#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 3.72 0.47 -0.99 2.01 0.25 -4.87 115.64 116.23 3k8l s THR 45 Ca 0.00 -0.85 -0.22 0.00 0.31 0.00 0.00 61.69 60.93 3k8l s THR 45 Cb 0.00 -2.66 -0.07 0.00 0.01 0.00 0.00 72.50 69.78 3k8l s THR 45 CO 0.00 0.32 1.12 0.00 -0.69 0.00 0.00 174.62 175.37 3k8l s ALA 46 N -1.08 2.92 0.22 7.40 0.00 -1.26 0.33 121.76 130.30 3k8l s ALA 46 Ca 0.19 0.84 -0.14 0.00 0.00 0.00 0.00 51.96 52.85 3k8l s ALA 46 Cb -0.11 -3.35 -0.08 0.00 0.00 0.00 0.00 23.12 19.59 3k8l s ALA 46 CO 0.10 -0.57 0.61 -0.51 0.00 0.00 0.00 175.76 175.39 3k8l s LEU 47 N -3.17 4.23 -0.12 0.00 1.43 -1.00 -4.82 118.68 115.22 3k8l s LEU 47 Ca 0.65 1.11 0.03 0.00 -1.03 0.00 0.00 54.13 54.89 3k8l s LEU 47 Cb -0.25 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.36 3k8l s LEU 47 CO 0.30 -0.03 -0.20 -0.89 0.23 0.00 0.00 176.35 175.76 3k8l s THR 48 N -1.70 1.85 0.02 5.49 2.01 -1.26 -5.01 115.64 117.04 3k8l s THR 48 Ca 0.45 -0.87 -0.23 0.00 0.31 0.00 0.00 61.69 61.36 3k8l s THR 48 Cb -0.13 -1.64 -0.05 0.00 0.01 0.00 0.00 72.50 70.69 3k8l s THR 48 CO 0.20 0.51 0.68 0.00 -0.69 0.00 0.00 174.62 175.32 3k8l s ALA 49 N 0.74 3.43 -0.39 7.40 0.00 -1.26 -4.52 121.76 127.16 3k8l s ALA 49 Ca -0.10 0.15 0.09 0.00 0.00 0.00 0.00 51.96 52.10 3k8l s ALA 49 Cb -0.16 -2.87 0.28 0.00 0.00 0.00 0.00 23.12 20.37 3k8l s ALA 49 CO 0.01 0.11 0.59 -1.13 0.00 0.00 0.00 175.76 175.34 3k8l n SER 50 N 2.78 0.25 -4.80 0.00 3.41 0.12 -4.98 113.62 110.39 3k8l n SER 50 Ca -0.05 -2.79 -0.32 0.00 -0.26 0.00 0.00 58.87 55.45 3k8l n SER 50 Cb 0.51 -0.56 0.03 0.00 -0.26 0.00 0.00 64.21 63.93 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 -1.44 3.05 0.70 4.33 0.04 -1.26 -4.83 135.00 135.60 3k8l s PRO 51 Ca 0.36 1.15 -0.15 0.00 0.04 0.00 0.00 61.00 62.40 3k8l s PRO 51 Cb 0.22 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.78 3k8l s PRO 51 CO -0.11 -1.02 1.16 -0.51 0.04 0.00 0.00 177.00 176.57 3k8l s ASP 52 N -3.11 4.58 0.26 6.66 1.01 -1.26 -4.94 116.67 119.88 3k8l s ASP 52 Ca 0.62 2.19 -0.30 0.00 0.71 0.00 0.00 52.55 55.78 3k8l s ASP 52 Cb -0.16 -2.57 -0.10 0.00 1.01 0.00 0.00 42.92 41.10 3k8l s ASP 52 CO 0.44 -1.99 1.31 -0.89 0.21 0.00 0.00 175.17 174.25 3k8l s THR 53 N -2.15 2.96 -0.12 -1.27 2.01 -1.26 -4.96 115.64 110.85 3k8l s THR 53 Ca 0.71 0.86 -0.29 0.00 0.31 0.00 0.00 61.69 63.28 3k8l s THR 53 Cb -0.25 -3.55 -0.02 0.00 0.01 0.00 0.00 72.50 68.69 3k8l s THR 53 CO 0.44 0.17 1.16 0.86 -0.69 0.00 0.00 174.62 176.55 3k8l s TRP 54 N -0.49 3.17 -2.00 4.92 -0.00 -1.26 -4.89 118.94 118.39 3k8l s TRP 54 Ca 0.53 1.26 0.15 0.00 -0.00 0.00 0.00 56.10 58.05 3k8l s TRP 54 Cb -0.38 -3.38 0.92 0.00 -0.00 0.00 0.00 33.47 30.63 3k8l s TRP 54 CO 0.45 -1.10 1.42 -0.40 -0.00 0.00 0.00 176.95 177.32 3k8l n ASP 55 N 5.74 0.00 -0.32 5.86 5.68 -1.26 -4.84 116.55 127.40 3k8l n ASP 55 Ca 0.12 -1.02 -0.04 0.00 -0.50 0.00 0.00 54.79 53.35 3k8l n ASP 55 Cb 0.46 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.43 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 -0.82 -0.27 -3.58 0.11 1.02 -1.26 -5.02 120.64 110.82 3k8l n GLU 56 Ca 0.12 0.49 -0.40 0.00 -0.02 0.00 0.00 57.16 57.35 3k8l n GLU 56 Cb 0.05 -4.17 -0.11 0.00 -0.02 0.00 0.00 31.44 27.20 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 -2.15 4.99 -1.10 2.62 2.01 -1.26 -5.00 115.64 115.74 3k8l s THR 57 Ca 0.00 -0.32 -0.23 0.00 0.31 0.00 0.00 61.69 61.45 3k8l s THR 57 Cb 0.00 -3.57 -0.06 0.00 0.01 0.00 0.00 72.50 68.89 3k8l s THR 57 CO 0.00 0.01 1.90 -0.54 -0.69 0.00 0.00 174.62 175.30 3k8l s LYS 58 N 1.67 2.68 0.27 4.92 1.02 -1.26 -4.69 119.74 124.36 3k8l s LYS 58 Ca 0.05 -0.97 0.06 0.00 0.02 0.00 0.00 55.97 55.13 3k8l s LYS 58 Cb -0.17 -5.22 0.38 0.00 -0.52 0.00 0.00 37.83 32.30 3k8l s LYS 58 CO 0.09 -3.60 1.65 0.00 -0.92 0.00 0.00 175.35 172.57 3k8l h ARG 59 N 10.02 0.21 -7.33 1.68 3.08 -1.85 -3.45 114.38 116.73 3k8l h ARG 59 Ca 0.20 -0.12 -0.48 0.00 0.07 0.00 0.00 59.98 59.65 3k8l h ARG 59 Cb 0.96 0.01 0.07 0.00 0.08 0.00 0.00 29.97 31.08 3k8l h ARG 59 CO 1.25 0.66 0.32 0.00 -1.07 0.00 0.00 179.97 181.12 3k8l s ALA 60 N -3.96 3.06 -0.79 0.04 0.00 -1.26 -4.76 121.76 114.09 3k8l s ALA 60 Ca -0.04 -0.50 0.01 0.00 0.00 0.00 0.00 51.96 51.44 3k8l s ALA 60 Cb 0.13 -2.85 0.19 0.00 0.00 0.00 0.00 23.12 20.59 3k8l s ALA 60 CO 0.78 -1.01 0.62 0.34 0.00 0.00 0.00 175.76 176.49 3k8l s ASP 61 N -4.34 5.39 -0.21 0.00 2.15 -1.26 -4.81 116.67 113.59 3k8l s ASP 61 Ca 0.56 -3.74 -0.09 0.00 0.43 0.00 0.00 52.55 49.71 3k8l s ASP 61 Cb -0.11 -1.78 -0.05 0.00 -0.30 0.00 0.00 42.92 40.69 3k8l s ASP 61 CO 0.49 -0.14 0.12 -0.63 -0.17 0.00 0.00 175.17 174.83 3k8l s ILE 62 N -1.33 5.17 0.16 4.11 1.01 -1.26 -3.55 121.20 125.51 3k8l s ILE 62 Ca 0.26 0.11 0.08 0.00 0.00 0.00 0.00 60.65 61.10 3k8l s ILE 62 Cb -0.07 -3.37 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 3k8l s ILE 62 CO -0.14 0.41 -0.10 -0.44 0.00 0.00 0.00 174.94 174.67 3k8l s SER 63 N 0.67 4.27 -0.15 3.58 0.01 -0.13 -0.63 113.70 121.32 3k8l s SER 63 Ca 0.06 -0.54 0.01 0.00 1.31 0.00 0.00 55.95 56.79 3k8l s SER 63 Cb -0.12 -0.74 0.02 0.00 0.21 0.00 0.00 66.02 65.39 3k8l s SER 63 CO 0.01 0.12 -0.16 -0.47 0.41 0.00 0.00 173.24 173.16 3k8l s TYR 64 N -1.57 2.29 -0.18 2.43 5.04 -0.21 0.07 117.35 125.21 3k8l s TYR 64 Ca 0.24 -1.29 -0.15 0.00 -2.44 0.00 0.00 57.07 53.43 3k8l s TYR 64 Cb -0.09 -1.65 -0.04 0.00 0.35 0.00 0.00 41.96 40.52 3k8l s TYR 64 CO 0.15 -0.68 0.34 -1.14 -1.34 0.00 0.00 175.55 172.87 3k8l s GLN 65 N 1.39 4.21 0.10 4.97 0.74 0.64 -1.00 119.66 130.72 3k8l s GLN 65 Ca 0.04 0.13 0.03 0.00 0.05 0.00 0.00 55.36 55.61 3k8l s GLN 65 Cb -0.13 -3.48 -0.04 0.00 1.10 0.00 0.00 33.01 30.46 3k8l s GLN 65 CO -0.10 0.10 -0.09 -0.48 -0.55 0.00 0.00 175.29 174.16 3k8l s LEU 66 N 0.89 2.44 -0.32 3.68 0.05 -0.89 -0.70 118.68 123.82 3k8l s LEU 66 Ca 0.17 -0.87 -0.07 0.00 0.05 0.00 0.00 54.13 53.41 3k8l s LEU 66 Cb -0.14 -0.27 0.02 0.00 -2.05 0.00 0.00 46.19 43.76 3k8l s LEU 66 CO 0.06 -0.31 0.11 -0.76 -0.55 0.00 0.00 176.35 174.90 3k8l s LEU 67 N -2.65 4.14 0.35 1.48 1.02 -1.26 -2.76 118.68 118.99 3k8l s LEU 67 Ca 0.08 -0.90 0.13 0.00 0.02 0.00 0.00 54.13 53.46 3k8l s LEU 67 Cb -0.01 -1.90 0.96 0.00 0.02 0.00 0.00 46.19 45.27 3k8l s LEU 67 CO -0.01 -0.27 1.74 -0.07 0.02 0.00 0.00 176.35 177.77 3k8l h LEU 68 N 8.26 0.60 -0.92 1.79 3.38 -1.95 0.26 115.31 126.73 3k8l h LEU 68 Ca -0.28 0.12 -0.09 0.00 0.09 0.00 0.00 57.88 57.72 3k8l h LEU 68 Cb 1.11 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 3k8l h LEU 68 CO 0.61 0.10 -0.44 0.10 0.09 0.00 0.00 178.44 178.90 3k8l h TYR 69 N 0.52 0.00 -0.06 1.13 -0.00 -1.91 -3.12 116.97 113.52 3k8l h TYR 69 Ca 0.63 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.36 3k8l h TYR 69 Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.06 3k8l h TYR 69 CO -0.00 0.44 0.00 -1.13 -0.00 0.00 0.00 178.16 177.46 3k8l n SER 70 N -3.64 1.90 0.00 0.10 3.41 -0.27 -1.21 113.62 113.91 3k8l n SER 70 Ca -0.01 -1.48 0.00 0.00 -0.26 0.00 0.00 58.87 57.13 3k8l n SER 70 Cb 0.53 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 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 0.44 0.00 -3.72 7.33 7.35 -0.08 -1.99 117.46 126.79 3k8l n PHE 71 Ca 0.06 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.62 3k8l n PHE 71 Cb 0.25 -0.37 -0.13 0.00 0.35 0.00 0.00 39.48 39.57 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 -3.15 -0.54 -0.24 3.13 0.00 -1.26 -4.31 121.76 115.38 3k8l s ALA 72 Ca 0.00 0.98 -0.12 0.00 0.00 0.00 0.00 51.96 52.81 3k8l s ALA 72 Cb 0.00 -0.67 -0.05 0.00 0.00 0.00 0.00 23.12 22.41 3k8l s ALA 72 CO 0.00 -0.24 0.23 0.34 0.00 0.00 0.00 175.76 176.09 3k8l s ASP 73 N 1.38 6.18 -0.01 0.00 2.15 0.56 -1.57 116.67 125.36 3k8l s ASP 73 Ca -0.08 0.20 0.17 0.00 0.43 0.00 0.00 52.55 53.27 3k8l s ASP 73 Cb -0.11 -2.14 -0.23 0.00 -0.30 0.00 0.00 42.92 40.14 3k8l s ASP 73 CO -0.08 -0.01 0.55 -1.54 -0.17 0.00 0.00 175.17 173.92 3k8l n SER 74 N 4.54 0.89 -0.32 -0.34 3.41 -1.26 -4.22 113.62 116.32 3k8l n SER 74 Ca -0.13 -0.43 0.09 0.00 -0.26 0.00 0.00 58.87 58.14 3k8l n SER 74 Cb 0.52 1.43 0.17 0.00 -0.26 0.00 0.00 64.21 66.06 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 -1.78 2.54 -1.26 4.04 5.68 -1.26 -5.02 116.55 119.49 3k8l n ASP 75 Ca -0.00 -3.21 -0.16 0.00 -0.50 0.00 0.00 54.79 50.92 3k8l n ASP 75 Cb 0.37 -0.47 -0.07 0.00 -1.14 0.00 0.00 41.12 39.81 3k8l n ASP 75 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3k8l n GLY 76 N -1.23 1.63 0.85 6.12 0.00 -1.26 -4.86 105.19 106.44 3k8l n GLY 76 Ca 0.18 -0.17 0.11 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.83 2.53 0.00 1.61 5.68 -1.26 -4.93 116.55 119.35 3k8l n ASP 77 Ca -0.16 -1.86 0.00 0.00 -0.50 0.00 0.00 54.79 52.26 3k8l n ASP 77 Cb 0.57 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 40.37 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 1.31 0.86 3.34 6.12 0.00 -1.26 -4.96 105.19 110.59 3k8l n GLY 78 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.48 2.82 0.88 1.61 5.04 -1.26 0.44 117.35 123.39 3k8l s TYR 79 Ca 0.00 -0.77 -0.13 0.00 -2.44 0.00 0.00 57.07 53.73 3k8l s TYR 79 Cb 0.00 -1.88 0.04 0.00 0.35 0.00 0.00 41.96 40.47 3k8l s TYR 79 CO 0.00 -0.31 0.60 0.41 -1.34 0.00 0.00 175.55 174.91 3k8l n GLY 80 N 3.77 -1.51 3.71 8.97 0.00 -0.35 -4.53 105.19 115.26 3k8l n GLY 80 Ca -0.18 -0.64 -0.08 0.00 0.00 0.00 0.00 46.02 45.12 3k8l n GLY 80 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3k8l s ASP 81 N -1.97 -0.14 0.15 1.61 -4.77 -0.61 -4.57 116.67 106.37 3k8l s ASP 81 Ca 0.62 -0.81 -0.17 0.00 -3.30 0.00 0.00 52.55 48.89 3k8l s ASP 81 Cb -0.25 0.66 -0.00 0.00 -1.09 0.00 0.00 42.92 42.24 3k8l s ASP 81 CO 0.62 -1.25 1.79 -0.07 0.70 0.00 0.00 175.17 176.96 3k8l h LEU 82 N 2.13 0.44 -2.26 2.11 3.38 -1.02 -2.11 115.31 117.99 3k8l h LEU 82 Ca -0.23 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 57.71 3k8l h LEU 82 Cb 1.25 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 3k8l h LEU 82 CO 0.30 0.35 0.04 0.78 0.09 0.00 0.00 178.44 180.00 3k8l h ASN 83 N 0.50 0.00 -0.51 -0.43 2.35 -1.86 0.15 115.58 115.78 3k8l h ASN 83 Ca 0.14 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.79 3k8l h ASN 83 Cb -0.02 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 3k8l h ASN 83 CO -0.03 0.00 -0.07 1.23 -1.65 0.00 0.00 177.43 176.92 3k8l h GLY 84 N 0.00 1.02 0.78 2.83 0.00 -1.54 0.05 103.07 106.21 3k8l h GLY 84 Ca 0.02 -0.80 -0.00 0.00 0.00 0.00 0.00 47.33 46.55 3k8l h GLY 84 CO -0.00 0.73 -0.01 -2.08 0.00 0.00 0.00 176.54 175.18 3k8l h VAL 85 N 0.81 1.13 -0.52 4.60 2.07 -0.84 -2.81 116.25 120.70 3k8l h VAL 85 Ca 0.14 -0.50 0.07 0.00 0.82 0.00 0.00 66.70 67.23 3k8l h VAL 85 Cb 0.61 1.47 -0.06 0.00 -1.52 0.00 0.00 31.29 31.79 3k8l h VAL 85 CO 0.04 0.13 0.17 0.74 0.02 0.00 0.00 177.57 178.67 3k8l h THR 86 N -0.26 0.80 0.00 2.57 2.02 -1.14 -0.08 112.91 116.83 3k8l h THR 86 Ca -0.00 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.06 3k8l h THR 86 Cb 0.24 0.43 0.00 0.00 -1.74 0.00 0.00 68.15 67.08 3k8l h THR 86 CO 0.01 0.06 0.00 0.00 0.37 0.00 0.00 175.52 175.96 3k8l n GLN 87 N -5.02 0.59 -0.05 6.66 6.02 -0.01 -2.18 117.38 123.39 3k8l n GLN 87 Ca 0.06 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 57.07 3k8l n GLN 87 Cb 0.22 -1.35 0.03 0.00 1.02 0.00 0.00 30.24 30.16 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 -0.85 1.99 0.04 -1.09 4.76 -0.08 -4.76 118.16 118.16 3k8l n LYS 88 Ca 0.10 -1.57 0.03 0.00 -2.87 0.00 0.00 58.31 54.00 3k8l n LYS 88 Cb 0.05 -1.01 0.41 0.00 -1.84 0.00 0.00 35.03 32.63 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 0.00 0.40 -0.75 -0.35 3.38 -0.98 -2.09 115.31 114.91 3k8l h LEU 89 Ca 0.00 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 3k8l h LEU 89 Cb 0.74 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3k8l h LEU 89 CO 0.00 0.37 -0.32 0.44 0.09 0.00 0.00 178.44 179.02 3k8l h ASP 90 N 0.45 0.61 -0.35 -0.43 3.32 -1.86 0.22 116.42 118.38 3k8l h ASP 90 Ca 0.11 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 3k8l h ASP 90 Cb 0.09 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3k8l h ASP 90 CO -0.01 0.89 0.18 0.22 -1.72 0.00 0.00 179.24 178.80 3k8l h TYR 91 N 0.50 0.50 0.00 4.55 3.20 -1.75 -2.10 116.97 121.87 3k8l h TYR 91 Ca 0.06 -0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.83 3k8l h TYR 91 Cb 0.80 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 3k8l h TYR 91 CO 0.03 0.42 -0.39 -0.07 -1.64 0.00 0.00 178.16 176.51 3k8l h LEU 92 N 0.44 0.00 -1.14 2.82 3.38 -1.07 -2.25 115.31 117.48 3k8l h LEU 92 Ca 0.12 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.01 3k8l h LEU 92 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3k8l h LEU 92 CO -0.02 0.39 -0.39 -1.13 0.09 0.00 0.00 178.44 177.39 3k8l h ASN 93 N 0.00 0.00 0.21 -0.43 -0.00 -0.13 -2.41 115.58 112.82 3k8l h ASN 93 Ca -0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 56.30 56.26 3k8l h ASN 93 Cb 0.72 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 39.03 3k8l h ASN 93 CO 0.05 0.39 -0.19 1.56 -0.00 0.00 0.00 177.43 179.23 3k8l h GLN 94 N 0.00 0.00 0.00 6.67 4.20 -0.76 -1.00 115.11 124.21 3k8l h GLN 94 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3k8l h GLN 94 Cb 0.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.56 3k8l h GLN 94 CO 0.05 0.19 0.00 1.28 -0.67 0.00 0.00 178.83 179.68 3k8l n LEU 95 N -4.25 0.00 -1.42 1.46 4.77 -0.91 -4.86 117.00 111.79 3k8l n LEU 95 Ca -0.02 0.14 -0.16 0.00 -0.03 0.00 0.00 56.01 55.94 3k8l n LEU 95 Cb 0.26 -0.14 -0.05 0.00 -2.33 0.00 0.00 43.42 41.15 3k8l n LEU 95 CO 0.36 -0.01 -0.17 0.61 -1.33 0.00 0.00 177.39 176.85 3k8l n GLY 96 N 1.05 1.01 3.77 -0.72 0.00 -0.38 -4.76 105.19 105.17 3k8l n GLY 96 Ca 0.18 -0.24 -0.37 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.66 3.23 -1.65 1.61 -7.23 -1.25 -4.71 120.40 107.74 3k8l s VAL 97 Ca 0.00 0.94 0.17 0.00 -1.81 0.00 0.00 61.98 61.28 3k8l s VAL 97 Cb 0.00 -3.48 0.02 0.00 0.56 0.00 0.00 36.38 33.47 3k8l s VAL 97 CO 0.00 0.00 0.91 1.17 -0.31 0.00 0.00 175.10 176.87 3k8l n LYS 98 N -0.34 1.60 -3.54 4.82 4.81 0.20 -4.77 118.16 120.94 3k8l n LYS 98 Ca 0.06 -0.95 -0.16 0.00 -0.87 0.00 0.00 58.31 56.39 3k8l n LYS 98 Cb 0.48 -1.31 -0.06 0.00 0.02 0.00 0.00 35.03 34.17 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 -1.88 -1.82 -0.13 3.14 0.00 -1.21 -1.24 121.76 118.62 3k8l s ALA 99 Ca 0.15 1.41 0.02 0.00 0.00 0.00 0.00 51.96 53.54 3k8l s ALA 99 Cb 0.14 -0.24 -0.00 0.00 0.00 0.00 0.00 23.12 23.02 3k8l s ALA 99 CO 0.39 -0.35 -0.19 -0.51 0.00 0.00 0.00 175.76 175.10 3k8l s LEU 100 N -1.12 2.35 -0.29 0.00 1.02 -0.05 -1.05 118.68 119.55 3k8l s LEU 100 Ca -0.08 -0.48 -0.08 0.00 0.02 0.00 0.00 54.13 53.50 3k8l s LEU 100 Cb -0.00 -1.51 -0.01 0.00 0.02 0.00 0.00 46.19 44.69 3k8l s LEU 100 CO 0.07 0.13 0.11 0.86 0.02 0.00 0.00 176.35 177.54 3k8l s TRP 101 N 0.55 3.14 0.14 0.29 -0.00 -0.17 -0.28 118.94 122.60 3k8l s TRP 101 Ca -0.11 -0.61 -0.05 0.00 -0.00 0.00 0.00 56.10 55.32 3k8l s TRP 101 Cb -0.16 -2.29 -0.06 0.00 -0.00 0.00 0.00 33.47 30.96 3k8l s TRP 101 CO 0.04 -0.45 0.38 -0.51 -0.00 0.00 0.00 176.95 176.41 3k8l s LEU 102 N 1.59 4.27 0.97 5.86 1.43 -0.59 -2.11 118.68 130.10 3k8l s LEU 102 Ca 0.05 0.61 -0.12 0.00 -1.03 0.00 0.00 54.13 53.64 3k8l s LEU 102 Cb -0.16 -3.30 0.17 0.00 0.03 0.00 0.00 46.19 42.93 3k8l s LEU 102 CO 0.04 0.06 1.09 -0.94 0.23 0.00 0.00 176.35 176.83 3k8l s SER 103 N -2.38 2.81 -0.29 2.29 1.04 -1.11 -2.93 113.70 113.12 3k8l s SER 103 Ca 0.41 1.39 -0.40 0.00 0.48 0.00 0.00 55.95 57.82 3k8l s SER 103 Cb -0.12 -2.07 -0.16 0.00 0.10 0.00 0.00 66.02 63.78 3k8l s SER 103 CO 0.24 -3.04 1.75 -2.65 0.98 0.00 0.00 173.24 170.52 3k8l n PRO 104 N -4.14 1.12 0.00 4.02 -0.02 -1.26 -4.55 135.00 130.17 3k8l n PRO 104 Ca 0.06 0.41 0.13 0.00 -2.02 0.00 0.00 63.50 62.08 3k8l n PRO 104 Cb 0.56 -2.09 0.37 0.00 -0.02 0.00 0.00 33.50 32.31 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 4.64 0.00 -2.69 4.25 3.06 -1.26 -4.73 119.36 122.62 3k8l n ILE 105 Ca 0.27 -0.33 -0.25 0.00 -2.50 0.00 0.00 62.75 59.94 3k8l n ILE 105 Cb 0.12 0.85 0.02 0.00 0.54 0.00 0.00 39.64 41.17 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 -2.02 3.30 0.33 9.51 0.09 -1.26 -0.00 115.29 125.24 3k8l s HIS 106 Ca 0.34 0.50 -0.29 0.00 -0.00 0.00 0.00 55.06 55.61 3k8l s HIS 106 Cb 0.21 -2.47 -0.12 0.00 -0.00 0.00 0.00 32.58 30.19 3k8l s HIS 106 CO 0.33 -0.52 1.47 -2.30 -0.00 0.00 0.00 174.74 173.72 3k8l n PRO 107 N -2.31 2.51 -1.17 8.40 -0.02 -1.26 -4.24 135.00 136.91 3k8l n PRO 107 Ca 0.02 0.88 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 3k8l n PRO 107 Cb 0.57 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 3k8l n PRO 107 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k8l n MET 109 N 0.00 0.91 -4.25 0.00 2.81 -0.95 -4.86 117.12 110.78 3k8l n MET 109 Ca 0.00 0.06 -0.23 0.00 -1.81 0.00 0.00 57.70 55.72 3k8l n MET 109 Cb 0.00 -1.38 -0.07 0.00 -0.71 0.00 0.00 33.22 31.06 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 -5.44 4.46 0.33 7.83 0.01 -1.26 -5.04 113.70 114.59 3k8l s SER 110 Ca -0.18 -0.79 0.01 0.00 1.31 0.00 0.00 55.95 56.30 3k8l s SER 110 Cb 0.06 -0.71 0.56 0.00 0.21 0.00 0.00 66.02 66.14 3k8l s SER 110 CO 0.51 -0.15 1.99 0.10 0.41 0.00 0.00 173.24 176.09 3k8l h TYR 111 N 1.77 0.88 0.00 2.43 -0.00 -2.01 -2.34 116.97 117.70 3k8l h TYR 111 Ca -0.44 0.02 0.00 0.00 0.00 0.00 0.00 58.73 58.31 3k8l h TYR 111 Cb 1.25 -0.30 0.00 0.00 0.00 0.00 0.00 36.73 37.69 3k8l h TYR 111 CO 0.67 0.56 0.00 -2.39 -0.00 0.00 0.00 178.16 177.01 3k8l n HIS 112 N -4.42 0.56 -0.93 0.10 1.44 -1.26 -4.90 115.22 105.82 3k8l n HIS 112 Ca 0.07 0.23 0.00 0.00 -2.01 0.00 0.00 57.72 56.02 3k8l n HIS 112 Cb 0.04 -0.88 0.00 0.00 0.12 0.00 0.00 29.99 29.28 3k8l n HIS 112 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3k8l n GLY 113 N -0.28 0.81 0.00 -1.39 0.00 -0.88 -4.47 105.19 98.99 3k8l n GLY 113 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.13 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 -2.07 0.00 -3.41 1.61 4.01 -1.26 -4.01 117.16 112.03 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 0.01 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 38.96 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 -0.81 3.36 -4.77 7.72 3.85 -1.26 -4.75 116.55 119.88 3k8l n ASP 115 Ca 0.14 -3.36 -0.38 0.00 -0.71 0.00 0.00 54.79 50.49 3k8l n ASP 115 Cb 0.06 -0.67 -0.02 0.00 -1.35 0.00 0.00 41.12 39.15 3k8l n ASP 115 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3k8l s VAL 116 N -2.30 3.15 -0.58 2.12 0.11 -1.26 -2.24 120.40 119.40 3k8l s VAL 116 Ca 0.39 0.92 0.06 0.00 -2.93 0.00 0.00 61.98 60.42 3k8l s VAL 116 Cb 0.14 -3.49 -0.00 0.00 -1.53 0.00 0.00 36.38 31.50 3k8l s VAL 116 CO -0.03 0.04 0.50 0.35 -3.33 0.00 0.00 175.10 172.63 3k8l n THR 117 N -0.16 0.00 -3.15 5.04 -2.24 0.01 -1.49 114.28 112.29 3k8l n THR 117 Ca 0.06 -0.43 0.04 0.00 -2.27 0.00 0.00 64.05 61.44 3k8l n THR 117 Cb 0.47 1.07 -0.01 0.00 -2.10 0.00 0.00 70.33 69.77 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 -1.04 -1.31 0.09 3.42 -1.08 -1.25 -4.31 116.67 111.20 3k8l s ASP 118 Ca 0.05 0.48 0.20 0.00 -0.52 0.00 0.00 52.55 52.76 3k8l s ASP 118 Cb 0.05 1.96 0.81 0.00 -1.46 0.00 0.00 42.92 44.29 3k8l s ASP 118 CO 0.16 -0.24 1.61 -1.22 0.52 0.00 0.00 175.17 176.00 3k8l n TYR 119 N 5.40 0.30 1.06 -5.34 4.02 -1.26 -3.32 117.16 118.02 3k8l n TYR 119 Ca 0.02 0.11 0.12 0.00 -0.01 0.00 0.00 57.90 58.14 3k8l n TYR 119 Cb 0.53 -0.68 0.15 0.00 -0.02 0.00 0.00 39.34 39.32 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 -1.77 0.00 -4.60 -0.72 -2.24 -1.26 -4.86 114.28 98.83 3k8l n THR 120 Ca 0.04 -0.47 -0.28 0.00 -2.27 0.00 0.00 64.05 61.07 3k8l n THR 120 Cb 0.22 1.38 -0.08 0.00 -2.10 0.00 0.00 70.33 69.75 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 -2.00 1.99 -0.16 -0.78 1.02 -1.21 -5.06 119.74 113.54 3k8l s LYS 121 Ca 0.29 -2.22 -0.05 0.00 0.02 0.00 0.00 55.97 54.01 3k8l s LYS 121 Cb 0.20 -1.05 -0.03 0.00 -0.52 0.00 0.00 37.83 36.43 3k8l s LYS 121 CO 0.30 -0.37 0.01 0.08 -0.92 0.00 0.00 175.35 174.46 3k8l s VAL 122 N -3.06 4.35 -0.07 3.17 1.01 -1.26 -4.06 120.40 120.48 3k8l s VAL 122 Ca 0.20 -0.20 -0.34 0.00 0.00 0.00 0.00 61.98 61.64 3k8l s VAL 122 Cb 0.04 -2.92 -0.12 0.00 0.00 0.00 0.00 36.38 33.37 3k8l s VAL 122 CO 0.11 0.49 1.85 -3.20 0.00 0.00 0.00 175.10 174.35 3k8l n ASN 123 N 3.34 3.38 -0.07 3.32 2.85 1.00 -4.60 115.26 124.49 3k8l n ASN 123 Ca -0.17 0.99 0.14 0.00 -0.11 0.00 0.00 54.58 55.43 3k8l n ASN 123 Cb 0.53 -1.37 0.54 0.00 1.24 0.00 0.00 39.78 40.72 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 8.82 0.30 0.00 1.20 0.11 -1.91 -0.90 132.00 139.62 3k8l h PRO 124 Ca -0.48 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 3k8l h PRO 124 Cb 1.27 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 3k8l h PRO 124 CO 0.94 0.20 -0.01 0.37 -0.21 0.00 0.00 178.00 179.30 3k8l h GLN 125 N 0.31 0.00 -0.01 1.05 4.15 -1.98 -2.80 115.11 115.83 3k8l h GLN 125 Ca 0.28 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.70 3k8l h GLN 125 Cb 0.68 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.37 3k8l h GLN 125 CO -0.07 0.01 -0.59 1.28 -1.93 0.00 0.00 178.83 177.53 3k8l n LEU 126 N -3.10 1.34 0.00 -2.39 4.77 -0.35 -4.84 117.00 112.43 3k8l n LEU 126 Ca 0.00 -0.49 0.00 0.00 -0.03 0.00 0.00 56.01 55.49 3k8l n LEU 126 Cb 0.29 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 3k8l n LEU 126 CO 0.27 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 3k8l n GLY 127 N 1.44 0.99 4.00 -0.72 0.00 -1.06 -0.38 105.19 109.47 3k8l n GLY 127 Ca 0.08 -1.95 -0.19 0.00 0.00 0.00 0.00 46.02 43.96 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 -1.47 2.79 0.33 2.61 -4.23 -1.26 -4.16 115.64 110.24 3k8l s THR 128 Ca 0.00 -0.86 0.01 0.00 -1.18 0.00 0.00 61.69 59.65 3k8l s THR 128 Cb 0.00 -2.92 0.25 0.00 1.34 0.00 0.00 72.50 71.17 3k8l s THR 128 CO 0.00 0.00 1.98 -0.33 -0.54 0.00 0.00 174.62 175.73 3k8l h GLU 129 N 0.36 0.90 -0.10 3.99 4.39 -1.96 -2.22 114.58 119.95 3k8l h GLU 129 Ca -0.40 -0.07 -0.17 0.00 0.34 0.00 0.00 59.36 59.06 3k8l h GLU 129 Cb 1.29 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.73 3k8l h GLU 129 CO 0.47 0.62 -0.66 1.03 -1.16 0.00 0.00 179.01 179.32 3k8l h SER 130 N 0.92 0.46 -0.98 1.42 0.87 -1.99 -2.80 113.55 111.44 3k8l h SER 130 Ca 0.24 -0.28 0.04 0.00 -1.23 0.00 0.00 61.79 60.57 3k8l h SER 130 Cb -0.05 -0.13 -0.06 0.00 -0.44 0.00 0.00 62.40 61.71 3k8l h SER 130 CO -0.05 0.99 0.64 0.44 -0.53 0.00 0.00 176.83 178.33 3k8l h ASP 131 N 0.28 1.07 -0.09 6.23 3.32 -1.78 -0.62 116.42 124.83 3k8l h ASP 131 Ca -0.02 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 3k8l h ASP 131 Cb 1.21 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.51 3k8l h ASP 131 CO 0.11 0.73 0.01 0.15 -1.72 0.00 0.00 179.24 178.52 3k8l h PHE 132 N 1.23 0.16 -0.18 4.55 3.57 -1.36 -2.00 116.94 122.91 3k8l h PHE 132 Ca 0.39 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.89 3k8l h PHE 132 Cb 0.02 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 3k8l h PHE 132 CO -0.00 0.37 0.13 -0.44 -2.23 0.00 0.00 178.31 176.14 3k8l h ASP 133 N -0.11 0.13 0.95 0.41 3.32 -1.18 -0.58 116.42 119.37 3k8l h ASP 133 Ca 0.03 -0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.95 3k8l h ASP 133 Cb 0.31 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 3k8l h ASP 133 CO 0.00 0.09 -0.59 0.03 -1.72 0.00 0.00 179.24 177.05 3k8l h ARG 134 N 0.15 0.00 -0.42 3.56 3.08 -0.89 -2.49 114.38 117.37 3k8l h ARG 134 Ca 0.08 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.97 3k8l h ARG 134 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 3k8l h ARG 134 CO -0.01 0.59 -0.34 1.25 -1.07 0.00 0.00 179.97 180.39 3k8l h LEU 135 N 0.00 1.01 -0.33 3.04 5.85 -0.37 -1.52 115.31 123.00 3k8l h LEU 135 Ca -0.01 -0.44 -0.02 0.00 0.84 0.00 0.00 57.88 58.25 3k8l h LEU 135 Cb 1.23 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.96 3k8l h LEU 135 CO 0.08 1.24 0.12 0.58 -0.34 0.00 0.00 178.44 180.12 3k8l h VAL 136 N 0.80 1.19 -0.13 1.05 2.07 -1.27 0.11 116.25 120.07 3k8l h VAL 136 Ca 0.08 -0.61 -0.00 0.00 0.82 0.00 0.00 66.70 66.98 3k8l h VAL 136 Cb 0.93 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 3k8l h VAL 136 CO 0.09 0.21 0.08 0.74 0.02 0.00 0.00 177.57 178.71 3k8l h THR 137 N 0.37 1.08 0.00 2.57 2.02 -1.36 -0.56 112.91 117.04 3k8l h THR 137 Ca 0.11 -0.20 -0.11 0.00 0.77 0.00 0.00 66.41 66.97 3k8l h THR 137 Cb 0.22 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.58 3k8l h THR 137 CO -0.01 0.07 -0.54 -0.33 0.37 0.00 0.00 175.52 175.08 3k8l h GLU 138 N 0.13 0.00 -0.06 6.66 4.39 -1.21 -1.74 114.58 122.75 3k8l h GLU 138 Ca 0.05 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.73 3k8l h GLU 138 Cb 0.05 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.70 3k8l h GLU 138 CO -0.01 0.54 -0.05 0.00 -1.16 0.00 0.00 179.01 178.34 3k8l h ALA 139 N 1.46 0.09 -0.91 3.43 0.00 -0.57 -3.05 119.26 119.72 3k8l h ALA 139 Ca -0.01 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 3k8l h ALA 139 Cb 0.96 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 3k8l h ALA 139 CO 0.07 -0.13 0.55 0.45 0.00 0.00 0.00 179.25 180.19 3k8l h HIS 140 N -0.27 1.19 -0.05 0.00 3.86 -1.02 0.36 115.15 119.23 3k8l h HIS 140 Ca 0.01 -0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.24 3k8l h HIS 140 Cb 0.52 -0.39 -0.00 0.00 1.06 0.00 0.00 27.41 28.60 3k8l h HIS 140 CO 0.08 0.79 0.04 -0.91 0.86 0.00 0.00 177.93 178.79 3k8l h ASN 141 N 1.25 0.00 -0.68 2.45 2.35 -1.26 -0.95 115.58 118.74 3k8l h ASN 141 Ca 0.33 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.08 3k8l h ASN 141 Cb -0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.31 3k8l h ASN 141 CO -0.06 0.00 0.00 0.54 -1.65 0.00 0.00 177.43 176.26 3k8l n ARG 142 N -4.23 2.81 -1.61 0.81 1.74 -0.74 -4.93 116.66 110.50 3k8l n ARG 142 Ca -0.02 -2.54 -0.04 0.00 -0.77 0.00 0.00 57.85 54.48 3k8l n ARG 142 Cb 0.14 -1.60 -0.01 0.00 -1.02 0.00 0.00 32.46 29.96 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 1.50 0.45 3.37 -0.13 0.00 -0.36 -5.03 105.19 104.99 3k8l n GLY 143 Ca 0.23 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.19 3.38 0.50 -0.61 1.01 0.04 -4.72 121.20 118.60 3k8l s ILE 144 Ca 0.00 -0.52 -0.10 0.00 0.00 0.00 0.00 60.65 60.03 3k8l s ILE 144 Cb 0.00 -2.49 -0.05 0.00 0.01 0.00 0.00 42.46 39.93 3k8l s ILE 144 CO 0.00 0.47 0.87 -0.54 0.00 0.00 0.00 174.94 175.75 3k8l s LYS 145 N 0.86 3.69 -0.16 2.79 1.02 -0.37 -3.16 119.74 124.39 3k8l s LYS 145 Ca -0.02 0.53 0.01 0.00 0.02 0.00 0.00 55.97 56.51 3k8l s LYS 145 Cb -0.15 -2.27 0.01 0.00 -0.52 0.00 0.00 37.83 34.90 3k8l s LYS 145 CO 0.01 -0.26 -0.18 0.42 -0.92 0.00 0.00 175.35 174.42 3k8l s ILE 146 N -2.73 2.31 -0.09 2.17 -1.09 -1.26 -0.87 121.20 119.64 3k8l s ILE 146 Ca 0.52 -0.88 0.01 0.00 -2.23 0.00 0.00 60.65 58.08 3k8l s ILE 146 Cb -0.10 -1.96 -0.02 0.00 -1.58 0.00 0.00 42.46 38.79 3k8l s ILE 146 CO 0.41 0.53 -0.12 -0.31 -1.23 0.00 0.00 174.94 174.22 3k8l s TYR 147 N 1.00 2.79 0.03 3.97 2.02 0.61 -1.08 117.35 126.69 3k8l s TYR 147 Ca -0.02 -0.33 -0.00 0.00 -0.37 0.00 0.00 57.07 56.35 3k8l s TYR 147 Cb -0.15 -1.74 -0.04 0.00 -0.40 0.00 0.00 41.96 39.64 3k8l s TYR 147 CO -0.05 0.04 0.15 -0.51 -1.57 0.00 0.00 175.55 173.61 3k8l s LEU 148 N -0.27 4.14 -0.40 -1.29 1.43 -0.92 -1.55 118.68 119.81 3k8l s LEU 148 Ca 0.02 0.20 -0.26 0.00 -1.03 0.00 0.00 54.13 53.06 3k8l s LEU 148 Cb -0.13 -2.62 0.02 0.00 0.03 0.00 0.00 46.19 43.49 3k8l s LEU 148 CO 0.03 0.21 0.93 -0.62 0.23 0.00 0.00 176.35 177.13 3k8l s ASP 149 N -2.18 6.61 -0.25 2.29 -1.08 -1.15 -0.89 116.67 120.02 3k8l s ASP 149 Ca 0.29 0.42 -0.06 0.00 -0.52 0.00 0.00 52.55 52.68 3k8l s ASP 149 Cb -0.13 -2.46 -0.01 0.00 -1.46 0.00 0.00 42.92 38.86 3k8l s ASP 149 CO 0.21 -0.93 0.03 -0.47 0.52 0.00 0.00 175.17 174.53 3k8l s TYR 150 N 3.60 3.06 -0.54 -5.34 5.04 0.28 -4.52 117.35 118.94 3k8l s TYR 150 Ca 0.38 -0.79 -0.17 0.00 -2.44 0.00 0.00 57.07 54.05 3k8l s TYR 150 Cb -0.11 -2.20 0.10 0.00 0.35 0.00 0.00 41.96 40.10 3k8l s TYR 150 CO 0.22 -0.49 0.57 0.08 -1.34 0.00 0.00 175.55 174.58 3k8l s VAL 151 N 1.53 5.03 -0.50 3.14 1.01 -1.26 -2.40 120.40 126.94 3k8l s VAL 151 Ca 0.05 -1.08 0.17 0.00 0.00 0.00 0.00 61.98 61.13 3k8l s VAL 151 Cb -0.15 -4.34 -0.22 0.00 0.00 0.00 0.00 36.38 31.66 3k8l s VAL 151 CO 0.01 -0.88 0.60 0.23 0.00 0.00 0.00 175.10 175.05 3k8l n MET 152 N 5.75 0.98 0.11 2.72 2.81 -1.26 -4.45 117.12 123.77 3k8l n MET 152 Ca -0.11 -0.07 -0.04 0.00 -1.81 0.00 0.00 57.70 55.68 3k8l n MET 152 Cb 0.42 -1.36 0.08 0.00 -0.71 0.00 0.00 33.22 31.66 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 0.00 0.06 -5.03 7.83 -1.24 -1.88 -3.43 115.58 111.89 3k8l h ASN 153 Ca 0.00 -0.04 0.02 0.00 0.71 0.00 0.00 56.30 56.99 3k8l h ASN 153 Cb 0.57 -0.02 -0.08 0.00 0.73 0.00 0.00 38.32 39.52 3k8l h ASN 153 CO 0.00 0.77 0.16 -1.38 -1.29 0.00 0.00 177.43 175.69 3k8l s HIS 154 N -3.40 -0.23 0.38 0.67 -3.43 -1.26 -0.77 115.29 107.25 3k8l s HIS 154 Ca -0.01 -0.14 0.06 0.00 -0.80 0.00 0.00 55.06 54.17 3k8l s HIS 154 Cb 0.12 0.57 -0.07 0.00 -1.43 0.00 0.00 32.58 31.77 3k8l s HIS 154 CO 0.79 -1.06 0.02 0.95 -2.00 0.00 0.00 174.74 173.44 3k8l s THR 155 N -3.87 1.75 0.64 -5.38 -4.23 -0.81 -4.79 115.64 98.94 3k8l s THR 155 Ca 0.09 -2.01 -0.12 0.00 -1.18 0.00 0.00 61.69 58.46 3k8l s THR 155 Cb -0.03 -2.91 -0.02 0.00 1.34 0.00 0.00 72.50 70.87 3k8l s THR 155 CO 0.00 -0.02 1.04 -0.83 -0.54 0.00 0.00 174.62 174.28 3k8l s GLY 156 N -3.63 1.80 0.00 3.99 0.00 -0.55 -1.34 107.32 107.58 3k8l s GLY 156 Ca 0.35 0.11 0.21 0.00 0.00 0.00 0.00 44.72 45.39 3k8l s GLY 156 CO 0.17 0.40 1.65 -1.30 0.00 0.00 0.00 173.10 174.03 3k8l n THR 157 N -2.65 0.37 1.37 0.90 -2.24 0.39 -2.02 114.28 110.41 3k8l n THR 157 Ca 0.07 0.09 0.13 0.00 -2.27 0.00 0.00 64.05 62.08 3k8l n THR 157 Cb 0.54 -0.75 0.43 0.00 -2.10 0.00 0.00 70.33 68.44 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 -1.29 2.55 -2.15 6.98 0.00 -1.26 -4.57 120.51 120.76 3k8l n ALA 158 Ca 0.10 -0.51 -0.42 0.00 0.00 0.00 0.00 53.44 52.61 3k8l n ALA 158 Cb 0.17 -1.09 -0.03 0.00 0.00 0.00 0.00 19.45 18.50 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 -1.98 3.28 0.58 0.00 5.04 -0.86 -4.88 115.29 116.47 3k8l s HIS 159 Ca 0.36 1.09 0.29 0.00 -1.54 0.00 0.00 55.06 55.26 3k8l s HIS 159 Cb 0.21 -3.62 1.43 0.00 0.04 0.00 0.00 32.58 30.64 3k8l s HIS 159 CO 0.32 -2.05 1.83 -1.00 -2.34 0.00 0.00 174.74 171.50 3k8l h PRO 160 N 6.32 0.00 -0.63 2.88 0.13 -1.91 0.12 132.00 138.91 3k8l h PRO 160 Ca -0.43 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.61 3k8l h PRO 160 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 3k8l h PRO 160 CO 0.83 0.00 0.05 -1.49 -0.23 0.00 0.00 178.00 177.15 3k8l h TRP 161 N 0.00 1.16 -0.01 1.56 6.55 -1.91 -1.44 115.95 121.86 3k8l h TRP 161 Ca 0.29 -0.18 -0.17 0.00 0.95 0.00 0.00 58.89 59.77 3k8l h TRP 161 Cb 1.50 -0.31 -0.01 0.00 -0.86 0.00 0.00 29.16 29.47 3k8l h TRP 161 CO 0.00 1.00 -0.78 0.35 -1.05 0.00 0.00 178.44 177.97 3k8l h PHE 162 N 0.99 0.21 -0.49 0.49 3.57 -1.12 0.75 116.94 121.34 3k8l h PHE 162 Ca 0.18 -0.11 -0.05 0.00 3.53 0.00 0.00 57.97 61.53 3k8l h PHE 162 Cb 0.51 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.20 3k8l h PHE 162 CO 0.04 0.86 0.10 1.15 -2.23 0.00 0.00 178.31 178.23 3k8l h THR 163 N 0.09 1.22 0.03 4.41 2.02 -1.09 -0.61 112.91 118.98 3k8l h THR 163 Ca -0.02 -0.80 -0.00 0.00 0.77 0.00 0.00 66.41 66.36 3k8l h THR 163 Cb 1.36 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 68.51 3k8l h THR 163 CO 0.11 0.29 -0.01 -0.33 0.37 0.00 0.00 175.52 175.95 3k8l h GLU 164 N 0.73 -0.04 -0.87 6.66 4.39 -1.08 -3.13 114.58 121.23 3k8l h GLU 164 Ca 0.16 0.00 0.13 0.00 0.34 0.00 0.00 59.36 60.00 3k8l h GLU 164 Cb 0.30 0.01 -0.09 0.00 -0.10 0.00 0.00 28.75 28.87 3k8l h GLU 164 CO 0.00 0.52 0.48 0.00 -1.16 0.00 0.00 179.01 178.85 3k8l h ALA 165 N -0.39 1.31 0.00 3.43 0.00 -0.82 -1.16 119.26 121.63 3k8l h ALA 165 Ca -0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3k8l h ALA 165 Cb 0.57 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3k8l h ALA 165 CO 0.01 -0.01 0.00 -1.13 0.00 0.00 0.00 179.25 178.12 3k8l n SER 166 N -4.81 0.28 0.05 0.00 3.41 -0.24 -3.74 113.62 108.57 3k8l n SER 166 Ca 0.17 0.53 -0.08 0.00 -0.26 0.00 0.00 58.87 59.22 3k8l n SER 166 Cb 0.40 -0.60 0.06 0.00 -0.26 0.00 0.00 64.21 63.81 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 0.45 -3.89 4.04 4.64 -1.15 -3.47 113.55 114.18 3k8l h SER 167 Ca 0.00 -0.27 0.02 0.00 -0.47 0.00 0.00 61.79 61.06 3k8l h SER 167 Cb 0.56 -0.13 -0.23 0.00 -0.31 0.00 0.00 62.40 62.29 3k8l h SER 167 CO 0.00 0.98 0.34 -0.55 -0.87 0.00 0.00 176.83 176.73 3k8l s SER 168 N -6.94 -0.55 0.00 4.97 0.15 -1.24 -5.00 113.70 105.09 3k8l s SER 168 Ca -0.06 0.92 0.12 0.00 0.70 0.00 0.00 55.95 57.64 3k8l s SER 168 Cb 0.11 0.88 0.56 0.00 -1.71 0.00 0.00 66.02 65.86 3k8l s SER 168 CO 0.83 -0.29 1.37 -1.54 1.20 0.00 0.00 173.24 174.81 3k8l n SER 169 N 1.85 0.00 -0.21 5.45 3.41 -1.26 -1.24 113.62 121.62 3k8l n SER 169 Ca -0.14 0.39 0.12 0.00 -0.26 0.00 0.00 58.87 58.98 3k8l n SER 169 Cb 0.56 -0.44 0.24 0.00 -0.26 0.00 0.00 64.21 64.31 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 -1.44 0.62 -1.87 4.33 -0.58 -1.26 -4.90 120.64 115.54 3k8l n GLU 170 Ca 0.04 -0.41 -0.39 0.00 -0.42 0.00 0.00 57.16 55.98 3k8l n GLU 170 Cb 0.13 -1.49 0.02 0.00 -0.57 0.00 0.00 31.44 29.53 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 -2.66 5.75 0.55 1.62 0.15 -0.37 -4.90 113.70 113.84 3k8l s SER 171 Ca 0.19 2.77 0.36 0.00 0.70 0.00 0.00 55.95 59.96 3k8l s SER 171 Cb 0.18 -2.64 1.66 0.00 -1.71 0.00 0.00 66.02 63.51 3k8l s SER 171 CO 0.60 -1.25 2.07 -0.65 1.20 0.00 0.00 173.24 175.21 3k8l h PRO 172 N 2.04 0.00 -0.02 5.44 0.11 -1.92 -2.31 132.00 135.35 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 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3k8l h PRO 172 CO 0.60 0.00 -0.32 0.66 -0.21 0.00 0.00 178.00 178.72 3k8l n TYR 173 N -2.96 0.00 -0.31 0.65 4.01 -1.26 -4.57 117.16 112.72 3k8l n TYR 173 Ca -0.01 0.00 0.17 0.00 -0.16 0.00 0.00 57.90 57.90 3k8l n TYR 173 Cb 0.21 -0.02 0.35 0.00 -0.31 0.00 0.00 39.34 39.57 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 2.59 0.23 0.00 -0.72 9.65 -1.65 0.13 114.38 124.61 3k8l h ARG 174 Ca 0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3k8l h ARG 174 Cb 0.74 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.26 3k8l h ARG 174 CO 0.00 0.15 0.00 -1.71 2.80 0.00 0.00 179.97 181.21 3k8l n ASN 175 N -5.18 0.00 0.19 -3.80 5.15 -1.26 -3.28 115.26 107.07 3k8l n ASN 175 Ca 0.25 -1.17 0.14 0.00 -0.60 0.00 0.00 54.58 53.20 3k8l n ASN 175 Cb 0.79 0.00 0.42 0.00 -0.53 0.00 0.00 39.78 40.46 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 -3.62 1.20 0.99 -1.23 -3.41 116.97 110.90 3k8l h TYR 176 Ca 0.00 0.00 -0.53 0.00 2.00 0.00 0.00 58.73 60.20 3k8l h TYR 176 Cb 0.00 0.00 -0.13 0.00 1.00 0.00 0.00 36.73 37.60 3k8l h TYR 176 CO 0.00 0.00 -0.50 0.71 -0.00 0.00 0.00 178.16 178.37 3k8l s TYR 177 N -3.32 1.77 -0.37 4.88 2.02 -1.21 -0.03 117.35 121.09 3k8l s TYR 177 Ca 0.06 -1.47 -0.08 0.00 -0.37 0.00 0.00 57.07 55.21 3k8l s TYR 177 Cb 0.09 -0.96 0.06 0.00 -0.40 0.00 0.00 41.96 40.74 3k8l s TYR 177 CO 0.57 -0.57 0.17 -1.12 -1.57 0.00 0.00 175.55 173.03 3k8l s SER 178 N -3.51 5.46 0.09 2.29 0.01 -1.26 -4.64 113.70 112.14 3k8l s SER 178 Ca 0.30 -1.30 0.06 0.00 1.31 0.00 0.00 55.95 56.32 3k8l s SER 178 Cb 0.02 -1.92 -0.04 0.00 0.21 0.00 0.00 66.02 64.29 3k8l s SER 178 CO 0.20 -0.42 -0.06 -0.36 0.41 0.00 0.00 173.24 173.02 3k8l s PHE 179 N 1.41 2.86 -0.16 2.43 0.08 -1.26 -1.89 117.98 121.45 3k8l s PHE 179 Ca 0.01 -0.09 -0.28 0.00 0.12 0.00 0.00 56.93 56.68 3k8l s PHE 179 Cb -0.21 -1.50 0.09 0.00 -0.57 0.00 0.00 43.02 40.84 3k8l s PHE 179 CO 0.03 0.44 0.81 0.45 -0.10 0.00 0.00 175.22 176.85 3k8l s SER 180 N -2.15 -0.58 0.02 1.36 0.15 0.11 -4.97 113.70 107.64 3k8l s SER 180 Ca 0.23 0.84 0.23 0.00 0.70 0.00 0.00 55.95 57.94 3k8l s SER 180 Cb -0.11 0.76 0.02 0.00 -1.71 0.00 0.00 66.02 64.97 3k8l s SER 180 CO 0.15 -0.40 1.03 -0.62 1.20 0.00 0.00 173.24 174.60 3k8l n GLU 181 N 1.48 0.16 -3.00 5.44 1.02 -1.26 0.19 120.64 124.68 3k8l n GLU 181 Ca -0.15 -0.01 -0.15 0.00 -0.02 0.00 0.00 57.16 56.83 3k8l n GLU 181 Cb 0.57 -1.54 -0.02 0.00 -0.02 0.00 0.00 31.44 30.42 3k8l n GLU 181 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3k8l n ASP 182 N -1.75 -1.90 -0.18 1.62 2.03 -1.26 -4.81 116.55 110.30 3k8l n ASP 182 Ca 0.03 -2.83 -0.03 0.00 0.52 0.00 0.00 54.79 52.47 3k8l n ASP 182 Cb 0.39 0.75 0.03 0.00 -0.72 0.00 0.00 41.12 41.57 3k8l n ASP 182 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3k8l h PRO 183 N 4.72 -0.08 0.15 -0.67 0.11 -1.97 0.19 132.00 134.46 3k8l h PRO 183 Ca 0.06 0.01 0.01 0.00 0.11 0.00 0.00 66.00 66.19 3k8l h PRO 183 Cb 1.00 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.09 3k8l h PRO 183 CO 0.26 -0.05 -0.28 -0.22 -0.21 0.00 0.00 178.00 177.50 3k8l h LYS 184 N -0.08 -0.50 -0.52 1.05 3.64 -1.96 0.48 116.57 118.69 3k8l h LYS 184 Ca 0.26 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.64 3k8l h LYS 184 Cb 0.48 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 3k8l h LYS 184 CO -0.61 -0.33 0.20 1.15 -2.27 0.00 0.00 179.45 177.59 3k8l h THR 185 N -0.52 1.22 -0.38 1.00 2.02 -1.92 -2.36 112.91 111.96 3k8l h THR 185 Ca 0.02 -0.68 -0.01 0.00 0.77 0.00 0.00 66.41 66.52 3k8l h THR 185 Cb 0.53 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 3k8l h THR 185 CO -0.14 0.26 0.20 0.44 0.37 0.00 0.00 175.52 176.65 3k8l h ASP 186 N 0.69 0.49 -0.24 4.18 3.32 -0.73 -1.23 116.42 122.90 3k8l h ASP 186 Ca 0.17 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 3k8l h ASP 186 Cb 0.20 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3k8l h ASP 186 CO -0.01 0.45 0.11 0.40 -1.72 0.00 0.00 179.24 178.46 3k8l h ILE 187 N 0.49 1.15 0.00 0.35 2.04 -0.84 -0.02 117.51 120.68 3k8l h ILE 187 Ca 0.13 -0.44 -0.02 0.00 1.00 0.00 0.00 64.86 65.53 3k8l h ILE 187 Cb 0.07 1.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 3k8l h ILE 187 CO -0.02 0.15 -0.11 0.00 0.00 0.00 0.00 178.15 178.17 3k8l h ALA 188 N 0.97 1.48 -0.01 1.87 0.00 -1.31 -0.62 119.26 121.64 3k8l h ALA 188 Ca 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3k8l h ALA 188 Cb 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3k8l h ALA 188 CO -0.01 0.13 -0.11 0.00 0.00 0.00 0.00 179.25 179.26 3k8l n ALA 189 N -2.36 2.80 -1.80 0.00 0.00 -0.48 -4.76 120.51 113.91 3k8l n ALA 189 Ca -0.02 -0.34 -0.05 0.00 0.00 0.00 0.00 53.44 53.03 3k8l n ALA 189 Cb 0.20 -1.25 -0.01 0.00 0.00 0.00 0.00 19.45 18.39 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 1.25 0.35 0.24 0.00 0.00 -0.24 -4.96 105.19 101.82 3k8l n GLY 190 Ca 0.16 -0.74 0.12 0.00 0.00 0.00 0.00 46.02 45.55 3k8l n GLY 190 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k8l n LYS 191 N -1.88 0.71 -3.57 1.61 5.02 -0.09 -4.68 118.16 115.27 3k8l n LYS 191 Ca -0.05 -0.49 -0.41 0.00 -2.02 0.00 0.00 58.31 55.34 3k8l n LYS 191 Cb 0.42 -1.49 -0.09 0.00 -0.02 0.00 0.00 35.03 33.86 3k8l n LYS 191 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3k8l s ILE 192 N -2.63 4.17 0.47 -0.18 -1.09 -1.26 -4.98 121.20 115.71 3k8l s ILE 192 Ca 0.19 -1.72 0.28 0.00 -2.23 0.00 0.00 60.65 57.17 3k8l s ILE 192 Cb 0.18 -3.71 0.48 0.00 -1.58 0.00 0.00 42.46 37.83 3k8l s ILE 192 CO 0.60 -0.72 1.78 0.00 -1.23 0.00 0.00 174.94 175.38 3k8l h ALA 193 N 8.42 2.70 -0.00 9.38 0.00 -1.94 0.70 119.26 138.53 3k8l h ALA 193 Ca -0.21 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3k8l h ALA 193 Cb 1.07 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3k8l h ALA 193 CO 0.83 -1.09 -0.07 -1.33 0.00 0.00 0.00 179.25 177.59 3k8l n MET 194 N -4.41 0.34 -3.19 0.00 2.81 -1.26 -4.26 117.12 107.15 3k8l n MET 194 Ca 0.26 -0.06 -0.22 0.00 -1.81 0.00 0.00 57.70 55.87 3k8l n MET 194 Cb 1.09 -1.50 -0.05 0.00 -0.71 0.00 0.00 33.22 32.05 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 -1.28 -0.01 -0.01 2.02 5.41 0.24 -0.92 119.36 124.82 3k8l n ILE 195 Ca 0.12 -4.45 0.03 0.00 1.00 0.00 0.00 62.75 59.44 3k8l n ILE 195 Cb 0.29 -1.19 0.07 0.00 -0.71 0.00 0.00 39.64 38.09 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 0.77 0.76 -1.05 1.39 -2.24 -1.24 -4.71 114.28 107.95 3k8l n THR 196 Ca 0.24 -0.88 0.09 0.00 -2.27 0.00 0.00 64.05 61.24 3k8l n THR 196 Cb 0.57 0.65 0.19 0.00 -2.10 0.00 0.00 70.33 69.64 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 0.10 1.93 0.00 -0.78 1.13 -1.26 -4.63 117.38 113.88 3k8l n GLN 197 Ca 0.05 -2.70 0.00 0.00 -1.94 0.00 0.00 57.00 52.42 3k8l n GLN 197 Cb 0.29 -1.64 0.00 0.00 0.11 0.00 0.00 30.24 29.00 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 -1.07 0.24 0.00 -1.09 1.02 -1.26 -5.01 120.64 113.47 3k8l n GLU 198 Ca 0.18 -0.49 0.00 0.00 -0.02 0.00 0.00 57.16 56.83 3k8l n GLU 198 Cb 0.74 -0.71 0.00 0.00 -0.02 0.00 0.00 31.44 31.46 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 -0.08 -0.04 0.33 0.62 0.00 -1.26 -3.09 105.19 101.67 3k8l n GLY 199 Ca 0.00 -1.02 0.16 0.00 0.00 0.00 0.00 46.02 45.16 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 -0.59 2.10 0.00 4.61 0.00 -1.86 -0.84 119.26 122.69 3k8l h ALA 200 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3k8l h ALA 200 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3k8l h ALA 200 CO 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 179.25 178.90 3k8l n ALA 201 N -2.50 1.22 0.31 0.00 0.00 -1.18 -1.57 120.51 116.80 3k8l n ALA 201 Ca 0.03 0.11 0.13 0.00 0.00 0.00 0.00 53.44 53.71 3k8l n ALA 201 Cb 0.36 -1.25 0.59 0.00 0.00 0.00 0.00 19.45 19.16 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 0.71 0.00 -5.27 0.00 0.00 -1.21 -3.42 103.07 93.88 3k8l h GLY 202 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 3k8l h GLY 202 CO 0.00 0.00 -0.04 -0.47 0.00 0.00 0.00 176.54 176.03 3k8l s TYR 203 N -3.48 3.55 -0.18 5.60 5.04 -0.61 -5.04 117.35 122.23 3k8l s TYR 203 Ca 0.01 1.06 -0.05 0.00 -2.44 0.00 0.00 57.07 55.66 3k8l s TYR 203 Cb 0.09 -2.66 0.06 0.00 0.35 0.00 0.00 41.96 39.80 3k8l s TYR 203 CO 0.36 0.15 0.08 1.21 -1.34 0.00 0.00 175.55 176.01 3k8l s ASN 204 N 0.63 2.49 0.42 4.32 3.84 -1.26 -5.04 114.94 120.35 3k8l s ASN 204 Ca 0.31 -0.68 0.25 0.00 0.21 0.00 0.00 52.86 52.95 3k8l s ASN 204 Cb -0.16 -0.31 1.30 0.00 -0.55 0.00 0.00 41.25 41.53 3k8l s ASN 204 CO 0.14 -0.35 1.68 0.00 -2.79 0.00 0.00 177.10 175.78 3k8l h ALA 205 N 8.39 2.52 0.00 1.71 0.00 -1.96 0.17 119.26 130.09 3k8l h ALA 205 Ca -0.15 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3k8l h ALA 205 Cb 1.14 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3k8l h ALA 205 CO 0.30 -1.07 0.00 0.00 0.00 0.00 0.00 179.25 178.49 3k8l n ALA 206 N -2.50 1.67 -0.58 0.00 0.00 -1.26 -2.54 120.51 115.31 3k8l n ALA 206 Ca 0.32 -0.01 0.09 0.00 0.00 0.00 0.00 53.44 53.84 3k8l n ALA 206 Cb 1.21 -1.28 0.36 0.00 0.00 0.00 0.00 19.45 19.73 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 -1.71 3.74 -4.30 0.00 1.02 0.60 -4.32 120.64 115.67 3k8l n GLU 207 Ca 0.03 -2.85 -0.21 0.00 -0.02 0.00 0.00 57.16 54.11 3k8l n GLU 207 Cb 0.19 -1.91 -0.16 0.00 -0.02 0.00 0.00 31.44 29.54 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 -1.87 0.94 0.06 -0.32 0.52 -1.05 -0.94 118.94 116.28 3k8l s TRP 208 Ca 0.51 -0.29 0.06 0.00 0.02 0.00 0.00 56.10 56.40 3k8l s TRP 208 Cb 0.33 -0.77 -0.03 0.00 -1.15 0.00 0.00 33.47 31.86 3k8l s TRP 208 CO 0.24 -0.20 -0.18 -0.06 0.02 0.00 0.00 176.95 176.77 3k8l s PHE 209 N 0.78 1.56 0.29 -1.98 0.08 -0.52 -4.93 117.98 113.26 3k8l s PHE 209 Ca -0.12 -0.38 -0.28 0.00 0.12 0.00 0.00 56.93 56.27 3k8l s PHE 209 Cb -0.14 -0.91 -0.09 0.00 -0.57 0.00 0.00 43.02 41.30 3k8l s PHE 209 CO 0.01 0.09 0.96 1.14 -0.10 0.00 0.00 175.22 177.33 3k8l s GLN 210 N -1.35 4.67 0.28 0.44 -2.07 -1.26 0.01 119.66 120.38 3k8l s GLN 210 Ca 0.04 1.44 0.00 0.00 -1.82 0.00 0.00 55.36 55.03 3k8l s GLN 210 Cb -0.09 -3.01 0.41 0.00 -1.09 0.00 0.00 33.01 29.23 3k8l s GLN 210 CO 0.02 0.35 1.78 0.28 -1.32 0.00 0.00 175.29 176.40 3k8l h VAL 211 N 2.84 1.23 0.00 3.63 2.07 -1.32 -3.46 116.25 121.25 3k8l h VAL 211 Ca -0.46 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.07 3k8l h VAL 211 Cb 1.20 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 3k8l h VAL 211 CO 0.66 0.34 0.00 -1.54 0.02 0.00 0.00 177.57 177.05 3k8l n SER 212 N -4.22 0.00 -0.38 0.57 3.41 -1.26 -4.99 113.62 106.75 3k8l n SER 212 Ca 0.02 0.00 0.14 0.00 -0.26 0.00 0.00 58.87 58.77 3k8l n SER 212 Cb 0.30 0.00 0.55 0.00 -0.26 0.00 0.00 64.21 64.81 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 0.03 1.22 -4.76 4.04 8.00 -1.26 -4.62 116.55 119.20 3k8l n ASP 213 Ca 0.00 -1.31 -0.39 0.00 0.71 0.00 0.00 54.79 53.80 3k8l n ASP 213 Cb 0.00 0.01 0.01 0.00 -0.02 0.00 0.00 41.12 41.12 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 -2.10 3.71 0.20 -1.24 2.56 -1.26 -4.95 118.70 115.63 3k8l s GLU 214 Ca 0.37 2.13 0.00 0.00 0.00 0.00 0.00 54.97 57.47 3k8l s GLU 214 Cb 0.21 -2.56 -0.04 0.00 2.00 0.00 0.00 34.13 33.73 3k8l s GLU 214 CO 0.37 -0.70 0.09 0.95 -0.56 0.00 0.00 175.26 175.41 3k8l s THR 215 N -1.32 0.30 0.58 -1.70 -4.23 -1.26 -4.46 115.64 103.56 3k8l s THR 215 Ca 0.62 -1.98 -0.16 0.00 -1.18 0.00 0.00 61.69 58.99 3k8l s THR 215 Cb -0.37 -2.40 -0.04 0.00 1.34 0.00 0.00 72.50 71.02 3k8l s THR 215 CO 0.47 -0.16 1.06 0.00 -0.54 0.00 0.00 174.62 175.44 3k8l s ALA 216 N -3.93 2.76 0.65 3.99 0.00 -1.26 -5.01 121.76 118.96 3k8l s ALA 216 Ca 0.34 0.41 -0.07 0.00 0.00 0.00 0.00 51.96 52.64 3k8l s ALA 216 Cb 0.07 -3.23 0.03 0.00 0.00 0.00 0.00 23.12 19.99 3k8l s ALA 216 CO 0.09 -0.76 0.97 0.00 0.00 0.00 0.00 175.76 176.07 3k8l s ALA 217 N -2.40 3.18 -0.10 0.00 0.00 -1.26 -4.76 121.76 116.41 3k8l s ALA 217 Ca 0.64 -0.72 0.04 0.00 0.00 0.00 0.00 51.96 51.92 3k8l s ALA 217 Cb -0.16 -2.67 0.00 0.00 0.00 0.00 0.00 23.12 20.29 3k8l s ALA 217 CO 0.35 -1.04 -0.24 0.08 0.00 0.00 0.00 175.76 174.92 3k8l s VAL 218 N -3.14 2.04 0.01 0.00 1.01 -0.46 -5.00 120.40 114.86 3k8l s VAL 218 Ca 0.57 -1.00 -0.04 0.00 0.00 0.00 0.00 61.98 61.51 3k8l s VAL 218 Cb -0.11 -1.77 -0.01 0.00 0.00 0.00 0.00 36.38 34.50 3k8l s VAL 218 CO 0.46 0.55 0.05 -0.54 0.00 0.00 0.00 175.10 175.63 3k8l s LYS 219 N 0.38 0.40 0.00 2.72 1.02 -1.26 -1.68 119.74 121.32 3k8l s LYS 219 Ca -0.18 -0.51 0.00 0.00 0.02 0.00 0.00 55.97 55.30 3k8l s LYS 219 Cb -0.18 0.16 0.00 0.00 -0.52 0.00 0.00 37.83 37.29 3k8l s LYS 219 CO 0.08 -0.08 0.00 0.41 -0.92 0.00 0.00 175.35 174.84 3k8l n GLY 220 N 1.51 3.30 3.62 -3.33 0.00 -0.67 -4.99 105.19 104.63 3k8l n GLY 220 Ca -0.23 -1.56 -0.43 0.00 0.00 0.00 0.00 46.02 43.80 3k8l n GLY 220 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k8l s LEU 221 N 0.00 3.79 -0.04 0.99 1.43 -1.26 -1.10 118.68 122.50 3k8l s LEU 221 Ca 0.00 0.88 0.03 0.00 -1.03 0.00 0.00 54.13 54.01 3k8l s LEU 221 Cb 0.00 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.68 3k8l s LEU 221 CO 0.00 -1.10 -0.12 -0.76 0.23 0.00 0.00 176.35 174.60 3k8l s LEU 222 N 4.25 1.81 -0.18 1.79 1.43 -0.81 -0.08 118.68 126.87 3k8l s LEU 222 Ca 0.50 -0.25 -0.11 0.00 -1.03 0.00 0.00 54.13 53.24 3k8l s LEU 222 Cb -0.12 -0.71 -0.05 0.00 0.03 0.00 0.00 46.19 45.34 3k8l s LEU 222 CO 0.24 0.09 0.20 -0.75 0.23 0.00 0.00 176.35 176.36 3k8l s LYS 223 N 0.20 4.17 -0.19 1.70 2.20 0.14 -1.86 119.74 126.09 3k8l s LYS 223 Ca -0.04 -0.09 -0.03 0.00 -0.36 0.00 0.00 55.97 55.45 3k8l s LYS 223 Cb -0.10 -3.41 -0.01 0.00 -1.51 0.00 0.00 37.83 32.80 3k8l s LYS 223 CO 0.01 0.31 -0.07 -0.06 -0.36 0.00 0.00 175.35 175.18 3k8l s PHE 224 N 0.30 2.92 -0.20 4.03 0.40 0.11 -1.19 117.98 124.35 3k8l s PHE 224 Ca 0.12 -0.83 -0.01 0.00 -0.60 0.00 0.00 56.93 55.61 3k8l s PHE 224 Cb -0.12 -2.01 0.01 0.00 0.51 0.00 0.00 43.02 41.41 3k8l s PHE 224 CO 0.01 -0.42 -0.14 0.99 0.70 0.00 0.00 175.22 176.36 3k8l s THR 225 N 1.06 2.55 -0.15 0.64 2.01 -0.22 -1.58 115.64 119.95 3k8l s THR 225 Ca 0.00 -0.78 -0.05 0.00 0.31 0.00 0.00 61.69 61.18 3k8l s THR 225 Cb -0.15 -2.12 -0.03 0.00 0.01 0.00 0.00 72.50 70.21 3k8l s THR 225 CO -0.01 0.49 0.02 -0.76 -0.69 0.00 0.00 174.62 173.67 3k8l s LEU 226 N 1.36 3.59 -0.32 4.42 1.43 0.95 -1.73 118.68 128.38 3k8l s LEU 226 Ca 0.05 0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.20 3k8l s LEU 226 Cb -0.14 -1.87 0.08 0.00 0.03 0.00 0.00 46.19 44.29 3k8l s LEU 226 CO -0.09 0.23 0.02 -0.62 0.23 0.00 0.00 176.35 176.11 3k8l s ASP 227 N 0.03 4.80 -0.12 2.29 3.68 -0.33 -0.05 116.67 126.98 3k8l s ASP 227 Ca 0.03 -1.69 0.14 0.00 2.13 0.00 0.00 52.55 53.17 3k8l s ASP 227 Cb -0.13 -1.67 0.63 0.00 -1.45 0.00 0.00 42.92 40.30 3k8l s ASP 227 CO 0.02 -0.32 1.50 1.87 0.13 0.00 0.00 175.17 178.36 3k8l n TRP 228 N 4.46 1.39 -0.25 -5.34 -0.00 0.15 -1.87 117.44 115.98 3k8l n TRP 228 Ca -0.07 -0.53 -0.00 0.00 -0.00 0.00 0.00 57.50 56.90 3k8l n TRP 228 Cb 0.42 -0.28 0.12 0.00 -0.00 0.00 0.00 31.31 31.57 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 3.38 0.61 -2.09 5.87 0.02 -1.87 -2.74 113.55 116.73 3k8l h SER 229 Ca 0.00 0.03 -0.79 0.00 -0.84 0.00 0.00 61.79 60.19 3k8l h SER 229 Cb 1.39 -0.09 -0.23 0.00 0.14 0.00 0.00 62.40 63.61 3k8l h SER 229 CO 0.26 0.38 1.34 -3.20 -1.14 0.00 0.00 176.83 174.47 3k8l n ASN 230 N -4.76 7.19 0.00 3.07 4.05 -1.26 -4.92 115.26 118.63 3k8l n ASN 230 Ca 0.10 -3.49 0.00 0.00 0.45 0.00 0.00 54.58 51.64 3k8l n ASN 230 Cb 0.20 -1.25 0.00 0.00 1.23 0.00 0.00 39.78 39.96 3k8l n ASN 230 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3k8l n ALA 231 N 0.81 0.00 -0.04 5.20 0.00 -1.04 0.95 120.51 126.40 3k8l n ALA 231 Ca 0.46 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.91 3k8l n ALA 231 Cb 0.28 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.06 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 0.61 -2.91 0.00 0.13 -1.91 -3.34 132.00 124.58 3k8l h PRO 232 Ca 0.00 -0.08 -0.61 0.00 -0.87 0.00 0.00 66.00 64.44 3k8l h PRO 232 Cb 0.00 -0.12 -0.41 0.00 0.13 0.00 0.00 31.00 30.60 3k8l h PRO 232 CO 0.00 0.50 -0.67 -1.12 -0.23 0.00 0.00 178.00 176.48 3k8l s SER 233 N -6.66 4.03 0.64 1.44 0.01 0.27 -4.61 113.70 108.82 3k8l s SER 233 Ca -0.08 -3.67 -0.17 0.00 1.31 0.00 0.00 55.95 53.34 3k8l s SER 233 Cb 0.17 -1.35 -0.01 0.00 0.21 0.00 0.00 66.02 65.03 3k8l s SER 233 CO 0.76 -0.10 1.18 -2.84 0.41 0.00 0.00 173.24 172.64 3k8l s PRO 234 N -1.10 2.74 -0.13 12.44 0.02 -1.22 -4.63 135.00 143.12 3k8l s PRO 234 Ca 0.27 1.68 -0.01 0.00 0.02 0.00 0.00 61.00 62.96 3k8l s PRO 234 Cb -0.03 -1.92 -0.02 0.00 0.02 0.00 0.00 34.50 32.56 3k8l s PRO 234 CO -0.17 -1.35 -0.11 0.42 -0.33 0.00 0.00 177.00 175.45 3k8l s ILE 235 N -1.90 3.22 -0.07 2.83 -1.09 -0.78 -1.43 121.20 121.98 3k8l s ILE 235 Ca 0.74 -0.61 0.03 0.00 -2.23 0.00 0.00 60.65 58.58 3k8l s ILE 235 Cb -0.27 -2.36 -0.02 0.00 -1.58 0.00 0.00 42.46 38.23 3k8l s ILE 235 CO 0.38 0.52 -0.14 -0.22 -1.23 0.00 0.00 174.94 174.25 3k8l s LEU 236 N 0.29 2.72 -0.04 2.97 2.96 -0.04 -1.18 118.68 126.36 3k8l s LEU 236 Ca -0.09 -0.24 0.01 0.00 -0.22 0.00 0.00 54.13 53.59 3k8l s LEU 236 Cb -0.15 -1.57 0.02 0.00 0.50 0.00 0.00 46.19 45.00 3k8l s LEU 236 CO 0.05 0.30 -0.02 -0.69 -1.32 0.00 0.00 176.35 174.67 3k8l s VAL 237 N -0.44 0.31 0.00 1.68 1.01 -0.70 -0.05 120.40 122.21 3k8l s VAL 237 Ca 0.05 0.01 0.04 0.00 0.00 0.00 0.00 61.98 62.09 3k8l s VAL 237 Cb -0.12 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.85 3k8l s VAL 237 CO 0.02 0.18 -0.12 -0.69 0.00 0.00 0.00 175.10 174.49 3k8l s VAL 238 N 1.00 3.28 0.17 2.92 1.01 -1.26 -1.06 120.40 126.46 3k8l s VAL 238 Ca -0.10 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 60.90 3k8l s VAL 238 Cb -0.14 -2.38 -0.00 0.00 0.00 0.00 0.00 36.38 33.86 3k8l s VAL 238 CO -0.01 0.42 0.34 -0.94 0.00 0.00 0.00 175.10 174.91 3k8l s SER 239 N -1.27 -0.02 0.27 3.32 1.04 -0.33 -0.50 113.70 116.22 3k8l s SER 239 Ca 0.15 -0.81 -0.30 0.00 0.48 0.00 0.00 55.95 55.47 3k8l s SER 239 Cb -0.11 0.47 -0.12 0.00 0.10 0.00 0.00 66.02 66.37 3k8l s SER 239 CO 0.05 -0.93 1.63 -0.89 0.98 0.00 0.00 173.24 174.08 3k8l s THR 240 N -3.95 2.04 0.32 2.02 2.01 -1.26 0.26 115.64 117.08 3k8l s THR 240 Ca 0.16 0.03 0.06 0.00 0.31 0.00 0.00 61.69 62.26 3k8l s THR 240 Cb 0.02 -3.02 -0.01 0.00 0.01 0.00 0.00 72.50 69.50 3k8l s THR 240 CO 0.00 0.00 0.44 -0.83 -0.69 0.00 0.00 174.62 173.55 3k8l s GLY 241 N 0.66 1.56 -0.21 4.40 0.00 0.88 -4.46 107.32 110.16 3k8l s GLY 241 Ca 0.66 -1.44 -0.09 0.00 0.00 0.00 0.00 44.72 43.85 3k8l s GLY 241 CO 0.44 -1.37 -0.25 -1.30 0.00 0.00 0.00 173.10 170.62 3k8l n THR 242 N -1.59 1.14 -3.75 0.90 -2.24 -1.26 -4.77 114.28 102.70 3k8l n THR 242 Ca -0.01 -0.31 -0.12 0.00 -2.27 0.00 0.00 64.05 61.33 3k8l n THR 242 Cb 0.58 -1.69 -0.12 0.00 -2.10 0.00 0.00 70.33 67.00 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 -2.38 0.27 0.28 -0.78 2.20 -1.26 -5.06 119.74 113.00 3k8l s LYS 243 Ca -0.29 0.48 -0.30 0.00 -0.36 0.00 0.00 55.97 55.50 3k8l s LYS 243 Cb 0.11 0.01 -0.12 0.00 -1.51 0.00 0.00 37.83 36.32 3k8l s LYS 243 CO 0.38 -0.10 1.62 0.00 -0.36 0.00 0.00 175.35 176.88 3k8l n ALA 244 N 3.64 2.60 -1.67 3.13 0.00 -1.26 -4.83 120.51 122.12 3k8l n ALA 244 Ca -0.19 0.38 -0.33 0.00 0.00 0.00 0.00 53.44 53.29 3k8l n ALA 244 Cb 0.56 -2.47 0.01 0.00 0.00 0.00 0.00 19.45 17.54 3k8l n ALA 244 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3k8l s ASP 245 N 0.59 5.73 0.49 0.00 1.01 0.26 -4.97 116.67 119.78 3k8l s ASP 245 Ca 0.65 1.90 -0.18 0.00 0.71 0.00 0.00 52.55 55.63 3k8l s ASP 245 Cb -0.50 -2.54 -0.08 0.00 1.01 0.00 0.00 42.92 40.80 3k8l s ASP 245 CO 0.46 -1.21 0.99 -1.83 0.21 0.00 0.00 175.17 173.80 3k8l s GLU 246 N -3.89 3.92 0.43 8.23 -1.05 -1.26 -4.91 118.70 120.17 3k8l s GLU 246 Ca 0.66 1.12 -0.26 0.00 -0.15 0.00 0.00 54.97 56.33 3k8l s GLU 246 Cb -0.18 -2.13 -0.09 0.00 -0.44 0.00 0.00 34.13 31.29 3k8l s GLU 246 CO 0.34 -0.30 1.37 -0.25 0.95 0.00 0.00 175.26 177.37 3k8l n ASP 247 N -1.24 3.05 -4.61 0.83 8.00 -1.26 -4.87 116.55 116.45 3k8l n ASP 247 Ca 0.07 1.13 -0.43 0.00 0.71 0.00 0.00 54.79 56.28 3k8l n ASP 247 Cb 0.54 -1.56 -0.03 0.00 -0.02 0.00 0.00 41.12 40.05 3k8l n ASP 247 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3k8l s ASN 248 N -0.45 5.82 0.46 -2.24 3.84 -1.26 -4.87 114.94 116.25 3k8l s ASN 248 Ca 0.60 1.74 0.19 0.00 0.21 0.00 0.00 52.86 55.60 3k8l s ASN 248 Cb -0.48 -2.52 1.13 0.00 -0.55 0.00 0.00 41.25 38.83 3k8l s ASN 248 CO 0.59 -1.69 1.99 1.55 -2.79 0.00 0.00 177.10 176.74 3k8l h PRO 249 N 13.31 0.00 -6.39 0.43 0.13 -1.98 -3.42 132.00 134.08 3k8l h PRO 249 Ca -0.38 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.18 3k8l h PRO 249 Cb 1.20 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.29 3k8l h PRO 249 CO 0.99 0.19 1.10 0.34 -0.23 0.00 0.00 178.00 180.39 3k8l s ASP 250 N -6.63 6.34 -0.00 1.44 -1.08 -1.26 -4.88 116.67 110.60 3k8l s ASP 250 Ca -0.03 1.17 0.11 0.00 -0.52 0.00 0.00 52.55 53.28 3k8l s ASP 250 Cb 0.14 -2.54 0.32 0.00 -1.46 0.00 0.00 42.92 39.39 3k8l s ASP 250 CO 0.66 -1.37 1.27 0.35 0.52 0.00 0.00 175.17 176.60 3k8l n THR 251 N 6.80 0.50 -1.65 1.71 -2.24 -1.26 -4.94 114.28 113.20 3k8l n THR 251 Ca 0.18 -0.49 -0.41 0.00 -2.27 0.00 0.00 64.05 61.06 3k8l n THR 251 Cb 0.47 0.23 0.02 0.00 -2.10 0.00 0.00 70.33 68.95 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 1.07 0.13 0.24 3.38 0.00 -1.26 -4.92 105.19 103.82 3k8l n GLY 252 Ca 0.12 0.14 0.08 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 0.00 -2.17 2.61 -2.24 -1.26 -4.77 114.28 105.98 3k8l n THR 253 Ca 0.09 -0.26 -0.43 0.00 -2.27 0.00 0.00 64.05 61.18 3k8l n THR 253 Cb 0.40 1.12 -0.02 0.00 -2.10 0.00 0.00 70.33 69.73 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 -2.13 6.44 -1.62 3.42 1.47 -1.26 -2.77 116.67 120.22 3k8l s ASP 254 Ca 0.11 1.56 0.00 0.00 1.18 0.00 0.00 52.55 55.40 3k8l s ASP 254 Cb 0.13 -2.53 0.00 0.00 -0.34 0.00 0.00 42.92 40.17 3k8l s ASP 254 CO 0.50 -1.22 0.00 0.59 0.68 0.00 0.00 175.17 175.72 3k8l n ASN 255 N 8.26 -5.15 -4.78 2.11 3.02 -1.26 -4.97 115.26 112.48 3k8l n ASN 255 Ca 0.18 0.12 -0.37 0.00 -0.03 0.00 0.00 54.58 54.48 3k8l n ASN 255 Cb 0.45 -4.23 -0.06 0.00 -0.61 0.00 0.00 39.78 35.33 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 -2.81 3.25 0.01 5.41 0.00 -1.12 -5.07 121.76 121.43 3k8l s ALA 256 Ca 0.00 0.48 0.08 0.00 0.00 0.00 0.00 51.96 52.53 3k8l s ALA 256 Cb 0.00 -3.13 -0.02 0.00 0.00 0.00 0.00 23.12 19.96 3k8l s ALA 256 CO 0.00 0.20 -0.26 0.15 0.00 0.00 0.00 175.76 175.85 3k8l s LYS 257 N -1.95 2.00 0.08 0.00 -0.14 -1.26 -4.55 119.74 113.92 3k8l s LYS 257 Ca 0.48 -1.00 0.06 0.00 -1.36 0.00 0.00 55.97 54.16 3k8l s LYS 257 Cb -0.19 -2.03 -0.03 0.00 -1.68 0.00 0.00 37.83 33.90 3k8l s LYS 257 CO 0.24 0.54 -0.17 0.71 -0.76 0.00 0.00 175.35 175.91 3k8l s TYR 258 N -0.70 1.47 -0.26 3.18 2.02 0.11 -0.52 117.35 122.64 3k8l s TYR 258 Ca 0.11 -0.42 -0.08 0.00 -0.37 0.00 0.00 57.07 56.31 3k8l s TYR 258 Cb -0.10 -0.83 -0.03 0.00 -0.40 0.00 0.00 41.96 40.61 3k8l s TYR 258 CO 0.00 0.11 0.09 -1.17 -1.57 0.00 0.00 175.55 173.01 3k8l s LEU 259 N -1.67 3.57 -0.14 -1.29 2.96 0.16 -0.73 118.68 121.54 3k8l s LEU 259 Ca 0.02 -0.26 -0.00 0.00 -0.22 0.00 0.00 54.13 53.67 3k8l s LEU 259 Cb -0.10 -1.94 -0.01 0.00 0.50 0.00 0.00 46.19 44.64 3k8l s LEU 259 CO 0.03 -0.06 -0.13 -0.47 -1.32 0.00 0.00 176.35 174.39 3k8l s TYR 260 N 1.62 2.81 0.21 5.38 5.04 0.62 -1.23 117.35 131.79 3k8l s TYR 260 Ca 0.06 -0.76 -0.23 0.00 -2.44 0.00 0.00 57.07 53.70 3k8l s TYR 260 Cb -0.15 -1.87 0.05 0.00 0.35 0.00 0.00 41.96 40.34 3k8l s TYR 260 CO 0.04 -0.30 0.86 1.52 -1.34 0.00 0.00 175.55 176.33 3k8l s TYR 261 N 0.52 -0.16 0.00 4.97 -0.85 -0.52 -0.89 117.35 120.42 3k8l s TYR 261 Ca -0.09 -0.21 0.00 0.00 -0.52 0.00 0.00 57.07 56.25 3k8l s TYR 261 Cb -0.16 0.67 0.00 0.00 0.38 0.00 0.00 41.96 42.85 3k8l s TYR 261 CO 0.04 -1.00 0.00 0.41 -1.52 0.00 0.00 175.55 173.48 3k8l n GLY 262 N -0.46 2.75 2.71 5.49 0.00 -1.26 -1.41 105.19 113.00 3k8l n GLY 262 Ca -0.05 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 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 14.00 2.89 -3.27 1.61 -0.58 -1.26 -4.46 120.64 129.56 3k8l n GLU 263 Ca 0.00 -2.57 -0.24 0.00 -0.42 0.00 0.00 57.16 53.93 3k8l n GLU 263 Cb 0.00 -3.26 0.03 0.00 -0.57 0.00 0.00 31.44 27.64 3k8l n GLU 263 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 3k8l n ASP 264 N 5.96 -5.24 -4.70 1.62 2.03 -1.24 -4.96 116.55 110.03 3k8l n ASP 264 Ca 0.54 -0.39 -0.40 0.00 0.52 0.00 0.00 54.79 55.05 3k8l n ASP 264 Cb 0.38 -4.24 -0.05 0.00 -0.72 0.00 0.00 41.12 36.50 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 -3.12 5.01 -0.16 5.18 -1.09 -0.50 -4.96 121.20 121.56 3k8l s ILE 265 Ca 0.40 1.46 -0.01 0.00 -2.23 0.00 0.00 60.65 60.27 3k8l s ILE 265 Cb -0.19 -4.05 0.04 0.00 -1.58 0.00 0.00 42.46 36.68 3k8l s ILE 265 CO 0.49 0.20 -0.05 0.00 -1.23 0.00 0.00 174.94 174.35 3k8l s LYS 267 N 1.67 2.29 -0.00 0.00 -0.14 -0.37 -4.95 119.74 118.25 3k8l s LYS 267 Ca 0.01 -0.82 -0.22 0.00 -1.36 0.00 0.00 55.97 53.58 3k8l s LYS 267 Cb -0.15 -2.20 -0.05 0.00 -1.68 0.00 0.00 37.83 33.75 3k8l s LYS 267 CO -0.08 0.59 0.64 0.21 -0.76 0.00 0.00 175.35 175.95 3k8l s LYS 268 N -0.68 4.37 0.86 1.68 2.20 -1.26 0.38 119.74 127.29 3k8l s LYS 268 Ca 0.11 0.81 -0.12 0.00 -0.36 0.00 0.00 55.97 56.41 3k8l s LYS 268 Cb -0.10 -3.36 0.11 0.00 -1.51 0.00 0.00 37.83 32.97 3k8l s LYS 268 CO -0.00 0.32 1.09 -0.06 -0.36 0.00 0.00 175.35 176.34 3k8l s PHE 269 N -0.06 2.49 -0.20 4.03 0.40 0.33 -4.50 117.98 120.46 3k8l s PHE 269 Ca 0.33 1.21 -0.09 0.00 -0.60 0.00 0.00 56.93 57.78 3k8l s PHE 269 Cb -0.19 -3.15 -0.05 0.00 0.51 0.00 0.00 43.02 40.14 3k8l s PHE 269 CO 0.18 -2.19 0.12 0.71 0.70 0.00 0.00 175.22 174.74 3k8l s TYR 270 N -3.01 3.35 -0.43 0.36 1.51 -0.36 -4.80 117.35 113.97 3k8l s TYR 270 Ca 0.63 0.24 -0.29 0.00 -1.01 0.00 0.00 57.07 56.64 3k8l s TYR 270 Cb -0.17 -2.16 0.03 0.00 -0.11 0.00 0.00 41.96 39.55 3k8l s TYR 270 CO 0.56 0.22 1.12 0.34 -1.11 0.00 0.00 175.55 176.67 3k8l s ASP 271 N 0.47 6.72 0.00 2.29 -1.08 -1.26 -1.26 116.67 122.54 3k8l s ASP 271 Ca 0.07 0.63 0.22 0.00 -0.52 0.00 0.00 52.55 52.95 3k8l s ASP 271 Cb -0.12 -2.55 0.75 0.00 -1.46 0.00 0.00 42.92 39.55 3k8l s ASP 271 CO -0.01 -1.14 1.56 0.29 0.52 0.00 0.00 175.17 176.39 3k8l n LYS 272 N 7.55 1.80 0.00 4.34 4.76 0.38 -5.00 118.16 131.98 3k8l n LYS 272 Ca 0.12 -1.20 0.00 0.00 -2.87 0.00 0.00 58.31 54.36 3k8l n LYS 272 Cb 0.48 -1.42 0.00 0.00 -1.84 0.00 0.00 35.03 32.25 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 1.18 -0.37 3.50 0.72 0.00 -1.23 -4.89 105.19 104.10 3k8l n GLY 273 Ca 0.17 -1.60 -0.22 0.00 0.00 0.00 0.00 46.02 44.37 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 -0.94 -5.47 -2.16 1.61 5.03 -1.26 -2.45 115.26 109.62 3k8l n ASN 274 Ca 0.00 -0.54 -0.16 0.00 0.87 0.00 0.00 54.58 54.75 3k8l n ASN 274 Cb 0.00 -4.92 -0.03 0.00 -1.02 0.00 0.00 39.78 33.81 3k8l n ASN 274 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3k8l n ASN 275 N -2.92 -4.74 -4.26 6.41 3.02 -1.26 -4.78 115.26 106.73 3k8l n ASN 275 Ca -0.05 0.18 -0.34 0.00 -0.03 0.00 0.00 54.58 54.34 3k8l n ASN 275 Cb 0.58 -4.06 -0.15 0.00 -0.61 0.00 0.00 39.78 35.55 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 -2.71 2.94 0.08 2.41 1.01 -1.02 0.35 121.20 124.25 3k8l s ILE 276 Ca 0.00 -0.65 0.06 0.00 0.00 0.00 0.00 60.65 60.06 3k8l s ILE 276 Cb 0.00 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 40.13 3k8l s ILE 276 CO 0.00 0.47 -0.07 -0.31 0.00 0.00 0.00 174.94 175.03 3k8l s TYR 277 N 1.27 2.82 -0.04 3.97 2.02 0.93 -0.47 117.35 127.85 3k8l s TYR 277 Ca 0.03 -0.10 -0.11 0.00 -0.37 0.00 0.00 57.07 56.51 3k8l s TYR 277 Cb -0.14 -1.49 0.02 0.00 -0.40 0.00 0.00 41.96 39.94 3k8l s TYR 277 CO -0.05 0.42 0.26 -2.00 -1.57 0.00 0.00 175.55 172.61 3k8l s GLU 278 N -2.04 0.51 -0.28 -0.62 2.12 -0.39 -0.04 118.70 117.96 3k8l s GLU 278 Ca 0.21 -0.05 -0.19 0.00 0.36 0.00 0.00 54.97 55.30 3k8l s GLU 278 Cb -0.11 0.23 0.12 0.00 0.26 0.00 0.00 34.13 34.63 3k8l s GLU 278 CO 0.13 -0.12 0.94 -1.17 -0.54 0.00 0.00 175.26 174.50 3k8l s LEU 279 N -0.86 -0.57 -0.11 2.70 2.96 -0.61 -1.23 118.68 120.96 3k8l s LEU 279 Ca -0.09 0.97 0.02 0.00 -0.22 0.00 0.00 54.13 54.80 3k8l s LEU 279 Cb -0.05 1.92 -0.01 0.00 0.50 0.00 0.00 46.19 48.55 3k8l s LEU 279 CO 0.02 -0.16 -0.16 -0.89 -1.32 0.00 0.00 176.35 173.84 3k8l s THR 280 N 1.01 2.79 0.18 3.68 2.01 -1.26 0.04 115.64 124.09 3k8l s THR 280 Ca -0.05 -0.77 0.02 0.00 0.31 0.00 0.00 61.69 61.20 3k8l s THR 280 Cb -0.04 -2.14 -0.05 0.00 0.01 0.00 0.00 72.50 70.28 3k8l s THR 280 CO -0.12 0.54 -0.00 0.68 -0.69 0.00 0.00 174.62 175.02 3k8l s VAL 281 N 0.17 0.73 -1.22 3.82 -7.23 -0.78 -0.57 120.40 115.32 3k8l s VAL 281 Ca -0.09 -1.99 -0.13 0.00 -1.81 0.00 0.00 61.98 57.96 3k8l s VAL 281 Cb -0.15 -2.12 0.17 0.00 0.56 0.00 0.00 36.38 34.84 3k8l s VAL 281 CO 0.06 -0.48 1.49 -0.67 -0.31 0.00 0.00 175.10 175.18 3k8l n ASP 282 N -0.25 5.22 -4.76 4.85 -0.08 -1.26 -1.93 116.55 118.33 3k8l n ASP 282 Ca -0.07 -3.00 -0.39 0.00 -1.51 0.00 0.00 54.79 49.83 3k8l n ASP 282 Cb 0.63 -1.56 0.02 0.00 2.34 0.00 0.00 41.12 42.56 3k8l n ASP 282 CO 0.00 0.00 0.00 0.12 0.12 0.00 0.00 177.20 177.44 3k8l s PHE 283 N 1.36 2.45 -0.30 -0.67 5.36 -0.26 -4.83 117.98 121.09 3k8l s PHE 283 Ca 0.42 1.37 -0.05 0.00 -0.96 0.00 0.00 56.93 57.71 3k8l s PHE 283 Cb -0.01 -3.77 0.18 0.00 -0.34 0.00 0.00 43.02 39.08 3k8l s PHE 283 CO 0.00 -2.66 0.73 -2.00 -1.46 0.00 0.00 175.22 169.83 3k8l s GLU 284 N -2.69 0.46 -0.14 10.12 2.12 -1.25 -1.67 118.70 125.66 3k8l s GLU 284 Ca 0.66 0.82 -0.16 0.00 0.36 0.00 0.00 54.97 56.66 3k8l s GLU 284 Cb -0.40 0.46 0.04 0.00 0.26 0.00 0.00 34.13 34.49 3k8l s GLU 284 CO 0.48 -0.49 0.43 0.45 -0.54 0.00 0.00 175.26 175.59 3k8l s SER 285 N 2.88 -0.42 -0.10 -1.70 0.15 -0.68 -4.19 113.70 109.64 3k8l s SER 285 Ca 0.14 0.75 0.16 0.00 0.70 0.00 0.00 55.95 57.69 3k8l s SER 285 Cb -0.13 0.78 -0.24 0.00 -1.71 0.00 0.00 66.02 64.72 3k8l s SER 285 CO -0.18 -0.22 0.41 0.35 1.20 0.00 0.00 173.24 174.80 3k8l n THR 286 N 2.52 1.44 0.46 6.45 -2.24 -1.26 -1.36 114.28 120.30 3k8l n THR 286 Ca -0.15 -0.81 0.11 0.00 -2.27 0.00 0.00 64.05 60.93 3k8l n THR 286 Cb 0.57 -0.73 -0.10 0.00 -2.10 0.00 0.00 70.33 67.97 3k8l n THR 286 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 3k8l n TRP 287 N -2.88 0.11 0.00 4.78 4.27 -1.26 -4.73 117.44 117.73 3k8l n TRP 287 Ca -0.23 0.03 0.00 0.00 -3.89 0.00 0.00 57.50 53.41 3k8l n TRP 287 Cb 1.07 -0.35 0.00 0.00 -1.36 0.00 0.00 31.31 30.68 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 1.36 0.21 3.49 -1.67 0.00 -1.26 -4.65 105.19 102.67 3k8l n GLY 288 Ca 0.00 -1.93 -0.12 0.00 0.00 0.00 0.00 46.02 43.97 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 0.78 0.00 0.99 2.34 0.92 -4.10 118.68 119.61 3k8l s LEU 289 Ca 0.00 -1.28 -0.15 0.00 0.06 0.00 0.00 54.13 52.76 3k8l s LEU 289 Cb 0.00 1.46 0.02 0.00 -0.56 0.00 0.00 46.19 47.12 3k8l s LEU 289 CO 0.00 -1.20 0.32 -0.76 -1.06 0.00 0.00 176.35 173.65 3k8l s LEU 290 N -3.15 0.83 -0.12 1.48 1.43 -0.06 -1.10 118.68 117.98 3k8l s LEU 290 Ca 0.29 0.02 -0.03 0.00 -1.03 0.00 0.00 54.13 53.38 3k8l s LEU 290 Cb 0.00 1.32 -0.03 0.00 0.03 0.00 0.00 46.19 47.51 3k8l s LEU 290 CO 0.15 -0.50 -0.01 -0.63 0.23 0.00 0.00 176.35 175.59 3k8l s ILE 291 N -1.67 4.14 0.17 -0.59 -1.09 -0.68 -0.27 121.20 121.22 3k8l s ILE 291 Ca -0.11 -0.29 0.09 0.00 -2.23 0.00 0.00 60.65 58.11 3k8l s ILE 291 Cb -0.04 -2.77 -0.04 0.00 -1.58 0.00 0.00 42.46 38.02 3k8l s ILE 291 CO 0.02 0.55 -0.20 -0.13 -1.23 0.00 0.00 174.94 173.96 3k8l s ARG 292 N -0.32 1.34 0.00 2.79 0.52 0.09 -0.76 118.95 122.62 3k8l s ARG 292 Ca 0.06 -1.44 0.10 0.00 -0.52 0.00 0.00 55.73 53.93 3k8l s ARG 292 Cb -0.12 -1.47 0.24 0.00 0.52 0.00 0.00 34.95 34.12 3k8l s ARG 292 CO 0.02 0.30 1.16 0.25 0.02 0.00 0.00 175.30 177.06 3k8l n THR 293 N 0.28 0.85 -3.82 0.02 -2.24 -1.00 0.04 114.28 108.40 3k8l n THR 293 Ca -0.13 -0.92 -0.12 0.00 -2.27 0.00 0.00 64.05 60.61 3k8l n THR 293 Cb 0.57 0.61 -0.10 0.00 -2.10 0.00 0.00 70.33 69.31 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 -0.97 -0.09 -0.08 3.42 0.15 -1.26 -4.73 113.70 110.13 3k8l s SER 294 Ca 0.19 0.00 0.12 0.00 0.70 0.00 0.00 55.95 56.97 3k8l s SER 294 Cb 0.10 0.29 0.19 0.00 -1.71 0.00 0.00 66.02 64.89 3k8l s SER 294 CO 0.14 -0.35 1.08 -0.46 1.20 0.00 0.00 173.24 174.85 3k8l n ASN 295 N 1.64 1.75 -4.80 5.45 6.94 -1.26 -4.88 115.26 120.09 3k8l n ASN 295 Ca -0.21 -2.66 -0.31 0.00 -0.02 0.00 0.00 54.58 51.39 3k8l n ASN 295 Cb 0.56 -0.32 0.07 0.00 -2.36 0.00 0.00 39.78 37.74 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 -1.97 2.45 0.26 -2.53 0.00 -1.26 -4.95 121.76 113.76 3k8l s ALA 296 Ca 0.20 0.02 -0.05 0.00 0.00 0.00 0.00 51.96 52.14 3k8l s ALA 296 Cb 0.18 -3.17 0.30 0.00 0.00 0.00 0.00 23.12 20.43 3k8l s ALA 296 CO 0.02 -1.49 1.88 1.03 0.00 0.00 0.00 175.76 177.20 3k8l h SER 297 N -0.92 1.04 -3.38 0.00 0.87 -2.06 -3.41 113.55 105.71 3k8l h SER 297 Ca -0.45 -0.08 -0.55 0.00 -1.23 0.00 0.00 61.79 59.48 3k8l h SER 297 Cb 1.23 -0.27 -0.04 0.00 -0.44 0.00 0.00 62.40 62.89 3k8l h SER 297 CO 0.57 0.83 -0.01 0.12 -0.53 0.00 0.00 176.83 177.81 3k8l s PHE 298 N -5.80 3.68 -0.48 2.24 5.36 -1.26 -5.05 117.98 116.68 3k8l s PHE 298 Ca -0.12 1.22 -0.14 0.00 -0.96 0.00 0.00 56.93 56.93 3k8l s PHE 298 Cb 0.17 -2.48 0.09 0.00 -0.34 0.00 0.00 43.02 40.46 3k8l s PHE 298 CO 0.82 0.44 0.38 -1.58 -1.46 0.00 0.00 175.22 173.83 3k8l s TRP 299 N -1.39 3.28 0.48 10.12 0.52 -1.26 -4.94 118.94 125.75 3k8l s TRP 299 Ca 0.37 -1.23 -0.22 0.00 0.02 0.00 0.00 56.10 55.03 3k8l s TRP 299 Cb -0.17 -3.30 -0.07 0.00 -1.15 0.00 0.00 33.47 28.78 3k8l s TRP 299 CO 0.20 -0.88 1.19 -2.14 0.02 0.00 0.00 176.95 175.34 3k8l s PRO 300 N 1.56 3.63 0.35 4.98 0.02 -1.26 -4.94 135.00 139.33 3k8l s PRO 300 Ca 0.04 1.82 -0.27 0.00 0.02 0.00 0.00 61.00 62.61 3k8l s PRO 300 Cb -0.25 -2.34 -0.12 0.00 0.02 0.00 0.00 34.50 31.80 3k8l s PRO 300 CO 0.04 -0.67 1.21 -1.13 -0.33 0.00 0.00 177.00 176.11 3k8l n SER 301 N -0.65 2.31 0.00 2.53 3.41 -1.26 -2.24 113.62 117.73 3k8l n SER 301 Ca 0.08 1.17 0.00 0.00 -0.26 0.00 0.00 58.87 59.86 3k8l n SER 301 Cb 0.48 -1.44 0.00 0.00 -0.26 0.00 0.00 64.21 62.99 3k8l n SER 301 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k8l n GLY 302 N 0.90 0.90 0.70 5.00 0.00 -1.26 -4.87 105.19 106.55 3k8l n GLY 302 Ca 0.06 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.21 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 -2.07 0.00 -3.61 2.61 -2.24 -0.95 -4.85 114.28 103.17 3k8l n THR 303 Ca 0.00 -0.36 -0.38 0.00 -2.27 0.00 0.00 64.05 61.03 3k8l n THR 303 Cb 0.00 1.10 -0.11 0.00 -2.10 0.00 0.00 70.33 69.22 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 -2.12 3.83 -0.17 -0.78 2.20 -1.26 -2.39 119.74 119.05 3k8l s LYS 304 Ca 0.29 -0.40 -0.02 0.00 -0.36 0.00 0.00 55.97 55.48 3k8l s LYS 304 Cb 0.20 -3.63 -0.01 0.00 -1.51 0.00 0.00 37.83 32.88 3k8l s LYS 304 CO 0.37 -0.22 -0.10 0.71 -0.36 0.00 0.00 175.35 175.75 3k8l s TYR 305 N 1.73 2.87 0.00 4.03 1.51 0.06 -4.56 117.35 123.00 3k8l s TYR 305 Ca 0.07 -0.87 0.00 0.00 -1.01 0.00 0.00 57.07 55.25 3k8l s TYR 305 Cb -0.16 -1.96 0.00 0.00 -0.11 0.00 0.00 41.96 39.72 3k8l s TYR 305 CO 0.10 -0.42 0.00 0.41 -1.11 0.00 0.00 175.55 174.53 3k8l n GLY 306 N 4.18 4.26 3.78 0.71 0.00 -0.81 -1.68 105.19 115.63 3k8l n GLY 306 Ca -0.18 -0.77 -0.39 0.00 0.00 0.00 0.00 46.02 44.68 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 -1.43 3.44 0.31 4.61 0.00 -0.42 -1.15 121.76 127.12 3k8l s ALA 307 Ca 0.00 0.33 0.31 0.00 0.00 0.00 0.00 51.96 52.60 3k8l s ALA 307 Cb 0.00 -2.94 1.46 0.00 0.00 0.00 0.00 23.12 21.64 3k8l s ALA 307 CO 0.00 0.30 2.04 0.66 0.00 0.00 0.00 175.76 178.76 3k8l h SER 308 N 4.13 0.00 -5.02 0.00 4.64 -1.88 -0.08 113.55 115.34 3k8l h SER 308 Ca -0.47 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.79 3k8l h SER 308 Cb 1.20 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.13 3k8l h SER 308 CO 0.66 0.09 0.04 -0.55 -0.87 0.00 0.00 176.83 176.20 3k8l s SER 309 N -5.90 -0.44 0.09 4.97 0.15 -1.26 -4.78 113.70 106.53 3k8l s SER 309 Ca -0.01 0.18 0.17 0.00 0.70 0.00 0.00 55.95 56.98 3k8l s SER 309 Cb 0.11 0.49 0.71 0.00 -1.71 0.00 0.00 66.02 65.63 3k8l s SER 309 CO 0.56 -0.72 1.52 -1.54 1.20 0.00 0.00 173.24 174.26 3k8l n SER 310 N 0.41 0.23 0.06 5.45 3.41 -1.26 -1.93 113.62 120.00 3k8l n SER 310 Ca -0.18 0.56 0.13 0.00 -0.26 0.00 0.00 58.87 59.11 3k8l n SER 310 Cb 0.60 -0.61 0.34 0.00 -0.26 0.00 0.00 64.21 64.28 3k8l n SER 310 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3k8l n SER 311 N -1.76 0.62 -4.52 4.04 3.41 -1.26 -4.69 113.62 109.46 3k8l n SER 311 Ca 0.03 0.31 -0.43 0.00 -0.26 0.00 0.00 58.87 58.52 3k8l n SER 311 Cb 0.17 -0.29 -0.05 0.00 -0.26 0.00 0.00 64.21 63.79 3k8l n SER 311 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3k8l s GLU 312 N -3.10 3.35 0.40 4.33 0.41 -0.81 -5.03 118.70 118.24 3k8l s GLU 312 Ca 0.10 -0.24 0.08 0.00 -0.41 0.00 0.00 54.97 54.49 3k8l s GLU 312 Cb 0.14 -4.02 -0.00 0.00 -1.78 0.00 0.00 34.13 28.47 3k8l s GLU 312 CO 0.64 -1.36 0.49 0.15 -0.49 0.00 0.00 175.26 174.69 3k8l s LYS 313 N 3.68 2.81 -0.15 1.61 -0.14 -1.26 -4.57 119.74 121.72 3k8l s LYS 313 Ca 0.30 -1.27 -0.05 0.00 -1.36 0.00 0.00 55.97 53.59 3k8l s LYS 313 Cb -0.13 -2.67 -0.03 0.00 -1.68 0.00 0.00 37.83 33.32 3k8l s LYS 313 CO 0.20 -0.17 0.02 -1.17 -0.76 0.00 0.00 175.35 173.46 3k8l s LEU 314 N -4.25 3.59 0.06 3.17 2.96 0.12 -4.82 118.68 119.52 3k8l s LEU 314 Ca 0.51 0.04 0.08 0.00 -0.22 0.00 0.00 54.13 54.54 3k8l s LEU 314 Cb -0.08 -1.87 -0.03 0.00 0.50 0.00 0.00 46.19 44.71 3k8l s LEU 314 CO 0.31 0.23 -0.22 0.00 -1.32 0.00 0.00 176.35 175.35 3k8l s ALA 315 N 0.02 1.91 0.38 5.97 0.00 -1.26 0.09 121.76 128.88 3k8l s ALA 315 Ca 0.03 -1.17 -0.28 0.00 0.00 0.00 0.00 51.96 50.54 3k8l s ALA 315 Cb -0.13 -0.35 -0.10 0.00 0.00 0.00 0.00 23.12 22.54 3k8l s ALA 315 CO 0.02 0.43 1.45 -0.51 0.00 0.00 0.00 175.76 177.14 3k8l s LEU 316 N -1.43 4.31 -1.36 0.00 1.43 -1.26 -3.28 118.68 117.09 3k8l s LEU 316 Ca 0.09 2.97 -0.02 0.00 -1.03 0.00 0.00 54.13 56.14 3k8l s LEU 316 Cb -0.09 -3.70 0.01 0.00 0.03 0.00 0.00 46.19 42.44 3k8l s LEU 316 CO 0.03 -0.86 0.70 0.59 0.23 0.00 0.00 176.35 177.04 3k8l n ASN 317 N 0.42 -1.55 -3.68 2.29 3.02 0.35 -4.99 115.26 111.11 3k8l n ASN 317 Ca 0.01 -0.84 -0.10 0.00 -0.03 0.00 0.00 54.58 53.62 3k8l n ASN 317 Cb 0.40 -3.88 -0.11 0.00 -0.61 0.00 0.00 39.78 35.59 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 -6.16 0.33 0.06 3.52 2.20 -1.21 -5.05 119.74 113.43 3k8l s LYS 318 Ca 0.10 0.83 -0.35 0.00 -0.36 0.00 0.00 55.97 56.19 3k8l s LYS 318 Cb -0.05 0.07 -0.14 0.00 -1.51 0.00 0.00 37.83 36.19 3k8l s LYS 318 CO 0.83 -0.20 1.58 -0.25 -0.36 0.00 0.00 175.35 176.95 3k8l n ASP 319 N 4.69 2.68 -4.27 1.43 8.00 -1.26 -4.65 116.55 123.17 3k8l n ASP 319 Ca -0.18 1.07 -0.34 0.00 0.71 0.00 0.00 54.79 56.06 3k8l n ASP 319 Cb 0.53 -1.32 -0.15 0.00 -0.02 0.00 0.00 41.12 40.15 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 1.57 2.84 -0.51 1.24 5.36 0.93 -4.95 117.98 124.47 3k8l s PHE 320 Ca 0.85 -1.07 -0.28 0.00 -0.96 0.00 0.00 56.93 55.46 3k8l s PHE 320 Cb -0.79 -1.96 0.03 0.00 -0.34 0.00 0.00 43.02 39.95 3k8l s PHE 320 CO 0.45 -0.53 1.14 0.15 -1.46 0.00 0.00 175.22 174.97 3k8l s LYS 321 N 1.07 3.64 0.31 10.12 1.02 -1.26 -0.86 119.74 133.78 3k8l s LYS 321 Ca -0.00 0.43 -0.26 0.00 0.02 0.00 0.00 55.97 56.17 3k8l s LYS 321 Cb -0.15 -3.94 -0.10 0.00 -0.52 0.00 0.00 37.83 33.12 3k8l s LYS 321 CO -0.03 -1.46 0.92 -0.51 -0.92 0.00 0.00 175.35 173.35 3k8l s LEU 322 N 4.55 4.34 0.06 3.17 1.43 -0.51 -4.67 118.68 127.05 3k8l s LEU 322 Ca 0.46 1.80 0.06 0.00 -1.03 0.00 0.00 54.13 55.42 3k8l s LEU 322 Cb -0.07 -3.97 -0.03 0.00 0.03 0.00 0.00 46.19 42.14 3k8l s LEU 322 CO 0.30 -0.06 -0.17 0.28 0.23 0.00 0.00 176.35 176.93 3k8l s THR 323 N -1.60 1.40 -0.17 5.49 -1.32 -0.30 -4.11 115.64 115.03 3k8l s THR 323 Ca 0.49 -1.24 0.18 0.00 -1.21 0.00 0.00 61.69 59.91 3k8l s THR 323 Cb -0.18 -1.26 -0.25 0.00 -1.51 0.00 0.00 72.50 69.29 3k8l s THR 323 CO 0.24 -0.01 0.18 -3.20 -2.21 0.00 0.00 174.62 169.62 3k8l n ASN 324 N 1.57 0.11 -4.58 8.08 5.15 -1.26 -1.93 115.26 122.39 3k8l n ASN 324 Ca -0.19 0.05 -0.41 0.00 -0.60 0.00 0.00 54.58 53.43 3k8l n ASN 324 Cb 0.54 0.94 0.01 0.00 -0.53 0.00 0.00 39.78 40.75 3k8l n ASN 324 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3k8l n ALA 325 N -2.69 -0.17 -0.14 5.20 0.00 -1.26 -4.77 120.51 116.68 3k8l n ALA 325 Ca -0.29 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.36 3k8l n ALA 325 Cb 1.10 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 18.53 3k8l n ALA 325 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k8l n GLY 326 N 1.31 2.60 2.98 0.00 0.00 -1.26 -3.44 105.19 107.39 3k8l n GLY 326 Ca 0.10 -0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 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 4.61 0.44 1.61 2.47 -1.26 -4.89 114.94 113.92 3k8l s ASN 327 Ca 0.00 -3.06 -0.23 0.00 0.42 0.00 0.00 52.86 49.99 3k8l s ASN 327 Cb 0.00 -1.70 -0.11 0.00 -1.45 0.00 0.00 41.25 37.99 3k8l s ASN 327 CO 0.00 -0.25 0.82 -2.65 -3.72 0.00 0.00 177.10 171.30 3k8l n PRO 328 N 3.08 0.99 -1.83 0.43 -0.02 -1.22 -4.98 135.00 131.45 3k8l n PRO 328 Ca 0.07 0.36 -0.31 0.00 -2.02 0.00 0.00 63.50 61.61 3k8l n PRO 328 Cb 0.34 -1.84 0.04 0.00 -0.02 0.00 0.00 33.50 32.01 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 -1.37 2.91 0.58 3.55 0.00 -0.04 -4.77 121.76 122.62 3k8l s ALA 329 Ca 0.64 -0.20 -0.19 0.00 0.00 0.00 0.00 51.96 52.21 3k8l s ALA 329 Cb -0.56 -3.07 -0.04 0.00 0.00 0.00 0.00 23.12 19.45 3k8l s ALA 329 CO 0.56 -1.01 1.22 -0.80 0.00 0.00 0.00 175.76 175.73 3k8l s ASN 330 N -4.21 5.26 -0.33 0.00 0.01 -1.26 -1.30 114.94 113.10 3k8l s ASN 330 Ca 0.57 2.41 -0.20 0.00 -0.71 0.00 0.00 52.86 54.93 3k8l s ASN 330 Cb -0.12 -2.60 -0.00 0.00 0.41 0.00 0.00 41.25 38.94 3k8l s ASN 330 CO 0.53 -1.55 0.62 -0.63 -1.51 0.00 0.00 177.10 174.56 3k8l s ILE 331 N -1.57 4.93 0.12 0.60 1.01 -0.26 -4.50 121.20 121.53 3k8l s ILE 331 Ca 0.76 0.68 0.07 0.00 0.00 0.00 0.00 60.65 62.17 3k8l s ILE 331 Cb -0.31 -4.02 -0.04 0.00 0.01 0.00 0.00 42.46 38.10 3k8l s ILE 331 CO 0.34 -0.22 -0.09 -0.04 0.00 0.00 0.00 174.94 174.93 3k8l s MET 332 N 2.62 2.15 0.43 2.79 -1.94 -1.26 -0.06 119.30 124.03 3k8l s MET 332 Ca 0.24 -1.05 -0.22 0.00 -1.71 0.00 0.00 55.69 52.95 3k8l s MET 332 Cb -0.15 -2.30 -0.10 0.00 2.01 0.00 0.00 34.83 34.29 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 -1.31 3.25 -1.61 -0.03 0.08 -1.26 0.16 117.98 117.26 3k8l s PHE 333 Ca 0.22 1.63 0.05 0.00 0.12 0.00 0.00 56.93 58.95 3k8l s PHE 333 Cb -0.11 -2.98 0.24 0.00 -0.57 0.00 0.00 43.02 39.60 3k8l s PHE 333 CO 0.14 -0.40 0.90 -0.40 -0.10 0.00 0.00 175.22 175.37 3k8l n ASP 334 N -0.47 0.00 0.04 1.36 5.75 0.11 -0.65 116.55 122.69 3k8l n ASP 334 Ca 0.07 0.10 0.12 0.00 -0.01 0.00 0.00 54.79 55.07 3k8l n ASP 334 Cb 0.52 -0.19 0.14 0.00 -1.03 0.00 0.00 41.12 40.55 3k8l n ASP 334 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3k8l n SER 335 N -1.19 0.64 -4.49 -1.12 3.41 -1.26 -4.68 113.62 104.92 3k8l n SER 335 Ca 0.03 -0.04 -0.43 0.00 -0.26 0.00 0.00 58.87 58.17 3k8l n SER 335 Cb 0.03 0.37 -0.03 0.00 -0.26 0.00 0.00 64.21 64.32 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 -3.15 3.41 0.13 4.33 -0.21 0.18 -4.76 119.66 119.59 3k8l s GLN 336 Ca 0.06 -1.17 0.08 0.00 0.02 0.00 0.00 55.36 54.36 3k8l s GLN 336 Cb 0.14 -4.74 -0.04 0.00 1.00 0.00 0.00 33.01 29.37 3k8l s GLN 336 CO 0.74 -1.93 -0.20 -0.65 -2.12 0.00 0.00 175.29 171.13 3k8l s GLN 337 N 3.97 1.20 0.34 2.91 -1.52 -1.26 -4.89 119.66 120.41 3k8l s GLN 337 Ca 0.33 -1.28 -0.23 0.00 -1.95 0.00 0.00 55.36 52.23 3k8l s GLN 337 Cb -0.07 -1.39 -0.10 0.00 -0.22 0.00 0.00 33.01 31.23 3k8l s GLN 337 CO -0.01 0.31 0.91 0.42 -0.25 0.00 0.00 175.29 176.66 3k8l s ILE 338 N -1.54 4.33 -0.14 1.08 1.01 -1.26 -4.49 121.20 120.19 3k8l s ILE 338 Ca 0.11 1.62 -0.08 0.00 0.00 0.00 0.00 60.65 62.30 3k8l s ILE 338 Cb -0.08 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.48 3k8l s ILE 338 CO 0.05 0.01 0.14 -0.89 0.00 0.00 0.00 174.94 174.25 3k8l s THR 339 N -1.77 5.48 0.19 2.92 2.01 -1.26 -4.47 115.64 118.74 3k8l s THR 339 Ca 0.53 0.20 0.10 0.00 0.31 0.00 0.00 61.69 62.83 3k8l s THR 339 Cb -0.15 -3.41 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 3k8l s THR 339 CO 0.20 0.58 -0.17 -0.31 -0.69 0.00 0.00 174.62 174.22 3k8l s TYR 340 N -0.69 2.45 0.12 4.92 2.02 0.13 -0.83 117.35 125.46 3k8l s TYR 340 Ca 0.13 -0.30 0.07 0.00 -0.37 0.00 0.00 57.07 56.61 3k8l s TYR 340 Cb -0.12 -1.19 -0.04 0.00 -0.40 0.00 0.00 41.96 40.21 3k8l s TYR 340 CO 0.03 0.52 -0.18 -0.59 -1.57 0.00 0.00 175.55 173.76 3k8l s PHE 341 N -1.74 1.65 0.07 2.71 -0.12 0.10 -0.71 117.98 119.94 3k8l s PHE 341 Ca 0.23 -0.47 -0.21 0.00 -0.05 0.00 0.00 56.93 56.43 3k8l s PHE 341 Cb -0.08 -0.87 -0.07 0.00 -0.63 0.00 0.00 43.02 41.38 3k8l s PHE 341 CO 0.12 0.22 0.63 -1.58 -0.05 0.00 0.00 175.22 174.56 3k8l s HIS 342 N -1.68 3.79 -0.30 3.49 5.65 -0.79 -1.43 115.29 124.02 3k8l s HIS 342 Ca 0.09 1.34 -0.00 0.00 0.25 0.00 0.00 55.06 56.74 3k8l s HIS 342 Cb -0.07 -2.60 0.14 0.00 -1.18 0.00 0.00 32.58 28.86 3k8l s HIS 342 CO 0.04 0.50 0.30 0.45 -0.65 0.00 0.00 174.74 175.38 3k8l s SER 343 N -0.82 1.69 0.33 9.88 0.15 -0.11 -1.32 113.70 123.50 3k8l s SER 343 Ca 0.31 -0.88 0.05 0.00 0.70 0.00 0.00 55.95 56.14 3k8l s SER 343 Cb -0.20 0.48 0.69 0.00 -1.71 0.00 0.00 66.02 65.27 3k8l s SER 343 CO 0.20 -0.38 1.91 -0.74 1.20 0.00 0.00 173.24 175.43 3k8l h HIS 344 N 8.13 0.90 0.00 3.44 2.76 -1.93 -1.30 115.15 127.14 3k8l h HIS 344 Ca -0.11 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.08 3k8l h HIS 344 Cb 1.07 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 29.74 3k8l h HIS 344 CO 0.29 0.42 0.00 1.19 -1.30 0.00 0.00 177.93 178.53 3k8l n PHE 345 N -4.52 0.00 -3.83 5.26 3.72 -1.26 -4.87 117.46 111.95 3k8l n PHE 345 Ca 0.14 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.28 3k8l n PHE 345 Cb 0.31 -0.01 0.03 0.00 -0.94 0.00 0.00 39.48 38.86 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 -3.46 -0.03 -1.35 0.00 -1.32 -1.26 -5.00 115.64 103.22 3k8l s THR 347 Ca 0.40 0.12 0.00 0.00 -1.21 0.00 0.00 61.69 61.01 3k8l s THR 347 Cb -0.20 -0.21 0.00 0.00 -1.51 0.00 0.00 72.50 70.58 3k8l s THR 347 CO 0.82 0.05 0.67 -0.90 -2.21 0.00 0.00 174.62 173.05 3k8l n ASP 348 N 3.82 0.64 0.09 8.08 5.68 -1.26 -2.33 116.55 131.28 3k8l n ASP 348 Ca -0.22 -1.97 0.09 0.00 -0.50 0.00 0.00 54.79 52.19 3k8l n ASP 348 Cb 0.54 -0.32 -0.01 0.00 -1.14 0.00 0.00 41.12 40.19 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 0.01 0.00 -2.56 2.11 4.06 -1.95 -3.42 115.95 114.20 3k8l h TRP 349 Ca 0.00 0.00 -0.59 0.00 2.06 0.00 0.00 58.89 60.36 3k8l h TRP 349 Cb 0.32 0.00 -0.12 0.00 -1.00 0.00 0.00 29.16 28.37 3k8l h TRP 349 CO 0.00 0.10 -0.68 -0.06 -3.56 0.00 0.00 178.44 174.24 3k8l s PHE 350 N -3.28 2.67 -0.13 0.49 0.08 -0.98 -0.46 117.98 116.36 3k8l s PHE 350 Ca -0.01 -0.22 -0.04 0.00 0.12 0.00 0.00 56.93 56.79 3k8l s PHE 350 Cb 0.09 -1.23 0.06 0.00 -0.57 0.00 0.00 43.02 41.37 3k8l s PHE 350 CO 0.79 0.58 0.17 0.00 -0.10 0.00 0.00 175.22 176.66 3k8l s ALA 351 N -2.05 -0.11 0.30 5.36 0.00 -0.45 -4.71 121.76 120.10 3k8l s ALA 351 Ca 0.29 0.36 -0.29 0.00 0.00 0.00 0.00 51.96 52.31 3k8l s ALA 351 Cb -0.07 -0.98 -0.11 0.00 0.00 0.00 0.00 23.12 21.96 3k8l s ALA 351 CO 0.18 -0.82 1.48 -0.51 0.00 0.00 0.00 175.76 176.09 3k8l s ASP 352 N 2.28 6.52 0.44 0.00 1.11 -0.43 -1.93 116.67 124.66 3k8l s ASP 352 Ca 0.04 2.83 -0.18 0.00 0.18 0.00 0.00 52.55 55.42 3k8l s ASP 352 Cb -0.14 -2.64 -0.10 0.00 1.07 0.00 0.00 42.92 41.12 3k8l s ASP 352 CO -0.08 -0.78 0.92 -0.76 1.18 0.00 0.00 175.17 175.65 3k8l s LEU 353 N -0.90 3.85 -0.11 1.23 1.43 0.05 -4.03 118.68 120.20 3k8l s LEU 353 Ca 0.58 1.56 -0.00 0.00 -1.03 0.00 0.00 54.13 55.24 3k8l s LEU 353 Cb -0.44 -4.44 -0.02 0.00 0.03 0.00 0.00 46.19 41.32 3k8l s LEU 353 CO 0.49 -0.41 -0.09 0.21 0.23 0.00 0.00 176.35 176.78 3k8l s ASN 354 N -2.52 4.36 0.00 2.29 2.47 0.95 -4.86 114.94 117.63 3k8l s ASN 354 Ca 0.59 -0.19 0.01 0.00 0.42 0.00 0.00 52.86 53.69 3k8l s ASN 354 Cb -0.10 -1.48 0.01 0.00 -1.45 0.00 0.00 41.25 38.24 3k8l s ASN 354 CO 0.20 0.23 0.50 -1.22 -3.72 0.00 0.00 177.10 173.09 3k8l n TYR 355 N 3.12 0.00 -3.32 0.43 4.01 -1.26 -4.54 117.16 115.59 3k8l n TYR 355 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.57 3k8l n TYR 355 Cb 0.53 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.55 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 0.18 -2.04 3.69 2.72 0.00 -1.26 -4.00 105.19 104.48 3k8l n GLY 356 Ca 0.01 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 44.20 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 -0.43 2.09 -0.32 1.61 -0.02 -1.26 -4.71 135.00 131.96 3k8l n PRO 357 Ca 0.00 0.73 0.11 0.00 -2.02 0.00 0.00 63.50 62.32 3k8l n PRO 357 Cb 0.01 -2.31 0.28 0.00 -0.02 0.00 0.00 33.50 31.46 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 2.50 0.66 0.00 -1.45 3.04 -1.89 0.65 116.25 119.75 3k8l h VAL 358 Ca -0.46 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.02 3k8l h VAL 358 Cb 1.29 -0.01 0.00 0.00 -2.01 0.00 0.00 31.29 30.55 3k8l h VAL 358 CO 0.62 0.11 0.00 0.47 -1.01 0.00 0.00 177.57 177.77 3k8l n ASP 359 N -4.87 0.00 -0.27 3.17 8.00 -1.26 -1.88 116.55 119.44 3k8l n ASP 359 Ca 0.20 0.07 0.03 0.00 0.71 0.00 0.00 54.79 55.81 3k8l n ASP 359 Cb 0.54 -0.31 0.03 0.00 -0.02 0.00 0.00 41.12 41.36 3k8l n ASP 359 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3k8l n GLN 360 N -1.31 0.21 -0.34 -1.24 6.02 0.13 -4.77 117.38 116.08 3k8l n GLN 360 Ca 0.08 -0.98 0.12 0.00 -0.01 0.00 0.00 57.00 56.21 3k8l n GLN 360 Cb 0.16 -1.13 0.30 0.00 1.02 0.00 0.00 30.24 30.59 3k8l n GLN 360 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3k8l h ALA 361 N 1.27 1.56 0.00 -1.58 0.00 -0.57 -1.45 119.26 118.49 3k8l h ALA 361 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3k8l h ALA 361 Cb 0.31 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3k8l h ALA 361 CO 0.00 -0.08 0.00 0.78 0.00 0.00 0.00 179.25 179.95 3k8l h GLY 362 N 0.70 0.00 -1.73 0.00 0.00 -1.86 -1.56 103.07 98.63 3k8l h GLY 362 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.88 3k8l h GLY 362 CO -0.39 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.33 3k8l n GLU 363 N -2.71 2.25 -2.56 4.80 -0.58 -0.55 -4.65 120.64 116.65 3k8l n GLU 363 Ca -0.02 -2.03 -0.35 0.00 -0.42 0.00 0.00 57.16 54.34 3k8l n GLU 363 Cb 0.06 -1.38 -0.04 0.00 -0.57 0.00 0.00 31.44 29.51 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 -1.16 6.63 0.37 1.62 1.04 -0.59 -4.94 113.70 116.67 3k8l s SER 364 Ca 0.30 1.98 0.16 0.00 0.48 0.00 0.00 55.95 58.87 3k8l s SER 364 Cb 0.17 -2.57 0.70 0.00 0.10 0.00 0.00 66.02 64.41 3k8l s SER 364 CO 0.23 -0.58 1.77 1.55 0.98 0.00 0.00 173.24 177.19 3k8l h PRO 365 N 2.17 0.00 -0.30 4.02 0.13 -1.90 -2.63 132.00 133.48 3k8l h PRO 365 Ca -0.49 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.61 3k8l h PRO 365 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 3k8l h PRO 365 CO 0.61 0.40 0.07 0.00 -0.23 0.00 0.00 178.00 178.86 3k8l h ALA 366 N 1.60 0.40 -0.29 -0.56 0.00 -1.88 -1.85 119.26 116.68 3k8l h ALA 366 Ca -0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 3k8l h ALA 366 Cb 0.81 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3k8l h ALA 366 CO 0.05 0.06 0.12 -0.92 0.00 0.00 0.00 179.25 178.57 3k8l h TYR 367 N 0.33 0.44 -0.72 0.00 3.20 -1.79 -1.32 116.97 117.10 3k8l h TYR 367 Ca 0.10 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 61.97 3k8l h TYR 367 Cb 0.29 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.39 3k8l h TYR 367 CO 0.01 0.42 0.45 1.96 -1.64 0.00 0.00 178.16 179.37 3k8l h GLN 368 N 0.32 0.85 -0.17 1.82 4.20 -1.37 0.52 115.11 121.29 3k8l h GLN 368 Ca 0.10 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 3k8l h GLN 368 Cb 0.17 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 3k8l h GLN 368 CO -0.01 0.57 -0.01 0.00 -0.67 0.00 0.00 178.83 178.71 3k8l h ALA 369 N 1.31 0.24 -0.20 3.87 0.00 -1.21 -0.06 119.26 123.20 3k8l h ALA 369 Ca 0.29 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 3k8l h ALA 369 Cb 0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3k8l h ALA 369 CO -0.11 -0.04 -0.43 0.97 0.00 0.00 0.00 179.25 179.64 3k8l h ILE 370 N 0.05 1.31 -0.29 0.00 2.10 -0.95 -2.09 117.51 117.64 3k8l h ILE 370 Ca 0.05 -1.61 -0.11 0.00 1.08 0.00 0.00 64.86 64.27 3k8l h ILE 370 Cb 0.41 1.62 -0.01 0.00 -1.09 0.00 0.00 36.82 37.76 3k8l h ILE 370 CO 0.01 0.50 -0.26 0.00 -1.08 0.00 0.00 178.15 177.32 3k8l h ALA 371 N 1.13 0.42 -0.66 0.18 0.00 0.10 -2.52 119.26 117.91 3k8l h ALA 371 Ca 0.03 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 3k8l h ALA 371 Cb 0.92 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 3k8l h ALA 371 CO 0.08 0.41 0.29 0.22 0.00 0.00 0.00 179.25 180.25 3k8l h ASP 372 N 0.43 0.87 -0.39 0.00 3.58 -0.89 -1.82 116.42 118.21 3k8l h ASP 372 Ca 0.05 -0.11 -0.06 0.00 0.42 0.00 0.00 57.03 57.34 3k8l h ASP 372 Cb 0.82 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.63 3k8l h ASP 372 CO 0.07 0.76 0.06 0.00 -2.88 0.00 0.00 179.24 177.25 3k8l h ALA 373 N 1.37 1.24 -0.37 -0.78 0.00 -1.30 -2.22 119.26 117.20 3k8l h ALA 373 Ca 0.23 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 3k8l h ALA 373 Cb 0.15 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3k8l h ALA 373 CO -0.02 0.52 -0.15 0.00 0.00 0.00 0.00 179.25 179.60 3k8l h ALA 374 N 1.37 1.05 -0.32 0.00 0.00 -0.90 -2.17 119.26 118.29 3k8l h ALA 374 Ca 0.15 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 3k8l h ALA 374 Cb 0.34 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3k8l h ALA 374 CO 0.01 0.58 -0.10 0.87 0.00 0.00 0.00 179.25 180.61 3k8l h LYS 375 N 0.61 0.54 -0.20 0.00 1.57 -0.97 -2.14 116.57 115.98 3k8l h LYS 375 Ca 0.10 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 3k8l h LYS 375 Cb 0.60 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 3k8l h LYS 375 CO 0.04 0.64 0.09 0.78 -0.57 0.00 0.00 179.45 180.42 3k8l h GLY 376 N 0.92 0.28 1.82 3.86 0.00 -0.80 0.81 103.07 109.97 3k8l h GLY 376 Ca 0.10 -0.12 -0.19 0.00 0.00 0.00 0.00 47.33 47.11 3k8l h GLY 376 CO 0.03 0.11 -1.00 1.49 0.00 0.00 0.00 176.54 177.17 3k8l h TRP 377 N 0.27 0.00 -0.33 5.60 4.06 -1.27 -3.08 115.95 121.21 3k8l h TRP 377 Ca 0.07 0.00 -0.16 0.00 2.06 0.00 0.00 58.89 60.86 3k8l h TRP 377 Cb 0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.20 3k8l h TRP 377 CO 0.00 0.86 -0.43 0.82 -3.56 0.00 0.00 178.44 176.14 3k8l h ILE 378 N 0.00 1.28 0.00 1.49 2.04 -0.72 -1.88 117.51 119.72 3k8l h ILE 378 Ca -0.05 -1.61 0.00 0.00 1.00 0.00 0.00 64.86 64.20 3k8l h ILE 378 Cb 1.70 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 39.26 3k8l h ILE 378 CO 0.10 0.53 0.00 0.00 0.00 0.00 0.00 178.15 178.78 3k8l h ALA 379 N 0.84 1.00 -0.28 1.87 0.00 -0.89 -1.11 119.26 120.69 3k8l h ALA 379 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3k8l h ALA 379 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3k8l h ALA 379 CO 0.10 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.89 3k8l n ARG 380 N -2.33 2.09 0.00 0.00 1.74 -0.79 -4.93 116.66 112.43 3k8l n ARG 380 Ca 0.01 -1.64 0.00 0.00 -0.77 0.00 0.00 57.85 55.45 3k8l n ARG 380 Cb 0.19 -1.44 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 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 1.30 0.31 3.69 -0.13 0.00 -0.42 -4.98 105.19 104.95 3k8l n GLY 381 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.96 1.32 0.23 1.61 0.31 -0.78 -4.82 118.33 114.25 3k8l n VAL 382 Ca 0.00 -0.33 0.11 0.00 -0.01 0.00 0.00 64.34 64.11 3k8l n VAL 382 Cb 0.00 -1.55 -0.05 0.00 -0.91 0.00 0.00 33.84 31.33 3k8l n VAL 382 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3k8l n ASP 383 N 1.68 0.50 -3.66 4.52 8.00 -0.24 -4.65 116.55 122.69 3k8l n ASP 383 Ca 0.09 0.03 0.01 0.00 0.71 0.00 0.00 54.79 55.63 3k8l n ASP 383 Cb 0.34 1.07 0.01 0.00 -0.02 0.00 0.00 41.12 42.52 3k8l n ASP 383 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3k8l s GLY 384 N -4.17 -0.06 0.02 0.44 0.00 -1.20 -2.93 107.32 99.42 3k8l s GLY 384 Ca -0.02 -0.06 0.02 0.00 0.00 0.00 0.00 44.72 44.66 3k8l s GLY 384 CO 0.83 4.35 -0.06 1.08 0.00 0.00 0.00 173.10 179.31 3k8l s LEU 385 N -3.64 2.15 -0.25 0.66 1.43 0.19 -2.16 118.68 117.05 3k8l s LEU 385 Ca 0.26 -0.34 -0.07 0.00 -1.03 0.00 0.00 54.13 52.95 3k8l s LEU 385 Cb -0.01 -0.17 -0.02 0.00 0.03 0.00 0.00 46.19 46.02 3k8l s LEU 385 CO 0.01 -0.10 0.06 -0.60 0.23 0.00 0.00 176.35 175.95 3k8l s ARG 386 N -0.94 3.53 -0.25 1.70 3.00 -0.07 -0.96 118.95 124.96 3k8l s ARG 386 Ca -0.06 -0.56 -0.15 0.00 -1.00 0.00 0.00 55.73 53.97 3k8l s ARG 386 Cb -0.06 -3.29 -0.04 0.00 0.00 0.00 0.00 34.95 31.55 3k8l s ARG 386 CO 0.00 -0.23 0.36 -0.51 0.00 0.00 0.00 175.30 174.92 3k8l s LEU 387 N 1.58 4.07 0.29 -0.88 1.43 0.43 -0.55 118.68 125.04 3k8l s LEU 387 Ca 0.06 0.32 -0.28 0.00 -1.03 0.00 0.00 54.13 53.19 3k8l s LEU 387 Cb -0.15 -2.42 -0.09 0.00 0.03 0.00 0.00 46.19 43.56 3k8l s LEU 387 CO 0.03 -0.14 1.02 -0.62 0.23 0.00 0.00 176.35 176.87 3k8l s ASP 388 N 1.46 7.34 -1.54 2.29 2.15 -1.01 -1.42 116.67 125.94 3k8l s ASP 388 Ca 0.15 2.07 -0.12 0.00 0.43 0.00 0.00 52.55 55.09 3k8l s ASP 388 Cb -0.15 -2.61 0.12 0.00 -0.30 0.00 0.00 42.92 39.97 3k8l s ASP 388 CO 0.09 -0.08 0.29 0.00 -0.17 0.00 0.00 175.17 175.30 3k8l n ALA 389 N 1.04 -1.45 0.31 3.66 0.00 -1.25 -4.55 120.51 118.27 3k8l n ALA 389 Ca -0.00 -0.27 0.18 0.00 0.00 0.00 0.00 53.44 53.35 3k8l n ALA 389 Cb 0.47 -1.53 1.02 0.00 0.00 0.00 0.00 19.45 19.40 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 -1.09 0.30 -0.04 0.00 -1.51 -1.74 -1.16 116.25 111.01 3k8l h VAL 390 Ca -0.56 -0.08 0.00 0.00 -1.23 0.00 0.00 66.70 64.84 3k8l h VAL 390 Cb 1.24 1.06 0.00 0.00 -2.13 0.00 0.00 31.29 31.45 3k8l h VAL 390 CO 0.72 0.01 0.00 2.29 -1.23 0.00 0.00 177.57 179.36 3k8l n LYS 391 N -3.49 1.17 0.00 5.19 2.85 -1.26 -3.45 118.16 119.17 3k8l n LYS 391 Ca -0.03 -0.26 0.01 0.00 -1.05 0.00 0.00 58.31 56.98 3k8l n LYS 391 Cb 0.10 -1.29 0.01 0.00 -0.65 0.00 0.00 35.03 33.20 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 -0.50 0.00 0.24 5.58 8.25 -0.44 -3.95 115.22 124.40 3k8l n HIS 392 Ca 0.13 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.48 3k8l n HIS 392 Cb 0.12 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.17 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 0.31 0.00 -3.41 1.59 2.04 -1.62 -3.36 117.51 113.06 3k8l h ILE 393 Ca 0.00 0.00 -0.55 0.00 1.00 0.00 0.00 64.86 65.31 3k8l h ILE 393 Cb 0.07 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.11 3k8l h ILE 393 CO 0.00 0.00 0.10 -0.31 0.00 0.00 0.00 178.15 177.94 3k8l s TYR 394 N -4.64 3.87 0.34 1.37 1.51 -1.26 -4.96 117.35 113.59 3k8l s TYR 394 Ca -0.11 1.49 0.10 0.00 -1.01 0.00 0.00 57.07 57.55 3k8l s TYR 394 Cb 0.02 -2.66 0.86 0.00 -0.11 0.00 0.00 41.96 40.07 3k8l s TYR 394 CO 0.34 0.54 1.80 1.25 -1.11 0.00 0.00 175.55 178.36 3k8l h HIS 395 N 4.43 0.90 -3.27 2.71 2.76 -1.18 -3.40 115.15 118.09 3k8l h HIS 395 Ca -0.48 0.03 -0.56 0.00 -2.20 0.00 0.00 60.37 57.16 3k8l h HIS 395 Cb 1.21 -0.27 -0.04 0.00 1.55 0.00 0.00 27.41 29.85 3k8l h HIS 395 CO 0.66 0.20 0.52 0.45 -1.30 0.00 0.00 177.93 178.45 3k8l s SER 396 N -5.46 7.18 0.27 3.26 0.15 -1.26 -4.87 113.70 112.97 3k8l s SER 396 Ca -0.10 1.45 0.24 0.00 0.70 0.00 0.00 55.95 58.23 3k8l s SER 396 Cb 0.24 -2.53 0.32 0.00 -1.71 0.00 0.00 66.02 62.34 3k8l s SER 396 CO 0.80 -0.43 1.42 1.05 1.20 0.00 0.00 173.24 177.27 3k8l h GLU 397 N 7.13 0.00 0.00 5.44 4.11 -1.79 -3.35 114.58 126.13 3k8l h GLU 397 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 3k8l h GLU 397 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 3k8l h GLU 397 CO 0.85 0.00 -1.54 0.25 0.07 0.00 0.00 179.01 178.65 3k8l n THR 398 N -2.64 0.05 -1.05 -1.06 -2.24 -1.26 -4.95 114.28 101.13 3k8l n THR 398 Ca 0.03 -0.32 -0.30 0.00 -2.27 0.00 0.00 64.05 61.19 3k8l n THR 398 Cb 0.50 0.30 0.23 0.00 -2.10 0.00 0.00 70.33 69.26 3k8l n THR 398 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3k8l s SER 399 N -4.04 1.28 0.00 3.42 1.04 -1.26 -4.92 113.70 109.23 3k8l s SER 399 Ca -0.01 0.83 0.20 0.00 0.48 0.00 0.00 55.95 57.44 3k8l s SER 399 Cb 0.14 -1.23 0.60 0.00 0.10 0.00 0.00 66.02 65.64 3k8l s SER 399 CO 0.88 -3.92 1.46 -0.62 0.98 0.00 0.00 173.24 172.02 3k8l n GLU 400 N -4.66 1.95 0.30 4.02 1.02 -1.26 -4.42 120.64 117.59 3k8l n GLU 400 Ca 0.10 -1.43 -0.17 0.00 -0.02 0.00 0.00 57.16 55.64 3k8l n GLU 400 Cb 0.59 -1.40 -0.09 0.00 -0.02 0.00 0.00 31.44 30.52 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 2.73 -0.68 -0.14 3.49 5.08 -1.91 -2.18 114.58 120.97 3k8l h GLU 401 Ca 0.00 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3k8l h GLU 401 Cb 0.61 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 3k8l h GLU 401 CO 0.00 -0.45 0.09 -0.91 -1.00 0.00 0.00 179.01 176.74 3k8l h ASN 402 N -0.71 0.14 -0.98 1.42 -0.26 -1.83 0.17 115.58 113.53 3k8l h ASN 402 Ca -0.07 -0.00 0.03 0.00 -0.56 0.00 0.00 56.30 55.70 3k8l h ASN 402 Cb 0.54 -0.03 -0.06 0.00 -1.06 0.00 0.00 38.32 37.72 3k8l h ASN 402 CO 0.12 0.11 0.64 -0.65 -1.06 0.00 0.00 177.43 176.58 3k8l h PRO 403 N 0.18 1.21 -0.47 0.81 0.11 -1.83 -0.04 132.00 131.97 3k8l h PRO 403 Ca 0.05 -0.07 -0.11 0.00 0.11 0.00 0.00 66.00 65.98 3k8l h PRO 403 Cb -0.01 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 30.81 3k8l h PRO 403 CO -0.02 0.80 -0.15 -0.09 -0.21 0.00 0.00 178.00 178.33 3k8l h ARG 404 N 1.24 0.90 -0.46 1.05 2.43 -1.06 -1.83 114.38 116.66 3k8l h ARG 404 Ca 0.39 -0.34 -0.07 0.00 -0.81 0.00 0.00 59.98 59.14 3k8l h ARG 404 Cb -0.02 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 3k8l h ARG 404 CO -0.12 0.99 -0.00 0.35 -1.51 0.00 0.00 179.97 179.68 3k8l h PHE 405 N 0.80 0.89 -0.56 2.20 3.57 -0.43 -2.29 116.94 121.11 3k8l h PHE 405 Ca 0.12 -0.15 -0.06 0.00 3.53 0.00 0.00 57.97 61.41 3k8l h PHE 405 Cb 0.68 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 3k8l h PHE 405 CO 0.04 0.86 0.11 -0.07 -2.23 0.00 0.00 178.31 177.01 3k8l h LEU 406 N 0.66 0.84 -0.77 0.59 3.38 -0.91 -1.77 115.31 117.33 3k8l h LEU 406 Ca 0.13 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 3k8l h LEU 406 Cb 0.50 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 3k8l h LEU 406 CO 0.02 0.84 0.15 0.50 0.09 0.00 0.00 178.44 180.04 3k8l h LYS 407 N 0.85 1.08 -0.49 1.13 3.64 -1.16 0.24 116.57 121.86 3k8l h LYS 407 Ca 0.18 -0.26 -0.07 0.00 -1.27 0.00 0.00 60.65 59.23 3k8l h LYS 407 Cb 0.35 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 3k8l h LYS 407 CO 0.00 0.96 0.04 1.98 -2.27 0.00 0.00 179.45 180.17 3k8l h MET 408 N 1.02 0.84 -0.37 1.90 4.05 -1.07 -1.58 114.93 119.73 3k8l h MET 408 Ca 0.21 -0.24 -0.08 0.00 -0.28 0.00 0.00 59.70 59.31 3k8l h MET 408 Cb 0.37 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.08 3k8l h MET 408 CO 0.00 0.86 -0.08 0.35 0.23 0.00 0.00 176.91 178.27 3k8l h PHE 409 N 0.70 0.79 -0.25 1.39 3.57 -0.94 -1.74 116.94 120.45 3k8l h PHE 409 Ca 0.14 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.48 3k8l h PHE 409 Cb 0.45 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 3k8l h PHE 409 CO 0.03 0.85 0.16 -0.92 -2.23 0.00 0.00 178.31 176.20 3k8l h TYR 410 N 0.51 0.33 -0.46 0.41 5.03 -0.42 -1.42 116.97 120.93 3k8l h TYR 410 Ca 0.09 0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.37 3k8l h TYR 410 Cb 0.59 -0.11 -0.02 0.00 1.55 0.00 0.00 36.73 38.74 3k8l h TYR 410 CO 0.05 0.23 0.13 0.93 -1.32 0.00 0.00 178.16 178.18 3k8l h GLU 411 N 0.33 0.68 -0.38 1.82 5.08 -1.24 0.99 114.58 121.86 3k8l h GLU 411 Ca 0.09 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 3k8l h GLU 411 Cb -0.01 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 3k8l h GLU 411 CO -0.02 0.61 0.03 -0.44 -1.00 0.00 0.00 179.01 178.19 3k8l h ASP 412 N 0.67 0.63 0.07 1.42 5.19 -0.98 -2.14 116.42 121.28 3k8l h ASP 412 Ca 0.16 -0.28 -0.20 0.00 -0.62 0.00 0.00 57.03 56.08 3k8l h ASP 412 Cb 0.22 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 39.56 3k8l h ASP 412 CO -0.01 0.76 -0.73 0.24 -3.12 0.00 0.00 179.24 176.37 3k8l h MET 413 N 0.48 0.58 -0.61 3.56 2.86 -0.90 -2.87 114.93 118.04 3k8l h MET 413 Ca 0.11 -0.46 -0.08 0.00 -2.06 0.00 0.00 59.70 57.21 3k8l h MET 413 Cb 0.41 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 3k8l h MET 413 CO 0.01 1.09 0.08 -0.97 1.06 0.00 0.00 176.91 178.18 3k8l h ASN 414 N 0.40 0.97 -0.77 1.22 -0.00 -0.79 -0.62 115.58 115.99 3k8l h ASN 414 Ca -0.04 -0.27 -0.03 0.00 -0.00 0.00 0.00 56.30 55.96 3k8l h ASN 414 Cb 1.33 -0.26 -0.03 0.00 -0.00 0.00 0.00 38.32 39.36 3k8l h ASN 414 CO 0.14 1.00 0.35 0.00 -0.00 0.00 0.00 177.43 178.91 3k8l h ALA 415 N 1.01 1.00 -0.38 1.57 0.00 -1.41 -0.52 119.26 120.53 3k8l h ALA 415 Ca 0.18 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 3k8l h ALA 415 Cb 0.45 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3k8l h ALA 415 CO 0.01 0.58 -0.33 -0.92 0.00 0.00 0.00 179.25 178.60 3k8l h TYR 416 N 1.10 0.99 -0.30 0.00 3.20 -1.26 -0.80 116.97 119.89 3k8l h TYR 416 Ca 0.26 -0.27 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 3k8l h TYR 416 Cb 0.15 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.19 3k8l h TYR 416 CO 0.01 1.05 0.11 -0.92 -1.64 0.00 0.00 178.16 176.78 3k8l h TYR 417 N 0.71 0.47 0.00 -3.82 3.20 -0.81 -2.33 116.97 114.39 3k8l h TYR 417 Ca 0.07 -0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.83 3k8l h TYR 417 Cb 0.89 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 39.01 3k8l h TYR 417 CO 0.05 0.47 -0.33 0.87 -1.64 0.00 0.00 178.16 177.57 3k8l h LYS 418 N 0.34 0.00 0.00 1.82 1.57 -1.04 -2.49 116.57 116.77 3k8l h LYS 418 Ca 0.10 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.84 3k8l h LYS 418 Cb 0.20 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 3k8l h LYS 418 CO -0.01 0.33 -0.19 0.37 -0.57 0.00 0.00 179.45 179.39 3k8l h GLN 419 N 0.00 0.00 -0.10 3.15 4.15 -0.72 -2.27 115.11 119.33 3k8l h GLN 419 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3k8l h GLN 419 Cb 0.76 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.45 3k8l h GLN 419 CO 0.04 0.19 0.00 1.63 -1.93 0.00 0.00 178.83 178.76 3k8l n LYS 420 N -3.37 1.42 -0.42 1.69 4.76 -0.91 -4.91 118.16 116.42 3k8l n LYS 420 Ca 0.00 -0.63 0.00 0.00 -2.87 0.00 0.00 58.31 54.81 3k8l n LYS 420 Cb 0.40 -1.35 0.00 0.00 -1.84 0.00 0.00 35.03 32.24 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 0.98 0.56 3.06 0.72 0.00 -0.86 -5.11 105.19 104.54 3k8l n GLY 421 Ca 0.15 -0.20 -0.18 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.57 0.90 -0.26 1.61 3.76 -1.21 -5.04 115.29 113.49 3k8l s HIS 422 Ca 0.00 -0.24 0.19 0.00 -0.15 0.00 0.00 55.06 54.86 3k8l s HIS 422 Cb 0.00 -0.56 -0.28 0.00 1.11 0.00 0.00 32.58 32.85 3k8l s HIS 422 CO 0.00 -0.01 0.52 0.25 -0.85 0.00 0.00 174.74 174.66 3k8l n THR 423 N 2.48 0.00 -2.29 1.30 -2.24 -1.26 -4.47 114.28 107.79 3k8l n THR 423 Ca -0.15 -0.34 -0.26 0.00 -2.27 0.00 0.00 64.05 61.03 3k8l n THR 423 Cb 0.56 0.31 0.12 0.00 -2.10 0.00 0.00 70.33 69.22 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 -3.84 4.15 0.01 3.42 -4.77 -1.26 -5.07 116.67 109.31 3k8l s ASP 424 Ca -0.03 0.06 -0.10 0.00 -3.30 0.00 0.00 52.55 49.17 3k8l s ASP 424 Cb 0.13 -0.43 -0.05 0.00 -1.09 0.00 0.00 42.92 41.48 3k8l s ASP 424 CO 0.80 -2.01 0.33 -1.81 0.70 0.00 0.00 175.17 173.17 3k8l s ASP 425 N -4.71 6.62 0.63 2.11 1.01 -1.26 -4.83 116.67 116.24 3k8l s ASP 425 Ca 0.66 0.74 -0.18 0.00 0.71 0.00 0.00 52.55 54.48 3k8l s ASP 425 Cb -0.07 -2.16 -0.02 0.00 1.01 0.00 0.00 42.92 41.69 3k8l s ASP 425 CO 0.47 0.27 1.29 0.12 0.21 0.00 0.00 175.17 177.53 3k8l s PHE 426 N -1.22 2.14 -0.19 4.23 5.36 -1.26 -4.99 117.98 122.05 3k8l s PHE 426 Ca 0.26 1.48 -0.10 0.00 -0.96 0.00 0.00 56.93 57.61 3k8l s PHE 426 Cb -0.14 -3.67 -0.05 0.00 -0.34 0.00 0.00 43.02 38.81 3k8l s PHE 426 CO 0.14 -2.83 0.14 -0.47 -1.46 0.00 0.00 175.22 170.75 3k8l s TYR 427 N -1.41 3.44 -0.06 10.12 5.04 -1.15 -4.99 117.35 128.33 3k8l s TYR 427 Ca 0.81 0.38 -0.03 0.00 -2.44 0.00 0.00 57.07 55.79 3k8l s TYR 427 Cb -0.37 -2.14 0.04 0.00 0.35 0.00 0.00 41.96 39.84 3k8l s TYR 427 CO 0.39 0.35 0.12 -1.64 -1.34 0.00 0.00 175.55 173.43 3k8l s MET 428 N 0.18 0.02 -0.06 4.97 -1.94 -1.26 -0.64 119.30 120.57 3k8l s MET 428 Ca 0.10 0.43 0.06 0.00 -1.71 0.00 0.00 55.69 54.57 3k8l s MET 428 Cb -0.11 -0.28 -0.01 0.00 2.01 0.00 0.00 34.83 36.44 3k8l s MET 428 CO -0.01 -0.25 -0.24 -1.50 -0.01 0.00 0.00 175.02 173.01 3k8l s ILE 429 N 1.80 2.00 0.06 2.53 2.07 -0.13 -3.05 121.20 126.49 3k8l s ILE 429 Ca -0.02 -1.03 0.04 0.00 -1.41 0.00 0.00 60.65 58.23 3k8l s ILE 429 Cb -0.12 -1.70 -0.04 0.00 0.13 0.00 0.00 42.46 40.73 3k8l s ILE 429 CO -0.05 0.56 -0.01 -0.83 -1.91 0.00 0.00 174.94 172.70 3k8l s GLY 430 N -0.11 1.90 -0.46 1.50 0.00 -0.30 -0.43 107.32 109.42 3k8l s GLY 430 Ca -0.05 -1.07 -0.15 0.00 0.00 0.00 0.00 44.72 43.45 3k8l s GLY 430 CO 0.04 -1.02 0.38 1.85 0.00 0.00 0.00 173.10 174.34 3k8l s GLU 431 N -2.08 2.93 -0.55 2.90 2.12 -0.51 -2.80 118.70 120.70 3k8l s GLU 431 Ca 0.24 -1.36 0.01 0.00 0.36 0.00 0.00 54.97 54.22 3k8l s GLU 431 Cb -0.12 -4.09 0.14 0.00 0.26 0.00 0.00 34.13 30.33 3k8l s GLU 431 CO 0.16 -1.01 0.32 0.08 -0.54 0.00 0.00 175.26 174.27 3k8l s VAL 432 N 1.62 3.03 -1.18 3.70 1.01 -1.26 -3.17 120.40 124.15 3k8l s VAL 432 Ca 0.04 -3.12 -0.23 0.00 0.00 0.00 0.00 61.98 58.67 3k8l s VAL 432 Cb -0.24 -3.05 -0.09 0.00 0.00 0.00 0.00 36.38 33.00 3k8l s VAL 432 CO 0.06 -0.82 1.94 -0.22 0.00 0.00 0.00 175.10 176.06 3k8l s LEU 433 N -0.14 3.05 0.31 3.92 2.96 -1.26 -4.80 118.68 122.72 3k8l s LEU 433 Ca 0.17 -1.66 -0.13 0.00 -0.22 0.00 0.00 54.13 52.29 3k8l s LEU 433 Cb -0.23 -2.59 0.02 0.00 0.50 0.00 0.00 46.19 43.89 3k8l s LEU 433 CO -0.02 -3.09 0.61 -0.44 -1.32 0.00 0.00 176.35 172.09 3k8l s SER 434 N 6.51 0.10 0.74 3.68 0.01 -1.26 -5.11 113.70 118.37 3k8l s SER 434 Ca 0.68 -1.03 -0.11 0.00 1.31 0.00 0.00 55.95 56.81 3k8l s SER 434 Cb -0.01 0.70 0.03 0.00 0.21 0.00 0.00 66.02 66.96 3k8l s SER 434 CO 0.13 -1.36 1.07 -1.61 0.41 0.00 0.00 173.24 171.89 3k8l s GLU 435 N -3.36 2.58 0.32 12.44 0.41 -1.26 -4.49 118.70 125.34 3k8l s GLU 435 Ca 0.20 1.00 0.09 0.00 -0.41 0.00 0.00 54.97 55.85 3k8l s GLU 435 Cb -0.03 -1.95 0.94 0.00 -1.78 0.00 0.00 34.13 31.31 3k8l s GLU 435 CO 0.11 -1.36 1.64 0.10 -0.49 0.00 0.00 175.26 175.26 3k8l h TYR 436 N -0.92 0.61 0.00 1.61 -0.00 -1.96 -1.19 116.97 115.12 3k8l h TYR 436 Ca -0.44 0.05 -0.04 0.00 0.00 0.00 0.00 58.73 58.29 3k8l h TYR 436 Cb 1.22 -0.11 -0.01 0.00 0.00 0.00 0.00 36.73 37.84 3k8l h TYR 436 CO 0.59 -0.25 -0.20 0.38 -0.00 0.00 0.00 178.16 178.68 3k8l h ASP 437 N 0.22 0.00 0.80 0.10 -0.00 -1.97 -0.55 116.42 115.01 3k8l h ASP 437 Ca 0.66 0.00 -0.23 0.00 -0.00 0.00 0.00 57.03 57.47 3k8l h ASP 437 Cb 1.48 0.00 -0.04 0.00 -0.00 0.00 0.00 39.33 40.77 3k8l h ASP 437 CO -0.67 0.20 -1.30 0.11 -0.00 0.00 0.00 179.24 177.59 3k8l h LYS 438 N 0.00 0.00 -0.02 4.15 1.79 -1.58 -3.36 116.57 117.55 3k8l h LYS 438 Ca -0.00 0.00 -0.13 0.00 -2.18 0.00 0.00 60.65 58.34 3k8l h LYS 438 Cb 0.43 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.09 3k8l h LYS 438 CO 0.03 0.65 -0.49 0.28 -1.08 0.00 0.00 179.45 178.84 3k8l h VAL 439 N 0.00 1.45 -0.85 0.50 2.07 -1.12 -3.38 116.25 114.92 3k8l h VAL 439 Ca -0.14 -2.00 0.14 0.00 0.82 0.00 0.00 66.70 65.52 3k8l h VAL 439 Cb 1.81 2.58 -0.14 0.00 -1.52 0.00 0.00 31.29 34.01 3k8l h VAL 439 CO 0.09 0.57 -0.30 0.00 0.02 0.00 0.00 177.57 177.96 3k8l n ALA 440 N -2.57 -0.02 0.11 1.67 0.00 -0.25 -0.53 120.51 118.93 3k8l n ALA 440 Ca -0.10 0.87 0.05 0.00 0.00 0.00 0.00 53.44 54.27 3k8l n ALA 440 Cb 0.61 -0.43 0.28 0.00 0.00 0.00 0.00 19.45 19.91 3k8l n ALA 440 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3k8l n PRO 441 N -5.29 0.07 0.00 0.00 -0.04 -1.26 -1.40 135.00 127.07 3k8l n PRO 441 Ca 0.10 0.54 0.16 0.00 -0.04 0.00 0.00 63.50 64.25 3k8l n PRO 441 Cb 0.36 -1.70 0.87 0.00 -0.04 0.00 0.00 33.50 32.99 3k8l n PRO 441 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3k8l n TYR 442 N -1.84 0.00 0.83 0.54 4.02 0.31 -2.73 117.16 118.29 3k8l n TYR 442 Ca -0.00 0.00 0.11 0.00 -0.01 0.00 0.00 57.90 58.00 3k8l n TYR 442 Cb 0.03 -0.12 0.50 0.00 -0.02 0.00 0.00 39.34 39.73 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 -1.12 0.00 0.40 -0.72 0.53 -0.50 -1.58 117.16 114.17 3k8l n TYR 443 Ca 0.20 0.00 0.13 0.00 -1.02 0.00 0.00 57.90 57.21 3k8l n TYR 443 Cb 0.17 -0.46 0.40 0.00 -1.03 0.00 0.00 39.34 38.41 3k8l n TYR 443 CO 0.00 0.00 0.00 0.87 -1.02 0.00 0.00 176.86 176.71 3k8l h LYS 444 N 0.00 0.00 0.00 -0.72 1.79 -1.74 -3.34 116.57 112.56 3k8l h LYS 444 Ca 0.00 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.29 3k8l h LYS 444 Cb 0.36 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.97 3k8l h LYS 444 CO 0.00 0.00 -1.67 0.41 -1.08 0.00 0.00 179.45 177.11 3k8l n GLY 445 N 0.79 -0.28 3.27 3.86 0.00 -0.69 -4.78 105.19 107.36 3k8l n GLY 445 Ca 0.04 -0.11 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 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 -5.31 2.29 0.23 0.99 1.43 -0.62 -3.39 118.68 114.31 3k8l s LEU 446 Ca -0.12 -0.67 0.12 0.00 -1.03 0.00 0.00 54.13 52.43 3k8l s LEU 446 Cb 0.04 -0.85 0.11 0.00 0.03 0.00 0.00 46.19 45.51 3k8l s LEU 446 CO 0.32 0.05 1.45 1.55 0.23 0.00 0.00 176.35 179.95 3k8l h PRO 447 N 4.13 0.00 -5.63 1.29 0.13 -1.84 -3.39 132.00 126.68 3k8l h PRO 447 Ca -0.46 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.18 3k8l h PRO 447 Cb 1.18 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.07 3k8l h PRO 447 CO 0.40 0.68 -0.81 0.00 -0.23 0.00 0.00 178.00 178.04 3k8l s ALA 448 N -3.06 1.41 -0.09 -0.56 0.00 -1.17 -1.85 121.76 116.43 3k8l s ALA 448 Ca 0.01 -0.97 -0.13 0.00 0.00 0.00 0.00 51.96 50.88 3k8l s ALA 448 Cb 0.10 -0.22 0.03 0.00 0.00 0.00 0.00 23.12 23.03 3k8l s ALA 448 CO 0.77 0.28 0.33 -0.51 0.00 0.00 0.00 175.76 176.62 3k8l s LEU 449 N -1.34 0.75 0.35 0.00 1.43 -1.17 -1.15 118.68 117.57 3k8l s LEU 449 Ca 0.03 0.47 -0.27 0.00 -1.03 0.00 0.00 54.13 53.33 3k8l s LEU 449 Cb -0.09 1.20 -0.09 0.00 0.03 0.00 0.00 46.19 47.25 3k8l s LEU 449 CO 0.02 -0.24 1.16 -0.36 0.23 0.00 0.00 176.35 177.16 3k8l s PHE 450 N -0.36 3.23 -0.84 0.29 0.08 -1.12 -2.44 117.98 116.82 3k8l s PHE 450 Ca -0.05 1.58 -0.07 0.00 0.12 0.00 0.00 56.93 58.51 3k8l s PHE 450 Cb -0.03 -3.38 0.21 0.00 -0.57 0.00 0.00 43.02 39.25 3k8l s PHE 450 CO 0.02 -1.12 0.74 -2.00 -0.10 0.00 0.00 175.22 172.76 3k8l s GLU 451 N -1.98 3.35 0.46 0.44 2.12 -0.34 -4.81 118.70 117.94 3k8l s GLU 451 Ca 0.52 -2.82 0.18 0.00 0.36 0.00 0.00 54.97 53.21 3k8l s GLU 451 Cb -0.32 -4.15 1.10 0.00 0.26 0.00 0.00 34.13 31.03 3k8l s GLU 451 CO 0.41 -1.24 2.00 0.74 -0.54 0.00 0.00 175.26 176.63 3k8l h PHE 452 N 6.94 0.00 0.00 5.30 -1.00 -1.86 -2.10 116.94 124.22 3k8l h PHE 452 Ca 0.10 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.88 3k8l h PHE 452 Cb 0.93 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.49 3k8l h PHE 452 CO 0.82 0.18 -0.00 0.77 -1.61 0.00 0.00 178.31 178.47 3k8l h SER 453 N 0.00 0.00 0.31 2.17 0.02 -1.90 -2.30 113.55 111.86 3k8l h SER 453 Ca -0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 3k8l h SER 453 Cb 0.35 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.89 3k8l h SER 453 CO 0.02 0.00 -0.15 0.15 -1.14 0.00 0.00 176.83 175.72 3k8l h PHE 454 N 0.00 -0.39 -0.49 3.45 3.57 -1.70 -1.55 116.94 119.83 3k8l h PHE 454 Ca -0.00 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.39 3k8l h PHE 454 Cb 0.08 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 3k8l h PHE 454 CO 0.00 -0.11 -0.10 2.35 -2.23 0.00 0.00 178.31 178.22 3k8l h TRP 455 N -0.64 0.98 -0.38 0.41 -0.00 -1.51 -0.76 115.95 114.06 3k8l h TRP 455 Ca -0.04 -0.19 0.02 0.00 -0.00 0.00 0.00 58.89 58.68 3k8l h TRP 455 Cb 0.45 -0.25 -0.03 0.00 -0.00 0.00 0.00 29.16 29.33 3k8l h TRP 455 CO -0.00 0.94 0.21 1.88 -0.00 0.00 0.00 178.44 181.46 3k8l h TYR 456 N 0.80 0.39 -0.24 2.65 0.99 -1.38 0.13 116.97 120.32 3k8l h TYR 456 Ca 0.13 0.01 -0.17 0.00 2.00 0.00 0.00 58.73 60.71 3k8l h TYR 456 Cb 0.61 -0.12 -0.00 0.00 1.00 0.00 0.00 36.73 38.22 3k8l h TYR 456 CO 0.04 0.22 -0.53 0.00 -0.00 0.00 0.00 178.16 177.88 3k8l h ARG 457 N 0.43 0.70 -0.07 4.88 2.47 -1.14 -2.80 114.38 118.85 3k8l h ARG 457 Ca 0.16 -0.43 -0.02 0.00 -1.26 0.00 0.00 59.98 58.42 3k8l h ARG 457 Cb 0.04 0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 28.40 3k8l h ARG 457 CO -0.09 1.05 -0.04 1.25 0.56 0.00 0.00 179.97 182.71 3k8l h LEU 458 N 0.54 0.15 -0.08 3.04 5.85 -0.82 -0.39 115.31 123.60 3k8l h LEU 458 Ca 0.02 -0.42 0.02 0.00 0.84 0.00 0.00 57.88 58.33 3k8l h LEU 458 Cb 1.10 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.07 3k8l h LEU 458 CO 0.11 0.54 -0.04 -0.08 -0.34 0.00 0.00 178.44 178.63 3k8l h GLU 459 N -0.24 -0.03 -0.29 1.25 4.22 -0.82 -0.16 114.58 118.50 3k8l h GLU 459 Ca 0.01 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.46 3k8l h GLU 459 Cb 0.49 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 3k8l h GLU 459 CO 0.01 -0.02 0.18 2.35 -2.18 0.00 0.00 179.01 179.35 3k8l h TRP 460 N -0.03 0.38 -0.35 0.92 7.01 -1.52 -1.56 115.95 120.80 3k8l h TRP 460 Ca 0.05 0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.09 3k8l h TRP 460 Cb 0.11 -0.13 -0.04 0.00 -2.10 0.00 0.00 29.16 27.00 3k8l h TRP 460 CO -0.15 0.27 0.14 0.78 -2.79 0.00 0.00 178.44 176.68 3k8l h GLY 461 N 0.38 0.45 0.97 2.65 0.00 -0.73 -1.27 103.07 105.52 3k8l h GLY 461 Ca 0.11 -0.09 -0.07 0.00 0.00 0.00 0.00 47.33 47.28 3k8l h GLY 461 CO -0.02 0.05 -0.03 -2.22 0.00 0.00 0.00 176.54 174.32 3k8l h ILE 462 N 0.29 1.27 0.00 2.60 2.04 -0.88 0.60 117.51 123.43 3k8l h ILE 462 Ca 0.15 -1.07 0.00 0.00 1.00 0.00 0.00 64.86 64.94 3k8l h ILE 462 Cb 0.11 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 3k8l h ILE 462 CO -0.14 0.36 0.00 0.59 0.00 0.00 0.00 178.15 178.96 3k8l n ASN 463 N -4.39 0.00 -0.06 1.72 3.02 -0.60 -2.49 115.26 112.46 3k8l n ASN 463 Ca -0.01 -0.33 0.03 0.00 -0.03 0.00 0.00 54.58 54.25 3k8l n ASN 463 Cb 0.31 -0.17 0.05 0.00 -0.61 0.00 0.00 39.78 39.36 3k8l n ASN 463 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3k8l n ASN 464 N -1.17 1.75 -4.26 6.41 4.13 -0.50 -4.99 115.26 116.63 3k8l n ASN 464 Ca 0.14 -2.27 -0.34 0.00 1.68 0.00 0.00 54.58 53.79 3k8l n ASN 464 Cb 0.14 -0.16 -0.05 0.00 -1.54 0.00 0.00 39.78 38.16 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 -0.73 -1.44 -3.89 6.41 7.64 -0.56 -4.92 113.62 116.14 3k8l n SER 465 Ca 0.05 -1.12 -0.30 0.00 1.01 0.00 0.00 58.87 58.51 3k8l n SER 465 Cb 0.44 -2.30 -0.16 0.00 -1.01 0.00 0.00 64.21 61.19 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 -3.65 1.31 -0.15 0.44 2.01 0.09 -3.40 115.64 112.29 3k8l s THR 466 Ca 0.45 -1.13 0.04 0.00 0.31 0.00 0.00 61.69 61.36 3k8l s THR 466 Cb -0.25 -1.66 -0.06 0.00 0.01 0.00 0.00 72.50 70.54 3k8l s THR 466 CO 0.96 -0.17 0.16 0.61 -0.69 0.00 0.00 174.62 175.49 3k8l n GLY 467 N 4.74 0.35 0.02 4.40 0.00 0.99 -4.49 105.19 111.20 3k8l n GLY 467 Ca -0.10 -0.12 0.02 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.61 0.00 0.16 0.00 4.01 -1.26 -2.50 117.16 115.96 3k8l n TYR 469 Ca -0.00 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.60 3k8l n TYR 469 Cb 0.01 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 38.97 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 0.15 -0.60 -0.83 -0.72 3.57 -1.70 -0.61 116.94 116.21 3k8l h PHE 470 Ca 0.00 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.50 3k8l h PHE 470 Cb 0.22 0.23 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 3k8l h PHE 470 CO 0.00 -0.34 0.51 0.00 -2.23 0.00 0.00 178.31 176.25 3k8l h ALA 471 N 0.20 1.05 -0.09 2.41 0.00 -1.86 -1.80 119.26 119.18 3k8l h ALA 471 Ca -0.00 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.85 3k8l h ALA 471 Cb 0.45 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 3k8l h ALA 471 CO -0.05 0.50 -0.13 -0.22 0.00 0.00 0.00 179.25 179.35 3k8l h LYS 472 N 1.13 -0.18 0.30 0.00 3.64 -1.78 -0.66 116.57 119.03 3k8l h LYS 472 Ca 0.30 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.68 3k8l h LYS 472 Cb -0.07 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 3k8l h LYS 472 CO -0.06 -0.12 -0.18 -0.44 -2.27 0.00 0.00 179.45 176.39 3k8l h ASP 473 N -0.18 -0.44 -0.94 4.20 3.32 -0.80 -2.12 116.42 119.46 3k8l h ASP 473 Ca 0.08 0.03 0.12 0.00 0.02 0.00 0.00 57.03 57.27 3k8l h ASP 473 Cb 0.29 0.13 -0.08 0.00 0.22 0.00 0.00 39.33 39.88 3k8l h ASP 473 CO -0.19 -0.29 0.57 0.40 -1.72 0.00 0.00 179.24 178.01 3k8l h ILE 474 N -0.46 0.89 -0.62 0.35 1.08 -1.16 -1.35 117.51 116.24 3k8l h ILE 474 Ca -0.03 -0.31 -0.09 0.00 -0.39 0.00 0.00 64.86 64.04 3k8l h ILE 474 Cb 0.37 -0.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.01 3k8l h ILE 474 CO 0.04 0.16 0.03 -0.07 -0.69 0.00 0.00 178.15 177.62 3k8l h LEU 475 N 0.90 1.05 -1.59 1.44 3.38 -0.95 -1.48 115.31 118.06 3k8l h LEU 475 Ca 0.47 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 3k8l h LEU 475 Cb 0.48 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3k8l h LEU 475 CO -0.27 1.09 -0.22 0.77 0.09 0.00 0.00 178.44 179.89 3k8l h SER 476 N 0.98 0.00 0.05 -0.43 4.64 -0.58 -1.60 113.55 116.60 3k8l h SER 476 Ca 0.18 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.30 3k8l h SER 476 Cb 0.53 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.64 3k8l h SER 476 CO 0.03 0.22 -0.80 1.88 -0.87 0.00 0.00 176.83 177.29 3k8l h TYR 477 N 0.00 0.71 -0.54 4.77 0.05 -0.84 -2.99 116.97 118.13 3k8l h TYR 477 Ca -0.00 -0.42 0.01 0.00 0.05 0.00 0.00 58.73 58.36 3k8l h TYR 477 Cb 0.45 -0.07 -0.03 0.00 1.01 0.00 0.00 36.73 38.09 3k8l h TYR 477 CO 0.00 1.26 0.36 1.96 -1.05 0.00 0.00 178.16 180.69 3k8l h GLN 478 N -0.04 0.70 -0.66 4.88 4.20 -0.96 -0.27 115.11 122.96 3k8l h GLN 478 Ca -0.11 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.51 3k8l h GLN 478 Cb 1.52 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 29.11 3k8l h GLN 478 CO 0.15 0.46 0.24 0.37 -0.67 0.00 0.00 178.83 179.39 3k8l h GLN 479 N 0.72 0.98 -0.45 1.46 4.15 -1.32 -0.99 115.11 119.66 3k8l h GLN 479 Ca 0.20 -0.17 -0.13 0.00 0.77 0.00 0.00 58.65 59.32 3k8l h GLN 479 Cb -0.07 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.45 3k8l h GLN 479 CO -0.04 0.82 -0.22 -0.22 -1.93 0.00 0.00 178.83 177.23 3k8l h LYS 480 N 0.96 0.93 -0.44 1.69 3.11 -0.93 -2.81 116.57 119.08 3k8l h LYS 480 Ca 0.22 -0.39 -0.13 0.00 -2.81 0.00 0.00 60.65 57.54 3k8l h LYS 480 Cb 0.22 -0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 31.40 3k8l h LYS 480 CO -0.02 1.05 -0.23 1.88 -2.81 0.00 0.00 179.45 179.33 3k8l h TYR 481 N 0.80 1.04 -0.18 1.91 0.05 -0.98 -2.76 116.97 116.84 3k8l h TYR 481 Ca 0.10 -0.25 0.05 0.00 0.05 0.00 0.00 58.73 58.69 3k8l h TYR 481 Cb 0.78 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 38.27 3k8l h TYR 481 CO 0.05 1.04 0.13 0.00 -1.05 0.00 0.00 178.16 178.33 3k8l h ALA 482 N 0.95 2.13 0.00 3.88 0.00 -1.00 -0.34 119.26 124.89 3k8l h ALA 482 Ca 0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3k8l h ALA 482 Cb 0.78 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 3k8l h ALA 482 CO 0.06 -0.23 -0.11 -0.91 0.00 0.00 0.00 179.25 178.06 3k8l h ASN 483 N 0.00 0.00 0.00 0.00 2.35 -1.24 -3.22 115.58 113.48 3k8l h ASN 483 Ca 0.09 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.55 3k8l h ASN 483 Cb 0.36 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.67 3k8l h ASN 483 CO -0.00 0.11 -2.08 -1.22 -1.65 0.00 0.00 177.43 172.59 3k8l n TYR 484 N -3.47 0.00 -3.65 1.19 4.01 -0.28 -4.99 117.16 109.96 3k8l n TYR 484 Ca -0.01 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.67 3k8l n TYR 484 Cb 0.27 -0.77 -0.07 0.00 -0.31 0.00 0.00 39.34 38.46 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 -2.38 0.58 0.26 -0.72 3.52 -0.35 -4.73 118.95 115.13 3k8l s ARG 485 Ca -0.09 1.22 -0.02 0.00 -0.13 0.00 0.00 55.73 56.71 3k8l s ARG 485 Cb 0.05 0.39 0.35 0.00 -1.56 0.00 0.00 34.95 34.18 3k8l s ARG 485 CO 0.63 -0.18 1.78 1.03 -0.81 0.00 0.00 175.30 177.75 3k8l h SER 486 N 7.49 0.76 -0.91 -2.12 0.87 -1.83 -3.17 113.55 114.65 3k8l h SER 486 Ca -0.25 -0.17 -0.59 0.00 -1.23 0.00 0.00 61.79 59.55 3k8l h SER 486 Cb 1.17 -0.20 -0.30 0.00 -0.44 0.00 0.00 62.40 62.62 3k8l h SER 486 CO 0.15 0.81 0.51 -0.90 -0.53 0.00 0.00 176.83 176.87 3k8l n ASP 487 N -4.23 6.13 -4.66 6.23 5.75 -1.26 -4.94 116.55 119.57 3k8l n ASP 487 Ca 0.03 -3.75 -0.38 0.00 -0.01 0.00 0.00 54.79 50.68 3k8l n ASP 487 Cb 0.28 -0.83 0.05 0.00 -1.03 0.00 0.00 41.12 39.59 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 -0.95 1.31 -3.70 2.11 0.18 -1.20 -4.97 117.16 109.94 3k8l n TYR 488 Ca 0.57 0.44 -0.39 0.00 1.88 0.00 0.00 57.90 60.40 3k8l n TYR 488 Cb 0.93 -2.21 -0.12 0.00 -0.38 0.00 0.00 39.34 37.56 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 -1.44 4.01 -0.52 -3.48 1.01 -0.77 -5.05 121.20 114.95 3k8l s ILE 489 Ca 0.76 -1.12 -0.22 0.00 0.00 0.00 0.00 60.65 60.06 3k8l s ILE 489 Cb -0.42 -3.29 0.04 0.00 0.01 0.00 0.00 42.46 38.80 3k8l s ILE 489 CO 0.47 -0.24 0.82 -0.70 0.00 0.00 0.00 174.94 175.29 3k8l s GLU 490 N 1.43 3.27 -0.75 2.79 2.12 -1.26 -3.02 118.70 123.29 3k8l s GLU 490 Ca -0.00 -0.44 -0.19 0.00 0.36 0.00 0.00 54.97 54.70 3k8l s GLU 490 Cb -0.20 -4.05 0.12 0.00 0.26 0.00 0.00 34.13 30.25 3k8l s GLU 490 CO 0.03 -1.36 0.93 0.00 -0.54 0.00 0.00 175.26 174.32 3k8l s ALA 491 N 3.46 3.38 0.73 6.30 0.00 -1.02 -0.66 121.76 133.95 3k8l s ALA 491 Ca 0.26 -2.42 -0.11 0.00 0.00 0.00 0.00 51.96 49.68 3k8l s ALA 491 Cb -0.15 -3.80 0.03 0.00 0.00 0.00 0.00 23.12 19.21 3k8l s ALA 491 CO 0.17 -2.68 1.08 0.95 0.00 0.00 0.00 175.76 175.29 3k8l s THR 492 N 2.81 3.58 0.05 0.00 -4.23 -1.11 -1.20 115.64 115.54 3k8l s THR 492 Ca 0.22 0.54 -0.27 0.00 -1.18 0.00 0.00 61.69 61.00 3k8l s THR 492 Cb -0.14 -3.11 0.09 0.00 1.34 0.00 0.00 72.50 70.67 3k8l s THR 492 CO 0.00 -0.64 0.93 -1.59 -0.54 0.00 0.00 174.62 172.78 3k8l s LYS 493 N -4.85 0.94 0.00 3.99 -2.85 -1.26 -1.35 119.74 114.36 3k8l s LYS 493 Ca 0.61 -0.43 0.00 0.00 -1.00 0.00 0.00 55.97 55.14 3k8l s LYS 493 Cb -0.16 0.38 0.00 0.00 -2.06 0.00 0.00 37.83 35.99 3k8l s LYS 493 CO 0.54 -0.42 0.00 1.28 0.10 0.00 0.00 175.35 176.84 3k8l n LEU 494 N -0.34 0.00 -4.82 2.77 4.77 -1.26 -3.57 117.00 114.55 3k8l n LEU 494 Ca -0.08 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.58 3k8l n LEU 494 Cb 0.61 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.68 3k8l n LEU 494 CO 0.12 0.00 0.70 -0.94 -1.33 0.00 0.00 177.39 175.94 3k8l s SER 495 N -0.52 6.28 0.00 -1.43 1.04 -1.26 -4.83 113.70 112.97 3k8l s SER 495 Ca 0.00 1.75 0.00 0.00 0.48 0.00 0.00 55.95 58.18 3k8l s SER 495 Cb 0.00 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.59 3k8l s SER 495 CO 0.00 -0.83 0.00 -0.46 0.98 0.00 0.00 173.24 172.93 3k8l n ASN 496 N -1.54 1.39 0.00 7.02 0.23 -1.26 -4.60 115.26 116.49 3k8l n ASN 496 Ca 0.08 -1.00 0.01 0.00 -0.53 0.00 0.00 54.58 53.14 3k8l n ASN 496 Cb 0.53 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 38.31 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 -0.14 -2.53 1.44 -1.26 -1.74 115.22 111.00 3k8l n HIS 497 Ca 0.00 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.73 3k8l n HIS 497 Cb 0.00 -0.08 0.03 0.00 0.12 0.00 0.00 29.99 30.06 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 -1.08 2.15 -4.23 4.39 3.02 -1.26 -4.88 115.26 113.37 3k8l n ASN 498 Ca 0.02 -2.12 -0.13 0.00 -0.03 0.00 0.00 54.58 52.32 3k8l n ASN 498 Cb 0.01 -0.07 -0.10 0.00 -0.61 0.00 0.00 39.78 39.01 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 -1.21 1.05 0.43 3.52 2.02 -0.71 -5.07 118.70 118.73 3k8l s GLU 499 Ca 0.06 -1.49 -0.26 0.00 0.02 0.00 0.00 54.97 53.30 3k8l s GLU 499 Cb 0.04 -0.28 -0.09 0.00 0.10 0.00 0.00 34.13 33.90 3k8l s GLU 499 CO 0.02 -0.09 1.44 -0.51 0.02 0.00 0.00 175.26 176.14 3k8l s ASP 500 N -3.15 6.03 0.34 -0.19 1.01 -1.26 -4.65 116.67 114.80 3k8l s ASP 500 Ca 0.21 2.96 -0.28 0.00 0.71 0.00 0.00 52.55 56.15 3k8l s ASP 500 Cb 0.06 -2.66 -0.12 0.00 1.01 0.00 0.00 42.92 41.20 3k8l s ASP 500 CO 0.02 -1.07 1.26 0.54 0.21 0.00 0.00 175.17 176.13 3k8l n ARG 501 N 0.02 2.05 -0.23 8.23 5.12 -0.41 -4.76 116.66 126.69 3k8l n ARG 501 Ca 0.04 0.72 0.01 0.00 -1.93 0.00 0.00 57.85 56.69 3k8l n ARG 501 Cb 0.41 -2.28 0.10 0.00 -1.16 0.00 0.00 32.46 29.53 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 2.50 0.37 -0.62 0.55 2.02 -1.88 -1.33 112.91 114.51 3k8l h THR 502 Ca -0.45 -0.02 0.03 0.00 0.77 0.00 0.00 66.41 66.75 3k8l h THR 502 Cb 1.29 0.32 -0.04 0.00 -1.74 0.00 0.00 68.15 67.97 3k8l h THR 502 CO 0.62 0.01 0.37 -1.28 0.37 0.00 0.00 175.52 175.61 3k8l h SER 503 N 0.04 0.59 -0.68 4.18 0.87 -1.88 -1.75 113.55 114.92 3k8l h SER 503 Ca 0.34 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.89 3k8l h SER 503 Cb 0.55 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.37 3k8l h SER 503 CO -0.65 0.40 0.33 0.28 -0.53 0.00 0.00 176.83 176.67 3k8l h SER 504 N 0.71 0.88 0.41 6.23 0.02 -1.55 0.94 113.55 121.19 3k8l h SER 504 Ca 0.26 -0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 61.05 3k8l h SER 504 Cb 0.06 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.37 3k8l h SER 504 CO -0.12 0.76 -0.16 0.11 -1.14 0.00 0.00 176.83 176.27 3k8l h LYS 505 N 0.94 0.00 -0.61 3.45 1.79 -0.98 -2.03 116.57 119.13 3k8l h LYS 505 Ca 0.23 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.70 3k8l h LYS 505 Cb 0.10 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.75 3k8l h LYS 505 CO -0.03 0.16 0.00 1.28 -1.08 0.00 0.00 179.45 179.78 3k8l n LEU 506 N -3.72 5.45 -0.79 2.94 4.77 -0.69 -4.92 117.00 120.05 3k8l n LEU 506 Ca -0.02 -2.76 -0.10 0.00 -0.03 0.00 0.00 56.01 53.10 3k8l n LEU 506 Cb 0.28 -0.66 -0.04 0.00 -2.33 0.00 0.00 43.42 40.66 3k8l n LEU 506 CO 0.32 0.67 -0.10 0.61 -1.33 0.00 0.00 177.39 177.56 3k8l n GLY 507 N 0.75 1.17 2.44 -0.72 0.00 -0.76 -2.83 105.19 105.23 3k8l n GLY 507 Ca 0.27 -0.54 -0.18 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.66 -1.29 -2.78 1.61 5.02 0.32 -4.95 118.16 113.42 3k8l n LYS 508 Ca -0.10 1.02 -0.42 0.00 -2.02 0.00 0.00 58.31 56.78 3k8l n LYS 508 Cb 0.34 -5.35 -0.03 0.00 -0.02 0.00 0.00 35.03 29.97 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 -2.58 6.96 0.36 4.39 0.15 -1.13 -4.93 113.70 116.91 3k8l s SER 509 Ca 0.00 1.20 0.09 0.00 0.70 0.00 0.00 55.95 57.94 3k8l s SER 509 Cb 0.00 -2.49 0.67 0.00 -1.71 0.00 0.00 66.02 62.50 3k8l s SER 509 CO 0.00 -0.59 1.84 0.00 1.20 0.00 0.00 173.24 175.69 3k8l h ALA 510 N 7.56 1.37 -0.32 5.45 0.00 -1.92 -1.43 119.26 129.97 3k8l h ALA 510 Ca -0.21 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.28 3k8l h ALA 510 Cb 1.08 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 3k8l h ALA 510 CO 0.92 0.44 -0.35 -0.44 0.00 0.00 0.00 179.25 179.83 3k8l h ASP 511 N 0.19 0.75 0.30 0.00 3.32 -1.97 -1.95 116.42 117.05 3k8l h ASP 511 Ca 0.03 -0.32 -0.15 0.00 0.02 0.00 0.00 57.03 56.61 3k8l h ASP 511 Cb 0.55 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 3k8l h ASP 511 CO 0.04 1.03 -0.60 0.11 -1.72 0.00 0.00 179.24 178.10 3k8l h LYS 512 N 0.60 0.30 -0.54 3.56 1.57 -1.82 -2.31 116.57 117.94 3k8l h LYS 512 Ca 0.06 -0.21 -0.10 0.00 -1.87 0.00 0.00 60.65 58.53 3k8l h LYS 512 Cb 0.88 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.20 3k8l h LYS 512 CO 0.08 0.81 -0.07 0.00 -0.57 0.00 0.00 179.45 179.70 3k8l h LYS 514 N 0.88 1.11 -0.25 0.00 1.57 -1.25 -2.03 116.57 116.59 3k8l h LYS 514 Ca 0.15 -0.31 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 3k8l h LYS 514 Cb 0.61 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 3k8l h LYS 514 CO 0.04 1.03 0.10 1.25 -0.57 0.00 0.00 179.45 181.30 3k8l h LEU 515 N 1.03 0.34 -1.21 2.94 5.85 -1.18 -1.24 115.31 121.83 3k8l h LEU 515 Ca 0.20 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 3k8l h LEU 515 Cb 0.48 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 3k8l h LEU 515 CO 0.02 0.41 0.40 0.00 -0.34 0.00 0.00 178.44 178.93 3k8l h ALA 516 N 0.94 1.41 -0.47 1.25 0.00 -1.11 0.04 119.26 121.32 3k8l h ALA 516 Ca 0.08 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3k8l h ALA 516 Cb 0.17 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3k8l h ALA 516 CO -0.01 0.50 -0.00 0.00 0.00 0.00 0.00 179.25 179.74 3k8l h ALA 517 N 1.49 0.64 -0.49 0.00 0.00 -1.13 -1.54 119.26 118.22 3k8l h ALA 517 Ca 0.25 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3k8l h ALA 517 Cb -0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3k8l h ALA 517 CO -0.04 0.44 0.28 0.00 0.00 0.00 0.00 179.25 179.92 3k8l h ALA 518 N 0.92 0.62 -0.37 0.00 0.00 -0.31 -0.91 119.26 119.21 3k8l h ALA 518 Ca 0.13 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3k8l h ALA 518 Cb 0.51 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3k8l h ALA 518 CO 0.02 0.13 0.17 0.28 0.00 0.00 0.00 179.25 179.86 3k8l h VAL 519 N 0.65 1.18 -0.19 0.00 2.07 -0.88 -0.72 116.25 118.35 3k8l h VAL 519 Ca 0.17 -0.52 0.03 0.00 0.82 0.00 0.00 66.70 67.21 3k8l h VAL 519 Cb 0.03 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 3k8l h VAL 519 CO -0.03 0.19 -0.02 0.25 0.02 0.00 0.00 177.57 177.98 3k8l h LEU 520 N 0.46 -0.12 -0.11 2.57 5.85 -1.02 -2.60 115.31 120.35 3k8l h LEU 520 Ca 0.13 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3k8l h LEU 520 Cb 0.15 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.27 3k8l h LEU 520 CO -0.01 -0.04 -0.07 0.18 -0.34 0.00 0.00 178.44 178.16 3k8l n LEU 521 N -5.16 0.24 -0.45 2.25 4.77 -0.37 -3.44 117.00 114.83 3k8l n LEU 521 Ca -0.03 0.15 0.05 0.00 -0.03 0.00 0.00 56.01 56.15 3k8l n LEU 521 Cb 0.11 -0.24 0.06 0.00 -2.33 0.00 0.00 43.42 41.02 3k8l n LEU 521 CO 0.26 0.05 0.45 0.35 -1.33 0.00 0.00 177.39 177.16 3k8l n THR 522 N -1.14 0.16 -3.13 -5.08 -2.24 -0.29 -4.76 114.28 97.80 3k8l n THR 522 Ca 0.14 -0.58 -0.22 0.00 -2.27 0.00 0.00 64.05 61.12 3k8l n THR 522 Cb 0.26 1.10 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 -0.90 5.89 0.76 3.42 0.01 -0.99 -4.98 113.70 116.91 3k8l s SER 523 Ca 0.14 0.19 -0.11 0.00 1.31 0.00 0.00 55.95 57.48 3k8l s SER 523 Cb 0.09 -1.50 0.05 0.00 0.21 0.00 0.00 66.02 64.87 3k8l s SER 523 CO 0.14 -0.61 1.08 0.00 0.41 0.00 0.00 173.24 174.25 3k8l s ALA 524 N -2.45 2.35 0.00 1.44 0.00 -1.26 -4.94 121.76 116.90 3k8l s ALA 524 Ca 0.47 0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.49 3k8l s ALA 524 Cb -0.10 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.83 3k8l s ALA 524 CO 0.36 -1.60 0.00 0.41 0.00 0.00 0.00 175.76 174.93 3k8l n GLY 525 N -1.70 -0.70 3.07 0.00 0.00 -1.26 -4.86 105.19 99.74 3k8l n GLY 525 Ca 0.08 -2.20 -0.35 0.00 0.00 0.00 0.00 46.02 43.54 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 -0.08 3.39 0.41 1.61 0.09 0.17 -4.79 115.29 116.09 3k8l s HIS 526 Ca 0.00 -2.77 -0.25 0.00 -0.00 0.00 0.00 55.06 52.04 3k8l s HIS 526 Cb 0.00 -3.14 -0.08 0.00 -0.00 0.00 0.00 32.58 29.35 3k8l s HIS 526 CO 0.00 -0.84 1.23 -1.25 -0.00 0.00 0.00 174.74 173.88 3k8l s PRO 527 N -0.01 4.00 0.02 8.40 0.04 -1.23 -2.75 135.00 143.46 3k8l s PRO 527 Ca 0.16 1.98 0.06 0.00 0.04 0.00 0.00 61.00 63.24 3k8l s PRO 527 Cb -0.21 -2.70 -0.03 0.00 0.04 0.00 0.00 34.50 31.60 3k8l s PRO 527 CO -0.03 -0.41 -0.16 0.71 0.04 0.00 0.00 177.00 177.15 3k8l s TYR 528 N -1.35 2.61 -0.12 0.56 1.51 -0.46 -0.96 117.35 119.14 3k8l s TYR 528 Ca 0.57 -0.22 0.03 0.00 -1.01 0.00 0.00 57.07 56.44 3k8l s TYR 528 Cb -0.34 -1.51 0.00 0.00 -0.11 0.00 0.00 41.96 40.00 3k8l s TYR 528 CO 0.43 0.24 -0.21 0.42 -1.11 0.00 0.00 175.55 175.32 3k8l s ILE 529 N -0.88 2.22 -0.25 2.71 1.01 0.11 -4.44 121.20 121.67 3k8l s ILE 529 Ca 0.14 -0.95 -0.20 0.00 0.00 0.00 0.00 60.65 59.64 3k8l s ILE 529 Cb -0.11 -1.88 -0.02 0.00 0.01 0.00 0.00 42.46 40.47 3k8l s ILE 529 CO 0.04 0.55 0.62 -0.47 0.00 0.00 0.00 174.94 175.69 3k8l s TYR 530 N 0.55 3.29 0.09 3.97 5.04 -1.26 -0.26 117.35 128.76 3k8l s TYR 530 Ca -0.13 0.82 -0.32 0.00 -2.44 0.00 0.00 57.07 55.00 3k8l s TYR 530 Cb -0.17 -2.83 -0.17 0.00 0.35 0.00 0.00 41.96 39.14 3k8l s TYR 530 CO 0.04 -0.31 0.76 2.48 -1.34 0.00 0.00 175.55 177.18 3k8l n TYR 531 N 5.64 0.11 0.00 4.97 0.18 0.12 -1.46 117.16 126.73 3k8l n TYR 531 Ca -0.01 0.94 0.00 0.00 1.88 0.00 0.00 57.90 60.72 3k8l n TYR 531 Cb 0.49 -1.88 0.00 0.00 -0.38 0.00 0.00 39.34 37.57 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 1.60 3.31 0.24 -7.48 0.00 -1.26 -4.87 105.19 96.73 3k8l n GLY 532 Ca 0.18 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 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 2.24 0.00 0.00 1.61 4.11 -1.58 -0.67 114.58 120.29 3k8l h GLU 533 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 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 0.20 -0.12 0.93 0.07 0.00 0.00 179.01 180.09 3k8l h GLU 534 N 0.00 0.00 0.00 1.06 3.07 -1.89 -2.97 114.58 113.85 3k8l h GLU 534 Ca -0.00 0.00 -0.31 0.00 -0.50 0.00 0.00 59.36 58.54 3k8l h GLU 534 Cb 0.54 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.39 3k8l h GLU 534 CO 0.03 0.12 -2.13 1.28 -1.40 0.00 0.00 179.01 176.91 3k8l n LEU 535 N -3.33 0.28 0.00 1.33 4.77 -0.62 -1.75 117.00 117.67 3k8l n LEU 535 Ca -0.00 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 3k8l n LEU 535 Cb 0.33 0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.78 3k8l n LEU 535 CO 0.30 0.42 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 3k8l n GLY 536 N 1.65 1.66 3.69 -0.72 0.00 -0.35 -4.77 105.19 106.35 3k8l n GLY 536 Ca -0.26 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.38 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 4.68 -4.40 0.99 4.77 -0.88 -4.83 117.00 117.33 3k8l n LEU 537 Ca 0.00 0.94 -0.22 0.00 -0.03 0.00 0.00 56.01 56.70 3k8l n LEU 537 Cb 0.00 -1.50 -0.08 0.00 -2.33 0.00 0.00 43.42 39.51 3k8l n LEU 537 CO 0.00 -1.05 -0.18 -0.72 -1.33 0.00 0.00 177.39 174.12 3k8l s TYR 538 N -1.35 1.72 0.00 -1.77 -0.85 -1.26 -4.33 117.35 109.51 3k8l s TYR 538 Ca 0.72 -1.39 0.00 0.00 -0.52 0.00 0.00 57.07 55.87 3k8l s TYR 538 Cb -0.44 -0.96 0.00 0.00 0.38 0.00 0.00 41.96 40.95 3k8l s TYR 538 CO 0.49 -0.50 0.00 0.41 -1.52 0.00 0.00 175.55 174.43 3k8l n GLY 539 N -0.73 4.43 3.55 5.49 0.00 -1.26 -4.85 105.19 111.81 3k8l n GLY 539 Ca -0.01 -1.35 -0.26 0.00 0.00 0.00 0.00 46.02 44.41 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 2.34 -2.15 2.61 -4.23 -1.26 -1.28 115.64 109.67 3k8l s THR 540 Ca 0.00 -2.19 0.17 0.00 -1.18 0.00 0.00 61.69 58.49 3k8l s THR 540 Cb 0.00 -2.64 0.41 0.00 1.34 0.00 0.00 72.50 71.61 3k8l s THR 540 CO 0.00 -0.22 1.41 2.29 -0.54 0.00 0.00 174.62 177.55 3k8l n LYS 541 N -0.80 1.95 -0.36 3.99 2.85 -1.26 -4.33 118.16 120.19 3k8l n LYS 541 Ca -0.05 -1.45 -0.09 0.00 -1.05 0.00 0.00 58.31 55.67 3k8l n LYS 541 Cb 0.63 -1.37 -0.09 0.00 -0.65 0.00 0.00 35.03 33.55 3k8l n LYS 541 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3k8l n ASP 542 N 0.67 -0.91 -1.49 -5.58 8.00 -1.26 -1.06 116.55 114.91 3k8l n ASP 542 Ca 0.15 1.58 0.07 0.00 0.71 0.00 0.00 54.79 57.31 3k8l n ASP 542 Cb 0.37 -0.22 0.32 0.00 -0.02 0.00 0.00 41.12 41.57 3k8l n ASP 542 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3k8l n ASN 543 N -5.02 4.42 0.00 -2.24 5.03 -1.26 -4.98 115.26 111.21 3k8l n ASN 543 Ca 0.02 -2.54 0.00 0.00 0.87 0.00 0.00 54.58 52.93 3k8l n ASN 543 Cb 0.22 -0.58 0.00 0.00 -1.02 0.00 0.00 39.78 38.40 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 0.80 4.40 0.27 7.41 0.00 -0.22 -4.95 105.19 112.89 3k8l n GLY 544 Ca 0.22 -0.95 0.15 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.67 1.61 3.32 -1.92 -2.98 116.42 115.78 3k8l h ASP 545 Ca 0.00 0.00 0.14 0.00 0.02 0.00 0.00 57.03 57.19 3k8l h ASP 545 Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 3k8l h ASP 545 CO 0.00 0.08 0.45 -0.33 -1.72 0.00 0.00 179.24 177.72 3k8l h GLU 546 N 0.00 0.30 0.00 3.56 3.07 -1.92 -1.01 114.58 118.59 3k8l h GLU 546 Ca -0.00 -0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 58.83 3k8l h GLU 546 Cb 0.52 -0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 28.36 3k8l h GLU 546 CO 0.01 0.20 -0.07 1.88 -1.40 0.00 0.00 179.01 179.63 3k8l h TYR 547 N 0.31 0.00 -0.48 4.33 0.05 -1.72 -0.27 116.97 119.19 3k8l h TYR 547 Ca 0.32 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.10 3k8l h TYR 547 Cb 0.82 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.56 3k8l h TYR 547 CO -0.00 0.07 0.00 1.33 -1.05 0.00 0.00 178.16 178.51 3k8l n VAL 548 N -3.68 0.65 -2.23 -2.88 0.24 -0.40 -4.20 118.33 105.83 3k8l n VAL 548 Ca -0.02 -0.82 -0.16 0.00 -2.04 0.00 0.00 64.34 61.29 3k8l n VAL 548 Cb 0.18 0.85 0.03 0.00 -1.47 0.00 0.00 33.84 33.43 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 1.51 3.01 -1.35 7.34 1.74 -0.13 -4.81 116.66 123.96 3k8l n ARG 549 Ca 0.20 -3.94 -0.31 0.00 -0.77 0.00 0.00 57.85 53.03 3k8l n ARG 549 Cb 0.60 -2.05 0.08 0.00 -1.02 0.00 0.00 32.46 30.07 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 -3.62 4.67 0.19 0.55 1.04 -1.08 -4.85 113.70 110.59 3k8l s SER 550 Ca 0.44 1.82 -0.33 0.00 0.48 0.00 0.00 55.95 58.36 3k8l s SER 550 Cb 0.38 -2.52 -0.15 0.00 0.10 0.00 0.00 66.02 63.84 3k8l s SER 550 CO 0.01 -1.92 1.31 -2.65 0.98 0.00 0.00 173.24 170.97 3k8l n PRO 551 N -3.36 1.57 -2.12 4.02 -0.02 -1.26 -4.92 135.00 128.91 3k8l n PRO 551 Ca 0.09 0.56 -0.42 0.00 -2.02 0.00 0.00 63.50 61.71 3k8l n PRO 551 Cb 0.53 -2.16 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 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 -0.18 4.28 -1.02 -0.52 1.75 -0.84 -4.93 119.30 117.85 3k8l s MET 552 Ca 0.73 2.11 -0.18 0.00 -1.25 0.00 0.00 55.69 57.10 3k8l s MET 552 Cb -0.77 -3.37 0.13 0.00 2.84 0.00 0.00 34.83 33.65 3k8l s MET 552 CO 0.49 -0.53 1.26 -0.51 -0.65 0.00 0.00 175.02 175.09 3k8l s LEU 553 N 1.65 4.79 0.05 4.11 1.43 -1.26 -4.46 118.68 124.99 3k8l s LEU 553 Ca 0.66 -2.19 -0.18 0.00 -1.03 0.00 0.00 54.13 51.40 3k8l s LEU 553 Cb -0.37 -2.43 -0.14 0.00 0.03 0.00 0.00 46.19 43.28 3k8l s LEU 553 CO 0.30 -1.06 1.31 -0.50 0.23 0.00 0.00 176.35 176.63 3k8l h TRP 554 N 8.55 0.63 0.00 0.29 4.06 -1.93 -1.20 115.95 126.35 3k8l h TRP 554 Ca 0.21 -0.23 0.00 0.00 2.06 0.00 0.00 58.89 60.93 3k8l h TRP 554 Cb 0.98 -0.12 0.00 0.00 -1.00 0.00 0.00 29.16 29.02 3k8l h TRP 554 CO 1.18 0.94 0.00 0.41 -3.56 0.00 0.00 178.44 177.41 3k8l n GLY 555 N 0.40 0.90 0.00 1.49 0.00 -1.26 -2.50 105.19 104.22 3k8l n GLY 555 Ca -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 0.16 0.00 0.00 1.61 5.68 -1.26 -4.91 116.55 117.83 3k8l n ASP 556 Ca 0.00 -0.87 0.08 0.00 -0.50 0.00 0.00 54.79 53.51 3k8l n ASP 556 Cb 0.00 0.00 0.42 0.00 -1.14 0.00 0.00 41.12 40.40 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 -2.21 0.00 0.16 -1.12 3.41 -1.26 -3.29 113.62 109.31 3k8l n SER 557 Ca 0.00 0.06 0.13 0.00 -0.26 0.00 0.00 58.87 58.79 3k8l n SER 557 Cb 0.00 -0.29 0.36 0.00 -0.26 0.00 0.00 64.21 64.02 3k8l n SER 557 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 3k8l h TYR 558 N 0.00 0.00 -2.23 7.33 -1.99 -1.97 -3.45 116.97 114.65 3k8l h TYR 558 Ca 0.00 0.00 -0.58 0.00 2.00 0.00 0.00 58.73 60.15 3k8l h TYR 558 Cb 0.16 0.00 0.04 0.00 2.00 0.00 0.00 36.73 38.93 3k8l h TYR 558 CO 0.00 0.00 0.94 2.41 -0.00 0.00 0.00 178.16 181.51 3k8l n THR 559 N -2.60 0.23 -2.01 -2.88 -1.04 -1.21 -0.33 114.28 104.45 3k8l n THR 559 Ca 0.04 -0.04 -0.28 0.00 -2.04 0.00 0.00 64.05 61.73 3k8l n THR 559 Cb 0.43 -1.73 0.07 0.00 -1.82 0.00 0.00 70.33 67.29 3k8l n THR 559 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 3k8l s THR 560 N 2.14 2.51 -0.47 12.58 -4.23 -1.26 -4.76 115.64 122.15 3k8l s THR 560 Ca 0.83 0.04 0.06 0.00 -1.18 0.00 0.00 61.69 61.45 3k8l s THR 560 Cb -0.65 -3.14 0.23 0.00 1.34 0.00 0.00 72.50 70.28 3k8l s THR 560 CO 0.42 -0.17 0.77 -3.20 -0.54 0.00 0.00 174.62 171.90 3k8l n ASN 561 N -3.10 -2.29 0.02 3.99 4.05 0.17 -4.77 115.26 113.32 3k8l n ASN 561 Ca 0.07 -3.10 0.12 0.00 0.45 0.00 0.00 54.58 52.12 3k8l n ASN 561 Cb 0.60 1.25 0.11 0.00 1.23 0.00 0.00 39.78 42.97 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 1.83 0.22 -4.05 1.20 0.18 -1.14 -4.66 117.16 110.74 3k8l n TYR 562 Ca 0.13 0.06 -0.07 0.00 1.88 0.00 0.00 57.90 59.90 3k8l n TYR 562 Cb 0.59 -0.38 -0.10 0.00 -0.38 0.00 0.00 39.34 39.07 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 -3.11 0.20 -0.50 -3.48 -1.32 -1.26 -5.02 115.64 101.15 3k8l s THR 563 Ca 0.07 -1.65 0.23 0.00 -1.21 0.00 0.00 61.69 59.14 3k8l s THR 563 Cb 0.15 -1.39 0.02 0.00 -1.51 0.00 0.00 72.50 69.78 3k8l s THR 563 CO 0.76 -0.91 1.21 0.44 -2.21 0.00 0.00 174.62 173.91 3k8l h ASP 564 N 3.22 0.00 -0.77 8.08 3.32 -2.03 -3.41 116.42 124.84 3k8l h ASP 564 Ca -0.34 -0.15 -0.60 0.00 0.02 0.00 0.00 57.03 55.96 3k8l h ASP 564 Cb 1.15 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.63 3k8l h ASP 564 CO 0.63 0.08 1.94 -0.54 -1.72 0.00 0.00 179.24 179.62 3k8l s LYS 565 N -3.24 3.64 -0.03 3.56 1.02 -1.26 -4.91 119.74 118.52 3k8l s LYS 565 Ca 0.04 -1.81 0.05 0.00 0.02 0.00 0.00 55.97 54.27 3k8l s LYS 565 Cb 0.12 -5.47 -0.01 0.00 -0.52 0.00 0.00 37.83 31.95 3k8l s LYS 565 CO 0.75 -2.67 -0.17 0.99 -0.92 0.00 0.00 175.35 173.33 3k8l s THR 566 N 5.83 1.42 -0.57 2.17 2.01 -1.26 -4.39 115.64 120.85 3k8l s THR 566 Ca 0.57 -0.73 -0.22 0.00 0.31 0.00 0.00 61.69 61.62 3k8l s THR 566 Cb 0.03 -1.20 0.06 0.00 0.01 0.00 0.00 72.50 71.39 3k8l s THR 566 CO 0.09 0.41 0.86 -0.62 -0.69 0.00 0.00 174.62 174.67 3k8l s ASP 567 N -0.12 6.26 0.52 3.53 -1.08 -1.26 -4.91 116.67 119.61 3k8l s ASP 567 Ca -0.00 -0.70 0.31 0.00 -0.52 0.00 0.00 52.55 51.64 3k8l s ASP 567 Cb -0.10 -2.39 1.69 0.00 -1.46 0.00 0.00 42.92 40.66 3k8l s ASP 567 CO 0.01 -1.20 1.94 0.00 0.52 0.00 0.00 175.17 176.44 3k8l h ALA 568 N 9.30 1.09 0.00 3.66 0.00 -1.98 -2.53 119.26 128.80 3k8l h ALA 568 Ca -0.27 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 3k8l h ALA 568 Cb 1.08 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 3k8l h ALA 568 CO 1.08 -0.09 -0.25 1.79 0.00 0.00 0.00 179.25 181.79 3k8l h THR 569 N 0.00 0.33 0.08 0.00 1.35 -2.00 -3.38 112.91 109.30 3k8l h THR 569 Ca 0.00 -1.48 0.02 0.00 -0.55 0.00 0.00 66.41 64.40 3k8l h THR 569 Cb 0.20 2.15 -0.03 0.00 -1.73 0.00 0.00 68.15 68.73 3k8l h THR 569 CO 0.00 0.19 -0.21 0.58 -0.25 0.00 0.00 175.52 175.83 3k8l h VAL 570 N 0.00 0.52 0.00 6.82 2.07 -1.84 -1.37 116.25 122.46 3k8l h VAL 570 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 3k8l h VAL 570 Cb 1.16 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3k8l h VAL 570 CO 0.03 0.00 -0.03 0.77 0.02 0.00 0.00 177.57 178.35 3k8l h SER 571 N -0.38 0.00 1.14 0.57 4.64 -1.79 -0.96 113.55 116.77 3k8l h SER 571 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3k8l h SER 571 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3k8l h SER 571 CO -0.14 0.03 -0.43 0.11 -0.87 0.00 0.00 176.83 175.54 3k8l h LYS 572 N 0.00 0.00 0.00 4.77 1.57 -1.53 -3.36 116.57 118.01 3k8l h LYS 572 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3k8l h LYS 572 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 3k8l h LYS 572 CO 0.00 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 178.97 3k8l n ASN 573 N -2.28 1.21 -4.00 0.86 4.13 -0.59 -5.00 115.26 109.59 3k8l n ASN 573 Ca 0.04 -1.24 -0.27 0.00 1.68 0.00 0.00 54.58 54.78 3k8l n ASN 573 Cb 0.45 0.00 -0.17 0.00 -1.54 0.00 0.00 39.78 38.53 3k8l n ASN 573 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3k8l s VAL 574 N -0.24 1.29 0.44 2.41 1.01 -0.45 -5.06 120.40 119.80 3k8l s VAL 574 Ca 0.00 -0.51 -0.24 0.00 0.00 0.00 0.00 61.98 61.23 3k8l s VAL 574 Cb 0.00 -1.22 -0.08 0.00 0.00 0.00 0.00 36.38 35.09 3k8l s VAL 574 CO 0.00 0.40 1.20 -0.54 0.00 0.00 0.00 175.10 176.17 3k8l s LYS 575 N 1.15 3.84 0.96 2.72 -0.14 -1.26 -4.79 119.74 122.22 3k8l s LYS 575 Ca -0.04 1.89 -0.14 0.00 -1.36 0.00 0.00 55.97 56.32 3k8l s LYS 575 Cb -0.14 -2.54 0.17 0.00 -1.68 0.00 0.00 37.83 33.64 3k8l s LYS 575 CO -0.03 -0.51 1.18 0.95 -0.76 0.00 0.00 175.35 176.18 3k8l s THR 576 N -1.44 1.94 0.14 2.17 -4.23 -1.26 -4.75 115.64 108.21 3k8l s THR 576 Ca 0.61 0.00 -0.18 0.00 -1.18 0.00 0.00 61.69 60.93 3k8l s THR 576 Cb -0.32 -2.79 -0.02 0.00 1.34 0.00 0.00 72.50 70.71 3k8l s THR 576 CO 0.39 0.00 1.74 0.58 -0.54 0.00 0.00 174.62 176.79 3k8l h VAL 577 N -1.65 0.89 -0.42 2.29 2.07 -1.15 0.74 116.25 119.02 3k8l h VAL 577 Ca -0.48 -0.05 0.08 0.00 0.82 0.00 0.00 66.70 67.07 3k8l h VAL 577 Cb 1.30 0.72 -0.07 0.00 -1.52 0.00 0.00 31.29 31.73 3k8l h VAL 577 CO 0.53 0.03 -0.04 0.00 0.02 0.00 0.00 177.57 178.11 3k8l h ALA 578 N 1.18 0.35 -0.41 1.67 0.00 -1.77 -0.21 119.26 120.07 3k8l h ALA 578 Ca 0.11 0.14 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 3k8l h ALA 578 Cb 0.11 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3k8l h ALA 578 CO -0.15 -0.42 -0.02 -0.44 0.00 0.00 0.00 179.25 178.23 3k8l h ASP 579 N 0.07 0.73 -0.05 0.00 3.32 -1.75 -3.22 116.42 115.52 3k8l h ASP 579 Ca 0.20 -0.32 -0.14 0.00 0.02 0.00 0.00 57.03 56.79 3k8l h ASP 579 Cb 0.30 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3k8l h ASP 579 CO -0.37 0.87 -0.45 1.56 -1.72 0.00 0.00 179.24 179.13 3k8l h GLN 580 N 0.57 0.59 -0.74 3.56 4.20 -0.41 -2.58 115.11 120.31 3k8l h GLN 580 Ca 0.11 -0.33 0.03 0.00 0.06 0.00 0.00 58.65 58.53 3k8l h GLN 580 Cb 0.51 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.27 3k8l h GLN 580 CO 0.02 0.93 0.49 1.96 -0.67 0.00 0.00 178.83 181.56 3k8l h GLN 581 N 0.48 0.88 0.00 1.46 4.20 -1.09 -1.05 115.11 119.98 3k8l h GLN 581 Ca 0.03 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.69 3k8l h GLN 581 Cb 0.98 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.56 3k8l h GLN 581 CO 0.09 0.58 -0.12 0.00 -0.67 0.00 0.00 178.83 178.71 3k8l n ALA 582 N -2.43 2.59 -2.60 3.87 0.00 -1.13 -4.70 120.51 116.11 3k8l n ALA 582 Ca 0.09 -0.15 -0.42 0.00 0.00 0.00 0.00 53.44 52.97 3k8l n ALA 582 Cb 0.12 -1.39 -0.10 0.00 0.00 0.00 0.00 19.45 18.07 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 -3.13 5.97 0.53 0.00 2.15 -0.40 -4.95 116.67 116.83 3k8l s ASP 583 Ca 0.13 -0.91 0.26 0.00 0.43 0.00 0.00 52.55 52.46 3k8l s ASP 583 Cb 0.18 -2.11 1.41 0.00 -0.30 0.00 0.00 42.92 42.11 3k8l s ASP 583 CO 0.57 -0.42 1.98 0.74 -0.17 0.00 0.00 175.17 177.88 3k8l h THR 584 N 5.71 0.70 -0.52 1.71 2.02 -1.84 -0.87 112.91 119.83 3k8l h THR 584 Ca -0.27 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.91 3k8l h THR 584 Cb 1.12 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 68.23 3k8l h THR 584 CO 0.70 0.00 0.00 1.41 0.37 0.00 0.00 175.52 178.00 3k8l n HIS 585 N -4.35 0.69 -1.52 3.16 8.25 -1.26 -4.86 115.22 115.32 3k8l n HIS 585 Ca 0.11 -0.34 -0.32 0.00 -0.26 0.00 0.00 57.72 56.90 3k8l n HIS 585 Cb 0.66 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.85 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 -1.12 4.74 0.23 0.41 1.04 -0.33 -4.94 113.70 113.73 3k8l s SER 586 Ca 0.38 1.98 -0.05 0.00 0.48 0.00 0.00 55.95 58.75 3k8l s SER 586 Cb 0.20 -2.55 0.22 0.00 0.10 0.00 0.00 66.02 64.00 3k8l s SER 586 CO 0.27 -1.88 1.70 0.25 0.98 0.00 0.00 173.24 174.56 3k8l h LEU 587 N -0.45 0.86 -0.28 2.42 5.85 -1.89 -2.63 115.31 119.19 3k8l h LEU 587 Ca -0.46 -0.24 0.04 0.00 0.84 0.00 0.00 57.88 58.06 3k8l h LEU 587 Cb 1.25 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 42.01 3k8l h LEU 587 CO 0.52 0.94 0.06 0.25 -0.34 0.00 0.00 178.44 179.88 3k8l h LEU 588 N 0.81 0.02 -1.97 2.25 5.85 -1.67 -1.00 115.31 119.60 3k8l h LEU 588 Ca 0.15 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 3k8l h LEU 588 Cb 0.53 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 3k8l h LEU 588 CO 0.03 0.05 -0.11 0.78 -0.34 0.00 0.00 178.44 178.85 3k8l h ASN 589 N 0.16 0.00 -0.01 1.25 -0.26 -1.74 -0.20 115.58 114.79 3k8l h ASN 589 Ca 0.13 0.00 -0.15 0.00 -0.56 0.00 0.00 56.30 55.71 3k8l h ASN 589 Cb 0.13 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.38 3k8l h ASN 589 CO -0.17 0.11 -0.51 0.40 -1.06 0.00 0.00 177.43 176.20 3k8l h ILE 590 N 0.00 1.31 -0.31 2.81 5.03 -0.86 -1.73 117.51 123.76 3k8l h ILE 590 Ca -0.00 -1.73 -0.06 0.00 -0.12 0.00 0.00 64.86 62.94 3k8l h ILE 590 Cb 0.27 1.70 -0.01 0.00 -3.03 0.00 0.00 36.82 35.76 3k8l h ILE 590 CO 0.01 0.54 -0.04 1.88 -0.68 0.00 0.00 178.15 179.86 3k8l h TYR 591 N 0.45 0.64 -0.67 1.37 -1.99 -0.22 -0.43 116.97 116.12 3k8l h TYR 591 Ca 0.02 -0.13 0.03 0.00 2.00 0.00 0.00 58.73 60.65 3k8l h TYR 591 Cb 1.04 -0.16 -0.04 0.00 2.00 0.00 0.00 36.73 39.57 3k8l h TYR 591 CO 0.04 0.74 0.42 0.74 -0.00 0.00 0.00 178.16 180.11 3k8l h PHE 592 N 0.36 0.79 -0.50 4.88 0.04 -1.13 -0.12 116.94 121.26 3k8l h PHE 592 Ca 0.08 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.84 3k8l h PHE 592 Cb 0.51 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.38 3k8l h PHE 592 CO 0.05 0.46 0.20 1.03 -0.60 0.00 0.00 178.31 179.44 3k8l h SER 593 N 0.83 0.70 -0.27 2.17 0.87 -1.17 -2.50 113.55 114.18 3k8l h SER 593 Ca 0.27 -0.17 -0.15 0.00 -1.23 0.00 0.00 61.79 60.51 3k8l h SER 593 Cb 0.01 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 61.79 3k8l h SER 593 CO -0.10 0.68 -0.41 -0.07 -0.53 0.00 0.00 176.83 176.40 3k8l h LEU 594 N 0.67 0.83 -0.69 2.23 3.38 -0.66 -2.17 115.31 118.90 3k8l h LEU 594 Ca 0.17 -0.52 -0.10 0.00 0.09 0.00 0.00 57.88 57.52 3k8l h LEU 594 Cb 0.20 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 3k8l h LEU 594 CO -0.01 1.18 -0.09 0.71 0.09 0.00 0.00 178.44 180.32 3k8l h THR 595 N 0.49 1.26 -0.55 0.22 1.35 -1.04 -1.54 112.91 113.10 3k8l h THR 595 Ca 0.02 -1.20 -0.10 0.00 -0.55 0.00 0.00 66.41 64.59 3k8l h THR 595 Cb 1.00 0.97 -0.02 0.00 -1.73 0.00 0.00 68.15 68.37 3k8l h THR 595 CO 0.09 0.42 -0.03 -0.09 -0.25 0.00 0.00 175.52 175.67 3k8l h ARG 596 N 0.83 0.99 -0.69 4.72 2.43 -1.47 -0.79 114.38 120.41 3k8l h ARG 596 Ca 0.14 -0.33 -0.00 0.00 -0.81 0.00 0.00 59.98 58.97 3k8l h ARG 596 Cb 0.62 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 3k8l h ARG 596 CO 0.04 1.01 0.42 1.25 -1.51 0.00 0.00 179.97 181.18 3k8l h LEU 597 N 0.87 0.82 -0.83 3.80 5.85 -1.12 -1.25 115.31 123.46 3k8l h LEU 597 Ca 0.15 -0.06 -0.10 0.00 0.84 0.00 0.00 57.88 58.71 3k8l h LEU 597 Cb 0.58 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 3k8l h LEU 597 CO 0.03 0.64 -0.24 -0.09 -0.34 0.00 0.00 178.44 178.45 3k8l h ARG 598 N 0.94 0.61 0.00 1.25 2.43 -1.05 -2.01 114.38 116.55 3k8l h ARG 598 Ca 0.25 -0.24 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3k8l h ARG 598 Cb -0.03 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 3k8l h ARG 598 CO -0.05 0.80 0.00 0.09 -1.51 0.00 0.00 179.97 179.30 3k8l n ASN 599 N -4.12 0.00 -0.11 -3.80 5.03 -0.32 -3.50 115.26 108.45 3k8l n ASN 599 Ca -0.00 0.23 -0.23 0.00 0.87 0.00 0.00 54.58 55.45 3k8l n ASN 599 Cb 0.42 -0.40 -0.12 0.00 -1.02 0.00 0.00 39.78 38.67 3k8l n ASN 599 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 3k8l n THR 600 N -1.40 1.56 -3.74 3.41 -1.04 -0.52 -3.35 114.28 109.21 3k8l n THR 600 Ca 0.08 -0.45 -0.37 0.00 -2.04 0.00 0.00 64.05 61.27 3k8l n THR 600 Cb 0.23 -1.71 -0.12 0.00 -1.82 0.00 0.00 70.33 66.91 3k8l n THR 600 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 3k8l s TYR 601 N -2.50 3.14 0.40 -1.42 1.51 -0.97 -4.98 117.35 112.52 3k8l s TYR 601 Ca -0.33 -0.23 0.14 0.00 -1.01 0.00 0.00 57.07 55.64 3k8l s TYR 601 Cb 0.10 -2.26 0.98 0.00 -0.11 0.00 0.00 41.96 40.67 3k8l s TYR 601 CO 0.59 -0.25 1.87 -1.35 -1.11 0.00 0.00 175.55 175.31 3k8l h PRO 602 N 8.11 0.49 -0.17 -1.71 0.11 -1.92 -0.15 132.00 136.77 3k8l h PRO 602 Ca -0.37 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.72 3k8l h PRO 602 Cb 1.18 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3k8l h PRO 602 CO 0.58 0.32 0.11 0.00 -0.21 0.00 0.00 178.00 178.81 3k8l h ALA 603 N 1.62 1.96 0.12 -0.75 0.00 -1.86 0.12 119.26 120.46 3k8l h ALA 603 Ca 0.44 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.98 3k8l h ALA 603 Cb 0.94 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 3k8l h ALA 603 CO -0.18 0.02 -2.02 1.28 0.00 0.00 0.00 179.25 178.36 3k8l n LEU 604 N -4.51 2.60 -0.04 0.00 4.32 -0.20 -2.36 117.00 116.81 3k8l n LEU 604 Ca -0.00 0.20 -0.11 0.00 -0.02 0.00 0.00 56.01 56.07 3k8l n LEU 604 Cb 0.13 -1.07 0.02 0.00 -1.62 0.00 0.00 43.42 40.88 3k8l n LEU 604 CO 0.34 0.85 0.49 0.00 -1.22 0.00 0.00 177.39 177.86 3k8l h ALA 605 N 0.10 0.64 0.00 -1.18 0.00 -0.90 -3.39 119.26 114.53 3k8l h ALA 605 Ca -0.43 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 53.99 3k8l h ALA 605 Cb 2.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.73 3k8l h ALA 605 CO 0.08 0.68 -0.18 -0.85 0.00 0.00 0.00 179.25 178.98 3k8l n GLU 606 N -4.00 0.00 -1.86 0.00 0.28 0.36 -4.49 120.64 110.93 3k8l n GLU 606 Ca -0.03 -0.65 -0.29 0.00 -0.16 0.00 0.00 57.16 56.03 3k8l n GLU 606 Cb 0.59 -0.47 0.13 0.00 1.43 0.00 0.00 31.44 33.12 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 -0.35 1.66 0.06 -1.84 0.00 -0.85 -4.93 107.32 101.07 3k8l s GLY 607 Ca 0.00 -0.85 0.02 0.00 0.00 0.00 0.00 44.72 43.89 3k8l s GLY 607 CO 0.00 -0.24 0.08 -1.31 0.00 0.00 0.00 173.10 171.63 3k8l s ASN 608 N -4.63 5.55 -0.09 1.64 0.02 0.10 -4.69 114.94 112.85 3k8l s ASN 608 Ca 0.67 0.02 -0.10 0.00 -1.02 0.00 0.00 52.86 52.43 3k8l s ASN 608 Cb -0.09 -1.51 -0.05 0.00 0.02 0.00 0.00 41.25 39.63 3k8l s ASN 608 CO 0.51 0.19 0.23 -0.32 0.02 0.00 0.00 177.10 177.73 3k8l s MET 609 N -2.27 3.64 0.03 -0.60 -2.45 -1.26 -1.10 119.30 115.28 3k8l s MET 609 Ca 0.28 0.04 0.00 0.00 -1.25 0.00 0.00 55.69 54.77 3k8l s MET 609 Cb -0.12 -3.21 -0.02 0.00 1.25 0.00 0.00 34.83 32.72 3k8l s MET 609 CO 0.21 0.72 -0.04 0.95 1.05 0.00 0.00 175.02 177.91 3k8l s THR 610 N -0.95 0.19 0.76 10.11 -4.23 -0.74 -4.97 115.64 115.81 3k8l s THR 610 Ca 0.18 -0.98 -0.13 0.00 -1.18 0.00 0.00 61.69 59.57 3k8l s THR 610 Cb -0.13 -0.38 0.06 0.00 1.34 0.00 0.00 72.50 73.38 3k8l s THR 610 CO 0.07 -0.50 1.15 -1.59 -0.54 0.00 0.00 174.62 173.20 3k8l s LYS 611 N -1.60 2.07 0.39 3.99 -2.85 -1.26 -0.56 119.74 119.92 3k8l s LYS 611 Ca -0.14 1.51 -0.23 0.00 -1.00 0.00 0.00 55.97 56.11 3k8l s LYS 611 Cb -0.09 -1.85 -0.11 0.00 -2.06 0.00 0.00 37.83 33.72 3k8l s LYS 611 CO -0.01 -1.84 0.94 -1.58 0.10 0.00 0.00 175.35 172.97 3k8l s HIS 612 N -2.39 3.46 0.38 1.78 5.65 -1.25 -4.53 115.29 118.38 3k8l s HIS 612 Ca 0.68 1.67 0.10 0.00 0.25 0.00 0.00 55.06 57.76 3k8l s HIS 612 Cb -0.23 -2.87 0.75 0.00 -1.18 0.00 0.00 32.58 29.04 3k8l s HIS 612 CO 0.49 0.02 1.88 0.66 -0.65 0.00 0.00 174.74 177.14 3k8l h SER 613 N 2.41 0.17 0.00 9.88 4.64 -1.95 -3.39 113.55 125.30 3k8l h SER 613 Ca -0.48 -0.04 -0.06 0.00 -0.47 0.00 0.00 61.79 60.74 3k8l h SER 613 Cb 1.18 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 3k8l h SER 613 CO 0.63 0.40 -0.81 0.52 -0.87 0.00 0.00 176.83 176.70 3k8l n VAL 614 N -4.21 1.21 -2.62 0.95 0.31 -1.26 -4.89 118.33 107.82 3k8l n VAL 614 Ca -0.01 0.16 -0.43 0.00 -0.01 0.00 0.00 64.34 64.05 3k8l n VAL 614 Cb 0.32 -1.89 -0.01 0.00 -0.91 0.00 0.00 33.84 31.35 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 -2.39 2.78 0.00 3.52 2.02 -1.26 -4.50 117.35 117.52 3k8l s TYR 615 Ca -0.15 -1.44 0.00 0.00 -0.37 0.00 0.00 57.07 55.11 3k8l s TYR 615 Cb 0.03 -4.69 0.00 0.00 -0.40 0.00 0.00 41.96 36.91 3k8l s TYR 615 CO 0.22 -1.80 0.00 0.27 -1.57 0.00 0.00 175.55 172.67 3k8l n ASN 616 N 8.23 0.04 0.33 2.29 0.23 -1.26 -4.23 115.26 120.89 3k8l n ASN 616 Ca 0.42 0.00 0.21 0.00 -0.53 0.00 0.00 54.58 54.69 3k8l n ASN 616 Cb 0.47 0.00 1.11 0.00 -2.08 0.00 0.00 39.78 39.28 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 0.00 0.00 -3.83 9.09 -1.82 -2.06 114.58 115.96 3k8l h GLU 617 Ca 0.00 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 59.36 3k8l h GLU 617 Cb 0.00 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.09 3k8l h GLU 617 CO 0.00 0.00 -0.23 0.66 0.05 0.00 0.00 179.01 179.49 3k8l h SER 618 N 0.00 0.00 -0.80 3.06 4.64 -1.88 -2.67 113.55 115.91 3k8l h SER 618 Ca -0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 3k8l h SER 618 Cb 0.09 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.02 3k8l h SER 618 CO 0.00 0.23 0.35 0.00 -0.87 0.00 0.00 176.83 176.54 3k8l n GLN 619 N -3.45 3.50 0.20 4.77 1.13 -0.77 -4.59 117.38 118.16 3k8l n GLN 619 Ca -0.00 -3.07 0.15 0.00 -1.94 0.00 0.00 57.00 52.14 3k8l n GLN 619 Cb 0.41 -2.22 0.78 0.00 0.11 0.00 0.00 30.24 29.32 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 2.41 0.00 0.04 -1.09 4.22 -1.57 0.10 114.58 118.68 3k8l h GLU 620 Ca 0.34 0.00 -0.00 0.00 0.08 0.00 0.00 59.36 59.77 3k8l h GLU 620 Cb 2.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.70 3k8l h GLU 620 CO 0.82 0.00 -0.02 -0.22 -2.18 0.00 0.00 179.01 177.41 3k8l h LYS 621 N 0.00 -0.05 0.00 1.92 3.64 -1.86 -3.28 116.57 116.94 3k8l h LYS 621 Ca 0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3k8l h LYS 621 Cb 0.39 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 3k8l h LYS 621 CO -0.00 0.45 -0.77 -0.44 -2.27 0.00 0.00 179.45 176.42 3k8l h ASP 622 N -0.97 0.00 -1.03 4.20 3.32 -1.91 -3.38 116.42 116.64 3k8l h ASP 622 Ca -0.00 -0.03 -0.41 0.00 0.02 0.00 0.00 57.03 56.61 3k8l h ASP 622 Cb 0.52 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 39.66 3k8l h ASP 622 CO 0.01 0.01 -1.06 -1.22 -1.72 0.00 0.00 179.24 175.26 3k8l n TYR 623 N -2.68 1.76 -0.34 4.55 4.01 0.01 -4.94 117.16 119.53 3k8l n TYR 623 Ca 0.01 -2.75 0.10 0.00 -0.16 0.00 0.00 57.90 55.10 3k8l n TYR 623 Cb 0.53 -0.29 0.29 0.00 -0.31 0.00 0.00 39.34 39.56 3k8l n TYR 623 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 3k8l h LYS 624 N 2.81 0.84 0.00 -0.72 3.64 -1.62 -2.43 116.57 119.08 3k8l h LYS 624 Ca 0.01 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3k8l h LYS 624 Cb 1.15 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.78 3k8l h LYS 624 CO 0.55 0.55 0.00 -2.30 -2.27 0.00 0.00 179.45 175.99 3k8l n PRO 625 N -4.65 0.15 -2.80 1.90 -0.02 -1.22 -0.01 135.00 128.35 3k8l n PRO 625 Ca 0.20 0.20 -0.42 0.00 -2.02 0.00 0.00 63.50 61.46 3k8l n PRO 625 Cb 0.45 -1.70 -0.03 0.00 -0.02 0.00 0.00 33.50 32.20 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 -3.10 4.82 -0.30 4.25 -1.09 -0.92 -0.35 121.20 124.51 3k8l s ILE 626 Ca 0.10 1.81 -0.01 0.00 -2.23 0.00 0.00 60.65 60.31 3k8l s ILE 626 Cb 0.13 -4.21 0.05 0.00 -1.58 0.00 0.00 42.46 36.85 3k8l s ILE 626 CO 0.50 -0.02 -0.01 0.00 -1.23 0.00 0.00 174.94 174.17 3k8l s ALA 627 N 2.36 2.79 0.09 9.38 0.00 -0.48 -2.07 121.76 133.83 3k8l s ALA 627 Ca 0.42 -1.77 0.05 0.00 0.00 0.00 0.00 51.96 50.65 3k8l s ALA 627 Cb -0.17 -1.90 -0.03 0.00 0.00 0.00 0.00 23.12 21.02 3k8l s ALA 627 CO 0.12 -1.27 -0.12 0.00 0.00 0.00 0.00 175.76 174.49 3k8l s ALA 628 N 1.23 1.20 -0.00 0.00 0.00 -1.26 -0.46 121.76 122.47 3k8l s ALA 628 Ca -0.05 -1.13 -0.29 0.00 0.00 0.00 0.00 51.96 50.48 3k8l s ALA 628 Cb -0.20 -0.04 0.10 0.00 0.00 0.00 0.00 23.12 22.99 3k8l s ALA 628 CO -0.02 0.06 1.04 1.67 0.00 0.00 0.00 175.76 178.52 3k8l s TRP 629 N -1.94 -0.19 0.09 0.00 -2.14 -0.50 -3.95 118.94 110.31 3k8l s TRP 629 Ca 0.03 0.03 0.02 0.00 2.66 0.00 0.00 56.10 58.84 3k8l s TRP 629 Cb -0.06 0.56 -0.04 0.00 -3.10 0.00 0.00 33.47 30.83 3k8l s TRP 629 CO 0.02 -0.51 0.18 0.71 -2.66 0.00 0.00 176.95 174.69 3k8l s TYR 630 N -2.91 3.39 -0.15 1.66 1.51 0.28 -1.01 117.35 120.13 3k8l s TYR 630 Ca 0.09 0.16 -0.00 0.00 -1.01 0.00 0.00 57.07 56.31 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 -0.04 0.55 -0.10 -1.64 -1.11 0.00 0.00 175.55 173.21 3k8l s MET 631 N -2.67 1.84 0.01 -0.62 -1.94 -0.76 -1.79 119.30 113.37 3k8l s MET 631 Ca 0.33 -0.50 0.03 0.00 -1.71 0.00 0.00 55.69 53.85 3k8l s MET 631 Cb -0.12 -1.97 -0.01 0.00 2.01 0.00 0.00 34.83 34.74 3k8l s MET 631 CO 0.26 -0.31 -0.10 0.99 -0.01 0.00 0.00 175.02 175.84 3k8l s THR 632 N 1.57 0.81 -0.09 2.05 2.01 -0.26 -0.52 115.64 121.22 3k8l s THR 632 Ca 0.03 -0.62 -0.04 0.00 0.31 0.00 0.00 61.69 61.38 3k8l s THR 632 Cb -0.14 -0.71 0.05 0.00 0.01 0.00 0.00 72.50 71.71 3k8l s THR 632 CO -0.09 0.10 0.19 -0.75 -0.69 0.00 0.00 174.62 173.38 3k8l s LYS 633 N -0.59 0.12 5.37 4.92 2.36 -0.85 0.01 119.74 131.09 3k8l s LYS 633 Ca 0.02 0.50 0.00 0.00 -2.55 0.00 0.00 55.97 53.93 3k8l s LYS 633 Cb -0.05 -0.16 0.00 0.00 -1.05 0.00 0.00 37.83 36.57 3k8l s LYS 633 CO 0.00 -0.20 0.00 -0.25 1.55 0.00 0.00 175.35 176.45 3k8l n ASP 634 N 4.53 0.00 -0.40 1.43 8.00 -1.26 -0.94 116.55 127.91 3k8l n ASP 634 Ca -0.20 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.33 3k8l n ASP 634 Cb 0.52 0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.71 3k8l n ASP 634 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3k8l n ASN 635 N 8.28 2.47 -4.57 -2.24 5.15 -1.26 -4.93 115.26 118.16 3k8l n ASN 635 Ca 0.00 -1.91 -0.42 0.00 -0.60 0.00 0.00 54.58 51.65 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 -0.95 3.64 -0.19 1.20 2.12 -0.11 -4.95 118.70 119.46 3k8l s GLU 636 Ca 0.14 0.15 -0.01 0.00 0.36 0.00 0.00 54.97 55.61 3k8l s GLU 636 Cb 0.08 -3.85 0.01 0.00 0.26 0.00 0.00 34.13 30.63 3k8l s GLU 636 CO 0.10 -0.91 -0.14 0.21 -0.54 0.00 0.00 175.26 173.98 3k8l s LYS 637 N 3.09 3.16 0.18 4.30 2.20 -1.26 -2.01 119.74 129.40 3k8l s LYS 637 Ca 0.30 -0.75 0.07 0.00 -0.36 0.00 0.00 55.97 55.23 3k8l s LYS 637 Cb -0.13 -2.72 -0.04 0.00 -1.51 0.00 0.00 37.83 33.43 3k8l s LYS 637 CO 0.18 -0.15 0.01 -0.51 -0.36 0.00 0.00 175.35 174.51 3k8l s LEU 638 N 1.24 3.32 -0.16 5.43 1.43 0.32 -1.08 118.68 129.18 3k8l s LEU 638 Ca 0.03 -0.41 -0.00 0.00 -1.03 0.00 0.00 54.13 52.71 3k8l s LEU 638 Cb -0.14 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.12 3k8l s LEU 638 CO -0.07 0.08 -0.13 -0.22 0.23 0.00 0.00 176.35 176.24 3k8l s LEU 639 N -3.03 2.60 -0.13 1.79 2.96 0.10 -1.83 118.68 121.14 3k8l s LEU 639 Ca 0.28 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 53.78 3k8l s LEU 639 Cb -0.09 -1.60 -0.01 0.00 0.50 0.00 0.00 46.19 44.99 3k8l s LEU 639 CO 0.19 0.09 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.46 3k8l s VAL 640 N 0.78 2.73 -0.03 1.68 1.01 -0.18 -0.37 120.40 126.03 3k8l s VAL 640 Ca -0.05 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.18 3k8l s VAL 640 Cb -0.15 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.11 3k8l s VAL 640 CO 0.01 0.53 -0.06 -0.63 0.00 0.00 0.00 175.10 174.94 3k8l s ILE 641 N 0.51 0.62 0.07 2.22 -1.09 -0.67 -1.42 121.20 121.44 3k8l s ILE 641 Ca -0.11 -0.23 0.05 0.00 -2.23 0.00 0.00 60.65 58.13 3k8l s ILE 641 Cb -0.16 -0.59 -0.03 0.00 -1.58 0.00 0.00 42.46 40.10 3k8l s ILE 641 CO 0.04 0.22 -0.13 -1.00 -1.23 0.00 0.00 174.94 172.85 3k8l s HIS 642 N 0.50 1.11 -0.35 3.97 3.76 0.40 -1.60 115.29 123.08 3k8l s HIS 642 Ca -0.07 -0.48 -0.02 0.00 -0.15 0.00 0.00 55.06 54.34 3k8l s HIS 642 Cb -0.11 -0.63 0.07 0.00 1.11 0.00 0.00 32.58 33.03 3k8l s HIS 642 CO 0.00 0.03 0.09 1.21 -0.85 0.00 0.00 174.74 175.22 3k8l s ASN 643 N -1.76 5.05 0.00 1.40 3.84 -0.53 -1.38 114.94 121.56 3k8l s ASN 643 Ca -0.03 -1.60 0.23 0.00 0.21 0.00 0.00 52.86 51.67 3k8l s ASN 643 Cb -0.10 -1.76 1.40 0.00 -0.55 0.00 0.00 41.25 40.24 3k8l s ASN 643 CO 0.02 -0.38 1.81 0.49 -2.79 0.00 0.00 177.10 176.25 3k8l n PHE 644 N 4.60 0.00 -4.06 0.43 3.01 0.53 -2.29 117.46 119.68 3k8l n PHE 644 Ca -0.08 0.00 -0.24 0.00 1.01 0.00 0.00 57.45 58.14 3k8l n PHE 644 Cb 0.43 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.83 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 -1.89 2.32 0.00 1.37 0.00 -1.26 -4.13 107.32 103.73 3k8l s GLY 645 Ca 0.35 -2.08 0.16 0.00 0.00 0.00 0.00 44.72 43.14 3k8l s GLY 645 CO 0.27 -1.89 1.37 0.61 0.00 0.00 0.00 173.10 173.46 3k8l n GLY 646 N -1.28 1.28 3.32 0.20 0.00 -1.26 0.10 105.19 107.55 3k8l n GLY 646 Ca -0.01 -0.53 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.36 2.78 0.59 2.61 2.01 -1.26 -4.30 115.64 116.70 3k8l s THR 647 Ca 0.33 -0.75 -0.20 0.00 0.31 0.00 0.00 61.69 61.38 3k8l s THR 647 Cb 0.17 -2.15 -0.04 0.00 0.01 0.00 0.00 72.50 70.49 3k8l s THR 647 CO 0.23 0.53 1.22 0.00 -0.69 0.00 0.00 174.62 175.91 3k8l n ALA 648 N 3.65 1.01 -2.93 7.40 0.00 -1.26 -4.37 120.51 124.02 3k8l n ALA 648 Ca -0.18 0.06 -0.11 0.00 0.00 0.00 0.00 53.44 53.20 3k8l n ALA 648 Cb 0.53 -2.27 -0.13 0.00 0.00 0.00 0.00 19.45 17.58 3k8l n ALA 648 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3k8l s MET 649 N -2.97 0.13 -0.19 0.00 1.00 -0.54 -4.95 119.30 111.77 3k8l s MET 649 Ca 0.76 -0.18 -0.17 0.00 0.00 0.00 0.00 55.69 56.10 3k8l s MET 649 Cb -0.41 0.05 -0.04 0.00 0.00 0.00 0.00 34.83 34.43 3k8l s MET 649 CO 0.46 -0.02 0.43 -0.65 0.00 0.00 0.00 175.02 175.24 3k8l s GLN 650 N -0.50 4.19 -0.24 2.03 -0.21 -1.26 -0.82 119.66 122.85 3k8l s GLN 650 Ca -0.05 0.27 0.02 0.00 0.02 0.00 0.00 55.36 55.61 3k8l s GLN 650 Cb -0.03 -3.53 0.06 0.00 1.00 0.00 0.00 33.01 30.50 3k8l s GLN 650 CO -0.00 -0.05 -0.09 -0.51 -2.12 0.00 0.00 175.29 172.52 3k8l s LEU 651 N 1.33 2.93 0.07 2.90 1.43 0.44 -4.93 118.68 122.86 3k8l s LEU 651 Ca 0.21 -1.24 -0.31 0.00 -1.03 0.00 0.00 54.13 51.76 3k8l s LEU 651 Cb -0.15 -1.35 -0.06 0.00 0.03 0.00 0.00 46.19 44.65 3k8l s LEU 651 CO 0.08 -0.20 1.25 -2.16 0.23 0.00 0.00 176.35 175.56 3k8l s PRO 652 N 1.26 4.40 -0.07 1.29 0.04 -1.26 -0.24 135.00 140.41 3k8l s PRO 652 Ca -0.07 1.85 0.05 0.00 0.04 0.00 0.00 61.00 62.88 3k8l s PRO 652 Cb -0.19 -3.33 -0.01 0.00 0.04 0.00 0.00 34.50 31.01 3k8l s PRO 652 CO -0.06 -0.32 -0.23 -0.51 0.04 0.00 0.00 177.00 175.92 3k8l s LEU 653 N 1.12 2.04 0.00 -3.56 1.43 -0.50 -4.94 118.68 114.28 3k8l s LEU 653 Ca 0.60 -0.50 0.18 0.00 -1.03 0.00 0.00 54.13 53.38 3k8l s LEU 653 Cb -0.31 -1.32 -0.09 0.00 0.03 0.00 0.00 46.19 44.49 3k8l s LEU 653 CO 0.29 0.20 0.85 0.35 0.23 0.00 0.00 176.35 178.27 3k8l n THR 654 N 3.19 0.00 -1.32 5.49 -2.24 -1.26 -4.24 114.28 113.90 3k8l n THR 654 Ca -0.18 -0.20 -0.34 0.00 -2.27 0.00 0.00 64.05 61.05 3k8l n THR 654 Cb 0.52 1.12 0.11 0.00 -2.10 0.00 0.00 70.33 69.98 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 -2.37 3.93 -1.28 3.42 1.01 -1.26 -4.87 116.67 115.25 3k8l s ASP 655 Ca 0.11 2.43 -0.17 0.00 0.71 0.00 0.00 52.55 55.62 3k8l s ASP 655 Cb 0.14 -2.60 0.08 0.00 1.01 0.00 0.00 42.92 41.56 3k8l s ASP 655 CO 0.58 -2.45 1.70 -0.54 0.21 0.00 0.00 175.17 174.68 3k8l s LYS 656 N -3.92 4.00 0.20 8.23 1.02 -1.26 -4.96 119.74 123.05 3k8l s LYS 656 Ca 0.76 -2.07 -0.31 0.00 0.02 0.00 0.00 55.97 54.36 3k8l s LYS 656 Cb -0.31 -5.47 -0.10 0.00 -0.52 0.00 0.00 37.83 31.43 3k8l s LYS 656 CO 0.47 -2.19 1.49 0.42 -0.92 0.00 0.00 175.35 174.62 3k8l s ILE 657 N 3.87 2.73 -0.03 2.17 -1.09 -1.26 0.95 121.20 128.54 3k8l s ILE 657 Ca 0.52 0.56 0.01 0.00 -2.23 0.00 0.00 60.65 59.52 3k8l s ILE 657 Cb 0.03 -3.36 -0.03 0.00 -1.58 0.00 0.00 42.46 37.52 3k8l s ILE 657 CO 0.07 0.06 -0.01 1.21 -1.23 0.00 0.00 174.94 175.04 3k8l n GLU 658 N 3.24 1.57 -3.54 2.79 2.13 -0.19 -4.72 120.64 121.92 3k8l n GLU 658 Ca 0.10 0.01 -0.16 0.00 0.66 0.00 0.00 57.16 57.78 3k8l n GLU 658 Cb 0.40 -1.07 -0.05 0.00 0.27 0.00 0.00 31.44 30.98 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 -2.07 1.05 -0.27 5.31 2.20 -1.11 -4.98 119.74 119.87 3k8l s LYS 659 Ca -0.03 -0.02 -0.10 0.00 -0.36 0.00 0.00 55.97 55.46 3k8l s LYS 659 Cb 0.01 0.49 -0.04 0.00 -1.51 0.00 0.00 37.83 36.77 3k8l s LYS 659 CO 0.09 -0.36 0.16 0.08 -0.36 0.00 0.00 175.35 174.96 3k8l s VAL 660 N -1.91 5.06 -0.15 4.02 1.01 -1.26 -0.63 120.40 126.53 3k8l s VAL 660 Ca -0.08 0.09 0.14 0.00 0.00 0.00 0.00 61.98 62.13 3k8l s VAL 660 Cb -0.01 -3.40 -0.24 0.00 0.00 0.00 0.00 36.38 32.73 3k8l s VAL 660 CO 0.03 0.27 0.24 0.18 0.00 0.00 0.00 175.10 175.82 3k8l n LEU 661 N 5.02 0.57 -3.64 3.92 4.32 -0.04 -0.71 117.00 126.45 3k8l n LEU 661 Ca -0.15 0.12 -0.15 0.00 -0.02 0.00 0.00 56.01 55.82 3k8l n LEU 661 Cb 0.52 0.24 -0.08 0.00 -1.62 0.00 0.00 43.42 42.48 3k8l n LEU 661 CO 0.32 0.51 0.27 0.12 -1.22 0.00 0.00 177.39 177.40 3k8l s PHE 662 N -2.53 -0.55 -0.04 -1.77 5.36 -1.17 -4.01 117.98 113.27 3k8l s PHE 662 Ca -0.11 1.15 -0.10 0.00 -0.96 0.00 0.00 56.93 56.91 3k8l s PHE 662 Cb 0.07 0.25 0.02 0.00 -0.34 0.00 0.00 43.02 43.02 3k8l s PHE 662 CO 0.81 -0.42 0.24 0.14 -1.46 0.00 0.00 175.22 174.53 3k8l s VAL 663 N -0.51 0.04 -0.09 3.12 -7.23 -1.26 -1.67 120.40 112.80 3k8l s VAL 663 Ca -0.06 -0.35 -0.05 0.00 -1.81 0.00 0.00 61.98 59.71 3k8l s VAL 663 Cb -0.03 -0.46 0.04 0.00 0.56 0.00 0.00 36.38 36.49 3k8l s VAL 663 CO 0.04 -0.19 0.21 0.21 -0.31 0.00 0.00 175.10 175.07 3k8l s ASN 664 N -0.76 -0.22 0.00 4.85 2.47 -0.54 -4.98 114.94 115.77 3k8l s ASN 664 Ca -0.08 0.45 0.00 0.00 0.42 0.00 0.00 52.86 53.65 3k8l s ASN 664 Cb -0.05 0.35 0.00 0.00 -1.45 0.00 0.00 41.25 40.10 3k8l s ASN 664 CO 0.02 -0.15 0.00 0.61 -3.72 0.00 0.00 177.10 173.85 3k8l n GLY 665 N 4.14 -2.18 3.63 1.21 0.00 -1.26 -1.38 105.19 109.36 3k8l n GLY 665 Ca -0.25 -1.66 -0.43 0.00 0.00 0.00 0.00 46.02 43.68 3k8l n GLY 665 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k8l s GLU 666 N -0.21 3.93 -0.05 1.61 2.02 -1.26 -4.94 118.70 119.80 3k8l s GLU 666 Ca 0.00 1.19 0.00 0.00 0.02 0.00 0.00 54.97 56.19 3k8l s GLU 666 Cb 0.00 -3.86 0.02 0.00 0.10 0.00 0.00 34.13 30.40 3k8l s GLU 666 CO 0.00 -1.09 -0.03 0.95 0.02 0.00 0.00 175.26 175.10 3k8l s THR 667 N 4.26 0.52 0.08 3.63 -4.23 -1.26 0.39 115.64 119.03 3k8l s THR 667 Ca 0.54 -0.07 -0.01 0.00 -1.18 0.00 0.00 61.69 60.97 3k8l s THR 667 Cb -0.16 -0.58 -0.04 0.00 1.34 0.00 0.00 72.50 73.06 3k8l s THR 667 CO 0.22 0.24 -0.01 -1.10 -0.54 0.00 0.00 174.62 173.44 3k8l s GLN 668 N 1.22 0.72 0.13 3.99 -0.21 -0.63 -2.39 119.66 122.50 3k8l s GLN 668 Ca -0.06 -1.29 0.03 0.00 0.02 0.00 0.00 55.36 54.05 3k8l s GLN 668 Cb -0.14 0.18 -0.04 0.00 1.00 0.00 0.00 33.01 34.01 3k8l s GLN 668 CO -0.02 -0.15 -0.06 1.14 -2.12 0.00 0.00 175.29 174.08 3k8l s GLN 669 N -3.95 0.96 -0.01 2.91 -2.07 0.15 0.09 119.66 117.74 3k8l s GLN 669 Ca 0.12 -1.41 -0.02 0.00 -1.82 0.00 0.00 55.36 52.23 3k8l s GLN 669 Cb 0.08 -0.35 -0.00 0.00 -1.09 0.00 0.00 33.01 31.64 3k8l s GLN 669 CO -0.06 -0.01 0.04 1.21 -1.32 0.00 0.00 175.29 175.15 3k8l s ASN 670 N -3.11 0.03 -0.22 12.60 3.84 -0.71 -0.59 114.94 126.79 3k8l s ASN 670 Ca 0.16 -0.09 0.18 0.00 0.21 0.00 0.00 52.86 53.32 3k8l s ASN 670 Cb 0.05 0.11 0.48 0.00 -0.55 0.00 0.00 41.25 41.34 3k8l s ASN 670 CO -0.01 -0.13 1.15 0.35 -2.79 0.00 0.00 177.10 175.67 3k8l n THR 671 N 2.49 1.51 -1.75 -5.21 -2.24 -1.25 -1.71 114.28 106.13 3k8l n THR 671 Ca -0.16 -3.02 -0.33 0.00 -2.27 0.00 0.00 64.05 58.28 3k8l n THR 671 Cb 0.58 0.45 0.04 0.00 -2.10 0.00 0.00 70.33 69.30 3k8l n THR 671 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3k8l s ASP 672 N -3.43 5.21 -1.56 3.42 1.01 -1.22 -3.63 116.67 116.48 3k8l s ASP 672 Ca 0.36 1.90 -0.16 0.00 0.71 0.00 0.00 52.55 55.36 3k8l s ASP 672 Cb 0.36 -2.54 0.13 0.00 1.01 0.00 0.00 42.92 41.88 3k8l s ASP 672 CO -0.04 -1.56 0.75 -1.20 0.21 0.00 0.00 175.17 173.34 3k8l n SER 673 N -2.52 -3.71 -3.88 0.27 7.64 -1.26 -0.90 113.62 109.25 3k8l n SER 673 Ca 0.10 -0.80 -0.24 0.00 1.01 0.00 0.00 58.87 58.93 3k8l n SER 673 Cb 0.52 -3.03 -0.00 0.00 -1.01 0.00 0.00 64.21 60.69 3k8l n SER 673 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3k8l n ASP 674 N -2.59 -0.67 -3.93 6.43 2.03 -1.24 -4.97 116.55 111.61 3k8l n ASP 674 Ca 0.05 -0.95 -0.13 0.00 0.52 0.00 0.00 54.79 54.28 3k8l n ASP 674 Cb 0.51 -3.36 -0.14 0.00 -0.72 0.00 0.00 41.12 37.41 3k8l n ASP 674 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 3k8l s SER 675 N -4.34 0.31 -0.19 1.67 0.15 -0.08 -5.14 113.70 106.08 3k8l s SER 675 Ca 0.03 -0.14 -0.08 0.00 0.70 0.00 0.00 55.95 56.45 3k8l s SER 675 Cb -0.01 -0.01 -0.04 0.00 -1.71 0.00 0.00 66.02 64.25 3k8l s SER 675 CO 0.87 -0.03 0.08 -0.47 1.20 0.00 0.00 173.24 174.88 3k8l s TYR 676 N -0.34 3.27 -0.03 3.44 5.04 -1.26 -3.43 117.35 124.04 3k8l s TYR 676 Ca -0.02 0.11 0.01 0.00 -2.44 0.00 0.00 57.07 54.72 3k8l s TYR 676 Cb -0.03 -2.11 0.02 0.00 0.35 0.00 0.00 41.96 40.20 3k8l s TYR 676 CO -0.00 0.16 -0.03 0.99 -1.34 0.00 0.00 175.55 175.32 3k8l s THR 677 N 0.44 0.40 -0.16 4.34 2.01 -0.69 -1.41 115.64 120.56 3k8l s THR 677 Ca 0.04 -0.06 -0.05 0.00 0.31 0.00 0.00 61.69 61.93 3k8l s THR 677 Cb -0.12 -0.44 -0.03 0.00 0.01 0.00 0.00 72.50 71.91 3k8l s THR 677 CO 0.00 0.19 0.01 -0.22 -0.69 0.00 0.00 174.62 173.91 3k8l s LEU 678 N 0.85 3.55 -0.50 4.42 2.96 0.66 -1.73 118.68 128.89 3k8l s LEU 678 Ca -0.10 -0.01 -0.13 0.00 -0.22 0.00 0.00 54.13 53.67 3k8l s LEU 678 Cb -0.13 -1.88 0.12 0.00 0.50 0.00 0.00 46.19 44.80 3k8l s LEU 678 CO -0.00 0.19 0.42 -0.75 -1.32 0.00 0.00 176.35 174.88 3k8l s LYS 679 N 0.28 2.80 -0.37 1.98 2.20 0.11 0.17 119.74 126.91 3k8l s LYS 679 Ca 0.00 -1.66 -0.16 0.00 -0.36 0.00 0.00 55.97 53.79 3k8l s LYS 679 Cb -0.13 -4.12 0.00 0.00 -1.51 0.00 0.00 37.83 32.07 3k8l s LYS 679 CO 0.02 -1.22 0.39 -1.17 -0.36 0.00 0.00 175.35 173.01 3k8l s LEU 680 N 1.52 4.59 1.26 5.43 2.96 -0.00 -1.60 118.68 132.84 3k8l s LEU 680 Ca 0.04 -0.38 -0.19 0.00 -0.22 0.00 0.00 54.13 53.37 3k8l s LEU 680 Cb -0.28 -2.36 0.31 0.00 0.50 0.00 0.00 46.19 44.36 3k8l s LEU 680 CO 0.02 -0.43 1.04 -0.83 -1.32 0.00 0.00 176.35 174.83 3k8l s GLY 681 N 1.76 1.52 0.23 7.98 0.00 0.16 -1.47 107.32 117.50 3k8l s GLY 681 Ca 0.12 -0.79 -0.32 0.00 0.00 0.00 0.00 44.72 43.73 3k8l s GLY 681 CO 0.12 0.10 1.70 0.61 0.00 0.00 0.00 173.10 175.64 3k8l n GLY 682 N 0.00 1.50 2.34 0.20 0.00 -1.26 -1.93 105.19 106.05 3k8l n GLY 682 Ca 0.11 0.58 -0.16 0.00 0.00 0.00 0.00 46.02 46.55 3k8l n GLY 682 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3k8l n TYR 683 N 3.55 -0.76 -3.23 1.61 0.53 0.11 -4.80 117.16 114.17 3k8l n TYR 683 Ca 0.14 0.00 -0.27 0.00 -1.02 0.00 0.00 57.90 56.75 3k8l n TYR 683 Cb 0.35 -3.15 -0.02 0.00 -1.03 0.00 0.00 39.34 35.49 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 -2.62 3.60 0.04 -0.72 0.00 -0.81 -4.55 121.76 116.70 3k8l s ALA 684 Ca 0.00 -0.65 -0.01 0.00 0.00 0.00 0.00 51.96 51.30 3k8l s ALA 684 Cb 0.00 -2.30 -0.03 0.00 0.00 0.00 0.00 23.12 20.79 3k8l s ALA 684 CO 0.00 0.06 -0.03 -1.12 0.00 0.00 0.00 175.76 174.67 3k8l s SER 685 N -3.58 0.39 -0.02 0.00 0.01 -0.48 -1.45 113.70 108.56 3k8l s SER 685 Ca 0.43 -0.81 -0.20 0.00 1.31 0.00 0.00 55.95 56.68 3k8l s SER 685 Cb -0.10 0.16 0.04 0.00 0.21 0.00 0.00 66.02 66.33 3k8l s SER 685 CO 0.34 -0.49 0.43 0.68 0.41 0.00 0.00 173.24 174.62 3k8l s VAL 686 N -3.00 0.04 -0.12 3.43 -7.23 -0.63 -1.46 120.40 111.42 3k8l s VAL 686 Ca -0.02 -0.32 -0.00 0.00 -1.81 0.00 0.00 61.98 59.83 3k8l s VAL 686 Cb 0.01 -0.76 0.03 0.00 0.56 0.00 0.00 36.38 36.22 3k8l s VAL 686 CO -0.07 -0.18 -0.08 -0.69 -0.31 0.00 0.00 175.10 173.78 3k8l s VAL 687 N -1.36 1.05 0.13 1.32 1.01 -0.67 -1.67 120.40 120.22 3k8l s VAL 687 Ca -0.12 -0.34 0.05 0.00 0.00 0.00 0.00 61.98 61.56 3k8l s VAL 687 Cb -0.03 -1.09 -0.04 0.00 0.00 0.00 0.00 36.38 35.22 3k8l s VAL 687 CO 0.06 0.34 0.10 -0.36 0.00 0.00 0.00 175.10 175.23 3k8l s PHE 688 N 1.69 3.12 -0.19 5.22 0.40 0.50 -0.86 117.98 127.87 3k8l s PHE 688 Ca 0.04 0.00 -0.10 0.00 -0.60 0.00 0.00 56.93 56.27 3k8l s PHE 688 Cb -0.13 -1.53 -0.05 0.00 0.51 0.00 0.00 43.02 41.82 3k8l s PHE 688 CO -0.08 0.52 0.15 0.21 0.70 0.00 0.00 175.22 176.72 3k8l s LYS 689 N -2.81 4.14 0.11 0.44 2.47 0.20 -0.72 119.74 123.56 3k8l s LYS 689 Ca 0.30 -0.17 -0.02 0.00 -1.56 0.00 0.00 55.97 54.51 3k8l s LYS 689 Cb -0.11 -3.40 -0.05 0.00 -1.46 0.00 0.00 37.83 32.81 3k8l s LYS 689 CO 0.22 0.33 0.30 -0.51 0.16 0.00 0.00 175.35 175.85 3k8l s LEU 690 N 0.26 4.31 0.31 5.43 1.43 -0.24 -1.02 118.68 129.15 3k8l s LEU 690 Ca 0.10 0.43 -0.29 0.00 -1.03 0.00 0.00 54.13 53.33 3k8l s LEU 690 Cb -0.11 -3.14 -0.10 0.00 0.03 0.00 0.00 46.19 42.87 3k8l s LEU 690 CO -0.01 0.10 1.34 -0.83 0.23 0.00 0.00 176.35 177.18 3k8l s GLY 691 N -2.52 2.84 0.00 -3.19 0.00 0.27 -4.71 107.32 100.01 3k8l s GLY 691 Ca 0.38 1.28 0.17 0.00 0.00 0.00 0.00 44.72 46.54 3k8l s GLY 691 CO 0.26 2.00 1.41 0.70 0.00 0.00 0.00 173.10 177.48