0.03 0.00 -0.40 0.00 0.00 41.96 40.18 3k8l s TYR 340 CO 0.01 0.58 -0.14 -0.59 -1.57 0.00 0.00 175.55 173.84 3k8l s PHE 341 N -2.05 1.18 0.21 2.71 -0.12 -0.00 -1.26 117.98 118.65 3k8l s PHE 341 Ca 0.29 -0.44 -0.24 0.00 -0.05 0.00 0.00 56.93 56.49 3k8l s PHE 341 Cb -0.07 -0.67 -0.08 0.00 -0.63 0.00 0.00 43.02 41.56 3k8l s PHE 341 CO 0.18 0.04 0.80 -1.58 -0.05 0.00 0.00 175.22 174.61 3k8l s HIS 342 N -1.18 3.81 -0.35 3.49 5.65 -0.68 -2.03 115.29 124.00 3k8l s HIS 342 Ca -0.02 1.61 0.03 0.00 0.25 0.00 0.00 55.06 56.94 3k8l s HIS 342 Cb -0.09 -2.77 0.16 0.00 -1.18 0.00 0.00 32.58 28.70 3k8l s HIS 342 CO 0.02 0.42 0.41 0.45 -0.65 0.00 0.00 174.74 175.38 3k8l s SER 343 N -1.36 0.74 0.41 9.88 0.15 0.11 -1.50 113.70 122.15 3k8l s SER 343 Ca 0.40 -1.20 0.16 0.00 0.70 0.00 0.00 55.95 56.01 3k8l s SER 343 Cb -0.21 0.82 1.05 0.00 -1.71 0.00 0.00 66.02 65.98 3k8l s SER 343 CO 0.25 -0.28 1.86 -0.74 1.20 0.00 0.00 173.24 175.54 3k8l h HIS 344 N 7.35 0.56 0.00 3.44 2.76 -1.93 -0.56 115.15 126.78 3k8l h HIS 344 Ca 0.01 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 3k8l h HIS 344 Cb 1.08 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 29.87 3k8l h HIS 344 CO 0.29 0.16 0.00 1.19 -1.30 0.00 0.00 177.93 178.27 3k8l n PHE 345 N -4.51 0.00 -3.51 5.26 3.72 -1.26 -4.90 117.46 112.25 3k8l n PHE 345 Ca 0.18 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.39 3k8l n PHE 345 Cb 0.65 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 39.27 3k8l n PHE 345 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k8l s THR 347 N -3.39 -0.25 -1.89 0.00 -1.32 -1.26 -5.02 115.64 102.50 3k8l s THR 347 Ca 0.13 0.11 0.00 0.00 -1.21 0.00 0.00 61.69 60.72 3k8l s THR 347 Cb -0.06 -0.66 0.00 0.00 -1.51 0.00 0.00 72.50 70.27 3k8l s THR 347 CO 0.74 0.05 0.55 -0.90 -2.21 0.00 0.00 174.62 172.85 3k8l n ASP 348 N 4.67 0.06 0.08 8.08 5.68 -1.26 -1.66 116.55 132.20 3k8l n ASP 348 Ca -0.18 -1.17 0.12 0.00 -0.50 0.00 0.00 54.79 53.07 3k8l n ASP 348 Cb 0.53 -0.03 0.23 0.00 -1.14 0.00 0.00 41.12 40.71 3k8l n ASP 348 CO 0.00 0.00 0.00 -0.50 -1.33 0.00 0.00 177.20 175.37 3k8l h TRP 349 N 0.04 0.00 -3.19 2.11 4.06 -1.95 -3.42 115.95 113.60 3k8l h TRP 349 Ca 0.00 0.00 -0.65 0.00 2.06 0.00 0.00 58.89 60.30 3k8l h TRP 349 Cb 0.03 0.00 -0.17 0.00 -1.00 0.00 0.00 29.16 28.02 3k8l h TRP 349 CO 0.00 0.00 -0.79 -0.06 -3.56 0.00 0.00 178.44 174.03 3k8l s PHE 350 N -3.16 2.41 -0.12 0.49 0.08 -0.66 -0.91 117.98 116.11 3k8l s PHE 350 Ca 0.07 -0.31 -0.04 0.00 0.12 0.00 0.00 56.93 56.77 3k8l s PHE 350 Cb 0.12 -1.20 0.05 0.00 -0.57 0.00 0.00 43.02 41.43 3k8l s PHE 350 CO 0.69 0.49 0.12 0.00 -0.10 0.00 0.00 175.22 176.42 3k8l s ALA 351 N -1.63 0.12 0.25 5.36 0.00 -0.74 -4.70 121.76 120.43 3k8l s ALA 351 Ca 0.22 0.13 -0.30 0.00 0.00 0.00 0.00 51.96 52.01 3k8l s ALA 351 Cb -0.08 -0.90 -0.10 0.00 0.00 0.00 0.00 23.12 22.03 3k8l s ALA 351 CO 0.11 -0.83 1.45 -0.51 0.00 0.00 0.00 175.76 175.98 3k8l s ASP 352 N 2.21 6.64 0.50 0.00 1.11 -0.56 -2.28 116.67 124.29 3k8l s ASP 352 Ca 0.04 2.68 -0.20 0.00 0.18 0.00 0.00 52.55 55.25 3k8l s ASP 352 Cb -0.14 -2.62 -0.08 0.00 1.07 0.00 0.00 42.92 41.15 3k8l s ASP 352 CO -0.07 -0.71 1.05 -0.76 1.18 0.00 0.00 175.17 175.85 3k8l s LEU 353 N -0.33 3.80 -0.17 1.23 1.43 -0.17 -3.92 118.68 120.54 3k8l s LEU 353 Ca 0.60 1.93 -0.03 0.00 -1.03 0.00 0.00 54.13 55.60 3k8l s LEU 353 Cb -0.42 -4.56 -0.02 0.00 0.03 0.00 0.00 46.19 41.23 3k8l s LEU 353 CO 0.43 -0.86 -0.07 0.21 0.23 0.00 0.00 176.35 176.29 3k8l s ASN 354 N -2.07 4.34 0.00 2.29 2.47 0.27 -4.84 114.94 117.40 3k8l s ASN 354 Ca 0.67 -0.30 0.07 0.00 0.42 0.00 0.00 52.86 53.73 3k8l s ASN 354 Cb -0.17 -1.71 0.09 0.00 -1.45 0.00 0.00 41.25 38.01 3k8l s ASN 354 CO 0.22 0.09 0.82 -1.22 -3.72 0.00 0.00 177.10 173.29 3k8l n TYR 355 N 4.06 0.06 -4.33 0.43 4.01 -1.26 -4.54 117.16 115.58 3k8l n TYR 355 Ca -0.18 -0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.46 3k8l n TYR 355 Cb 0.52 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.54 3k8l n TYR 355 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3k8l n GLY 356 N 0.38 -1.50 3.69 2.72 0.00 -1.26 -3.92 105.19 105.30 3k8l n GLY 356 Ca 0.05 -1.26 -0.44 0.00 0.00 0.00 0.00 46.02 44.37 3k8l n GLY 356 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3k8l n PRO 357 N -0.52 2.20 -0.29 1.61 -0.02 -1.26 -4.71 135.00 132.00 3k8l n PRO 357 Ca 0.00 0.78 0.24 0.00 -2.02 0.00 0.00 63.50 62.50 3k8l n PRO 357 Cb 0.00 -2.48 0.55 0.00 -0.02 0.00 0.00 33.50 31.55 3k8l n PRO 357 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3k8l h VAL 358 N 3.21 0.56 0.00 -1.45 3.04 -1.89 -0.42 116.25 119.29 3k8l h VAL 358 Ca -0.45 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.13 3k8l h VAL 358 Cb 1.26 0.20 0.00 0.00 -2.01 0.00 0.00 31.29 30.74 3k8l h VAL 358 CO 0.79 0.06 0.00 0.44 -1.01 0.00 0.00 177.57 177.85 3k8l h ASP 359 N 0.32 0.00 -0.02 3.17 3.32 -1.95 -3.02 116.42 118.23 3k8l h ASP 359 Ca 0.54 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.59 3k8l h ASP 359 Cb 1.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.06 3k8l h ASP 359 CO -0.21 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.31 3k8l n GLN 360 N -2.77 0.18 -0.35 3.56 3.00 -0.22 -4.73 117.38 116.04 3k8l n GLN 360 Ca 0.01 -0.98 0.37 0.00 -0.01 0.00 0.00 57.00 56.39 3k8l n GLN 360 Cb 0.27 -1.14 0.75 0.00 0.00 0.00 0.00 30.24 30.13 3k8l n GLN 360 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3k8l h ALA 361 N 1.36 3.18 0.00 -1.58 0.00 -1.28 0.27 119.26 121.21 3k8l h ALA 361 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 3k8l h ALA 361 Cb 0.32 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 3k8l h ALA 361 CO 0.00 -1.56 -0.10 0.78 0.00 0.00 0.00 179.25 178.37 3k8l h GLY 362 N 0.00 0.00 0.34 0.00 0.00 -1.85 -2.83 103.07 98.73 3k8l h GLY 362 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.92 3k8l h GLY 362 CO -0.01 0.00 -0.93 1.18 0.00 0.00 0.00 176.54 176.78 3k8l n GLU 363 N -3.53 0.08 -1.98 4.80 -0.58 0.95 -4.62 120.64 115.76 3k8l n GLU 363 Ca -0.02 -0.01 -0.38 0.00 -0.42 0.00 0.00 57.16 56.33 3k8l n GLU 363 Cb 0.23 -1.51 0.02 0.00 -0.57 0.00 0.00 31.44 29.60 3k8l n GLU 363 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3k8l s SER 364 N -3.21 5.79 0.47 1.62 1.04 -1.07 -4.90 113.70 113.43 3k8l s SER 364 Ca 0.07 2.62 0.20 0.00 0.48 0.00 0.00 55.95 59.32 3k8l s SER 364 Cb 0.16 -2.63 1.16 0.00 0.10 0.00 0.00 66.02 64.81 3k8l s SER 364 CO 0.82 -1.21 2.00 1.55 0.98 0.00 0.00 173.24 177.39 3k8l h PRO 365 N 1.94 0.00 -0.22 4.02 0.13 -1.90 -2.66 132.00 133.31 3k8l h PRO 365 Ca -0.50 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.59 3k8l h PRO 365 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 3k8l h PRO 365 CO 0.59 0.18 -0.03 0.00 -0.23 0.00 0.00 178.00 178.52 3k8l h ALA 366 N 1.82 0.30 0.07 -0.56 0.00 -1.89 -1.90 119.26 117.10 3k8l h ALA 366 Ca -0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 3k8l h ALA 366 Cb 0.37 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3k8l h ALA 366 CO 0.02 0.06 -0.03 -0.92 0.00 0.00 0.00 179.25 178.38 3k8l h TYR 367 N 0.15 -0.09 -0.56 0.00 3.20 -1.77 -0.85 116.97 117.05 3k8l h TYR 367 Ca 0.06 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.03 3k8l h TYR 367 Cb 0.46 0.03 -0.08 0.00 1.54 0.00 0.00 36.73 38.67 3k8l h TYR 367 CO 0.04 0.02 0.09 1.96 -1.64 0.00 0.00 178.16 178.63 3k8l h GLN 368 N -0.17 0.21 0.02 1.82 1.08 -1.48 0.49 115.11 117.08 3k8l h GLN 368 Ca -0.01 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.18 3k8l h GLN 368 Cb 0.15 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 3k8l h GLN 368 CO 0.02 0.14 -0.01 0.00 -0.95 0.00 0.00 178.83 178.02 3k8l h ALA 369 N 1.46 -0.03 0.00 3.87 0.00 -1.11 -0.66 119.26 122.79 3k8l h ALA 369 Ca 0.29 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 55.00 3k8l h ALA 369 Cb 0.43 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3k8l h ALA 369 CO -0.40 -0.45 -0.62 0.97 0.00 0.00 0.00 179.25 178.75 3k8l h ILE 370 N -0.17 1.25 -0.04 0.00 2.10 -0.75 -2.54 117.51 117.37 3k8l h ILE 370 Ca -0.00 -2.27 -0.22 0.00 1.08 0.00 0.00 64.86 63.45 3k8l h ILE 370 Cb 0.16 2.29 0.00 0.00 -1.09 0.00 0.00 36.82 38.18 3k8l h ILE 370 CO 0.01 0.61 -0.88 0.00 -1.08 0.00 0.00 178.15 176.81 3k8l h ALA 371 N 1.38 0.40 -0.27 0.18 0.00 -0.01 -2.51 119.26 118.44 3k8l h ALA 371 Ca -0.01 -0.67 -0.10 0.00 0.00 0.00 0.00 54.91 54.13 3k8l h ALA 371 Cb 1.24 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 3k8l h ALA 371 CO 0.08 0.78 -0.25 0.22 0.00 0.00 0.00 179.25 180.08 3k8l h ASP 372 N 0.29 0.52 -0.43 0.00 3.58 -1.03 -1.78 116.42 117.57 3k8l h ASP 372 Ca -0.07 -0.18 -0.13 0.00 0.42 0.00 0.00 57.03 57.07 3k8l h ASP 372 Cb 1.50 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 42.39 3k8l h ASP 372 CO 0.16 0.77 -0.22 0.00 -2.88 0.00 0.00 179.24 177.07 3k8l h ALA 373 N 1.27 0.74 -0.93 -0.78 0.00 -1.41 -2.32 119.26 115.83 3k8l h ALA 373 Ca 0.07 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.59 3k8l h ALA 373 Cb 0.69 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 3k8l h ALA 373 CO 0.05 0.66 0.60 0.00 0.00 0.00 0.00 179.25 180.57 3k8l h ALA 374 N 0.93 1.31 -0.20 0.00 0.00 -1.03 -1.10 119.26 119.17 3k8l h ALA 374 Ca 0.11 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3k8l h ALA 374 Cb 0.78 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3k8l h ALA 374 CO 0.06 0.63 -0.13 0.87 0.00 0.00 0.00 179.25 180.68 3k8l h LYS 375 N 1.27 0.32 -0.42 0.00 1.57 -0.96 -1.81 116.57 116.53 3k8l h LYS 375 Ca 0.34 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 59.01 3k8l h LYS 375 Cb -0.12 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.13 3k8l h LYS 375 CO -0.07 0.46 0.16 0.78 -0.57 0.00 0.00 179.45 180.20 3k8l h GLY 376 N 0.82 0.65 1.46 3.86 0.00 -0.67 -0.13 103.07 109.06 3k8l h GLY 376 Ca 0.06 -0.31 -0.24 0.00 0.00 0.00 0.00 47.33 46.83 3k8l h GLY 376 CO 0.02 0.30 -1.00 1.49 0.00 0.00 0.00 176.54 177.35 3k8l h TRP 377 N 0.60 0.72 -0.80 5.60 4.06 -1.08 -3.02 115.95 122.03 3k8l h TRP 377 Ca 0.15 -0.41 -0.05 0.00 2.06 0.00 0.00 58.89 60.65 3k8l h TRP 377 Cb 0.14 -0.08 -0.04 0.00 -1.00 0.00 0.00 29.16 28.19 3k8l h TRP 377 CO 0.01 1.24 0.32 0.82 -3.56 0.00 0.00 178.44 177.27 3k8l h ILE 378 N 0.26 1.26 0.00 1.49 2.04 -0.90 -0.27 117.51 121.40 3k8l h ILE 378 Ca -0.10 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 64.93 3k8l h ILE 378 Cb 1.65 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 3k8l h ILE 378 CO 0.18 0.34 0.00 0.00 0.00 0.00 0.00 178.15 178.67 3k8l n ALA 379 N -2.43 1.35 -0.12 1.87 0.00 -0.10 -1.26 120.51 119.81 3k8l n ALA 379 Ca 0.07 0.15 0.11 0.00 0.00 0.00 0.00 53.44 53.77 3k8l n ALA 379 Cb 0.19 -1.36 0.29 0.00 0.00 0.00 0.00 19.45 18.58 3k8l n ALA 379 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3k8l n ARG 380 N -2.26 2.55 -0.09 0.00 1.74 -0.14 -4.94 116.66 113.51 3k8l n ARG 380 Ca 0.00 -2.41 0.00 0.00 -0.77 0.00 0.00 57.85 54.67 3k8l n ARG 380 Cb 0.13 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.05 3k8l n ARG 380 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k8l n GLY 381 N 1.57 0.52 3.70 -0.13 0.00 -0.39 -4.98 105.19 105.47 3k8l n GLY 381 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 3k8l n GLY 381 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3k8l n VAL 382 N -2.00 0.01 0.33 1.61 0.31 -1.02 -4.82 118.33 112.75 3k8l n VAL 382 Ca 0.00 -0.00 0.12 0.00 -0.01 0.00 0.00 64.34 64.45 3k8l n VAL 382 Cb 0.00 -1.84 0.13 0.00 -0.91 0.00 0.00 33.84 31.22 3k8l n VAL 382 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 3k8l h ASP 383 N 6.54 0.00 -5.89 4.52 3.32 -1.52 -3.43 116.42 119.95 3k8l h ASP 383 Ca -0.44 -0.07 0.37 0.00 0.02 0.00 0.00 57.03 56.91 3k8l h ASP 383 Cb 1.22 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.67 3k8l h ASP 383 CO 0.93 0.03 0.94 -0.83 -1.72 0.00 0.00 179.24 178.59 3k8l s GLY 384 N -4.03 -0.28 0.00 2.75 0.00 -1.19 -2.89 107.32 101.69 3k8l s GLY 384 Ca 0.04 0.38 0.03 0.00 0.00 0.00 0.00 44.72 45.18 3k8l s GLY 384 CO 0.72 3.79 -0.10 1.08 0.00 0.00 0.00 173.10 178.58 3k8l s LEU 385 N -3.53 2.05 -0.28 0.66 1.43 -0.86 -1.85 118.68 116.30 3k8l s LEU 385 Ca 0.24 -0.23 -0.10 0.00 -1.03 0.00 0.00 54.13 53.01 3k8l s LEU 385 Cb 0.02 -0.51 -0.03 0.00 0.03 0.00 0.00 46.19 45.70 3k8l s LEU 385 CO -0.03 0.10 0.16 -0.60 0.23 0.00 0.00 176.35 176.20 3k8l s ARG 386 N -0.41 3.70 -0.19 1.70 3.00 0.52 -1.43 118.95 125.85 3k8l s ARG 386 Ca 0.03 -0.47 -0.18 0.00 -1.00 0.00 0.00 55.73 54.11 3k8l s ARG 386 Cb -0.05 -3.57 -0.03 0.00 0.00 0.00 0.00 34.95 31.30 3k8l s ARG 386 CO -0.00 -0.26 0.49 -0.51 0.00 0.00 0.00 175.30 175.02 3k8l s LEU 387 N 1.69 4.16 0.16 -0.88 1.43 0.95 -1.09 118.68 125.09 3k8l s LEU 387 Ca 0.06 0.65 -0.30 0.00 -1.03 0.00 0.00 54.13 53.52 3k8l s LEU 387 Cb -0.16 -2.67 -0.07 0.00 0.03 0.00 0.00 46.19 43.32 3k8l s LEU 387 CO 0.08 -0.14 1.00 -0.62 0.23 0.00 0.00 176.35 176.90 3k8l s ASP 388 N 1.09 7.45 -1.02 2.29 2.15 -0.99 -1.42 116.67 126.21 3k8l s ASP 388 Ca 0.23 1.93 -0.13 0.00 0.43 0.00 0.00 52.55 55.01 3k8l s ASP 388 Cb -0.15 -2.60 0.02 0.00 -0.30 0.00 0.00 42.92 39.89 3k8l s ASP 388 CO 0.09 -0.07 0.25 0.00 -0.17 0.00 0.00 175.17 175.27 3k8l n ALA 389 N 2.38 -1.96 0.29 3.66 0.00 -1.25 -4.56 120.51 119.06 3k8l n ALA 389 Ca 0.02 -0.38 0.19 0.00 0.00 0.00 0.00 53.44 53.26 3k8l n ALA 389 Cb 0.48 -1.22 0.81 0.00 0.00 0.00 0.00 19.45 19.51 3k8l n ALA 389 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 3k8l h VAL 390 N -1.11 0.00 -0.05 0.00 -1.51 -1.71 -2.37 116.25 109.51 3k8l h VAL 390 Ca -0.51 -0.39 0.00 0.00 -1.23 0.00 0.00 66.70 64.57 3k8l h VAL 390 Cb 1.03 1.39 0.00 0.00 -2.13 0.00 0.00 31.29 31.59 3k8l h VAL 390 CO 0.45 0.00 0.00 2.29 -1.23 0.00 0.00 177.57 179.08 3k8l n LYS 391 N -3.08 1.20 0.00 5.19 2.85 -1.26 -3.43 118.16 119.62 3k8l n LYS 391 Ca -0.00 -0.30 0.02 0.00 -1.05 0.00 0.00 58.31 56.97 3k8l n LYS 391 Cb 0.25 -1.28 -0.00 0.00 -0.65 0.00 0.00 35.03 33.35 3k8l n LYS 391 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 3k8l n HIS 392 N -0.45 0.00 0.08 5.58 8.25 -0.89 -3.90 115.22 123.89 3k8l n HIS 392 Ca 0.13 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.51 3k8l n HIS 392 Cb 0.13 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.19 3k8l n HIS 392 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3k8l h ILE 393 N 0.29 0.00 -3.37 1.59 2.04 -1.63 -3.34 117.51 113.09 3k8l h ILE 393 Ca 0.00 0.00 -0.56 0.00 1.00 0.00 0.00 64.86 65.30 3k8l h ILE 393 Cb 0.11 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.14 3k8l h ILE 393 CO 0.00 0.00 0.08 -0.31 0.00 0.00 0.00 178.15 177.92 3k8l s TYR 394 N -4.23 3.70 0.31 1.37 1.51 -1.26 -4.96 117.35 113.79 3k8l s TYR 394 Ca -0.07 1.34 0.07 0.00 -1.01 0.00 0.00 57.07 57.39 3k8l s TYR 394 Cb 0.02 -2.73 0.86 0.00 -0.11 0.00 0.00 41.96 40.01 3k8l s TYR 394 CO 0.27 0.29 1.63 1.25 -1.11 0.00 0.00 175.55 177.87 3k8l h HIS 395 N 5.74 0.44 -3.20 2.71 2.76 -1.35 -3.39 115.15 118.86 3k8l h HIS 395 Ca -0.44 0.05 -0.57 0.00 -2.20 0.00 0.00 60.37 57.20 3k8l h HIS 395 Cb 1.20 -0.04 -0.06 0.00 1.55 0.00 0.00 27.41 30.07 3k8l h HIS 395 CO 0.65 -0.28 0.61 0.45 -1.30 0.00 0.00 177.93 178.06 3k8l s SER 396 N -4.97 7.09 0.24 3.26 0.15 -1.26 -4.86 113.70 113.35 3k8l s SER 396 Ca -0.11 1.36 0.17 0.00 0.70 0.00 0.00 55.95 58.06 3k8l s SER 396 Cb 0.28 -2.52 0.04 0.00 -1.71 0.00 0.00 66.02 62.12 3k8l s SER 396 CO 0.78 -0.53 1.26 1.05 1.20 0.00 0.00 173.24 177.00 3k8l h GLU 397 N 7.33 0.00 0.00 5.44 4.11 -1.77 -3.34 114.58 126.36 3k8l h GLU 397 Ca -0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.18 3k8l h GLU 397 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 3k8l h GLU 397 CO 0.90 0.32 -0.65 0.25 0.07 0.00 0.00 179.01 179.91 3k8l n THR 398 N -3.06 0.16 -1.05 -1.06 -2.24 -1.26 -4.90 114.28 100.87 3k8l n THR 398 Ca -0.01 -0.15 -0.22 0.00 -2.27 0.00 0.00 64.05 61.40 3k8l n THR 398 Cb 0.71 0.10 0.18 0.00 -2.10 0.00 0.00 70.33 69.23 3k8l n THR 398 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3k8l n SER 399 N -1.81 -1.47 -1.24 3.42 3.41 -1.25 -4.94 113.62 109.74 3k8l n SER 399 Ca 0.04 -1.06 0.11 0.00 -0.26 0.00 0.00 58.87 57.70 3k8l n SER 399 Cb 0.39 -0.75 0.29 0.00 -0.26 0.00 0.00 64.21 63.88 3k8l n SER 399 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3k8l n GLU 400 N -3.82 2.70 0.39 4.33 1.02 -1.26 -4.56 120.64 119.44 3k8l n GLU 400 Ca 0.11 -2.54 -0.15 0.00 -0.02 0.00 0.00 57.16 54.56 3k8l n GLU 400 Cb 0.44 -1.52 -0.07 0.00 -0.02 0.00 0.00 31.44 30.26 3k8l n GLU 400 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3k8l h GLU 401 N 4.03 -0.97 -0.41 3.49 5.08 -1.92 -2.02 114.58 121.87 3k8l h GLU 401 Ca 0.00 0.07 0.08 0.00 -1.00 0.00 0.00 59.36 58.50 3k8l h GLU 401 Cb 0.96 0.22 -0.07 0.00 0.50 0.00 0.00 28.75 30.36 3k8l h GLU 401 CO 0.00 -0.65 -0.02 -0.91 -1.00 0.00 0.00 179.01 176.44 3k8l h ASN 402 N -1.13 -0.20 -0.86 1.42 2.35 -1.83 0.71 115.58 116.04 3k8l h ASN 402 Ca -0.10 0.10 0.05 0.00 -0.55 0.00 0.00 56.30 55.80 3k8l h ASN 402 Cb 0.77 0.18 -0.06 0.00 0.05 0.00 0.00 38.32 39.27 3k8l h ASN 402 CO 0.17 -0.06 0.54 -0.65 -1.65 0.00 0.00 177.43 175.77 3k8l h PRO 403 N 0.09 0.97 -0.24 0.81 0.11 -1.84 0.86 132.00 132.76 3k8l h PRO 403 Ca 0.20 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.16 3k8l h PRO 403 Cb 0.29 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.17 3k8l h PRO 403 CO -0.35 0.64 -0.24 0.00 -0.21 0.00 0.00 178.00 177.84 3k8l h ARG 404 N 1.00 0.44 -0.15 1.05 3.08 -0.55 -0.89 114.38 118.36 3k8l h ARG 404 Ca 0.37 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 60.22 3k8l h ARG 404 Cb 0.13 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 3k8l h ARG 404 CO -0.16 0.66 -0.05 0.35 -1.07 0.00 0.00 179.97 179.70 3k8l h PHE 405 N 0.39 0.33 -0.57 3.04 3.57 0.07 -2.36 116.94 121.42 3k8l h PHE 405 Ca 0.06 -0.07 -0.03 0.00 3.53 0.00 0.00 57.97 61.45 3k8l h PHE 405 Cb 0.64 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.27 3k8l h PHE 405 CO 0.02 0.59 0.21 -0.07 -2.23 0.00 0.00 178.31 176.83 3k8l h LEU 406 N -0.02 0.77 -0.15 0.59 3.38 -0.68 -0.98 115.31 118.22 3k8l h LEU 406 Ca 0.04 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3k8l h LEU 406 Cb 0.49 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3k8l h LEU 406 CO 0.02 0.70 0.06 0.50 0.09 0.00 0.00 178.44 179.80 3k8l h LYS 407 N 0.83 0.22 -0.67 1.13 3.64 -1.03 0.17 116.57 120.86 3k8l h LYS 407 Ca 0.19 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.54 3k8l h LYS 407 Cb 0.19 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.94 3k8l h LYS 407 CO -0.02 0.32 0.44 1.98 -2.27 0.00 0.00 179.45 179.91 3k8l h MET 408 N 0.07 0.88 -0.51 1.90 4.05 -1.12 -1.09 114.93 119.11 3k8l h MET 408 Ca 0.05 -0.05 -0.11 0.00 -0.28 0.00 0.00 59.70 59.30 3k8l h MET 408 Cb 0.18 -0.20 -0.02 0.00 -0.80 0.00 0.00 31.60 30.77 3k8l h MET 408 CO -0.00 0.58 -0.12 0.35 0.23 0.00 0.00 176.91 177.94 3k8l h PHE 409 N 0.90 1.08 0.12 1.39 3.57 -0.95 -1.65 116.94 121.41 3k8l h PHE 409 Ca 0.25 -0.22 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 3k8l h PHE 409 Cb -0.10 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.37 3k8l h PHE 409 CO -0.03 1.02 -0.06 -0.92 -2.23 0.00 0.00 178.31 176.09 3k8l h TYR 410 N 0.86 -0.15 -0.12 0.41 5.03 -0.25 -1.03 116.97 121.72 3k8l h TYR 410 Ca 0.13 -0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.47 3k8l h TYR 410 Cb 0.67 0.05 -0.00 0.00 1.55 0.00 0.00 36.73 39.00 3k8l h TYR 410 CO 0.04 0.11 0.09 0.93 -1.32 0.00 0.00 178.16 178.01 3k8l h GLU 411 N -0.40 0.00 0.03 1.82 5.08 -1.20 0.40 114.58 120.30 3k8l h GLU 411 Ca -0.02 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3k8l h GLU 411 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3k8l h GLU 411 CO 0.03 0.00 -0.01 0.22 -1.00 0.00 0.00 179.01 178.24 3k8l h ASP 412 N 0.00 -0.03 -0.40 1.42 1.82 -0.97 -1.91 116.42 116.35 3k8l h ASP 412 Ca 0.06 -0.43 -0.16 0.00 -0.39 0.00 0.00 57.03 56.11 3k8l h ASP 412 Cb 0.23 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.24 3k8l h ASP 412 CO -0.00 0.42 -0.35 0.24 -1.61 0.00 0.00 179.24 177.94 3k8l h MET 413 N -0.49 0.96 -0.49 0.28 2.86 -0.33 -2.90 114.93 114.81 3k8l h MET 413 Ca -0.00 -0.48 -0.03 0.00 -2.06 0.00 0.00 59.70 57.12 3k8l h MET 413 Cb 0.46 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.11 3k8l h MET 413 CO 0.01 1.15 0.19 -0.97 1.06 0.00 0.00 176.91 178.34 3k8l h ASN 414 N 0.79 0.69 -0.69 1.22 -1.24 -0.28 -0.50 115.58 115.56 3k8l h ASN 414 Ca 0.07 -0.18 -0.00 0.00 0.71 0.00 0.00 56.30 56.90 3k8l h ASN 414 Cb 0.95 -0.18 -0.03 0.00 0.73 0.00 0.00 38.32 39.78 3k8l h ASN 414 CO 0.09 0.68 0.43 0.00 -1.29 0.00 0.00 177.43 177.33 3k8l h ALA 415 N 1.04 1.44 0.00 1.57 0.00 -1.34 -1.16 119.26 120.81 3k8l h ALA 415 Ca 0.16 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 3k8l h ALA 415 Cb 0.21 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3k8l h ALA 415 CO -0.01 0.49 -0.61 -0.92 0.00 0.00 0.00 179.25 178.20 3k8l h TYR 416 N 0.96 0.00 0.01 0.00 3.20 -1.28 -2.20 116.97 117.67 3k8l h TYR 416 Ca 0.25 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.12 3k8l h TYR 416 Cb -0.05 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.22 3k8l h TYR 416 CO 0.00 0.61 -0.01 -0.92 -1.64 0.00 0.00 178.16 176.20 3k8l h TYR 417 N 0.00 -0.02 -0.31 -3.82 3.20 0.06 -2.95 116.97 113.13 3k8l h TYR 417 Ca -0.01 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.80 3k8l h TYR 417 Cb 1.15 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.41 3k8l h TYR 417 CO 0.00 0.39 -0.08 0.87 -1.64 0.00 0.00 178.16 177.70 3k8l h LYS 418 N -0.43 0.51 -0.03 1.82 1.57 -1.32 -1.71 116.57 116.98 3k8l h LYS 418 Ca -0.00 -0.13 0.01 0.00 -1.87 0.00 0.00 60.65 58.65 3k8l h LYS 418 Cb 0.42 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 3k8l h LYS 418 CO 0.00 0.60 0.05 0.37 -0.57 0.00 0.00 179.45 179.90 3k8l h GLN 419 N 0.48 0.00 -0.28 3.15 4.15 -1.31 0.51 115.11 121.81 3k8l h GLN 419 Ca 0.09 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.51 3k8l h GLN 419 Cb 0.44 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.13 3k8l h GLN 419 CO 0.02 0.00 0.00 1.63 -1.93 0.00 0.00 178.83 178.55 3k8l n LYS 420 N -3.66 1.72 -0.90 1.69 4.76 -0.64 -4.91 118.16 116.22 3k8l n LYS 420 Ca -0.02 -1.10 0.00 0.00 -2.87 0.00 0.00 58.31 54.31 3k8l n LYS 420 Cb 0.13 -1.28 0.00 0.00 -1.84 0.00 0.00 35.03 32.04 3k8l n LYS 420 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3k8l n GLY 421 N 1.03 0.50 3.08 0.72 0.00 0.16 -5.11 105.19 105.57 3k8l n GLY 421 Ca 0.12 -0.22 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 3k8l n GLY 421 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3k8l s HIS 422 N -1.91 1.12 -0.21 1.61 3.76 -1.17 -5.02 115.29 113.47 3k8l s HIS 422 Ca 0.00 -0.21 0.22 0.00 -0.15 0.00 0.00 55.06 54.92 3k8l s HIS 422 Cb 0.00 -0.72 -0.25 0.00 1.11 0.00 0.00 32.58 32.71 3k8l s HIS 422 CO 0.00 -0.02 0.64 0.25 -0.85 0.00 0.00 174.74 174.76 3k8l n THR 423 N 2.77 0.09 -2.73 1.30 -2.24 -1.26 -4.46 114.28 107.75 3k8l n THR 423 Ca -0.14 -0.43 -0.24 0.00 -2.27 0.00 0.00 64.05 60.97 3k8l n THR 423 Cb 0.56 0.09 0.02 0.00 -2.10 0.00 0.00 70.33 68.90 3k8l n THR 423 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3k8l s ASP 424 N -4.40 5.63 0.35 3.42 -4.77 -1.26 -5.09 116.67 110.55 3k8l s ASP 424 Ca -0.04 0.36 -0.15 0.00 -3.30 0.00 0.00 52.55 49.41 3k8l s ASP 424 Cb 0.14 -1.45 -0.09 0.00 -1.09 0.00 0.00 42.92 40.43 3k8l s ASP 424 CO 0.88 -0.91 0.76 -1.81 0.70 0.00 0.00 175.17 174.79 3k8l s ASP 425 N -4.29 6.75 0.38 2.11 1.01 -1.26 -4.79 116.67 116.58 3k8l s ASP 425 Ca 0.52 1.30 -0.26 0.00 0.71 0.00 0.00 52.55 54.82 3k8l s ASP 425 Cb -0.10 -2.38 -0.09 0.00 1.01 0.00 0.00 42.92 41.36 3k8l s ASP 425 CO 0.40 -0.25 1.17 0.12 0.21 0.00 0.00 175.17 176.82 3k8l s PHE 426 N -2.06 3.13 0.02 4.23 5.36 -1.26 -5.01 117.98 122.39 3k8l s PHE 426 Ca 0.55 1.56 -0.19 0.00 -0.96 0.00 0.00 56.93 57.89 3k8l s PHE 426 Cb -0.10 -3.40 -0.06 0.00 -0.34 0.00 0.00 43.02 39.12 3k8l s PHE 426 CO 0.19 -1.25 0.54 -0.47 -1.46 0.00 0.00 175.22 172.76 3k8l s TYR 427 N -1.37 3.73 -0.22 10.12 5.04 -1.14 -4.98 117.35 128.54 3k8l s TYR 427 Ca 0.55 1.17 -0.05 0.00 -2.44 0.00 0.00 57.07 56.29 3k8l s TYR 427 Cb -0.31 -2.49 0.11 0.00 0.35 0.00 0.00 41.96 39.62 3k8l s TYR 427 CO 0.40 0.50 0.42 1.41 -1.34 0.00 0.00 175.55 176.94 3k8l s MET 428 N -0.70 0.36 -0.09 4.97 1.75 -1.26 -2.02 119.30 122.30 3k8l s MET 428 Ca 0.28 0.87 0.03 0.00 -1.25 0.00 0.00 55.69 55.62 3k8l s MET 428 Cb -0.18 0.08 -0.01 0.00 2.84 0.00 0.00 34.83 37.55 3k8l s MET 428 CO 0.17 -0.41 -0.18 -1.50 -0.65 0.00 0.00 175.02 172.44 3k8l s ILE 429 N 2.62 2.66 0.15 10.11 2.07 -0.51 -2.95 121.20 135.34 3k8l s ILE 429 Ca 0.05 -0.83 0.05 0.00 -1.41 0.00 0.00 60.65 58.51 3k8l s ILE 429 Cb -0.13 -2.05 -0.04 0.00 0.13 0.00 0.00 42.46 40.36 3k8l s ILE 429 CO -0.15 0.56 0.10 -0.83 -1.91 0.00 0.00 174.94 172.71 3k8l s GLY 430 N -0.03 1.78 -0.39 1.50 0.00 -0.62 -0.04 107.32 109.52 3k8l s GLY 430 Ca -0.05 -1.19 -0.11 0.00 0.00 0.00 0.00 44.72 43.37 3k8l s GLY 430 CO 0.04 -1.20 0.22 1.85 0.00 0.00 0.00 173.10 174.02 3k8l s GLU 431 N -2.91 2.77 -0.57 2.90 2.12 -0.51 -2.88 118.70 119.62 3k8l s GLU 431 Ca 0.30 -1.18 0.04 0.00 0.36 0.00 0.00 54.97 54.49 3k8l s GLU 431 Cb -0.10 -3.75 0.14 0.00 0.26 0.00 0.00 34.13 30.68 3k8l s GLU 431 CO 0.22 -0.77 0.33 0.08 -0.54 0.00 0.00 175.26 174.58 3k8l s VAL 432 N 1.52 2.54 -0.64 3.70 1.01 -1.26 -2.66 120.40 124.61 3k8l s VAL 432 Ca 0.02 -3.55 -0.25 0.00 0.00 0.00 0.00 61.98 58.21 3k8l s VAL 432 Cb -0.20 -2.74 -0.21 0.00 0.00 0.00 0.00 36.38 33.23 3k8l s VAL 432 CO 0.06 -0.88 1.85 -0.11 0.00 0.00 0.00 175.10 176.02 3k8l n LEU 433 N 2.79 3.04 -4.21 3.92 7.94 -1.26 -4.77 117.00 124.45 3k8l n LEU 433 Ca 0.10 -2.55 -0.18 0.00 -1.11 0.00 0.00 56.01 52.27 3k8l n LEU 433 Cb 0.33 -1.06 -0.06 0.00 0.53 0.00 0.00 43.42 43.16 3k8l n LEU 433 CO 0.31 -1.12 0.00 -0.44 -1.11 0.00 0.00 177.39 175.03 3k8l s SER 434 N 5.86 1.48 0.62 1.96 0.01 -1.26 -5.14 113.70 117.24 3k8l s SER 434 Ca 0.63 -1.69 -0.12 0.00 1.31 0.00 0.00 55.95 56.08 3k8l s SER 434 Cb 0.12 0.62 -0.03 0.00 0.21 0.00 0.00 66.02 66.93 3k8l s SER 434 CO 0.18 -1.18 1.03 -1.61 0.41 0.00 0.00 173.24 172.07 3k8l s GLU 435 N -3.19 3.47 0.33 12.44 0.41 -1.26 -4.54 118.70 126.35 3k8l s GLU 435 Ca 0.37 0.86 0.08 0.00 -0.41 0.00 0.00 54.97 55.86 3k8l s GLU 435 Cb 0.01 -2.06 0.94 0.00 -1.78 0.00 0.00 34.13 31.23 3k8l s GLU 435 CO 0.26 -0.67 1.58 0.10 -0.49 0.00 0.00 175.26 176.03 3k8l h TYR 436 N -0.20 0.25 0.00 1.61 -0.00 -1.97 -0.13 116.97 116.54 3k8l h TYR 436 Ca -0.45 0.06 -0.05 0.00 0.00 0.00 0.00 58.73 58.29 3k8l h TYR 436 Cb 1.20 0.05 -0.01 0.00 0.00 0.00 0.00 36.73 37.97 3k8l h TYR 436 CO 0.64 -0.43 -0.25 0.38 -0.00 0.00 0.00 178.16 178.50 3k8l h ASP 437 N 0.02 0.00 0.98 0.10 3.04 -1.97 -1.44 116.42 117.15 3k8l h ASP 437 Ca 0.67 0.00 -0.16 0.00 -3.24 0.00 0.00 57.03 54.30 3k8l h ASP 437 Cb 1.54 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 39.80 3k8l h ASP 437 CO -0.86 0.25 -1.09 0.11 -2.04 0.00 0.00 179.24 175.61 3k8l h LYS 438 N 0.00 0.00 -0.01 4.15 1.79 -1.40 -3.37 116.57 117.73 3k8l h LYS 438 Ca -0.00 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 3k8l h LYS 438 Cb 0.49 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 3k8l h LYS 438 CO 0.03 0.46 -0.19 0.28 -1.08 0.00 0.00 179.45 178.95 3k8l h VAL 439 N 0.00 1.54 -0.65 0.50 2.07 -1.03 -3.40 116.25 115.29 3k8l h VAL 439 Ca -0.10 -1.86 0.07 0.00 0.82 0.00 0.00 66.70 65.62 3k8l h VAL 439 Cb 1.58 2.71 -0.08 0.00 -1.52 0.00 0.00 31.29 33.98 3k8l h VAL 439 CO 0.07 0.51 -0.36 0.00 0.02 0.00 0.00 177.57 177.80 3k8l n ALA 440 N -2.52 -0.35 0.19 1.67 0.00 -0.58 -0.34 120.51 118.58 3k8l n ALA 440 Ca -0.09 0.57 0.11 0.00 0.00 0.00 0.00 53.44 54.03 3k8l n ALA 440 Cb 0.47 -0.13 0.61 0.00 0.00 0.00 0.00 19.45 20.40 3k8l n ALA 440 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3k8l h PRO 441 N 0.00 0.00 0.00 0.00 0.13 -1.81 -0.63 132.00 129.69 3k8l h PRO 441 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3k8l h PRO 441 Cb 0.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.42 3k8l h PRO 441 CO -0.61 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 177.82 3k8l n TYR 442 N -2.33 0.06 0.50 1.56 4.02 0.53 -2.56 117.16 118.94 3k8l n TYR 442 Ca -0.01 0.02 0.07 0.00 -0.01 0.00 0.00 57.90 57.96 3k8l n TYR 442 Cb 0.13 -0.53 0.31 0.00 -0.02 0.00 0.00 39.34 39.22 3k8l n TYR 442 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3k8l n TYR 443 N -1.55 0.00 0.58 -0.72 0.53 -0.24 -1.03 117.16 114.73 3k8l n TYR 443 Ca 0.06 0.00 0.13 0.00 -1.02 0.00 0.00 57.90 57.06 3k8l n TYR 443 Cb 0.28 -0.49 0.36 0.00 -1.03 0.00 0.00 39.34 38.47 3k8l n TYR 443 CO 0.00 0.00 0.00 -0.22 -1.02 0.00 0.00 176.86 175.62 3k8l h LYS 444 N 0.00 0.00 0.00 -0.72 3.64 -1.70 -3.34 116.57 114.45 3k8l h LYS 444 Ca 0.00 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.18 3k8l h LYS 444 Cb 0.24 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.02 3k8l h LYS 444 CO 0.00 0.00 -1.76 0.41 -2.27 0.00 0.00 179.45 175.83 3k8l n GLY 445 N 1.29 -0.48 3.24 5.01 0.00 -0.20 -4.76 105.19 109.29 3k8l n GLY 445 Ca 0.05 -0.17 -0.16 0.00 0.00 0.00 0.00 46.02 45.74 3k8l n GLY 445 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k8l s LEU 446 N -4.99 2.44 0.17 0.99 1.43 -0.79 -2.90 118.68 115.03 3k8l s LEU 446 Ca -0.08 -0.87 0.15 0.00 -1.03 0.00 0.00 54.13 52.30 3k8l s LEU 446 Cb 0.04 -0.46 -0.05 0.00 0.03 0.00 0.00 46.19 45.75 3k8l s LEU 446 CO 0.43 -0.21 1.17 1.55 0.23 0.00 0.00 176.35 179.52 3k8l h PRO 447 N 3.29 0.00 -5.74 1.29 0.13 -1.83 -3.39 132.00 125.76 3k8l h PRO 447 Ca -0.38 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.21 3k8l h PRO 447 Cb 1.20 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.06 3k8l h PRO 447 CO 0.55 0.46 -0.83 0.00 -0.23 0.00 0.00 178.00 177.95 3k8l s ALA 448 N -2.92 1.50 -0.11 -0.56 0.00 -1.15 -1.04 121.76 117.48 3k8l s ALA 448 Ca 0.01 -0.90 -0.10 0.00 0.00 0.00 0.00 51.96 50.96 3k8l s ALA 448 Cb 0.08 -0.30 0.03 0.00 0.00 0.00 0.00 23.12 22.93 3k8l s ALA 448 CO 0.78 0.33 0.30 -0.51 0.00 0.00 0.00 175.76 176.66 3k8l s LEU 449 N -0.94 0.87 0.52 0.00 1.43 -1.12 -1.59 118.68 117.86 3k8l s LEU 449 Ca 0.06 0.59 -0.21 0.00 -1.03 0.00 0.00 54.13 53.54 3k8l s LEU 449 Cb -0.08 1.01 -0.06 0.00 0.03 0.00 0.00 46.19 47.10 3k8l s LEU 449 CO 0.01 -0.10 1.21 -0.36 0.23 0.00 0.00 176.35 177.34 3k8l s PHE 450 N 0.16 2.62 -0.75 0.29 0.08 -1.14 -2.39 117.98 116.85 3k8l s PHE 450 Ca -0.00 1.50 -0.02 0.00 0.12 0.00 0.00 56.93 58.53 3k8l s PHE 450 Cb -0.02 -3.48 0.19 0.00 -0.57 0.00 0.00 43.02 39.14 3k8l s PHE 450 CO 0.00 -1.97 0.59 -2.00 -0.10 0.00 0.00 175.22 171.75 3k8l s GLU 451 N -2.95 2.87 0.39 0.44 2.12 0.50 -4.84 118.70 117.23 3k8l s GLU 451 Ca 0.69 -2.93 0.08 0.00 0.36 0.00 0.00 54.97 53.18 3k8l s GLU 451 Cb -0.31 -3.81 0.79 0.00 0.26 0.00 0.00 34.13 31.06 3k8l s GLU 451 CO 0.36 -1.22 1.95 0.74 -0.54 0.00 0.00 175.26 176.55 3k8l h PHE 452 N 6.45 0.37 -0.08 5.30 -1.00 -1.86 -2.06 116.94 124.06 3k8l h PHE 452 Ca 0.07 -0.02 0.02 0.00 2.81 0.00 0.00 57.97 60.85 3k8l h PHE 452 Cb 0.88 -0.11 -0.00 0.00 3.61 0.00 0.00 35.95 40.32 3k8l h PHE 452 CO 0.72 0.38 0.10 0.77 -1.61 0.00 0.00 178.31 178.66 3k8l h SER 453 N 0.36 0.00 -0.51 2.17 0.02 -1.91 -1.65 113.55 112.03 3k8l h SER 453 Ca 0.08 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.00 3k8l h SER 453 Cb 0.24 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 3k8l h SER 453 CO 0.01 0.00 0.18 0.15 -1.14 0.00 0.00 176.83 176.03 3k8l h PHE 454 N 0.00 0.80 -0.06 3.45 3.57 -1.69 0.20 116.94 123.21 3k8l h PHE 454 Ca 0.04 -0.07 -0.24 0.00 3.53 0.00 0.00 57.97 61.22 3k8l h PHE 454 Cb 0.23 -0.23 0.01 0.00 2.79 0.00 0.00 35.95 38.75 3k8l h PHE 454 CO 0.00 0.68 -0.92 2.35 -2.23 0.00 0.00 178.31 178.18 3k8l h TRP 455 N 0.69 0.97 0.26 0.41 -0.00 -1.38 -1.96 115.95 114.93 3k8l h TRP 455 Ca 0.17 -0.49 -0.00 0.00 -0.00 0.00 0.00 58.89 58.57 3k8l h TRP 455 Cb 0.24 -0.13 -0.01 0.00 -0.00 0.00 0.00 29.16 29.26 3k8l h TRP 455 CO 0.01 1.31 -0.20 1.88 -0.00 0.00 0.00 178.44 181.44 3k8l h TYR 456 N 0.41 -0.53 0.11 2.65 0.99 -1.21 0.11 116.97 119.51 3k8l h TYR 456 Ca -0.09 -0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.63 3k8l h TYR 456 Cb 1.56 0.20 0.00 0.00 1.00 0.00 0.00 36.73 39.49 3k8l h TYR 456 CO 0.09 -0.31 -0.05 0.00 -0.00 0.00 0.00 178.16 177.89 3k8l h ARG 457 N -0.47 -0.14 -0.92 4.88 2.47 -1.03 -2.51 114.38 116.67 3k8l h ARG 457 Ca -0.02 0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.71 3k8l h ARG 457 Cb 0.41 0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 28.72 3k8l h ARG 457 CO -0.01 -0.04 0.55 1.25 0.56 0.00 0.00 179.97 182.29 3k8l h LEU 458 N -0.22 1.10 0.10 3.04 5.85 -1.27 0.06 115.31 123.97 3k8l h LEU 458 Ca -0.02 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.63 3k8l h LEU 458 Cb 0.17 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 40.93 3k8l h LEU 458 CO 0.03 0.85 -0.05 -0.08 -0.34 0.00 0.00 178.44 178.84 3k8l h GLU 459 N 1.26 -0.13 -0.08 1.25 4.22 -0.73 -1.69 114.58 118.68 3k8l h GLU 459 Ca 0.33 0.01 0.01 0.00 0.08 0.00 0.00 59.36 59.79 3k8l h GLU 459 Cb -0.05 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3k8l h GLU 459 CO -0.06 0.07 0.01 2.35 -2.18 0.00 0.00 179.01 179.19 3k8l h TRP 460 N -0.30 0.01 -0.32 0.92 7.01 -1.27 -2.49 115.95 119.50 3k8l h TRP 460 Ca -0.01 0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.06 3k8l h TRP 460 Cb 0.25 0.01 -0.07 0.00 -2.10 0.00 0.00 29.16 27.25 3k8l h TRP 460 CO -0.02 0.00 -0.12 0.78 -2.79 0.00 0.00 178.44 176.30 3k8l h GLY 461 N 0.04 0.17 1.06 2.65 0.00 -0.90 -0.45 103.07 105.64 3k8l h GLY 461 Ca 0.03 0.15 -0.07 0.00 0.00 0.00 0.00 47.33 47.45 3k8l h GLY 461 CO -0.05 -0.15 0.20 -2.22 0.00 0.00 0.00 176.54 174.32 3k8l h ILE 462 N -0.05 1.26 0.00 2.60 2.04 -1.22 -0.16 117.51 121.99 3k8l h ILE 462 Ca 0.16 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 65.06 3k8l h ILE 462 Cb 0.29 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 3k8l h ILE 462 CO -0.36 0.37 0.00 0.78 0.00 0.00 0.00 178.15 178.94 3k8l h ASN 463 N 1.10 0.00 -0.20 1.72 2.35 -1.11 -3.13 115.58 116.32 3k8l h ASN 463 Ca 0.23 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.96 3k8l h ASN 463 Cb 0.35 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 3k8l h ASN 463 CO -0.00 0.00 -0.02 0.59 -1.65 0.00 0.00 177.43 176.35 3k8l n ASN 464 N -2.46 3.26 -2.96 5.81 4.13 -0.21 -4.96 115.26 117.87 3k8l n ASN 464 Ca 0.04 -3.15 -0.10 0.00 1.68 0.00 0.00 54.58 53.04 3k8l n ASN 464 Cb 0.38 -0.53 -0.02 0.00 -1.54 0.00 0.00 39.78 38.08 3k8l n ASN 464 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 3k8l n SER 465 N -0.85 -1.34 -4.12 6.41 7.64 -0.58 -4.89 113.62 115.90 3k8l n SER 465 Ca 0.21 0.09 -0.33 0.00 1.01 0.00 0.00 58.87 59.85 3k8l n SER 465 Cb 0.84 -1.25 -0.15 0.00 -1.01 0.00 0.00 64.21 62.64 3k8l n SER 465 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3k8l s THR 466 N -2.31 2.48 0.00 0.44 2.01 -0.18 -2.81 115.64 115.27 3k8l s THR 466 Ca 0.19 -1.42 0.00 0.00 0.31 0.00 0.00 61.69 60.77 3k8l s THR 466 Cb -0.11 -2.38 0.00 0.00 0.01 0.00 0.00 72.50 70.01 3k8l s THR 466 CO 0.24 0.04 0.35 0.61 -0.69 0.00 0.00 174.62 175.17 3k8l n GLY 467 N 4.53 -0.53 0.00 4.40 0.00 0.25 -4.33 105.19 109.52 3k8l n GLY 467 Ca -0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.99 3k8l n GLY 467 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k8l n TYR 469 N -1.00 0.00 0.04 0.00 4.01 -1.26 -2.66 117.16 116.28 3k8l n TYR 469 Ca 0.17 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.82 3k8l n TYR 469 Cb 0.08 -0.06 -0.05 0.00 -0.31 0.00 0.00 39.34 38.99 3k8l n TYR 469 CO 0.00 0.00 0.00 0.35 -0.46 0.00 0.00 176.86 176.75 3k8l h PHE 470 N 0.00 -0.83 -1.00 -0.72 3.57 -1.83 0.17 116.94 116.30 3k8l h PHE 470 Ca 0.00 0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.63 3k8l h PHE 470 Cb 0.21 0.36 -0.08 0.00 2.79 0.00 0.00 35.95 39.22 3k8l h PHE 470 CO 0.00 -0.31 0.64 0.00 -2.23 0.00 0.00 178.31 176.40 3k8l h ALA 471 N -0.97 1.51 -0.43 2.41 0.00 -1.87 0.24 119.26 120.15 3k8l h ALA 471 Ca 0.00 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.94 3k8l h ALA 471 Cb 0.39 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3k8l h ALA 471 CO -0.17 0.26 0.26 -0.22 0.00 0.00 0.00 179.25 179.37 3k8l h LYS 472 N 1.02 0.50 0.37 0.00 3.64 -1.72 -0.43 116.57 119.96 3k8l h LYS 472 Ca 0.48 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.82 3k8l h LYS 472 Cb 0.43 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 3k8l h LYS 472 CO -0.25 0.33 -0.18 -0.44 -2.27 0.00 0.00 179.45 176.65 3k8l h ASP 473 N 0.52 -0.42 -0.49 4.20 3.32 0.91 -2.12 116.42 122.34 3k8l h ASP 473 Ca 0.17 -0.09 0.08 0.00 0.02 0.00 0.00 57.03 57.21 3k8l h ASP 473 Cb -0.00 0.11 -0.07 0.00 0.22 0.00 0.00 39.33 39.59 3k8l h ASP 473 CO -0.07 -0.15 0.08 0.40 -1.72 0.00 0.00 179.24 177.78 3k8l h ILE 474 N -0.69 0.71 -0.74 0.35 1.08 -0.92 -1.40 117.51 115.90 3k8l h ILE 474 Ca -0.05 -0.07 0.04 0.00 -0.39 0.00 0.00 64.86 64.39 3k8l h ILE 474 Cb 0.49 0.48 -0.05 0.00 -3.07 0.00 0.00 36.82 34.67 3k8l h ILE 474 CO 0.08 0.04 0.46 -0.07 -0.69 0.00 0.00 178.15 177.97 3k8l h LEU 475 N 0.21 0.74 -1.82 1.44 3.38 -1.05 -1.05 115.31 117.16 3k8l h LEU 475 Ca 0.24 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.21 3k8l h LEU 475 Cb 0.33 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 3k8l h LEU 475 CO -0.33 0.50 0.01 0.77 0.09 0.00 0.00 178.44 179.47 3k8l h SER 476 N 0.88 0.10 -0.01 -0.43 4.64 -0.57 -2.31 113.55 115.85 3k8l h SER 476 Ca 0.31 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.59 3k8l h SER 476 Cb 0.07 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3k8l h SER 476 CO -0.13 0.12 -0.11 1.88 -0.87 0.00 0.00 176.83 177.72 3k8l h TYR 477 N 0.12 0.13 -0.67 4.77 0.05 -0.52 -3.16 116.97 117.68 3k8l h TYR 477 Ca 0.03 -0.06 0.16 0.00 0.05 0.00 0.00 58.73 58.90 3k8l h TYR 477 Cb 0.07 -0.02 -0.04 0.00 1.01 0.00 0.00 36.73 37.76 3k8l h TYR 477 CO 0.00 0.81 0.46 1.96 -1.05 0.00 0.00 178.16 180.35 3k8l h GLN 478 N -0.59 0.23 -0.72 4.88 4.20 -1.12 0.14 115.11 122.12 3k8l h GLN 478 Ca -0.01 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 3k8l h GLN 478 Cb 0.83 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.53 3k8l h GLN 478 CO 0.02 0.15 0.38 0.37 -0.67 0.00 0.00 178.83 179.08 3k8l h GLN 479 N 0.23 1.02 -0.25 1.46 4.15 -1.41 -1.76 115.11 118.55 3k8l h GLN 479 Ca 0.33 -0.13 -0.04 0.00 0.77 0.00 0.00 58.65 59.57 3k8l h GLN 479 Cb 0.95 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 28.44 3k8l h GLN 479 CO -0.07 0.77 -0.01 0.87 -1.93 0.00 0.00 178.83 178.47 3k8l h LYS 480 N 1.00 0.45 -0.75 1.69 1.79 -0.72 -3.12 116.57 116.91 3k8l h LYS 480 Ca 0.25 -0.15 0.01 0.00 -2.18 0.00 0.00 60.65 58.58 3k8l h LYS 480 Cb 0.06 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.64 3k8l h LYS 480 CO -0.04 0.63 0.50 1.88 -1.08 0.00 0.00 179.45 181.34 3k8l h TYR 481 N 0.22 0.94 -0.17 -1.35 0.05 -1.18 -2.03 116.97 113.45 3k8l h TYR 481 Ca 0.07 0.02 0.05 0.00 0.05 0.00 0.00 58.73 58.92 3k8l h TYR 481 Cb 0.43 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 37.84 3k8l h TYR 481 CO 0.04 0.59 0.14 0.00 -1.05 0.00 0.00 178.16 177.88 3k8l h ALA 482 N 1.28 1.98 0.00 3.88 0.00 -1.28 0.05 119.26 125.17 3k8l h ALA 482 Ca 0.28 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 3k8l h ALA 482 Cb -0.11 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3k8l h ALA 482 CO -0.06 -0.23 -0.10 -0.91 0.00 0.00 0.00 179.25 177.95 3k8l h ASN 483 N 0.00 0.00 0.00 0.00 2.35 -1.31 -3.21 115.58 113.42 3k8l h ASN 483 Ca 0.08 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.58 3k8l h ASN 483 Cb 0.36 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.68 3k8l h ASN 483 CO -0.00 0.10 -1.97 -1.22 -1.65 0.00 0.00 177.43 172.69 3k8l n TYR 484 N -3.54 0.00 -3.66 1.19 4.01 -0.11 -4.98 117.16 110.07 3k8l n TYR 484 Ca -0.02 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.66 3k8l n TYR 484 Cb 0.23 -0.69 -0.08 0.00 -0.31 0.00 0.00 39.34 38.49 3k8l n TYR 484 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 3k8l s ARG 485 N -2.37 0.44 0.21 -0.72 3.52 -0.54 -4.59 118.95 114.90 3k8l s ARG 485 Ca -0.07 1.14 -0.08 0.00 -0.13 0.00 0.00 55.73 56.59 3k8l s ARG 485 Cb 0.04 0.42 0.16 0.00 -1.56 0.00 0.00 34.95 34.02 3k8l s ARG 485 CO 0.58 -0.22 1.79 1.03 -0.81 0.00 0.00 175.30 177.68 3k8l h SER 486 N 7.89 1.09 -0.95 -2.12 0.87 -1.84 -3.09 113.55 115.39 3k8l h SER 486 Ca -0.20 -0.15 -0.65 0.00 -1.23 0.00 0.00 61.79 59.55 3k8l h SER 486 Cb 1.13 -0.28 -0.31 0.00 -0.44 0.00 0.00 62.40 62.49 3k8l h SER 486 CO 0.14 0.94 0.59 -0.90 -0.53 0.00 0.00 176.83 177.08 3k8l n ASP 487 N -4.31 7.08 -4.73 6.23 5.75 -1.26 -4.94 116.55 120.37 3k8l n ASP 487 Ca 0.08 -3.78 -0.39 0.00 -0.01 0.00 0.00 54.79 50.69 3k8l n ASP 487 Cb 0.16 -0.87 0.03 0.00 -1.03 0.00 0.00 41.12 39.42 3k8l n ASP 487 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3k8l n TYR 488 N -0.90 2.21 -3.73 2.11 0.18 -1.17 -4.98 117.16 110.89 3k8l n TYR 488 Ca 0.60 0.45 -0.38 0.00 1.88 0.00 0.00 57.90 60.44 3k8l n TYR 488 Cb 0.75 -2.36 -0.12 0.00 -0.38 0.00 0.00 39.34 37.22 3k8l n TYR 488 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 3k8l s ILE 489 N -1.27 4.14 -0.54 -3.48 1.01 -0.20 -5.05 121.20 115.81 3k8l s ILE 489 Ca 0.68 -0.66 -0.20 0.00 0.00 0.00 0.00 60.65 60.48 3k8l s ILE 489 Cb -0.44 -3.15 0.07 0.00 0.01 0.00 0.00 42.46 38.95 3k8l s ILE 489 CO 0.52 0.05 0.69 -0.70 0.00 0.00 0.00 174.94 175.50 3k8l s GLU 490 N 1.52 3.11 -0.62 2.79 2.12 -1.26 -2.78 118.70 123.59 3k8l s GLU 490 Ca 0.03 -0.98 -0.22 0.00 0.36 0.00 0.00 54.97 54.16 3k8l s GLU 490 Cb -0.17 -4.15 0.07 0.00 0.26 0.00 0.00 34.13 30.13 3k8l s GLU 490 CO 0.04 -1.37 0.92 0.00 -0.54 0.00 0.00 175.26 174.30 3k8l s ALA 491 N 2.82 3.16 0.54 6.30 0.00 -1.00 -1.12 121.76 132.46 3k8l s ALA 491 Ca 0.15 -1.73 -0.15 0.00 0.00 0.00 0.00 51.96 50.22 3k8l s ALA 491 Cb -0.20 -3.78 -0.07 0.00 0.00 0.00 0.00 23.12 19.07 3k8l s ALA 491 CO 0.10 -2.62 1.00 0.95 0.00 0.00 0.00 175.76 175.20 3k8l s THR 492 N 3.86 4.51 0.13 0.00 -4.23 -0.96 -0.37 115.64 118.58 3k8l s THR 492 Ca 0.23 1.12 -0.25 0.00 -1.18 0.00 0.00 61.69 61.61 3k8l s THR 492 Cb -0.17 -3.72 0.07 0.00 1.34 0.00 0.00 72.50 70.02 3k8l s THR 492 CO 0.12 -0.77 0.74 -1.59 -0.54 0.00 0.00 174.62 172.58 3k8l s LYS 493 N -4.29 1.22 0.00 3.99 -2.85 -1.26 -0.61 119.74 115.94 3k8l s LYS 493 Ca 0.58 -0.52 0.00 0.00 -1.00 0.00 0.00 55.97 55.03 3k8l s LYS 493 Cb -0.11 0.51 0.00 0.00 -2.06 0.00 0.00 37.83 36.18 3k8l s LYS 493 CO 0.36 -0.54 0.00 1.28 0.10 0.00 0.00 175.35 176.55 3k8l n LEU 494 N -0.36 0.00 -4.84 2.77 4.77 -1.26 -3.60 117.00 114.48 3k8l n LEU 494 Ca -0.11 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.54 3k8l n LEU 494 Cb 0.63 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.66 3k8l n LEU 494 CO 0.12 0.00 0.57 -0.94 -1.33 0.00 0.00 177.39 175.82 3k8l s SER 495 N -0.79 6.76 0.00 -1.43 1.04 -1.26 -4.81 113.70 113.20 3k8l s SER 495 Ca 0.00 1.48 0.00 0.00 0.48 0.00 0.00 55.95 57.91 3k8l s SER 495 Cb 0.00 -2.46 0.00 0.00 0.10 0.00 0.00 66.02 63.66 3k8l s SER 495 CO 0.00 -0.39 0.00 -0.46 0.98 0.00 0.00 173.24 173.37 3k8l n ASN 496 N -0.92 1.99 0.00 7.02 0.23 -1.26 -4.59 115.26 117.73 3k8l n ASN 496 Ca 0.05 -0.17 0.08 0.00 -0.53 0.00 0.00 54.58 54.02 3k8l n ASN 496 Cb 0.54 0.00 0.47 0.00 -2.08 0.00 0.00 39.78 38.71 3k8l n ASN 496 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3k8l n HIS 497 N -0.00 0.00 -0.93 -2.53 1.44 -1.26 -2.63 115.22 109.31 3k8l n HIS 497 Ca 0.00 0.00 0.09 0.00 -2.01 0.00 0.00 57.72 55.80 3k8l n HIS 497 Cb 0.00 -0.14 0.14 0.00 0.12 0.00 0.00 29.99 30.11 3k8l n HIS 497 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 3k8l n ASN 498 N -1.14 2.53 -4.16 4.39 3.02 -1.26 -4.88 115.26 113.77 3k8l n ASN 498 Ca 0.11 -2.95 -0.10 0.00 -0.03 0.00 0.00 54.58 51.61 3k8l n ASN 498 Cb 0.10 -0.40 -0.10 0.00 -0.61 0.00 0.00 39.78 38.77 3k8l n ASN 498 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3k8l s GLU 499 N -2.65 0.85 0.30 3.52 2.02 -1.08 -5.05 118.70 116.62 3k8l s GLU 499 Ca 0.30 -1.37 -0.29 0.00 0.02 0.00 0.00 54.97 53.63 3k8l s GLU 499 Cb 0.26 -0.03 -0.10 0.00 0.10 0.00 0.00 34.13 34.35 3k8l s GLU 499 CO 0.04 -0.11 1.43 -0.51 0.02 0.00 0.00 175.26 176.13 3k8l s ASP 500 N -3.04 6.59 0.81 -0.19 1.01 -1.26 -4.68 116.67 115.91 3k8l s ASP 500 Ca 0.15 2.79 -0.16 0.00 0.71 0.00 0.00 52.55 56.04 3k8l s ASP 500 Cb 0.07 -2.64 -0.07 0.00 1.01 0.00 0.00 42.92 41.28 3k8l s ASP 500 CO -0.03 -0.72 0.01 0.54 0.21 0.00 0.00 175.17 175.19 3k8l n ARG 501 N 1.53 0.05 -0.05 8.23 5.12 -0.55 -4.72 116.66 126.27 3k8l n ARG 501 Ca 0.04 0.04 -0.12 0.00 -1.93 0.00 0.00 57.85 55.88 3k8l n ARG 501 Cb 0.40 -1.46 -0.06 0.00 -1.16 0.00 0.00 32.46 30.18 3k8l n ARG 501 CO 0.00 0.00 0.00 1.15 -1.93 0.00 0.00 177.63 176.85 3k8l h THR 502 N -0.72 1.23 -0.82 0.55 2.02 -1.89 -2.15 112.91 111.13 3k8l h THR 502 Ca -0.44 -0.75 0.10 0.00 0.77 0.00 0.00 66.41 66.09 3k8l h THR 502 Cb 1.34 1.42 -0.06 0.00 -1.74 0.00 0.00 68.15 69.12 3k8l h THR 502 CO 0.35 0.22 0.53 -1.28 0.37 0.00 0.00 175.52 175.72 3k8l h SER 503 N 0.04 0.68 -0.19 4.18 0.87 -1.86 -1.93 113.55 115.35 3k8l h SER 503 Ca 0.05 0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.54 3k8l h SER 503 Cb 0.32 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 62.16 3k8l h SER 503 CO 0.00 0.40 -0.22 0.28 -0.53 0.00 0.00 176.83 176.76 3k8l h SER 504 N 0.75 0.52 0.11 6.23 0.02 -1.78 0.58 113.55 119.98 3k8l h SER 504 Ca 0.38 -0.50 -0.00 0.00 -0.84 0.00 0.00 61.79 60.83 3k8l h SER 504 Cb 0.46 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.85 3k8l h SER 504 CO -0.15 0.91 -0.02 0.11 -1.14 0.00 0.00 176.83 176.55 3k8l h LYS 505 N 0.14 0.00 -0.88 3.45 1.79 -0.70 -2.58 116.57 117.78 3k8l h LYS 505 Ca 0.02 0.00 -0.62 0.00 -2.18 0.00 0.00 60.65 57.88 3k8l h LYS 505 Cb 0.78 0.00 -0.35 0.00 -1.58 0.00 0.00 32.23 31.08 3k8l h LYS 505 CO 0.05 0.02 0.14 1.28 -1.08 0.00 0.00 179.45 179.86 3k8l n LEU 506 N -3.43 6.47 -1.64 2.94 4.77 -0.81 -4.92 117.00 120.38 3k8l n LEU 506 Ca -0.03 -4.47 -0.11 0.00 -0.03 0.00 0.00 56.01 51.37 3k8l n LEU 506 Cb 0.11 -0.70 -0.04 0.00 -2.33 0.00 0.00 43.42 40.46 3k8l n LEU 506 CO 0.24 1.74 -0.12 0.61 -1.33 0.00 0.00 177.39 178.54 3k8l n GLY 507 N -0.84 0.62 2.49 -0.72 0.00 -0.97 -0.80 105.19 104.97 3k8l n GLY 507 Ca 0.54 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.42 3k8l n GLY 507 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k8l n LYS 508 N -2.02 -1.14 -2.29 1.61 5.02 0.20 -4.95 118.16 114.59 3k8l n LYS 508 Ca -0.12 1.02 -0.43 0.00 -2.02 0.00 0.00 58.31 56.76 3k8l n LYS 508 Cb 0.43 -5.19 -0.02 0.00 -0.02 0.00 0.00 35.03 30.22 3k8l n LYS 508 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3k8l s SER 509 N -2.77 6.74 0.42 4.39 0.15 0.02 -4.89 113.70 117.75 3k8l s SER 509 Ca 0.00 1.69 0.12 0.00 0.70 0.00 0.00 55.95 58.45 3k8l s SER 509 Cb 0.00 -2.54 0.91 0.00 -1.71 0.00 0.00 66.02 62.68 3k8l s SER 509 CO 0.00 -0.94 1.97 0.00 1.20 0.00 0.00 173.24 175.47 3k8l h ALA 510 N 9.11 1.63 -0.29 5.45 0.00 -1.92 -2.14 119.26 131.11 3k8l h ALA 510 Ca -0.30 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.30 3k8l h ALA 510 Cb 1.12 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 3k8l h ALA 510 CO 0.98 0.27 -0.43 -0.44 0.00 0.00 0.00 179.25 179.64 3k8l h ASP 511 N 0.15 0.77 0.32 0.00 3.32 -1.97 -2.68 116.42 116.34 3k8l h ASP 511 Ca 0.03 -0.36 -0.18 0.00 0.02 0.00 0.00 57.03 56.54 3k8l h ASP 511 Cb 0.29 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3k8l h ASP 511 CO 0.02 1.09 -0.75 0.11 -1.72 0.00 0.00 179.24 177.99 3k8l h LYS 512 N 0.58 0.35 -0.53 3.56 1.57 -1.78 -2.55 116.57 117.76 3k8l h LYS 512 Ca 0.04 -0.30 -0.09 0.00 -1.87 0.00 0.00 60.65 58.43 3k8l h LYS 512 Cb 0.97 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.33 3k8l h LYS 512 CO 0.09 0.95 -0.04 0.00 -0.57 0.00 0.00 179.45 179.88 3k8l h LYS 514 N 0.84 0.98 0.43 0.00 1.57 -1.47 -1.46 116.57 117.46 3k8l h LYS 514 Ca 0.15 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 3k8l h LYS 514 Cb 0.58 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3k8l h LYS 514 CO 0.03 0.83 -0.21 1.25 -0.57 0.00 0.00 179.45 180.79 3k8l h LEU 515 N 0.95 -0.49 -1.00 2.94 5.85 -1.00 -1.18 115.31 121.38 3k8l h LEU 515 Ca 0.22 -0.06 0.18 0.00 0.84 0.00 0.00 57.88 59.05 3k8l h LEU 515 Cb 0.25 0.13 -0.10 0.00 0.37 0.00 0.00 40.66 41.30 3k8l h LEU 515 CO -0.01 -0.23 0.61 0.00 -0.34 0.00 0.00 178.44 178.47 3k8l h ALA 516 N -0.23 1.63 -0.57 1.25 0.00 -0.70 0.14 119.26 120.78 3k8l h ALA 516 Ca -0.06 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 3k8l h ALA 516 Cb 0.52 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3k8l h ALA 516 CO 0.10 0.00 0.01 0.00 0.00 0.00 0.00 179.25 179.36 3k8l h ALA 517 N 1.63 0.95 -0.26 0.00 0.00 -1.06 -1.48 119.26 119.02 3k8l h ALA 517 Ca 0.56 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 3k8l h ALA 517 Cb 0.82 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3k8l h ALA 517 CO -0.36 0.64 0.07 0.00 0.00 0.00 0.00 179.25 179.59 3k8l h ALA 518 N 1.10 0.35 -0.56 0.00 0.00 0.48 -1.58 119.26 119.05 3k8l h ALA 518 Ca 0.17 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3k8l h ALA 518 Cb 0.51 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3k8l h ALA 518 CO 0.02 -0.00 0.22 0.28 0.00 0.00 0.00 179.25 179.77 3k8l h VAL 519 N 0.26 1.22 -0.05 0.00 2.07 -0.99 -0.98 116.25 117.79 3k8l h VAL 519 Ca 0.08 -0.71 0.00 0.00 0.82 0.00 0.00 66.70 66.90 3k8l h VAL 519 Cb 0.28 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.68 3k8l h VAL 519 CO 0.00 0.27 0.02 0.25 0.02 0.00 0.00 177.57 178.13 3k8l h LEU 520 N 0.77 0.02 -0.10 2.57 5.85 -1.18 -2.37 115.31 120.87 3k8l h LEU 520 Ca 0.19 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.91 3k8l h LEU 520 Cb 0.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 3k8l h LEU 520 CO -0.01 0.02 -0.02 0.18 -0.34 0.00 0.00 178.44 178.26 3k8l n LEU 521 N -5.08 0.17 -0.29 2.25 4.77 -0.60 -3.48 117.00 114.75 3k8l n LEU 521 Ca -0.06 0.09 0.04 0.00 -0.03 0.00 0.00 56.01 56.05 3k8l n LEU 521 Cb 0.04 -0.15 0.03 0.00 -2.33 0.00 0.00 43.42 41.00 3k8l n LEU 521 CO 0.32 0.03 0.36 0.35 -1.33 0.00 0.00 177.39 177.12 3k8l n THR 522 N -1.05 0.00 -3.10 -5.08 -2.24 -0.38 -4.74 114.28 97.68 3k8l n THR 522 Ca 0.18 -0.50 -0.23 0.00 -2.27 0.00 0.00 64.05 61.24 3k8l n THR 522 Cb 0.21 1.15 0.01 0.00 -2.10 0.00 0.00 70.33 69.60 3k8l n THR 522 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3k8l s SER 523 N -0.65 5.92 0.74 3.42 0.01 -0.91 -4.98 113.70 117.25 3k8l s SER 523 Ca 0.09 0.25 -0.11 0.00 1.31 0.00 0.00 55.95 57.49 3k8l s SER 523 Cb 0.06 -1.57 0.04 0.00 0.21 0.00 0.00 66.02 64.76 3k8l s SER 523 CO 0.10 -0.61 1.08 0.00 0.41 0.00 0.00 173.24 174.22 3k8l s ALA 524 N -2.47 2.42 0.00 1.44 0.00 -1.26 -4.92 121.76 116.96 3k8l s ALA 524 Ca 0.47 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.64 3k8l s ALA 524 Cb -0.10 -3.24 0.00 0.00 0.00 0.00 0.00 23.12 19.78 3k8l s ALA 524 CO 0.37 -1.55 0.00 0.41 0.00 0.00 0.00 175.76 174.99 3k8l n GLY 525 N -1.47 -0.51 3.03 0.00 0.00 -1.26 -4.86 105.19 100.11 3k8l n GLY 525 Ca 0.09 -2.20 -0.33 0.00 0.00 0.00 0.00 46.02 43.58 3k8l n GLY 525 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3k8l s HIS 526 N 0.00 3.43 0.40 1.61 0.09 -0.27 -4.80 115.29 115.75 3k8l s HIS 526 Ca 0.00 -2.91 -0.25 0.00 -0.00 0.00 0.00 55.06 51.91 3k8l s HIS 526 Cb 0.00 -3.00 -0.09 0.00 -0.00 0.00 0.00 32.58 29.49 3k8l s HIS 526 CO 0.00 -0.85 1.12 -1.25 -0.00 0.00 0.00 174.74 173.76 3k8l s PRO 527 N 0.23 4.09 -0.10 8.40 0.04 -1.25 -2.26 135.00 144.16 3k8l s PRO 527 Ca 0.14 1.70 0.01 0.00 0.04 0.00 0.00 61.00 62.90 3k8l s PRO 527 Cb -0.22 -2.62 -0.02 0.00 0.04 0.00 0.00 34.50 31.68 3k8l s PRO 527 CO -0.03 -0.25 -0.14 0.71 0.04 0.00 0.00 177.00 177.33 3k8l s TYR 528 N -1.51 2.77 -0.22 0.56 1.51 0.22 -1.46 117.35 119.22 3k8l s TYR 528 Ca 0.57 -0.49 -0.06 0.00 -1.01 0.00 0.00 57.07 56.08 3k8l s TYR 528 Cb -0.27 -1.77 -0.02 0.00 -0.11 0.00 0.00 41.96 39.78 3k8l s TYR 528 CO 0.34 -0.09 0.03 0.42 -1.11 0.00 0.00 175.55 175.14 3k8l s ILE 529 N 0.01 4.07 -0.16 2.71 1.01 0.13 -4.35 121.20 124.62 3k8l s ILE 529 Ca -0.04 -0.26 -0.27 0.00 0.00 0.00 0.00 60.65 60.07 3k8l s ILE 529 Cb -0.14 -2.87 -0.01 0.00 0.01 0.00 0.00 42.46 39.45 3k8l s ILE 529 CO 0.04 0.39 0.93 -0.47 0.00 0.00 0.00 174.94 175.83 3k8l s TYR 530 N 1.27 3.44 0.20 3.97 5.04 -1.26 -0.28 117.35 129.73 3k8l s TYR 530 Ca 0.04 1.40 -0.30 0.00 -2.44 0.00 0.00 57.07 55.78 3k8l s TYR 530 Cb -0.15 -3.12 -0.16 0.00 0.35 0.00 0.00 41.96 38.88 3k8l s TYR 530 CO 0.02 -0.28 0.76 2.48 -1.34 0.00 0.00 175.55 177.20 3k8l n TYR 531 N 5.34 0.25 0.00 4.97 0.18 0.07 -1.38 117.16 126.60 3k8l n TYR 531 Ca 0.07 0.88 0.00 0.00 1.88 0.00 0.00 57.90 60.73 3k8l n TYR 531 Cb 0.48 -2.08 0.00 0.00 -0.38 0.00 0.00 39.34 37.36 3k8l n TYR 531 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3k8l n GLY 532 N 1.76 2.91 0.26 -7.48 0.00 -1.26 -4.84 105.19 96.53 3k8l n GLY 532 Ca 0.16 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.35 3k8l n GLY 532 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3k8l h GLU 533 N 0.55 0.00 0.00 1.61 4.11 -1.57 0.68 114.58 119.96 3k8l h GLU 533 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3k8l h GLU 533 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3k8l h GLU 533 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 179.01 180.01 3k8l h GLU 534 N 0.00 0.00 0.00 1.06 3.07 -1.89 -3.25 114.58 113.58 3k8l h GLU 534 Ca 0.00 0.00 -0.37 0.00 -0.50 0.00 0.00 59.36 58.49 3k8l h GLU 534 Cb 0.18 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.02 3k8l h GLU 534 CO 0.00 0.00 -2.40 1.28 -1.40 0.00 0.00 179.01 176.49 3k8l n LEU 535 N -2.53 0.35 0.00 1.33 4.77 0.14 -2.06 117.00 119.00 3k8l n LEU 535 Ca 0.04 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 3k8l n LEU 535 Cb 0.42 0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.84 3k8l n LEU 535 CO 0.29 0.55 0.00 0.61 -1.33 0.00 0.00 177.39 177.52 3k8l n GLY 536 N 1.81 1.40 3.51 -0.72 0.00 -0.63 -4.76 105.19 105.80 3k8l n GLY 536 Ca -0.34 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.29 3k8l n GLY 536 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3k8l n LEU 537 N 0.00 1.45 -4.26 0.99 4.77 -1.17 -4.76 117.00 114.02 3k8l n LEU 537 Ca 0.00 0.80 -0.14 0.00 -0.03 0.00 0.00 56.01 56.64 3k8l n LEU 537 Cb 0.00 -1.23 -0.10 0.00 -2.33 0.00 0.00 43.42 39.76 3k8l n LEU 537 CO 0.00 -2.63 -0.28 -0.72 -1.33 0.00 0.00 177.39 172.43 3k8l s TYR 538 N -1.60 1.33 0.00 -1.77 -0.85 -1.26 -4.12 117.35 109.08 3k8l s TYR 538 Ca 0.69 -1.15 0.00 0.00 -0.52 0.00 0.00 57.07 56.09 3k8l s TYR 538 Cb -0.47 -0.76 0.00 0.00 0.38 0.00 0.00 41.96 41.11 3k8l s TYR 538 CO 0.54 -0.34 0.00 0.41 -1.52 0.00 0.00 175.55 174.63 3k8l n GLY 539 N -0.34 3.71 3.25 5.49 0.00 -1.26 -4.86 105.19 111.19 3k8l n GLY 539 Ca -0.02 -1.16 -0.16 0.00 0.00 0.00 0.00 46.02 44.68 3k8l n GLY 539 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k8l s THR 540 N -2.00 1.30 -0.29 2.61 -4.23 -1.26 -1.48 115.64 110.28 3k8l s THR 540 Ca 0.00 -1.89 0.25 0.00 -1.18 0.00 0.00 61.69 58.87 3k8l s THR 540 Cb 0.00 -1.69 0.26 0.00 1.34 0.00 0.00 72.50 72.41 3k8l s THR 540 CO 0.00 -0.56 1.75 0.11 -0.54 0.00 0.00 174.62 175.38 3k8l h LYS 541 N 3.15 0.00 -0.11 3.99 1.57 -1.86 -3.37 116.57 119.93 3k8l h LYS 541 Ca -0.38 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.41 3k8l h LYS 541 Cb 1.20 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 3k8l h LYS 541 CO 0.57 0.00 -0.06 -0.25 -0.57 0.00 0.00 179.45 179.13 3k8l n ASP 542 N -2.37 -0.11 -1.08 0.86 10.43 -1.26 -0.30 116.55 122.73 3k8l n ASP 542 Ca 0.01 0.76 0.03 0.00 2.57 0.00 0.00 54.79 58.16 3k8l n ASP 542 Cb 0.18 -0.31 0.18 0.00 1.84 0.00 0.00 41.12 43.00 3k8l n ASP 542 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 3k8l n ASN 543 N -3.02 2.99 0.00 -2.24 5.03 -1.26 -4.96 115.26 111.80 3k8l n ASN 543 Ca 0.00 -2.38 0.00 0.00 0.87 0.00 0.00 54.58 53.07 3k8l n ASN 543 Cb 0.03 -0.56 0.00 0.00 -1.02 0.00 0.00 39.78 38.23 3k8l n ASN 543 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3k8l n GLY 544 N 0.33 3.80 0.31 7.41 0.00 0.59 -4.86 105.19 112.77 3k8l n GLY 544 Ca 0.12 -1.50 0.21 0.00 0.00 0.00 0.00 46.02 44.86 3k8l n GLY 544 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3k8l h ASP 545 N 0.00 0.00 -0.19 1.61 3.32 -1.88 -2.01 116.42 117.27 3k8l h ASP 545 Ca 0.00 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.07 3k8l h ASP 545 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3k8l h ASP 545 CO 0.00 0.00 0.13 -0.33 -1.72 0.00 0.00 179.24 177.32 3k8l h GLU 546 N 0.00 0.17 0.00 3.56 3.07 -1.90 -1.93 114.58 117.55 3k8l h GLU 546 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 3k8l h GLU 546 Cb 0.00 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 27.88 3k8l h GLU 546 CO 0.00 0.11 0.00 1.88 -1.40 0.00 0.00 179.01 179.60 3k8l h TYR 547 N 0.17 0.00 -0.02 4.33 0.05 -1.58 -1.53 116.97 118.39 3k8l h TYR 547 Ca 0.08 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.86 3k8l h TYR 547 Cb 0.11 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.85 3k8l h TYR 547 CO -0.00 0.00 -0.08 1.33 -1.05 0.00 0.00 178.16 178.36 3k8l n VAL 548 N -2.82 0.00 -1.94 -2.88 0.24 -0.76 -4.23 118.33 105.95 3k8l n VAL 548 Ca 0.01 -0.46 -0.22 0.00 -2.04 0.00 0.00 64.34 61.63 3k8l n VAL 548 Cb 0.29 1.40 0.04 0.00 -1.47 0.00 0.00 33.84 34.10 3k8l n VAL 548 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3k8l n ARG 549 N 0.96 3.37 -1.41 7.34 1.74 -0.59 -4.86 116.66 123.20 3k8l n ARG 549 Ca 0.12 -4.04 -0.31 0.00 -0.77 0.00 0.00 57.85 52.85 3k8l n ARG 549 Cb 0.51 -2.22 0.07 0.00 -1.02 0.00 0.00 32.46 29.80 3k8l n ARG 549 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3k8l s SER 550 N -3.46 4.92 0.33 0.55 1.04 -1.11 -4.87 113.70 111.09 3k8l s SER 550 Ca 0.50 1.73 -0.28 0.00 0.48 0.00 0.00 55.95 58.39 3k8l s SER 550 Cb 0.41 -2.51 -0.13 0.00 0.10 0.00 0.00 66.02 63.90 3k8l s SER 550 CO 0.03 -1.76 1.21 -2.65 0.98 0.00 0.00 173.24 171.06 3k8l n PRO 551 N -3.33 1.92 -2.41 4.02 -0.02 -1.26 -4.94 135.00 128.97 3k8l n PRO 551 Ca 0.08 0.67 -0.42 0.00 -2.02 0.00 0.00 63.50 61.81 3k8l n PRO 551 Cb 0.53 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.78 3k8l n PRO 551 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 3k8l s MET 552 N -1.81 4.32 -0.94 -0.52 1.75 -0.93 -4.96 119.30 116.20 3k8l s MET 552 Ca 0.56 1.73 -0.21 0.00 -1.25 0.00 0.00 55.69 56.52 3k8l s MET 552 Cb -0.60 -3.60 0.09 0.00 2.84 0.00 0.00 34.83 33.56 3k8l s MET 552 CO 0.61 -0.52 1.26 -0.51 -0.65 0.00 0.00 175.02 175.22 3k8l s LEU 553 N 2.47 4.26 0.10 4.11 1.43 -1.26 -4.43 118.68 125.36 3k8l s LEU 553 Ca 0.57 -1.65 0.02 0.00 -1.03 0.00 0.00 54.13 52.04 3k8l s LEU 553 Cb -0.25 -2.48 -0.24 0.00 0.03 0.00 0.00 46.19 43.24 3k8l s LEU 553 CO 0.22 -1.31 1.21 -0.50 0.23 0.00 0.00 176.35 176.19 3k8l h TRP 554 N 9.35 0.23 0.00 0.29 4.06 -1.93 -0.76 115.95 127.19 3k8l h TRP 554 Ca 0.13 -0.17 0.00 0.00 2.06 0.00 0.00 58.89 60.91 3k8l h TRP 554 Cb 1.02 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 29.17 3k8l h TRP 554 CO 1.20 1.13 0.00 0.41 -3.56 0.00 0.00 178.44 177.62 3k8l n GLY 555 N 1.44 0.70 0.11 1.49 0.00 -1.26 -2.62 105.19 105.04 3k8l n GLY 555 Ca -0.04 -0.51 -0.01 0.00 0.00 0.00 0.00 46.02 45.47 3k8l n GLY 555 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3k8l n ASP 556 N 0.92 -0.04 0.00 1.61 5.68 -1.26 -4.92 116.55 118.54 3k8l n ASP 556 Ca 0.00 -1.06 0.05 0.00 -0.50 0.00 0.00 54.79 53.28 3k8l n ASP 556 Cb 0.00 0.08 0.26 0.00 -1.14 0.00 0.00 41.12 40.32 3k8l n ASP 556 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3k8l n SER 557 N -2.35 0.00 0.09 -1.12 3.41 -1.26 -2.73 113.62 109.65 3k8l n SER 557 Ca 0.00 0.30 0.13 0.00 -0.26 0.00 0.00 58.87 59.04 3k8l n SER 557 Cb 0.02 -0.38 0.40 0.00 -0.26 0.00 0.00 64.21 63.99 3k8l n SER 557 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3k8l n TYR 558 N -1.38 0.78 -1.73 7.33 4.02 -1.26 -4.79 117.16 120.12 3k8l n TYR 558 Ca 0.04 0.23 -0.42 0.00 -0.01 0.00 0.00 57.90 57.74 3k8l n TYR 558 Cb 0.11 -0.85 -0.03 0.00 -0.02 0.00 0.00 39.34 38.55 3k8l n TYR 558 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3k8l s THR 559 N -3.09 2.04 0.59 -0.72 2.01 -1.11 -0.77 115.64 114.59 3k8l s THR 559 Ca 0.11 0.03 -0.04 0.00 0.31 0.00 0.00 61.69 62.10 3k8l s THR 559 Cb 0.13 -3.02 0.03 0.00 0.01 0.00 0.00 72.50 69.65 3k8l s THR 559 CO 0.60 0.00 0.87 0.42 -0.69 0.00 0.00 174.62 175.83 3k8l s THR 560 N 1.17 3.13 -0.47 -0.82 -4.23 -1.26 -4.74 115.64 108.42 3k8l s THR 560 Ca 0.75 -0.28 0.06 0.00 -1.18 0.00 0.00 61.69 61.04 3k8l s THR 560 Cb -0.50 -3.24 0.23 0.00 1.34 0.00 0.00 72.50 70.33 3k8l s THR 560 CO 0.32 -0.22 0.73 -3.20 -0.54 0.00 0.00 174.62 171.71 3k8l n ASN 561 N -2.55 -2.11 0.04 3.99 4.05 0.21 -4.76 115.26 114.13 3k8l n ASN 561 Ca 0.06 -3.02 0.12 0.00 0.45 0.00 0.00 54.58 52.19 3k8l n ASN 561 Cb 0.59 1.06 0.19 0.00 1.23 0.00 0.00 39.78 42.84 3k8l n ASN 561 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3k8l n TYR 562 N 1.93 0.39 -3.99 1.20 0.18 -1.04 -4.59 117.16 111.24 3k8l n TYR 562 Ca 0.15 0.11 -0.08 0.00 1.88 0.00 0.00 57.90 59.97 3k8l n TYR 562 Cb 0.58 -0.54 -0.09 0.00 -0.38 0.00 0.00 39.34 38.91 3k8l n TYR 562 CO 0.00 0.00 0.00 -0.08 -2.08 0.00 0.00 176.86 174.70 3k8l s THR 563 N -3.13 0.18 -0.25 -3.48 -1.32 -1.26 -5.02 115.64 101.36 3k8l s THR 563 Ca 0.07 -1.55 0.19 0.00 -1.21 0.00 0.00 61.69 59.19 3k8l s THR 563 Cb 0.15 -1.47 0.10 0.00 -1.51 0.00 0.00 72.50 69.77 3k8l s THR 563 CO 0.72 -0.83 1.31 0.44 -2.21 0.00 0.00 174.62 174.05 3k8l h ASP 564 N 2.97 0.00 -0.88 8.08 3.32 -2.03 -3.39 116.42 124.49 3k8l h ASP 564 Ca -0.34 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 56.04 3k8l h ASP 564 Cb 1.17 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.64 3k8l h ASP 564 CO 0.62 0.26 2.12 -0.54 -1.72 0.00 0.00 179.24 179.98 3k8l s LYS 565 N -3.11 3.92 0.03 3.56 1.02 -1.26 -4.89 119.74 119.02 3k8l s LYS 565 Ca 0.03 -1.89 0.02 0.00 0.02 0.00 0.00 55.97 54.14 3k8l s LYS 565 Cb 0.07 -5.52 -0.02 0.00 -0.52 0.00 0.00 37.83 31.85 3k8l s LYS 565 CO 0.74 -2.28 -0.07 0.99 -0.92 0.00 0.00 175.35 173.81 3k8l s THR 566 N 4.43 0.47 -0.34 2.17 2.01 -1.26 -4.47 115.64 118.64 3k8l s THR 566 Ca 0.53 -0.91 -0.12 0.00 0.31 0.00 0.00 61.69 61.51 3k8l s THR 566 Cb 0.03 -0.52 -0.01 0.00 0.01 0.00 0.00 72.50 72.01 3k8l s THR 566 CO 0.06 -0.31 0.23 -0.62 -0.69 0.00 0.00 174.62 173.29 3k8l s ASP 567 N -1.30 5.94 0.58 3.53 -1.08 -1.26 -4.97 116.67 118.11 3k8l s ASP 567 Ca -0.08 -0.51 0.36 0.00 -0.52 0.00 0.00 52.55 51.79 3k8l s ASP 567 Cb -0.09 -2.11 1.71 0.00 -1.46 0.00 0.00 42.92 40.98 3k8l s ASP 567 CO 0.00 -0.25 2.12 0.00 0.52 0.00 0.00 175.17 177.56 3k8l h ALA 568 N 8.47 1.05 -0.25 3.66 0.00 -2.00 -2.98 119.26 127.20 3k8l h ALA 568 Ca -0.31 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.46 3k8l h ALA 568 Cb 1.15 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3k8l h ALA 568 CO 0.64 0.04 -0.31 1.79 0.00 0.00 0.00 179.25 181.40 3k8l h THR 569 N 0.00 1.28 -0.17 0.00 1.35 -2.00 -3.31 112.91 110.07 3k8l h THR 569 Ca -0.00 -1.40 0.03 0.00 -0.55 0.00 0.00 66.41 64.49 3k8l h THR 569 Cb 0.33 1.43 -0.07 0.00 -1.73 0.00 0.00 68.15 68.11 3k8l h THR 569 CO 0.00 0.44 -0.55 0.58 -0.25 0.00 0.00 175.52 175.75 3k8l h VAL 570 N 0.45 0.00 0.00 6.82 2.07 -1.92 0.36 116.25 124.03 3k8l h VAL 570 Ca 0.06 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.58 3k8l h VAL 570 Cb 0.77 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 3k8l h VAL 570 CO 0.06 0.00 0.00 -1.54 0.02 0.00 0.00 177.57 176.11 3k8l n SER 571 N -5.41 0.46 -0.06 0.57 3.41 -1.25 -1.31 113.62 110.04 3k8l n SER 571 Ca -0.06 0.71 -0.14 0.00 -0.26 0.00 0.00 58.87 59.12 3k8l n SER 571 Cb 0.37 -0.77 -0.14 0.00 -0.26 0.00 0.00 64.21 63.41 3k8l n SER 571 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3k8l n LYS 572 N -2.11 0.68 -0.33 4.33 5.02 0.24 -4.36 118.16 121.62 3k8l n LYS 572 Ca -0.01 0.17 0.12 0.00 -2.02 0.00 0.00 58.31 56.57 3k8l n LYS 572 Cb 0.05 -1.64 0.30 0.00 -0.02 0.00 0.00 35.03 33.72 3k8l n LYS 572 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3k8l n ASN 573 N -3.10 3.85 -3.81 4.39 3.02 0.10 -4.89 115.26 114.81 3k8l n ASN 573 Ca -0.31 -2.00 -0.20 0.00 -0.03 0.00 0.00 54.58 52.05 3k8l n ASN 573 Cb 1.07 -0.44 -0.17 0.00 -0.61 0.00 0.00 39.78 39.63 3k8l n ASN 573 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3k8l s VAL 574 N -1.12 0.30 0.47 2.41 1.01 -0.43 -5.03 120.40 118.02 3k8l s VAL 574 Ca 0.47 0.07 -0.22 0.00 0.00 0.00 0.00 61.98 62.30 3k8l s VAL 574 Cb 0.25 -0.41 -0.07 0.00 0.00 0.00 0.00 36.38 36.15 3k8l s VAL 574 CO 0.33 0.20 1.11 -0.54 0.00 0.00 0.00 175.10 176.21 3k8l s LYS 575 N 1.32 3.74 0.80 2.72 -0.14 -1.26 -4.74 119.74 122.17 3k8l s LYS 575 Ca -0.05 1.62 -0.12 0.00 -1.36 0.00 0.00 55.97 56.06 3k8l s LYS 575 Cb -0.13 -2.28 0.07 0.00 -1.68 0.00 0.00 37.83 33.81 3k8l s LYS 575 CO -0.02 -0.53 1.16 0.95 -0.76 0.00 0.00 175.35 176.15 3k8l s THR 576 N -1.69 2.11 0.27 2.17 -4.23 -1.26 -4.75 115.64 108.26 3k8l s THR 576 Ca 0.65 0.01 -0.01 0.00 -1.18 0.00 0.00 61.69 61.17 3k8l s THR 576 Cb -0.24 -3.03 0.27 0.00 1.34 0.00 0.00 72.50 70.84 3k8l s THR 576 CO 0.29 -0.04 1.84 0.58 -0.54 0.00 0.00 174.62 176.76 3k8l h VAL 577 N -1.01 0.96 -0.31 2.29 2.07 -1.20 0.24 116.25 119.30 3k8l h VAL 577 Ca -0.46 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 3k8l h VAL 577 Cb 1.32 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 3k8l h VAL 577 CO 0.66 0.19 0.10 0.00 0.02 0.00 0.00 177.57 178.53 3k8l h ALA 578 N 1.50 0.41 -0.16 1.67 0.00 -1.77 -1.82 119.26 119.10 3k8l h ALA 578 Ca 0.46 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 3k8l h ALA 578 Cb 0.38 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3k8l h ALA 578 CO -0.24 0.04 -0.03 -0.44 0.00 0.00 0.00 179.25 178.58 3k8l h ASP 579 N 0.35 0.30 0.24 0.00 3.32 -1.62 -3.23 116.42 115.77 3k8l h ASP 579 Ca 0.10 -0.36 -0.05 0.00 0.02 0.00 0.00 57.03 56.74 3k8l h ASP 579 Cb 0.24 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 3k8l h ASP 579 CO -0.00 0.59 -0.23 1.56 -1.72 0.00 0.00 179.24 179.44 3k8l h GLN 580 N 0.00 0.00 0.00 3.56 4.20 -0.55 -2.37 115.11 119.96 3k8l h GLN 580 Ca 0.04 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 3k8l h GLN 580 Cb 0.46 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.23 3k8l h GLN 580 CO 0.01 0.23 -0.04 1.96 -0.67 0.00 0.00 178.83 180.32 3k8l h GLN 581 N 0.00 0.00 0.00 1.46 4.20 -1.34 -2.72 115.11 116.71 3k8l h GLN 581 Ca -0.00 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.55 3k8l h GLN 581 Cb 0.41 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.16 3k8l h GLN 581 CO 0.03 0.04 -1.74 0.00 -0.67 0.00 0.00 178.83 176.49 3k8l n ALA 582 N -2.14 2.10 -2.72 3.87 0.00 -0.91 -4.80 120.51 115.91 3k8l n ALA 582 Ca -0.01 -0.69 -0.43 0.00 0.00 0.00 0.00 53.44 52.31 3k8l n ALA 582 Cb 0.22 -0.74 -0.04 0.00 0.00 0.00 0.00 19.45 18.88 3k8l n ALA 582 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3k8l s ASP 583 N -5.37 6.27 0.65 0.00 2.15 -1.03 -4.91 116.67 114.44 3k8l s ASP 583 Ca -0.06 -0.58 0.33 0.00 0.43 0.00 0.00 52.55 52.67 3k8l s ASP 583 Cb 0.09 -2.43 1.78 0.00 -0.30 0.00 0.00 42.92 42.06 3k8l s ASP 583 CO 0.84 -1.32 2.02 0.71 -0.17 0.00 0.00 175.17 177.24 3k8l h THR 584 N 6.00 0.07 -0.45 1.71 1.35 -1.87 0.36 112.91 120.08 3k8l h THR 584 Ca -0.27 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 3k8l h THR 584 Cb 1.07 0.74 0.00 0.00 -1.73 0.00 0.00 68.15 68.23 3k8l h THR 584 CO 1.13 0.00 0.00 1.41 -0.25 0.00 0.00 175.52 177.81 3k8l n HIS 585 N -3.06 0.58 -1.21 4.73 8.25 -1.26 -4.87 115.22 118.37 3k8l n HIS 585 Ca -0.01 -0.29 -0.33 0.00 -0.26 0.00 0.00 57.72 56.83 3k8l n HIS 585 Cb 0.34 -0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.56 3k8l n HIS 585 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3k8l s SER 586 N -1.41 3.96 0.30 0.41 1.04 0.11 -4.93 113.70 113.18 3k8l s SER 586 Ca 0.41 2.17 0.05 0.00 0.48 0.00 0.00 55.95 59.06 3k8l s SER 586 Cb 0.23 -2.57 0.47 0.00 0.10 0.00 0.00 66.02 64.25 3k8l s SER 586 CO 0.32 -2.41 1.73 0.25 0.98 0.00 0.00 173.24 174.11 3k8l h LEU 587 N -0.89 0.36 -0.98 2.42 5.85 -1.89 -2.79 115.31 117.40 3k8l h LEU 587 Ca -0.45 -0.13 -0.05 0.00 0.84 0.00 0.00 57.88 58.09 3k8l h LEU 587 Cb 1.27 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.17 3k8l h LEU 587 CO 0.48 0.66 0.19 0.25 -0.34 0.00 0.00 178.44 179.68 3k8l h LEU 588 N 0.31 0.86 -1.01 2.25 5.85 -1.74 -2.12 115.31 119.71 3k8l h LEU 588 Ca 0.04 -0.15 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 3k8l h LEU 588 Cb 0.70 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 3k8l h LEU 588 CO 0.05 0.81 -0.26 0.78 -0.34 0.00 0.00 178.44 179.48 3k8l h ASN 589 N 0.90 0.00 -0.41 1.25 -0.26 -1.76 -1.68 115.58 113.63 3k8l h ASN 589 Ca 0.20 0.00 -0.13 0.00 -0.56 0.00 0.00 56.30 55.81 3k8l h ASN 589 Cb 0.26 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.51 3k8l h ASN 589 CO -0.01 0.26 -0.23 0.40 -1.06 0.00 0.00 177.43 176.80 3k8l h ILE 590 N 0.00 1.27 -0.34 2.81 1.08 -1.21 -1.91 117.51 119.22 3k8l h ILE 590 Ca -0.00 -1.38 -0.11 0.00 -0.39 0.00 0.00 64.86 62.98 3k8l h ILE 590 Cb 0.81 1.17 -0.01 0.00 -3.07 0.00 0.00 36.82 35.72 3k8l h ILE 590 CO 0.03 0.47 -0.21 1.88 -0.69 0.00 0.00 178.15 179.63 3k8l h TYR 591 N 0.79 0.86 -0.69 1.37 -1.99 -0.97 0.87 116.97 117.20 3k8l h TYR 591 Ca 0.10 -0.23 -0.03 0.00 2.00 0.00 0.00 58.73 60.57 3k8l h TYR 591 Cb 0.79 -0.19 -0.03 0.00 2.00 0.00 0.00 36.73 39.29 3k8l h TYR 591 CO 0.05 0.96 0.30 0.74 -0.00 0.00 0.00 178.16 180.21 3k8l h PHE 592 N 0.51 1.02 -0.43 4.88 0.04 -1.28 0.05 116.94 121.72 3k8l h PHE 592 Ca 0.07 -0.07 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 3k8l h PHE 592 Cb 0.76 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 38.58 3k8l h PHE 592 CO 0.06 0.78 0.16 1.03 -0.60 0.00 0.00 178.31 179.75 3k8l h SER 593 N 0.97 0.61 -0.36 2.17 0.87 -1.23 -1.49 113.55 115.09 3k8l h SER 593 Ca 0.23 -0.18 -0.17 0.00 -1.23 0.00 0.00 61.79 60.45 3k8l h SER 593 Cb 0.17 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 61.97 3k8l h SER 593 CO -0.02 0.62 -0.42 -0.07 -0.53 0.00 0.00 176.83 176.41 3k8l h LEU 594 N 0.56 0.99 -0.63 2.23 3.38 -0.55 -1.78 115.31 119.51 3k8l h LEU 594 Ca 0.14 -0.48 -0.14 0.00 0.09 0.00 0.00 57.88 57.49 3k8l h LEU 594 Cb 0.21 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3k8l h LEU 594 CO -0.01 1.28 -0.48 0.71 0.09 0.00 0.00 178.44 180.03 3k8l h THR 595 N 0.73 1.32 -0.57 0.22 1.35 -0.98 -1.31 112.91 113.67 3k8l h THR 595 Ca 0.05 -1.69 -0.09 0.00 -0.55 0.00 0.00 66.41 64.13 3k8l h THR 595 Cb 1.02 1.69 -0.02 0.00 -1.73 0.00 0.00 68.15 69.11 3k8l h THR 595 CO 0.10 0.52 -0.00 -0.09 -0.25 0.00 0.00 175.52 175.81 3k8l h ARG 596 N 0.40 0.98 0.21 4.72 2.43 -1.23 -1.20 114.38 120.68 3k8l h ARG 596 Ca 0.02 -0.29 -0.01 0.00 -0.81 0.00 0.00 59.98 58.89 3k8l h ARG 596 Cb 0.99 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.44 3k8l h ARG 596 CO 0.09 0.96 -0.10 1.25 -1.51 0.00 0.00 179.97 180.66 3k8l h LEU 597 N 0.90 -0.23 -1.85 3.80 5.85 -1.05 -2.35 115.31 120.38 3k8l h LEU 597 Ca 0.16 -0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 3k8l h LEU 597 Cb 0.53 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 3k8l h LEU 597 CO 0.03 0.00 0.08 -0.09 -0.34 0.00 0.00 178.44 178.12 3k8l h ARG 598 N -0.47 0.18 0.00 1.25 2.43 -1.14 -1.47 114.38 115.16 3k8l h ARG 598 Ca -0.03 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3k8l h ARG 598 Cb 0.36 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 3k8l h ARG 598 CO 0.05 0.13 -0.04 0.09 -1.51 0.00 0.00 179.97 178.69 3k8l n ASN 599 N -4.51 0.24 -0.10 -3.80 5.03 -0.46 -3.05 115.26 108.61 3k8l n ASN 599 Ca -0.01 0.47 -0.12 0.00 0.87 0.00 0.00 54.58 55.80 3k8l n ASN 599 Cb 0.09 -0.52 -0.13 0.00 -1.02 0.00 0.00 39.78 38.19 3k8l n ASN 599 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 3k8l n THR 600 N -1.70 1.30 -3.52 3.41 -2.24 -0.60 -3.27 114.28 107.66 3k8l n THR 600 Ca 0.07 -0.68 -0.41 0.00 -2.27 0.00 0.00 64.05 60.75 3k8l n THR 600 Cb 0.36 -0.82 -0.10 0.00 -2.10 0.00 0.00 70.33 67.66 3k8l n THR 600 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3k8l s TYR 601 N -2.46 3.23 0.36 4.78 1.51 -0.92 -4.97 117.35 118.89 3k8l s TYR 601 Ca -0.18 -0.36 0.12 0.00 -1.01 0.00 0.00 57.07 55.64 3k8l s TYR 601 Cb 0.07 -2.50 0.92 0.00 -0.11 0.00 0.00 41.96 40.33 3k8l s TYR 601 CO 0.68 -0.44 1.82 -1.35 -1.11 0.00 0.00 175.55 175.15 3k8l h PRO 602 N 8.52 0.57 -0.47 -1.71 0.11 -1.91 0.11 132.00 137.21 3k8l h PRO 602 Ca -0.30 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.82 3k8l h PRO 602 Cb 1.14 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.10 3k8l h PRO 602 CO 0.66 0.38 0.32 0.00 -0.21 0.00 0.00 178.00 179.14 3k8l h ALA 603 N 1.62 1.87 0.05 -0.75 0.00 -1.85 -0.14 119.26 120.06 3k8l h ALA 603 Ca 0.52 -0.02 -0.25 0.00 0.00 0.00 0.00 54.91 55.16 3k8l h ALA 603 Cb 1.04 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 3k8l h ALA 603 CO -0.27 0.06 -1.34 -0.07 0.00 0.00 0.00 179.25 177.64 3k8l h LEU 604 N 0.46 0.16 -0.58 0.00 4.07 -1.23 -2.39 115.31 115.79 3k8l h LEU 604 Ca 0.20 -0.70 0.07 0.00 0.08 0.00 0.00 57.88 57.52 3k8l h LEU 604 Cb 0.22 -0.05 -0.06 0.00 1.08 0.00 0.00 40.66 41.85 3k8l h LEU 604 CO -0.05 1.55 0.28 0.00 -1.08 0.00 0.00 178.44 179.14 3k8l h ALA 605 N -0.26 0.76 0.00 1.53 0.00 -0.67 -3.36 119.26 117.26 3k8l h ALA 605 Ca -0.33 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3k8l h ALA 605 Cb 1.52 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.27 3k8l h ALA 605 CO -0.08 -0.09 -0.14 -0.85 0.00 0.00 0.00 179.25 178.09 3k8l n GLU 606 N -4.90 0.00 -1.42 0.00 0.28 -0.11 -4.42 120.64 110.08 3k8l n GLU 606 Ca 0.07 -0.59 -0.29 0.00 -0.16 0.00 0.00 57.16 56.19 3k8l n GLU 606 Cb 0.19 -0.45 0.16 0.00 1.43 0.00 0.00 31.44 32.78 3k8l n GLU 606 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 3k8l s GLY 607 N -0.27 1.59 0.20 -1.84 0.00 -0.90 -4.94 107.32 101.15 3k8l s GLY 607 Ca 0.00 -0.59 0.05 0.00 0.00 0.00 0.00 44.72 44.18 3k8l s GLY 607 CO 0.00 0.04 0.25 -1.31 0.00 0.00 0.00 173.10 172.07 3k8l s ASN 608 N -3.93 5.94 -0.10 1.64 0.01 0.28 -4.64 114.94 114.14 3k8l s ASN 608 Ca 0.66 -0.03 -0.04 0.00 -0.71 0.00 0.00 52.86 52.74 3k8l s ASN 608 Cb -0.14 -1.66 -0.04 0.00 0.41 0.00 0.00 41.25 39.82 3k8l s ASN 608 CO 0.55 0.00 0.05 -0.32 -1.51 0.00 0.00 177.10 175.87 3k8l s MET 609 N -3.54 3.16 0.01 -0.60 -2.45 -1.26 -1.18 119.30 113.44 3k8l s MET 609 Ca 0.33 -0.31 -0.00 0.00 -1.25 0.00 0.00 55.69 54.47 3k8l s MET 609 Cb -0.09 -2.94 -0.01 0.00 1.25 0.00 0.00 34.83 33.03 3k8l s MET 609 CO 0.27 0.72 -0.02 0.95 1.05 0.00 0.00 175.02 177.99 3k8l s THR 610 N -0.91 0.07 0.62 10.11 -4.23 -0.91 -4.98 115.64 115.41 3k8l s THR 610 Ca 0.14 -0.58 -0.19 0.00 -1.18 0.00 0.00 61.69 59.88 3k8l s THR 610 Cb -0.12 -0.17 -0.02 0.00 1.34 0.00 0.00 72.50 73.53 3k8l s THR 610 CO 0.03 -0.32 1.28 -1.59 -0.54 0.00 0.00 174.62 173.48 3k8l s LYS 611 N -0.93 2.75 0.60 3.99 -2.85 -1.26 -1.16 119.74 120.87 3k8l s LYS 611 Ca -0.10 2.01 -0.17 0.00 -1.00 0.00 0.00 55.97 56.71 3k8l s LYS 611 Cb -0.06 -1.92 -0.03 0.00 -2.06 0.00 0.00 37.83 33.76 3k8l s LYS 611 CO -0.01 -1.43 1.10 -1.58 0.10 0.00 0.00 175.35 173.53 3k8l s HIS 612 N -1.44 2.72 0.29 1.78 5.65 -1.26 -4.65 115.29 118.39 3k8l s HIS 612 Ca 0.80 1.54 0.05 0.00 0.25 0.00 0.00 55.06 57.71 3k8l s HIS 612 Cb -0.36 -3.18 0.43 0.00 -1.18 0.00 0.00 32.58 28.30 3k8l s HIS 612 CO 0.39 -1.49 1.70 0.66 -0.65 0.00 0.00 174.74 175.34 3k8l h SER 613 N 0.61 0.31 0.00 9.88 4.64 -1.96 -3.42 113.55 123.62 3k8l h SER 613 Ca -0.48 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 60.71 3k8l h SER 613 Cb 1.25 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3k8l h SER 613 CO 0.56 0.67 0.00 0.52 -0.87 0.00 0.00 176.83 177.71 3k8l n VAL 614 N -4.04 0.00 -1.79 0.95 0.31 -1.26 -4.90 118.33 107.60 3k8l n VAL 614 Ca -0.01 0.16 -0.19 0.00 -0.01 0.00 0.00 64.34 64.28 3k8l n VAL 614 Cb 0.47 -1.07 -0.06 0.00 -0.91 0.00 0.00 33.84 32.27 3k8l n VAL 614 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 3k8l s TYR 615 N -0.58 1.45 0.00 3.52 2.02 -1.26 -4.54 117.35 117.95 3k8l s TYR 615 Ca 0.00 1.40 0.00 0.00 -0.37 0.00 0.00 57.07 58.10 3k8l s TYR 615 Cb 0.00 -3.70 0.00 0.00 -0.40 0.00 0.00 41.96 37.86 3k8l s TYR 615 CO 0.00 -1.56 0.00 0.27 -1.57 0.00 0.00 175.55 172.69 3k8l n ASN 616 N 16.70 0.00 -0.01 2.29 0.23 -1.26 -4.38 115.26 128.82 3k8l n ASN 616 Ca 0.44 -0.15 0.17 0.00 -0.53 0.00 0.00 54.58 54.51 3k8l n ASN 616 Cb 0.45 0.00 0.63 0.00 -2.08 0.00 0.00 39.78 38.78 3k8l n ASN 616 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3k8l h GLU 617 N 0.00 0.12 -0.09 -3.83 9.09 -1.82 -1.78 114.58 116.27 3k8l h GLU 617 Ca 0.00 -0.01 -0.04 0.00 0.05 0.00 0.00 59.36 59.36 3k8l h GLU 617 Cb 0.00 -0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.06 3k8l h GLU 617 CO 0.00 0.08 -0.14 0.66 0.05 0.00 0.00 179.01 179.66 3k8l h SER 618 N 0.13 0.12 -0.25 3.06 4.64 -1.88 -2.33 113.55 117.04 3k8l h SER 618 Ca 0.25 -0.02 -0.10 0.00 -0.47 0.00 0.00 61.79 61.44 3k8l h SER 618 Cb 0.81 -0.03 -0.06 0.00 -0.31 0.00 0.00 62.40 62.81 3k8l h SER 618 CO -0.03 0.28 0.13 0.00 -0.87 0.00 0.00 176.83 176.34 3k8l n GLN 619 N -4.31 1.66 -0.30 4.77 1.13 -0.67 -4.36 117.38 115.31 3k8l n GLN 619 Ca -0.01 -0.91 0.08 0.00 -1.94 0.00 0.00 57.00 54.22 3k8l n GLN 619 Cb 0.25 -1.49 0.24 0.00 0.11 0.00 0.00 30.24 29.35 3k8l n GLN 619 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 3k8l h GLU 620 N 0.62 0.55 0.10 -1.09 4.81 -1.56 0.17 114.58 118.19 3k8l h GLU 620 Ca 0.12 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.32 3k8l h GLU 620 Cb 1.34 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 3k8l h GLU 620 CO 0.27 0.36 -0.12 -0.22 -0.73 0.00 0.00 179.01 178.57 3k8l h LYS 621 N 0.57 -0.21 -0.03 1.92 3.64 -1.87 -3.32 116.57 117.27 3k8l h LYS 621 Ca 0.48 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.87 3k8l h LYS 621 Cb 0.74 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 3k8l h LYS 621 CO -0.40 -0.14 -0.04 -0.25 -2.27 0.00 0.00 179.45 176.35 3k8l n ASP 622 N -3.01 2.62 -3.07 4.20 8.00 -1.19 -4.65 116.55 119.45 3k8l n ASP 622 Ca -0.03 -1.85 -0.16 0.00 0.71 0.00 0.00 54.79 53.46 3k8l n ASP 622 Cb 0.10 0.04 -0.01 0.00 -0.02 0.00 0.00 41.12 41.23 3k8l n ASP 622 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3k8l n TYR 623 N 1.00 0.10 -0.02 1.24 4.01 0.61 -4.95 117.16 119.14 3k8l n TYR 623 Ca 0.15 -3.53 -0.16 0.00 -0.16 0.00 0.00 57.90 54.20 3k8l n TYR 623 Cb 0.54 -0.26 -0.10 0.00 -0.31 0.00 0.00 39.34 39.22 3k8l n TYR 623 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 3k8l h LYS 624 N 2.99 0.37 0.00 -0.72 1.57 -1.69 -3.23 116.57 115.85 3k8l h LYS 624 Ca 0.05 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 3k8l h LYS 624 Cb 1.02 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.40 3k8l h LYS 624 CO 0.47 0.98 0.00 -2.30 -0.57 0.00 0.00 179.45 178.03 3k8l n PRO 625 N -4.35 0.08 -3.03 3.15 -0.02 -1.12 0.87 135.00 130.57 3k8l n PRO 625 Ca -0.09 0.57 -0.40 0.00 -2.02 0.00 0.00 63.50 61.56 3k8l n PRO 625 Cb 0.56 -1.75 -0.05 0.00 -0.02 0.00 0.00 33.50 32.24 3k8l n PRO 625 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3k8l s ILE 626 N -3.30 5.00 -0.23 4.25 1.09 -1.22 0.10 121.20 126.89 3k8l s ILE 626 Ca -0.01 1.41 0.02 0.00 -1.10 0.00 0.00 60.65 60.96 3k8l s ILE 626 Cb 0.04 -4.03 0.05 0.00 -1.06 0.00 0.00 42.46 37.46 3k8l s ILE 626 CO 0.11 0.16 -0.09 0.00 -0.10 0.00 0.00 174.94 175.02 3k8l s ALA 627 N 1.43 2.22 0.05 9.38 0.00 -0.31 -1.70 121.76 132.82 3k8l s ALA 627 Ca 0.35 -1.47 0.01 0.00 0.00 0.00 0.00 51.96 50.85 3k8l s ALA 627 Cb -0.17 -1.45 -0.03 0.00 0.00 0.00 0.00 23.12 21.48 3k8l s ALA 627 CO 0.14 -1.08 -0.06 0.00 0.00 0.00 0.00 175.76 174.77 3k8l s ALA 628 N 1.28 0.51 0.07 0.00 0.00 -1.26 -0.12 121.76 122.23 3k8l s ALA 628 Ca -0.06 -0.85 -0.27 0.00 0.00 0.00 0.00 51.96 50.78 3k8l s ALA 628 Cb -0.18 0.11 0.09 0.00 0.00 0.00 0.00 23.12 23.13 3k8l s ALA 628 CO -0.06 -0.12 1.04 1.67 0.00 0.00 0.00 175.76 178.29 3k8l s TRP 629 N -1.96 -0.14 0.06 0.00 -2.14 -0.55 -4.00 118.94 110.21 3k8l s TRP 629 Ca -0.07 -0.07 0.02 0.00 2.66 0.00 0.00 56.10 58.63 3k8l s TRP 629 Cb -0.06 0.59 -0.04 0.00 -3.10 0.00 0.00 33.47 30.86 3k8l s TRP 629 CO -0.02 -0.62 0.11 0.71 -2.66 0.00 0.00 176.95 174.48 3k8l s TYR 630 N -3.01 3.30 -0.16 1.66 1.51 -0.30 -0.81 117.35 119.53 3k8l s TYR 630 Ca 0.11 0.15 0.00 0.00 -1.01 0.00 0.00 57.07 56.33 3k8l s TYR 630 Cb 0.00 -1.68 0.03 0.00 -0.11 0.00 0.00 41.96 40.20 3k8l s TYR 630 CO -0.01 0.55 -0.12 -1.64 -1.11 0.00 0.00 175.55 173.21 3k8l s MET 631 N -2.30 2.14 -0.03 -0.62 -1.94 -0.73 -2.13 119.30 113.69 3k8l s MET 631 Ca 0.30 -0.60 0.02 0.00 -1.71 0.00 0.00 55.69 53.70 3k8l s MET 631 Cb -0.12 -2.14 0.00 0.00 2.01 0.00 0.00 34.83 34.58 3k8l s MET 631 CO 0.22 -0.29 -0.09 0.99 -0.01 0.00 0.00 175.02 175.84 3k8l s THR 632 N 1.49 0.76 -0.04 2.05 2.01 -0.33 -0.75 115.64 120.83 3k8l s THR 632 Ca 0.03 -0.34 -0.01 0.00 0.31 0.00 0.00 61.69 61.68 3k8l s THR 632 Cb -0.14 -0.68 0.03 0.00 0.01 0.00 0.00 72.50 71.72 3k8l s THR 632 CO -0.10 0.24 0.06 -0.75 -0.69 0.00 0.00 174.62 173.38 3k8l s LYS 633 N 0.24 -0.06 7.06 4.92 2.47 -0.72 -0.55 119.74 133.09 3k8l s LYS 633 Ca -0.04 0.33 0.00 0.00 -1.56 0.00 0.00 55.97 54.70 3k8l s LYS 633 Cb -0.09 -0.42 0.00 0.00 -1.46 0.00 0.00 37.83 35.86 3k8l s LYS 633 CO 0.00 -0.28 0.00 -0.25 0.16 0.00 0.00 175.35 174.99 3k8l n ASP 634 N 4.95 0.00 -0.90 1.43 9.92 -1.26 -1.06 116.55 129.63 3k8l n ASP 634 Ca -0.11 0.00 0.10 0.00 -0.53 0.00 0.00 54.79 54.25 3k8l n ASP 634 Cb 0.50 0.00 0.14 0.00 -0.64 0.00 0.00 41.12 41.12 3k8l n ASP 634 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 3k8l n ASN 635 N 7.47 2.96 -4.63 -2.24 5.15 -1.26 -4.91 115.26 117.80 3k8l n ASN 635 Ca 0.00 -1.88 -0.42 0.00 -0.60 0.00 0.00 54.58 51.69 3k8l n ASN 635 Cb 0.00 -0.13 -0.05 0.00 -0.53 0.00 0.00 39.78 39.07 3k8l n ASN 635 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 3k8l s GLU 636 N -1.45 4.12 -0.11 1.20 2.12 -0.23 -5.04 118.70 119.31 3k8l s GLU 636 Ca 0.29 0.78 0.04 0.00 0.36 0.00 0.00 54.97 56.43 3k8l s GLU 636 Cb 0.18 -3.66 0.00 0.00 0.26 0.00 0.00 34.13 30.91 3k8l s GLU 636 CO 0.26 -0.53 -0.23 0.21 -0.54 0.00 0.00 175.26 174.43 3k8l s LYS 637 N 2.79 3.05 0.22 4.30 2.20 -1.26 -1.76 119.74 129.28 3k8l s LYS 637 Ca 0.32 -0.87 0.11 0.00 -0.36 0.00 0.00 55.97 55.18 3k8l s LYS 637 Cb -0.15 -2.34 -0.05 0.00 -1.51 0.00 0.00 37.83 33.79 3k8l s LYS 637 CO 0.09 0.14 -0.22 -0.51 -0.36 0.00 0.00 175.35 174.49 3k8l s LEU 638 N 0.44 2.49 -0.13 5.43 1.43 0.07 -1.43 118.68 126.97 3k8l s LEU 638 Ca -0.16 -0.93 0.03 0.00 -1.03 0.00 0.00 54.13 52.03 3k8l s LEU 638 Cb -0.17 -1.09 0.00 0.00 0.03 0.00 0.00 46.19 44.96 3k8l s LEU 638 CO 0.07 0.06 -0.21 -0.22 0.23 0.00 0.00 176.35 176.28 3k8l s LEU 639 N -2.98 2.19 -0.16 1.79 2.96 0.93 -1.78 118.68 121.63 3k8l s LEU 639 Ca 0.23 -0.55 0.00 0.00 -0.22 0.00 0.00 54.13 53.59 3k8l s LEU 639 Cb -0.06 -1.46 0.00 0.00 0.50 0.00 0.00 46.19 45.17 3k8l s LEU 639 CO 0.11 0.11 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.40 3k8l s VAL 640 N 0.62 2.54 -0.08 1.68 1.01 0.01 -0.41 120.40 125.77 3k8l s VAL 640 Ca -0.11 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.09 3k8l s VAL 640 Cb -0.16 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 34.16 3k8l s VAL 640 CO 0.03 0.52 -0.15 -0.63 0.00 0.00 0.00 175.10 174.86 3k8l s ILE 641 N 0.90 1.37 -0.02 2.22 -1.09 -0.40 -1.48 121.20 122.70 3k8l s ILE 641 Ca -0.04 -0.62 0.04 0.00 -2.23 0.00 0.00 60.65 57.81 3k8l s ILE 641 Cb -0.15 -1.23 -0.01 0.00 -1.58 0.00 0.00 42.46 39.49 3k8l s ILE 641 CO -0.02 0.41 -0.13 -1.00 -1.23 0.00 0.00 174.94 172.97 3k8l s HIS 642 N 0.61 1.23 -0.59 3.97 3.76 0.82 -1.09 115.29 124.00 3k8l s HIS 642 Ca -0.15 -0.26 -0.09 0.00 -0.15 0.00 0.00 55.06 54.41 3k8l s HIS 642 Cb -0.16 -0.81 0.15 0.00 1.11 0.00 0.00 32.58 32.87 3k8l s HIS 642 CO 0.05 -0.05 0.47 1.21 -0.85 0.00 0.00 174.74 175.57 3k8l s ASN 643 N -0.22 5.85 0.00 1.40 2.47 -0.52 -1.16 114.94 122.76 3k8l s ASN 643 Ca 0.03 -2.31 0.09 0.00 0.42 0.00 0.00 52.86 51.10 3k8l s ASN 643 Cb -0.06 -2.03 0.55 0.00 -1.45 0.00 0.00 41.25 38.26 3k8l s ASN 643 CO -0.00 -0.60 0.97 0.49 -3.72 0.00 0.00 177.10 174.24 3k8l n PHE 644 N 4.38 0.00 -4.09 0.43 3.01 0.29 -1.31 117.46 120.17 3k8l n PHE 644 Ca 0.00 0.00 -0.24 0.00 1.01 0.00 0.00 57.45 58.22 3k8l n PHE 644 Cb 0.41 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.81 3k8l n PHE 644 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 3k8l s GLY 645 N -1.93 2.32 0.00 1.37 0.00 -1.26 -3.93 107.32 103.89 3k8l s GLY 645 Ca 0.14 -2.09 0.24 0.00 0.00 0.00 0.00 44.72 43.00 3k8l s GLY 645 CO 0.11 -1.90 1.23 0.61 0.00 0.00 0.00 173.10 173.16 3k8l n GLY 646 N -1.26 -0.23 3.61 0.20 0.00 -1.26 0.11 105.19 106.36 3k8l n GLY 646 Ca -0.01 -0.56 -0.40 0.00 0.00 0.00 0.00 46.02 45.05 3k8l n GLY 646 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k8l s THR 647 N -2.52 5.07 0.53 2.61 2.01 -1.26 -4.02 115.64 118.06 3k8l s THR 647 Ca 0.20 0.84 -0.19 0.00 0.31 0.00 0.00 61.69 62.84 3k8l s THR 647 Cb 0.18 -3.84 -0.09 0.00 0.01 0.00 0.00 72.50 68.77 3k8l s THR 647 CO 0.57 0.07 0.62 0.00 -0.69 0.00 0.00 174.62 175.19 3k8l n ALA 648 N 5.56 -0.94 -2.87 7.40 0.00 -1.26 -4.47 120.51 123.93 3k8l n ALA 648 Ca -0.04 0.04 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 3k8l n ALA 648 Cb 0.50 -1.87 -0.10 0.00 0.00 0.00 0.00 19.45 17.97 3k8l n ALA 648 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3k8l s MET 649 N -2.05 0.41 -0.17 0.00 0.00 -0.58 -4.94 119.30 111.98 3k8l s MET 649 Ca 0.68 -0.66 -0.02 0.00 0.00 0.00 0.00 55.69 55.69 3k8l s MET 649 Cb -0.48 0.15 -0.01 0.00 0.00 0.00 0.00 34.83 34.49 3k8l s MET 649 CO 0.54 -0.08 -0.09 -0.65 0.00 0.00 0.00 175.02 174.75 3k8l s GLN 650 N -1.87 3.42 -0.15 4.11 -0.21 -1.26 -0.76 119.66 122.94 3k8l s GLN 650 Ca -0.12 -0.64 0.00 0.00 0.02 0.00 0.00 55.36 54.62 3k8l s GLN 650 Cb -0.06 -2.81 0.03 0.00 1.00 0.00 0.00 33.01 31.16 3k8l s GLN 650 CO -0.02 0.06 -0.12 -0.51 -2.12 0.00 0.00 175.29 172.59 3k8l s LEU 651 N 0.78 1.65 -0.08 2.90 1.43 0.11 -4.94 118.68 120.53 3k8l s LEU 651 Ca -0.03 -0.51 -0.26 0.00 -1.03 0.00 0.00 54.13 52.29 3k8l s LEU 651 Cb -0.15 -1.09 -0.03 0.00 0.03 0.00 0.00 46.19 44.95 3k8l s LEU 651 CO 0.01 -0.09 0.83 -2.16 0.23 0.00 0.00 176.35 175.18 3k8l s PRO 652 N 1.54 4.43 -0.15 1.29 0.04 -1.26 0.77 135.00 141.65 3k8l s PRO 652 Ca 0.04 1.10 -0.01 0.00 0.04 0.00 0.00 61.00 62.17 3k8l s PRO 652 Cb -0.13 -3.49 -0.01 0.00 0.04 0.00 0.00 34.50 30.90 3k8l s PRO 652 CO -0.10 -0.10 -0.11 -0.51 0.04 0.00 0.00 177.00 176.22 3k8l s LEU 653 N 1.31 2.75 0.00 -3.56 1.43 0.02 -4.96 118.68 115.67 3k8l s LEU 653 Ca 0.42 -0.34 0.25 0.00 -1.03 0.00 0.00 54.13 53.43 3k8l s LEU 653 Cb -0.18 -1.64 0.48 0.00 0.03 0.00 0.00 46.19 44.88 3k8l s LEU 653 CO 0.19 0.12 1.41 0.35 0.23 0.00 0.00 176.35 178.66 3k8l n THR 654 N 3.81 0.00 -2.14 5.49 -2.24 -1.26 -4.27 114.28 113.67 3k8l n THR 654 Ca -0.18 -0.36 -0.35 0.00 -2.27 0.00 0.00 64.05 60.88 3k8l n THR 654 Cb 0.52 1.07 0.02 0.00 -2.10 0.00 0.00 70.33 69.83 3k8l n THR 654 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3k8l s ASP 655 N -2.10 5.48 -1.15 3.42 1.01 -1.26 -4.93 116.67 117.14 3k8l s ASP 655 Ca 0.30 2.25 -0.21 0.00 0.71 0.00 0.00 52.55 55.60 3k8l s ASP 655 Cb 0.20 -2.59 0.05 0.00 1.01 0.00 0.00 42.92 41.60 3k8l s ASP 655 CO 0.36 -1.39 1.60 -0.75 0.21 0.00 0.00 175.17 175.20 3k8l s LYS 656 N -3.34 3.73 0.32 8.23 2.47 -1.26 -4.97 119.74 124.91 3k8l s LYS 656 Ca 0.74 -1.50 -0.28 0.00 -1.56 0.00 0.00 55.97 53.37 3k8l s LYS 656 Cb -0.26 -5.43 -0.09 0.00 -1.46 0.00 0.00 37.83 30.58 3k8l s LYS 656 CO 0.30 -2.29 1.11 0.42 0.16 0.00 0.00 175.35 175.04 3k8l s ILE 657 N 4.87 3.46 0.00 5.43 -1.09 -1.26 -1.13 121.20 131.47 3k8l s ILE 657 Ca 0.51 1.37 0.00 0.00 -2.23 0.00 0.00 60.65 60.29 3k8l s ILE 657 Cb 0.02 -3.83 0.00 0.00 -1.58 0.00 0.00 42.46 37.06 3k8l s ILE 657 CO -0.01 0.25 0.00 1.21 -1.23 0.00 0.00 174.94 175.16 3k8l n GLU 658 N 0.80 1.47 -3.54 2.79 2.13 -0.50 -4.70 120.64 119.07 3k8l n GLU 658 Ca 0.01 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.68 3k8l n GLU 658 Cb 0.46 -0.78 -0.05 0.00 0.27 0.00 0.00 31.44 31.34 3k8l n GLU 658 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 3k8l s LYS 659 N -1.55 1.07 -0.26 5.31 2.20 -1.00 -4.99 119.74 120.52 3k8l s LYS 659 Ca 0.00 -0.16 -0.09 0.00 -0.36 0.00 0.00 55.97 55.36 3k8l s LYS 659 Cb 0.00 0.49 -0.04 0.00 -1.51 0.00 0.00 37.83 36.78 3k8l s LYS 659 CO 0.00 -0.39 0.11 0.08 -0.36 0.00 0.00 175.35 174.80 3k8l s VAL 660 N -2.34 4.71 -0.22 4.02 1.01 -1.26 -1.22 120.40 125.10 3k8l s VAL 660 Ca -0.06 -0.04 0.02 0.00 0.00 0.00 0.00 61.98 61.90 3k8l s VAL 660 Cb -0.01 -3.22 -0.20 0.00 0.00 0.00 0.00 36.38 32.96 3k8l s VAL 660 CO -0.01 0.31 -0.06 0.18 0.00 0.00 0.00 175.10 175.53 3k8l n LEU 661 N 4.91 2.61 -3.73 3.92 4.32 -0.24 0.29 117.00 129.07 3k8l n LEU 661 Ca -0.15 -0.04 -0.12 0.00 -0.02 0.00 0.00 56.01 55.67 3k8l n LEU 661 Cb 0.52 -0.81 -0.11 0.00 -1.62 0.00 0.00 43.42 41.40 3k8l n LEU 661 CO 0.32 0.87 0.04 0.12 -1.22 0.00 0.00 177.39 177.52 3k8l s PHE 662 N -2.53 -0.46 -0.03 -1.77 5.36 -1.17 -4.03 117.98 113.35 3k8l s PHE 662 Ca -0.30 1.07 0.01 0.00 -0.96 0.00 0.00 56.93 56.76 3k8l s PHE 662 Cb 0.08 0.17 0.01 0.00 -0.34 0.00 0.00 43.02 42.94 3k8l s PHE 662 CO 0.66 -0.24 -0.05 0.08 -1.46 0.00 0.00 175.22 174.21 3k8l s VAL 663 N 0.61 0.49 -0.05 3.12 1.01 -1.26 -1.20 120.40 123.12 3k8l s VAL 663 Ca -0.03 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.79 3k8l s VAL 663 Cb -0.05 -0.48 0.02 0.00 0.00 0.00 0.00 36.38 35.87 3k8l s VAL 663 CO -0.04 0.18 -0.06 0.21 0.00 0.00 0.00 175.10 175.40 3k8l s ASN 664 N 0.48 1.24 0.00 3.32 3.04 -0.18 -4.99 114.94 117.85 3k8l s ASN 664 Ca -0.06 -0.17 0.00 0.00 0.04 0.00 0.00 52.86 52.67 3k8l s ASN 664 Cb -0.10 -0.55 0.00 0.00 -1.54 0.00 0.00 41.25 39.06 3k8l s ASN 664 CO -0.00 -0.05 0.00 0.61 -3.04 0.00 0.00 177.10 174.62 3k8l n GLY 665 N 4.13 -1.89 3.63 1.21 0.00 -1.26 -1.00 105.19 110.00 3k8l n GLY 665 Ca -0.22 -1.54 -0.43 0.00 0.00 0.00 0.00 46.02 43.82 3k8l n GLY 665 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3k8l s GLU 666 N 0.00 3.99 -0.05 1.61 2.12 -1.26 -4.94 118.70 120.16 3k8l s GLU 666 Ca 0.00 0.95 0.02 0.00 0.36 0.00 0.00 54.97 56.30 3k8l s GLU 666 Cb 0.00 -3.78 0.02 0.00 0.26 0.00 0.00 34.13 30.63 3k8l s GLU 666 CO 0.00 -1.01 -0.09 0.95 -0.54 0.00 0.00 175.26 174.57 3k8l s THR 667 N 3.83 0.90 0.06 -1.70 -4.23 -1.26 0.64 115.64 113.89 3k8l s THR 667 Ca 0.46 -0.35 0.01 0.00 -1.18 0.00 0.00 61.69 60.63 3k8l s THR 667 Cb -0.11 -0.85 -0.03 0.00 1.34 0.00 0.00 72.50 72.85 3k8l s THR 667 CO 0.19 0.30 -0.05 -1.10 -0.54 0.00 0.00 174.62 173.42 3k8l s GLN 668 N 0.70 0.63 0.07 3.99 -0.21 -0.17 -2.63 119.66 122.05 3k8l s GLN 668 Ca -0.13 -1.07 0.09 0.00 0.02 0.00 0.00 55.36 54.27 3k8l s GLN 668 Cb -0.15 -0.06 -0.03 0.00 1.00 0.00 0.00 33.01 33.77 3k8l s GLN 668 CO 0.02 -0.03 -0.25 -1.14 -2.12 0.00 0.00 175.29 171.77 3k8l s GLN 669 N -3.03 1.58 -0.08 2.91 0.74 0.26 0.26 119.66 122.30 3k8l s GLN 669 Ca 0.02 -1.17 -0.02 0.00 0.05 0.00 0.00 55.36 54.24 3k8l s GLN 669 Cb 0.01 -1.85 0.03 0.00 1.10 0.00 0.00 33.01 32.30 3k8l s GLN 669 CO -0.05 0.46 0.03 1.21 -0.55 0.00 0.00 175.29 176.40 3k8l s ASN 670 N -1.53 1.67 -0.06 6.67 2.47 -0.25 -0.81 114.94 123.10 3k8l s ASN 670 Ca 0.12 -0.16 0.03 0.00 0.42 0.00 0.00 52.86 53.26 3k8l s ASN 670 Cb -0.10 -0.36 0.01 0.00 -1.45 0.00 0.00 41.25 39.35 3k8l s ASN 670 CO 0.03 -0.23 -0.14 0.42 -3.72 0.00 0.00 177.10 173.46 3k8l s THR 671 N 2.03 1.26 -0.35 -5.21 -4.23 -1.26 -1.13 115.64 106.76 3k8l s THR 671 Ca 0.04 -0.58 -0.02 0.00 -1.18 0.00 0.00 61.69 59.95 3k8l s THR 671 Cb -0.13 -1.12 0.08 0.00 1.34 0.00 0.00 72.50 72.66 3k8l s THR 671 CO -0.05 0.38 0.08 -0.62 -0.54 0.00 0.00 174.62 173.87 3k8l s ASP 674 N 0.42 5.03 0.00 3.99 2.15 -1.26 -4.81 116.67 122.19 3k8l s ASP 674 Ca -0.11 -1.62 0.00 0.00 0.43 0.00 0.00 52.55 51.25 3k8l s ASP 674 Cb -0.14 -1.76 0.00 0.00 -0.30 0.00 0.00 42.92 40.72 3k8l s ASP 674 CO 0.03 -0.38 0.00 -1.54 -0.17 0.00 0.00 175.17 173.12 3k8l n SER 675 N 4.59 0.28 -3.86 -0.34 3.41 -1.26 -5.17 113.62 111.27 3k8l n SER 675 Ca -0.08 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.34 3k8l n SER 675 Cb 0.43 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.21 3k8l n SER 675 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3k8l s TYR 676 N -0.41 0.61 -0.08 7.33 5.04 -1.26 -4.96 117.35 123.62 3k8l s TYR 676 Ca 0.00 -0.14 -0.00 0.00 -2.44 0.00 0.00 57.07 54.49 3k8l s TYR 676 Cb 0.00 -0.60 0.02 0.00 0.35 0.00 0.00 41.96 41.73 3k8l s TYR 676 CO 0.00 -0.19 -0.04 0.99 -1.34 0.00 0.00 175.55 174.97 3k8l s THR 677 N 1.06 0.66 -0.15 4.34 2.01 -0.28 -0.79 115.64 122.49 3k8l s THR 677 Ca -0.09 -0.10 -0.11 0.00 0.31 0.00 0.00 61.69 61.69 3k8l s THR 677 Cb -0.14 -0.73 -0.05 0.00 0.01 0.00 0.00 72.50 71.60 3k8l s THR 677 CO -0.01 0.29 0.23 -0.22 -0.69 0.00 0.00 174.62 174.22 3k8l s LEU 678 N 1.53 4.28 -0.43 4.42 0.20 0.23 -1.10 118.68 127.81 3k8l s LEU 678 Ca -0.01 0.46 -0.07 0.00 0.69 0.00 0.00 54.13 55.21 3k8l s LEU 678 Cb -0.13 -2.25 0.10 0.00 -0.43 0.00 0.00 46.19 43.48 3k8l s LEU 678 CO -0.04 0.20 0.27 -0.75 -0.29 0.00 0.00 176.35 175.74 3k8l s LYS 679 N -0.00 2.35 -0.42 1.98 2.20 0.14 0.05 119.74 126.03 3k8l s LYS 679 Ca 0.14 -1.70 -0.16 0.00 -0.36 0.00 0.00 55.97 53.90 3k8l s LYS 679 Cb -0.13 -3.75 0.03 0.00 -1.51 0.00 0.00 37.83 32.47 3k8l s LYS 679 CO 0.03 -1.08 0.38 -0.51 -0.36 0.00 0.00 175.35 173.81 3k8l s LEU 680 N 1.30 5.06 1.20 5.43 1.43 0.06 -1.00 118.68 132.15 3k8l s LEU 680 Ca 0.05 -0.85 -0.15 0.00 -1.03 0.00 0.00 54.13 52.15 3k8l s LEU 680 Cb -0.24 -2.27 0.26 0.00 0.03 0.00 0.00 46.19 43.97 3k8l s LEU 680 CO -0.01 -0.54 0.72 0.61 0.23 0.00 0.00 176.35 177.35 3k8l n GLY 681 N 5.14 -2.35 3.75 -3.19 0.00 0.21 -1.52 105.19 107.23 3k8l n GLY 681 Ca -0.09 -1.12 -0.41 0.00 0.00 0.00 0.00 46.02 44.39 3k8l n GLY 681 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3k8l s GLY 682 N -2.25 2.34 -1.49 -0.02 0.00 -1.26 -2.10 107.32 102.55 3k8l s GLY 682 Ca 0.65 1.41 0.00 0.00 0.00 0.00 0.00 44.72 46.78 3k8l s GLY 682 CO 0.65 2.33 0.00 -1.72 0.00 0.00 0.00 173.10 174.36 3k8l n TYR 683 N 2.09 0.00 -2.38 1.90 0.53 0.29 -4.85 117.16 114.74 3k8l n TYR 683 Ca 0.06 0.00 -0.27 0.00 -1.02 0.00 0.00 57.90 56.67 3k8l n TYR 683 Cb 0.39 -2.94 0.02 0.00 -1.03 0.00 0.00 39.34 35.79 3k8l n TYR 683 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 3k8l s ALA 684 N -2.22 3.28 0.03 -0.72 0.00 -0.89 -4.62 121.76 116.61 3k8l s ALA 684 Ca 0.00 -0.57 -0.07 0.00 0.00 0.00 0.00 51.96 51.32 3k8l s ALA 684 Cb 0.00 -2.67 -0.00 0.00 0.00 0.00 0.00 23.12 20.45 3k8l s ALA 684 CO 0.00 -0.70 0.14 -1.12 0.00 0.00 0.00 175.76 174.08 3k8l s SER 685 N -4.25 0.09 -0.05 0.00 0.01 -0.17 -1.44 113.70 107.89 3k8l s SER 685 Ca 0.53 -0.38 -0.09 0.00 1.31 0.00 0.00 55.95 57.31 3k8l s SER 685 Cb -0.11 0.24 0.02 0.00 0.21 0.00 0.00 66.02 66.38 3k8l s SER 685 CO 0.46 -0.47 0.23 -0.69 0.41 0.00 0.00 173.24 173.18 3k8l s VAL 686 N -2.18 0.03 -0.20 3.43 1.01 -0.25 -1.01 120.40 121.23 3k8l s VAL 686 Ca -0.08 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.64 3k8l s VAL 686 Cb -0.03 -0.42 0.05 0.00 0.00 0.00 0.00 36.38 35.97 3k8l s VAL 686 CO -0.02 -0.15 -0.08 -0.69 0.00 0.00 0.00 175.10 174.17 3k8l s VAL 687 N -0.53 1.48 -0.06 2.92 1.01 -0.34 -1.28 120.40 123.61 3k8l s VAL 687 Ca -0.06 -0.99 -0.03 0.00 0.00 0.00 0.00 61.98 60.90 3k8l s VAL 687 Cb -0.04 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 3k8l s VAL 687 CO 0.01 0.08 0.08 -0.36 0.00 0.00 0.00 175.10 174.91 3k8l s PHE 688 N 1.45 3.34 -0.27 5.22 0.40 0.46 -1.08 117.98 127.49 3k8l s PHE 688 Ca -0.02 0.29 -0.14 0.00 -0.60 0.00 0.00 56.93 56.46 3k8l s PHE 688 Cb -0.17 -1.81 -0.04 0.00 0.51 0.00 0.00 43.02 41.51 3k8l s PHE 688 CO -0.07 0.58 0.32 0.21 0.70 0.00 0.00 175.22 176.95 3k8l s LYS 689 N -1.30 3.99 0.37 0.44 2.20 -0.36 -0.05 119.74 125.02 3k8l s LYS 689 Ca 0.18 -0.07 -0.09 0.00 -0.36 0.00 0.00 55.97 55.63 3k8l s LYS 689 Cb -0.12 -3.66 -0.06 0.00 -1.51 0.00 0.00 37.83 32.48 3k8l s LYS 689 CO 0.08 -0.25 0.71 -0.51 -0.36 0.00 0.00 175.35 175.01 3k8l s LEU 690 N 1.98 3.91 0.00 5.43 1.43 -0.52 -1.41 118.68 129.49 3k8l s LEU 690 Ca 0.13 1.02 0.30 0.00 -1.03 0.00 0.00 54.13 54.55 3k8l s LEU 690 Cb -0.16 -3.88 1.50 0.00 0.03 0.00 0.00 46.19 43.68 3k8l s LEU 690 CO 0.10 -0.33 2.00 0.61 0.23 0.00 0.00 176.35 178.96