#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2buc n ARG 40 N 0.00 -3.17 -1.94 -1.46 1.74 -1.26 -5.00 116.66 105.57 2buc n ARG 40 Ca 0.00 2.42 -0.34 0.00 -0.77 0.00 0.00 57.85 59.16 2buc n ARG 40 Cb 0.00 -2.43 0.03 0.00 -1.02 0.00 0.00 32.46 29.03 2buc n ARG 40 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2buc s ARG 41 N -1.95 3.03 0.25 5.56 1.70 -1.26 -4.74 118.95 121.55 2buc s ARG 41 Ca 0.00 1.42 0.05 0.00 -0.47 0.00 0.00 55.73 56.73 2buc s ARG 41 Cb 0.00 -1.98 -0.03 0.00 -0.57 0.00 0.00 34.95 32.37 2buc s ARG 41 CO 0.00 -1.07 0.38 0.95 -1.08 0.00 0.00 175.30 174.48 2buc s THR 42 N -2.20 5.18 -0.43 4.99 -4.23 -1.26 -0.32 115.64 117.38 2buc s THR 42 Ca 0.68 -0.95 -0.29 0.00 -1.18 0.00 0.00 61.69 59.96 2buc s THR 42 Cb -0.21 -3.84 0.01 0.00 1.34 0.00 0.00 72.50 69.80 2buc s THR 42 CO 0.37 -0.34 1.47 -0.47 -0.54 0.00 0.00 174.62 175.11 2buc s TYR 43 N -2.02 2.29 0.65 3.99 5.04 -1.26 -4.84 117.35 121.21 2buc s TYR 43 Ca 0.35 0.64 -0.01 0.00 -2.44 0.00 0.00 57.07 55.61 2buc s TYR 43 Cb -0.09 -4.30 0.08 0.00 0.35 0.00 0.00 41.96 38.00 2buc s TYR 43 CO 0.30 -2.10 0.91 0.95 -1.34 0.00 0.00 175.55 174.27 2buc s THR 44 N 5.79 2.37 0.18 4.34 -4.23 -1.26 -4.02 115.64 118.80 2buc s THR 44 Ca 0.62 -0.56 -0.10 0.00 -1.18 0.00 0.00 61.69 60.47 2buc s THR 44 Cb -0.14 -2.80 0.07 0.00 1.34 0.00 0.00 72.50 70.96 2buc s THR 44 CO 0.32 0.00 1.65 0.25 -0.54 0.00 0.00 174.62 176.29 2buc h LEU 45 N -0.32 1.03 -1.41 4.79 5.85 -1.94 -2.79 115.31 120.51 2buc h LEU 45 Ca -0.40 -0.29 -0.01 0.00 0.84 0.00 0.00 57.88 58.02 2buc h LEU 45 Cb 1.29 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 2buc h LEU 45 CO 0.48 1.06 0.23 0.74 -0.34 0.00 0.00 178.44 180.61 2buc h THR 46 N 0.95 1.15 -0.38 1.05 2.02 -1.98 -0.77 112.91 114.95 2buc h THR 46 Ca 0.18 -0.41 -0.05 0.00 0.77 0.00 0.00 66.41 66.90 2buc h THR 46 Cb 0.52 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 2buc h THR 46 CO 0.02 0.17 0.04 0.44 0.37 0.00 0.00 175.52 176.57 2buc h ASP 47 N 0.64 0.53 0.02 4.18 3.32 -1.88 -1.20 116.42 122.03 2buc h ASP 47 Ca 0.16 -0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 2buc h ASP 47 Cb 0.05 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.46 2buc h ASP 47 CO -0.02 0.58 -0.14 0.22 -1.72 0.00 0.00 179.24 178.16 2buc h TYR 48 N 0.55 0.10 -0.26 4.55 3.20 -1.23 -2.68 116.97 121.21 2buc h TYR 48 Ca 0.12 -0.07 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 2buc h TYR 48 Cb 0.29 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 2buc h TYR 48 CO 0.01 0.98 -0.01 -0.07 -1.64 0.00 0.00 178.16 177.43 2buc h LEU 49 N -0.80 0.46 0.00 2.82 3.38 -1.11 -2.91 115.31 117.14 2buc h LEU 49 Ca -0.02 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2buc h LEU 49 Cb 1.03 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.66 2buc h LEU 49 CO 0.03 0.67 -0.10 0.29 0.09 0.00 0.00 178.44 179.42 2buc n LYS 50 N -4.60 0.28 -3.38 1.13 4.76 -0.46 -4.97 118.16 110.92 2buc n LYS 50 Ca -0.03 0.20 -0.17 0.00 -2.87 0.00 0.00 58.31 55.43 2buc n LYS 50 Cb 0.26 -1.80 0.07 0.00 -1.84 0.00 0.00 35.03 31.72 2buc n LYS 50 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2buc n SER 51 N -2.27 -4.51 0.11 4.39 7.64 -1.09 -4.93 113.62 112.97 2buc n SER 51 Ca 0.05 -0.71 0.00 0.00 1.01 0.00 0.00 58.87 59.22 2buc n SER 51 Cb 0.44 -4.95 0.30 0.00 -1.01 0.00 0.00 64.21 58.98 2buc n SER 51 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2buc h THR 52 N -1.49 1.25 -3.26 0.44 1.35 -1.75 -3.34 112.91 106.11 2buc h THR 52 Ca -0.61 -1.21 -0.76 0.00 -0.55 0.00 0.00 66.41 63.28 2buc h THR 52 Cb 1.33 1.50 -0.23 0.00 -1.73 0.00 0.00 68.15 69.02 2buc h THR 52 CO 0.47 0.36 0.48 -0.36 -0.25 0.00 0.00 175.52 176.22 2buc s PHE 53 N -4.37 3.68 0.04 4.73 0.08 -1.26 -5.03 117.98 115.85 2buc s PHE 53 Ca -0.05 -2.00 -0.30 0.00 0.12 0.00 0.00 56.93 54.70 2buc s PHE 53 Cb 0.14 -3.99 -0.05 0.00 -0.57 0.00 0.00 43.02 38.55 2buc s PHE 53 CO 0.75 -1.15 1.21 0.50 -0.10 0.00 0.00 175.22 176.44 2buc s ARG 54 N 0.64 4.41 -0.43 0.44 6.06 -1.26 -5.00 118.95 123.81 2buc s ARG 54 Ca 0.27 1.77 -0.19 0.00 -2.50 0.00 0.00 55.73 55.07 2buc s ARG 54 Cb -0.08 -3.40 0.02 0.00 0.06 0.00 0.00 34.95 31.55 2buc s ARG 54 CO -0.08 -0.31 0.56 0.08 -2.50 0.00 0.00 175.30 173.05 2buc s VAL 55 N 1.36 4.93 0.53 7.11 1.01 -1.26 -4.72 120.40 129.36 2buc s VAL 55 Ca 0.59 -0.05 -0.16 0.00 0.00 0.00 0.00 61.98 62.35 2buc s VAL 55 Cb -0.29 -4.13 -0.07 0.00 0.00 0.00 0.00 36.38 31.89 2buc s VAL 55 CO 0.28 -0.51 1.00 -0.54 0.00 0.00 0.00 175.10 175.32 2buc s LYS 56 N 2.54 3.82 0.33 2.72 1.02 -1.26 -5.08 119.74 123.82 2buc s LYS 56 Ca 0.18 1.02 0.05 0.00 0.02 0.00 0.00 55.97 57.24 2buc s LYS 56 Cb -0.15 -2.11 -0.03 0.00 -0.52 0.00 0.00 37.83 35.01 2buc s LYS 56 CO 0.17 -0.38 0.21 -0.59 -0.92 0.00 0.00 175.35 173.84 2buc s PHE 57 N -2.57 1.67 -0.30 3.18 -0.12 -1.26 -4.91 117.98 113.66 2buc s PHE 57 Ca 0.60 -1.52 -0.02 0.00 -0.05 0.00 0.00 56.93 55.94 2buc s PHE 57 Cb -0.11 -0.80 0.10 0.00 -0.63 0.00 0.00 43.02 41.57 2buc s PHE 57 CO 0.32 -0.68 0.11 -0.47 -0.05 0.00 0.00 175.22 174.45 2buc s TYR 58 N -3.51 1.15 -0.35 3.49 6.14 -1.26 -4.96 117.35 118.05 2buc s TYR 58 Ca 0.37 -1.39 -0.13 0.00 0.64 0.00 0.00 57.07 56.56 2buc s TYR 58 Cb 0.03 -1.39 -0.01 0.00 0.42 0.00 0.00 41.96 41.01 2buc s TYR 58 CO 0.22 -0.86 0.24 0.99 0.64 0.00 0.00 175.55 176.78 2buc s THR 59 N 1.81 5.25 0.16 4.34 2.01 -1.26 -5.07 115.64 122.88 2buc s THR 59 Ca 0.09 -0.27 0.09 0.00 0.31 0.00 0.00 61.69 61.91 2buc s THR 59 Cb -0.17 -3.72 -0.04 0.00 0.01 0.00 0.00 72.50 68.58 2buc s THR 59 CO -0.30 -0.04 -0.19 -1.48 -0.69 0.00 0.00 174.62 171.92 2buc s LEU 60 N 1.71 2.41 -0.25 4.42 0.05 -1.26 -4.36 118.68 121.41 2buc s LEU 60 Ca 0.06 -0.83 0.03 0.00 0.05 0.00 0.00 54.13 53.43 2buc s LEU 60 Cb -0.18 -0.88 0.05 0.00 -2.05 0.00 0.00 46.19 43.14 2buc s LEU 60 CO 0.10 0.00 -0.12 -1.10 -0.55 0.00 0.00 176.35 174.68 2buc s GLN 61 N -2.63 2.32 0.16 1.48 -0.21 -0.32 -4.96 119.66 115.49 2buc s GLN 61 Ca 0.15 -1.25 -0.31 0.00 0.02 0.00 0.00 55.36 53.96 2buc s GLN 61 Cb -0.07 -2.82 -0.10 0.00 1.00 0.00 0.00 33.01 31.02 2buc s GLN 61 CO 0.07 -0.52 1.57 -1.58 -2.12 0.00 0.00 175.29 172.71 2buc s TRP 62 N 1.14 3.02 0.00 0.91 0.52 -1.26 -0.48 118.94 122.79 2buc s TRP 62 Ca -0.07 0.61 0.00 0.00 0.02 0.00 0.00 56.10 56.67 2buc s TRP 62 Cb -0.19 -3.92 0.00 0.00 -1.15 0.00 0.00 33.47 28.21 2buc s TRP 62 CO -0.06 -3.42 0.23 0.44 0.02 0.00 0.00 176.95 174.16 2buc n ILE 63 N 4.03 0.00 -3.44 2.03 -5.35 -0.92 -4.93 119.36 110.78 2buc n ILE 63 Ca 0.14 -0.38 -0.04 0.00 -0.27 0.00 0.00 62.75 62.20 2buc n ILE 63 Cb 0.39 1.15 0.00 0.00 -1.74 0.00 0.00 39.64 39.44 2buc n ILE 63 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2buc n SER 64 N -0.30 -0.67 0.23 7.28 3.41 -1.11 -4.96 113.62 117.49 2buc n SER 64 Ca 0.00 -1.58 0.15 0.00 -0.26 0.00 0.00 58.87 57.18 2buc n SER 64 Cb 0.04 1.15 0.54 0.00 -0.26 0.00 0.00 64.21 65.67 2buc n SER 64 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2buc h ASP 65 N 0.68 0.00 0.00 4.04 2.03 -1.93 -2.80 116.42 118.44 2buc h ASP 65 Ca -0.11 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.19 2buc h ASP 65 Cb 0.42 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.92 2buc h ASP 65 CO 0.14 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 178.35 2buc n HIS 66 N -2.87 0.00 -4.26 4.15 1.44 -1.26 -4.36 115.22 108.07 2buc n HIS 66 Ca 0.02 -0.00 -0.21 0.00 -2.01 0.00 0.00 57.72 55.51 2buc n HIS 66 Cb 0.34 -0.00 -0.12 0.00 0.12 0.00 0.00 29.99 30.32 2buc n HIS 66 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 2buc s GLU 67 N -0.00 1.00 0.02 -1.40 2.02 -1.26 -0.87 118.70 118.20 2buc s GLU 67 Ca 0.00 -1.04 -0.06 0.00 0.02 0.00 0.00 54.97 53.89 2buc s GLU 67 Cb 0.00 -1.13 -0.00 0.00 0.10 0.00 0.00 34.13 33.09 2buc s GLU 67 CO 0.00 0.26 0.12 1.52 0.02 0.00 0.00 175.26 177.18 2buc s TYR 68 N -1.17 0.11 0.08 1.61 -0.85 -0.95 -2.17 117.35 114.01 2buc s TYR 68 Ca 0.03 -0.29 -0.14 0.00 -0.52 0.00 0.00 57.07 56.15 2buc s TYR 68 Cb -0.10 -0.09 -0.06 0.00 0.38 0.00 0.00 41.96 42.09 2buc s TYR 68 CO 0.03 -0.32 0.47 -0.51 -1.52 0.00 0.00 175.55 173.71 2buc s LEU 69 N -1.68 4.40 -0.03 -3.49 1.43 0.37 -1.18 118.68 118.50 2buc s LEU 69 Ca -0.11 0.99 -0.01 0.00 -1.03 0.00 0.00 54.13 53.96 2buc s LEU 69 Cb -0.05 -2.96 0.02 0.00 0.03 0.00 0.00 46.19 43.23 2buc s LEU 69 CO -0.01 0.20 0.06 -0.47 0.23 0.00 0.00 176.35 176.36 2buc s TYR 70 N -1.30 -0.05 -0.28 0.29 5.04 -0.52 -1.17 117.35 119.36 2buc s TYR 70 Ca 0.32 0.19 -0.17 0.00 -2.44 0.00 0.00 57.07 54.97 2buc s TYR 70 Cb -0.16 -0.08 -0.03 0.00 0.35 0.00 0.00 41.96 42.05 2buc s TYR 70 CO 0.17 -0.07 0.46 0.21 -1.34 0.00 0.00 175.55 174.98 2buc s LYS 71 N 0.56 3.95 -0.15 4.97 2.20 -1.26 -0.84 119.74 129.18 2buc s LYS 71 Ca -0.04 0.11 -0.04 0.00 -0.36 0.00 0.00 55.97 55.64 2buc s LYS 71 Cb -0.06 -3.69 0.05 0.00 -1.51 0.00 0.00 37.83 32.62 2buc s LYS 71 CO -0.02 -0.38 0.06 -1.14 -0.36 0.00 0.00 175.35 173.51 2buc s GLN 72 N 2.23 0.27 -1.29 4.03 0.74 -0.03 -4.86 119.66 120.75 2buc s GLN 72 Ca 0.18 -0.09 -0.01 0.00 0.05 0.00 0.00 55.36 55.49 2buc s GLN 72 Cb -0.16 -1.62 -0.00 0.00 1.10 0.00 0.00 33.01 32.33 2buc s GLN 72 CO 0.10 -0.57 0.71 0.39 -0.55 0.00 0.00 175.29 175.37 2buc n GLU 73 N 5.20 -4.60 -0.76 1.67 1.02 -1.26 -1.74 120.64 120.18 2buc n GLU 73 Ca -0.07 0.62 0.00 0.00 -0.02 0.00 0.00 57.16 57.69 2buc n GLU 73 Cb 0.49 -5.14 0.00 0.00 -0.02 0.00 0.00 31.44 26.77 2buc n GLU 73 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2buc n ASN 74 N -3.04 -2.26 -4.83 1.62 3.02 -1.26 -4.74 115.26 103.77 2buc n ASN 74 Ca -0.28 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 53.90 2buc n ASN 74 Cb 0.67 -2.43 -0.06 0.00 -0.61 0.00 0.00 39.78 37.36 2buc n ASN 74 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2buc s ASN 75 N -2.11 6.92 -0.31 6.41 -0.87 -0.71 -3.73 114.94 120.55 2buc s ASN 75 Ca 0.00 1.17 -0.10 0.00 -1.57 0.00 0.00 52.86 52.36 2buc s ASN 75 Cb 0.00 -2.33 -0.02 0.00 -0.02 0.00 0.00 41.25 38.89 2buc s ASN 75 CO 0.00 0.15 0.17 -0.63 -2.57 0.00 0.00 177.10 174.22 2buc s ILE 76 N -1.36 4.87 -0.04 0.60 1.01 0.91 -0.85 121.20 126.33 2buc s ILE 76 Ca 0.36 -0.24 0.02 0.00 0.00 0.00 0.00 60.65 60.79 2buc s ILE 76 Cb -0.17 -3.43 -0.03 0.00 0.01 0.00 0.00 42.46 38.84 2buc s ILE 76 CO 0.19 0.11 -0.09 -0.76 0.00 0.00 0.00 174.94 174.39 2buc s LEU 77 N 1.67 3.02 -0.55 2.97 1.43 -0.02 -1.02 118.68 126.17 2buc s LEU 77 Ca 0.06 -0.11 -0.17 0.00 -1.03 0.00 0.00 54.13 52.87 2buc s LEU 77 Cb -0.17 -1.67 0.11 0.00 0.03 0.00 0.00 46.19 44.50 2buc s LEU 77 CO 0.08 0.34 0.58 -0.22 0.23 0.00 0.00 176.35 177.36 2buc s LEU 78 N -0.93 5.75 0.12 1.79 0.20 0.04 -1.43 118.68 124.22 2buc s LEU 78 Ca 0.13 -1.56 -0.19 0.00 0.69 0.00 0.00 54.13 53.20 2buc s LEU 78 Cb -0.11 -2.26 -0.07 0.00 -0.43 0.00 0.00 46.19 43.32 2buc s LEU 78 CO 0.02 -0.95 0.62 -0.36 -0.29 0.00 0.00 176.35 175.39 2buc s PHE 79 N 2.11 3.77 -0.26 5.38 0.08 -0.33 -2.11 117.98 126.62 2buc s PHE 79 Ca 0.07 1.31 -0.10 0.00 0.12 0.00 0.00 56.93 58.33 2buc s PHE 79 Cb -0.27 -2.53 -0.05 0.00 -0.57 0.00 0.00 43.02 39.61 2buc s PHE 79 CO 0.05 0.52 0.16 1.21 -0.10 0.00 0.00 175.22 177.07 2buc s ASN 80 N -1.28 5.97 0.22 1.36 3.84 -0.69 -2.25 114.94 122.10 2buc s ASN 80 Ca 0.33 0.02 0.05 0.00 0.21 0.00 0.00 52.86 53.48 2buc s ASN 80 Cb -0.19 -2.09 0.17 0.00 -0.55 0.00 0.00 41.25 38.59 2buc s ASN 80 CO 0.20 0.00 1.50 0.00 -2.79 0.00 0.00 177.10 176.02 2buc h ALA 81 N 7.99 0.76 0.07 1.71 0.00 -1.35 -2.10 119.26 126.34 2buc h ALA 81 Ca -0.36 -0.62 -0.00 0.00 0.00 0.00 0.00 54.91 53.92 2buc h ALA 81 Cb 1.18 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2buc h ALA 81 CO 0.60 0.82 -0.03 1.49 0.00 0.00 0.00 179.25 182.12 2buc h GLU 82 N 0.11 -0.09 0.00 0.00 4.81 -1.95 -3.41 114.58 114.05 2buc h GLU 82 Ca -0.02 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2buc h GLU 82 Cb 1.26 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.66 2buc h GLU 82 CO 0.10 0.10 -0.52 0.66 -0.73 0.00 0.00 179.01 178.62 2buc n TYR 83 N -5.05 0.00 0.00 0.92 4.01 -1.25 -5.06 117.16 110.73 2buc n TYR 83 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 2buc n TYR 83 Cb 0.14 -0.26 0.00 0.00 -0.31 0.00 0.00 39.34 38.91 2buc n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2buc n GLY 84 N 1.56 0.70 3.77 2.72 0.00 -0.79 -5.07 105.19 108.08 2buc n GLY 84 Ca -0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.58 2buc n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2buc s ASN 85 N -0.08 6.23 -0.08 1.61 2.20 -1.26 -4.68 114.94 118.88 2buc s ASN 85 Ca 0.00 2.24 0.02 0.00 -0.94 0.00 0.00 52.86 54.18 2buc s ASN 85 Cb 0.00 -2.60 0.01 0.00 -2.00 0.00 0.00 41.25 36.67 2buc s ASN 85 CO 0.00 -0.87 -0.15 -0.94 -2.94 0.00 0.00 177.10 172.20 2buc s SER 86 N -1.46 2.13 -0.01 3.54 1.04 -1.26 -1.71 113.70 115.97 2buc s SER 86 Ca 0.64 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.70 2buc s SER 86 Cb -0.27 -0.97 -0.04 0.00 0.10 0.00 0.00 66.02 64.84 2buc s SER 86 CO 0.32 0.05 0.04 -0.94 0.98 0.00 0.00 173.24 173.69 2buc s SER 87 N 0.67 5.40 -0.28 7.02 1.04 -0.90 -4.92 113.70 121.73 2buc s SER 87 Ca -0.14 0.07 -0.29 0.00 0.48 0.00 0.00 55.95 56.08 2buc s SER 87 Cb -0.16 -1.49 -0.02 0.00 0.10 0.00 0.00 66.02 64.46 2buc s SER 87 CO 0.04 0.28 1.62 -0.63 0.98 0.00 0.00 173.24 175.52 2buc s ILE 88 N -1.13 3.69 -0.07 -1.02 1.01 -1.26 -0.78 121.20 121.65 2buc s ILE 88 Ca 0.21 0.75 -0.18 0.00 0.00 0.00 0.00 60.65 61.43 2buc s ILE 88 Cb -0.12 -3.79 -0.30 0.00 0.01 0.00 0.00 42.46 38.26 2buc s ILE 88 CO 0.12 -0.41 0.74 0.15 0.00 0.00 0.00 174.94 175.53 2buc h PHE 89 N 11.23 0.54 -2.76 3.97 3.04 -1.40 -3.46 116.94 128.10 2buc h PHE 89 Ca -0.32 -0.40 -0.18 0.00 3.98 0.00 0.00 57.97 61.05 2buc h PHE 89 Cb 1.15 -0.02 -0.31 0.00 2.56 0.00 0.00 35.95 39.33 2buc h PHE 89 CO 0.93 1.46 -0.48 -1.17 -2.02 0.00 0.00 178.31 177.03 2buc s LEU 90 N -7.68 -0.39 0.60 0.59 2.96 -0.40 -5.00 118.68 109.36 2buc s LEU 90 Ca -0.16 0.71 -0.15 0.00 -0.22 0.00 0.00 54.13 54.31 2buc s LEU 90 Cb 0.03 0.89 -0.03 0.00 0.50 0.00 0.00 46.19 47.58 2buc s LEU 90 CO 0.81 -0.24 1.05 -1.83 -1.32 0.00 0.00 176.35 174.82 2buc s GLU 91 N 2.46 3.35 0.61 1.98 1.03 -1.26 -0.06 118.70 126.81 2buc s GLU 91 Ca 0.00 1.10 0.39 0.00 0.03 0.00 0.00 54.97 56.49 2buc s GLU 91 Cb -0.12 -2.04 1.96 0.00 -0.80 0.00 0.00 34.13 33.12 2buc s GLU 91 CO -0.10 -0.77 2.21 -2.95 -1.33 0.00 0.00 175.26 172.32 2buc h ASN 92 N 0.27 0.00 0.50 0.83 7.08 -1.85 -2.56 115.58 119.85 2buc h ASN 92 Ca -0.46 0.00 -0.11 0.00 -3.08 0.00 0.00 56.30 52.65 2buc h ASN 92 Cb 1.21 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 37.44 2buc h ASN 92 CO 0.58 0.02 -0.52 0.77 -2.08 0.00 0.00 177.43 176.20 2buc h SER 93 N 0.00 0.02 -0.27 6.14 4.64 -1.92 -3.02 113.55 119.14 2buc h SER 93 Ca -0.00 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 2buc h SER 93 Cb 0.20 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.27 2buc h SER 93 CO 0.00 0.53 0.13 0.74 -0.87 0.00 0.00 176.83 177.37 2buc h THR 94 N 0.02 1.12 -0.03 2.95 2.02 -1.84 -2.14 112.91 115.00 2buc h THR 94 Ca -0.00 -0.36 -0.12 0.00 0.77 0.00 0.00 66.41 66.69 2buc h THR 94 Cb 0.92 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 2buc h THR 94 CO 0.07 0.14 -0.56 -0.26 0.37 0.00 0.00 175.52 175.28 2buc h PHE 95 N 0.43 0.12 -0.02 3.16 0.05 -1.68 -3.28 116.94 115.71 2buc h PHE 95 Ca 0.11 -0.04 -0.15 0.00 3.82 0.00 0.00 57.97 61.71 2buc h PHE 95 Cb 0.08 -0.02 -0.02 0.00 2.00 0.00 0.00 35.95 37.99 2buc h PHE 95 CO 0.00 0.63 -0.67 -0.44 -0.18 0.00 0.00 178.31 177.65 2buc h ASP 96 N 0.08 0.14 0.81 2.17 3.45 -1.43 -3.19 116.42 118.45 2buc h ASP 96 Ca -0.00 -0.09 0.00 0.00 0.43 0.00 0.00 57.03 57.37 2buc h ASP 96 Cb 1.01 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 39.74 2buc h ASP 96 CO 0.08 0.77 -0.13 -1.84 -1.57 0.00 0.00 179.24 176.55 2buc n GLU 97 N -3.78 0.07 -0.05 3.56 0.28 -1.16 -3.98 120.64 115.58 2buc n GLU 97 Ca -0.02 -0.02 -0.10 0.00 -0.16 0.00 0.00 57.16 56.87 2buc n GLU 97 Cb 0.66 -1.50 0.05 0.00 1.43 0.00 0.00 31.44 32.09 2buc n GLU 97 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 2buc h LEU 98 N 0.04 0.75 0.00 -1.84 3.38 -1.66 -3.48 115.31 112.50 2buc h LEU 98 Ca 0.00 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2buc h LEU 98 Cb 0.48 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2buc h LEU 98 CO 0.00 1.06 0.00 0.61 0.09 0.00 0.00 178.44 180.20 2buc n GLY 99 N 0.06 3.43 3.65 0.83 0.00 -1.26 -5.05 105.19 106.86 2buc n GLY 99 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 2buc n GLY 99 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2buc s TYR 100 N -2.97 2.56 -0.36 1.61 -0.85 -1.26 -5.11 117.35 110.98 2buc s TYR 100 Ca 0.00 -0.47 -0.23 0.00 -0.52 0.00 0.00 57.07 55.85 2buc s TYR 100 Cb 0.00 -1.58 0.01 0.00 0.38 0.00 0.00 41.96 40.77 2buc s TYR 100 CO 0.00 0.43 0.76 -1.12 -1.52 0.00 0.00 175.55 174.10 2buc s SER 101 N -3.75 6.55 -0.30 -0.18 0.01 -1.26 -4.96 113.70 109.81 2buc s SER 101 Ca 0.36 0.36 -0.20 0.00 1.31 0.00 0.00 55.95 57.78 2buc s SER 101 Cb 0.01 -2.39 -0.01 0.00 0.21 0.00 0.00 66.02 63.84 2buc s SER 101 CO 0.20 -0.70 0.63 -0.89 0.41 0.00 0.00 173.24 172.89 2buc s THR 102 N 3.02 4.94 -0.20 1.44 2.01 -1.26 -4.49 115.64 121.11 2buc s THR 102 Ca 0.30 0.89 0.22 0.00 0.31 0.00 0.00 61.69 63.42 2buc s THR 102 Cb -0.13 -3.99 -0.25 0.00 0.01 0.00 0.00 72.50 68.14 2buc s THR 102 CO 0.16 -0.12 0.67 -0.46 -0.69 0.00 0.00 174.62 174.18 2buc n ASN 103 N 5.86 0.29 -3.71 3.53 6.94 -0.84 -4.98 115.26 122.34 2buc n ASN 103 Ca -0.01 -0.04 -0.13 0.00 -0.02 0.00 0.00 54.58 54.38 2buc n ASN 103 Cb 0.49 1.52 -0.07 0.00 -2.36 0.00 0.00 39.78 39.36 2buc n ASN 103 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2buc s ASP 104 N -4.49 -0.23 0.10 0.53 -1.08 -1.24 -5.04 116.67 105.22 2buc s ASP 104 Ca -0.04 0.03 0.04 0.00 -0.52 0.00 0.00 52.55 52.06 2buc s ASP 104 Cb 0.13 0.37 -0.04 0.00 -1.46 0.00 0.00 42.92 41.93 2buc s ASP 104 CO 0.87 -0.57 -0.11 -0.72 0.52 0.00 0.00 175.17 175.16 2buc s TYR 105 N -2.00 1.15 -0.12 -5.34 -0.85 -1.26 -0.54 117.35 108.39 2buc s TYR 105 Ca -0.09 -0.63 -0.04 0.00 -0.52 0.00 0.00 57.07 55.79 2buc s TYR 105 Cb -0.02 -0.62 0.06 0.00 0.38 0.00 0.00 41.96 41.76 2buc s TYR 105 CO 0.01 0.04 0.22 0.45 -1.52 0.00 0.00 175.55 174.74 2buc s SER 106 N -2.45 0.60 -0.06 -0.18 0.15 -0.80 -4.98 113.70 105.98 2buc s SER 106 Ca 0.06 0.42 -0.19 0.00 0.70 0.00 0.00 55.95 56.94 2buc s SER 106 Cb -0.03 0.50 -0.05 0.00 -1.71 0.00 0.00 66.02 64.73 2buc s SER 106 CO 0.01 -0.25 0.52 -0.69 1.20 0.00 0.00 173.24 174.02 2buc s VAL 107 N 2.36 5.06 0.38 4.45 1.01 -1.26 0.08 120.40 132.49 2buc s VAL 107 Ca 0.03 1.06 -0.28 0.00 0.00 0.00 0.00 61.98 62.78 2buc s VAL 107 Cb -0.12 -3.85 -0.11 0.00 0.00 0.00 0.00 36.38 32.30 2buc s VAL 107 CO -0.08 0.39 1.46 -0.94 0.00 0.00 0.00 175.10 175.94 2buc s SER 108 N 0.11 6.31 0.52 3.32 1.04 -0.44 -4.88 113.70 119.67 2buc s SER 108 Ca 0.28 3.00 0.27 0.00 0.48 0.00 0.00 55.95 59.98 2buc s SER 108 Cb -0.16 -2.66 1.45 0.00 0.10 0.00 0.00 66.02 64.74 2buc s SER 108 CO 0.13 -0.89 1.79 1.55 0.98 0.00 0.00 173.24 176.80 2buc h PRO 109 N 2.93 0.00 -0.03 4.02 0.13 -1.82 0.25 132.00 137.48 2buc h PRO 109 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2buc h PRO 109 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2buc h PRO 109 CO 0.64 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.01 2buc n ASP 110 N -2.60 2.03 -1.64 1.44 5.75 -1.10 -4.81 116.55 115.62 2buc n ASP 110 Ca -0.02 -1.68 -0.20 0.00 -0.01 0.00 0.00 54.79 52.88 2buc n ASP 110 Cb 0.26 -0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.27 2buc n ASP 110 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2buc n ARG 111 N 0.58 -1.44 -0.02 0.11 3.00 0.86 -4.86 116.66 114.90 2buc n ARG 111 Ca 0.17 1.19 -0.12 0.00 -0.01 0.00 0.00 57.85 59.09 2buc n ARG 111 Cb 0.44 -5.58 -0.14 0.00 0.00 0.00 0.00 32.46 27.17 2buc n ARG 111 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 2buc n GLN 112 N -2.46 0.66 -4.15 5.56 6.02 -1.26 -4.83 117.38 116.91 2buc n GLN 112 Ca -0.21 0.27 -0.15 0.00 -0.01 0.00 0.00 57.00 56.90 2buc n GLN 112 Cb 0.67 -1.75 -0.11 0.00 1.02 0.00 0.00 30.24 30.07 2buc n GLN 112 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2buc s PHE 113 N -2.58 1.03 -0.03 1.08 0.08 -1.26 -1.00 117.98 115.30 2buc s PHE 113 Ca -0.09 -0.56 0.03 0.00 0.12 0.00 0.00 56.93 56.43 2buc s PHE 113 Cb 0.08 -0.57 -0.00 0.00 -0.57 0.00 0.00 43.02 41.95 2buc s PHE 113 CO 0.81 0.00 -0.12 -1.50 -0.10 0.00 0.00 175.22 174.31 2buc s ILE 114 N -1.85 1.02 -0.03 0.64 2.07 -0.56 -1.33 121.20 121.17 2buc s ILE 114 Ca -0.00 -0.51 -0.15 0.00 -1.41 0.00 0.00 60.65 58.58 2buc s ILE 114 Cb -0.07 -0.88 -0.05 0.00 0.13 0.00 0.00 42.46 41.59 2buc s ILE 114 CO 0.01 0.30 0.39 -0.22 -1.91 0.00 0.00 174.94 173.51 2buc s LEU 115 N 0.00 4.44 -0.17 8.50 2.96 0.11 -0.51 118.68 134.01 2buc s LEU 115 Ca -0.01 0.89 -0.01 0.00 -0.22 0.00 0.00 54.13 54.79 2buc s LEU 115 Cb -0.08 -2.55 -0.00 0.00 0.50 0.00 0.00 46.19 44.06 2buc s LEU 115 CO 0.01 0.29 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.83 2buc s PHE 116 N -0.82 2.82 -0.22 5.38 2.99 0.18 -1.90 117.98 126.41 2buc s PHE 116 Ca 0.23 -1.10 -0.13 0.00 0.00 0.00 0.00 56.93 55.93 2buc s PHE 116 Cb -0.16 -1.94 -0.04 0.00 0.00 0.00 0.00 43.02 40.88 2buc s PHE 116 CO 0.12 -0.53 0.29 -2.00 -0.00 0.00 0.00 175.22 173.10 2buc s GLU 117 N 1.01 4.11 0.18 0.44 2.12 0.30 -2.08 118.70 124.79 2buc s GLU 117 Ca -0.01 -0.03 -0.09 0.00 0.36 0.00 0.00 54.97 55.20 2buc s GLU 117 Cb -0.15 -3.55 -0.01 0.00 0.26 0.00 0.00 34.13 30.69 2buc s GLU 117 CO -0.03 -0.01 0.30 1.52 -0.54 0.00 0.00 175.26 176.50 2buc s TYR 118 N 1.26 0.45 -1.32 5.30 1.13 -0.49 -1.99 117.35 121.70 2buc s TYR 118 Ca 0.13 -0.80 -0.05 0.00 -1.41 0.00 0.00 57.07 54.94 2buc s TYR 118 Cb -0.14 -0.06 0.01 0.00 -1.10 0.00 0.00 41.96 40.67 2buc s TYR 118 CO 0.07 -0.76 1.02 0.09 -2.51 0.00 0.00 175.55 173.46 2buc n ASN 119 N -0.25 -3.87 -4.67 -0.18 3.02 -1.26 0.19 115.26 108.24 2buc n ASN 119 Ca -0.06 -0.64 -0.42 0.00 -0.03 0.00 0.00 54.58 53.43 2buc n ASN 119 Cb 0.63 -4.78 -0.03 0.00 -0.61 0.00 0.00 39.78 34.99 2buc n ASN 119 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2buc s TYR 120 N -3.38 1.75 -0.26 3.10 5.04 -1.26 -4.27 117.35 118.07 2buc s TYR 120 Ca 0.30 -0.16 0.01 0.00 -2.44 0.00 0.00 57.07 54.78 2buc s TYR 120 Cb -0.14 -4.15 0.07 0.00 0.35 0.00 0.00 41.96 38.09 2buc s TYR 120 CO 0.75 -4.96 -0.03 0.08 -1.34 0.00 0.00 175.55 170.06 2buc s VAL 121 N 3.71 1.64 0.34 3.14 1.01 -0.44 -5.02 120.40 124.78 2buc s VAL 121 Ca 0.83 -1.44 -0.29 0.00 0.00 0.00 0.00 61.98 61.08 2buc s VAL 121 Cb -0.42 -1.96 -0.11 0.00 0.00 0.00 0.00 36.38 33.88 2buc s VAL 121 CO 0.37 -0.22 1.50 1.17 0.00 0.00 0.00 175.10 177.93 2buc n LYS 122 N 4.60 2.62 0.00 2.72 4.81 -1.26 -1.95 118.16 129.70 2buc n LYS 122 Ca -0.09 0.92 0.00 0.00 -0.87 0.00 0.00 58.31 58.27 2buc n LYS 122 Cb 0.43 -2.66 0.00 0.00 0.02 0.00 0.00 35.03 32.83 2buc n LYS 122 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 2buc n GLN 123 N 1.02 0.00 0.00 1.64 7.27 -0.14 -4.89 117.38 122.28 2buc n GLN 123 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.11 2buc n GLN 123 Cb 0.38 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.03 2buc n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 2buc n TRP 124 N 0.00 0.00 -0.13 3.69 5.03 -1.21 -4.95 117.44 119.87 2buc n TRP 124 Ca 0.00 0.00 -0.10 0.00 3.03 0.00 0.00 57.50 60.43 2buc n TRP 124 Cb 0.00 0.00 -0.01 0.00 -1.03 0.00 0.00 31.31 30.27 2buc n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 2buc h ARG 125 N 0.00 0.62 0.00 -0.99 2.43 -1.98 -3.36 114.38 111.09 2buc h ARG 125 Ca 0.00 -0.15 -0.11 0.00 -0.81 0.00 0.00 59.98 58.91 2buc h ARG 125 Cb 0.00 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 2buc h ARG 125 CO 0.00 0.65 -1.43 0.72 -1.51 0.00 0.00 179.97 178.40 2buc n HIS 126 N -4.58 0.00 -2.34 2.20 8.25 -1.26 -5.05 115.22 112.44 2buc n HIS 126 Ca -0.01 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.09 2buc n HIS 126 Cb 0.20 -0.30 -0.02 0.00 1.12 0.00 0.00 29.99 30.99 2buc n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2buc s SER 127 N -3.73 6.23 -0.02 0.41 1.04 -1.26 -4.72 113.70 111.65 2buc s SER 127 Ca -0.03 2.20 -0.29 0.00 0.48 0.00 0.00 55.95 58.31 2buc s SER 127 Cb 0.02 -2.59 0.10 0.00 0.10 0.00 0.00 66.02 63.65 2buc s SER 127 CO 0.26 -0.87 0.87 -0.72 0.98 0.00 0.00 173.24 173.76 2buc s TYR 128 N -1.64 -0.38 0.10 5.02 -0.85 -1.26 -0.97 117.35 117.37 2buc s TYR 128 Ca 0.64 0.32 0.05 0.00 -0.52 0.00 0.00 57.07 57.56 2buc s TYR 128 Cb -0.25 0.52 -0.04 0.00 0.38 0.00 0.00 41.96 42.57 2buc s TYR 128 CO 0.31 -0.54 -0.00 0.95 -1.52 0.00 0.00 175.55 174.75 2buc s THR 129 N -2.79 3.97 0.18 -3.49 -4.23 -0.82 -4.54 115.64 103.92 2buc s THR 129 Ca 0.03 -1.05 -0.14 0.00 -1.18 0.00 0.00 61.69 59.35 2buc s THR 129 Cb -0.01 -2.91 0.01 0.00 1.34 0.00 0.00 72.50 70.94 2buc s THR 129 CO -0.07 0.09 0.43 0.00 -0.54 0.00 0.00 174.62 174.53 2buc s ALA 130 N -1.36 -0.56 0.04 3.99 0.00 -0.49 -1.33 121.76 122.05 2buc s ALA 130 Ca 0.26 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.73 2buc s ALA 130 Cb -0.11 0.86 -0.04 0.00 0.00 0.00 0.00 23.12 23.82 2buc s ALA 130 CO 0.18 -0.75 0.13 -1.12 0.00 0.00 0.00 175.76 174.21 2buc s SER 131 N -2.91 5.92 -0.02 0.00 0.01 0.13 -1.55 113.70 115.28 2buc s SER 131 Ca 0.12 0.16 0.02 0.00 1.31 0.00 0.00 55.95 57.56 2buc s SER 131 Cb 0.01 -1.73 0.00 0.00 0.21 0.00 0.00 66.02 64.51 2buc s SER 131 CO -0.01 0.21 -0.07 -0.31 0.41 0.00 0.00 173.24 173.46 2buc s TYR 132 N -1.37 0.73 0.06 2.43 1.51 -1.26 -1.40 117.35 118.06 2buc s TYR 132 Ca 0.29 -0.16 0.08 0.00 -1.01 0.00 0.00 57.07 56.27 2buc s TYR 132 Cb -0.12 -0.52 -0.03 0.00 -0.11 0.00 0.00 41.96 41.18 2buc s TYR 132 CO 0.21 -0.06 -0.20 -0.51 -1.11 0.00 0.00 175.55 173.88 2buc s ASP 133 N 0.11 3.69 -0.15 2.29 1.11 -0.88 -4.26 116.67 118.58 2buc s ASP 133 Ca -0.01 -0.50 -0.04 0.00 0.18 0.00 0.00 52.55 52.18 2buc s ASP 133 Cb -0.06 -0.52 -0.03 0.00 1.07 0.00 0.00 42.92 43.38 2buc s ASP 133 CO -0.00 0.23 -0.03 -0.63 1.18 0.00 0.00 175.17 175.93 2buc s ILE 134 N -0.97 3.99 -0.22 0.77 1.01 -1.26 -0.65 121.20 123.88 2buc s ILE 134 Ca 0.15 -0.33 -0.04 0.00 0.00 0.00 0.00 60.65 60.43 2buc s ILE 134 Cb -0.10 -2.74 -0.01 0.00 0.01 0.00 0.00 42.46 39.61 2buc s ILE 134 CO 0.06 0.50 -0.02 -0.47 0.00 0.00 0.00 174.94 175.01 2buc s TYR 135 N 0.22 2.98 -0.40 3.97 5.04 0.33 -1.37 117.35 128.12 2buc s TYR 135 Ca -0.02 -0.78 -0.29 0.00 -2.44 0.00 0.00 57.07 53.55 2buc s TYR 135 Cb -0.14 -2.11 0.00 0.00 0.35 0.00 0.00 41.96 40.07 2buc s TYR 135 CO 0.03 -0.46 1.50 0.34 -1.34 0.00 0.00 175.55 175.62 2buc s ASP 136 N 1.39 6.22 0.25 4.32 -1.08 0.76 -1.49 116.67 127.04 2buc s ASP 136 Ca 0.05 0.91 0.07 0.00 -0.52 0.00 0.00 52.55 53.06 2buc s ASP 136 Cb -0.14 -2.54 0.29 0.00 -1.46 0.00 0.00 42.92 39.07 2buc s ASP 136 CO -0.01 -1.51 1.58 -0.07 0.52 0.00 0.00 175.17 175.68 2buc h LEU 137 N 12.59 0.14 -0.14 -1.34 3.38 -1.36 0.56 115.31 129.13 2buc h LEU 137 Ca -0.29 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.50 2buc h LEU 137 Cb 1.12 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2buc h LEU 137 CO 1.08 0.72 -0.32 0.78 0.09 0.00 0.00 178.44 180.79 2buc h ASN 138 N 0.09 0.53 -0.68 -0.43 2.35 -1.88 -3.22 115.58 112.33 2buc h ASN 138 Ca -0.01 -0.57 0.00 0.00 -0.55 0.00 0.00 56.30 55.18 2buc h ASN 138 Cb 1.11 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.33 2buc h ASN 138 CO 0.09 1.00 0.00 2.29 -1.65 0.00 0.00 177.43 179.15 2buc n LYS 139 N -4.37 2.70 -3.90 0.81 2.85 -1.24 -5.00 118.16 110.00 2buc n LYS 139 Ca -0.07 -2.61 -0.38 0.00 -1.05 0.00 0.00 58.31 54.20 2buc n LYS 139 Cb 0.49 -1.56 0.02 0.00 -0.65 0.00 0.00 35.03 33.33 2buc n LYS 139 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2buc n ARG 140 N 1.62 -0.72 -3.76 -1.58 1.74 0.13 -4.97 116.66 109.12 2buc n ARG 140 Ca 0.24 0.32 -0.13 0.00 -0.77 0.00 0.00 57.85 57.51 2buc n ARG 140 Cb 0.62 -2.98 -0.08 0.00 -1.02 0.00 0.00 32.46 28.99 2buc n ARG 140 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2buc s GLN 141 N -6.56 0.72 0.17 5.56 0.74 -0.83 -5.00 119.66 114.47 2buc s GLN 141 Ca 0.40 -0.29 -0.25 0.00 0.05 0.00 0.00 55.36 55.26 2buc s GLN 141 Cb -0.20 0.31 -0.08 0.00 1.10 0.00 0.00 33.01 34.15 2buc s GLN 141 CO 0.93 -0.21 0.78 -0.51 -0.55 0.00 0.00 175.29 175.73 2buc s LEU 142 N -1.57 4.59 -0.13 3.68 1.43 -1.26 -0.17 118.68 125.24 2buc s LEU 142 Ca -0.11 1.65 -0.26 0.00 -1.03 0.00 0.00 54.13 54.39 2buc s LEU 142 Cb -0.04 -3.33 -0.02 0.00 0.03 0.00 0.00 46.19 42.84 2buc s LEU 142 CO 0.02 0.20 0.84 -0.63 0.23 0.00 0.00 176.35 177.01 2buc s ILE 143 N -1.17 4.89 -0.25 -0.59 1.09 -0.47 -4.91 121.20 119.79 2buc s ILE 143 Ca 0.36 1.69 0.05 0.00 -1.10 0.00 0.00 60.65 61.65 2buc s ILE 143 Cb -0.23 -4.16 -0.04 0.00 -1.06 0.00 0.00 42.46 36.97 2buc s ILE 143 CO 0.26 0.07 0.23 0.35 -0.10 0.00 0.00 174.94 175.76 2buc n THR 144 N 4.50 0.00 -4.26 2.92 -2.24 -1.26 -4.65 114.28 109.29 2buc n THR 144 Ca 0.04 -0.40 -0.34 0.00 -2.27 0.00 0.00 64.05 61.09 2buc n THR 144 Cb 0.49 1.01 -0.09 0.00 -2.10 0.00 0.00 70.33 69.65 2buc n THR 144 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2buc s GLU 145 N -1.37 2.96 -1.27 -0.78 -1.05 -1.26 -4.66 118.70 111.27 2buc s GLU 145 Ca 0.02 -0.48 -0.11 0.00 -0.15 0.00 0.00 54.97 54.25 2buc s GLU 145 Cb 0.04 -2.79 -0.00 0.00 -0.44 0.00 0.00 34.13 30.94 2buc s GLU 145 CO 0.18 0.67 0.61 0.39 0.95 0.00 0.00 175.26 178.06 2buc n GLU 146 N 1.68 -2.32 -1.76 -4.83 -0.58 -1.26 -4.68 120.64 106.89 2buc n GLU 146 Ca -0.16 0.42 -0.30 0.00 -0.42 0.00 0.00 57.16 56.70 2buc n GLU 146 Cb 0.53 -4.28 0.06 0.00 -0.57 0.00 0.00 31.44 27.18 2buc n GLU 146 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 2buc s ARG 147 N -6.32 2.64 0.11 3.49 3.03 -1.26 -4.76 118.95 115.88 2buc s ARG 147 Ca 0.23 0.55 -0.31 0.00 2.03 0.00 0.00 55.73 58.24 2buc s ARG 147 Cb -0.09 -1.99 -0.08 0.00 -1.03 0.00 0.00 34.95 31.77 2buc s ARG 147 CO 0.88 -1.21 1.35 0.42 -1.13 0.00 0.00 175.30 175.60 2buc s ILE 148 N -3.27 3.44 0.78 4.99 1.01 -1.26 -4.99 121.20 121.90 2buc s ILE 148 Ca 0.59 1.04 -0.14 0.00 0.00 0.00 0.00 60.65 62.15 2buc s ILE 148 Cb -0.12 -3.67 0.07 0.00 0.01 0.00 0.00 42.46 38.75 2buc s ILE 148 CO 0.53 0.09 1.19 -2.84 0.00 0.00 0.00 174.94 173.90 2buc s PRO 149 N 1.00 1.86 0.65 2.79 0.02 -1.26 -4.45 135.00 135.60 2buc s PRO 149 Ca 0.63 1.69 -0.15 0.00 0.02 0.00 0.00 61.00 63.18 2buc s PRO 149 Cb -0.35 -1.81 -0.01 0.00 0.02 0.00 0.00 34.50 32.35 2buc s PRO 149 CO 0.31 -2.03 1.11 -0.80 -0.33 0.00 0.00 177.00 175.26 2buc s ASN 150 N -2.25 5.17 -1.14 2.53 0.01 -1.26 -3.73 114.94 114.27 2buc s ASN 150 Ca 0.72 2.01 -0.05 0.00 -0.71 0.00 0.00 52.86 54.83 2buc s ASN 150 Cb -0.27 -2.55 0.01 0.00 0.41 0.00 0.00 41.25 38.84 2buc s ASN 150 CO 0.49 -1.59 0.60 0.59 -1.51 0.00 0.00 177.10 175.68 2buc n ASN 151 N -2.32 -5.14 -4.71 -1.22 3.02 -1.18 -4.98 115.26 98.73 2buc n ASN 151 Ca 0.10 -0.28 -0.42 0.00 -0.03 0.00 0.00 54.58 53.96 2buc n ASN 151 Cb 0.52 -3.91 -0.03 0.00 -0.61 0.00 0.00 39.78 35.75 2buc n ASN 151 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2buc s THR 152 N -3.09 4.19 -0.02 3.41 2.01 -0.60 -4.54 115.64 117.01 2buc s THR 152 Ca 0.30 1.57 -0.17 0.00 0.31 0.00 0.00 61.69 63.69 2buc s THR 152 Cb -0.13 -4.00 -0.33 0.00 0.01 0.00 0.00 72.50 68.05 2buc s THR 152 CO 0.37 0.10 0.86 1.56 -0.69 0.00 0.00 174.62 176.81 2buc h GLN 153 N 6.94 0.41 -2.85 4.92 4.20 -0.73 -1.29 115.11 126.71 2buc h GLN 153 Ca -0.40 -0.70 -0.11 0.00 0.06 0.00 0.00 58.65 57.50 2buc h GLN 153 Cb 1.20 0.26 -0.21 0.00 0.30 0.00 0.00 27.48 29.04 2buc h GLN 153 CO 0.82 1.34 -0.21 -0.46 -0.67 0.00 0.00 178.83 179.64 2buc s TRP 154 N -2.53 -0.30 -0.06 2.96 -0.11 -1.16 -4.60 118.94 113.15 2buc s TRP 154 Ca -0.13 0.55 -0.09 0.00 1.22 0.00 0.00 56.10 57.65 2buc s TRP 154 Cb 0.03 0.15 0.02 0.00 -1.50 0.00 0.00 33.47 32.17 2buc s TRP 154 CO 0.87 -0.38 0.22 -1.50 -4.62 0.00 0.00 176.95 171.55 2buc s ILE 155 N -0.97 0.02 -0.13 5.86 2.07 -1.26 0.57 121.20 127.36 2buc s ILE 155 Ca -0.10 -0.19 -0.12 0.00 -1.41 0.00 0.00 60.65 58.82 2buc s ILE 155 Cb -0.04 -0.38 0.04 0.00 0.13 0.00 0.00 42.46 42.20 2buc s ILE 155 CO 0.04 -0.10 0.35 0.28 -1.91 0.00 0.00 174.94 173.60 2buc s THR 156 N -0.34 -0.00 0.58 4.00 -1.32 0.33 -5.00 115.64 113.89 2buc s THR 156 Ca -0.04 0.00 -0.18 0.00 -1.21 0.00 0.00 61.69 60.26 2buc s THR 156 Cb -0.03 -0.50 -0.04 0.00 -1.51 0.00 0.00 72.50 70.42 2buc s THR 156 CO 0.01 0.00 1.10 0.26 -2.21 0.00 0.00 174.62 173.78 2buc s TRP 157 N 0.22 2.74 0.76 9.09 0.52 -1.26 -1.21 118.94 129.80 2buc s TRP 157 Ca -0.00 1.55 -0.11 0.00 0.02 0.00 0.00 56.10 57.55 2buc s TRP 157 Cb -0.03 -3.19 0.05 0.00 -1.15 0.00 0.00 33.47 29.16 2buc s TRP 157 CO 0.00 -1.46 1.10 -1.54 0.02 0.00 0.00 176.95 175.08 2buc s SER 158 N -2.18 4.52 0.52 2.95 1.04 -0.23 -4.89 113.70 115.43 2buc s SER 158 Ca 0.69 1.89 0.30 0.00 0.48 0.00 0.00 55.95 59.32 2buc s SER 158 Cb -0.21 -2.53 1.28 0.00 0.10 0.00 0.00 66.02 64.66 2buc s SER 158 CO 0.32 -2.03 1.96 -0.65 0.98 0.00 0.00 173.24 173.82 2buc h PRO 159 N -0.92 0.00 -5.81 4.02 0.11 -1.81 -3.43 132.00 124.17 2buc h PRO 159 Ca -0.44 0.00 -0.49 0.00 0.11 0.00 0.00 66.00 65.17 2buc h PRO 159 Cb 1.24 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.17 2buc h PRO 159 CO 0.51 0.09 -0.78 0.14 -0.21 0.00 0.00 178.00 177.75 2buc s VAL 160 N -3.74 1.69 0.00 3.15 -7.23 -1.26 -4.76 120.40 108.24 2buc s VAL 160 Ca 0.00 -1.85 0.00 0.00 -1.81 0.00 0.00 61.98 58.32 2buc s VAL 160 Cb 0.10 -1.76 0.00 0.00 0.56 0.00 0.00 36.38 35.28 2buc s VAL 160 CO 0.57 -0.33 0.00 0.61 -0.31 0.00 0.00 175.10 175.64 2buc n GLY 161 N 0.38 1.60 1.39 2.32 0.00 -1.26 -4.37 105.19 105.25 2buc n GLY 161 Ca -0.14 -0.60 0.01 0.00 0.00 0.00 0.00 46.02 45.28 2buc n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2buc n HIS 162 N 12.89 0.01 -2.48 1.61 1.44 -1.26 -2.70 115.22 124.72 2buc n HIS 162 Ca 0.00 -0.54 -0.34 0.00 -2.01 0.00 0.00 57.72 54.83 2buc n HIS 162 Cb 0.00 0.05 -0.03 0.00 0.12 0.00 0.00 29.99 30.13 2buc n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 2buc s LYS 163 N -0.08 3.76 0.00 -1.40 1.02 -1.26 -4.68 119.74 117.10 2buc s LYS 163 Ca 0.24 1.31 0.06 0.00 0.02 0.00 0.00 55.97 57.60 2buc s LYS 163 Cb 0.28 -2.09 -0.02 0.00 -0.52 0.00 0.00 37.83 35.48 2buc s LYS 163 CO -0.12 -0.46 -0.19 -0.51 -0.92 0.00 0.00 175.35 173.15 2buc s LEU 164 N -3.63 2.07 -0.05 3.17 1.43 0.71 -1.07 118.68 121.31 2buc s LEU 164 Ca 0.66 -0.38 0.04 0.00 -1.03 0.00 0.00 54.13 53.43 2buc s LEU 164 Cb -0.16 -0.93 -0.00 0.00 0.03 0.00 0.00 46.19 45.13 2buc s LEU 164 CO 0.22 0.20 -0.18 0.00 0.23 0.00 0.00 176.35 176.82 2buc s ALA 165 N -0.53 1.61 0.03 4.21 0.00 -0.35 0.07 121.76 126.81 2buc s ALA 165 Ca 0.07 -0.73 -0.06 0.00 0.00 0.00 0.00 51.96 51.24 2buc s ALA 165 Cb -0.07 -0.54 -0.01 0.00 0.00 0.00 0.00 23.12 22.50 2buc s ALA 165 CO -0.00 0.29 0.10 1.52 0.00 0.00 0.00 175.76 177.67 2buc s TYR 166 N 0.04 0.18 -0.22 0.00 -0.85 -0.02 -0.52 117.35 115.97 2buc s TYR 166 Ca -0.05 -0.46 -0.05 0.00 -0.52 0.00 0.00 57.07 56.00 2buc s TYR 166 Cb -0.12 -0.13 -0.01 0.00 0.38 0.00 0.00 41.96 42.07 2buc s TYR 166 CO 0.03 -0.35 -0.02 0.08 -1.52 0.00 0.00 175.55 173.77 2buc s VAL 167 N -2.42 3.61 -0.05 -3.49 1.01 0.19 -0.25 120.40 119.01 2buc s VAL 167 Ca -0.07 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.51 2buc s VAL 167 Cb -0.02 -2.65 0.02 0.00 0.00 0.00 0.00 36.38 33.73 2buc s VAL 167 CO -0.04 0.41 -0.03 0.86 0.00 0.00 0.00 175.10 176.30 2buc s TRP 168 N 1.40 0.71 -1.49 5.22 -0.00 -0.39 -0.08 118.94 124.31 2buc s TRP 168 Ca 0.05 -0.19 -0.08 0.00 -0.00 0.00 0.00 56.10 55.87 2buc s TRP 168 Cb -0.14 -0.68 0.06 0.00 -0.00 0.00 0.00 33.47 32.71 2buc s TRP 168 CO -0.01 -0.22 0.74 0.09 -0.00 0.00 0.00 176.95 177.55 2buc n ASN 169 N 4.28 -2.56 -0.38 5.86 5.03 -1.26 -1.98 115.26 124.25 2buc n ASN 169 Ca -0.21 -0.89 -0.05 0.00 0.87 0.00 0.00 54.58 54.29 2buc n ASN 169 Cb 0.51 -3.47 -0.02 0.00 -1.02 0.00 0.00 39.78 35.77 2buc n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2buc n ASN 170 N -2.88 -4.76 -4.41 6.41 5.03 -1.26 -4.54 115.26 108.84 2buc n ASN 170 Ca -0.12 0.12 -0.29 0.00 0.87 0.00 0.00 54.58 55.16 2buc n ASN 170 Cb 0.59 -2.70 -0.13 0.00 -1.02 0.00 0.00 39.78 36.52 2buc n ASN 170 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 2buc s ASP 171 N -2.33 3.47 -0.08 6.41 1.01 -0.84 -2.27 116.67 122.05 2buc s ASP 171 Ca 0.00 -0.65 -0.17 0.00 0.71 0.00 0.00 52.55 52.44 2buc s ASP 171 Cb 0.00 -0.34 -0.05 0.00 1.01 0.00 0.00 42.92 43.54 2buc s ASP 171 CO 0.00 0.20 0.44 -0.63 0.21 0.00 0.00 175.17 175.39 2buc s ILE 172 N -1.03 5.13 -0.01 0.77 1.01 -1.26 -1.26 121.20 124.56 2buc s ILE 172 Ca 0.15 0.90 0.06 0.00 0.00 0.00 0.00 60.65 61.75 2buc s ILE 172 Cb -0.10 -3.77 -0.02 0.00 0.01 0.00 0.00 42.46 38.58 2buc s ILE 172 CO 0.06 0.41 -0.20 -0.31 0.00 0.00 0.00 174.94 174.91 2buc s TYR 173 N 0.07 1.75 -0.17 3.97 1.51 0.66 -0.27 117.35 124.86 2buc s TYR 173 Ca 0.25 -0.33 -0.02 0.00 -1.01 0.00 0.00 57.07 55.95 2buc s TYR 173 Cb -0.16 -1.12 -0.01 0.00 -0.11 0.00 0.00 41.96 40.57 2buc s TYR 173 CO 0.11 -0.02 -0.10 0.08 -1.11 0.00 0.00 175.55 174.51 2buc s VAL 174 N -0.50 3.10 -0.39 0.71 1.01 0.34 -0.84 120.40 123.83 2buc s VAL 174 Ca 0.07 -0.61 -0.03 0.00 0.00 0.00 0.00 61.98 61.41 2buc s VAL 174 Cb -0.08 -2.35 0.10 0.00 0.00 0.00 0.00 36.38 34.05 2buc s VAL 174 CO -0.00 0.49 0.18 -0.54 0.00 0.00 0.00 175.10 175.22 2buc s LYS 175 N 0.89 2.14 0.20 2.72 1.02 0.11 -0.43 119.74 126.39 2buc s LYS 175 Ca -0.02 -1.68 -0.07 0.00 0.02 0.00 0.00 55.97 54.21 2buc s LYS 175 Cb -0.15 -3.54 0.14 0.00 -0.52 0.00 0.00 37.83 33.77 2buc s LYS 175 CO 0.00 -0.98 1.68 -0.91 -0.92 0.00 0.00 175.35 174.22 2buc h ASN 176 N 8.08 0.99 -4.09 2.83 -0.26 -1.84 0.20 115.58 121.49 2buc h ASN 176 Ca -0.15 -0.26 -0.41 0.00 -0.56 0.00 0.00 56.30 54.92 2buc h ASN 176 Cb 1.05 -0.26 -0.28 0.00 -1.06 0.00 0.00 38.32 37.76 2buc h ASN 176 CO 0.68 1.03 -0.78 -1.61 -1.06 0.00 0.00 177.43 175.68 2buc s GLU 177 N -5.06 0.79 0.37 0.81 0.41 -1.26 -4.20 118.70 110.56 2buc s GLU 177 Ca -0.11 -0.38 0.04 0.00 -0.41 0.00 0.00 54.97 54.11 2buc s GLU 177 Cb 0.14 -0.77 0.70 0.00 -1.78 0.00 0.00 34.13 32.42 2buc s GLU 177 CO 0.85 0.21 2.02 -1.35 -0.49 0.00 0.00 175.26 176.50 2buc h PRO 178 N 5.83 0.74 -0.18 0.39 0.11 -1.85 -2.01 132.00 135.03 2buc h PRO 178 Ca -0.32 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2buc h PRO 178 Cb 1.18 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2buc h PRO 178 CO 0.49 0.50 0.00 0.27 -0.21 0.00 0.00 178.00 179.05 2buc n ASN 179 N -4.45 1.60 -4.65 -2.05 6.94 -1.26 -4.79 115.26 106.61 2buc n ASN 179 Ca 0.05 -1.74 -0.23 0.00 -0.02 0.00 0.00 54.58 52.65 2buc n ASN 179 Cb 0.05 -0.12 -0.07 0.00 -2.36 0.00 0.00 39.78 37.28 2buc n ASN 179 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2buc s LEU 180 N -1.48 3.19 0.40 -4.53 2.01 -0.76 -4.76 118.68 112.76 2buc s LEU 180 Ca 0.31 -0.65 -0.27 0.00 0.01 0.00 0.00 54.13 53.53 2buc s LEU 180 Cb 0.16 -1.71 -0.09 0.00 0.01 0.00 0.00 46.19 44.56 2buc s LEU 180 CO 0.24 -0.01 1.41 -0.55 1.01 0.00 0.00 176.35 178.45 2buc s SER 181 N -3.68 6.23 0.64 2.29 0.15 -1.26 -4.78 113.70 113.29 2buc s SER 181 Ca 0.32 2.88 -0.12 0.00 0.70 0.00 0.00 55.95 59.73 2buc s SER 181 Cb -0.06 -2.65 -0.02 0.00 -1.71 0.00 0.00 66.02 61.57 2buc s SER 181 CO 0.20 -0.93 1.04 -0.94 1.20 0.00 0.00 173.24 173.81 2buc s SER 182 N -0.43 5.86 -0.15 5.45 1.04 -1.26 -4.72 113.70 119.49 2buc s SER 182 Ca 0.56 1.55 0.01 0.00 0.48 0.00 0.00 55.95 58.55 2buc s SER 182 Cb -0.43 -2.49 0.01 0.00 0.10 0.00 0.00 66.02 63.21 2buc s SER 182 CO 0.57 -1.12 -0.19 -1.58 0.98 0.00 0.00 173.24 171.89 2buc s GLN 183 N -4.95 3.08 0.11 4.02 2.00 0.43 -4.93 119.66 119.41 2buc s GLN 183 Ca 0.57 -0.82 -0.30 0.00 -2.00 0.00 0.00 55.36 52.81 2buc s GLN 183 Cb -0.13 -2.52 -0.06 0.00 0.80 0.00 0.00 33.01 31.10 2buc s GLN 183 CO 0.51 -0.04 1.15 0.50 -0.50 0.00 0.00 175.29 176.91 2buc s ARG 184 N 0.90 4.50 -0.23 1.67 3.52 -1.26 -0.51 118.95 127.54 2buc s ARG 184 Ca -0.05 1.73 -0.01 0.00 -0.13 0.00 0.00 55.73 57.27 2buc s ARG 184 Cb -0.15 -3.32 -0.14 0.00 -1.56 0.00 0.00 34.95 29.78 2buc s ARG 184 CO -0.03 -0.11 -0.22 -0.89 -0.81 0.00 0.00 175.30 173.23 2buc n ILE 185 N 3.28 1.30 -4.42 4.11 2.08 0.63 -4.95 119.36 121.39 2buc n ILE 185 Ca 0.06 -0.46 -0.27 0.00 0.56 0.00 0.00 62.75 62.64 2buc n ILE 185 Cb 0.47 -1.41 -0.12 0.00 -0.75 0.00 0.00 39.64 37.82 2buc n ILE 185 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 2buc s THR 186 N -2.45 2.32 0.00 1.39 -4.23 -1.23 -4.93 115.64 106.52 2buc s THR 186 Ca -0.31 -1.98 0.00 0.00 -1.18 0.00 0.00 61.69 58.22 2buc s THR 186 Cb 0.09 -2.09 0.00 0.00 1.34 0.00 0.00 72.50 71.83 2buc s THR 186 CO 0.50 -0.09 0.46 0.79 -0.54 0.00 0.00 174.62 175.74 2buc n TRP 187 N 0.38 0.00 0.92 3.99 7.02 -1.26 -4.61 117.44 123.88 2buc n TRP 187 Ca -0.13 -0.09 0.11 0.00 -1.02 0.00 0.00 57.50 56.37 2buc n TRP 187 Cb 0.55 -0.01 0.11 0.00 -2.42 0.00 0.00 31.31 29.55 2buc n TRP 187 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 2buc n THR 188 N -0.09 0.03 -1.63 -0.99 -2.24 -1.26 -4.96 114.28 103.15 2buc n THR 188 Ca 0.00 -0.04 -0.53 0.00 -2.27 0.00 0.00 64.05 61.21 2buc n THR 188 Cb 0.15 0.44 -0.06 0.00 -2.10 0.00 0.00 70.33 68.76 2buc n THR 188 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2buc n GLY 189 N 1.48 0.94 2.90 3.38 0.00 -1.26 -4.63 105.19 108.00 2buc n GLY 189 Ca 0.04 0.91 -0.19 0.00 0.00 0.00 0.00 46.02 46.79 2buc n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2buc s LYS 190 N 4.46 0.69 -0.09 1.61 2.20 -1.05 -4.89 119.74 122.66 2buc s LYS 190 Ca 1.00 -0.11 -0.37 0.00 -0.36 0.00 0.00 55.97 56.14 2buc s LYS 190 Cb -0.90 -0.71 -0.14 0.00 -1.51 0.00 0.00 37.83 34.57 2buc s LYS 190 CO 0.57 -0.04 1.71 -1.91 -0.36 0.00 0.00 175.35 175.32 2buc n GLU 191 N 3.81 1.67 -1.19 4.03 2.13 -1.26 -1.67 120.64 128.15 2buc n GLU 191 Ca -0.23 0.61 -0.07 0.00 0.66 0.00 0.00 57.16 58.13 2buc n GLU 191 Cb 0.52 -2.36 -0.03 0.00 0.27 0.00 0.00 31.44 29.84 2buc n GLU 191 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2buc n ASN 192 N 5.10 -5.04 0.09 4.31 5.03 -1.26 -4.75 115.26 118.74 2buc n ASN 192 Ca 0.22 0.16 0.00 0.00 0.87 0.00 0.00 54.58 55.84 2buc n ASN 192 Cb 0.22 -3.13 0.00 0.00 -1.02 0.00 0.00 39.78 35.86 2buc n ASN 192 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 2buc n VAL 193 N -2.39 0.39 -4.99 2.41 0.31 -0.67 -4.74 118.33 108.65 2buc n VAL 193 Ca -0.07 0.13 -0.32 0.00 -0.01 0.00 0.00 64.34 64.07 2buc n VAL 193 Cb 0.42 -0.82 -0.16 0.00 -0.91 0.00 0.00 33.84 32.37 2buc n VAL 193 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2buc s ILE 194 N -1.80 2.59 -0.22 2.52 -1.09 -0.84 0.41 121.20 122.76 2buc s ILE 194 Ca 0.00 -0.83 0.02 0.00 -2.23 0.00 0.00 60.65 57.61 2buc s ILE 194 Cb 0.00 -2.04 0.05 0.00 -1.58 0.00 0.00 42.46 38.88 2buc s ILE 194 CO 0.00 0.54 -0.12 -0.31 -1.23 0.00 0.00 174.94 173.82 2buc s TYR 195 N 0.33 2.82 -0.25 3.97 1.51 0.43 -2.53 117.35 123.64 2buc s TYR 195 Ca -0.14 -1.91 -0.08 0.00 -1.01 0.00 0.00 57.07 53.93 2buc s TYR 195 Cb -0.17 -1.80 -0.03 0.00 -0.11 0.00 0.00 41.96 39.84 2buc s TYR 195 CO 0.07 -0.81 0.09 -0.80 -1.11 0.00 0.00 175.55 172.99 2buc s ASN 196 N 1.26 5.33 0.00 2.29 0.01 -0.96 -0.31 114.94 122.55 2buc s ASN 196 Ca -0.03 -0.15 0.00 0.00 -0.71 0.00 0.00 52.86 51.96 2buc s ASN 196 Cb -0.17 -1.96 0.00 0.00 0.41 0.00 0.00 41.25 39.52 2buc s ASN 196 CO -0.08 -0.03 0.00 0.61 -1.51 0.00 0.00 177.10 176.10 2buc n GLY 197 N 4.88 1.36 3.10 0.66 0.00 -0.65 -4.35 105.19 110.18 2buc n GLY 197 Ca -0.16 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 2buc n GLY 197 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2buc s VAL 198 N -3.68 0.62 0.59 1.61 -7.23 -1.26 -0.21 120.40 110.83 2buc s VAL 198 Ca 0.00 -1.31 -0.15 0.00 -1.81 0.00 0.00 61.98 58.71 2buc s VAL 198 Cb 0.00 -0.91 -0.04 0.00 0.56 0.00 0.00 36.38 35.99 2buc s VAL 198 CO 0.00 -0.50 1.04 0.42 -0.31 0.00 0.00 175.10 175.75 2buc s THR 199 N -1.94 4.03 0.77 5.32 -4.23 0.74 -4.74 115.64 115.60 2buc s THR 199 Ca -0.04 0.92 -0.12 0.00 -1.18 0.00 0.00 61.69 61.27 2buc s THR 199 Cb -0.06 -3.48 0.17 0.00 1.34 0.00 0.00 72.50 70.47 2buc s THR 199 CO -0.01 -0.61 1.05 -0.90 -0.54 0.00 0.00 174.62 173.61 2buc n ASP 200 N -2.06 0.19 0.08 3.99 5.75 -1.26 -4.83 116.55 118.40 2buc n ASP 200 Ca 0.08 -1.45 -0.13 0.00 -0.01 0.00 0.00 54.79 53.28 2buc n ASP 200 Cb 0.53 -0.79 -0.06 0.00 -1.03 0.00 0.00 41.12 39.77 2buc n ASP 200 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 2buc h TRP 201 N -1.51 -1.05 -0.53 2.11 7.01 -1.99 -2.21 115.95 117.79 2buc h TRP 201 Ca -0.34 0.03 -0.08 0.00 2.11 0.00 0.00 58.89 60.61 2buc h TRP 201 Cb 0.96 0.46 -0.02 0.00 -2.10 0.00 0.00 29.16 28.45 2buc h TRP 201 CO 0.00 -0.47 -0.01 -0.24 -2.79 0.00 0.00 178.44 174.94 2buc h VAL 202 N -0.55 1.25 -0.19 2.65 3.04 -1.95 -1.95 116.25 118.55 2buc h VAL 202 Ca 0.05 -1.08 -0.13 0.00 -1.01 0.00 0.00 66.70 64.53 2buc h VAL 202 Cb 0.62 0.85 -0.01 0.00 -2.01 0.00 0.00 31.29 30.74 2buc h VAL 202 CO -0.27 0.38 -0.44 1.88 -1.01 0.00 0.00 177.57 178.11 2buc h TYR 203 N 0.83 0.55 0.10 3.17 -1.99 -1.93 -0.53 116.97 117.18 2buc h TYR 203 Ca 0.16 -0.16 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 2buc h TYR 203 Cb 0.50 -0.12 0.00 0.00 2.00 0.00 0.00 36.73 39.12 2buc h TYR 203 CO 0.03 0.82 -0.05 1.49 -0.00 0.00 0.00 178.16 180.45 2buc h GLU 204 N 0.37 -0.13 -0.08 4.88 4.81 -1.03 0.22 114.58 123.62 2buc h GLU 204 Ca 0.03 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.21 2buc h GLU 204 Cb 0.92 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.33 2buc h GLU 204 CO 0.08 0.07 -0.19 1.49 -0.73 0.00 0.00 179.01 179.73 2buc h GLU 205 N -0.33 0.27 0.00 1.92 4.57 -1.31 -2.48 114.58 117.22 2buc h GLU 205 Ca -0.01 -0.18 -0.15 0.00 -1.18 0.00 0.00 59.36 57.83 2buc h GLU 205 Cb 0.27 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.86 2buc h GLU 205 CO 0.02 0.79 -1.84 0.39 -1.18 0.00 0.00 179.01 177.20 2buc n GLU 206 N -4.55 1.23 -0.02 1.92 -0.58 -0.21 -4.48 120.64 113.95 2buc n GLU 206 Ca -0.08 -0.06 -0.03 0.00 -0.42 0.00 0.00 57.16 56.58 2buc n GLU 206 Cb 0.41 -1.35 -0.01 0.00 -0.57 0.00 0.00 31.44 29.92 2buc n GLU 206 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2buc n VAL 207 N -2.31 0.58 0.14 2.62 0.31 -0.96 -4.76 118.33 113.95 2buc n VAL 207 Ca -0.15 0.30 0.02 0.00 -0.01 0.00 0.00 64.34 64.50 2buc n VAL 207 Cb 0.72 -1.66 0.08 0.00 -0.91 0.00 0.00 33.84 32.07 2buc n VAL 207 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2buc h PHE 208 N -0.28 0.00 -6.00 3.52 -1.00 -0.79 -3.47 116.94 108.92 2buc h PHE 208 Ca 0.00 0.00 -0.46 0.00 2.81 0.00 0.00 57.97 60.32 2buc h PHE 208 Cb 0.28 0.00 -0.07 0.00 3.61 0.00 0.00 35.95 39.77 2buc h PHE 208 CO -0.12 0.55 -0.70 0.45 -1.61 0.00 0.00 178.31 176.88 2buc n SER 209 N -3.32 -4.39 -3.50 2.17 2.88 -0.95 -4.95 113.62 101.57 2buc n SER 209 Ca 0.01 -0.67 -0.09 0.00 -1.33 0.00 0.00 58.87 56.79 2buc n SER 209 Cb 0.71 -3.55 -0.02 0.00 -0.75 0.00 0.00 64.21 60.61 2buc n SER 209 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2buc s ALA 210 N -3.18 -1.75 -0.03 -1.46 0.00 -1.11 -5.00 121.76 109.23 2buc s ALA 210 Ca 0.58 0.82 -0.05 0.00 0.00 0.00 0.00 51.96 53.31 2buc s ALA 210 Cb -0.30 0.55 -0.28 0.00 0.00 0.00 0.00 23.12 23.09 2buc s ALA 210 CO 0.72 -0.73 0.73 -0.92 0.00 0.00 0.00 175.76 175.56 2buc h TYR 211 N 2.00 0.51 -3.79 0.00 3.20 -1.87 -3.38 116.97 113.64 2buc h TYR 211 Ca -0.25 -0.38 -0.51 0.00 3.14 0.00 0.00 58.73 60.73 2buc h TYR 211 Cb 1.26 -0.02 0.04 0.00 1.54 0.00 0.00 36.73 39.55 2buc h TYR 211 CO 0.26 1.50 0.56 -1.54 -1.64 0.00 0.00 178.16 177.29 2buc s SER 212 N -7.03 7.03 -0.36 -2.11 1.04 -1.26 -0.18 113.70 110.82 2buc s SER 212 Ca -0.12 2.46 0.11 0.00 0.48 0.00 0.00 55.95 58.88 2buc s SER 212 Cb 0.06 -2.63 0.45 0.00 0.10 0.00 0.00 66.02 64.00 2buc s SER 212 CO 0.84 -0.34 1.07 0.00 0.98 0.00 0.00 173.24 175.79 2buc n ALA 213 N 1.18 4.26 -2.77 5.32 0.00 0.70 -4.69 120.51 124.52 2buc n ALA 213 Ca 0.00 -3.70 -0.22 0.00 0.00 0.00 0.00 53.44 49.52 2buc n ALA 213 Cb 0.43 -0.68 -0.15 0.00 0.00 0.00 0.00 19.45 19.05 2buc n ALA 213 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2buc s LEU 214 N -3.44 1.94 -0.29 0.00 1.43 -1.25 -1.75 118.68 115.33 2buc s LEU 214 Ca 0.39 -0.25 -0.02 0.00 -1.03 0.00 0.00 54.13 53.23 2buc s LEU 214 Cb 0.41 -0.71 0.12 0.00 0.03 0.00 0.00 46.19 46.05 2buc s LEU 214 CO -0.07 0.14 0.23 0.26 0.23 0.00 0.00 176.35 177.14 2buc s TRP 215 N -0.11 -0.16 0.37 0.29 0.51 0.11 -5.00 118.94 114.95 2buc s TRP 215 Ca 0.01 -0.43 -0.28 0.00 -2.12 0.00 0.00 56.10 53.28 2buc s TRP 215 Cb -0.07 -0.63 -0.10 0.00 -0.81 0.00 0.00 33.47 31.86 2buc s TRP 215 CO 0.00 -0.88 1.38 -1.58 -0.51 0.00 0.00 176.95 175.36 2buc s TRP 216 N 2.26 2.79 0.68 -1.98 0.52 -1.26 -1.20 118.94 120.74 2buc s TRP 216 Ca 0.09 1.31 -0.15 0.00 0.02 0.00 0.00 56.10 57.37 2buc s TRP 216 Cb -0.15 -3.83 0.01 0.00 -1.15 0.00 0.00 33.47 28.36 2buc s TRP 216 CO -0.34 -2.41 1.14 -1.54 0.02 0.00 0.00 176.95 173.83 2buc s SER 217 N -0.41 4.83 0.55 2.95 1.04 0.27 -4.92 113.70 118.02 2buc s SER 217 Ca 0.53 2.13 0.29 0.00 0.48 0.00 0.00 55.95 59.38 2buc s SER 217 Cb -0.42 -2.57 1.46 0.00 0.10 0.00 0.00 66.02 64.59 2buc s SER 217 CO 0.56 -1.82 1.93 -0.65 0.98 0.00 0.00 173.24 174.24 2buc h PRO 218 N -0.01 0.00 -0.25 4.02 0.11 -1.90 0.97 132.00 134.94 2buc h PRO 218 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2buc h PRO 218 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2buc h PRO 218 CO 0.53 0.00 0.00 -1.71 -0.21 0.00 0.00 178.00 176.61 2buc n ASN 219 N -4.15 3.11 0.00 -2.05 2.85 -1.26 -4.25 115.26 109.52 2buc n ASN 219 Ca 0.13 -2.44 0.00 0.00 -0.11 0.00 0.00 54.58 52.16 2buc n ASN 219 Cb 0.77 -0.33 0.00 0.00 1.24 0.00 0.00 39.78 41.46 2buc n ASN 219 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2buc n GLY 220 N -0.12 0.49 0.10 8.20 0.00 0.33 -4.84 105.19 109.35 2buc n GLY 220 Ca 0.14 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.04 2buc n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2buc h THR 221 N 0.00 1.27 -3.58 2.61 2.02 -1.95 -3.45 112.91 109.84 2buc h THR 221 Ca 0.00 -0.89 -0.68 0.00 0.77 0.00 0.00 66.41 65.61 2buc h THR 221 Cb 0.14 1.66 -0.17 0.00 -1.74 0.00 0.00 68.15 68.04 2buc h THR 221 CO 0.00 0.25 -0.69 -0.36 0.37 0.00 0.00 175.52 175.09 2buc s PHE 222 N -4.84 2.93 -0.25 3.16 0.08 -1.26 -1.35 117.98 116.46 2buc s PHE 222 Ca -0.14 0.00 -0.00 0.00 0.12 0.00 0.00 56.93 56.90 2buc s PHE 222 Cb 0.05 -1.65 0.03 0.00 -0.57 0.00 0.00 43.02 40.88 2buc s PHE 222 CO 0.71 0.38 -0.08 -1.17 -0.10 0.00 0.00 175.22 174.95 2buc s LEU 223 N -1.25 3.16 -0.07 -0.37 2.96 0.41 -0.57 118.68 122.96 2buc s LEU 223 Ca 0.16 -0.97 -0.09 0.00 -0.22 0.00 0.00 54.13 53.01 2buc s LEU 223 Cb -0.11 -1.62 -0.05 0.00 0.50 0.00 0.00 46.19 44.91 2buc s LEU 223 CO 0.06 -0.13 0.23 0.00 -1.32 0.00 0.00 176.35 175.19 2buc s ALA 224 N 1.27 3.83 0.08 5.97 0.00 -0.34 -0.26 121.76 132.31 2buc s ALA 224 Ca -0.01 -0.52 -0.08 0.00 0.00 0.00 0.00 51.96 51.34 2buc s ALA 224 Cb -0.17 -2.09 -0.00 0.00 0.00 0.00 0.00 23.12 20.85 2buc s ALA 224 CO -0.05 0.59 0.18 1.52 0.00 0.00 0.00 175.76 177.99 2buc s TYR 225 N -1.09 0.17 -0.02 0.00 1.13 -0.36 0.05 117.35 117.22 2buc s TYR 225 Ca 0.20 -0.60 0.01 0.00 -1.41 0.00 0.00 57.07 55.26 2buc s TYR 225 Cb -0.13 -0.08 -0.03 0.00 -1.10 0.00 0.00 41.96 40.61 2buc s TYR 225 CO 0.09 -0.53 -0.01 0.00 -2.51 0.00 0.00 175.55 172.59 2buc s ALA 226 N -3.81 3.24 -0.12 9.51 0.00 -0.72 -1.03 121.76 128.82 2buc s ALA 226 Ca 0.05 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 51.08 2buc s ALA 226 Cb 0.05 -1.33 -0.01 0.00 0.00 0.00 0.00 23.12 21.82 2buc s ALA 226 CO -0.11 0.63 -0.14 -1.14 0.00 0.00 0.00 175.76 175.00 2buc s GLN 227 N -1.38 3.33 -0.18 0.00 0.74 0.12 -1.63 119.66 120.65 2buc s GLN 227 Ca 0.18 -0.71 -0.01 0.00 0.05 0.00 0.00 55.36 54.87 2buc s GLN 227 Cb -0.11 -2.59 -0.00 0.00 1.10 0.00 0.00 33.01 31.40 2buc s GLN 227 CO 0.08 0.22 -0.12 -0.06 -0.55 0.00 0.00 175.29 174.87 2buc s PHE 228 N 0.32 2.85 -0.31 1.67 0.08 0.57 -0.93 117.98 122.23 2buc s PHE 228 Ca -0.11 -1.03 -0.09 0.00 0.12 0.00 0.00 56.93 55.81 2buc s PHE 228 Cb -0.16 -1.97 -0.01 0.00 -0.57 0.00 0.00 43.02 40.32 2buc s PHE 228 CO 0.06 -0.51 0.15 1.21 -0.10 0.00 0.00 175.22 176.02 2buc s ASN 229 N 1.06 5.51 -0.18 1.36 3.84 -0.48 -0.42 114.94 125.62 2buc s ASN 229 Ca -0.00 -0.52 0.16 0.00 0.21 0.00 0.00 52.86 52.71 2buc s ASN 229 Cb -0.15 -1.99 0.57 0.00 -0.55 0.00 0.00 41.25 39.13 2buc s ASN 229 CO -0.03 -0.19 1.47 0.47 -2.79 0.00 0.00 177.10 176.03 2buc n ASP 230 N 4.97 4.14 -0.25 -4.21 9.92 0.16 -2.00 116.55 129.29 2buc n ASP 230 Ca -0.14 -2.98 0.06 0.00 -0.53 0.00 0.00 54.79 51.20 2buc n ASP 230 Cb 0.49 -0.56 0.19 0.00 -0.64 0.00 0.00 41.12 40.60 2buc n ASP 230 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 2buc h THR 231 N 2.15 0.51 -0.23 -3.53 2.02 -1.85 -1.95 112.91 110.03 2buc h THR 231 Ca 0.00 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.09 2buc h THR 231 Cb 1.51 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 2buc h THR 231 CO 0.26 0.05 0.00 -0.62 0.37 0.00 0.00 175.52 175.58 2buc n GLU 232 N -5.15 2.34 -2.51 6.66 1.02 -1.26 -4.89 120.64 116.85 2buc n GLU 232 Ca 0.14 -2.09 -0.43 0.00 -0.02 0.00 0.00 57.16 54.77 2buc n GLU 232 Cb 0.47 -1.47 -0.02 0.00 -0.02 0.00 0.00 31.44 30.40 2buc n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2buc s VAL 233 N -1.64 4.42 0.78 2.62 1.01 -0.73 -4.66 120.40 122.20 2buc s VAL 233 Ca 0.33 1.72 -0.14 0.00 0.00 0.00 0.00 61.98 63.88 2buc s VAL 233 Cb 0.21 -4.11 0.07 0.00 0.00 0.00 0.00 36.38 32.55 2buc s VAL 233 CO 0.30 -0.15 1.22 -2.84 0.00 0.00 0.00 175.10 173.62 2buc s PRO 234 N 3.38 1.78 -0.18 2.72 0.02 -1.26 -4.66 135.00 136.79 2buc s PRO 234 Ca 0.51 1.80 -0.09 0.00 0.02 0.00 0.00 61.00 63.24 2buc s PRO 234 Cb -0.19 -1.79 -0.05 0.00 0.02 0.00 0.00 34.50 32.49 2buc s PRO 234 CO 0.12 -2.12 0.12 -0.51 -0.33 0.00 0.00 177.00 174.28 2buc s LEU 235 N -5.51 4.16 0.04 -5.54 1.43 -1.26 -2.01 118.68 109.99 2buc s LEU 235 Ca 0.74 0.24 -0.30 0.00 -1.03 0.00 0.00 54.13 53.78 2buc s LEU 235 Cb -0.30 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.82 2buc s LEU 235 CO 0.49 0.22 0.97 -0.51 0.23 0.00 0.00 176.35 177.75 2buc s ILE 236 N 0.14 4.73 -0.05 -0.59 1.10 -0.04 -4.92 121.20 121.57 2buc s ILE 236 Ca 0.08 2.06 0.05 0.00 -0.51 0.00 0.00 60.65 62.34 2buc s ILE 236 Cb -0.11 -4.32 -0.01 0.00 0.15 0.00 0.00 42.46 38.17 2buc s ILE 236 CO -0.01 0.22 -0.22 -1.61 -2.11 0.00 0.00 174.94 171.21 2buc s GLU 237 N 0.62 2.23 0.05 3.50 2.02 -1.26 -1.88 118.70 123.98 2buc s GLU 237 Ca 0.50 -0.78 -0.17 0.00 0.02 0.00 0.00 54.97 54.53 2buc s GLU 237 Cb -0.22 -1.91 0.03 0.00 0.10 0.00 0.00 34.13 32.14 2buc s GLU 237 CO 0.29 0.33 0.40 1.52 0.02 0.00 0.00 175.26 177.81 2buc s TYR 238 N -0.08 -0.24 0.21 1.61 1.13 -1.02 -5.00 117.35 113.96 2buc s TYR 238 Ca -0.04 0.16 -0.30 0.00 -1.41 0.00 0.00 57.07 55.49 2buc s TYR 238 Cb -0.13 0.21 -0.08 0.00 -1.10 0.00 0.00 41.96 40.86 2buc s TYR 238 CO 0.03 -0.57 1.04 -1.12 -2.51 0.00 0.00 175.55 172.42 2buc s SER 239 N -2.08 7.39 -0.17 -0.18 0.01 -1.26 -0.73 113.70 116.68 2buc s SER 239 Ca -0.04 2.06 0.01 0.00 1.31 0.00 0.00 55.95 59.28 2buc s SER 239 Cb -0.01 -2.61 0.02 0.00 0.21 0.00 0.00 66.02 63.63 2buc s SER 239 CO -0.03 -0.09 -0.19 0.12 0.41 0.00 0.00 173.24 173.46 2buc s PHE 240 N -0.66 2.60 -0.04 2.43 5.36 0.64 -4.64 117.98 123.67 2buc s PHE 240 Ca 0.46 -1.50 0.13 0.00 -0.96 0.00 0.00 56.93 55.06 2buc s PHE 240 Cb -0.28 -1.82 -0.15 0.00 -0.34 0.00 0.00 43.02 40.42 2buc s PHE 240 CO 0.35 -0.75 0.98 1.88 -1.46 0.00 0.00 175.22 176.22 2buc h TYR 241 N 7.88 0.00 -1.42 10.12 -1.99 -1.96 -1.96 116.97 127.65 2buc h TYR 241 Ca -0.42 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.31 2buc h TYR 241 Cb 1.15 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.88 2buc h TYR 241 CO 0.47 0.81 0.00 0.45 -0.00 0.00 0.00 178.16 179.89 2buc n SER 242 N -3.10 -4.27 -4.65 3.88 2.88 -1.26 -4.77 113.62 102.32 2buc n SER 242 Ca -0.08 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.10 2buc n SER 242 Cb 0.92 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 64.45 2buc n SER 242 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2buc n ASP 243 N -3.02 1.04 -0.18 -3.46 -0.08 -1.26 -4.89 116.55 104.70 2buc n ASP 243 Ca 0.00 0.73 0.22 0.00 -1.51 0.00 0.00 54.79 54.23 2buc n ASP 243 Cb 0.00 -1.45 0.60 0.00 2.34 0.00 0.00 41.12 42.61 2buc n ASP 243 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2buc h GLU 244 N 0.06 0.22 0.00 -0.67 5.08 -2.05 -0.82 114.58 116.40 2buc h GLU 244 Ca -0.49 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 57.86 2buc h GLU 244 Cb 1.34 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.54 2buc h GLU 244 CO 0.49 0.15 -0.03 0.66 -1.00 0.00 0.00 179.01 179.28 2buc h SER 245 N 0.23 0.00 -2.64 1.42 4.64 -1.95 -3.41 113.55 111.84 2buc h SER 245 Ca 0.41 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 61.18 2buc h SER 245 Cb 1.27 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.32 2buc h SER 245 CO -0.09 0.03 1.24 -0.22 -0.87 0.00 0.00 176.83 176.91 2buc s LEU 246 N -6.83 3.46 0.12 5.97 0.20 -0.31 -4.89 118.68 116.40 2buc s LEU 246 Ca -0.04 0.88 -0.14 0.00 0.69 0.00 0.00 54.13 55.52 2buc s LEU 246 Cb 0.13 -3.23 -0.03 0.00 -0.43 0.00 0.00 46.19 42.63 2buc s LEU 246 CO 0.50 -1.82 1.53 -0.61 -0.29 0.00 0.00 176.35 175.66 2buc h GLN 247 N 12.78 0.75 -5.42 1.98 4.15 -1.88 -3.42 115.11 124.05 2buc h GLN 247 Ca -0.30 -0.29 -0.66 0.00 0.77 0.00 0.00 58.65 58.18 2buc h GLN 247 Cb 1.15 -0.04 -0.25 0.00 0.21 0.00 0.00 27.48 28.54 2buc h GLN 247 CO 1.10 0.89 -0.75 0.71 -1.93 0.00 0.00 178.83 178.85 2buc s TYR 248 N -4.80 2.84 0.47 3.99 1.51 -1.26 -5.11 117.35 115.00 2buc s TYR 248 Ca -0.13 -0.53 -0.22 0.00 -1.01 0.00 0.00 57.07 55.19 2buc s TYR 248 Cb 0.10 -1.84 -0.07 0.00 -0.11 0.00 0.00 41.96 40.04 2buc s TYR 248 CO 0.81 -0.13 1.14 -2.14 -1.11 0.00 0.00 175.55 174.12 2buc s PRO 249 N 0.23 3.70 0.06 -1.71 0.02 -1.26 -5.04 135.00 131.00 2buc s PRO 249 Ca -0.07 1.70 -0.02 0.00 0.02 0.00 0.00 61.00 62.63 2buc s PRO 249 Cb -0.15 -2.32 -0.04 0.00 0.02 0.00 0.00 34.50 32.01 2buc s PRO 249 CO 0.05 -0.58 0.24 -1.59 -0.33 0.00 0.00 177.00 174.79 2buc s LYS 250 N -2.83 3.49 -0.29 5.54 -2.85 -0.74 -4.92 119.74 117.13 2buc s LYS 250 Ca 0.65 -0.32 -0.16 0.00 -1.00 0.00 0.00 55.97 55.14 2buc s LYS 250 Cb -0.27 -3.02 -0.02 0.00 -2.06 0.00 0.00 37.83 32.46 2buc s LYS 250 CO 0.32 0.60 0.42 0.99 0.10 0.00 0.00 175.35 177.78 2buc s THR 251 N -1.49 5.12 0.05 3.79 2.01 -1.26 -0.26 115.64 123.60 2buc s THR 251 Ca 0.34 0.50 -0.28 0.00 0.31 0.00 0.00 61.69 62.56 2buc s THR 251 Cb -0.13 -3.79 -0.05 0.00 0.01 0.00 0.00 72.50 68.54 2buc s THR 251 CO 0.25 0.03 0.89 -0.69 -0.69 0.00 0.00 174.62 174.41 2buc s VAL 252 N 2.17 4.69 -0.19 3.82 1.01 0.09 -4.92 120.40 127.08 2buc s VAL 252 Ca 0.16 1.90 0.01 0.00 0.00 0.00 0.00 61.98 64.05 2buc s VAL 252 Cb -0.16 -4.25 0.04 0.00 0.00 0.00 0.00 36.38 32.01 2buc s VAL 252 CO 0.11 0.29 -0.12 -0.13 0.00 0.00 0.00 175.10 175.24 2buc s ARG 253 N 0.29 2.19 -0.10 2.72 0.52 -1.26 -2.42 118.95 120.88 2buc s ARG 253 Ca 0.45 -0.78 0.03 0.00 -0.52 0.00 0.00 55.73 54.92 2buc s ARG 253 Cb -0.22 -2.36 0.01 0.00 0.52 0.00 0.00 34.95 32.90 2buc s ARG 253 CO 0.27 -0.36 -0.20 0.42 0.02 0.00 0.00 175.30 175.44 2buc s ILE 254 N 1.40 1.81 -0.32 1.52 1.01 -0.79 -4.99 121.20 120.85 2buc s ILE 254 Ca 0.01 -0.86 -0.28 0.00 0.00 0.00 0.00 60.65 59.52 2buc s ILE 254 Cb -0.15 -1.59 -0.04 0.00 0.01 0.00 0.00 42.46 40.69 2buc s ILE 254 CO -0.09 0.50 2.05 -2.84 0.00 0.00 0.00 174.94 174.56 2buc s PRO 255 N 0.54 3.07 -0.16 2.79 0.02 -1.26 -0.86 135.00 139.14 2buc s PRO 255 Ca -0.15 1.63 -0.04 0.00 0.02 0.00 0.00 61.00 62.47 2buc s PRO 255 Cb -0.17 -4.33 0.05 0.00 0.02 0.00 0.00 34.50 30.08 2buc s PRO 255 CO 0.05 -2.17 0.06 -0.47 -0.33 0.00 0.00 177.00 174.14 2buc s TYR 256 N 8.21 0.49 -0.32 6.54 6.14 -0.85 -4.49 117.35 133.06 2buc s TYR 256 Ca 0.90 -0.42 -0.28 0.00 0.64 0.00 0.00 57.07 57.90 2buc s TYR 256 Cb -0.26 -0.79 0.01 0.00 0.42 0.00 0.00 41.96 41.35 2buc s TYR 256 CO 0.33 -0.50 1.03 -1.25 0.64 0.00 0.00 175.55 175.79 2buc s PRO 257 N 2.04 4.03 0.63 4.97 0.04 -1.26 -4.55 135.00 140.90 2buc s PRO 257 Ca 0.02 0.96 -0.05 0.00 0.04 0.00 0.00 61.00 61.97 2buc s PRO 257 Cb -0.16 -3.74 0.03 0.00 0.04 0.00 0.00 34.50 30.68 2buc s PRO 257 CO -0.08 -0.88 0.92 0.15 0.04 0.00 0.00 177.00 177.15 2buc s LYS 258 N 3.55 2.55 -0.16 4.56 1.02 -1.26 -0.47 119.74 129.54 2buc s LYS 258 Ca 0.43 -0.26 -0.40 0.00 0.02 0.00 0.00 55.97 55.76 2buc s LYS 258 Cb -0.12 -2.28 -0.18 0.00 -0.52 0.00 0.00 37.83 34.74 2buc s LYS 258 CO 0.15 -0.91 1.47 0.00 -0.92 0.00 0.00 175.35 175.14 2buc n ALA 259 N -2.67 -1.27 -0.44 5.17 0.00 -0.16 -0.73 120.51 120.42 2buc n ALA 259 Ca 0.06 0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.99 2buc n ALA 259 Cb 0.59 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 18.00 2buc n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2buc n GLY 260 N 3.16 1.94 3.82 0.00 0.00 -1.26 -4.87 105.19 107.99 2buc n GLY 260 Ca 0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 2buc n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2buc s ALA 261 N -3.37 1.98 0.12 4.61 0.00 0.09 -4.98 121.76 120.22 2buc s ALA 261 Ca 0.00 -0.69 -0.31 0.00 0.00 0.00 0.00 51.96 50.96 2buc s ALA 261 Cb 0.00 -2.96 -0.10 0.00 0.00 0.00 0.00 23.12 20.06 2buc s ALA 261 CO 0.00 -2.25 1.67 -2.00 0.00 0.00 0.00 175.76 173.18 2buc s GLU 262 N -5.46 4.18 0.36 0.00 2.56 -1.26 -4.91 118.70 114.17 2buc s GLU 262 Ca 0.65 2.42 0.02 0.00 0.00 0.00 0.00 54.97 58.06 2buc s GLU 262 Cb -0.12 -3.43 -0.02 0.00 2.00 0.00 0.00 34.13 32.56 2buc s GLU 262 CO 0.52 -0.72 0.54 -0.80 -0.56 0.00 0.00 175.26 174.24 2buc s ASN 263 N 2.01 6.15 0.33 -1.70 0.01 -1.26 -4.34 114.94 116.13 2buc s ASN 263 Ca 0.74 0.29 -0.29 0.00 -0.71 0.00 0.00 52.86 52.89 2buc s ASN 263 Cb -0.43 -1.79 -0.10 0.00 0.41 0.00 0.00 41.25 39.33 2buc s ASN 263 CO 0.33 -0.38 1.29 -2.16 -1.51 0.00 0.00 177.10 174.67 2buc s PRO 264 N -4.31 4.36 0.42 -0.60 0.04 -1.26 -4.72 135.00 128.93 2buc s PRO 264 Ca 0.42 2.18 -0.01 0.00 0.04 0.00 0.00 61.00 63.63 2buc s PRO 264 Cb -0.10 -3.07 -0.02 0.00 0.04 0.00 0.00 34.50 31.36 2buc s PRO 264 CO 0.35 -0.17 0.66 0.95 0.04 0.00 0.00 177.00 178.83 2buc s THR 265 N -1.15 4.67 0.04 1.26 -4.23 -0.85 -4.92 115.64 110.47 2buc s THR 265 Ca 0.49 -0.28 0.04 0.00 -1.18 0.00 0.00 61.69 60.75 2buc s THR 265 Cb -0.39 -3.74 -0.02 0.00 1.34 0.00 0.00 72.50 69.69 2buc s THR 265 CO 0.52 -0.56 -0.11 0.54 -0.54 0.00 0.00 174.62 174.47 2buc s VAL 266 N -2.53 0.82 -0.03 2.29 0.11 -1.26 -1.39 120.40 118.41 2buc s VAL 266 Ca 0.45 -0.95 0.03 0.00 -2.93 0.00 0.00 61.98 58.58 2buc s VAL 266 Cb -0.10 -0.78 -0.00 0.00 -1.53 0.00 0.00 36.38 33.97 2buc s VAL 266 CO 0.39 -0.14 -0.12 -0.54 -3.33 0.00 0.00 175.10 171.36 2buc s LYS 267 N -1.21 1.28 -0.16 1.54 1.02 -0.11 -4.97 119.74 117.13 2buc s LYS 267 Ca -0.03 -0.43 -0.04 0.00 0.02 0.00 0.00 55.97 55.49 2buc s LYS 267 Cb -0.08 -1.16 -0.03 0.00 -0.52 0.00 0.00 37.83 36.05 2buc s LYS 267 CO 0.01 0.18 -0.03 0.12 -0.92 0.00 0.00 175.35 174.71 2buc s PHE 268 N 0.09 3.04 0.05 3.18 5.36 -1.26 0.13 117.98 128.57 2buc s PHE 268 Ca -0.03 -0.29 0.08 0.00 -0.96 0.00 0.00 56.93 55.74 2buc s PHE 268 Cb -0.09 -1.98 -0.03 0.00 -0.34 0.00 0.00 43.02 40.58 2buc s PHE 268 CO 0.01 -0.04 -0.22 -0.06 -1.46 0.00 0.00 175.22 173.45 2buc s PHE 269 N 0.41 1.91 -0.21 10.12 0.40 -0.20 -1.65 117.98 128.76 2buc s PHE 269 Ca -0.03 -0.38 -0.01 0.00 -0.60 0.00 0.00 56.93 55.90 2buc s PHE 269 Cb -0.14 -1.13 0.01 0.00 0.51 0.00 0.00 43.02 42.27 2buc s PHE 269 CO 0.03 0.11 -0.11 0.08 0.70 0.00 0.00 175.22 176.03 2buc s VAL 270 N -0.84 2.75 -0.26 -0.44 1.01 -0.24 -1.22 120.40 121.15 2buc s VAL 270 Ca 0.08 -0.80 -0.11 0.00 0.00 0.00 0.00 61.98 61.15 2buc s VAL 270 Cb -0.09 -2.26 -0.05 0.00 0.00 0.00 0.00 36.38 33.98 2buc s VAL 270 CO 0.02 0.41 0.18 -0.69 0.00 0.00 0.00 175.10 175.02 2buc s VAL 271 N 1.37 5.33 -0.51 2.92 1.01 0.64 -1.31 120.40 129.84 2buc s VAL 271 Ca 0.04 0.19 -0.28 0.00 0.00 0.00 0.00 61.98 61.93 2buc s VAL 271 Cb -0.14 -3.52 0.02 0.00 0.00 0.00 0.00 36.38 32.73 2buc s VAL 271 CO -0.07 0.29 1.33 -0.62 0.00 0.00 0.00 175.10 176.03 2buc s ASP 272 N 1.42 6.31 0.09 3.32 3.68 0.08 -0.44 116.67 131.13 2buc s ASP 272 Ca 0.08 0.42 0.26 0.00 2.13 0.00 0.00 52.55 55.43 2buc s ASP 272 Cb -0.15 -2.55 1.01 0.00 -1.45 0.00 0.00 42.92 39.78 2buc s ASP 272 CO 0.08 -1.53 1.81 0.35 0.13 0.00 0.00 175.17 176.01 2buc n THR 273 N 6.89 0.38 0.05 1.71 -2.24 -0.46 -3.58 114.28 117.02 2buc n THR 273 Ca 0.13 -0.05 0.01 0.00 -2.27 0.00 0.00 64.05 61.87 2buc n THR 273 Cb 0.49 -0.64 0.35 0.00 -2.10 0.00 0.00 70.33 68.43 2buc n THR 273 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2buc h ARG 274 N 0.00 0.41 -0.25 -0.78 3.08 -1.91 -2.72 114.38 112.20 2buc h ARG 274 Ca 0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2buc h ARG 274 Cb 0.54 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.53 2buc h ARG 274 CO 0.00 0.45 0.00 0.25 -1.07 0.00 0.00 179.97 179.60 2buc n THR 275 N -4.30 0.33 -2.14 2.04 -2.24 -1.24 -4.92 114.28 101.81 2buc n THR 275 Ca 0.01 -0.43 -0.42 0.00 -2.27 0.00 0.00 64.05 60.93 2buc n THR 275 Cb 0.23 0.38 -0.03 0.00 -2.10 0.00 0.00 70.33 68.82 2buc n THR 275 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2buc s LEU 276 N -1.38 4.30 -0.19 3.22 1.43 -1.03 -4.82 118.68 120.21 2buc s LEU 276 Ca 0.31 2.12 -0.23 0.00 -1.03 0.00 0.00 54.13 55.30 2buc s LEU 276 Cb 0.17 -3.54 0.06 0.00 0.03 0.00 0.00 46.19 42.90 2buc s LEU 276 CO 0.24 -0.83 0.62 -0.55 0.23 0.00 0.00 176.35 176.05 2buc s SER 277 N 2.58 -0.63 0.42 2.29 0.15 -1.26 -5.04 113.70 112.22 2buc s SER 277 Ca 0.67 1.10 0.21 0.00 0.70 0.00 0.00 55.95 58.63 2buc s SER 277 Cb -0.31 1.09 1.18 0.00 -1.71 0.00 0.00 66.02 66.28 2buc s SER 277 CO 0.26 -0.30 1.78 1.55 1.20 0.00 0.00 173.24 177.73 2buc h PRO 278 N 4.71 0.31 -0.44 5.44 0.13 -1.98 -1.05 132.00 139.12 2buc h PRO 278 Ca -0.28 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2buc h PRO 278 Cb 1.16 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2buc h PRO 278 CO 0.18 0.21 0.00 0.09 -0.23 0.00 0.00 178.00 178.24 2buc n ASN 279 N -4.55 4.75 -4.37 1.44 3.02 -1.26 -4.97 115.26 109.32 2buc n ASN 279 Ca 0.25 -2.88 -0.26 0.00 -0.03 0.00 0.00 54.58 51.66 2buc n ASN 279 Cb 0.93 -0.60 -0.12 0.00 -0.61 0.00 0.00 39.78 39.38 2buc n ASN 279 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2buc s ALA 280 N -2.62 2.23 0.70 5.41 0.00 -0.40 -5.14 121.76 121.94 2buc s ALA 280 Ca 0.48 -1.47 -0.11 0.00 0.00 0.00 0.00 51.96 50.86 2buc s ALA 280 Cb 0.36 -0.30 0.01 0.00 0.00 0.00 0.00 23.12 23.19 2buc s ALA 280 CO 0.14 0.42 1.06 -1.54 0.00 0.00 0.00 175.76 175.84 2buc s SER 281 N -2.30 5.31 -0.06 0.00 1.04 -1.26 -4.57 113.70 111.87 2buc s SER 281 Ca 0.14 1.66 -0.30 0.00 0.48 0.00 0.00 55.95 57.93 2buc s SER 281 Cb -0.09 -2.50 -0.03 0.00 0.10 0.00 0.00 66.02 63.50 2buc s SER 281 CO 0.07 -1.49 1.21 -0.69 0.98 0.00 0.00 173.24 173.32 2buc s VAL 282 N -2.98 4.22 -0.34 5.02 1.01 -1.26 -4.81 120.40 121.26 2buc s VAL 282 Ca 0.59 1.55 -0.22 0.00 0.00 0.00 0.00 61.98 63.89 2buc s VAL 282 Cb -0.15 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.24 2buc s VAL 282 CO 0.54 -0.01 0.73 -0.89 0.00 0.00 0.00 175.10 175.47 2buc s THR 283 N 2.27 4.81 -0.02 3.92 2.01 -1.26 -5.04 115.64 122.33 2buc s THR 283 Ca 0.56 0.88 -0.18 0.00 0.31 0.00 0.00 61.69 63.27 2buc s THR 283 Cb -0.25 -4.14 0.03 0.00 0.01 0.00 0.00 72.50 68.15 2buc s THR 283 CO 0.22 -0.33 0.38 -0.94 -0.69 0.00 0.00 174.62 173.25 2buc s SER 284 N 1.76 -0.28 -0.08 3.53 1.04 -1.26 -0.74 113.70 117.66 2buc s SER 284 Ca 0.29 0.20 0.04 0.00 0.48 0.00 0.00 55.95 56.96 2buc s SER 284 Cb -0.14 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.34 2buc s SER 284 CO 0.15 -0.47 -0.20 -0.47 0.98 0.00 0.00 173.24 173.23 2buc s TYR 285 N -1.29 2.13 -0.29 5.02 5.04 -0.43 -4.95 117.35 122.58 2buc s TYR 285 Ca -0.13 -0.81 -0.21 0.00 -2.44 0.00 0.00 57.07 53.48 2buc s TYR 285 Cb -0.04 -1.45 -0.01 0.00 0.35 0.00 0.00 41.96 40.81 2buc s TYR 285 CO 0.05 -0.34 0.65 -1.14 -1.34 0.00 0.00 175.55 173.44 2buc s GLN 286 N 0.37 3.96 -0.26 4.97 0.74 -1.26 -1.08 119.66 127.09 2buc s GLN 286 Ca -0.15 0.39 -0.19 0.00 0.05 0.00 0.00 55.36 55.46 2buc s GLN 286 Cb -0.16 -3.71 -0.02 0.00 1.10 0.00 0.00 33.01 30.21 2buc s GLN 286 CO 0.06 -0.55 0.56 0.42 -0.55 0.00 0.00 175.29 175.24 2buc s ILE 287 N 2.63 5.03 0.25 -2.34 1.01 -0.66 -5.01 121.20 122.11 2buc s ILE 287 Ca 0.26 0.99 -0.01 0.00 0.00 0.00 0.00 60.65 61.90 2buc s ILE 287 Cb -0.15 -3.87 -0.04 0.00 0.01 0.00 0.00 42.46 38.41 2buc s ILE 287 CO 0.11 0.06 0.45 0.68 0.00 0.00 0.00 174.94 176.24 2buc s VAL 288 N 2.38 5.16 0.73 2.92 -7.23 -1.26 -4.14 120.40 118.96 2buc s VAL 288 Ca 0.23 -0.38 -0.13 0.00 -1.81 0.00 0.00 61.98 59.90 2buc s VAL 288 Cb -0.16 -3.77 0.03 0.00 0.56 0.00 0.00 36.38 33.05 2buc s VAL 288 CO 0.09 -0.29 1.10 -2.16 -0.31 0.00 0.00 175.10 173.53 2buc s PRO 289 N -3.63 2.46 0.74 4.82 0.04 -1.26 -5.00 135.00 133.17 2buc s PRO 289 Ca 0.39 1.29 -0.16 0.00 0.04 0.00 0.00 61.00 62.57 2buc s PRO 289 Cb -0.10 -1.91 -0.00 0.00 0.04 0.00 0.00 34.50 32.52 2buc s PRO 289 CO 0.31 -1.50 0.77 -2.30 0.04 0.00 0.00 177.00 174.31 2buc n PRO 290 N -3.04 0.33 -0.17 0.56 -0.02 -1.26 -4.55 135.00 126.86 2buc n PRO 290 Ca 0.10 0.16 0.19 0.00 -2.02 0.00 0.00 63.50 61.93 2buc n PRO 290 Cb 0.52 -2.05 0.56 0.00 -0.02 0.00 0.00 33.50 32.52 2buc n PRO 290 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2buc h ALA 291 N -0.45 2.30 0.00 3.55 0.00 -1.97 -0.68 119.26 122.01 2buc h ALA 291 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2buc h ALA 291 Cb 1.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2buc h ALA 291 CO 0.44 -0.53 0.00 0.66 0.00 0.00 0.00 179.25 179.82 2buc h SER 292 N 0.29 0.00 0.00 0.00 4.64 -2.02 -2.82 113.55 113.64 2buc h SER 292 Ca 0.39 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.45 2buc h SER 292 Cb 1.10 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.14 2buc h SER 292 CO -0.11 0.00 -1.99 0.52 -0.87 0.00 0.00 176.83 174.38 2buc n VAL 293 N -2.87 1.00 0.31 0.95 0.31 -0.35 -4.56 118.33 113.12 2buc n VAL 293 Ca -0.01 -0.50 0.20 0.00 -0.01 0.00 0.00 64.34 64.03 2buc n VAL 293 Cb 0.19 -0.88 1.01 0.00 -0.91 0.00 0.00 33.84 33.24 2buc n VAL 293 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2buc h LEU 294 N 0.00 0.00 0.00 7.52 6.46 -1.16 -3.12 115.31 125.01 2buc h LEU 294 Ca -0.39 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.37 2buc h LEU 294 Cb 1.75 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.68 2buc h LEU 294 CO -0.02 0.00 0.00 2.30 -0.62 0.00 0.00 178.44 180.10 2buc n ILE 295 N -3.03 0.80 -2.94 4.05 -5.35 -1.08 -4.83 119.36 106.98 2buc n ILE 295 Ca -0.02 0.20 0.00 0.00 -0.27 0.00 0.00 62.75 62.66 2buc n ILE 295 Cb 0.15 -1.04 0.00 0.00 -1.74 0.00 0.00 39.64 37.01 2buc n ILE 295 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2buc n GLY 296 N -0.47 1.67 3.75 3.28 0.00 -1.18 -5.14 105.19 107.10 2buc n GLY 296 Ca 0.04 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.84 2buc n GLY 296 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2buc s ASP 297 N 0.42 6.39 0.25 1.61 1.01 -1.26 -4.96 116.67 120.13 2buc s ASP 297 Ca 0.00 2.94 -0.09 0.00 0.71 0.00 0.00 52.55 56.11 2buc s ASP 297 Cb 0.00 -2.64 -0.01 0.00 1.01 0.00 0.00 42.92 41.28 2buc s ASP 297 CO 0.00 -0.89 0.41 -1.38 0.21 0.00 0.00 175.17 173.52 2buc s HIS 298 N -0.17 0.64 0.11 4.23 -3.43 -1.26 -1.60 115.29 113.80 2buc s HIS 298 Ca 0.61 -0.95 0.07 0.00 -0.80 0.00 0.00 55.06 53.99 2buc s HIS 298 Cb -0.47 -0.00 -0.03 0.00 -1.43 0.00 0.00 32.58 30.64 2buc s HIS 298 CO 0.50 -0.95 -0.17 0.71 -2.00 0.00 0.00 174.74 172.83 2buc s TYR 299 N -3.89 1.52 -0.34 0.38 2.02 0.04 -4.84 117.35 112.24 2buc s TYR 299 Ca 0.27 -0.47 -0.16 0.00 -0.37 0.00 0.00 57.07 56.34 2buc s TYR 299 Cb 0.01 -0.82 -0.01 0.00 -0.40 0.00 0.00 41.96 40.74 2buc s TYR 299 CO 0.11 0.16 0.41 -1.17 -1.57 0.00 0.00 175.55 173.49 2buc s LEU 300 N -2.11 4.41 0.00 -1.29 2.96 -1.26 -1.96 118.68 119.44 2buc s LEU 300 Ca 0.06 -0.17 0.04 0.00 -0.22 0.00 0.00 54.13 53.84 2buc s LEU 300 Cb -0.08 -2.41 0.01 0.00 0.50 0.00 0.00 46.19 44.21 2buc s LEU 300 CO 0.04 -0.38 0.52 0.00 -1.32 0.00 0.00 176.35 175.20 2buc s GLY 302 N -0.64 -0.21 -0.07 0.00 0.00 -0.92 -4.84 107.32 100.65 2buc s GLY 302 Ca 0.04 2.65 0.01 0.00 0.00 0.00 0.00 44.72 47.43 2buc s GLY 302 CO 0.08 1.97 -0.08 0.14 0.00 0.00 0.00 173.10 175.22 2buc s VAL 303 N 0.50 0.87 -0.06 1.40 1.01 -1.26 -0.03 120.40 122.83 2buc s VAL 303 Ca 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 61.69 2buc s VAL 303 Cb -0.05 -0.86 0.03 0.00 0.00 0.00 0.00 36.38 35.50 2buc s VAL 303 CO -0.07 0.31 0.01 -0.89 0.00 0.00 0.00 175.10 174.46 2buc s THR 304 N 1.12 0.26 -0.15 3.92 2.01 0.34 -5.01 115.64 118.13 2buc s THR 304 Ca -0.07 0.18 -0.29 0.00 0.31 0.00 0.00 61.69 61.82 2buc s THR 304 Cb -0.14 -0.43 -0.00 0.00 0.01 0.00 0.00 72.50 71.93 2buc s THR 304 CO -0.01 0.23 1.01 0.26 -0.69 0.00 0.00 174.62 175.42 2buc s TRP 305 N 1.92 3.45 -0.12 4.92 0.52 -1.26 0.22 118.94 128.59 2buc s TRP 305 Ca 0.04 1.54 -0.10 0.00 0.02 0.00 0.00 56.10 57.59 2buc s TRP 305 Cb -0.12 -3.21 -0.03 0.00 -1.15 0.00 0.00 33.47 28.95 2buc s TRP 305 CO -0.04 -0.32 -0.20 0.28 0.02 0.00 0.00 176.95 176.69 2buc n VAL 306 N 4.83 1.09 -3.49 4.03 0.31 -0.46 -4.95 118.33 119.69 2buc n VAL 306 Ca 0.10 0.26 0.00 0.00 -0.01 0.00 0.00 64.34 64.69 2buc n VAL 306 Cb 0.48 -2.15 0.00 0.00 -0.91 0.00 0.00 33.84 31.26 2buc n VAL 306 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2buc n THR 307 N -3.99 0.00 0.21 2.52 -2.24 -1.00 -4.85 114.28 104.92 2buc n THR 307 Ca -0.08 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.80 2buc n THR 307 Cb 0.30 0.00 0.33 0.00 -2.10 0.00 0.00 70.33 68.86 2buc n THR 307 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2buc h GLU 308 N 0.00 0.00 -0.04 -0.78 4.39 -1.98 -3.22 114.58 112.95 2buc h GLU 308 Ca 0.00 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 2buc h GLU 308 Cb 0.00 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2buc h GLU 308 CO 0.00 0.21 -0.07 0.39 -1.16 0.00 0.00 179.01 178.39 2buc n GLU 309 N -3.25 1.50 -3.68 2.33 1.02 -1.26 -4.92 120.64 112.38 2buc n GLU 309 Ca 0.01 -2.72 -0.14 0.00 -0.02 0.00 0.00 57.16 54.30 2buc n GLU 309 Cb 0.50 -1.56 -0.13 0.00 -0.02 0.00 0.00 31.44 30.23 2buc n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2buc s ARG 310 N -2.93 0.15 0.02 3.49 3.52 -1.22 -0.66 118.95 121.32 2buc s ARG 310 Ca 0.34 0.67 0.07 0.00 -0.13 0.00 0.00 55.73 56.69 2buc s ARG 310 Cb 0.30 -0.08 -0.02 0.00 -1.56 0.00 0.00 34.95 33.59 2buc s ARG 310 CO 0.02 -0.26 -0.21 -1.50 -0.81 0.00 0.00 175.30 172.55 2buc s ILE 311 N 2.12 1.67 -0.16 4.11 2.07 -0.34 -1.36 121.20 129.31 2buc s ILE 311 Ca -0.01 -1.06 -0.03 0.00 -1.41 0.00 0.00 60.65 58.14 2buc s ILE 311 Cb -0.12 -1.42 -0.02 0.00 0.13 0.00 0.00 42.46 41.03 2buc s ILE 311 CO -0.08 0.33 -0.06 -0.55 -1.91 0.00 0.00 174.94 172.67 2buc s SER 312 N -0.86 4.49 -0.08 4.50 0.15 0.13 -0.17 113.70 121.87 2buc s SER 312 Ca 0.08 -0.23 0.05 0.00 0.70 0.00 0.00 55.95 56.54 2buc s SER 312 Cb -0.08 -1.73 -0.01 0.00 -1.71 0.00 0.00 66.02 62.49 2buc s SER 312 CO 0.01 0.13 -0.24 -0.76 1.20 0.00 0.00 173.24 173.58 2buc s LEU 313 N 0.57 2.14 -0.28 3.45 1.43 -0.34 -0.50 118.68 125.15 2buc s LEU 313 Ca -0.04 -0.51 -0.05 0.00 -1.03 0.00 0.00 54.13 52.50 2buc s LEU 313 Cb -0.15 -1.41 0.02 0.00 0.03 0.00 0.00 46.19 44.68 2buc s LEU 313 CO 0.03 0.21 0.04 -1.58 0.23 0.00 0.00 176.35 175.28 2buc s GLN 314 N 0.02 2.96 0.05 1.70 0.74 0.96 -0.43 119.66 125.65 2buc s GLN 314 Ca -0.09 -0.93 0.05 0.00 0.05 0.00 0.00 55.36 54.45 2buc s GLN 314 Cb -0.15 -3.25 -0.04 0.00 1.10 0.00 0.00 33.01 30.67 2buc s GLN 314 CO 0.05 -0.45 -0.10 -1.58 -0.55 0.00 0.00 175.29 172.67 2buc s TRP 315 N 1.43 2.77 0.06 1.67 0.52 -0.54 -0.69 118.94 124.16 2buc s TRP 315 Ca 0.01 -0.12 0.05 0.00 0.02 0.00 0.00 56.10 56.06 2buc s TRP 315 Cb -0.17 -1.52 -0.03 0.00 -1.15 0.00 0.00 33.47 30.60 2buc s TRP 315 CO 0.00 0.37 -0.15 -1.50 0.02 0.00 0.00 176.95 175.69 2buc s ILE 316 N -1.06 1.21 0.72 2.03 2.07 -0.83 -0.85 121.20 124.50 2buc s ILE 316 Ca 0.18 -1.21 -0.11 0.00 -1.41 0.00 0.00 60.65 58.10 2buc s ILE 316 Cb -0.11 -1.12 0.03 0.00 0.13 0.00 0.00 42.46 41.38 2buc s ILE 316 CO 0.09 -0.10 1.08 -0.13 -1.91 0.00 0.00 174.94 173.97 2buc s ARG 317 N -1.50 2.65 0.25 3.50 0.52 -0.24 -0.78 118.95 123.36 2buc s ARG 317 Ca 0.01 1.10 -0.05 0.00 -0.52 0.00 0.00 55.73 56.27 2buc s ARG 317 Cb -0.09 -1.95 0.35 0.00 0.52 0.00 0.00 34.95 33.78 2buc s ARG 317 CO 0.02 -1.33 1.86 -0.09 0.02 0.00 0.00 175.30 175.78 2buc h ARG 318 N -0.76 1.00 0.00 3.54 2.43 -1.62 -1.08 114.38 117.88 2buc h ARG 318 Ca -0.44 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 58.66 2buc h ARG 318 Cb 1.22 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 30.55 2buc h ARG 318 CO 0.54 0.66 -0.04 0.00 -1.51 0.00 0.00 179.97 179.63 2buc h ALA 319 N 1.41 1.50 -0.67 2.80 0.00 -1.91 -3.44 119.26 118.96 2buc h ALA 319 Ca 0.39 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 55.07 2buc h ALA 319 Cb 0.16 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 2buc h ALA 319 CO -0.17 0.04 -0.19 1.04 0.00 0.00 0.00 179.25 179.97 2buc n GLN 320 N -3.85 -0.69 -0.05 0.00 6.02 -0.41 -4.62 117.38 113.79 2buc n GLN 320 Ca -0.03 0.75 0.05 0.00 -0.01 0.00 0.00 57.00 57.76 2buc n GLN 320 Cb 0.12 -4.68 0.07 0.00 1.02 0.00 0.00 30.24 26.77 2buc n GLN 320 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 2buc n ASN 321 N 0.39 2.12 -3.83 1.08 6.94 -1.26 -1.87 115.26 118.82 2buc n ASN 321 Ca -0.10 -1.58 -0.28 0.00 -0.02 0.00 0.00 54.58 52.59 2buc n ASN 321 Cb 0.38 -0.06 -0.16 0.00 -2.36 0.00 0.00 39.78 37.58 2buc n ASN 321 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 2buc s TYR 322 N -0.88 1.58 0.15 -2.53 6.14 -1.26 -2.04 117.35 118.52 2buc s TYR 322 Ca 0.14 -1.17 0.10 0.00 0.64 0.00 0.00 57.07 56.78 2buc s TYR 322 Cb 0.09 -1.25 -0.04 0.00 0.42 0.00 0.00 41.96 41.18 2buc s TYR 322 CO 0.13 -0.66 -0.22 0.45 0.64 0.00 0.00 175.55 175.89 2buc s SER 323 N 1.67 3.01 -0.11 4.32 0.15 -0.19 -1.07 113.70 121.47 2buc s SER 323 Ca -0.02 -0.80 -0.08 0.00 0.70 0.00 0.00 55.95 55.75 2buc s SER 323 Cb -0.17 -0.20 0.04 0.00 -1.71 0.00 0.00 66.02 63.98 2buc s SER 323 CO -0.07 0.08 0.28 -0.51 1.20 0.00 0.00 173.24 174.21 2buc s ILE 324 N -1.53 -0.02 -0.23 6.45 2.07 -0.03 -0.31 121.20 127.60 2buc s ILE 324 Ca 0.15 0.07 -0.12 0.00 -1.41 0.00 0.00 60.65 59.34 2buc s ILE 324 Cb -0.08 -0.41 -0.05 0.00 0.13 0.00 0.00 42.46 42.05 2buc s ILE 324 CO 0.07 0.03 0.22 -0.63 -1.91 0.00 0.00 174.94 172.72 2buc s ILE 325 N 0.74 5.32 -0.29 2.00 1.01 -0.19 -1.47 121.20 128.32 2buc s ILE 325 Ca -0.05 0.31 -0.03 0.00 0.00 0.00 0.00 60.65 60.88 2buc s ILE 325 Cb -0.06 -3.56 0.04 0.00 0.01 0.00 0.00 42.46 38.89 2buc s ILE 325 CO -0.05 0.32 0.00 -0.62 0.00 0.00 0.00 174.94 174.59 2buc s ASP 326 N 1.09 4.82 -0.43 3.58 2.15 0.43 -1.05 116.67 127.25 2buc s ASP 326 Ca 0.10 -1.11 -0.17 0.00 0.43 0.00 0.00 52.55 51.80 2buc s ASP 326 Cb -0.14 -1.73 0.03 0.00 -0.30 0.00 0.00 42.92 40.78 2buc s ASP 326 CO 0.06 -0.23 0.43 -0.63 -0.17 0.00 0.00 175.17 174.63 2buc s ILE 327 N 1.31 5.10 -0.14 4.11 1.01 -1.16 -1.19 121.20 130.23 2buc s ILE 327 Ca -0.03 -0.44 -0.06 0.00 0.00 0.00 0.00 60.65 60.12 2buc s ILE 327 Cb -0.19 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.19 2buc s ILE 327 CO -0.01 -0.45 0.07 0.00 0.00 0.00 0.00 174.94 174.54 2buc s ASP 329 N -0.38 5.21 0.06 0.00 1.11 -0.19 -1.20 116.67 121.29 2buc s ASP 329 Ca 0.09 0.13 -0.30 0.00 0.18 0.00 0.00 52.55 52.65 2buc s ASP 329 Cb -0.12 -1.48 -0.05 0.00 1.07 0.00 0.00 42.92 42.33 2buc s ASP 329 CO 0.02 0.37 1.13 -0.47 1.18 0.00 0.00 175.17 177.39 2buc s TYR 330 N -0.81 3.52 -0.45 4.23 5.04 0.17 -0.10 117.35 128.94 2buc s TYR 330 Ca 0.12 1.44 -0.17 0.00 -2.44 0.00 0.00 57.07 56.02 2buc s TYR 330 Cb -0.11 -3.32 0.04 0.00 0.35 0.00 0.00 41.96 38.91 2buc s TYR 330 CO 0.02 -0.87 0.48 0.34 -1.34 0.00 0.00 175.55 174.18 2buc s ASP 331 N 0.88 6.19 0.53 4.32 2.15 0.82 -4.95 116.67 126.62 2buc s ASP 331 Ca 0.56 -0.84 0.24 0.00 0.43 0.00 0.00 52.55 52.93 2buc s ASP 331 Cb -0.27 -2.23 1.39 0.00 -0.30 0.00 0.00 42.92 41.50 2buc s ASP 331 CO 0.30 -0.67 2.03 -0.33 -0.17 0.00 0.00 175.17 176.32 2buc h GLU 332 N 8.80 0.00 0.00 4.34 5.08 -1.95 0.13 114.58 130.98 2buc h GLU 332 Ca -0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 2buc h GLU 332 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 2buc h GLU 332 CO 0.85 0.00 -1.23 -1.13 -1.00 0.00 0.00 179.01 176.50 2buc n SER 333 N -4.37 0.56 0.00 1.42 3.41 -1.26 -4.41 113.62 108.96 2buc n SER 333 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 2buc n SER 333 Cb 0.51 0.95 0.00 0.00 -0.26 0.00 0.00 64.21 65.40 2buc n SER 333 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2buc n THR 334 N -2.25 0.00 -0.29 6.66 -2.24 -1.02 -5.00 114.28 110.14 2buc n THR 334 Ca 0.00 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 2buc n THR 334 Cb 0.50 0.94 0.00 0.00 -2.10 0.00 0.00 70.33 69.67 2buc n THR 334 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2buc n GLY 335 N 0.96 1.72 3.74 3.38 0.00 0.44 -4.99 105.19 110.45 2buc n GLY 335 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2buc n GLY 335 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2buc s ARG 336 N -0.09 2.75 -0.33 1.61 0.52 -1.25 -4.71 118.95 117.46 2buc s ARG 336 Ca 0.00 1.92 -0.08 0.00 -0.52 0.00 0.00 55.73 57.06 2buc s ARG 336 Cb 0.00 -1.89 0.02 0.00 0.52 0.00 0.00 34.95 33.61 2buc s ARG 336 CO 0.00 -1.41 0.12 -1.58 0.02 0.00 0.00 175.30 172.46 2buc s TRP 337 N -1.53 3.21 -0.19 -0.53 0.52 -1.26 -0.12 118.94 119.04 2buc s TRP 337 Ca 0.79 -1.12 -0.11 0.00 0.02 0.00 0.00 56.10 55.69 2buc s TRP 337 Cb -0.33 -2.31 -0.05 0.00 -1.15 0.00 0.00 33.47 29.63 2buc s TRP 337 CO 0.36 -0.64 0.16 0.42 0.02 0.00 0.00 176.95 177.27 2buc s ILE 338 N 1.48 5.39 0.07 2.03 1.01 0.86 -4.82 121.20 127.22 2buc s ILE 338 Ca 0.01 0.26 0.01 0.00 0.00 0.00 0.00 60.65 60.93 2buc s ILE 338 Cb -0.18 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 2buc s ILE 338 CO 0.04 0.44 0.16 -0.94 0.00 0.00 0.00 174.94 174.64 2buc s SER 339 N 0.30 6.05 0.02 3.58 1.04 -1.26 -1.02 113.70 122.42 2buc s SER 339 Ca 0.10 0.16 0.02 0.00 0.48 0.00 0.00 55.95 56.71 2buc s SER 339 Cb -0.11 -1.78 -0.02 0.00 0.10 0.00 0.00 66.02 64.21 2buc s SER 339 CO -0.01 0.17 -0.06 -0.94 0.98 0.00 0.00 173.24 173.38 2buc s SER 340 N -2.48 0.66 0.27 7.02 1.04 -1.26 -5.05 113.70 113.90 2buc s SER 340 Ca 0.33 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.39 2buc s SER 340 Cb -0.13 0.01 0.54 0.00 0.10 0.00 0.00 66.02 66.54 2buc s SER 340 CO 0.26 -0.12 1.81 0.58 0.98 0.00 0.00 173.24 176.75 2buc h VAL 341 N 4.72 0.87 -0.72 5.02 2.07 -1.98 -0.24 116.25 125.98 2buc h VAL 341 Ca -0.32 -0.30 0.06 0.00 0.82 0.00 0.00 66.70 66.96 2buc h VAL 341 Cb 1.20 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 2buc h VAL 341 CO 0.44 0.16 0.47 0.00 0.02 0.00 0.00 177.57 178.66 2buc h ALA 342 N 1.54 1.69 -0.23 1.67 0.00 -1.93 -1.88 119.26 120.12 2buc h ALA 342 Ca 0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2buc h ALA 342 Cb 0.53 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2buc h ALA 342 CO -0.29 0.20 0.00 0.54 0.00 0.00 0.00 179.25 179.70 2buc n ARG 343 N -4.48 1.68 -3.51 0.00 1.74 -0.12 -3.74 116.66 108.24 2buc n ARG 343 Ca 0.10 -1.04 -0.34 0.00 -0.77 0.00 0.00 57.85 55.79 2buc n ARG 343 Cb 0.21 -1.32 -0.05 0.00 -1.02 0.00 0.00 32.46 30.28 2buc n ARG 343 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2buc s GLN 344 N -1.70 3.81 -0.24 5.56 -0.21 -0.71 -3.01 119.66 123.16 2buc s GLN 344 Ca 0.27 0.25 -0.04 0.00 0.02 0.00 0.00 55.36 55.86 2buc s GLN 344 Cb 0.14 -2.94 0.08 0.00 1.00 0.00 0.00 33.01 31.30 2buc s GLN 344 CO 0.20 0.51 0.10 -1.01 -2.12 0.00 0.00 175.29 172.98 2buc s HIS 345 N -1.47 0.49 0.14 0.91 3.76 -0.21 -4.82 115.29 114.09 2buc s HIS 345 Ca 0.36 -0.77 -0.27 0.00 -0.15 0.00 0.00 55.06 54.22 2buc s HIS 345 Cb -0.14 -0.92 -0.07 0.00 1.11 0.00 0.00 32.58 32.56 2buc s HIS 345 CO 0.19 -0.70 0.86 0.42 -0.85 0.00 0.00 174.74 174.65 2buc s ILE 346 N 2.04 4.41 -0.09 0.60 1.01 -1.26 -1.02 121.20 126.89 2buc s ILE 346 Ca 0.06 1.87 -0.01 0.00 0.00 0.00 0.00 60.65 62.57 2buc s ILE 346 Cb -0.16 -4.22 0.03 0.00 0.01 0.00 0.00 42.46 38.11 2buc s ILE 346 CO -0.23 0.43 -0.04 -0.70 0.00 0.00 0.00 174.94 174.40 2buc s GLU 347 N -0.65 1.10 0.16 2.79 2.12 0.57 -4.98 118.70 119.81 2buc s GLU 347 Ca 0.40 -0.09 0.08 0.00 0.36 0.00 0.00 54.97 55.72 2buc s GLU 347 Cb -0.23 -1.27 -0.04 0.00 0.26 0.00 0.00 34.13 32.84 2buc s GLU 347 CO 0.28 -0.26 -0.16 0.96 -0.54 0.00 0.00 175.26 175.53 2buc s ILE 348 N 1.75 1.68 -0.10 -3.70 -5.25 -1.26 -1.02 121.20 113.29 2buc s ILE 348 Ca 0.03 -1.93 -0.00 0.00 -0.99 0.00 0.00 60.65 57.76 2buc s ILE 348 Cb -0.13 -1.81 0.02 0.00 2.95 0.00 0.00 42.46 43.50 2buc s ILE 348 CO -0.06 -0.40 -0.07 -0.55 -1.79 0.00 0.00 174.94 172.06 2buc s SER 349 N -2.76 1.99 0.11 4.36 0.15 -0.86 -4.99 113.70 111.69 2buc s SER 349 Ca 0.16 -0.26 0.24 0.00 0.70 0.00 0.00 55.95 56.79 2buc s SER 349 Cb -0.04 -0.77 0.41 0.00 -1.71 0.00 0.00 66.02 63.91 2buc s SER 349 CO 0.06 -0.11 1.37 0.35 1.20 0.00 0.00 173.24 176.11 2buc n THR 350 N 4.78 0.33 -0.09 6.45 -2.24 -1.26 -4.20 114.28 118.06 2buc n THR 350 Ca -0.14 -0.24 -0.10 0.00 -2.27 0.00 0.00 64.05 61.30 2buc n THR 350 Cb 0.50 -0.13 -0.16 0.00 -2.10 0.00 0.00 70.33 68.45 2buc n THR 350 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2buc n THR 351 N -2.05 1.43 0.00 4.28 -2.24 -1.26 -5.06 114.28 109.38 2buc n THR 351 Ca 0.04 -0.85 0.00 0.00 -2.27 0.00 0.00 64.05 60.97 2buc n THR 351 Cb 0.43 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 68.08 2buc n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2buc n GLY 352 N 1.72 1.18 3.69 3.38 0.00 -1.26 -4.91 105.19 108.99 2buc n GLY 352 Ca -0.30 0.38 -0.24 0.00 0.00 0.00 0.00 46.02 45.86 2buc n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2buc s TRP 353 N 2.18 2.62 -0.16 1.61 -2.14 -1.26 -4.53 118.94 117.25 2buc s TRP 353 Ca 0.00 -0.47 -0.19 0.00 2.66 0.00 0.00 56.10 58.10 2buc s TRP 353 Cb 0.00 -1.68 -0.03 0.00 -3.10 0.00 0.00 33.47 28.66 2buc s TRP 353 CO 0.00 0.35 0.54 0.08 -2.66 0.00 0.00 176.95 175.26 2buc s VAL 354 N -2.52 5.11 0.00 -0.66 1.01 -0.78 -4.79 120.40 117.77 2buc s VAL 354 Ca 0.38 1.04 0.00 0.00 0.00 0.00 0.00 61.98 63.39 2buc s VAL 354 Cb 0.00 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.51 2buc s VAL 354 CO 0.21 0.22 0.00 0.61 0.00 0.00 0.00 175.10 176.14 2buc n GLY 355 N 3.61 -1.29 0.05 4.51 0.00 -1.26 -3.63 105.19 107.18 2buc n GLY 355 Ca -0.05 -1.26 -0.03 0.00 0.00 0.00 0.00 46.02 44.69 2buc n GLY 355 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2buc h ARG 356 N 0.00 0.00 0.00 1.61 3.08 -1.93 -3.46 114.38 113.68 2buc h ARG 356 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2buc h ARG 356 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2buc h ARG 356 CO 0.00 0.00 -0.72 1.19 -1.07 0.00 0.00 179.97 179.37 2buc n PHE 357 N -4.10 0.00 -4.18 3.04 3.72 -1.26 -4.84 117.46 109.84 2buc n PHE 357 Ca -0.05 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.20 2buc n PHE 357 Cb 0.17 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.60 2buc n PHE 357 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 2buc s ARG 358 N -1.72 0.84 0.32 -1.08 1.70 -1.26 -4.95 118.95 112.80 2buc s ARG 358 Ca 0.00 -1.10 -0.27 0.00 -0.47 0.00 0.00 55.73 53.89 2buc s ARG 358 Cb 0.00 -0.63 -0.13 0.00 -0.57 0.00 0.00 34.95 33.62 2buc s ARG 358 CO 0.00 0.11 1.00 -0.35 -1.08 0.00 0.00 175.30 174.98 2buc n PRO 359 N 0.77 1.35 -1.76 3.89 -0.04 -1.24 -4.57 135.00 133.42 2buc n PRO 359 Ca -0.18 0.48 -0.39 0.00 -0.04 0.00 0.00 63.50 63.37 2buc n PRO 359 Cb 0.57 -1.88 0.03 0.00 -0.04 0.00 0.00 33.50 32.17 2buc n PRO 359 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2buc n ALA 360 N 0.05 1.87 -2.12 0.55 0.00 -1.26 -4.97 120.51 114.63 2buc n ALA 360 Ca 0.09 0.20 -0.38 0.00 0.00 0.00 0.00 53.44 53.35 2buc n ALA 360 Cb 0.34 -2.38 -0.06 0.00 0.00 0.00 0.00 19.45 17.35 2buc n ALA 360 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2buc s GLU 361 N -2.62 4.36 0.37 0.00 2.02 -1.26 -4.83 118.70 116.74 2buc s GLU 361 Ca 0.65 0.94 -0.26 0.00 0.02 0.00 0.00 54.97 56.32 2buc s GLU 361 Cb -0.44 -3.17 -0.09 0.00 0.10 0.00 0.00 34.13 30.54 2buc s GLU 361 CO 0.54 0.56 1.10 -1.25 0.02 0.00 0.00 175.26 176.23 2buc s PRO 362 N -1.32 4.24 -0.26 0.39 0.04 -1.26 -4.65 135.00 132.18 2buc s PRO 362 Ca 0.35 1.68 0.02 0.00 0.04 0.00 0.00 61.00 63.09 2buc s PRO 362 Cb -0.20 -2.73 0.05 0.00 0.04 0.00 0.00 34.50 31.65 2buc s PRO 362 CO 0.23 -0.11 -0.09 -1.01 0.04 0.00 0.00 177.00 176.05 2buc s HIS 363 N -1.46 3.23 0.13 0.56 3.76 0.13 -4.96 115.29 116.68 2buc s HIS 363 Ca 0.54 -2.14 -0.12 0.00 -0.15 0.00 0.00 55.06 53.20 2buc s HIS 363 Cb -0.27 -1.98 -0.06 0.00 1.11 0.00 0.00 32.58 31.38 2buc s HIS 363 CO 0.34 -0.85 0.49 -0.06 -0.85 0.00 0.00 174.74 173.81 2buc s PHE 364 N 1.16 3.57 0.84 1.40 0.40 -1.26 -0.43 117.98 123.65 2buc s PHE 364 Ca -0.07 0.91 -0.11 0.00 -0.60 0.00 0.00 56.93 57.06 2buc s PHE 364 Cb -0.19 -2.26 0.10 0.00 0.51 0.00 0.00 43.02 41.18 2buc s PHE 364 CO -0.05 0.44 1.10 0.95 0.70 0.00 0.00 175.22 178.36 2buc s THR 365 N -1.50 2.90 0.19 0.64 -4.23 -0.80 -4.92 115.64 107.93 2buc s THR 365 Ca 0.37 0.29 -0.13 0.00 -1.18 0.00 0.00 61.69 61.05 2buc s THR 365 Cb -0.14 -2.70 0.11 0.00 1.34 0.00 0.00 72.50 71.11 2buc s THR 365 CO 0.19 -0.38 1.71 0.28 -0.54 0.00 0.00 174.62 175.88 2buc h SER 366 N -1.42 -0.01 0.47 3.99 0.02 -1.93 -1.23 113.55 113.45 2buc h SER 366 Ca -0.46 0.09 -0.08 0.00 -0.84 0.00 0.00 61.79 60.50 2buc h SER 366 Cb 1.26 0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.91 2buc h SER 366 CO 0.51 0.02 -0.40 -2.24 -1.14 0.00 0.00 176.83 173.58 2buc h ASP 367 N 0.23 0.00 0.00 3.07 2.03 -1.93 -3.46 116.42 116.36 2buc h ASP 367 Ca 0.25 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.55 2buc h ASP 367 Cb 0.35 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.85 2buc h ASP 367 CO -0.34 0.40 0.00 0.61 -1.03 0.00 0.00 179.24 178.89 2buc n GLY 368 N -0.26 0.62 0.01 7.15 0.00 -0.47 -4.94 105.19 107.29 2buc n GLY 368 Ca -0.02 -0.31 0.12 0.00 0.00 0.00 0.00 46.02 45.81 2buc n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2buc n ASN 369 N 0.57 0.43 -3.96 1.61 5.03 -1.26 -4.84 115.26 112.83 2buc n ASN 369 Ca 0.00 -0.09 -0.09 0.00 0.87 0.00 0.00 54.58 55.27 2buc n ASN 369 Cb 0.00 0.11 -0.07 0.00 -1.02 0.00 0.00 39.78 38.80 2buc n ASN 369 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2buc s SER 370 N -3.11 0.08 0.03 6.41 1.04 -1.26 -1.25 113.70 115.64 2buc s SER 370 Ca 0.11 -0.87 -0.16 0.00 0.48 0.00 0.00 55.95 55.51 2buc s SER 370 Cb 0.17 0.41 0.03 0.00 0.10 0.00 0.00 66.02 66.73 2buc s SER 370 CO 0.67 -0.86 0.34 0.72 0.98 0.00 0.00 173.24 175.10 2buc s PHE 371 N -3.96 -0.18 -0.14 5.02 -0.12 -0.66 -1.90 117.98 116.04 2buc s PHE 371 Ca 0.16 0.14 -0.03 0.00 -0.05 0.00 0.00 56.93 57.15 2buc s PHE 371 Cb 0.04 0.14 -0.03 0.00 -0.63 0.00 0.00 43.02 42.54 2buc s PHE 371 CO -0.01 -0.50 -0.04 0.71 -0.05 0.00 0.00 175.22 175.33 2buc s TYR 372 N -2.21 3.03 -0.05 3.49 1.51 0.42 -0.46 117.35 123.09 2buc s TYR 372 Ca -0.07 -0.23 -0.05 0.00 -1.01 0.00 0.00 57.07 55.71 2buc s TYR 372 Cb -0.02 -1.93 0.01 0.00 -0.11 0.00 0.00 41.96 39.92 2buc s TYR 372 CO -0.01 0.03 0.13 0.21 -1.11 0.00 0.00 175.55 174.81 2buc s LYS 373 N 0.17 0.15 -0.19 -0.62 2.20 -0.74 -0.69 119.74 120.02 2buc s LYS 373 Ca -0.02 0.18 -0.29 0.00 -0.36 0.00 0.00 55.97 55.48 2buc s LYS 373 Cb -0.14 0.07 -0.01 0.00 -1.51 0.00 0.00 37.83 36.25 2buc s LYS 373 CO 0.03 -0.02 1.21 0.42 -0.36 0.00 0.00 175.35 176.62 2buc s ILE 374 N 0.07 4.38 0.30 5.43 1.01 -1.26 -0.54 121.20 130.59 2buc s ILE 374 Ca -0.00 1.66 0.03 0.00 0.00 0.00 0.00 60.65 62.33 2buc s ILE 374 Cb -0.01 -4.10 -0.05 0.00 0.01 0.00 0.00 42.46 38.31 2buc s ILE 374 CO 0.00 -0.18 0.09 0.27 0.00 0.00 0.00 174.94 175.12 2buc s ILE 375 N 3.49 0.82 -0.00 2.92 -4.36 -0.33 -4.46 121.20 119.29 2buc s ILE 375 Ca 0.52 -2.00 -0.27 0.00 -0.26 0.00 0.00 60.65 58.64 2buc s ILE 375 Cb -0.19 -2.68 -0.04 0.00 1.25 0.00 0.00 42.46 40.79 2buc s ILE 375 CO 0.13 0.00 0.84 -0.44 0.24 0.00 0.00 174.94 175.71 2buc s SER 376 N -3.41 7.22 0.77 4.36 0.01 -1.26 -0.83 113.70 120.55 2buc s SER 376 Ca 0.36 1.47 -0.02 0.00 1.31 0.00 0.00 55.95 59.07 2buc s SER 376 Cb 0.08 -2.50 0.05 0.00 0.21 0.00 0.00 66.02 63.86 2buc s SER 376 CO 0.15 -0.13 0.29 -0.46 0.41 0.00 0.00 173.24 173.50 2buc n ASN 377 N 3.50 0.16 -0.04 2.44 2.04 0.03 -4.90 115.26 118.47 2buc n ASN 377 Ca 0.01 -1.19 0.06 0.00 -0.44 0.00 0.00 54.58 53.03 2buc n ASN 377 Cb 0.51 -0.21 0.44 0.00 -2.53 0.00 0.00 39.78 37.99 2buc n ASN 377 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 2buc h GLU 378 N 0.00 0.52 -0.64 -3.83 3.07 -1.98 -1.88 114.58 109.85 2buc h GLU 378 Ca -0.09 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.73 2buc h GLU 378 Cb 0.29 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 2buc h GLU 378 CO 0.08 0.35 0.00 -0.85 -1.40 0.00 0.00 179.01 177.19 2buc n GLU 379 N -4.47 3.38 -1.13 2.33 0.28 -1.26 -4.94 120.64 114.82 2buc n GLU 379 Ca 0.06 -2.49 -0.04 0.00 -0.16 0.00 0.00 57.16 54.53 2buc n GLU 379 Cb 0.16 -1.81 -0.02 0.00 1.43 0.00 0.00 31.44 31.20 2buc n GLU 379 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2buc n GLY 380 N 1.05 0.65 3.71 -1.84 0.00 -0.71 -4.81 105.19 103.24 2buc n GLY 380 Ca 0.23 -0.90 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 2buc n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2buc s TYR 381 N -2.14 3.12 -0.24 1.61 1.51 -1.26 0.81 117.35 120.76 2buc s TYR 381 Ca 0.00 0.09 -0.22 0.00 -1.01 0.00 0.00 57.07 55.93 2buc s TYR 381 Cb 0.00 -1.66 -0.01 0.00 -0.11 0.00 0.00 41.96 40.18 2buc s TYR 381 CO 0.00 0.49 0.70 0.15 -1.11 0.00 0.00 175.55 175.78 2buc s LYS 382 N -1.78 4.15 0.11 -0.62 1.02 -1.26 -0.79 119.74 120.57 2buc s LYS 382 Ca 0.22 0.71 -0.05 0.00 0.02 0.00 0.00 55.97 56.87 2buc s LYS 382 Cb -0.12 -3.64 -0.02 0.00 -0.52 0.00 0.00 37.83 33.53 2buc s LYS 382 CO 0.13 -0.43 0.13 -1.01 -0.92 0.00 0.00 175.35 173.26 2buc s HIS 383 N 2.54 0.49 -0.04 3.18 3.76 -0.01 -1.17 115.29 124.03 2buc s HIS 383 Ca 0.30 -0.92 -0.30 0.00 -0.15 0.00 0.00 55.06 53.99 2buc s HIS 383 Cb -0.15 -0.25 -0.03 0.00 1.11 0.00 0.00 32.58 33.26 2buc s HIS 383 CO 0.08 -0.55 1.15 0.42 -0.85 0.00 0.00 174.74 175.00 2buc s ILE 384 N -3.95 4.36 -0.06 0.60 1.01 -1.26 -1.18 121.20 120.71 2buc s ILE 384 Ca 0.14 1.68 0.00 0.00 0.00 0.00 0.00 60.65 62.47 2buc s ILE 384 Cb 0.06 -4.08 -0.03 0.00 0.01 0.00 0.00 42.46 38.42 2buc s ILE 384 CO -0.04 0.03 -0.04 0.00 0.00 0.00 0.00 174.94 174.88 2buc s HIS 386 N -0.86 2.99 0.24 0.00 2.46 0.14 -1.79 115.29 118.46 2buc s HIS 386 Ca 0.13 -0.81 -0.07 0.00 0.47 0.00 0.00 55.06 54.78 2buc s HIS 386 Cb -0.11 -3.91 -0.06 0.00 -0.13 0.00 0.00 32.58 28.37 2buc s HIS 386 CO 0.03 -1.25 0.52 -0.06 -2.47 0.00 0.00 174.74 171.51 2buc s PHE 387 N 2.78 3.45 -0.08 3.88 0.40 0.39 -2.33 117.98 126.46 2buc s PHE 387 Ca 0.13 0.75 -0.02 0.00 -0.60 0.00 0.00 56.93 57.20 2buc s PHE 387 Cb -0.22 -2.17 -0.03 0.00 0.51 0.00 0.00 43.02 41.10 2buc s PHE 387 CO 0.08 0.26 0.00 -1.14 0.70 0.00 0.00 175.22 175.12 2buc s GLN 388 N -3.03 2.97 0.24 0.44 2.00 -1.26 -1.65 119.66 119.37 2buc s GLN 388 Ca 0.45 -0.42 -0.04 0.00 -2.00 0.00 0.00 55.36 53.35 2buc s GLN 388 Cb -0.11 -2.78 0.42 0.00 0.80 0.00 0.00 33.01 31.33 2buc s GLN 388 CO 0.25 0.70 1.79 1.15 -0.50 0.00 0.00 175.29 178.67 2buc h THR 389 N 4.10 0.84 -0.66 -0.34 2.02 -1.50 -2.15 112.91 115.21 2buc h THR 389 Ca -0.51 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.44 2buc h THR 389 Cb 1.19 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.69 2buc h THR 389 CO 0.55 0.13 0.00 -0.90 0.37 0.00 0.00 175.52 175.66 2buc n ASP 390 N -4.81 4.70 -4.25 4.18 5.68 -1.26 -4.01 116.55 116.78 2buc n ASP 390 Ca 0.14 -2.40 -0.28 0.00 -0.50 0.00 0.00 54.79 51.75 2buc n ASP 390 Cb 0.32 -0.57 -0.16 0.00 -1.14 0.00 0.00 41.12 39.57 2buc n ASP 390 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 2buc s LYS 391 N -1.75 1.79 0.14 0.11 -0.14 -0.81 -4.71 119.74 114.37 2buc s LYS 391 Ca 0.51 -0.81 0.08 0.00 -1.36 0.00 0.00 55.97 54.40 2buc s LYS 391 Cb 0.32 -1.74 -0.18 0.00 -1.68 0.00 0.00 37.83 34.56 2buc s LYS 391 CO 0.26 0.48 1.30 0.66 -0.76 0.00 0.00 175.35 177.28 2buc h SER 392 N 5.55 0.00 -3.25 2.83 4.64 -1.83 -3.39 113.55 118.10 2buc h SER 392 Ca -0.40 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.35 2buc h SER 392 Cb 1.13 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.19 2buc h SER 392 CO 0.47 0.94 -0.25 0.54 -0.87 0.00 0.00 176.83 177.67 2buc s ASN 393 N -6.68 6.54 0.23 4.97 2.20 -1.26 -4.96 114.94 115.98 2buc s ASN 393 Ca 0.01 0.70 0.03 0.00 -0.94 0.00 0.00 52.86 52.66 2buc s ASN 393 Cb 0.10 -2.13 -0.05 0.00 -2.00 0.00 0.00 41.25 37.16 2buc s ASN 393 CO 0.81 0.02 0.01 0.00 -2.94 0.00 0.00 177.10 175.00 2buc s THR 395 N -3.50 2.38 0.08 0.00 2.01 -0.99 -4.88 115.64 110.76 2buc s THR 395 Ca 0.29 -0.86 -0.31 0.00 0.31 0.00 0.00 61.69 61.13 2buc s THR 395 Cb 0.06 -2.00 -0.07 0.00 0.01 0.00 0.00 72.50 70.50 2buc s THR 395 CO 0.09 0.52 1.41 -0.36 -0.69 0.00 0.00 174.62 175.59 2buc s PHE 396 N 0.99 3.10 -0.51 4.92 0.08 -1.26 0.27 117.98 125.56 2buc s PHE 396 Ca -0.02 0.88 0.20 0.00 0.12 0.00 0.00 56.93 58.11 2buc s PHE 396 Cb -0.15 -3.69 -0.27 0.00 -0.57 0.00 0.00 43.02 38.35 2buc s PHE 396 CO -0.04 -2.47 0.66 0.44 -0.10 0.00 0.00 175.22 173.71 2buc n ILE 397 N 4.18 0.00 -4.26 0.64 -5.35 -0.30 -4.93 119.36 109.34 2buc n ILE 397 Ca 0.12 -0.24 -0.20 0.00 -0.27 0.00 0.00 62.75 62.17 2buc n ILE 397 Cb 0.43 0.54 -0.12 0.00 -1.74 0.00 0.00 39.64 38.75 2buc n ILE 397 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2buc s THR 398 N -3.14 1.47 0.17 7.28 -4.23 -1.25 -4.91 115.64 111.02 2buc s THR 398 Ca 0.00 -1.66 -0.16 0.00 -1.18 0.00 0.00 61.69 58.70 2buc s THR 398 Cb 0.14 -1.53 0.03 0.00 1.34 0.00 0.00 72.50 72.48 2buc s THR 398 CO 0.84 -0.30 0.46 -1.59 -0.54 0.00 0.00 174.62 173.49 2buc s LYS 399 N -2.40 1.25 0.00 3.99 0.00 -1.26 -4.62 119.74 116.69 2buc s LYS 399 Ca 0.08 -0.84 0.00 0.00 0.00 0.00 0.00 55.97 55.21 2buc s LYS 399 Cb -0.07 0.49 0.00 0.00 0.00 0.00 0.00 37.83 38.25 2buc s LYS 399 CO 0.04 -0.51 0.00 0.41 0.00 0.00 0.00 175.35 175.29 2buc n GLY 400 N -0.29 3.68 2.26 0.59 0.00 -1.26 -4.90 105.19 105.27 2buc n GLY 400 Ca -0.12 -1.72 -0.17 0.00 0.00 0.00 0.00 46.02 44.01 2buc n GLY 400 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2buc n ALA 401 N -1.71 5.45 -3.21 4.61 0.00 -1.26 -4.71 120.51 119.69 2buc n ALA 401 Ca 0.00 -1.90 -0.10 0.00 0.00 0.00 0.00 53.44 51.44 2buc n ALA 401 Cb 0.00 -2.64 -0.04 0.00 0.00 0.00 0.00 19.45 16.77 2buc n ALA 401 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 2buc s TRP 402 N 2.02 -0.08 -0.01 0.00 1.48 -1.26 -5.01 118.94 116.08 2buc s TRP 402 Ca 0.52 -0.26 0.07 0.00 -1.06 0.00 0.00 56.10 55.37 2buc s TRP 402 Cb 0.20 0.33 -0.02 0.00 -1.16 0.00 0.00 33.47 32.82 2buc s TRP 402 CO -0.02 -0.87 -0.22 -1.21 -4.06 0.00 0.00 176.95 170.57 2buc s GLU 403 N -3.87 2.14 -0.08 3.25 2.02 -1.26 -4.46 118.70 116.43 2buc s GLU 403 Ca 0.09 -0.92 -0.28 0.00 0.02 0.00 0.00 54.97 53.89 2buc s GLU 403 Cb -0.00 -2.12 -0.02 0.00 0.10 0.00 0.00 34.13 32.08 2buc s GLU 403 CO -0.04 0.56 0.92 0.08 0.02 0.00 0.00 175.26 176.81 2buc s VAL 404 N -0.71 4.87 -0.08 2.63 1.01 -0.32 -2.52 120.40 125.28 2buc s VAL 404 Ca 0.11 1.88 -0.23 0.00 0.00 0.00 0.00 61.98 63.74 2buc s VAL 404 Cb -0.10 -4.24 -0.29 0.00 0.00 0.00 0.00 36.38 31.75 2buc s VAL 404 CO 0.01 0.09 0.80 0.40 0.00 0.00 0.00 175.10 176.40 2buc h ILE 405 N 4.97 1.51 -1.69 2.22 1.08 -0.11 -3.45 117.51 122.05 2buc h ILE 405 Ca -0.35 -2.47 0.10 0.00 -0.39 0.00 0.00 64.86 61.76 2buc h ILE 405 Cb 1.17 3.17 -0.21 0.00 -3.07 0.00 0.00 36.82 37.88 2buc h ILE 405 CO 0.80 0.68 0.56 -0.83 -0.69 0.00 0.00 178.15 178.67 2buc s GLY 406 N -4.45 -0.30 -0.30 5.37 0.00 -1.13 -5.00 107.32 101.51 2buc s GLY 406 Ca -0.16 1.81 -0.22 0.00 0.00 0.00 0.00 44.72 46.15 2buc s GLY 406 CO 0.78 0.85 0.72 -0.42 0.00 0.00 0.00 173.10 175.03 2buc s ILE 407 N -1.61 4.87 -0.13 0.90 1.01 -1.26 -0.93 121.20 124.05 2buc s ILE 407 Ca 0.01 1.08 -0.12 0.00 0.00 0.00 0.00 60.65 61.61 2buc s ILE 407 Cb -0.01 -4.07 -0.11 0.00 0.01 0.00 0.00 42.46 38.29 2buc s ILE 407 CO -0.01 -0.17 0.26 -0.33 0.00 0.00 0.00 174.94 174.69 2buc h GLU 408 N 8.10 0.00 -4.25 2.79 4.39 -0.78 -3.49 114.58 121.34 2buc h GLU 408 Ca -0.25 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.30 2buc h GLU 408 Cb 1.11 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 29.61 2buc h GLU 408 CO 0.84 0.42 -0.57 0.00 -1.16 0.00 0.00 179.01 178.54 2buc s ALA 409 N -2.44 0.56 -0.13 3.43 0.00 -1.05 -4.91 121.76 117.22 2buc s ALA 409 Ca -0.10 -1.26 -0.05 0.00 0.00 0.00 0.00 51.96 50.55 2buc s ALA 409 Cb -0.00 0.75 0.06 0.00 0.00 0.00 0.00 23.12 23.93 2buc s ALA 409 CO 0.30 -0.50 0.27 -1.17 0.00 0.00 0.00 175.76 174.66 2buc s LEU 410 N -3.00 -0.24 0.42 0.00 2.96 -1.26 -1.47 118.68 116.09 2buc s LEU 410 Ca 0.19 0.60 0.07 0.00 -0.22 0.00 0.00 54.13 54.77 2buc s LEU 410 Cb 0.07 0.73 -0.04 0.00 0.50 0.00 0.00 46.19 47.44 2buc s LEU 410 CO -0.01 -0.23 0.19 0.42 -1.32 0.00 0.00 176.35 175.40 2buc s THR 411 N 2.29 2.24 0.47 3.68 -4.23 0.44 -4.96 115.64 115.57 2buc s THR 411 Ca -0.00 -1.68 0.37 0.00 -1.18 0.00 0.00 61.69 59.19 2buc s THR 411 Cb -0.12 -2.92 0.39 0.00 1.34 0.00 0.00 72.50 71.19 2buc s THR 411 CO -0.09 0.00 2.20 0.77 -0.54 0.00 0.00 174.62 176.96 2buc h SER 412 N 1.37 0.00 0.05 3.99 4.64 -2.01 -3.15 113.55 118.44 2buc h SER 412 Ca -0.42 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.52 2buc h SER 412 Cb 1.26 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.30 2buc h SER 412 CO 0.69 0.03 -2.22 0.47 -0.87 0.00 0.00 176.83 174.93 2buc n ASP 413 N -3.29 2.03 -4.12 4.97 8.00 -1.26 -4.82 116.55 118.05 2buc n ASP 413 Ca -0.02 0.08 -0.16 0.00 0.71 0.00 0.00 54.79 55.40 2buc n ASP 413 Cb 0.17 -0.66 -0.12 0.00 -0.02 0.00 0.00 41.12 40.49 2buc n ASP 413 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2buc s TYR 414 N -2.52 0.96 -0.21 1.24 1.51 -1.19 -1.39 117.35 115.75 2buc s TYR 414 Ca -0.30 -0.49 -0.00 0.00 -1.01 0.00 0.00 57.07 55.26 2buc s TYR 414 Cb 0.08 -0.55 0.02 0.00 -0.11 0.00 0.00 41.96 41.40 2buc s TYR 414 CO 0.65 -0.01 -0.13 -1.17 -1.11 0.00 0.00 175.55 173.78 2buc s LEU 415 N -1.73 2.62 -0.20 -1.29 1.98 -0.34 -0.42 118.68 119.30 2buc s LEU 415 Ca -0.05 -0.72 -0.11 0.00 -2.89 0.00 0.00 54.13 50.36 2buc s LEU 415 Cb -0.09 -1.57 -0.05 0.00 0.66 0.00 0.00 46.19 45.13 2buc s LEU 415 CO 0.01 -0.05 0.17 -0.31 -1.89 0.00 0.00 176.35 174.28 2buc s TYR 416 N 1.31 3.39 0.09 5.38 1.51 -0.55 -1.08 117.35 127.41 2buc s TYR 416 Ca 0.03 0.35 -0.05 0.00 -1.01 0.00 0.00 57.07 56.39 2buc s TYR 416 Cb -0.15 -2.22 -0.02 0.00 -0.11 0.00 0.00 41.96 39.46 2buc s TYR 416 CO -0.09 0.22 0.10 1.52 -1.11 0.00 0.00 175.55 176.20 2buc s TYR 417 N 0.56 0.41 -0.14 2.71 -0.85 -0.05 -0.02 117.35 119.98 2buc s TYR 417 Ca 0.09 -0.87 -0.03 0.00 -0.52 0.00 0.00 57.07 55.74 2buc s TYR 417 Cb -0.12 -0.24 -0.03 0.00 0.38 0.00 0.00 41.96 41.96 2buc s TYR 417 CO 0.00 -0.50 -0.04 0.42 -1.52 0.00 0.00 175.55 173.92 2buc s ILE 418 N -3.92 3.93 0.29 -3.49 -1.09 -0.10 0.05 121.20 116.86 2buc s ILE 418 Ca 0.10 -0.36 -0.00 0.00 -2.23 0.00 0.00 60.65 58.16 2buc s ILE 418 Cb 0.06 -2.70 -0.02 0.00 -1.58 0.00 0.00 42.46 38.22 2buc s ILE 418 CO -0.08 0.52 0.32 -0.94 -1.23 0.00 0.00 174.94 173.53 2buc s SER 419 N 0.09 0.79 -0.25 3.58 1.04 -1.02 0.66 113.70 118.60 2buc s SER 419 Ca -0.00 -1.47 0.12 0.00 0.48 0.00 0.00 55.95 55.08 2buc s SER 419 Cb -0.13 0.54 0.51 0.00 0.10 0.00 0.00 66.02 67.04 2buc s SER 419 CO 0.03 -1.07 1.45 -0.46 0.98 0.00 0.00 173.24 174.16 2buc n ASN 420 N -0.99 3.04 -0.12 7.02 0.23 -1.05 -2.09 115.26 121.31 2buc n ASN 420 Ca 0.03 -3.46 -0.10 0.00 -0.53 0.00 0.00 54.58 50.52 2buc n ASN 420 Cb 0.63 -0.60 -0.02 0.00 -2.08 0.00 0.00 39.78 37.71 2buc n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2buc h GLU 421 N 1.26 0.54 -6.50 -3.83 4.81 -1.86 -3.33 114.58 105.68 2buc h GLU 421 Ca 0.14 -0.11 -0.60 0.00 -0.13 0.00 0.00 59.36 58.66 2buc h GLU 421 Cb 1.59 -0.08 0.07 0.00 0.63 0.00 0.00 28.75 30.96 2buc h GLU 421 CO 0.33 0.56 0.67 1.58 -0.73 0.00 0.00 179.01 181.43 2buc n HIS 422 N -4.66 2.10 -0.98 0.92 -0.00 -1.26 -0.69 115.22 110.66 2buc n HIS 422 Ca -0.01 0.38 -0.03 0.00 0.46 0.00 0.00 57.72 58.52 2buc n HIS 422 Cb 0.17 -2.48 -0.01 0.00 -0.12 0.00 0.00 29.99 27.55 2buc n HIS 422 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 2buc n LYS 423 N 2.80 -1.90 -2.00 1.57 4.01 -1.26 -2.73 118.16 118.65 2buc n LYS 423 Ca 0.15 0.54 -0.20 0.00 -0.51 0.00 0.00 58.31 58.30 2buc n LYS 423 Cb 0.28 -4.80 -0.05 0.00 -0.51 0.00 0.00 35.03 29.96 2buc n LYS 423 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2buc n GLY 424 N 0.67 0.66 3.36 0.72 0.00 0.14 -4.98 105.19 105.75 2buc n GLY 424 Ca -0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 2buc n GLY 424 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2buc s MET 425 N -4.38 3.01 0.53 1.61 0.23 -1.11 -4.99 119.30 114.21 2buc s MET 425 Ca 0.00 -0.93 0.19 0.00 -1.03 0.00 0.00 55.69 53.92 2buc s MET 425 Cb 0.00 -3.51 1.37 0.00 -1.53 0.00 0.00 34.83 31.16 2buc s MET 425 CO 0.00 -0.53 2.14 -1.00 -2.03 0.00 0.00 175.02 173.60 2buc h PRO 426 N 8.30 0.00 0.00 3.16 0.13 -1.86 -1.59 132.00 140.15 2buc h PRO 426 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2buc h PRO 426 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2buc h PRO 426 CO 0.62 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.80 2buc n GLY 427 N -1.52 -0.82 3.66 1.56 0.00 -1.26 -4.78 105.19 102.03 2buc n GLY 427 Ca -0.01 -0.06 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 2buc n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2buc s GLY 428 N -1.47 1.80 -0.02 -0.02 0.00 -0.60 -1.99 107.32 105.02 2buc s GLY 428 Ca 0.14 -1.26 0.01 0.00 0.00 0.00 0.00 44.72 43.61 2buc s GLY 428 CO 0.11 -1.26 -0.04 0.50 0.00 0.00 0.00 173.10 172.41 2buc s ARG 429 N -2.63 0.53 0.01 2.90 1.81 0.63 -4.12 118.95 118.07 2buc s ARG 429 Ca 0.26 -0.11 -0.04 0.00 -1.72 0.00 0.00 55.73 54.12 2buc s ARG 429 Cb -0.10 -0.56 -0.01 0.00 -0.45 0.00 0.00 34.95 33.83 2buc s ARG 429 CO 0.18 0.00 0.07 -0.80 -0.68 0.00 0.00 175.30 174.08 2buc s ASN 430 N 0.43 0.09 0.04 0.23 0.01 -0.89 -0.23 114.94 114.62 2buc s ASN 430 Ca -0.05 -0.28 -0.28 0.00 -0.71 0.00 0.00 52.86 51.54 2buc s ASN 430 Cb -0.08 0.17 -0.05 0.00 0.41 0.00 0.00 41.25 41.70 2buc s ASN 430 CO -0.00 -0.32 0.89 -0.22 -1.51 0.00 0.00 177.10 175.94 2buc s LEU 431 N -1.29 4.43 0.06 0.60 2.96 -1.26 -2.44 118.68 121.74 2buc s LEU 431 Ca -0.14 1.60 0.07 0.00 -0.22 0.00 0.00 54.13 55.44 2buc s LEU 431 Cb -0.08 -3.44 -0.03 0.00 0.50 0.00 0.00 46.19 43.14 2buc s LEU 431 CO 0.01 -0.11 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.43 2buc s TYR 432 N 0.37 1.60 -0.18 5.38 1.51 0.11 -1.77 117.35 124.37 2buc s TYR 432 Ca 0.45 -0.38 0.01 0.00 -1.01 0.00 0.00 57.07 56.14 2buc s TYR 432 Cb -0.21 -0.93 0.03 0.00 -0.11 0.00 0.00 41.96 40.73 2buc s TYR 432 CO 0.26 0.10 -0.17 0.50 -1.11 0.00 0.00 175.55 175.13 2buc s ARG 433 N -1.38 2.66 -0.12 -0.62 3.52 0.08 -0.87 118.95 122.22 2buc s ARG 433 Ca 0.05 -0.79 -0.03 0.00 -0.13 0.00 0.00 55.73 54.83 2buc s ARG 433 Cb -0.09 -2.45 -0.03 0.00 -1.56 0.00 0.00 34.95 30.82 2buc s ARG 433 CO 0.02 -0.26 -0.02 -1.50 -0.81 0.00 0.00 175.30 172.73 2buc s ILE 434 N 1.34 4.08 0.09 4.11 2.07 -0.25 -1.55 121.20 131.10 2buc s ILE 434 Ca 0.03 -0.31 -0.30 0.00 -1.41 0.00 0.00 60.65 58.66 2buc s ILE 434 Cb -0.14 -2.75 -0.06 0.00 0.13 0.00 0.00 42.46 39.64 2buc s ILE 434 CO -0.11 0.54 1.10 -1.58 -1.91 0.00 0.00 174.94 172.98 2buc s GLN 435 N -0.19 4.53 0.15 3.50 0.74 -0.97 -1.20 119.66 126.23 2buc s GLN 435 Ca 0.04 1.66 -0.10 0.00 0.05 0.00 0.00 55.36 57.00 2buc s GLN 435 Cb -0.13 -3.35 -0.01 0.00 1.10 0.00 0.00 33.01 30.63 2buc s GLN 435 CO 0.02 -0.07 1.53 -0.07 -0.55 0.00 0.00 175.29 176.15 2buc h LEU 436 N 6.16 1.02 -0.12 3.68 4.07 -1.55 -3.10 115.31 125.49 2buc h LEU 436 Ca -0.42 -0.41 0.00 0.00 0.08 0.00 0.00 57.88 57.13 2buc h LEU 436 Cb 1.21 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 42.67 2buc h LEU 436 CO 0.76 1.21 -0.18 -0.46 -1.08 0.00 0.00 178.44 178.68 2buc n ASN 437 N -4.11 0.37 -3.37 -0.43 0.23 -1.26 -4.65 115.26 102.04 2buc n ASN 437 Ca -0.00 -0.21 -0.14 0.00 -0.53 0.00 0.00 54.58 53.70 2buc n ASN 437 Cb 0.48 -0.10 -0.08 0.00 -2.08 0.00 0.00 39.78 37.99 2buc n ASN 437 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2buc s ASP 438 N -2.75 1.21 0.25 0.53 -1.08 -1.17 -5.03 116.67 108.63 2buc s ASP 438 Ca 0.20 -0.59 0.24 0.00 -0.52 0.00 0.00 52.55 51.87 2buc s ASP 438 Cb 0.19 0.71 0.96 0.00 -1.46 0.00 0.00 42.92 43.32 2buc s ASP 438 CO 0.55 -0.37 1.71 -1.22 0.52 0.00 0.00 175.17 176.36 2buc n TYR 439 N 5.33 0.79 0.10 -5.34 4.01 -1.24 -2.73 117.16 118.09 2buc n TYR 439 Ca -0.01 0.30 -0.18 0.00 -0.16 0.00 0.00 57.90 57.85 2buc n TYR 439 Cb 0.47 -0.99 -0.12 0.00 -0.31 0.00 0.00 39.34 38.39 2buc n TYR 439 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 2buc h THR 440 N 0.00 1.40 -1.82 -0.72 1.35 -1.91 -3.42 112.91 107.79 2buc h THR 440 Ca 0.00 -2.77 -0.54 0.00 -0.55 0.00 0.00 66.41 62.55 2buc h THR 440 Cb 0.39 2.82 -0.08 0.00 -1.73 0.00 0.00 68.15 69.56 2buc h THR 440 CO 0.00 0.82 1.21 -0.54 -0.25 0.00 0.00 175.52 176.76 2buc s LYS 441 N -2.82 3.21 -0.09 4.72 1.02 -1.10 -4.95 119.74 119.73 2buc s LYS 441 Ca -0.06 -0.43 -0.01 0.00 0.02 0.00 0.00 55.97 55.49 2buc s LYS 441 Cb 0.07 -4.63 0.03 0.00 -0.52 0.00 0.00 37.83 32.78 2buc s LYS 441 CO 0.90 -2.31 -0.01 0.54 -0.92 0.00 0.00 175.35 173.55 2buc s VAL 442 N 6.15 0.54 -0.05 3.17 0.11 -1.26 -2.29 120.40 126.77 2buc s VAL 442 Ca 0.44 -0.05 -0.03 0.00 -2.93 0.00 0.00 61.98 59.42 2buc s VAL 442 Cb -0.06 -0.70 -0.04 0.00 -1.53 0.00 0.00 36.38 34.05 2buc s VAL 442 CO 0.07 0.23 0.11 0.42 -3.33 0.00 0.00 175.10 172.60 2buc s THR 443 N 1.90 5.05 -0.36 5.04 -4.23 -0.60 -4.95 115.64 117.49 2buc s THR 443 Ca 0.04 -0.17 -0.17 0.00 -1.18 0.00 0.00 61.69 60.22 2buc s THR 443 Cb -0.13 -3.27 -0.00 0.00 1.34 0.00 0.00 72.50 70.44 2buc s THR 443 CO -0.06 0.45 0.44 0.00 -0.54 0.00 0.00 174.62 174.90 2buc n LEU 445 N 5.58 0.28 0.00 0.00 4.77 -0.73 -4.17 117.00 122.73 2buc n LEU 445 Ca -0.07 0.49 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 2buc n LEU 445 Cb 0.49 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.15 2buc n LEU 445 CO 0.43 -0.05 -0.33 -1.54 -1.33 0.00 0.00 177.39 174.57 2buc n SER 446 N -1.74 3.30 -0.08 -1.43 3.41 -1.24 -4.78 113.62 111.05 2buc n SER 446 Ca 0.06 -0.05 0.15 0.00 -0.26 0.00 0.00 58.87 58.78 2buc n SER 446 Cb 0.37 0.76 0.56 0.00 -0.26 0.00 0.00 64.21 65.64 2buc n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2buc n GLU 448 N -4.45 1.00 -0.09 0.00 4.71 -1.26 -4.29 120.64 116.25 2buc n GLU 448 Ca 0.11 -1.27 -0.13 0.00 -0.01 0.00 0.00 57.16 55.87 2buc n GLU 448 Cb 0.49 -1.17 -0.04 0.00 -1.01 0.00 0.00 31.44 29.71 2buc n GLU 448 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 2buc h LEU 449 N 1.54 0.69 -5.38 -4.62 3.38 -1.84 -3.39 115.31 105.68 2buc h LEU 449 Ca 0.00 -0.45 -0.33 0.00 0.09 0.00 0.00 57.88 57.18 2buc h LEU 449 Cb 0.44 -0.19 -0.23 0.00 0.09 0.00 0.00 40.66 40.77 2buc h LEU 449 CO 0.00 1.00 -0.70 0.59 0.09 0.00 0.00 178.44 179.42 2buc n ASN 450 N -4.33 -1.96 0.27 -0.43 4.13 -1.26 -5.05 115.26 106.63 2buc n ASN 450 Ca -0.04 -3.01 0.09 0.00 1.68 0.00 0.00 54.58 53.31 2buc n ASN 450 Cb 0.43 0.96 0.70 0.00 -1.54 0.00 0.00 39.78 40.33 2buc n ASN 450 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2buc h PRO 451 N 4.28 0.00 0.02 3.52 0.13 -1.77 0.47 132.00 138.65 2buc h PRO 451 Ca -0.03 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.81 2buc h PRO 451 Cb 0.99 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.08 2buc h PRO 451 CO 0.32 0.00 -1.68 0.93 -0.23 0.00 0.00 178.00 177.34 2buc h GLU 452 N 0.00 0.05 0.01 0.86 4.39 -1.96 -3.38 114.58 114.55 2buc h GLU 452 Ca 0.00 -0.08 -0.28 0.00 0.34 0.00 0.00 59.36 59.33 2buc h GLU 452 Cb 0.00 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.64 2buc h GLU 452 CO -0.00 0.66 -1.60 -0.09 -1.16 0.00 0.00 179.01 176.81 2buc h ARG 453 N 0.01 0.03 -4.09 2.33 2.43 -1.77 -3.42 114.38 109.91 2buc h ARG 453 Ca -0.28 -0.05 -0.59 0.00 -0.81 0.00 0.00 59.98 58.25 2buc h ARG 453 Cb 2.00 0.02 -0.39 0.00 -0.42 0.00 0.00 29.97 31.18 2buc h ARG 453 CO 0.09 0.65 -0.77 0.00 -1.51 0.00 0.00 179.97 178.42 2buc n GLN 455 N 4.74 2.23 -3.89 0.00 6.02 0.33 -4.51 117.38 122.30 2buc n GLN 455 Ca -0.09 -0.23 -0.29 0.00 -0.01 0.00 0.00 57.00 56.39 2buc n GLN 455 Cb 0.44 -0.69 -0.16 0.00 1.02 0.00 0.00 30.24 30.85 2buc n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 2buc s TYR 456 N -0.38 1.85 -0.01 1.08 6.14 -1.11 -0.27 117.35 124.65 2buc s TYR 456 Ca 0.00 -1.29 0.05 0.00 0.64 0.00 0.00 57.07 56.47 2buc s TYR 456 Cb 0.00 -1.37 -0.01 0.00 0.42 0.00 0.00 41.96 41.00 2buc s TYR 456 CO 0.00 -0.67 -0.17 0.71 0.64 0.00 0.00 175.55 176.06 2buc s TYR 457 N 1.58 1.53 0.18 4.97 1.51 0.68 -1.64 117.35 126.16 2buc s TYR 457 Ca -0.02 -0.29 0.08 0.00 -1.01 0.00 0.00 57.07 55.82 2buc s TYR 457 Cb -0.17 -0.98 -0.04 0.00 -0.11 0.00 0.00 41.96 40.66 2buc s TYR 457 CO -0.07 -0.02 -0.15 -1.54 -1.11 0.00 0.00 175.55 172.66 2buc s SER 458 N -0.45 2.49 0.05 2.29 1.04 -0.44 -4.38 113.70 114.30 2buc s SER 458 Ca 0.06 -0.95 0.03 0.00 0.48 0.00 0.00 55.95 55.58 2buc s SER 458 Cb -0.07 -0.13 -0.02 0.00 0.10 0.00 0.00 66.02 65.90 2buc s SER 458 CO -0.01 -0.14 -0.10 0.00 0.98 0.00 0.00 173.24 173.98 2buc s ALA 459 N -2.64 0.79 -0.12 5.32 0.00 -1.26 -0.22 121.76 123.62 2buc s ALA 459 Ca 0.19 -0.81 -0.01 0.00 0.00 0.00 0.00 51.96 51.33 2buc s ALA 459 Cb -0.02 -0.02 0.03 0.00 0.00 0.00 0.00 23.12 23.10 2buc s ALA 459 CO 0.06 0.06 -0.07 0.45 0.00 0.00 0.00 175.76 176.26 2buc s SER 460 N -1.50 2.26 0.02 0.00 0.15 -0.68 -4.99 113.70 108.96 2buc s SER 460 Ca -0.06 -0.35 -0.01 0.00 0.70 0.00 0.00 55.95 56.23 2buc s SER 460 Cb -0.09 -0.83 -0.04 0.00 -1.71 0.00 0.00 66.02 63.35 2buc s SER 460 CO 0.01 -0.14 0.16 -0.36 1.20 0.00 0.00 173.24 174.11 2buc s PHE 461 N 1.71 3.45 1.15 3.44 0.40 -1.26 -0.58 117.98 126.29 2buc s PHE 461 Ca 0.04 0.27 -0.17 0.00 -0.60 0.00 0.00 56.93 56.47 2buc s PHE 461 Cb -0.13 -1.77 0.26 0.00 0.51 0.00 0.00 43.02 41.89 2buc s PHE 461 CO -0.08 0.60 1.08 -1.54 0.70 0.00 0.00 175.22 175.98 2buc s SER 462 N -2.09 1.33 0.17 1.36 1.04 0.20 -4.87 113.70 110.83 2buc s SER 462 Ca 0.29 0.90 -0.15 0.00 0.48 0.00 0.00 55.95 57.47 2buc s SER 462 Cb -0.13 -1.35 0.13 0.00 0.10 0.00 0.00 66.02 64.78 2buc s SER 462 CO 0.20 -3.90 1.69 0.78 0.98 0.00 0.00 173.24 173.00 2buc h ASN 463 N -2.42 -0.17 -0.49 7.02 -0.26 -1.72 -1.37 115.58 116.16 2buc h ASN 463 Ca -0.50 0.10 -0.07 0.00 -0.56 0.00 0.00 56.30 55.27 2buc h ASN 463 Cb 1.32 0.18 -0.04 0.00 -1.06 0.00 0.00 38.32 38.71 2buc h ASN 463 CO 0.44 -0.05 0.06 0.29 -1.06 0.00 0.00 177.43 177.11 2buc n LYS 464 N -5.20 3.73 -3.80 0.81 5.02 -1.26 -4.94 118.16 112.52 2buc n LYS 464 Ca 0.03 -3.04 -0.27 0.00 -2.02 0.00 0.00 58.31 53.02 2buc n LYS 464 Cb 0.23 -2.08 0.04 0.00 -0.02 0.00 0.00 35.03 33.19 2buc n LYS 464 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2buc n ALA 465 N -0.08 -1.50 -0.02 7.82 0.00 -0.52 -4.91 120.51 121.30 2buc n ALA 465 Ca 0.29 0.13 -0.07 0.00 0.00 0.00 0.00 53.44 53.78 2buc n ALA 465 Cb 1.13 -3.92 -0.13 0.00 0.00 0.00 0.00 19.45 16.53 2buc n ALA 465 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2buc n LYS 466 N -4.61 0.63 -4.14 0.00 5.02 -1.26 -4.70 118.16 109.10 2buc n LYS 466 Ca -0.06 0.28 -0.12 0.00 -2.02 0.00 0.00 58.31 56.39 2buc n LYS 466 Cb 0.57 -1.79 -0.11 0.00 -0.02 0.00 0.00 35.03 33.69 2buc n LYS 466 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2buc s TYR 467 N -2.64 0.88 -0.10 2.13 2.02 -1.26 -0.61 117.35 117.77 2buc s TYR 467 Ca -0.04 -0.72 -0.09 0.00 -0.37 0.00 0.00 57.07 55.85 2buc s TYR 467 Cb 0.08 -0.50 0.03 0.00 -0.40 0.00 0.00 41.96 41.16 2buc s TYR 467 CO 0.82 -0.09 0.25 1.52 -1.57 0.00 0.00 175.55 176.49 2buc s TYR 468 N -2.61 -0.28 0.00 2.71 1.13 -1.03 -0.63 117.35 116.64 2buc s TYR 468 Ca 0.04 0.68 -0.24 0.00 -1.41 0.00 0.00 57.07 56.14 2buc s TYR 468 Cb -0.02 0.09 -0.05 0.00 -1.10 0.00 0.00 41.96 40.89 2buc s TYR 468 CO -0.02 -0.14 0.71 -1.14 -2.51 0.00 0.00 175.55 172.46 2buc s GLN 469 N 0.17 4.44 -0.20 -3.49 0.74 0.26 -0.74 119.66 120.84 2buc s GLN 469 Ca -0.00 0.94 -0.06 0.00 0.05 0.00 0.00 55.36 56.30 2buc s GLN 469 Cb -0.02 -3.38 -0.03 0.00 1.10 0.00 0.00 33.01 30.68 2buc s GLN 469 CO 0.00 0.24 0.01 -0.51 -0.55 0.00 0.00 175.29 174.48 2buc s LEU 470 N 0.16 3.35 -0.32 3.68 1.43 0.34 -1.68 118.68 125.65 2buc s LEU 470 Ca 0.37 -0.16 -0.08 0.00 -1.03 0.00 0.00 54.13 53.23 2buc s LEU 470 Cb -0.19 -1.85 0.02 0.00 0.03 0.00 0.00 46.19 44.19 2buc s LEU 470 CO 0.20 0.07 0.12 -0.13 0.23 0.00 0.00 176.35 176.85 2buc s ARG 471 N 0.96 2.98 -0.23 1.70 3.00 0.69 -1.74 118.95 126.30 2buc s ARG 471 Ca 0.02 -0.95 -0.11 0.00 0.00 0.00 0.00 55.73 54.69 2buc s ARG 471 Cb -0.14 -3.50 -0.05 0.00 0.00 0.00 0.00 34.95 31.26 2buc s ARG 471 CO 0.02 -0.54 0.18 0.00 0.00 0.00 0.00 175.30 174.96 2buc n PHE 473 N 4.25 0.00 0.00 0.00 3.01 -0.65 -1.33 117.46 122.74 2buc n PHE 473 Ca -0.14 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.32 2buc n PHE 473 Cb 0.52 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.99 2buc n PHE 473 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2buc n GLY 474 N 0.74 -0.79 0.03 1.37 0.00 -1.24 0.96 105.19 106.25 2buc n GLY 474 Ca 0.04 -1.34 0.13 0.00 0.00 0.00 0.00 46.02 44.84 2buc n GLY 474 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2buc n PRO 475 N -1.03 0.08 -0.18 1.61 -0.04 -0.77 -0.51 135.00 134.16 2buc n PRO 475 Ca 0.00 0.11 -0.03 0.00 -0.04 0.00 0.00 63.50 63.54 2buc n PRO 475 Cb 0.00 -1.60 0.02 0.00 -0.04 0.00 0.00 33.50 31.89 2buc n PRO 475 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2buc n GLY 476 N 1.18 -1.50 3.77 0.55 0.00 0.13 -4.54 105.19 104.78 2buc n GLY 476 Ca 0.06 -1.62 -0.41 0.00 0.00 0.00 0.00 46.02 44.05 2buc n GLY 476 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2buc s LEU 477 N 0.00 4.39 0.23 0.99 1.43 -1.26 -4.55 118.68 119.92 2buc s LEU 477 Ca 0.08 2.78 -0.31 0.00 -1.03 0.00 0.00 54.13 55.66 2buc s LEU 477 Cb -0.00 -3.65 -0.14 0.00 0.03 0.00 0.00 46.19 42.42 2buc s LEU 477 CO 0.06 -0.65 1.23 -2.65 0.23 0.00 0.00 176.35 174.57 2buc n PRO 478 N 0.96 1.59 -4.25 1.29 -0.02 -1.26 -4.76 135.00 128.56 2buc n PRO 478 Ca 0.01 0.56 -0.21 0.00 -2.02 0.00 0.00 63.50 61.85 2buc n PRO 478 Cb 0.41 -2.10 -0.16 0.00 -0.02 0.00 0.00 33.50 31.62 2buc n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2buc s LEU 479 N 0.28 1.39 -0.17 2.45 2.96 -0.44 -4.21 118.68 120.94 2buc s LEU 479 Ca 0.67 -0.17 0.00 0.00 -0.22 0.00 0.00 54.13 54.41 2buc s LEU 479 Cb -0.73 -0.54 0.01 0.00 0.50 0.00 0.00 46.19 45.43 2buc s LEU 479 CO 0.54 -0.04 -0.17 -0.31 -1.32 0.00 0.00 176.35 175.04 2buc s TYR 480 N 0.89 2.78 0.15 5.38 1.51 0.77 -0.39 117.35 128.45 2buc s TYR 480 Ca -0.11 -1.38 0.06 0.00 -1.01 0.00 0.00 57.07 54.62 2buc s TYR 480 Cb -0.15 -1.92 -0.04 0.00 -0.11 0.00 0.00 41.96 39.74 2buc s TYR 480 CO 0.01 -0.67 -0.13 0.95 -1.11 0.00 0.00 175.55 174.59 2buc s THR 481 N 1.14 1.38 -0.04 -0.71 -4.23 -0.71 -0.53 115.64 111.93 2buc s THR 481 Ca 0.01 -1.97 0.05 0.00 -1.18 0.00 0.00 61.69 58.59 2buc s THR 481 Cb -0.14 -1.78 -0.02 0.00 1.34 0.00 0.00 72.50 71.89 2buc s THR 481 CO -0.07 -0.58 -0.17 -0.22 -0.54 0.00 0.00 174.62 173.03 2buc s LEU 482 N -2.94 2.56 0.30 4.79 2.96 -0.97 -0.50 118.68 124.88 2buc s LEU 482 Ca 0.15 -0.27 0.03 0.00 -0.22 0.00 0.00 54.13 53.82 2buc s LEU 482 Cb -0.01 -1.50 -0.06 0.00 0.50 0.00 0.00 46.19 45.12 2buc s LEU 482 CO 0.03 0.34 0.08 -1.00 -1.32 0.00 0.00 176.35 174.47 2buc s HIS 483 N -0.68 1.80 -0.06 5.38 3.76 0.08 -0.90 115.29 124.67 2buc s HIS 483 Ca 0.11 -1.06 0.04 0.00 -0.15 0.00 0.00 55.06 54.00 2buc s HIS 483 Cb -0.11 -1.13 -0.02 0.00 1.11 0.00 0.00 32.58 32.43 2buc s HIS 483 CO 0.00 -0.14 -0.19 0.45 -0.85 0.00 0.00 174.74 174.01 2buc s SER 484 N -3.43 3.58 0.44 1.40 0.15 -1.19 -2.47 113.70 112.17 2buc s SER 484 Ca 0.36 -0.36 0.24 0.00 0.70 0.00 0.00 55.95 56.89 2buc s SER 484 Cb 0.08 -0.92 0.86 0.00 -1.71 0.00 0.00 66.02 64.34 2buc s SER 484 CO 0.15 0.28 1.80 0.28 1.20 0.00 0.00 173.24 176.94 2buc h SER 485 N 5.84 0.00 -0.01 5.45 0.02 -1.14 0.16 113.55 123.87 2buc h SER 485 Ca -0.37 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.53 2buc h SER 485 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2buc h SER 485 CO 0.50 0.22 -0.16 0.77 -1.14 0.00 0.00 176.83 177.02 2buc h SER 486 N 0.00 0.16 0.00 3.07 4.64 -1.92 -3.38 113.55 116.12 2buc h SER 486 Ca -0.00 -0.74 -0.09 0.00 -0.47 0.00 0.00 61.79 60.49 2buc h SER 486 Cb 0.79 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.81 2buc h SER 486 CO 0.03 0.88 -1.98 -1.54 -0.87 0.00 0.00 176.83 173.35 2buc n SER 487 N -4.59 0.56 -0.69 4.97 3.41 -1.23 -5.00 113.62 111.06 2buc n SER 487 Ca -0.09 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.43 2buc n SER 487 Cb 0.45 1.63 -0.04 0.00 -0.26 0.00 0.00 64.21 65.99 2buc n SER 487 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2buc n ASP 488 N -2.31 -4.70 -4.78 4.04 9.92 0.55 -5.01 116.55 114.28 2buc n ASP 488 Ca -0.10 0.22 -0.37 0.00 -0.53 0.00 0.00 54.79 54.00 2buc n ASP 488 Cb 0.66 -2.99 -0.06 0.00 -0.64 0.00 0.00 41.12 38.10 2buc n ASP 488 CO 0.00 0.00 0.00 -0.75 0.13 0.00 0.00 177.20 176.58 2buc s LYS 489 N -2.52 4.51 -0.64 -1.24 2.20 -1.26 -4.82 119.74 115.97 2buc s LYS 489 Ca 0.00 1.43 -0.27 0.00 -0.36 0.00 0.00 55.97 56.77 2buc s LYS 489 Cb 0.00 -2.81 -0.00 0.00 -1.51 0.00 0.00 37.83 33.51 2buc s LYS 489 CO 0.00 0.19 1.63 -2.00 -0.36 0.00 0.00 175.35 174.82 2buc s GLU 490 N -2.04 2.88 0.07 4.03 2.12 -1.26 -3.20 118.70 121.31 2buc s GLU 490 Ca 0.51 0.34 -0.30 0.00 0.36 0.00 0.00 54.97 55.88 2buc s GLU 490 Cb -0.21 -4.29 -0.18 0.00 0.26 0.00 0.00 34.13 29.71 2buc s GLU 490 CO 0.27 -2.45 1.64 -0.07 -0.54 0.00 0.00 175.26 174.11 2buc h LEU 491 N 14.97 -0.57 -7.00 2.70 4.07 -1.36 -3.47 115.31 124.65 2buc h LEU 491 Ca -0.27 0.01 -0.00 0.00 0.08 0.00 0.00 57.88 57.70 2buc h LEU 491 Cb 1.12 0.15 -0.13 0.00 1.08 0.00 0.00 40.66 42.87 2buc h LEU 491 CO 1.23 -0.40 0.26 0.00 -1.08 0.00 0.00 178.44 178.45 2buc s ARG 492 N -6.04 1.17 -0.31 1.13 1.70 -1.23 -5.04 118.95 110.32 2buc s ARG 492 Ca -0.16 -0.36 -0.24 0.00 -0.47 0.00 0.00 55.73 54.50 2buc s ARG 492 Cb 0.04 0.54 0.00 0.00 -0.57 0.00 0.00 34.95 34.96 2buc s ARG 492 CO 0.63 -0.50 0.79 0.08 -1.08 0.00 0.00 175.30 175.22 2buc s VAL 493 N -3.35 4.78 0.01 4.99 1.01 -1.26 -2.28 120.40 124.30 2buc s VAL 493 Ca 0.00 1.17 -0.13 0.00 0.00 0.00 0.00 61.98 63.03 2buc s VAL 493 Cb -0.01 -4.16 -0.33 0.00 0.00 0.00 0.00 36.38 31.88 2buc s VAL 493 CO -0.10 -0.27 0.91 -0.07 0.00 0.00 0.00 175.10 175.58 2buc h LEU 494 N 9.49 0.73 -7.03 3.92 3.38 -1.16 -3.46 115.31 121.19 2buc h LEU 494 Ca -0.24 -0.86 0.04 0.00 0.09 0.00 0.00 57.88 56.90 2buc h LEU 494 Cb 1.10 -0.24 -0.22 0.00 0.09 0.00 0.00 40.66 41.39 2buc h LEU 494 CO 0.89 1.69 -0.17 -0.70 0.09 0.00 0.00 178.44 180.24 2buc s GLU 495 N -2.60 0.53 0.00 1.13 2.56 -0.83 -4.98 118.70 114.51 2buc s GLU 495 Ca -0.10 1.35 0.08 0.00 0.00 0.00 0.00 54.97 56.29 2buc s GLU 495 Cb 0.05 0.72 0.07 0.00 2.00 0.00 0.00 34.13 36.97 2buc s GLU 495 CO 0.91 -0.21 0.78 -0.40 -0.56 0.00 0.00 175.26 175.78 2buc n ASP 496 N 5.36 1.72 -3.29 -1.70 5.68 -1.26 -0.16 116.55 122.89 2buc n ASP 496 Ca -0.12 -1.37 -0.24 0.00 -0.50 0.00 0.00 54.79 52.56 2buc n ASP 496 Cb 0.50 -0.01 0.04 0.00 -1.14 0.00 0.00 41.12 40.51 2buc n ASP 496 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2buc n ASN 497 N 0.41 -5.88 0.13 -1.12 3.02 -1.26 -4.83 115.26 105.72 2buc n ASN 497 Ca 0.05 -0.41 0.00 0.00 -0.03 0.00 0.00 54.58 54.19 2buc n ASN 497 Cb 0.21 -4.72 0.30 0.00 -0.61 0.00 0.00 39.78 34.96 2buc n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2buc h SER 498 N -1.78 0.16 -0.49 6.41 4.64 -1.95 -1.62 113.55 118.92 2buc h SER 498 Ca -0.54 -0.06 -0.06 0.00 -0.47 0.00 0.00 61.79 60.67 2buc h SER 498 Cb 1.36 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 63.38 2buc h SER 498 CO 0.57 0.50 0.10 0.00 -0.87 0.00 0.00 176.83 177.14 2buc h ALA 499 N 1.51 1.15 -0.12 5.18 0.00 -1.98 -1.68 119.26 123.32 2buc h ALA 499 Ca 0.02 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.54 2buc h ALA 499 Cb 0.69 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2buc h ALA 499 CO 0.05 0.57 -0.60 1.25 0.00 0.00 0.00 179.25 180.51 2buc h LEU 500 N 0.82 0.45 -0.85 0.00 5.85 -1.74 -3.11 115.31 116.72 2buc h LEU 500 Ca 0.17 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 2buc h LEU 500 Cb 0.35 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 2buc h LEU 500 CO 0.00 0.95 0.47 -0.78 -0.34 0.00 0.00 178.44 178.74 2buc h ASP 501 N 0.30 1.06 -0.76 1.25 3.58 -0.82 -1.86 116.42 119.17 2buc h ASP 501 Ca -0.01 -0.10 -0.06 0.00 0.42 0.00 0.00 57.03 57.29 2buc h ASP 501 Cb 1.13 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 41.88 2buc h ASP 501 CO 0.10 0.85 0.25 0.50 -2.88 0.00 0.00 179.24 178.06 2buc h LYS 502 N 1.19 1.17 -0.33 0.28 1.63 -1.32 -3.05 116.57 116.14 2buc h LYS 502 Ca 0.30 -0.25 -0.15 0.00 -0.85 0.00 0.00 60.65 59.71 2buc h LYS 502 Cb 0.03 -0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 31.48 2buc h LYS 502 CO -0.05 0.99 -0.38 0.52 -3.45 0.00 0.00 179.45 177.08 2buc h MET 503 N 1.12 0.78 0.00 1.90 2.86 -1.43 -3.31 114.93 116.85 2buc h MET 503 Ca 0.25 -0.40 -0.07 0.00 -2.06 0.00 0.00 59.70 57.42 2buc h MET 503 Cb 0.30 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 2buc h MET 503 CO -0.01 1.02 -0.33 -0.07 1.06 0.00 0.00 176.91 178.59 2buc h LEU 504 N 0.64 0.00 -0.00 1.22 3.38 -1.25 -2.51 115.31 116.79 2buc h LEU 504 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2buc h LEU 504 Cb 0.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 2buc h LEU 504 CO 0.09 0.33 0.00 0.00 0.09 0.00 0.00 178.44 178.94 2buc n GLN 505 N -3.33 0.00 -0.30 1.13 10.64 -1.16 -2.06 117.38 122.30 2buc n GLN 505 Ca 0.01 0.08 0.10 0.00 -1.83 0.00 0.00 57.00 55.36 2buc n GLN 505 Cb 0.55 -1.50 0.27 0.00 -0.86 0.00 0.00 30.24 28.71 2buc n GLN 505 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 2buc n ASP 506 N -1.51 3.30 -4.04 2.61 2.03 -0.95 -4.93 116.55 113.07 2buc n ASP 506 Ca 0.06 -1.99 -0.16 0.00 0.52 0.00 0.00 54.79 53.21 2buc n ASP 506 Cb 0.29 -0.40 -0.13 0.00 -0.72 0.00 0.00 41.12 40.16 2buc n ASP 506 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2buc s VAL 507 N -1.20 0.65 -1.13 5.18 0.11 -0.87 -4.06 120.40 119.08 2buc s VAL 507 Ca 0.41 -0.69 -0.21 0.00 -2.93 0.00 0.00 61.98 58.56 2buc s VAL 507 Cb 0.22 -0.61 0.02 0.00 -1.53 0.00 0.00 36.38 34.47 2buc s VAL 507 CO 0.29 -0.05 1.72 -1.10 -3.33 0.00 0.00 175.10 172.63 2buc s GLN 508 N -0.81 3.36 0.28 1.54 -0.21 0.57 -4.94 119.66 119.45 2buc s GLN 508 Ca -0.02 -1.31 -0.29 0.00 0.02 0.00 0.00 55.36 53.77 2buc s GLN 508 Cb -0.06 -5.35 -0.09 0.00 1.00 0.00 0.00 33.01 28.50 2buc s GLN 508 CO 0.00 -2.74 1.02 -1.64 -2.12 0.00 0.00 175.29 169.81 2buc s MET 509 N 5.32 4.69 0.75 2.91 -1.94 -1.26 -4.22 119.30 125.53 2buc s MET 509 Ca 0.57 1.62 -0.12 0.00 -1.71 0.00 0.00 55.69 56.06 2buc s MET 509 Cb 0.00 -3.15 0.04 0.00 2.01 0.00 0.00 34.83 33.73 2buc s MET 509 CO 0.02 0.31 1.11 -1.25 -0.01 0.00 0.00 175.02 175.20 2buc s PRO 510 N -1.47 2.53 0.06 2.03 0.04 -1.26 -4.47 135.00 132.46 2buc s PRO 510 Ca 0.45 0.44 0.05 0.00 0.04 0.00 0.00 61.00 61.98 2buc s PRO 510 Cb -0.28 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 2buc s PRO 510 CO 0.35 -1.27 -0.07 -1.54 0.04 0.00 0.00 177.00 174.51 2buc s SER 511 N -4.29 4.58 -0.27 6.66 1.04 -0.83 -4.94 113.70 115.65 2buc s SER 511 Ca 0.59 -0.26 -0.05 0.00 0.48 0.00 0.00 55.95 56.71 2buc s SER 511 Cb -0.12 -0.99 0.01 0.00 0.10 0.00 0.00 66.02 65.02 2buc s SER 511 CO 0.52 0.22 0.03 -0.75 0.98 0.00 0.00 173.24 174.24 2buc s LYS 512 N -1.93 3.08 -0.22 4.02 2.20 -1.26 -0.64 119.74 124.98 2buc s LYS 512 Ca 0.21 -0.85 -0.10 0.00 -0.36 0.00 0.00 55.97 54.87 2buc s LYS 512 Cb -0.11 -3.23 -0.05 0.00 -1.51 0.00 0.00 37.83 32.93 2buc s LYS 512 CO 0.12 -0.40 0.13 0.21 -0.36 0.00 0.00 175.35 175.06 2buc s LYS 513 N 1.46 4.05 -0.23 4.03 2.20 -0.63 -4.96 119.74 125.66 2buc s LYS 513 Ca 0.02 -0.29 -0.07 0.00 -0.36 0.00 0.00 55.97 55.28 2buc s LYS 513 Cb -0.17 -3.45 -0.03 0.00 -1.51 0.00 0.00 37.83 32.68 2buc s LYS 513 CO 0.00 0.12 0.06 -0.51 -0.36 0.00 0.00 175.35 174.66 2buc s LEU 514 N 0.85 3.48 0.35 5.43 1.02 -1.26 -1.58 118.68 126.98 2buc s LEU 514 Ca 0.07 -0.15 0.01 0.00 0.02 0.00 0.00 54.13 54.08 2buc s LEU 514 Cb -0.13 -1.92 -0.00 0.00 0.02 0.00 0.00 46.19 44.16 2buc s LEU 514 CO 0.03 0.02 0.43 -0.62 0.02 0.00 0.00 176.35 176.23 2buc s ASP 515 N 1.29 1.26 0.02 2.29 2.15 -0.65 -5.03 116.67 118.01 2buc s ASP 515 Ca 0.05 -1.61 0.05 0.00 0.43 0.00 0.00 52.55 51.46 2buc s ASP 515 Cb -0.15 0.65 -0.02 0.00 -0.30 0.00 0.00 42.92 43.11 2buc s ASP 515 CO 0.03 -1.26 -0.15 0.68 -0.17 0.00 0.00 175.17 174.30 2buc s VAL 516 N -3.05 1.16 0.19 1.11 -7.23 -1.26 -0.92 120.40 110.40 2buc s VAL 516 Ca 0.34 -0.90 0.06 0.00 -1.81 0.00 0.00 61.98 59.67 2buc s VAL 516 Cb 0.00 -1.03 -0.05 0.00 0.56 0.00 0.00 36.38 35.87 2buc s VAL 516 CO 0.24 0.12 -0.12 0.27 -0.31 0.00 0.00 175.10 175.30 2buc s ILE 517 N -0.69 1.48 -0.20 -0.62 -4.36 -0.77 -4.96 121.20 111.09 2buc s ILE 517 Ca 0.03 -2.14 -0.09 0.00 -0.26 0.00 0.00 60.65 58.19 2buc s ILE 517 Cb -0.07 -1.99 -0.05 0.00 1.25 0.00 0.00 42.46 41.60 2buc s ILE 517 CO 0.01 -0.64 0.10 0.20 0.24 0.00 0.00 174.94 174.85 2buc s ASN 518 N -3.26 5.90 -0.02 4.36 -0.87 -1.26 -0.46 114.94 119.33 2buc s ASN 518 Ca 0.21 0.14 0.03 0.00 -1.57 0.00 0.00 52.86 51.66 2buc s ASN 518 Cb 0.01 -2.03 0.00 0.00 -0.02 0.00 0.00 41.25 39.21 2buc s ASN 518 CO 0.05 0.16 -0.10 -0.76 -2.57 0.00 0.00 177.10 173.88 2buc s LEU 519 N 0.45 1.83 -1.60 0.60 1.43 0.63 -4.85 118.68 117.17 2buc s LEU 519 Ca 0.06 -0.19 -0.07 0.00 -1.03 0.00 0.00 54.13 52.89 2buc s LEU 519 Cb -0.12 -0.57 0.07 0.00 0.03 0.00 0.00 46.19 45.61 2buc s LEU 519 CO -0.00 0.08 0.19 0.00 0.23 0.00 0.00 176.35 176.84 2buc n HIS 520 N 3.22 -1.18 -2.19 0.29 -0.00 -1.26 -0.47 115.22 113.63 2buc n HIS 520 Ca -0.18 0.61 -0.15 0.00 -0.00 0.00 0.00 57.72 58.01 2buc n HIS 520 Cb 0.54 -2.40 -0.01 0.00 -0.00 0.00 0.00 29.99 28.12 2buc n HIS 520 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2buc n GLY 521 N -2.05 -0.05 2.80 -1.39 0.00 -1.26 -5.01 105.19 98.23 2buc n GLY 521 Ca -0.18 -0.27 -0.15 0.00 0.00 0.00 0.00 46.02 45.42 2buc n GLY 521 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2buc s THR 522 N -2.72 -0.06 -0.14 2.61 2.01 0.38 -5.13 115.64 112.60 2buc s THR 522 Ca 0.00 0.21 -0.25 0.00 0.31 0.00 0.00 61.69 61.96 2buc s THR 522 Cb 0.00 -0.11 -0.02 0.00 0.01 0.00 0.00 72.50 72.38 2buc s THR 522 CO 0.00 0.09 0.80 -1.59 -0.69 0.00 0.00 174.62 173.22 2buc s LYS 523 N 1.07 4.34 0.08 4.92 -2.85 -1.26 -0.27 119.74 125.76 2buc s LYS 523 Ca -0.09 0.98 0.09 0.00 -1.00 0.00 0.00 55.97 55.95 2buc s LYS 523 Cb -0.12 -3.54 -0.03 0.00 -2.06 0.00 0.00 37.83 32.07 2buc s LYS 523 CO -0.03 -0.22 -0.21 -0.06 0.10 0.00 0.00 175.35 174.92 2buc s PHE 524 N 1.78 2.46 0.13 1.78 0.40 0.39 -4.96 117.98 119.97 2buc s PHE 524 Ca 0.38 -0.31 -0.22 0.00 -0.60 0.00 0.00 56.93 56.18 2buc s PHE 524 Cb -0.17 -1.38 -0.07 0.00 0.51 0.00 0.00 43.02 41.90 2buc s PHE 524 CO 0.14 0.28 0.67 -1.58 0.70 0.00 0.00 175.22 175.43 2buc s TRP 525 N -0.98 3.84 0.08 0.36 0.52 -1.26 -1.84 118.94 119.66 2buc s TRP 525 Ca 0.15 1.44 -0.03 0.00 0.02 0.00 0.00 56.10 57.68 2buc s TRP 525 Cb -0.10 -2.63 -0.03 0.00 -1.15 0.00 0.00 33.47 29.56 2buc s TRP 525 CO 0.06 0.53 0.05 1.52 0.02 0.00 0.00 176.95 179.13 2buc s TYR 526 N -1.17 0.50 0.09 -1.98 -0.85 -0.10 -2.11 117.35 111.74 2buc s TYR 526 Ca 0.33 -0.98 0.05 0.00 -0.52 0.00 0.00 57.07 55.95 2buc s TYR 526 Cb -0.21 -0.32 -0.03 0.00 0.38 0.00 0.00 41.96 41.78 2buc s TYR 526 CO 0.22 -0.46 -0.12 1.14 -1.52 0.00 0.00 175.55 174.81 2buc s GLN 527 N -3.94 0.86 -0.07 -3.49 -2.07 -0.44 -1.63 119.66 108.89 2buc s GLN 527 Ca 0.11 -1.09 -0.01 0.00 -1.82 0.00 0.00 55.36 52.55 2buc s GLN 527 Cb 0.07 -0.70 0.03 0.00 -1.09 0.00 0.00 33.01 31.32 2buc s GLN 527 CO -0.07 0.13 -0.02 -1.64 -1.32 0.00 0.00 175.29 172.37 2buc s MET 528 N -2.36 0.81 -0.52 9.60 -1.94 -0.62 -1.32 119.30 122.95 2buc s MET 528 Ca 0.03 -0.01 -0.22 0.00 -1.71 0.00 0.00 55.69 53.78 2buc s MET 528 Cb -0.06 -1.02 0.05 0.00 2.01 0.00 0.00 34.83 35.80 2buc s MET 528 CO 0.01 -0.23 0.80 0.42 -0.01 0.00 0.00 175.02 176.01 2buc s ILE 529 N 1.62 4.61 -0.14 2.53 1.01 0.13 -1.60 121.20 129.37 2buc s ILE 529 Ca 0.00 -0.00 -0.09 0.00 0.00 0.00 0.00 60.65 60.56 2buc s ILE 529 Cb -0.13 -4.42 -0.04 0.00 0.01 0.00 0.00 42.46 37.88 2buc s ILE 529 CO -0.04 -0.95 0.16 -0.76 0.00 0.00 0.00 174.94 173.36 2buc s LEU 530 N 3.36 4.33 0.76 2.97 1.43 0.18 -2.29 118.68 129.43 2buc s LEU 530 Ca 0.24 0.43 -0.15 0.00 -1.03 0.00 0.00 54.13 53.62 2buc s LEU 530 Cb -0.15 -2.13 -0.00 0.00 0.03 0.00 0.00 46.19 43.94 2buc s LEU 530 CO 0.17 0.32 0.69 -2.65 0.23 0.00 0.00 176.35 175.10 2buc n PRO 531 N 2.52 0.25 -1.74 1.29 -0.02 -1.26 -1.97 135.00 134.08 2buc n PRO 531 Ca -0.18 0.14 -0.40 0.00 -2.02 0.00 0.00 63.50 61.04 2buc n PRO 531 Cb 0.54 -1.99 0.02 0.00 -0.02 0.00 0.00 33.50 32.05 2buc n PRO 531 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2buc n PRO 532 N -1.41 2.03 -3.50 0.52 -0.02 -1.26 -3.33 135.00 128.02 2buc n PRO 532 Ca 0.11 0.73 -0.23 0.00 -2.02 0.00 0.00 63.50 62.08 2buc n PRO 532 Cb 0.50 -2.53 0.05 0.00 -0.02 0.00 0.00 33.50 31.51 2buc n PRO 532 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2buc n HIS 533 N -0.37 -2.14 -2.04 6.00 8.25 -1.26 -4.90 115.22 118.76 2buc n HIS 533 Ca 0.07 0.69 -0.42 0.00 -0.26 0.00 0.00 57.72 57.79 2buc n HIS 533 Cb 0.41 -3.91 -0.03 0.00 1.12 0.00 0.00 29.99 27.58 2buc n HIS 533 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 2buc s PHE 534 N -3.46 2.49 -0.23 4.41 5.36 -1.21 -5.00 117.98 120.33 2buc s PHE 534 Ca 0.38 0.47 -0.04 0.00 -0.96 0.00 0.00 56.93 56.78 2buc s PHE 534 Cb -0.09 -3.85 -0.00 0.00 -0.34 0.00 0.00 43.02 38.73 2buc s PHE 534 CO 0.80 -3.38 -0.04 0.34 -1.46 0.00 0.00 175.22 171.48 2buc s ASP 535 N 2.40 4.30 0.55 6.13 3.68 -1.26 -4.99 116.67 127.48 2buc s ASP 535 Ca 0.70 -0.49 0.33 0.00 2.13 0.00 0.00 52.55 55.22 2buc s ASP 535 Cb -0.36 -1.73 1.51 0.00 -1.45 0.00 0.00 42.92 40.90 2buc s ASP 535 CO 0.30 -0.05 2.05 0.11 0.13 0.00 0.00 175.17 177.71 2buc h LYS 536 N 8.10 0.00 0.14 4.34 1.57 -1.98 -3.17 116.57 125.58 2buc h LYS 536 Ca -0.40 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.18 2buc h LYS 536 Cb 1.15 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.48 2buc h LYS 536 CO 0.60 0.07 -0.86 0.66 -0.57 0.00 0.00 179.45 179.34 2buc h SER 537 N 0.00 0.51 -4.14 0.86 4.64 -1.94 -3.35 113.55 110.13 2buc h SER 537 Ca -0.00 -0.94 -0.50 0.00 -0.47 0.00 0.00 61.79 59.88 2buc h SER 537 Cb 0.41 -0.17 0.08 0.00 -0.31 0.00 0.00 62.40 62.41 2buc h SER 537 CO 0.01 1.41 0.40 -0.75 -0.87 0.00 0.00 176.83 177.03 2buc s LYS 538 N -2.50 3.19 -0.25 4.77 2.20 -1.20 -4.85 119.74 121.10 2buc s LYS 538 Ca -0.13 1.45 -0.12 0.00 -0.36 0.00 0.00 55.97 56.80 2buc s LYS 538 Cb 0.01 -2.00 -0.05 0.00 -1.51 0.00 0.00 37.83 34.29 2buc s LYS 538 CO 0.84 -0.95 0.24 0.15 -0.36 0.00 0.00 175.35 175.28 2buc s LYS 539 N -3.69 4.05 -0.01 4.03 -0.14 -1.26 -4.49 119.74 118.24 2buc s LYS 539 Ca 0.69 -0.15 0.01 0.00 -1.36 0.00 0.00 55.97 55.15 2buc s LYS 539 Cb -0.21 -3.59 -0.04 0.00 -1.68 0.00 0.00 37.83 32.32 2buc s LYS 539 CO 0.33 -0.07 0.01 0.71 -0.76 0.00 0.00 175.35 175.58 2buc s TYR 540 N 1.42 3.11 0.45 3.18 1.51 0.38 -4.76 117.35 122.65 2buc s TYR 540 Ca 0.10 0.11 -0.23 0.00 -1.01 0.00 0.00 57.07 56.05 2buc s TYR 540 Cb -0.15 -1.69 -0.08 0.00 -0.11 0.00 0.00 41.96 39.94 2buc s TYR 540 CO 0.07 0.48 1.09 -1.25 -1.11 0.00 0.00 175.55 174.83 2buc s PRO 541 N -1.56 3.91 -0.13 -1.71 0.04 -1.26 -0.10 135.00 134.19 2buc s PRO 541 Ca 0.20 1.57 -0.01 0.00 0.04 0.00 0.00 61.00 62.80 2buc s PRO 541 Cb -0.12 -2.37 -0.02 0.00 0.04 0.00 0.00 34.50 32.03 2buc s PRO 541 CO 0.10 -0.38 -0.11 -1.17 0.04 0.00 0.00 177.00 175.49 2buc s LEU 542 N -3.01 2.87 -0.17 -3.56 0.20 -0.54 -1.79 118.68 112.69 2buc s LEU 542 Ca 0.62 -0.26 0.01 0.00 0.69 0.00 0.00 54.13 55.20 2buc s LEU 542 Cb -0.23 -1.65 0.01 0.00 -0.43 0.00 0.00 46.19 43.89 2buc s LEU 542 CO 0.28 0.18 -0.19 -0.22 -0.29 0.00 0.00 176.35 176.12 2buc s LEU 543 N 0.25 2.21 -0.25 -0.68 2.96 0.40 0.01 118.68 123.57 2buc s LEU 543 Ca -0.07 -0.60 -0.21 0.00 -0.22 0.00 0.00 54.13 53.02 2buc s LEU 543 Cb -0.15 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 45.03 2buc s LEU 543 CO 0.05 0.03 0.68 -0.63 -1.32 0.00 0.00 176.35 175.16 2buc s ILE 544 N 1.13 4.94 -0.26 6.68 -1.09 0.11 -0.96 121.20 131.76 2buc s ILE 544 Ca 0.01 1.25 -0.17 0.00 -2.23 0.00 0.00 60.65 59.51 2buc s ILE 544 Cb -0.14 -3.98 -0.03 0.00 -1.58 0.00 0.00 42.46 36.73 2buc s ILE 544 CO -0.08 0.00 0.48 -0.70 -1.23 0.00 0.00 174.94 173.41 2buc s GLU 545 N 2.59 4.06 0.04 2.79 2.12 0.17 -0.34 118.70 130.12 2buc s GLU 545 Ca 0.29 0.25 0.07 0.00 0.36 0.00 0.00 54.97 55.93 2buc s GLU 545 Cb -0.15 -3.65 -0.02 0.00 0.26 0.00 0.00 34.13 30.56 2buc s GLU 545 CO 0.08 -0.33 -0.20 0.54 -0.54 0.00 0.00 175.26 174.81 2buc s VAL 546 N 2.24 1.58 0.12 3.70 0.11 0.21 -4.34 120.40 124.02 2buc s VAL 546 Ca 0.20 -1.13 0.00 0.00 -2.93 0.00 0.00 61.98 58.11 2buc s VAL 546 Cb -0.16 -1.37 0.00 0.00 -1.53 0.00 0.00 36.38 33.32 2buc s VAL 546 CO 0.09 0.20 0.00 0.00 -3.33 0.00 0.00 175.10 172.07 2buc n TYR 547 N 1.93 -0.34 -1.43 1.54 9.36 -1.26 -4.04 117.16 122.92 2buc n TYR 547 Ca -0.17 0.06 -0.15 0.00 3.32 0.00 0.00 57.90 60.96 2buc n TYR 547 Cb 0.53 0.08 -0.06 0.00 -0.63 0.00 0.00 39.34 39.27 2buc n TYR 547 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2buc n ALA 548 N -3.40 -0.23 -1.48 2.98 0.00 -1.26 -2.93 120.51 114.19 2buc n ALA 548 Ca 0.00 0.24 -0.34 0.00 0.00 0.00 0.00 53.44 53.34 2buc n ALA 548 Cb 0.00 -1.87 0.06 0.00 0.00 0.00 0.00 19.45 17.63 2buc n ALA 548 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2buc s GLY 549 N -2.57 2.26 0.23 0.00 0.00 -1.26 -4.82 107.32 101.16 2buc s GLY 549 Ca 0.00 0.68 -0.32 0.00 0.00 0.00 0.00 44.72 45.09 2buc s GLY 549 CO 0.00 1.06 1.66 -1.55 0.00 0.00 0.00 173.10 174.27 2buc n PRO 550 N -2.43 2.67 -0.98 2.90 -0.04 -1.26 -2.12 135.00 133.74 2buc n PRO 550 Ca 0.11 0.96 0.00 0.00 -0.04 0.00 0.00 63.50 64.53 2buc n PRO 550 Cb 0.51 -2.77 0.00 0.00 -0.04 0.00 0.00 33.50 31.20 2buc n PRO 550 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2buc s SER 552 N -2.07 6.18 -0.20 0.00 1.04 -0.90 -4.13 113.70 113.62 2buc s SER 552 Ca 0.00 0.46 -0.04 0.00 0.48 0.00 0.00 55.95 56.84 2buc s SER 552 Cb 0.00 -1.93 0.07 0.00 0.10 0.00 0.00 66.02 64.26 2buc s SER 552 CO 0.00 -0.42 0.09 -1.58 0.98 0.00 0.00 173.24 172.31 2buc s GLN 553 N -4.42 0.20 0.16 4.02 0.74 -1.26 -1.98 119.66 117.12 2buc s GLN 553 Ca 0.43 -0.25 0.20 0.00 0.05 0.00 0.00 55.36 55.78 2buc s GLN 553 Cb -0.10 -1.75 -0.04 0.00 1.10 0.00 0.00 33.01 32.22 2buc s GLN 553 CO 0.37 -0.74 0.99 0.87 -0.55 0.00 0.00 175.29 176.23 2buc h LYS 554 N 8.38 0.00 -4.16 1.67 1.79 -1.98 -3.44 116.57 118.83 2buc h LYS 554 Ca -0.16 0.00 -0.75 0.00 -2.18 0.00 0.00 60.65 57.56 2buc h LYS 554 Cb 1.11 0.00 -0.26 0.00 -1.58 0.00 0.00 32.23 31.51 2buc h LYS 554 CO 0.33 0.15 -0.28 0.08 -1.08 0.00 0.00 179.45 178.66 2buc s VAL 555 N -3.14 4.89 0.15 0.50 1.01 -1.26 -4.92 120.40 117.63 2buc s VAL 555 Ca -0.01 -1.58 0.02 0.00 0.00 0.00 0.00 61.98 60.41 2buc s VAL 555 Cb 0.09 -4.15 -0.01 0.00 0.00 0.00 0.00 36.38 32.31 2buc s VAL 555 CO 0.79 -0.83 0.16 -0.90 0.00 0.00 0.00 175.10 174.32 2buc n ASP 556 N 5.14 -0.41 -1.61 3.32 5.68 -1.26 -4.23 116.55 123.17 2buc n ASP 556 Ca -0.12 -1.96 -0.14 0.00 -0.50 0.00 0.00 54.79 52.06 2buc n ASP 556 Cb 0.40 0.88 0.16 0.00 -1.14 0.00 0.00 41.12 41.42 2buc n ASP 556 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2buc n THR 557 N -0.28 2.81 -2.90 2.12 -2.24 -0.84 -5.00 114.28 107.95 2buc n THR 557 Ca 0.03 -2.80 -0.40 0.00 -2.27 0.00 0.00 64.05 58.61 2buc n THR 557 Cb 0.27 -0.54 -0.05 0.00 -2.10 0.00 0.00 70.33 67.91 2buc n THR 557 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2buc s VAL 558 N -3.61 4.58 -0.05 2.28 1.01 -1.26 -1.84 120.40 121.51 2buc s VAL 558 Ca 0.50 1.79 -0.30 0.00 0.00 0.00 0.00 61.98 63.97 2buc s VAL 558 Cb 0.43 -4.19 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 2buc s VAL 558 CO 0.02 0.38 1.09 0.12 0.00 0.00 0.00 175.10 176.71 2buc s PHE 559 N -0.26 3.43 -0.08 5.22 5.36 0.27 -4.89 117.98 127.04 2buc s PHE 559 Ca 0.41 1.45 -0.03 0.00 -0.96 0.00 0.00 56.93 57.80 2buc s PHE 559 Cb -0.22 -3.28 0.04 0.00 -0.34 0.00 0.00 43.02 39.22 2buc s PHE 559 CO 0.26 -0.69 0.07 1.03 -1.46 0.00 0.00 175.22 174.44 2buc s ARG 560 N 1.75 -0.04 -0.96 10.12 0.52 -1.26 -4.91 118.95 124.17 2buc s ARG 560 Ca 0.53 0.27 -0.23 0.00 -0.52 0.00 0.00 55.73 55.78 2buc s ARG 560 Cb -0.22 -0.83 0.06 0.00 0.52 0.00 0.00 34.95 34.47 2buc s ARG 560 CO 0.23 -0.42 1.36 -0.51 0.02 0.00 0.00 175.30 175.98 2buc s LEU 561 N 2.17 3.74 0.00 2.53 1.02 -1.26 -4.83 118.68 122.05 2buc s LEU 561 Ca 0.04 -1.41 0.02 0.00 0.02 0.00 0.00 54.13 52.80 2buc s LEU 561 Cb -0.13 -2.54 0.02 0.00 0.02 0.00 0.00 46.19 43.56 2buc s LEU 561 CO -0.05 -1.48 0.13 -1.54 0.02 0.00 0.00 176.35 173.44 2buc n SER 562 N 8.53 2.40 0.02 2.29 3.41 -1.26 -4.99 113.62 124.02 2buc n SER 562 Ca 0.27 -2.22 -0.02 0.00 -0.26 0.00 0.00 58.87 56.64 2buc n SER 562 Cb 0.50 0.08 0.24 0.00 -0.26 0.00 0.00 64.21 64.77 2buc n SER 562 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 2buc h TRP 563 N 0.85 0.50 -0.29 7.33 7.01 -1.97 -2.83 115.95 126.54 2buc h TRP 563 Ca -0.23 -0.09 -0.06 0.00 2.11 0.00 0.00 58.89 60.62 2buc h TRP 563 Cb 0.76 -0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 27.68 2buc h TRP 563 CO 0.00 0.63 -0.09 0.00 -2.79 0.00 0.00 178.44 176.18 2buc h ALA 564 N 1.38 1.29 -0.75 2.65 0.00 -1.96 -2.04 119.26 119.84 2buc h ALA 564 Ca 0.07 -0.25 0.06 0.00 0.00 0.00 0.00 54.91 54.79 2buc h ALA 564 Cb 0.58 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 2buc h ALA 564 CO 0.04 0.47 0.44 1.15 0.00 0.00 0.00 179.25 181.35 2buc h THR 565 N 0.45 1.00 -0.28 0.00 2.02 -1.82 -1.53 112.91 112.75 2buc h THR 565 Ca 0.09 -0.28 -0.04 0.00 0.77 0.00 0.00 66.41 66.95 2buc h THR 565 Cb 0.44 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 2buc h THR 565 CO 0.02 0.15 0.02 0.22 0.37 0.00 0.00 175.52 176.30 2buc h TYR 566 N 0.81 0.53 -0.42 3.16 3.20 -1.45 -1.93 116.97 120.88 2buc h TYR 566 Ca 0.33 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 62.09 2buc h TYR 566 Cb 0.19 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.29 2buc h TYR 566 CO -0.06 0.62 0.16 -0.07 -1.64 0.00 0.00 178.16 177.17 2buc h LEU 567 N 0.29 0.54 0.04 2.82 3.38 -0.84 0.53 115.31 122.08 2buc h LEU 567 Ca 0.08 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 2buc h LEU 567 Cb 0.40 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 2buc h LEU 567 CO 0.01 0.50 -0.60 0.00 0.09 0.00 0.00 178.44 178.44 2buc h ALA 568 N 1.58 0.06 -0.20 1.53 0.00 -1.30 0.01 119.26 120.95 2buc h ALA 568 Ca 0.15 -0.76 -0.01 0.00 0.00 0.00 0.00 54.91 54.29 2buc h ALA 568 Cb 0.14 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2buc h ALA 568 CO -0.01 0.33 0.09 1.03 0.00 0.00 0.00 179.25 180.68 2buc h SER 569 N -0.78 0.26 0.02 0.00 0.87 -1.23 -2.95 113.55 109.75 2buc h SER 569 Ca -0.14 -0.14 -0.39 0.00 -1.23 0.00 0.00 61.79 59.89 2buc h SER 569 Cb 1.29 -0.07 -0.06 0.00 -0.44 0.00 0.00 62.40 63.13 2buc h SER 569 CO -0.00 0.33 -2.37 0.41 -0.53 0.00 0.00 176.83 174.66 2buc n THR 570 N -4.85 1.54 0.21 2.23 -1.04 0.17 -4.56 114.28 107.98 2buc n THR 570 Ca -0.04 -0.53 0.11 0.00 -2.04 0.00 0.00 64.05 61.56 2buc n THR 570 Cb 0.11 -1.58 0.21 0.00 -1.82 0.00 0.00 70.33 67.25 2buc n THR 570 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2buc n GLU 571 N -3.52 2.46 -4.00 -2.82 -0.58 -1.09 -4.98 120.64 106.12 2buc n GLU 571 Ca -0.45 -2.27 -0.32 0.00 -0.42 0.00 0.00 57.16 53.71 2buc n GLU 571 Cb 0.97 -1.49 0.01 0.00 -0.57 0.00 0.00 31.44 30.36 2buc n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2buc n ASN 572 N 1.42 -4.29 -4.67 1.62 4.13 -0.97 -4.92 115.26 107.58 2buc n ASN 572 Ca 0.19 -0.85 -0.35 0.00 1.68 0.00 0.00 54.58 55.25 2buc n ASN 572 Cb 0.58 -3.57 -0.09 0.00 -1.54 0.00 0.00 39.78 35.16 2buc n ASN 572 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2buc s ILE 573 N -3.31 4.87 -0.07 2.41 1.01 -0.05 -4.43 121.20 121.63 2buc s ILE 573 Ca 0.67 -0.01 -0.30 0.00 0.00 0.00 0.00 60.65 61.01 2buc s ILE 573 Cb -0.34 -3.18 -0.03 0.00 0.01 0.00 0.00 42.46 38.92 2buc s ILE 573 CO 0.86 0.48 1.19 -0.63 0.00 0.00 0.00 174.94 176.84 2buc s ILE 574 N 0.17 4.29 -0.28 2.92 1.01 -0.74 -3.34 121.20 125.22 2buc s ILE 574 Ca 0.05 1.61 -0.07 0.00 0.00 0.00 0.00 60.65 62.24 2buc s ILE 574 Cb -0.12 -4.03 -0.00 0.00 0.01 0.00 0.00 42.46 38.32 2buc s ILE 574 CO 0.00 -0.01 0.08 -0.69 0.00 0.00 0.00 174.94 174.32 2buc s VAL 575 N 2.30 4.03 0.06 2.92 1.01 -0.97 -0.45 120.40 129.29 2buc s VAL 575 Ca 0.55 -0.57 0.07 0.00 0.00 0.00 0.00 61.98 62.04 2buc s VAL 575 Cb -0.24 -3.03 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 2buc s VAL 575 CO 0.21 0.15 -0.17 0.00 0.00 0.00 0.00 175.10 175.28 2buc s ALA 576 N 1.53 2.64 0.09 5.51 0.00 -0.13 0.23 121.76 131.62 2buc s ALA 576 Ca 0.04 -1.22 0.06 0.00 0.00 0.00 0.00 51.96 50.84 2buc s ALA 576 Cb -0.17 -0.74 -0.03 0.00 0.00 0.00 0.00 23.12 22.19 2buc s ALA 576 CO 0.03 0.58 -0.16 -1.12 0.00 0.00 0.00 175.76 175.08 2buc s SER 577 N -1.60 1.99 -0.04 0.00 0.01 -0.43 -0.65 113.70 112.97 2buc s SER 577 Ca 0.16 -0.68 -0.03 0.00 1.31 0.00 0.00 55.95 56.71 2buc s SER 577 Cb -0.11 -0.08 0.02 0.00 0.21 0.00 0.00 66.02 66.07 2buc s SER 577 CO 0.07 -0.05 0.10 0.12 0.41 0.00 0.00 173.24 173.88 2buc s PHE 578 N -1.43 -0.10 -0.43 2.43 5.36 -1.26 -1.32 117.98 121.23 2buc s PHE 578 Ca 0.03 0.30 -0.10 0.00 -0.96 0.00 0.00 56.93 56.20 2buc s PHE 578 Cb -0.09 -0.04 0.08 0.00 -0.34 0.00 0.00 43.02 42.63 2buc s PHE 578 CO 0.03 -0.09 0.28 -0.51 -1.46 0.00 0.00 175.22 173.46 2buc s ASP 579 N 0.54 5.69 0.00 6.13 1.01 -0.90 -4.81 116.67 124.32 2buc s ASP 579 Ca -0.04 -1.50 0.00 0.00 0.71 0.00 0.00 52.55 51.72 2buc s ASP 579 Cb -0.06 -2.01 0.00 0.00 1.01 0.00 0.00 42.92 41.87 2buc s ASP 579 CO -0.02 -0.55 0.00 0.61 0.21 0.00 0.00 175.17 175.41 2buc n GLY 580 N 4.94 1.87 3.77 0.21 0.00 -1.26 -4.14 105.19 110.58 2buc n GLY 580 Ca -0.10 -1.88 -0.41 0.00 0.00 0.00 0.00 46.02 43.63 2buc n GLY 580 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2buc s ARG 581 N 3.87 4.33 0.00 1.61 0.52 -1.26 -2.81 118.95 125.22 2buc s ARG 581 Ca 0.00 2.25 0.00 0.00 -0.52 0.00 0.00 55.73 57.46 2buc s ARG 581 Cb 0.00 -3.07 0.00 0.00 0.52 0.00 0.00 34.95 32.40 2buc s ARG 581 CO 0.00 -0.23 0.00 0.41 0.02 0.00 0.00 175.30 175.50 2buc n GLY 582 N 0.92 3.23 3.73 -3.53 0.00 1.00 -3.80 105.19 106.74 2buc n GLY 582 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2buc n GLY 582 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2buc s SER 583 N -0.39 4.05 0.52 1.61 1.04 -1.12 -0.90 113.70 118.51 2buc s SER 583 Ca 0.00 2.13 0.05 0.00 0.48 0.00 0.00 55.95 58.61 2buc s SER 583 Cb 0.00 -2.56 0.09 0.00 0.10 0.00 0.00 66.02 63.65 2buc s SER 583 CO 0.00 -2.35 0.68 0.61 0.98 0.00 0.00 173.24 173.16 2buc n GLY 584 N -0.18 1.56 2.47 7.32 0.00 -0.84 -3.71 105.19 111.81 2buc n GLY 584 Ca 0.11 -2.15 -0.17 0.00 0.00 0.00 0.00 46.02 43.82 2buc n GLY 584 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2buc n TYR 585 N -2.17 -0.15 -1.96 1.61 4.01 -1.26 -4.82 117.16 112.42 2buc n TYR 585 Ca 0.13 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.89 2buc n TYR 585 Cb 0.47 -3.05 0.02 0.00 -0.31 0.00 0.00 39.34 36.47 2buc n TYR 585 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2buc n GLN 586 N -2.53 0.15 0.00 -0.72 6.02 -1.26 -4.56 117.38 114.48 2buc n GLN 586 Ca -0.18 -1.32 0.00 0.00 -0.01 0.00 0.00 57.00 55.49 2buc n GLN 586 Cb 0.58 -0.56 0.00 0.00 1.02 0.00 0.00 30.24 31.29 2buc n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2buc n GLY 587 N -0.10 1.06 0.14 1.08 0.00 -1.26 -4.52 105.19 101.59 2buc n GLY 587 Ca 0.03 -1.87 -0.00 0.00 0.00 0.00 0.00 46.02 44.17 2buc n GLY 587 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2buc h ASP 588 N 0.00 0.00 -0.30 1.61 3.32 0.09 -2.58 116.42 118.56 2buc h ASP 588 Ca 0.00 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.08 2buc h ASP 588 Cb 0.00 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 2buc h ASP 588 CO 0.00 0.59 0.13 0.50 -1.72 0.00 0.00 179.24 178.73 2buc h LYS 589 N 0.00 0.26 -0.16 3.56 1.63 -1.86 0.27 116.57 120.28 2buc h LYS 589 Ca -0.01 -0.02 -0.10 0.00 -0.85 0.00 0.00 60.65 59.68 2buc h LYS 589 Cb 1.08 -0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 32.65 2buc h LYS 589 CO 0.08 0.17 -0.28 0.82 -3.45 0.00 0.00 179.45 176.79 2buc h ILE 590 N 0.27 1.35 0.08 2.00 2.04 -1.79 -3.29 117.51 118.18 2buc h ILE 590 Ca 0.13 -1.52 -0.00 0.00 1.00 0.00 0.00 64.86 64.46 2buc h ILE 590 Cb 0.08 1.94 0.00 0.00 -0.74 0.00 0.00 36.82 38.09 2buc h ILE 590 CO -0.11 0.46 -0.04 -0.03 0.00 0.00 0.00 178.15 178.42 2buc h MET 591 N 0.11 -0.11 -0.36 2.37 4.05 -1.22 0.28 114.93 120.06 2buc h MET 591 Ca 0.01 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.44 2buc h MET 591 Cb 0.87 0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.69 2buc h MET 591 CO 0.06 0.01 0.00 0.72 0.23 0.00 0.00 176.91 177.93 2buc n HIS 592 N -5.10 0.43 -0.13 1.39 8.25 0.95 -4.02 115.22 116.99 2buc n HIS 592 Ca -0.08 -0.20 -0.07 0.00 -0.26 0.00 0.00 57.72 57.11 2buc n HIS 592 Cb 0.11 -0.04 0.09 0.00 1.12 0.00 0.00 29.99 31.27 2buc n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2buc h ALA 593 N 3.39 0.93 -0.25 -1.41 0.00 -1.61 -2.76 119.26 117.55 2buc h ALA 593 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2buc h ALA 593 Cb 0.47 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2buc h ALA 593 CO 0.03 0.63 0.00 0.44 0.00 0.00 0.00 179.25 180.34 2buc n ILE 594 N -4.16 0.42 -1.69 0.00 -5.35 -1.26 -4.87 119.36 102.44 2buc n ILE 594 Ca 0.02 -0.36 -0.44 0.00 -0.27 0.00 0.00 62.75 61.70 2buc n ILE 594 Cb 0.37 0.09 -0.04 0.00 -1.74 0.00 0.00 39.64 38.32 2buc n ILE 594 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 2buc n ASN 595 N 0.24 3.58 0.00 7.28 4.05 -1.04 -1.01 115.26 128.35 2buc n ASN 595 Ca 0.09 1.07 0.00 0.00 0.45 0.00 0.00 54.58 56.18 2buc n ASN 595 Cb 0.26 -1.50 0.00 0.00 1.23 0.00 0.00 39.78 39.77 2buc n ASN 595 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 2buc n ARG 596 N 3.84 -1.78 -2.94 1.20 1.74 0.25 -4.80 116.66 114.17 2buc n ARG 596 Ca 0.17 0.45 -0.13 0.00 -0.77 0.00 0.00 57.85 57.56 2buc n ARG 596 Cb 0.32 -4.94 0.01 0.00 -1.02 0.00 0.00 32.46 26.84 2buc n ARG 596 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2buc n ARG 597 N 0.67 1.05 -1.86 5.56 1.85 -0.18 -4.86 116.66 118.87 2buc n ARG 597 Ca 0.00 -3.08 -0.40 0.00 -1.00 0.00 0.00 57.85 53.37 2buc n ARG 597 Cb 0.45 -1.37 0.00 0.00 -1.05 0.00 0.00 32.46 30.48 2buc n ARG 597 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2buc s LEU 598 N -2.69 4.25 0.00 2.89 1.43 -1.15 -2.85 118.68 120.56 2buc s LEU 598 Ca 0.33 2.93 0.00 0.00 -1.03 0.00 0.00 54.13 56.36 2buc s LEU 598 Cb 0.38 -3.77 0.00 0.00 0.03 0.00 0.00 46.19 42.83 2buc s LEU 598 CO -0.04 -0.93 0.00 0.61 0.23 0.00 0.00 176.35 176.22 2buc n GLY 599 N 0.55 0.59 0.00 -3.19 0.00 -1.26 -4.85 105.19 97.03 2buc n GLY 599 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2buc n GLY 599 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2buc n THR 600 N -2.82 0.00 0.05 2.61 -2.24 -1.13 -4.59 114.28 106.16 2buc n THR 600 Ca 0.00 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.66 2buc n THR 600 Cb 0.00 -0.64 -0.08 0.00 -2.10 0.00 0.00 70.33 67.51 2buc n THR 600 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2buc h PHE 601 N 0.00 -0.05 -0.52 4.78 0.04 -1.93 0.14 116.94 119.41 2buc h PHE 601 Ca 0.00 -0.00 0.06 0.00 2.80 0.00 0.00 57.97 60.83 2buc h PHE 601 Cb 0.00 0.02 -0.03 0.00 2.20 0.00 0.00 35.95 38.14 2buc h PHE 601 CO 0.00 0.03 0.34 1.05 -0.60 0.00 0.00 178.31 179.14 2buc h GLU 602 N -0.13 0.43 -0.03 1.51 9.09 -1.91 0.75 114.58 124.29 2buc h GLU 602 Ca -0.01 -0.03 -0.08 0.00 0.05 0.00 0.00 59.36 59.30 2buc h GLU 602 Cb 0.11 -0.10 0.00 0.00 -1.65 0.00 0.00 28.75 27.12 2buc h GLU 602 CO 0.01 0.28 -0.27 0.28 0.05 0.00 0.00 179.01 179.36 2buc h VAL 603 N 0.44 1.47 -0.76 -1.06 2.07 -1.69 -2.93 116.25 113.80 2buc h VAL 603 Ca 0.23 -1.79 -0.03 0.00 0.82 0.00 0.00 66.70 65.93 2buc h VAL 603 Cb 0.33 2.51 -0.04 0.00 -1.52 0.00 0.00 31.29 32.57 2buc h VAL 603 CO -0.06 0.50 0.37 -0.33 0.02 0.00 0.00 177.57 178.07 2buc h GLU 604 N -0.33 1.08 -0.31 1.57 5.08 0.10 -2.85 114.58 118.92 2buc h GLU 604 Ca -0.02 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.11 2buc h GLU 604 Cb 0.96 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 2buc h GLU 604 CO 0.06 0.83 -0.15 -0.44 -1.00 0.00 0.00 179.01 178.30 2buc h ASP 605 N 1.08 0.53 -0.72 1.42 5.19 0.43 -2.10 116.42 122.24 2buc h ASP 605 Ca 0.26 -0.15 -0.04 0.00 -0.62 0.00 0.00 57.03 56.48 2buc h ASP 605 Cb 0.10 -0.14 -0.03 0.00 0.18 0.00 0.00 39.33 39.43 2buc h ASP 605 CO -0.03 0.70 0.29 1.56 -3.12 0.00 0.00 179.24 178.64 2buc h GLN 606 N 0.50 1.10 0.12 3.56 1.08 -1.31 -1.96 115.11 118.20 2buc h GLN 606 Ca 0.09 -0.20 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 2buc h GLN 606 Cb 0.55 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 27.80 2buc h GLN 606 CO 0.03 0.90 -0.06 0.82 -0.95 0.00 0.00 178.83 179.57 2buc h ILE 607 N 1.07 1.07 -0.46 2.54 2.04 -1.34 -2.45 117.51 119.98 2buc h ILE 607 Ca 0.25 -1.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.08 2buc h ILE 607 Cb 0.21 1.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 2buc h ILE 607 CO -0.02 0.23 0.20 -0.08 0.00 0.00 0.00 178.15 178.48 2buc h GLU 608 N -0.66 0.65 -0.35 2.37 4.57 -1.42 0.76 114.58 120.50 2buc h GLU 608 Ca -0.02 -0.08 -0.07 0.00 -1.18 0.00 0.00 59.36 58.01 2buc h GLU 608 Cb 0.50 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.96 2buc h GLU 608 CO 0.03 0.53 -0.05 0.00 -1.18 0.00 0.00 179.01 178.34 2buc h ALA 609 N 1.57 0.48 -0.26 2.92 0.00 -1.40 -2.47 119.26 120.10 2buc h ALA 609 Ca 0.16 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 2buc h ALA 609 Cb 0.11 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2buc h ALA 609 CO -0.02 0.30 -0.22 1.15 0.00 0.00 0.00 179.25 180.45 2buc h THR 610 N 0.46 1.26 -0.94 0.00 2.02 -0.92 -1.50 112.91 113.28 2buc h THR 610 Ca 0.09 -1.21 0.03 0.00 0.77 0.00 0.00 66.41 66.10 2buc h THR 610 Cb 0.53 1.31 -0.06 0.00 -1.74 0.00 0.00 68.15 68.20 2buc h THR 610 CO 0.03 0.39 0.61 0.03 0.37 0.00 0.00 175.52 176.95 2buc h ARG 611 N 0.43 1.16 -0.06 6.66 3.08 -0.74 0.16 114.38 125.07 2buc h ARG 611 Ca 0.07 -0.07 -0.14 0.00 0.07 0.00 0.00 59.98 59.90 2buc h ARG 611 Cb 0.63 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 2buc h ARG 611 CO 0.04 0.76 -0.61 1.96 -1.07 0.00 0.00 179.97 181.06 2buc h GLN 612 N 1.19 0.21 -0.23 0.04 4.20 -1.01 -3.01 115.11 116.49 2buc h GLN 612 Ca 0.37 -0.15 -0.14 0.00 0.06 0.00 0.00 58.65 58.80 2buc h GLN 612 Cb -0.00 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 2buc h GLN 612 CO -0.12 0.75 -0.42 0.74 -0.67 0.00 0.00 178.83 179.12 2buc h PHE 613 N 0.15 0.67 -0.06 2.96 0.04 -0.56 -3.23 116.94 116.92 2buc h PHE 613 Ca -0.01 -0.20 -0.12 0.00 2.80 0.00 0.00 57.97 60.44 2buc h PHE 613 Cb 1.11 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 39.10 2buc h PHE 613 CO 0.02 0.89 -0.51 0.66 -0.60 0.00 0.00 178.31 178.77 2buc h SER 614 N 0.46 0.19 1.15 2.17 4.64 -0.65 -2.94 113.55 118.56 2buc h SER 614 Ca 0.04 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2buc h SER 614 Cb 0.92 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2buc h SER 614 CO 0.08 0.67 0.00 0.11 -0.87 0.00 0.00 176.83 176.82 2buc h LYS 615 N 0.14 0.00 -6.88 4.77 1.57 -1.54 -3.42 116.57 111.20 2buc h LYS 615 Ca 0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 2buc h LYS 615 Cb 0.95 0.00 0.06 0.00 0.08 0.00 0.00 32.23 33.33 2buc h LYS 615 CO 0.08 0.00 0.61 -1.64 -0.57 0.00 0.00 179.45 177.93 2buc s MET 616 N -3.28 4.33 0.57 3.15 -1.94 -1.11 -4.93 119.30 116.09 2buc s MET 616 Ca 0.06 2.16 0.30 0.00 -1.71 0.00 0.00 55.69 56.50 2buc s MET 616 Cb 0.10 -3.04 1.71 0.00 2.01 0.00 0.00 34.83 35.62 2buc s MET 616 CO 0.51 -0.18 2.19 0.78 -0.01 0.00 0.00 175.02 178.30 2buc h GLY 617 N 3.32 0.00 -1.04 -0.03 0.00 -1.88 -2.63 103.07 100.82 2buc h GLY 617 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2buc h GLY 617 CO 0.65 0.00 0.00 1.97 0.00 0.00 0.00 176.54 179.16 2buc n PHE 618 N -3.68 0.31 -4.22 5.60 1.16 -1.26 -4.69 117.46 110.68 2buc n PHE 618 Ca -0.02 -0.15 -0.34 0.00 -1.87 0.00 0.00 57.45 55.06 2buc n PHE 618 Cb 0.15 0.00 -0.15 0.00 -1.61 0.00 0.00 39.48 37.87 2buc n PHE 618 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 2buc s VAL 619 N -1.69 2.93 -0.50 1.97 1.01 -0.99 -0.47 120.40 122.66 2buc s VAL 619 Ca 0.30 -0.66 -0.28 0.00 0.00 0.00 0.00 61.98 61.34 2buc s VAL 619 Cb 0.16 -2.28 0.01 0.00 0.00 0.00 0.00 36.38 34.27 2buc s VAL 619 CO 0.24 0.48 1.50 -0.62 0.00 0.00 0.00 175.10 176.70 2buc s ASP 620 N 1.11 6.07 0.02 3.32 -1.08 0.85 -4.82 116.67 122.14 2buc s ASP 620 Ca 0.01 0.57 0.14 0.00 -0.52 0.00 0.00 52.55 52.74 2buc s ASP 620 Cb -0.14 -2.54 0.61 0.00 -1.46 0.00 0.00 42.92 39.39 2buc s ASP 620 CO -0.03 -1.70 1.46 -0.90 0.52 0.00 0.00 175.17 174.52 2buc n ASP 621 N 9.77 0.06 0.00 -0.34 5.75 -1.26 -1.68 116.55 128.85 2buc n ASP 621 Ca 0.16 0.52 0.12 0.00 -0.01 0.00 0.00 54.79 55.57 2buc n ASP 621 Cb 0.49 -0.53 0.22 0.00 -1.03 0.00 0.00 41.12 40.27 2buc n ASP 621 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2buc n LYS 622 N -1.57 0.01 -3.20 0.11 5.02 -1.26 -4.58 118.16 112.68 2buc n LYS 622 Ca 0.03 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.09 2buc n LYS 622 Cb 0.16 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.61 2buc n LYS 622 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2buc n ARG 623 N -1.52 1.41 -4.87 1.97 1.74 -0.67 -4.81 116.66 109.90 2buc n ARG 623 Ca 0.05 -3.72 -0.33 0.00 -0.77 0.00 0.00 57.85 53.08 2buc n ARG 623 Cb 0.34 -1.66 -0.14 0.00 -1.02 0.00 0.00 32.46 29.98 2buc n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2buc s ILE 624 N -2.13 2.99 0.23 0.55 1.01 -1.26 -1.47 121.20 121.12 2buc s ILE 624 Ca 0.39 -0.72 0.05 0.00 0.00 0.00 0.00 60.65 60.36 2buc s ILE 624 Cb 0.23 -2.20 -0.05 0.00 0.01 0.00 0.00 42.46 40.45 2buc s ILE 624 CO -0.09 0.56 -0.04 0.00 0.00 0.00 0.00 174.94 175.37 2buc s ALA 625 N -0.26 1.93 -0.00 9.38 0.00 0.10 0.09 121.76 133.01 2buc s ALA 625 Ca 0.01 -1.76 0.01 0.00 0.00 0.00 0.00 51.96 50.22 2buc s ALA 625 Cb -0.13 0.30 -0.00 0.00 0.00 0.00 0.00 23.12 23.29 2buc s ALA 625 CO 0.03 -0.16 -0.03 -1.50 0.00 0.00 0.00 175.76 174.11 2buc s ILE 626 N -3.26 0.21 0.09 0.00 2.07 -1.11 0.07 121.20 119.27 2buc s ILE 626 Ca 0.27 -0.12 -0.11 0.00 -1.41 0.00 0.00 60.65 59.28 2buc s ILE 626 Cb 0.04 -0.18 0.01 0.00 0.13 0.00 0.00 42.46 42.46 2buc s ILE 626 CO 0.08 0.06 0.24 -1.66 -1.91 0.00 0.00 174.94 171.75 2buc s TRP 627 N -0.07 0.06 -0.10 3.50 1.48 0.53 -1.48 118.94 122.87 2buc s TRP 627 Ca 0.01 -0.43 -0.33 0.00 -1.06 0.00 0.00 56.10 54.29 2buc s TRP 627 Cb -0.01 0.02 0.13 0.00 -1.16 0.00 0.00 33.47 32.44 2buc s TRP 627 CO -0.00 -0.56 1.26 0.20 -4.06 0.00 0.00 176.95 173.79 2buc s GLY 628 N -2.75 -0.36 -0.04 3.67 0.00 -1.09 -0.62 107.32 106.14 2buc s GLY 628 Ca 0.03 1.10 0.04 0.00 0.00 0.00 0.00 44.72 45.90 2buc s GLY 628 CO -0.10 0.30 -0.16 0.86 0.00 0.00 0.00 173.10 174.00 2buc s TRP 629 N -2.40 2.64 0.00 1.90 -0.11 -1.26 -1.97 118.94 117.73 2buc s TRP 629 Ca 0.12 -0.21 0.00 0.00 1.22 0.00 0.00 56.10 57.23 2buc s TRP 629 Cb 0.02 -1.60 0.00 0.00 -1.50 0.00 0.00 33.47 30.39 2buc s TRP 629 CO -0.04 0.15 0.00 0.43 -4.62 0.00 0.00 176.95 172.87 2buc n SER 630 N 2.32 0.00 -0.10 5.86 7.64 -0.64 -0.29 113.62 128.41 2buc n SER 630 Ca -0.17 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.76 2buc n SER 630 Cb 0.52 0.00 0.38 0.00 -1.01 0.00 0.00 64.21 64.10 2buc n SER 630 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2buc h TYR 631 N 0.00 0.66 -0.47 1.43 5.03 -1.85 -1.49 116.97 120.28 2buc h TYR 631 Ca 0.00 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.31 2buc h TYR 631 Cb 0.00 -0.22 -0.02 0.00 1.55 0.00 0.00 36.73 38.04 2buc h TYR 631 CO 0.00 0.39 0.23 0.78 -1.32 0.00 0.00 178.16 178.23 2buc h GLY 632 N 0.69 0.70 1.19 1.82 0.00 -0.53 -0.06 103.07 106.88 2buc h GLY 632 Ca 0.24 -0.31 -0.13 0.00 0.00 0.00 0.00 47.33 47.12 2buc h GLY 632 CO -0.06 0.30 -0.26 -1.33 0.00 0.00 0.00 176.54 175.19 2buc h GLY 633 N 0.76 1.00 0.93 4.60 0.00 -1.09 -0.08 103.07 109.19 2buc h GLY 633 Ca 0.17 -0.90 -0.02 0.00 0.00 0.00 0.00 47.33 46.57 2buc h GLY 633 CO -0.02 0.82 0.13 -1.82 0.00 0.00 0.00 176.54 175.64 2buc h TYR 634 N 0.78 0.54 -0.12 5.60 3.20 -0.91 -1.13 116.97 124.94 2buc h TYR 634 Ca 0.10 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 2buc h TYR 634 Cb 0.82 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.92 2buc h TYR 634 CO 0.05 0.52 0.03 0.28 -1.64 0.00 0.00 178.16 177.40 2buc h VAL 635 N 0.41 1.20 -0.58 1.81 2.07 -0.99 -0.40 116.25 119.77 2buc h VAL 635 Ca 0.11 -0.61 0.09 0.00 0.82 0.00 0.00 66.70 67.12 2buc h VAL 635 Cb 0.21 1.37 -0.11 0.00 -1.52 0.00 0.00 31.29 31.25 2buc h VAL 635 CO -0.01 0.18 -0.41 0.74 0.02 0.00 0.00 177.57 178.09 2buc h THR 636 N -0.00 0.10 -0.46 2.57 2.02 -0.94 0.56 112.91 116.76 2buc h THR 636 Ca 0.04 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.21 2buc h THR 636 Cb 0.25 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 2buc h THR 636 CO 0.00 0.00 0.24 0.28 0.37 0.00 0.00 175.52 176.41 2buc h SER 637 N -0.22 0.58 -0.77 4.18 0.02 -1.03 -0.04 113.55 116.27 2buc h SER 637 Ca 0.19 -0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 61.00 2buc h SER 637 Cb 0.56 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.92 2buc h SER 637 CO -0.69 0.53 0.38 0.24 -1.14 0.00 0.00 176.83 176.15 2buc h MET 638 N 0.60 1.12 -0.03 3.45 2.86 -0.61 0.05 114.93 122.38 2buc h MET 638 Ca 0.16 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2buc h MET 638 Cb 0.08 -0.21 -0.00 0.00 0.06 0.00 0.00 31.60 31.54 2buc h MET 638 CO -0.02 0.86 0.00 0.28 1.06 0.00 0.00 176.91 179.09 2buc h VAL 639 N 1.12 1.23 0.00 -2.22 2.07 -0.56 -1.56 116.25 116.33 2buc h VAL 639 Ca 0.27 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 2buc h VAL 639 Cb 0.11 1.64 -0.00 0.00 -1.52 0.00 0.00 31.29 31.51 2buc h VAL 639 CO -0.03 0.18 -0.09 -0.07 0.02 0.00 0.00 177.57 177.57 2buc h LEU 640 N -0.23 0.00 -1.88 2.57 3.38 -0.74 -1.05 115.31 117.36 2buc h LEU 640 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2buc h LEU 640 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2buc h LEU 640 CO 0.00 0.09 0.00 0.61 0.09 0.00 0.00 178.44 179.23 2buc n GLY 641 N -1.18 1.30 0.13 0.83 0.00 -0.02 -4.18 105.19 102.07 2buc n GLY 641 Ca -0.03 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2buc n GLY 641 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2buc h ALA 642 N 4.15 0.68 -0.97 4.61 0.00 -0.13 -3.43 119.26 124.18 2buc h ALA 642 Ca 0.00 -0.57 -0.12 0.00 0.00 0.00 0.00 54.91 54.21 2buc h ALA 642 Cb 0.74 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2buc h ALA 642 CO 0.00 0.79 -0.16 0.41 0.00 0.00 0.00 179.25 180.29 2buc n GLY 643 N 0.95 0.13 0.24 0.00 0.00 -1.26 -4.94 105.19 100.31 2buc n GLY 643 Ca 0.01 -0.62 0.12 0.00 0.00 0.00 0.00 46.02 45.53 2buc n GLY 643 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2buc h SER 644 N -0.04 0.00 0.00 1.61 4.64 -1.90 -3.47 113.55 114.39 2buc h SER 644 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 2buc h SER 644 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 2buc h SER 644 CO 0.17 0.16 0.00 0.61 -0.87 0.00 0.00 176.83 176.90 2buc n GLY 645 N 0.19 2.15 0.09 -0.77 0.00 -1.26 -4.90 105.19 100.69 2buc n GLY 645 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2buc n GLY 645 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2buc h VAL 646 N 0.00 1.39 -3.24 1.61 2.07 -1.94 -3.45 116.25 112.69 2buc h VAL 646 Ca 0.00 -1.31 -0.59 0.00 0.82 0.00 0.00 66.70 65.62 2buc h VAL 646 Cb 0.00 2.12 -0.08 0.00 -1.52 0.00 0.00 31.29 31.81 2buc h VAL 646 CO 0.00 0.36 -0.24 -0.36 0.02 0.00 0.00 177.57 177.36 2buc s PHE 647 N -4.13 3.53 0.06 1.57 0.40 -1.26 -4.53 117.98 113.62 2buc s PHE 647 Ca -0.15 0.78 -0.06 0.00 -0.60 0.00 0.00 56.93 56.90 2buc s PHE 647 Cb 0.03 -2.40 -0.29 0.00 0.51 0.00 0.00 43.02 40.86 2buc s PHE 647 CO 0.72 0.30 1.07 -0.22 0.70 0.00 0.00 175.22 177.79 2buc h LYS 648 N 6.28 0.31 0.00 0.44 3.64 -0.66 -3.46 116.57 123.13 2buc h LYS 648 Ca -0.43 -0.53 -0.12 0.00 -1.27 0.00 0.00 60.65 58.30 2buc h LYS 648 Cb 1.18 0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 33.18 2buc h LYS 648 CO 0.73 1.24 0.13 0.00 -2.27 0.00 0.00 179.45 179.27 2buc s GLY 650 N -3.12 -0.32 -0.09 0.00 0.00 -0.80 -2.76 107.32 100.24 2buc s GLY 650 Ca 0.21 1.44 0.01 0.00 0.00 0.00 0.00 44.72 46.37 2buc s GLY 650 CO 0.15 0.47 -0.08 -0.42 0.00 0.00 0.00 173.10 173.21 2buc s ILE 651 N -2.48 0.97 -0.21 0.90 1.01 -0.55 -1.49 121.20 119.36 2buc s ILE 651 Ca 0.10 -0.31 -0.05 0.00 0.00 0.00 0.00 60.65 60.39 2buc s ILE 651 Cb -0.00 -0.96 -0.02 0.00 0.01 0.00 0.00 42.46 41.49 2buc s ILE 651 CO -0.05 0.34 -0.01 0.00 0.00 0.00 0.00 174.94 175.22 2buc s ALA 652 N 1.27 2.95 -0.21 9.38 0.00 -0.00 -2.66 121.76 132.49 2buc s ALA 652 Ca -0.04 -1.06 -0.04 0.00 0.00 0.00 0.00 51.96 50.81 2buc s ALA 652 Cb -0.14 -1.76 -0.02 0.00 0.00 0.00 0.00 23.12 21.20 2buc s ALA 652 CO -0.03 -0.27 -0.02 0.08 0.00 0.00 0.00 175.76 175.52 2buc s VAL 653 N 1.22 3.67 -1.38 0.00 1.01 -0.83 -0.47 120.40 123.62 2buc s VAL 653 Ca 0.03 -0.40 -0.06 0.00 0.00 0.00 0.00 61.98 61.55 2buc s VAL 653 Cb -0.15 -2.67 0.00 0.00 0.00 0.00 0.00 36.38 33.57 2buc s VAL 653 CO 0.00 0.42 0.42 0.00 0.00 0.00 0.00 175.10 175.95 2buc n ALA 654 N 4.52 -2.15 -1.88 5.51 0.00 0.12 -1.62 120.51 125.01 2buc n ALA 654 Ca -0.18 -0.32 -0.33 0.00 0.00 0.00 0.00 53.44 52.61 2buc n ALA 654 Cb 0.51 -1.84 -0.07 0.00 0.00 0.00 0.00 19.45 18.05 2buc n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2buc s PRO 655 N -6.71 4.19 0.22 0.00 0.04 -1.26 -3.63 135.00 127.86 2buc s PRO 655 Ca 0.12 1.03 -0.30 0.00 0.04 0.00 0.00 61.00 61.89 2buc s PRO 655 Cb -0.05 -2.24 -0.09 0.00 0.04 0.00 0.00 34.50 32.16 2buc s PRO 655 CO 0.91 0.01 1.19 0.08 0.04 0.00 0.00 177.00 179.24 2buc s VAL 656 N -2.13 3.44 -0.02 -0.36 1.01 -1.24 -4.56 120.40 116.54 2buc s VAL 656 Ca 0.60 1.28 0.06 0.00 0.00 0.00 0.00 61.98 63.92 2buc s VAL 656 Cb -0.09 -3.82 -0.09 0.00 0.00 0.00 0.00 36.38 32.38 2buc s VAL 656 CO 0.14 0.24 0.13 -1.54 0.00 0.00 0.00 175.10 174.07 2buc n SER 657 N 2.03 3.52 -3.64 3.32 3.41 -1.26 -4.21 113.62 116.78 2buc n SER 657 Ca 0.03 -0.04 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 2buc n SER 657 Cb 0.44 1.24 -0.06 0.00 -0.26 0.00 0.00 64.21 65.57 2buc n SER 657 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2buc s LYS 658 N -2.34 0.67 0.18 4.33 2.20 -1.26 -0.94 119.74 122.57 2buc s LYS 658 Ca -0.02 1.25 0.23 0.00 -0.36 0.00 0.00 55.97 57.07 2buc s LYS 658 Cb 0.04 0.29 0.90 0.00 -1.51 0.00 0.00 37.83 37.55 2buc s LYS 658 CO 0.23 -0.16 1.70 0.91 -0.36 0.00 0.00 175.35 177.67 2buc n TRP 659 N 4.53 0.61 0.30 4.03 7.02 -1.26 -1.86 117.44 130.81 2buc n TRP 659 Ca -0.18 0.22 0.14 0.00 -1.02 0.00 0.00 57.50 56.66 2buc n TRP 659 Cb 0.57 -0.85 0.45 0.00 -2.42 0.00 0.00 31.31 29.06 2buc n TRP 659 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 2buc h GLU 660 N 0.00 0.00 0.00 -0.99 3.07 -1.92 -3.15 114.58 111.58 2buc h GLU 660 Ca 0.00 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 2buc h GLU 660 Cb 0.43 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.34 2buc h GLU 660 CO 0.00 0.00 -0.49 1.88 -1.40 0.00 0.00 179.01 179.00 2buc h TYR 661 N 0.00 0.00 -3.09 4.33 0.05 -1.76 -3.24 116.97 113.26 2buc h TYR 661 Ca 0.00 0.00 -0.47 0.00 0.05 0.00 0.00 58.73 58.31 2buc h TYR 661 Cb 0.69 0.00 0.03 0.00 1.01 0.00 0.00 36.73 38.47 2buc h TYR 661 CO 0.00 0.07 -0.02 -0.47 -1.05 0.00 0.00 178.16 176.69 2buc s TYR 662 N -3.23 3.36 0.86 4.88 5.04 -1.19 -4.82 117.35 122.25 2buc s TYR 662 Ca 0.03 0.45 -0.10 0.00 -2.44 0.00 0.00 57.07 55.02 2buc s TYR 662 Cb 0.07 -2.30 0.11 0.00 0.35 0.00 0.00 41.96 40.19 2buc s TYR 662 CO 0.73 -0.32 1.13 0.16 -1.34 0.00 0.00 175.55 175.90 2buc s ASP 663 N -4.17 3.51 0.04 4.32 1.47 -1.26 -0.99 116.67 119.60 2buc s ASP 663 Ca 0.47 2.05 -0.24 0.00 1.18 0.00 0.00 52.55 56.02 2buc s ASP 663 Cb -0.10 -2.55 -0.16 0.00 -0.34 0.00 0.00 42.92 39.77 2buc s ASP 663 CO 0.40 -2.71 1.51 0.77 0.68 0.00 0.00 175.17 175.83 2buc h SER 664 N -1.60 0.06 0.10 2.11 4.64 -0.92 -2.79 113.55 115.15 2buc h SER 664 Ca -0.43 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 60.64 2buc h SER 664 Cb 1.25 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 63.32 2buc h SER 664 CO 0.45 0.29 -0.09 0.58 -0.87 0.00 0.00 176.83 177.19 2buc h VAL 665 N -0.18 0.79 0.18 0.95 2.07 -1.93 -1.21 116.25 116.92 2buc h VAL 665 Ca 0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 2buc h VAL 665 Cb 0.26 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 2buc h VAL 665 CO 0.00 0.00 -0.09 0.22 0.02 0.00 0.00 177.57 177.72 2buc h TYR 666 N -0.21 -0.23 0.37 1.57 5.03 -1.94 -3.00 116.97 118.57 2buc h TYR 666 Ca 0.00 -0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.29 2buc h TYR 666 Cb 0.20 0.08 0.00 0.00 1.55 0.00 0.00 36.73 38.56 2buc h TYR 666 CO -0.11 0.12 -0.18 1.15 -1.32 0.00 0.00 178.16 177.82 2buc h THR 667 N -0.62 0.64 0.00 1.81 2.02 -1.49 -3.01 112.91 112.27 2buc h THR 667 Ca -0.03 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 66.88 2buc h THR 667 Cb 0.45 0.77 -0.00 0.00 -1.74 0.00 0.00 68.15 67.63 2buc h THR 667 CO 0.04 0.05 -0.09 -0.33 0.37 0.00 0.00 175.52 175.56 2buc h GLU 668 N -0.64 0.00 -0.99 6.66 5.08 -1.36 0.61 114.58 123.94 2buc h GLU 668 Ca -0.05 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.33 2buc h GLU 668 Cb 0.46 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.66 2buc h GLU 668 CO 0.08 0.09 0.65 -0.09 -1.00 0.00 0.00 179.01 178.75 2buc h ARG 669 N 0.00 1.25 0.00 2.33 2.43 -1.38 -1.04 114.38 117.96 2buc h ARG 669 Ca -0.00 -0.08 -0.26 0.00 -0.81 0.00 0.00 59.98 58.83 2buc h ARG 669 Cb 0.23 -0.28 -0.05 0.00 -0.42 0.00 0.00 29.97 29.45 2buc h ARG 669 CO 0.01 0.83 -2.18 0.66 -1.51 0.00 0.00 179.97 177.78 2buc n TYR 670 N -4.42 0.00 0.10 2.20 4.01 -0.46 -4.68 117.16 113.92 2buc n TYR 670 Ca 0.13 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.90 2buc n TYR 670 Cb 0.06 -0.81 -0.05 0.00 -0.31 0.00 0.00 39.34 38.23 2buc n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2buc n MET 671 N -2.57 1.69 0.00 -0.72 2.81 0.20 0.84 117.12 119.37 2buc n MET 671 Ca -0.24 -0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.61 2buc n MET 671 Cb 0.97 -1.05 0.00 0.00 -0.71 0.00 0.00 33.22 32.43 2buc n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2buc n GLY 672 N 1.80 -0.28 3.80 3.03 0.00 -0.40 -4.70 105.19 108.45 2buc n GLY 672 Ca -0.00 -1.05 -0.36 0.00 0.00 0.00 0.00 46.02 44.60 2buc n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2buc s LEU 673 N 0.00 4.29 -0.76 0.99 1.43 -1.26 -4.17 118.68 119.20 2buc s LEU 673 Ca 0.00 0.34 -0.07 0.00 -1.03 0.00 0.00 54.13 53.37 2buc s LEU 673 Cb 0.00 -2.08 -0.15 0.00 0.03 0.00 0.00 46.19 43.99 2buc s LEU 673 CO 0.00 0.29 2.95 -0.81 0.23 0.00 0.00 176.35 179.00 2buc n PRO 674 N 2.80 2.54 -4.61 1.29 -0.04 -1.26 -1.67 135.00 134.05 2buc n PRO 674 Ca -0.18 -1.47 -0.29 0.00 -0.04 0.00 0.00 63.50 61.52 2buc n PRO 674 Cb 0.53 -2.35 -0.14 0.00 -0.04 0.00 0.00 33.50 31.51 2buc n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2buc s THR 675 N 1.95 2.20 0.65 0.52 -4.23 -1.26 -4.68 115.64 110.79 2buc s THR 675 Ca 0.60 -1.60 0.32 0.00 -1.18 0.00 0.00 61.69 59.82 2buc s THR 675 Cb 0.21 -1.92 0.34 0.00 1.34 0.00 0.00 72.50 72.47 2buc s THR 675 CO -0.03 0.20 2.00 1.55 -0.54 0.00 0.00 174.62 177.80 2buc h PRO 676 N 4.27 0.00 0.00 3.99 0.13 -1.96 0.67 132.00 139.10 2buc h PRO 676 Ca -0.49 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.45 2buc h PRO 676 Cb 1.16 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.26 2buc h PRO 676 CO 0.41 0.00 -0.88 0.93 -0.23 0.00 0.00 178.00 178.23 2buc h GLU 677 N 0.00 0.00 0.00 0.86 3.07 -1.95 -3.45 114.58 113.10 2buc h GLU 677 Ca 0.04 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.90 2buc h GLU 677 Cb 0.63 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.54 2buc h GLU 677 CO -0.00 0.88 0.00 -3.47 -1.40 0.00 0.00 179.01 175.02 2buc n ASP 678 N -3.41 0.00 -0.63 1.42 -0.08 0.20 -5.03 116.55 109.02 2buc n ASP 678 Ca 0.00 0.00 0.06 0.00 -1.51 0.00 0.00 54.79 53.34 2buc n ASP 678 Cb 0.86 0.00 0.15 0.00 2.34 0.00 0.00 41.12 44.47 2buc n ASP 678 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 2buc n ASN 679 N 0.00 1.61 -0.30 1.67 4.05 -0.67 -4.82 115.26 116.79 2buc n ASN 679 Ca 0.00 -3.28 0.01 0.00 0.45 0.00 0.00 54.58 51.76 2buc n ASN 679 Cb 0.00 -0.45 0.14 0.00 1.23 0.00 0.00 39.78 40.70 2buc n ASN 679 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 2buc h LEU 680 N 0.72 0.81 -0.94 1.20 5.85 -1.58 -2.33 115.31 119.03 2buc h LEU 680 Ca -0.04 0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.84 2buc h LEU 680 Cb 1.18 -0.15 -0.09 0.00 0.37 0.00 0.00 40.66 41.97 2buc h LEU 680 CO 0.02 0.51 0.56 0.44 -0.34 0.00 0.00 178.44 179.63 2buc h ASP 681 N 0.94 0.77 1.32 1.25 3.32 -1.87 0.14 116.42 122.29 2buc h ASP 681 Ca 0.37 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.49 2buc h ASP 681 Cb 0.19 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.66 2buc h ASP 681 CO -0.18 0.37 -0.35 1.88 -1.72 0.00 0.00 179.24 179.24 2buc h TYR 682 N 0.84 0.00 -0.24 4.55 -1.99 -1.80 -2.77 116.97 115.56 2buc h TYR 682 Ca 0.49 0.00 -0.17 0.00 2.00 0.00 0.00 58.73 61.05 2buc h TYR 682 Cb 0.58 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.32 2buc h TYR 682 CO -0.03 0.00 -0.51 1.88 -0.00 0.00 0.00 178.16 179.49 2buc h TYR 683 N 0.00 0.98 -0.19 4.88 0.05 -0.51 -3.25 116.97 118.93 2buc h TYR 683 Ca 0.00 -0.36 -0.16 0.00 0.05 0.00 0.00 58.73 58.26 2buc h TYR 683 Cb 0.84 -0.18 0.00 0.00 1.01 0.00 0.00 36.73 38.41 2buc h TYR 683 CO 0.00 1.17 -0.50 0.00 -1.05 0.00 0.00 178.16 177.77 2buc h ARG 684 N 0.51 0.67 -0.28 4.88 3.08 -0.74 -3.25 114.38 119.25 2buc h ARG 684 Ca 0.00 -0.47 0.00 0.00 0.07 0.00 0.00 59.98 59.58 2buc h ARG 684 Cb 1.12 0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.25 2buc h ARG 684 CO 0.11 1.09 0.00 0.27 -1.07 0.00 0.00 179.97 180.38 2buc n ASN 685 N -4.16 1.99 -0.75 7.04 6.94 -1.05 -3.88 115.26 121.39 2buc n ASN 685 Ca -0.06 -1.85 0.08 0.00 -0.02 0.00 0.00 54.58 52.72 2buc n ASN 685 Cb 0.60 -0.18 0.13 0.00 -2.36 0.00 0.00 39.78 37.97 2buc n ASN 685 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 2buc n SER 686 N 0.55 2.75 -4.82 0.53 3.41 -1.22 -5.00 113.62 109.82 2buc n SER 686 Ca 0.15 -1.81 -0.33 0.00 -0.26 0.00 0.00 58.87 56.63 2buc n SER 686 Cb 0.35 -0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.13 2buc n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2buc s THR 687 N -1.17 4.18 0.26 6.66 -4.23 -1.25 -4.88 115.64 115.21 2buc s THR 687 Ca 0.25 1.13 0.01 0.00 -1.18 0.00 0.00 61.69 61.89 2buc s THR 687 Cb 0.15 -3.56 0.05 0.00 1.34 0.00 0.00 72.50 70.48 2buc s THR 687 CO 0.21 -0.51 1.68 0.58 -0.54 0.00 0.00 174.62 176.04 2buc h VAL 688 N 1.01 1.27 -0.43 2.29 2.07 -1.37 -3.19 116.25 117.89 2buc h VAL 688 Ca -0.48 -1.34 0.06 0.00 0.82 0.00 0.00 66.70 65.77 2buc h VAL 688 Cb 1.20 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 32.31 2buc h VAL 688 CO 0.60 0.43 0.29 0.24 0.02 0.00 0.00 177.57 179.15 2buc h MET 689 N 0.47 0.30 0.00 1.57 2.86 -1.93 -1.00 114.93 117.20 2buc h MET 689 Ca 0.06 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 2buc h MET 689 Cb 0.72 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 32.31 2buc h MET 689 CO 0.06 0.20 -0.11 0.66 1.06 0.00 0.00 176.91 178.78 2buc h SER 690 N 0.31 0.00 -0.54 1.22 4.64 -1.89 -2.53 113.55 114.77 2buc h SER 690 Ca 0.19 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.43 2buc h SER 690 Cb 0.35 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.40 2buc h SER 690 CO -0.04 0.11 0.08 0.54 -0.87 0.00 0.00 176.83 176.65 2buc n ARG 691 N -3.42 3.90 -0.34 4.77 1.74 -0.38 -4.67 116.66 118.25 2buc n ARG 691 Ca -0.01 -3.07 0.05 0.00 -0.77 0.00 0.00 57.85 54.04 2buc n ARG 691 Cb 0.27 -2.13 0.20 0.00 -1.02 0.00 0.00 32.46 29.78 2buc n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2buc h ALA 692 N 2.89 1.36 -0.96 7.54 0.00 -1.43 -2.78 119.26 125.89 2buc h ALA 692 Ca 0.10 0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.11 2buc h ALA 692 Cb 1.96 -0.20 -0.07 0.00 0.00 0.00 0.00 17.79 19.48 2buc h ALA 692 CO 0.50 0.22 0.62 1.49 0.00 0.00 0.00 179.25 182.08 2buc h GLU 693 N 0.95 1.00 0.00 0.00 4.57 -1.85 -2.48 114.58 116.76 2buc h GLU 693 Ca 0.45 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.57 2buc h GLU 693 Cb 0.38 -0.23 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 2buc h GLU 693 CO -0.24 0.66 0.00 0.09 -1.18 0.00 0.00 179.01 178.34 2buc n ASN 694 N -4.53 0.37 0.05 1.04 5.03 -1.05 -2.89 115.26 113.29 2buc n ASN 694 Ca 0.16 0.58 0.10 0.00 0.87 0.00 0.00 54.58 56.28 2buc n ASN 694 Cb 0.26 -0.66 0.41 0.00 -1.02 0.00 0.00 39.78 38.77 2buc n ASN 694 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 2buc n PHE 695 N -1.89 0.36 0.27 3.10 3.01 -0.93 -2.57 117.46 118.80 2buc n PHE 695 Ca 0.04 0.13 0.12 0.00 1.01 0.00 0.00 57.45 58.75 2buc n PHE 695 Cb 0.25 -0.72 0.75 0.00 -0.01 0.00 0.00 39.48 39.75 2buc n PHE 695 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 2buc h LYS 696 N 0.00 0.00 0.00 -1.08 1.79 -1.72 -2.85 116.57 112.71 2buc h LYS 696 Ca 0.00 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 58.36 2buc h LYS 696 Cb 0.35 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.98 2buc h LYS 696 CO 0.00 0.08 -0.74 1.96 -1.08 0.00 0.00 179.45 179.66 2buc h GLN 697 N 0.00 0.00 -6.11 3.15 4.20 -1.76 -3.48 115.11 111.11 2buc h GLN 697 Ca -0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 2buc h GLN 697 Cb 0.18 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 27.87 2buc h GLN 697 CO 0.01 0.41 -0.61 0.14 -0.67 0.00 0.00 178.83 178.10 2buc s VAL 698 N -2.98 3.00 -0.17 -0.54 -7.23 -1.08 -4.99 120.40 106.41 2buc s VAL 698 Ca 0.02 -1.90 -0.18 0.00 -1.81 0.00 0.00 61.98 58.11 2buc s VAL 698 Cb 0.08 -2.83 -0.04 0.00 0.56 0.00 0.00 36.38 34.15 2buc s VAL 698 CO 0.76 -0.27 0.49 -1.61 -0.31 0.00 0.00 175.10 174.16 2buc s GLU 699 N -3.72 4.24 -0.10 4.82 2.02 -0.91 -4.95 118.70 120.10 2buc s GLU 699 Ca 0.34 0.40 0.04 0.00 0.02 0.00 0.00 54.97 55.77 2buc s GLU 699 Cb -0.03 -3.51 -0.00 0.00 0.10 0.00 0.00 34.13 30.68 2buc s GLU 699 CO 0.20 -0.02 -0.23 -0.47 0.02 0.00 0.00 175.26 174.76 2buc s TYR 700 N 1.22 2.57 -0.22 1.61 5.04 -1.26 -1.90 117.35 124.42 2buc s TYR 700 Ca 0.24 -0.92 -0.02 0.00 -2.44 0.00 0.00 57.07 53.93 2buc s TYR 700 Cb -0.15 -1.71 0.01 0.00 0.35 0.00 0.00 41.96 40.47 2buc s TYR 700 CO 0.10 -0.34 -0.09 -1.17 -1.34 0.00 0.00 175.55 172.70 2buc s LEU 701 N 0.23 2.80 -0.22 6.97 0.20 -0.55 0.31 118.68 128.41 2buc s LEU 701 Ca -0.15 -0.66 -0.04 0.00 0.69 0.00 0.00 54.13 53.97 2buc s LEU 701 Cb -0.17 -1.64 -0.01 0.00 -0.43 0.00 0.00 46.19 43.95 2buc s LEU 701 CO 0.07 -0.06 -0.04 -0.22 -0.29 0.00 0.00 176.35 175.82 2buc s LEU 702 N 1.36 2.93 -0.05 -0.68 0.20 -0.43 -0.82 118.68 121.18 2buc s LEU 702 Ca 0.03 -0.41 0.05 0.00 0.69 0.00 0.00 54.13 54.49 2buc s LEU 702 Cb -0.15 -1.74 -0.01 0.00 -0.43 0.00 0.00 46.19 43.86 2buc s LEU 702 CO -0.06 -0.03 -0.21 -0.63 -0.29 0.00 0.00 176.35 175.13 2buc s ILE 703 N 1.48 1.72 -0.06 6.68 1.01 0.38 -0.09 121.20 132.32 2buc s ILE 703 Ca 0.06 -0.87 -0.15 0.00 0.00 0.00 0.00 60.65 59.69 2buc s ILE 703 Cb -0.14 -1.47 0.03 0.00 0.01 0.00 0.00 42.46 40.89 2buc s ILE 703 CO -0.03 0.48 0.34 -2.28 0.00 0.00 0.00 174.94 173.46 2buc s HIS 704 N 0.01 -0.28 -0.03 3.97 2.46 -0.81 0.13 115.29 120.76 2buc s HIS 704 Ca -0.06 0.55 -0.19 0.00 0.47 0.00 0.00 55.06 55.83 2buc s HIS 704 Cb -0.13 0.12 -0.05 0.00 -0.13 0.00 0.00 32.58 32.39 2buc s HIS 704 CO 0.03 -0.33 0.54 0.20 -2.47 0.00 0.00 174.74 172.71 2buc s GLY 705 N -0.80 2.54 0.50 1.59 0.00 -1.26 -0.51 107.32 109.38 2buc s GLY 705 Ca -0.09 -0.06 0.28 0.00 0.00 0.00 0.00 44.72 44.86 2buc s GLY 705 CO 0.03 0.65 1.94 -0.91 0.00 0.00 0.00 173.10 174.81 2buc h THR 706 N 4.18 0.35 -0.63 0.90 1.35 -1.21 -2.84 112.91 115.01 2buc h THR 706 Ca -0.45 -0.78 -0.13 0.00 -0.55 0.00 0.00 66.41 64.49 2buc h THR 706 Cb 1.20 1.59 -0.08 0.00 -1.73 0.00 0.00 68.15 69.12 2buc h THR 706 CO 0.69 0.12 0.16 0.00 -0.25 0.00 0.00 175.52 176.24 2buc n ALA 707 N -2.18 4.23 -2.00 6.62 0.00 -0.67 -4.72 120.51 121.79 2buc n ALA 707 Ca -0.00 -2.27 -0.41 0.00 0.00 0.00 0.00 53.44 50.76 2buc n ALA 707 Cb 0.34 -1.14 -0.03 0.00 0.00 0.00 0.00 19.45 18.63 2buc n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2buc s ASP 708 N -1.13 5.62 0.30 0.00 -1.08 -1.07 -4.38 116.67 114.93 2buc s ASP 708 Ca 0.53 0.95 0.24 0.00 -0.52 0.00 0.00 52.55 53.75 2buc s ASP 708 Cb 0.42 -2.53 0.40 0.00 -1.46 0.00 0.00 42.92 39.76 2buc s ASP 708 CO 0.13 -1.99 1.52 -2.24 0.52 0.00 0.00 175.17 173.12 2buc h ASP 709 N 13.87 0.00 0.00 -0.34 2.03 -1.92 -3.33 116.42 126.74 2buc h ASP 709 Ca -0.30 -0.03 0.00 0.00 -0.73 0.00 0.00 57.03 55.97 2buc h ASP 709 Cb 1.17 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.67 2buc h ASP 709 CO 1.10 0.01 0.00 -3.20 -1.03 0.00 0.00 179.24 176.13 2buc n ASN 710 N -2.70 0.00 -4.43 4.15 2.85 -1.26 -4.69 115.26 109.18 2buc n ASN 710 Ca 0.04 0.00 -0.44 0.00 -0.11 0.00 0.00 54.58 54.07 2buc n ASN 710 Cb 0.50 -0.00 -0.05 0.00 1.24 0.00 0.00 39.78 41.47 2buc n ASN 710 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2buc s VAL 711 N -0.00 4.69 0.53 3.44 1.01 -1.26 -4.83 120.40 123.97 2buc s VAL 711 Ca 0.00 -0.57 -0.22 0.00 0.00 0.00 0.00 61.98 61.19 2buc s VAL 711 Cb 0.00 -4.48 -0.05 0.00 0.00 0.00 0.00 36.38 31.85 2buc s VAL 711 CO 0.00 -1.09 1.33 -1.00 0.00 0.00 0.00 175.10 174.33 2buc s HIS 712 N 3.08 2.39 0.54 5.22 3.76 -1.25 -4.73 115.29 124.31 2buc s HIS 712 Ca 0.17 1.40 0.29 0.00 -0.15 0.00 0.00 55.06 56.76 2buc s HIS 712 Cb -0.20 -3.73 1.45 0.00 1.11 0.00 0.00 32.58 31.21 2buc s HIS 712 CO 0.10 -2.67 1.94 0.35 -0.85 0.00 0.00 174.74 173.61 2buc h PHE 713 N 1.57 0.00 -0.97 1.40 3.57 -1.78 -0.59 116.94 120.14 2buc h PHE 713 Ca -0.51 0.00 0.32 0.00 3.53 0.00 0.00 57.97 61.31 2buc h PHE 713 Cb 1.29 0.00 -0.17 0.00 2.79 0.00 0.00 35.95 39.86 2buc h PHE 713 CO 0.47 0.00 0.28 0.37 -2.23 0.00 0.00 178.31 177.20 2buc h GLN 714 N 0.00 0.07 -0.55 1.11 4.15 -1.93 -1.54 115.11 116.42 2buc h GLN 714 Ca 0.32 -0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.76 2buc h GLN 714 Cb 1.32 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.96 2buc h GLN 714 CO -0.00 0.04 0.34 1.96 -1.93 0.00 0.00 178.83 179.24 2buc h GLN 715 N 0.07 0.66 0.01 1.69 4.20 -1.43 0.23 115.11 120.53 2buc h GLN 715 Ca 0.69 -0.04 -0.20 0.00 0.06 0.00 0.00 58.65 59.15 2buc h GLN 715 Cb 1.59 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 29.20 2buc h GLN 715 CO -0.80 0.43 -0.96 0.77 -0.67 0.00 0.00 178.83 177.61 2buc h SER 716 N 0.68 0.04 -0.34 1.46 0.02 -1.57 -2.52 113.55 111.32 2buc h SER 716 Ca 0.22 -0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 61.08 2buc h SER 716 Cb 0.00 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 2buc h SER 716 CO -0.09 0.97 -0.00 0.00 -1.14 0.00 0.00 176.83 176.57 2buc h ALA 717 N 1.02 0.46 -0.17 3.77 0.00 -0.72 0.18 119.26 123.81 2buc h ALA 717 Ca -0.02 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 2buc h ALA 717 Cb 1.69 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 2buc h ALA 717 CO 0.13 0.23 -0.40 1.96 0.00 0.00 0.00 179.25 181.16 2buc h GLN 718 N 0.42 0.38 -0.04 0.00 1.08 -0.62 -1.76 115.11 114.55 2buc h GLN 718 Ca 0.10 -0.19 -0.01 0.00 -1.45 0.00 0.00 58.65 57.10 2buc h GLN 718 Cb 0.46 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.89 2buc h GLN 718 CO 0.02 0.72 0.00 1.25 -0.95 0.00 0.00 178.83 179.87 2buc h LEU 719 N 0.32 0.07 -1.16 1.46 5.85 -1.26 -2.47 115.31 118.13 2buc h LEU 719 Ca 0.03 -0.30 0.02 0.00 0.84 0.00 0.00 57.88 58.46 2buc h LEU 719 Cb 0.85 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.82 2buc h LEU 719 CO 0.07 0.36 0.57 0.77 -0.34 0.00 0.00 178.44 179.87 2buc h SER 720 N -0.21 0.98 -0.52 1.25 4.64 -0.60 -2.23 113.55 116.87 2buc h SER 720 Ca 0.01 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 2buc h SER 720 Cb 0.32 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.15 2buc h SER 720 CO 0.00 0.70 0.23 0.50 -0.87 0.00 0.00 176.83 177.39 2buc h LYS 721 N 1.15 0.75 -0.51 4.77 3.64 -1.25 -1.02 116.57 124.11 2buc h LYS 721 Ca 0.33 -0.12 -0.07 0.00 -1.27 0.00 0.00 60.65 59.52 2buc h LYS 721 Cb -0.09 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.58 2buc h LYS 721 CO -0.08 0.64 0.04 0.00 -2.27 0.00 0.00 179.45 177.79 2buc h ALA 722 N 1.07 1.12 -0.35 5.00 0.00 -1.11 -0.66 119.26 124.34 2buc h ALA 722 Ca 0.17 -0.25 -0.16 0.00 0.00 0.00 0.00 54.91 54.68 2buc h ALA 722 Cb 0.15 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2buc h ALA 722 CO -0.02 0.57 -0.40 -0.07 0.00 0.00 0.00 179.25 179.33 2buc h LEU 723 N 0.77 0.95 -0.82 0.00 3.38 -1.19 -1.30 115.31 117.10 2buc h LEU 723 Ca 0.16 -0.48 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 2buc h LEU 723 Cb 0.41 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 2buc h LEU 723 CO 0.01 1.24 0.42 0.58 0.09 0.00 0.00 178.44 180.78 2buc h VAL 724 N 0.68 1.25 0.00 1.22 2.07 -1.01 -0.02 116.25 120.44 2buc h VAL 724 Ca 0.05 -0.66 -0.04 0.00 0.82 0.00 0.00 66.70 66.86 2buc h VAL 724 Cb 0.99 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2buc h VAL 724 CO 0.10 0.29 -0.21 0.44 0.02 0.00 0.00 177.57 178.20 2buc h ASP 725 N 1.15 0.00 -0.37 0.57 5.19 -0.91 -2.53 116.42 119.52 2buc h ASP 725 Ca 0.28 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.69 2buc h ASP 725 Cb 0.08 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.59 2buc h ASP 725 CO -0.04 0.21 0.00 0.00 -3.12 0.00 0.00 179.24 176.29 2buc n ALA 726 N -2.27 2.45 -2.09 3.45 0.00 -0.51 -4.94 120.51 116.60 2buc n ALA 726 Ca -0.01 -0.82 -0.14 0.00 0.00 0.00 0.00 53.44 52.47 2buc n ALA 726 Cb 0.36 -0.97 -0.02 0.00 0.00 0.00 0.00 19.45 18.82 2buc n ALA 726 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2buc n GLY 727 N 1.33 0.13 3.68 0.00 0.00 -0.95 -4.94 105.19 104.44 2buc n GLY 727 Ca 0.18 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 2buc n GLY 727 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2buc s VAL 728 N -2.66 5.13 -0.03 1.61 1.01 -0.06 -5.03 120.40 120.37 2buc s VAL 728 Ca 0.00 0.97 -0.25 0.00 0.00 0.00 0.00 61.98 62.70 2buc s VAL 728 Cb 0.00 -3.84 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 2buc s VAL 728 CO 0.00 0.22 0.77 -0.62 0.00 0.00 0.00 175.10 175.47 2buc s ASP 729 N 0.98 7.11 0.10 3.32 2.15 -1.26 -4.43 116.67 124.64 2buc s ASP 729 Ca 0.25 1.33 -0.20 0.00 0.43 0.00 0.00 52.55 54.36 2buc s ASP 729 Cb -0.15 -2.45 0.05 0.00 -0.30 0.00 0.00 42.92 40.06 2buc s ASP 729 CO 0.10 -0.12 0.50 0.72 -0.17 0.00 0.00 175.17 176.20 2buc s PHE 730 N 0.66 -0.37 0.19 -5.34 -0.71 -1.26 -4.70 117.98 106.45 2buc s PHE 730 Ca 0.40 0.22 -0.02 0.00 -1.04 0.00 0.00 56.93 56.49 2buc s PHE 730 Cb -0.19 0.37 -0.05 0.00 -1.21 0.00 0.00 43.02 41.94 2buc s PHE 730 CO 0.21 -0.72 0.39 -0.65 -1.34 0.00 0.00 175.22 173.11 2buc s GLN 731 N -3.28 3.55 0.03 1.99 -0.21 0.15 -5.00 119.66 116.88 2buc s GLN 731 Ca -0.01 -0.26 -0.01 0.00 0.02 0.00 0.00 55.36 55.10 2buc s GLN 731 Cb 0.00 -2.84 -0.02 0.00 1.00 0.00 0.00 33.01 31.15 2buc s GLN 731 CO -0.08 0.41 -0.01 -0.08 -2.12 0.00 0.00 175.29 173.41 2buc s THR 732 N -1.82 0.13 -0.27 -0.19 -1.32 -1.26 -1.31 115.64 109.60 2buc s THR 732 Ca 0.39 -1.10 0.00 0.00 -1.21 0.00 0.00 61.69 59.78 2buc s THR 732 Cb -0.11 -0.60 0.15 0.00 -1.51 0.00 0.00 72.50 70.43 2buc s THR 732 CO 0.28 -0.61 0.40 -0.32 -2.21 0.00 0.00 174.62 172.17 2buc s MET 733 N -2.08 0.40 0.42 7.08 0.00 0.87 -4.88 119.30 121.11 2buc s MET 733 Ca -0.10 0.30 -0.20 0.00 0.00 0.00 0.00 55.69 55.68 2buc s MET 733 Cb -0.05 -0.33 -0.11 0.00 0.00 0.00 0.00 34.83 34.34 2buc s MET 733 CO -0.03 -0.89 0.94 1.67 0.00 0.00 0.00 175.02 176.71 2buc s TRP 734 N 2.55 3.32 -0.23 4.11 -2.14 -1.26 -1.92 118.94 123.37 2buc s TRP 734 Ca 0.11 1.58 0.01 0.00 2.66 0.00 0.00 56.10 60.46 2buc s TRP 734 Cb -0.14 -2.83 0.05 0.00 -3.10 0.00 0.00 33.47 27.46 2buc s TRP 734 CO -0.25 -0.10 -0.08 0.71 -2.66 0.00 0.00 176.95 174.57 2buc s TYR 735 N -2.17 2.55 0.09 1.66 2.02 0.33 -4.92 117.35 116.91 2buc s TYR 735 Ca 0.61 -1.81 -0.31 0.00 -0.37 0.00 0.00 57.07 55.20 2buc s TYR 735 Cb -0.09 -1.66 -0.09 0.00 -0.40 0.00 0.00 41.96 39.72 2buc s TYR 735 CO 0.14 -0.78 1.79 0.99 -1.57 0.00 0.00 175.55 176.11 2buc s THR 736 N 1.34 2.81 0.00 -0.71 2.01 -1.26 -1.51 115.64 118.32 2buc s THR 736 Ca -0.05 0.21 0.00 0.00 0.31 0.00 0.00 61.69 62.16 2buc s THR 736 Cb -0.18 -3.14 0.00 0.00 0.01 0.00 0.00 72.50 69.19 2buc s THR 736 CO -0.07 -0.00 0.00 0.47 -0.69 0.00 0.00 174.62 174.33 2buc n ASP 737 N 5.99 -3.81 -4.77 3.53 8.00 -1.26 -4.89 116.55 119.33 2buc n ASP 737 Ca 0.17 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.28 2buc n ASP 737 Cb 0.39 -2.37 -0.06 0.00 -0.02 0.00 0.00 41.12 39.06 2buc n ASP 737 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2buc s GLU 738 N -1.21 4.60 0.00 -1.24 0.41 -1.07 -4.62 118.70 115.58 2buc s GLU 738 Ca 0.00 1.20 0.00 0.00 -0.41 0.00 0.00 54.97 55.76 2buc s GLU 738 Cb 0.00 -3.26 0.00 0.00 -1.78 0.00 0.00 34.13 29.09 2buc s GLU 738 CO 0.00 0.56 0.00 -0.40 -0.49 0.00 0.00 175.26 174.93 2buc n ASP 739 N 1.56 0.00 0.12 -0.19 5.68 -1.26 -1.67 116.55 120.79 2buc n ASP 739 Ca -0.05 0.00 0.03 0.00 -0.50 0.00 0.00 54.79 54.27 2buc n ASP 739 Cb 0.48 0.00 0.41 0.00 -1.14 0.00 0.00 41.12 40.88 2buc n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 2buc h HIS 740 N 0.00 0.25 0.00 2.11 -0.00 -1.92 -2.44 115.15 113.15 2buc h HIS 740 Ca 0.00 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.34 2buc h HIS 740 Cb 0.00 -0.07 -0.00 0.00 -0.00 0.00 0.00 27.41 27.33 2buc h HIS 740 CO 0.00 0.33 -0.02 0.78 -0.00 0.00 0.00 177.93 179.02 2buc h GLY 741 N 0.66 0.00 -7.08 5.26 0.00 -2.00 -3.48 103.07 96.44 2buc h GLY 741 Ca 0.05 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.76 2buc h GLY 741 CO 0.01 0.00 -0.97 1.39 0.00 0.00 0.00 176.54 176.98 2buc n ILE 742 N -3.11 -1.05 0.95 2.60 5.41 -0.92 -4.85 119.36 118.40 2buc n ILE 742 Ca 0.04 -0.50 0.11 0.00 1.00 0.00 0.00 62.75 63.40 2buc n ILE 742 Cb 0.52 -1.04 0.04 0.00 -0.71 0.00 0.00 39.64 38.46 2buc n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2buc n ALA 743 N -4.59 2.98 -1.79 -1.39 0.00 -1.26 -3.61 120.51 110.85 2buc n ALA 743 Ca -0.33 -0.65 -0.41 0.00 0.00 0.00 0.00 53.44 52.05 2buc n ALA 743 Cb 0.70 -0.76 -0.01 0.00 0.00 0.00 0.00 19.45 19.38 2buc n ALA 743 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2buc s SER 744 N -2.13 6.47 0.22 0.00 1.04 -1.26 -4.76 113.70 113.27 2buc s SER 744 Ca 0.22 2.91 -0.17 0.00 0.48 0.00 0.00 55.95 59.39 2buc s SER 744 Cb 0.18 -2.65 0.22 0.00 0.10 0.00 0.00 66.02 63.87 2buc s SER 744 CO 0.41 -0.80 1.50 -3.20 0.98 0.00 0.00 173.24 172.14 2buc n ASN 745 N 1.17 -0.64 0.04 7.02 2.85 -1.26 -0.35 115.26 124.09 2buc n ASN 745 Ca 0.03 1.69 -0.13 0.00 -0.11 0.00 0.00 54.58 56.07 2buc n ASN 745 Cb 0.39 -0.38 -0.02 0.00 1.24 0.00 0.00 39.78 41.01 2buc n ASN 745 CO 0.00 0.00 0.00 0.24 -2.11 0.00 0.00 177.26 175.39 2buc h MET 746 N 0.00 0.48 -0.21 1.20 2.86 -1.97 -2.63 114.93 114.66 2buc h MET 746 Ca 0.33 -0.44 -0.17 0.00 -2.06 0.00 0.00 59.70 57.36 2buc h MET 746 Cb 0.57 0.11 -0.00 0.00 0.06 0.00 0.00 31.60 32.34 2buc h MET 746 CO -0.96 1.08 -0.56 0.00 1.06 0.00 0.00 176.91 177.53 2buc h ALA 747 N 0.78 0.63 -0.61 6.32 0.00 -1.69 -1.71 119.26 122.99 2buc h ALA 747 Ca -0.06 -0.52 0.01 0.00 0.00 0.00 0.00 54.91 54.34 2buc h ALA 747 Cb 1.43 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 2buc h ALA 747 CO 0.15 0.69 0.40 1.25 0.00 0.00 0.00 179.25 181.74 2buc h HIS 748 N 0.49 0.76 -0.59 0.00 6.17 -0.68 -0.42 115.15 120.88 2buc h HIS 748 Ca 0.01 0.02 -0.08 0.00 0.71 0.00 0.00 60.37 61.03 2buc h HIS 748 Cb 1.12 -0.26 -0.02 0.00 2.52 0.00 0.00 27.41 30.77 2buc h HIS 748 CO 0.05 0.48 0.07 1.96 0.71 0.00 0.00 177.93 181.20 2buc h GLN 749 N 0.82 1.00 -0.27 5.26 4.20 -1.41 -3.21 115.11 121.50 2buc h GLN 749 Ca 0.22 -0.28 -0.12 0.00 0.06 0.00 0.00 58.65 58.53 2buc h GLN 749 Cb -0.09 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.57 2buc h GLN 749 CO -0.05 0.96 -0.31 1.25 -0.67 0.00 0.00 178.83 180.01 2buc h HIS 750 N 0.90 0.82 -0.75 2.96 2.76 -0.90 -2.64 115.15 118.30 2buc h HIS 750 Ca 0.18 -0.26 -0.06 0.00 -2.20 0.00 0.00 60.37 58.03 2buc h HIS 750 Cb 0.46 -0.17 -0.03 0.00 1.55 0.00 0.00 27.41 29.22 2buc h HIS 750 CO 0.03 1.00 0.24 0.97 -1.30 0.00 0.00 177.93 178.88 2buc h ILE 751 N 0.41 1.26 0.01 6.26 2.10 -1.15 -0.76 117.51 125.63 2buc h ILE 751 Ca 0.04 -0.90 -0.19 0.00 1.08 0.00 0.00 64.86 64.88 2buc h ILE 751 Cb 0.88 0.43 -0.02 0.00 -1.09 0.00 0.00 36.82 37.02 2buc h ILE 751 CO 0.07 0.36 -0.89 1.88 -1.08 0.00 0.00 178.15 178.49 2buc h TYR 752 N 1.12 0.10 -0.24 2.19 0.05 -1.59 -0.55 116.97 118.05 2buc h TYR 752 Ca 0.24 -0.06 -0.03 0.00 0.05 0.00 0.00 58.73 58.93 2buc h TYR 752 Cb 0.30 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.02 2buc h TYR 752 CO 0.03 0.92 0.02 1.15 -1.05 0.00 0.00 178.16 179.22 2buc h THR 753 N 0.03 1.24 -0.55 -2.88 2.02 -1.33 -1.11 112.91 110.33 2buc h THR 753 Ca -0.02 -0.84 -0.06 0.00 0.77 0.00 0.00 66.41 66.26 2buc h THR 753 Cb 1.55 1.34 -0.02 0.00 -1.74 0.00 0.00 68.15 69.27 2buc h THR 753 CO 0.12 0.26 0.11 -0.74 0.37 0.00 0.00 175.52 175.65 2buc h HIS 754 N 0.19 0.95 -0.25 3.16 -0.00 -1.07 -1.81 115.15 116.31 2buc h HIS 754 Ca 0.07 -0.12 -0.09 0.00 -0.00 0.00 0.00 60.37 60.23 2buc h HIS 754 Cb 0.37 -0.26 -0.01 0.00 -0.00 0.00 0.00 27.41 27.51 2buc h HIS 754 CO 0.03 0.83 -0.23 0.52 -0.00 0.00 0.00 177.93 179.08 2buc h MET 755 N 0.79 0.47 -0.45 5.26 2.07 -1.10 -2.03 114.93 119.93 2buc h MET 755 Ca 0.17 -0.17 -0.08 0.00 -2.07 0.00 0.00 59.70 57.55 2buc h MET 755 Cb 0.38 -0.03 -0.02 0.00 -1.87 0.00 0.00 31.60 30.06 2buc h MET 755 CO 0.01 0.67 -0.05 0.77 1.07 0.00 0.00 176.91 179.38 2buc h SER 756 N 0.42 0.82 0.08 1.22 0.02 -0.90 -0.28 113.55 114.92 2buc h SER 756 Ca 0.06 -0.33 -0.00 0.00 -0.84 0.00 0.00 61.79 60.68 2buc h SER 756 Cb 0.63 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.95 2buc h SER 756 CO 0.05 0.96 -0.04 0.45 -1.14 0.00 0.00 176.83 177.10 2buc h HIS 757 N 0.67 -0.11 -0.55 3.45 3.86 -1.24 -1.73 115.15 119.50 2buc h HIS 757 Ca 0.12 -0.00 0.04 0.00 -1.16 0.00 0.00 60.37 59.37 2buc h HIS 757 Cb 0.56 0.04 -0.04 0.00 1.06 0.00 0.00 27.41 29.03 2buc h HIS 757 CO 0.04 -0.07 0.31 0.35 0.86 0.00 0.00 177.93 179.42 2buc h PHE 758 N -0.11 0.56 -0.59 2.45 3.57 -1.24 -0.82 116.94 120.76 2buc h PHE 758 Ca -0.01 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 2buc h PHE 758 Cb 0.09 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.63 2buc h PHE 758 CO -0.08 0.30 0.04 1.25 -2.23 0.00 0.00 178.31 177.59 2buc h LEU 759 N 0.59 0.99 -0.59 0.59 6.46 -1.01 -1.91 115.31 120.43 2buc h LEU 759 Ca 0.23 -0.29 -0.11 0.00 -0.12 0.00 0.00 57.88 57.59 2buc h LEU 759 Cb 0.10 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 39.74 2buc h LEU 759 CO -0.14 1.04 -0.12 0.11 -0.62 0.00 0.00 178.44 178.71 2buc h LYS 760 N 0.92 0.99 -0.64 1.25 1.57 -1.00 -0.89 116.57 118.77 2buc h LYS 760 Ca 0.17 -0.37 -0.08 0.00 -1.87 0.00 0.00 60.65 58.51 2buc h LYS 760 Cb 0.50 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 2buc h LYS 760 CO 0.02 1.05 0.10 1.96 -0.57 0.00 0.00 179.45 182.00 2buc h GLN 761 N 0.88 1.07 -0.40 3.15 4.20 -1.07 0.31 115.11 123.25 2buc h GLN 761 Ca 0.14 -0.29 -0.12 0.00 0.06 0.00 0.00 58.65 58.43 2buc h GLN 761 Cb 0.68 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 2buc h GLN 761 CO 0.05 0.99 -0.22 0.00 -0.67 0.00 0.00 178.83 178.98 2buc n PHE 763 N -4.20 0.13 -1.26 0.00 3.72 -0.35 -4.87 117.46 110.63 2buc n PHE 763 Ca -0.01 -0.06 -0.11 0.00 -0.05 0.00 0.00 57.45 57.21 2buc n PHE 763 Cb 0.45 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.94 2buc n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2buc n SER 764 N -0.25 -4.06 -4.71 4.37 7.64 -0.76 -4.93 113.62 110.92 2buc n SER 764 Ca 0.08 0.28 -0.42 0.00 1.01 0.00 0.00 58.87 59.82 2buc n SER 764 Cb 0.12 -3.40 -0.03 0.00 -1.01 0.00 0.00 64.21 59.89 2buc n SER 764 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2buc s LEU 765 N -3.00 4.39 0.00 -3.43 1.43 0.10 -4.98 118.68 113.19 2buc s LEU 765 Ca 0.00 1.82 0.07 0.00 -1.03 0.00 0.00 54.13 54.99 2buc s LEU 765 Cb 0.00 -3.58 0.41 0.00 0.03 0.00 0.00 46.19 43.05 2buc s LEU 765 CO 0.00 -0.31 0.87 -0.81 0.23 0.00 0.00 176.35 176.33