#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i03 n ARG 40 N 0.00 0.21 -1.13 1.43 -4.01 -1.26 -5.08 116.66 106.83 2i03 n ARG 40 Ca 0.00 -1.34 -0.29 0.00 -1.04 0.00 0.00 57.85 55.18 2i03 n ARG 40 Cb 0.00 -0.35 0.15 0.00 -3.04 0.00 0.00 32.46 29.23 2i03 n ARG 40 CO 0.00 0.00 0.00 -1.59 -3.04 0.00 0.00 177.63 173.00 2i03 s LYS 41 N -3.77 0.94 0.65 2.89 0.00 -1.25 -4.55 119.74 114.64 2i03 s LYS 41 Ca 0.33 0.80 0.02 0.00 0.00 0.00 0.00 55.97 57.12 2i03 s LYS 41 Cb -0.02 -1.77 0.10 0.00 0.00 0.00 0.00 37.83 36.14 2i03 s LYS 41 CO 0.22 -2.46 0.90 0.95 0.00 0.00 0.00 175.35 174.97 2i03 s THR 42 N -2.89 2.25 -0.51 3.79 -4.23 -1.26 -1.47 115.64 111.32 2i03 s THR 42 Ca 0.64 -0.71 -0.23 0.00 -1.18 0.00 0.00 61.69 60.22 2i03 s THR 42 Cb -0.19 -2.54 0.04 0.00 1.34 0.00 0.00 72.50 71.15 2i03 s THR 42 CO 0.58 0.00 0.83 -0.47 -0.54 0.00 0.00 174.62 175.01 2i03 s TYR 43 N -2.95 2.90 0.77 3.99 5.04 -1.26 -4.82 117.35 121.02 2i03 s TYR 43 Ca 0.64 -0.09 -0.05 0.00 -2.44 0.00 0.00 57.07 55.12 2i03 s TYR 43 Cb -0.06 -3.84 0.13 0.00 0.35 0.00 0.00 41.96 38.53 2i03 s TYR 43 CO 0.42 -1.18 1.06 0.95 -1.34 0.00 0.00 175.55 175.46 2i03 s THR 44 N 3.48 2.16 0.11 4.34 -4.23 -1.26 -4.02 115.64 116.22 2i03 s THR 44 Ca 0.27 -0.40 -0.16 0.00 -1.18 0.00 0.00 61.69 60.22 2i03 s THR 44 Cb -0.14 -2.76 -0.04 0.00 1.34 0.00 0.00 72.50 70.90 2i03 s THR 44 CO 0.18 0.00 1.58 0.25 -0.54 0.00 0.00 174.62 176.09 2i03 h LEU 45 N -0.78 0.55 -1.41 4.79 5.85 -1.95 -2.65 115.31 119.71 2i03 h LEU 45 Ca -0.40 -0.27 0.01 0.00 0.84 0.00 0.00 57.88 58.05 2i03 h LEU 45 Cb 1.27 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.12 2i03 h LEU 45 CO 0.44 0.68 0.39 0.74 -0.34 0.00 0.00 178.44 180.36 2i03 h THR 46 N 0.40 1.15 -0.51 1.05 2.02 -1.97 0.44 112.91 115.50 2i03 h THR 46 Ca 0.10 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 2i03 h THR 46 Cb 0.37 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.04 2i03 h THR 46 CO 0.01 0.15 0.28 0.44 0.37 0.00 0.00 175.52 176.76 2i03 h ASP 47 N 0.81 0.63 0.13 4.18 3.32 -1.88 0.42 116.42 124.04 2i03 h ASP 47 Ca 0.22 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2i03 h ASP 47 Cb -0.09 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.30 2i03 h ASP 47 CO -0.05 0.54 -0.06 0.22 -1.72 0.00 0.00 179.24 178.17 2i03 h TYR 48 N 0.67 -0.16 -0.18 4.55 3.20 -0.93 -1.04 116.97 123.08 2i03 h TYR 48 Ca 0.18 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.98 2i03 h TYR 48 Cb 0.05 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 2i03 h TYR 48 CO -0.02 0.19 -0.18 -0.07 -1.64 0.00 0.00 178.16 176.44 2i03 h LEU 49 N -0.54 0.30 -2.72 2.82 3.38 -0.04 -2.75 115.31 115.76 2i03 h LEU 49 Ca -0.02 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2i03 h LEU 49 Cb 0.43 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2i03 h LEU 49 CO 0.03 0.50 0.00 0.29 0.09 0.00 0.00 178.44 179.35 2i03 n LYS 50 N -4.20 2.72 -4.07 1.13 4.76 0.15 -4.97 118.16 113.67 2i03 n LYS 50 Ca -0.00 -2.57 -0.38 0.00 -2.87 0.00 0.00 58.31 52.49 2i03 n LYS 50 Cb 0.32 -1.53 -0.01 0.00 -1.84 0.00 0.00 35.03 31.97 2i03 n LYS 50 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2i03 n ASN 51 N 1.53 -2.48 0.12 4.39 4.05 -0.51 -4.86 115.26 117.49 2i03 n ASN 51 Ca 0.23 -1.22 -0.03 0.00 0.45 0.00 0.00 54.58 54.01 2i03 n ASN 51 Cb 0.60 -2.05 0.15 0.00 1.23 0.00 0.00 39.78 39.71 2i03 n ASN 51 CO 0.00 0.00 0.00 0.71 -3.05 0.00 0.00 177.26 174.92 2i03 h THR 52 N -2.22 1.42 -3.43 -0.44 1.35 -1.50 -3.37 112.91 104.72 2i03 h THR 52 Ca -0.68 -2.08 -0.73 0.00 -0.55 0.00 0.00 66.41 62.37 2i03 h THR 52 Cb 1.40 2.10 -0.31 0.00 -1.73 0.00 0.00 68.15 69.61 2i03 h THR 52 CO 0.58 0.60 -0.33 -0.31 -0.25 0.00 0.00 175.52 175.81 2i03 s TYR 53 N -3.66 3.48 0.02 4.73 2.02 -1.26 -5.07 117.35 117.61 2i03 s TYR 53 Ca -0.02 -2.11 -0.06 0.00 -0.37 0.00 0.00 57.07 54.51 2i03 s TYR 53 Cb 0.12 -3.46 -0.05 0.00 -0.40 0.00 0.00 41.96 38.17 2i03 s TYR 53 CO 0.78 -0.96 0.27 0.50 -1.57 0.00 0.00 175.55 174.57 2i03 s ARG 54 N 0.89 3.58 0.03 -0.62 3.52 -1.26 -5.06 118.95 120.02 2i03 s ARG 54 Ca 0.10 -0.09 -0.18 0.00 -0.13 0.00 0.00 55.73 55.43 2i03 s ARG 54 Cb -0.23 -3.07 -0.06 0.00 -1.56 0.00 0.00 34.95 30.04 2i03 s ARG 54 CO -0.03 0.64 0.52 -0.51 -0.81 0.00 0.00 175.30 175.11 2i03 s LEU 55 N -1.83 4.48 -0.10 -0.88 1.43 -1.26 -4.77 118.68 115.75 2i03 s LEU 55 Ca 0.28 1.13 -0.11 0.00 -1.03 0.00 0.00 54.13 54.40 2i03 s LEU 55 Cb -0.13 -2.79 -0.05 0.00 0.03 0.00 0.00 46.19 43.25 2i03 s LEU 55 CO 0.17 0.25 0.24 -0.54 0.23 0.00 0.00 176.35 176.70 2i03 s LYS 56 N -0.84 3.81 0.36 1.70 1.02 -1.26 -5.09 119.74 119.44 2i03 s LYS 56 Ca 0.27 0.05 0.02 0.00 0.02 0.00 0.00 55.97 56.34 2i03 s LYS 56 Cb -0.18 -3.27 0.02 0.00 -0.52 0.00 0.00 37.83 33.88 2i03 s LYS 56 CO 0.16 0.60 0.15 1.28 -0.92 0.00 0.00 175.35 176.62 2i03 n LEU 57 N 2.42 0.00 -2.95 3.17 4.77 -1.26 -4.85 117.00 118.30 2i03 n LEU 57 Ca -0.16 -2.04 -0.11 0.00 -0.03 0.00 0.00 56.01 53.66 2i03 n LEU 57 Cb 0.53 0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.70 2i03 n LEU 57 CO 0.35 -0.40 -0.01 0.00 -1.33 0.00 0.00 177.39 176.01 2i03 n TYR 58 N -1.13 -2.91 -3.01 -1.77 4.19 -1.26 -4.99 117.16 106.28 2i03 n TYR 58 Ca -0.08 -1.99 -0.43 0.00 3.31 0.00 0.00 57.90 58.72 2i03 n TYR 58 Cb 0.43 1.10 -0.05 0.00 0.49 0.00 0.00 39.34 41.31 2i03 n TYR 58 CO 0.00 0.00 0.00 -1.12 0.91 0.00 0.00 176.86 176.65 2i03 s SER 59 N 0.41 6.29 0.40 2.98 0.01 -1.26 -5.03 113.70 117.50 2i03 s SER 59 Ca 0.31 -0.57 0.08 0.00 1.31 0.00 0.00 55.95 57.08 2i03 s SER 59 Cb 0.03 -2.36 -0.02 0.00 0.21 0.00 0.00 66.02 63.88 2i03 s SER 59 CO -0.11 -1.01 0.36 -1.48 0.41 0.00 0.00 173.24 171.41 2i03 s LEU 60 N 3.22 3.45 -0.18 2.44 0.05 -1.26 -4.38 118.68 122.01 2i03 s LEU 60 Ca 0.23 -0.68 -0.05 0.00 0.05 0.00 0.00 54.13 53.68 2i03 s LEU 60 Cb -0.15 -2.10 0.07 0.00 -2.05 0.00 0.00 46.19 41.95 2i03 s LEU 60 CO 0.16 -0.57 0.10 -0.60 -0.55 0.00 0.00 176.35 174.89 2i03 s ARG 61 N -4.10 0.08 0.17 1.48 3.00 -0.29 -4.93 118.95 114.37 2i03 s ARG 61 Ca 0.46 -0.09 -0.32 0.00 -1.00 0.00 0.00 55.73 54.78 2i03 s ARG 61 Cb -0.04 -1.74 -0.11 0.00 0.00 0.00 0.00 34.95 33.07 2i03 s ARG 61 CO 0.28 -0.70 1.66 -1.58 0.00 0.00 0.00 175.30 174.96 2i03 s TRP 62 N 2.15 2.84 -0.32 5.12 0.52 -1.26 -0.43 118.94 127.57 2i03 s TRP 62 Ca 0.03 0.42 0.09 0.00 0.02 0.00 0.00 56.10 56.65 2i03 s TRP 62 Cb -0.16 -4.04 -0.10 0.00 -1.15 0.00 0.00 33.47 28.02 2i03 s TRP 62 CO -0.11 -3.96 0.33 0.44 0.02 0.00 0.00 176.95 173.66 2i03 n ILE 63 N 4.13 0.00 -2.79 2.03 -5.35 -0.95 -4.91 119.36 111.52 2i03 n ILE 63 Ca 0.15 -0.28 0.00 0.00 -0.27 0.00 0.00 62.75 62.36 2i03 n ILE 63 Cb 0.37 0.84 0.00 0.00 -1.74 0.00 0.00 39.64 39.12 2i03 n ILE 63 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2i03 n SER 64 N -1.34 0.00 -1.03 7.28 3.41 -1.13 -4.99 113.62 115.83 2i03 n SER 64 Ca 0.01 -0.35 0.10 0.00 -0.26 0.00 0.00 58.87 58.37 2i03 n SER 64 Cb 0.16 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.31 2i03 n SER 64 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2i03 n ASP 65 N -0.66 3.30 0.00 4.04 2.03 -1.26 -2.65 116.55 121.35 2i03 n ASP 65 Ca 0.00 -1.94 0.00 0.00 0.52 0.00 0.00 54.79 53.37 2i03 n ASP 65 Cb 0.00 -0.26 0.00 0.00 -0.72 0.00 0.00 41.12 40.14 2i03 n ASP 65 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 2i03 n HIS 66 N 1.27 0.00 -4.24 -0.67 -0.00 -1.26 -4.52 115.22 105.79 2i03 n HIS 66 Ca 0.17 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 57.76 2i03 n HIS 66 Cb 0.55 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.43 2i03 n HIS 66 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 2i03 s GLU 67 N -0.32 1.12 0.15 -0.41 2.02 -1.26 -1.35 118.70 118.65 2i03 s GLU 67 Ca 0.00 -1.54 -0.17 0.00 0.02 0.00 0.00 54.97 53.27 2i03 s GLU 67 Cb 0.00 -0.25 0.04 0.00 0.10 0.00 0.00 34.13 34.02 2i03 s GLU 67 CO 0.00 -0.14 0.45 1.52 0.02 0.00 0.00 175.26 177.11 2i03 s TYR 68 N -3.68 -0.21 0.13 1.61 -0.85 -1.17 -2.25 117.35 110.93 2i03 s TYR 68 Ca 0.25 -0.10 0.04 0.00 -0.52 0.00 0.00 57.07 56.74 2i03 s TYR 68 Cb 0.06 0.32 -0.04 0.00 0.38 0.00 0.00 41.96 42.68 2i03 s TYR 68 CO 0.04 -0.77 0.10 -0.51 -1.52 0.00 0.00 175.55 172.89 2i03 s LEU 69 N -2.82 3.77 -0.27 -3.49 1.43 0.43 -0.83 118.68 116.91 2i03 s LEU 69 Ca 0.04 -0.09 -0.03 0.00 -1.03 0.00 0.00 54.13 53.02 2i03 s LEU 69 Cb 0.01 -2.42 0.09 0.00 0.03 0.00 0.00 46.19 43.90 2i03 s LEU 69 CO -0.10 0.12 0.11 -0.47 0.23 0.00 0.00 176.35 176.24 2i03 s TYR 70 N -1.58 0.61 -0.05 0.29 5.04 0.85 -1.13 117.35 121.37 2i03 s TYR 70 Ca 0.30 -0.95 -0.30 0.00 -2.44 0.00 0.00 57.07 53.68 2i03 s TYR 70 Cb -0.11 -1.03 -0.05 0.00 0.35 0.00 0.00 41.96 41.13 2i03 s TYR 70 CO 0.22 -0.77 1.47 0.15 -1.34 0.00 0.00 175.55 175.28 2i03 s LYS 71 N 2.00 4.23 0.51 4.97 1.02 -1.26 -2.16 119.74 129.04 2i03 s LYS 71 Ca 0.07 1.99 0.08 0.00 0.02 0.00 0.00 55.97 58.13 2i03 s LYS 71 Cb -0.16 -3.76 0.04 0.00 -0.52 0.00 0.00 37.83 33.42 2i03 s LYS 71 CO -0.28 -0.70 0.56 -0.65 -0.92 0.00 0.00 175.35 173.35 2i03 s GLN 72 N 3.22 2.43 0.53 1.68 -0.21 -0.14 -4.99 119.66 122.17 2i03 s GLN 72 Ca 0.65 -1.66 0.23 0.00 0.02 0.00 0.00 55.36 54.60 2i03 s GLN 72 Cb -0.30 -2.46 1.36 0.00 1.00 0.00 0.00 33.01 32.61 2i03 s GLN 72 CO 0.25 -0.55 2.04 1.49 -2.12 0.00 0.00 175.29 176.40 2i03 h GLU 73 N 0.60 0.00 0.00 2.91 4.81 -2.04 -3.32 114.58 117.54 2i03 h GLU 73 Ca -0.36 -0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 58.72 2i03 h GLU 73 Cb 1.29 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.64 2i03 h GLU 73 CO 0.50 0.00 -1.32 0.09 -0.73 0.00 0.00 179.01 177.54 2i03 n ASN 74 N -4.42 1.11 -4.35 1.04 3.02 -1.26 -5.10 115.26 105.29 2i03 n ASN 74 Ca 0.06 0.18 -0.18 0.00 -0.03 0.00 0.00 54.58 54.62 2i03 n ASN 74 Cb 0.46 -0.43 -0.10 0.00 -0.61 0.00 0.00 39.78 39.10 2i03 n ASN 74 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2i03 s ASN 75 N -6.11 1.84 0.12 6.41 2.20 -1.25 -3.95 114.94 114.19 2i03 s ASN 75 Ca -0.17 -1.28 -0.03 0.00 -0.94 0.00 0.00 52.86 50.44 2i03 s ASN 75 Cb 0.05 0.01 -0.05 0.00 -2.00 0.00 0.00 41.25 39.27 2i03 s ASN 75 CO 0.22 -0.57 0.32 -0.63 -2.94 0.00 0.00 177.10 173.50 2i03 s ILE 76 N -3.45 5.24 0.10 0.54 1.01 -1.19 -0.96 121.20 122.50 2i03 s ILE 76 Ca 0.32 -0.13 0.07 0.00 0.00 0.00 0.00 60.65 60.91 2i03 s ILE 76 Cb 0.07 -3.63 -0.03 0.00 0.01 0.00 0.00 42.46 38.87 2i03 s ILE 76 CO 0.11 0.07 -0.17 -0.76 0.00 0.00 0.00 174.94 174.19 2i03 s LEU 77 N -2.62 2.33 -0.22 2.97 1.43 -0.92 -0.92 118.68 120.73 2i03 s LEU 77 Ca 0.39 -0.72 -0.01 0.00 -1.03 0.00 0.00 54.13 52.77 2i03 s LEU 77 Cb -0.12 -0.68 0.02 0.00 0.03 0.00 0.00 46.19 45.44 2i03 s LEU 77 CO 0.26 -0.05 -0.12 0.54 0.23 0.00 0.00 176.35 177.21 2i03 s VAL 78 N -1.55 2.57 0.27 -1.59 0.11 -0.20 -0.11 120.40 119.91 2i03 s VAL 78 Ca 0.05 -0.94 0.05 0.00 -2.93 0.00 0.00 61.98 58.21 2i03 s VAL 78 Cb -0.08 -2.21 -0.03 0.00 -1.53 0.00 0.00 36.38 32.53 2i03 s VAL 78 CO 0.04 0.36 0.40 -0.36 -3.33 0.00 0.00 175.10 172.20 2i03 s PHE 79 N 1.32 3.42 -0.38 1.54 0.08 -0.01 -2.32 117.98 121.62 2i03 s PHE 79 Ca 0.02 0.00 -0.05 0.00 0.12 0.00 0.00 56.93 57.03 2i03 s PHE 79 Cb -0.15 -1.66 0.08 0.00 -0.57 0.00 0.00 43.02 40.72 2i03 s PHE 79 CO -0.08 0.34 0.17 1.21 -0.10 0.00 0.00 175.22 176.77 2i03 s ASN 80 N -4.01 5.30 0.49 1.36 3.84 0.06 -3.02 114.94 118.96 2i03 s ASN 80 Ca 0.36 -1.66 0.31 0.00 0.21 0.00 0.00 52.86 52.08 2i03 s ASN 80 Cb -0.09 -1.85 1.41 0.00 -0.55 0.00 0.00 41.25 40.17 2i03 s ASN 80 CO 0.30 -0.47 1.77 0.00 -2.79 0.00 0.00 177.10 175.92 2i03 h ALA 81 N 8.16 2.84 0.45 1.71 0.00 -1.53 0.38 119.26 131.27 2i03 h ALA 81 Ca -0.18 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 2i03 h ALA 81 Cb 1.06 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2i03 h ALA 81 CO 0.68 -1.23 -0.22 1.49 0.00 0.00 0.00 179.25 179.97 2i03 h GLU 82 N 0.13 -0.59 0.00 0.00 4.57 -1.94 -3.38 114.58 113.37 2i03 h GLU 82 Ca 0.60 0.04 -0.06 0.00 -1.18 0.00 0.00 59.36 58.77 2i03 h GLU 82 Cb 2.10 0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 30.82 2i03 h GLU 82 CO -0.13 -0.39 -1.33 0.66 -1.18 0.00 0.00 179.01 176.64 2i03 n TYR 83 N -4.75 0.77 -0.41 0.92 4.01 -1.09 -4.98 117.16 111.64 2i03 n TYR 83 Ca -0.08 0.24 0.00 0.00 -0.16 0.00 0.00 57.90 57.90 2i03 n TYR 83 Cb 0.24 -0.92 0.00 0.00 -0.31 0.00 0.00 39.34 38.35 2i03 n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2i03 n GLY 84 N 1.27 0.80 3.78 2.72 0.00 0.13 -5.04 105.19 108.85 2i03 n GLY 84 Ca -0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 2i03 n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i03 s ASN 85 N -2.99 6.71 0.00 1.61 4.22 -1.26 -4.70 114.94 118.53 2i03 s ASN 85 Ca 0.00 2.03 0.00 0.00 -2.14 0.00 0.00 52.86 52.75 2i03 s ASN 85 Cb 0.00 -2.58 0.00 0.00 1.28 0.00 0.00 41.25 39.95 2i03 s ASN 85 CO 0.00 -0.52 0.00 -1.54 -2.04 0.00 0.00 177.10 173.00 2i03 n SER 86 N -0.17 1.33 -3.61 3.54 3.41 -1.26 -0.76 113.62 116.10 2i03 n SER 86 Ca 0.05 -0.72 -0.07 0.00 -0.26 0.00 0.00 58.87 57.88 2i03 n SER 86 Cb 0.50 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.40 2i03 n SER 86 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2i03 s SER 87 N -0.44 -0.22 -0.12 4.04 0.01 -0.98 -4.97 113.70 111.02 2i03 s SER 87 Ca 0.00 0.26 -0.29 0.00 1.31 0.00 0.00 55.95 57.23 2i03 s SER 87 Cb 0.00 0.21 -0.03 0.00 0.21 0.00 0.00 66.02 66.41 2i03 s SER 87 CO 0.00 -0.19 1.34 -0.69 0.41 0.00 0.00 173.24 174.11 2i03 s VAL 88 N -0.94 4.11 0.11 3.43 1.01 -1.26 -1.03 120.40 125.83 2i03 s VAL 88 Ca 0.03 1.36 0.03 0.00 0.00 0.00 0.00 61.98 63.41 2i03 s VAL 88 Cb -0.01 -3.88 -0.22 0.00 0.00 0.00 0.00 36.38 32.27 2i03 s VAL 88 CO -0.04 -0.10 1.25 0.15 0.00 0.00 0.00 175.10 176.37 2i03 h PHE 89 N 8.34 0.18 -0.80 5.22 3.04 -1.33 -3.46 116.94 128.12 2i03 h PHE 89 Ca -0.30 -0.12 0.19 0.00 3.98 0.00 0.00 57.97 61.71 2i03 h PHE 89 Cb 1.13 -0.01 -0.23 0.00 2.56 0.00 0.00 35.95 39.39 2i03 h PHE 89 CO 0.81 1.07 0.20 -0.48 -2.02 0.00 0.00 178.31 177.89 2i03 s LEU 90 N -6.93 -0.56 1.03 0.59 -0.00 -1.22 -5.02 118.68 106.57 2i03 s LEU 90 Ca -0.01 0.65 -0.21 0.00 -0.00 0.00 0.00 54.13 54.56 2i03 s LEU 90 Cb 0.09 1.59 -0.07 0.00 -0.00 0.00 0.00 46.19 47.80 2i03 s LEU 90 CO 0.84 -0.11 -0.65 -0.62 -0.00 0.00 0.00 176.35 175.82 2i03 n GLU 91 N 5.07 -0.50 0.08 1.48 4.71 -1.26 -3.16 120.64 127.06 2i03 n GLU 91 Ca -0.08 -0.13 0.12 0.00 -0.01 0.00 0.00 57.16 57.06 2i03 n GLU 91 Cb 0.53 -1.33 0.18 0.00 -1.01 0.00 0.00 31.44 29.80 2i03 n GLU 91 CO 0.00 0.00 0.00 -2.95 0.09 0.00 0.00 177.13 174.27 2i03 h ASN 92 N -1.39 0.00 0.91 1.62 -1.07 -1.95 -3.27 115.58 110.43 2i03 h ASN 92 Ca -0.45 -0.16 -0.02 0.00 0.07 0.00 0.00 56.30 55.74 2i03 h ASN 92 Cb 1.35 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.59 2i03 h ASN 92 CO 0.28 0.08 -1.10 -1.54 0.07 0.00 0.00 177.43 175.22 2i03 n SER 93 N -2.23 0.81 -0.52 6.14 3.41 -1.26 -4.28 113.62 115.69 2i03 n SER 93 Ca 0.03 0.32 0.42 0.00 -0.26 0.00 0.00 58.87 59.38 2i03 n SER 93 Cb 0.45 0.49 0.71 0.00 -0.26 0.00 0.00 64.21 65.60 2i03 n SER 93 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2i03 h THR 94 N 0.00 0.04 0.00 6.66 2.02 -1.92 0.22 112.91 119.93 2i03 h THR 94 Ca -0.02 -0.01 -0.04 0.00 0.77 0.00 0.00 66.41 67.11 2i03 h THR 94 Cb 1.07 0.01 -0.09 0.00 -1.74 0.00 0.00 68.15 67.40 2i03 h THR 94 CO 0.01 0.00 -0.61 0.49 0.37 0.00 0.00 175.52 175.78 2i03 n PHE 95 N -4.54 0.00 -0.06 3.16 3.72 -1.26 -4.88 117.46 113.60 2i03 n PHE 95 Ca 0.40 -1.26 -0.04 0.00 -0.05 0.00 0.00 57.45 56.51 2i03 n PHE 95 Cb 1.64 -0.22 -0.03 0.00 -0.94 0.00 0.00 39.48 39.92 2i03 n PHE 95 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2i03 h ASP 96 N 0.98 -0.54 -1.40 4.37 3.32 -0.76 -1.95 116.42 120.44 2i03 h ASP 96 Ca -0.05 0.07 -0.64 0.00 0.02 0.00 0.00 57.03 56.43 2i03 h ASP 96 Cb 1.21 0.23 -0.19 0.00 0.22 0.00 0.00 39.33 40.79 2i03 h ASP 96 CO 0.02 -0.10 1.08 -1.84 -1.72 0.00 0.00 179.24 176.68 2i03 n GLU 97 N -3.49 3.35 0.13 3.56 0.28 -1.26 -4.46 120.64 118.74 2i03 n GLU 97 Ca -0.01 -3.10 -0.01 0.00 -0.16 0.00 0.00 57.16 53.88 2i03 n GLU 97 Cb 0.09 -2.32 0.12 0.00 1.43 0.00 0.00 31.44 30.76 2i03 n GLU 97 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 2i03 h PHE 98 N 3.52 0.00 0.00 -1.84 3.57 -1.72 -3.47 116.94 117.00 2i03 h PHE 98 Ca 0.52 0.00 0.00 0.00 3.53 0.00 0.00 57.97 62.02 2i03 h PHE 98 Cb 0.44 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.18 2i03 h PHE 98 CO 1.43 0.66 0.00 0.41 -2.23 0.00 0.00 178.31 178.58 2i03 n GLY 99 N 0.56 2.32 3.18 2.40 0.00 -1.26 -5.04 105.19 107.35 2i03 n GLY 99 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2i03 n GLY 99 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2i03 s HIS 100 N -2.66 0.96 -0.30 1.61 3.76 -1.26 -5.12 115.29 112.27 2i03 s HIS 100 Ca 0.00 -1.10 -0.23 0.00 -0.15 0.00 0.00 55.06 53.58 2i03 s HIS 100 Cb 0.00 -0.56 -0.00 0.00 1.11 0.00 0.00 32.58 33.13 2i03 s HIS 100 CO 0.00 -0.35 0.75 0.45 -0.85 0.00 0.00 174.74 174.74 2i03 s SER 101 N -3.08 6.62 -0.33 1.40 0.15 -1.26 -5.02 113.70 112.18 2i03 s SER 101 Ca 0.21 0.61 -0.25 0.00 0.70 0.00 0.00 55.95 57.22 2i03 s SER 101 Cb 0.07 -2.39 0.01 0.00 -1.71 0.00 0.00 66.02 62.00 2i03 s SER 101 CO 0.01 -0.58 0.85 -0.63 1.20 0.00 0.00 173.24 174.09 2i03 s ILE 102 N 2.87 4.70 -0.91 6.45 1.01 -1.26 -4.33 121.20 129.72 2i03 s ILE 102 Ca 0.31 1.19 0.25 0.00 0.00 0.00 0.00 60.65 62.39 2i03 s ILE 102 Cb -0.14 -4.23 0.01 0.00 0.01 0.00 0.00 42.46 38.11 2i03 s ILE 102 CO 0.12 -0.38 1.39 -0.46 0.00 0.00 0.00 174.94 175.61 2i03 n ASN 103 N 6.45 0.53 -3.52 3.58 6.94 0.10 -4.97 115.26 124.36 2i03 n ASN 103 Ca 0.05 -0.16 -0.08 0.00 -0.02 0.00 0.00 54.58 54.37 2i03 n ASN 103 Cb 0.48 0.24 -0.02 0.00 -2.36 0.00 0.00 39.78 38.12 2i03 n ASN 103 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2i03 s ASP 104 N -3.27 -0.34 0.24 0.53 -1.08 -1.18 -5.02 116.67 106.54 2i03 s ASP 104 Ca 0.10 0.06 0.08 0.00 -0.52 0.00 0.00 52.55 52.26 2i03 s ASP 104 Cb 0.17 0.34 -0.05 0.00 -1.46 0.00 0.00 42.92 41.92 2i03 s ASP 104 CO 0.70 -0.54 -0.12 -0.31 0.52 0.00 0.00 175.17 175.42 2i03 s TYR 105 N -2.76 1.85 -0.29 -5.34 1.51 -1.26 -1.52 117.35 109.53 2i03 s TYR 105 Ca 0.05 -0.58 0.04 0.00 -1.01 0.00 0.00 57.07 55.56 2i03 s TYR 105 Cb -0.01 -0.91 0.20 0.00 -0.11 0.00 0.00 41.96 41.13 2i03 s TYR 105 CO -0.07 0.38 0.59 0.45 -1.11 0.00 0.00 175.55 175.79 2i03 s SER 106 N -3.38 -1.55 -0.07 2.29 0.15 -0.63 -4.94 113.70 105.58 2i03 s SER 106 Ca 0.25 0.37 -0.26 0.00 0.70 0.00 0.00 55.95 57.00 2i03 s SER 106 Cb 0.00 2.06 -0.03 0.00 -1.71 0.00 0.00 66.02 66.35 2i03 s SER 106 CO 0.09 -0.29 0.85 -0.63 1.20 0.00 0.00 173.24 174.46 2i03 s ILE 107 N 2.83 4.93 0.72 6.45 1.01 -1.26 -0.03 121.20 135.86 2i03 s ILE 107 Ca 0.13 1.74 -0.16 0.00 0.00 0.00 0.00 60.65 62.36 2i03 s ILE 107 Cb -0.11 -4.18 0.01 0.00 0.01 0.00 0.00 42.46 38.19 2i03 s ILE 107 CO -0.25 0.15 1.04 -1.54 0.00 0.00 0.00 174.94 174.35 2i03 n SER 108 N 4.23 0.78 0.00 3.58 3.41 -0.56 -4.75 113.62 120.32 2i03 n SER 108 Ca 0.03 0.68 0.03 0.00 -0.26 0.00 0.00 58.87 59.36 2i03 n SER 108 Cb 0.50 -1.44 0.20 0.00 -0.26 0.00 0.00 64.21 63.21 2i03 n SER 108 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2i03 n PRO 109 N -2.03 0.30 0.03 4.33 -0.04 -1.26 -1.25 135.00 135.07 2i03 n PRO 109 Ca 0.14 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.48 2i03 n PRO 109 Cb 0.49 -1.35 -0.14 0.00 -0.04 0.00 0.00 33.50 32.47 2i03 n PRO 109 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2i03 h ASP 110 N 0.00 0.16 0.00 3.54 3.58 -1.54 -3.46 116.42 118.70 2i03 h ASP 110 Ca 0.00 -0.26 0.00 0.00 0.42 0.00 0.00 57.03 57.19 2i03 h ASP 110 Cb 0.00 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.00 2i03 h ASP 110 CO 0.00 1.22 0.00 0.61 -2.88 0.00 0.00 179.24 178.19 2i03 n GLY 111 N 1.58 2.24 0.07 -0.78 0.00 -0.38 -4.87 105.19 103.05 2i03 n GLY 111 Ca -0.14 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.80 2i03 n GLY 111 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2i03 h GLN 112 N 2.51 0.03 -5.06 1.61 4.20 -1.92 -3.46 115.11 113.01 2i03 h GLN 112 Ca 0.00 -0.06 -0.34 0.00 0.06 0.00 0.00 58.65 58.32 2i03 h GLN 112 Cb 0.00 0.02 -0.17 0.00 0.30 0.00 0.00 27.48 27.63 2i03 h GLN 112 CO 0.00 0.99 -0.73 -0.06 -0.67 0.00 0.00 178.83 178.36 2i03 s PHE 113 N -2.70 1.15 -0.06 2.96 0.08 -1.26 -1.05 117.98 117.11 2i03 s PHE 113 Ca -0.00 -0.65 0.05 0.00 0.12 0.00 0.00 56.93 56.44 2i03 s PHE 113 Cb 0.09 -0.62 -0.00 0.00 -0.57 0.00 0.00 43.02 41.92 2i03 s PHE 113 CO 0.83 0.04 -0.21 0.42 -0.10 0.00 0.00 175.22 176.20 2i03 s ILE 114 N -2.52 1.71 -0.12 0.64 1.01 -0.55 -1.49 121.20 119.88 2i03 s ILE 114 Ca 0.08 -0.87 -0.13 0.00 0.00 0.00 0.00 60.65 59.73 2i03 s ILE 114 Cb -0.02 -1.47 -0.05 0.00 0.01 0.00 0.00 42.46 40.93 2i03 s ILE 114 CO 0.01 0.48 0.31 -0.22 0.00 0.00 0.00 174.94 175.51 2i03 s LEU 115 N 0.02 4.31 -0.18 2.97 2.96 0.96 -0.75 118.68 128.97 2i03 s LEU 115 Ca -0.06 0.61 -0.01 0.00 -0.22 0.00 0.00 54.13 54.46 2i03 s LEU 115 Cb -0.13 -2.39 0.00 0.00 0.50 0.00 0.00 46.19 44.17 2i03 s LEU 115 CO 0.04 0.18 -0.14 -0.76 -1.32 0.00 0.00 176.35 174.35 2i03 s LEU 116 N -0.05 2.49 -0.19 -0.68 1.43 0.75 -1.60 118.68 120.82 2i03 s LEU 116 Ca 0.18 -0.50 -0.08 0.00 -1.03 0.00 0.00 54.13 52.70 2i03 s LEU 116 Cb -0.14 -1.59 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 2i03 s LEU 116 CO 0.06 0.03 0.07 -0.70 0.23 0.00 0.00 176.35 176.05 2i03 s GLU 117 N 1.13 3.97 0.32 1.70 2.12 -0.58 -1.81 118.70 125.55 2i03 s GLU 117 Ca 0.01 -0.34 -0.00 0.00 0.36 0.00 0.00 54.97 55.00 2i03 s GLU 117 Cb -0.14 -3.26 -0.01 0.00 0.26 0.00 0.00 34.13 30.97 2i03 s GLU 117 CO -0.05 0.22 0.38 1.52 -0.54 0.00 0.00 175.26 176.79 2i03 s TYR 118 N 0.52 1.24 -1.44 5.30 1.13 -0.98 -0.73 117.35 122.39 2i03 s TYR 118 Ca 0.04 -1.38 -0.09 0.00 -1.41 0.00 0.00 57.07 54.23 2i03 s TYR 118 Cb -0.13 -0.31 0.05 0.00 -1.10 0.00 0.00 41.96 40.47 2i03 s TYR 118 CO 0.01 -0.99 0.68 0.09 -2.51 0.00 0.00 175.55 172.83 2i03 n ASN 119 N -1.25 -4.98 -4.69 -0.18 3.02 -1.26 -0.74 115.26 105.18 2i03 n ASN 119 Ca 0.03 -0.45 -0.42 0.00 -0.03 0.00 0.00 54.58 53.71 2i03 n ASN 119 Cb 0.62 -4.03 -0.03 0.00 -0.61 0.00 0.00 39.78 35.73 2i03 n ASN 119 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2i03 s TYR 120 N -3.12 2.31 -0.14 3.10 5.04 -1.26 -4.39 117.35 118.89 2i03 s TYR 120 Ca 0.44 0.12 -0.01 0.00 -2.44 0.00 0.00 57.07 55.17 2i03 s TYR 120 Cb -0.21 -4.11 0.04 0.00 0.35 0.00 0.00 41.96 38.02 2i03 s TYR 120 CO 0.54 -4.52 -0.02 0.08 -1.34 0.00 0.00 175.55 170.30 2i03 s VAL 121 N 2.53 0.73 0.24 3.14 1.01 -0.57 -5.01 120.40 122.47 2i03 s VAL 121 Ca 0.78 -0.35 -0.30 0.00 0.00 0.00 0.00 61.98 62.11 2i03 s VAL 121 Cb -0.45 -0.97 -0.09 0.00 0.00 0.00 0.00 36.38 34.87 2i03 s VAL 121 CO 0.35 0.11 1.09 -0.75 0.00 0.00 0.00 175.10 175.90 2i03 s LYS 122 N 1.80 4.64 0.00 2.72 2.20 -1.26 -1.20 119.74 128.63 2i03 s LYS 122 Ca 0.02 1.76 0.00 0.00 -0.36 0.00 0.00 55.97 57.39 2i03 s LYS 122 Cb -0.15 -3.22 0.00 0.00 -1.51 0.00 0.00 37.83 32.95 2i03 s LYS 122 CO -0.07 0.18 0.00 0.94 -0.36 0.00 0.00 175.35 176.04 2i03 n GLN 123 N 1.62 0.00 0.00 4.03 7.27 -0.78 -4.92 117.38 124.60 2i03 n GLN 123 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2i03 n GLN 123 Cb 0.45 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.10 2i03 n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 2i03 n TRP 124 N 0.00 0.00 -0.27 3.69 5.03 -1.23 -4.93 117.44 119.74 2i03 n TRP 124 Ca 0.00 0.00 0.02 0.00 3.03 0.00 0.00 57.50 60.55 2i03 n TRP 124 Cb 0.00 0.00 0.23 0.00 -1.03 0.00 0.00 31.31 30.51 2i03 n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 2i03 h ARG 125 N 0.00 1.03 0.00 -0.99 2.43 -1.99 -3.35 114.38 111.51 2i03 h ARG 125 Ca 0.00 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2i03 h ARG 125 Cb 0.00 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 29.32 2i03 h ARG 125 CO 0.00 0.68 -0.98 0.72 -1.51 0.00 0.00 179.97 178.88 2i03 n HIS 126 N -4.44 0.00 -1.52 2.20 8.25 -1.26 -5.08 115.22 113.37 2i03 n HIS 126 Ca 0.11 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.27 2i03 n HIS 126 Cb 0.09 0.00 0.09 0.00 1.12 0.00 0.00 29.99 31.29 2i03 n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2i03 s SER 127 N -3.00 4.49 0.00 0.41 1.04 -1.26 -4.69 113.70 110.69 2i03 s SER 127 Ca 0.00 1.37 0.00 0.00 0.48 0.00 0.00 55.95 57.80 2i03 s SER 127 Cb 0.00 -2.11 0.00 0.00 0.10 0.00 0.00 66.02 64.01 2i03 s SER 127 CO 0.00 -1.98 0.00 0.00 0.98 0.00 0.00 173.24 172.24 2i03 n TYR 128 N -3.45 0.00 -4.42 5.02 0.18 -1.26 -1.87 117.16 111.36 2i03 n TYR 128 Ca 0.07 0.00 -0.23 0.00 1.88 0.00 0.00 57.90 59.62 2i03 n TYR 128 Cb 0.56 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.41 2i03 n TYR 128 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 2i03 s THR 129 N -2.00 2.23 0.27 -3.48 -4.23 -0.34 -4.64 115.64 103.45 2i03 s THR 129 Ca 0.00 -2.24 -0.21 0.00 -1.18 0.00 0.00 61.69 58.07 2i03 s THR 129 Cb 0.00 -2.16 0.05 0.00 1.34 0.00 0.00 72.50 71.73 2i03 s THR 129 CO 0.00 -0.37 0.83 0.00 -0.54 0.00 0.00 174.62 174.54 2i03 s ALA 130 N -2.38 -1.23 0.19 3.99 0.00 -0.61 -1.51 121.76 120.20 2i03 s ALA 130 Ca 0.25 -0.33 0.05 0.00 0.00 0.00 0.00 51.96 51.92 2i03 s ALA 130 Cb -0.05 0.74 -0.04 0.00 0.00 0.00 0.00 23.12 23.78 2i03 s ALA 130 CO 0.11 -1.03 0.23 -1.12 0.00 0.00 0.00 175.76 173.95 2i03 s SER 131 N -3.02 5.87 -0.06 0.00 0.01 0.08 -1.81 113.70 114.77 2i03 s SER 131 Ca 0.14 -0.04 -0.02 0.00 1.31 0.00 0.00 55.95 57.33 2i03 s SER 131 Cb -0.04 -1.63 0.04 0.00 0.21 0.00 0.00 66.02 64.60 2i03 s SER 131 CO 0.07 0.02 0.12 -0.31 0.41 0.00 0.00 173.24 173.55 2i03 s TYR 132 N -1.87 -0.12 -0.00 2.43 1.51 -1.26 -2.33 117.35 115.71 2i03 s TYR 132 Ca 0.33 0.41 0.07 0.00 -1.01 0.00 0.00 57.07 56.87 2i03 s TYR 132 Cb -0.10 -0.13 -0.02 0.00 -0.11 0.00 0.00 41.96 41.60 2i03 s TYR 132 CO 0.26 -0.15 -0.23 -0.51 -1.11 0.00 0.00 175.55 173.80 2i03 s ASP 133 N 1.21 3.32 -0.15 2.29 1.01 -0.75 -4.07 116.67 119.53 2i03 s ASP 133 Ca -0.08 -0.45 -0.04 0.00 0.71 0.00 0.00 52.55 52.69 2i03 s ASP 133 Cb -0.12 -0.44 -0.03 0.00 1.01 0.00 0.00 42.92 43.34 2i03 s ASP 133 CO -0.05 0.30 -0.02 -0.63 0.21 0.00 0.00 175.17 174.98 2i03 s ILE 134 N -0.71 4.07 -0.18 0.77 1.01 -1.26 -0.18 121.20 124.72 2i03 s ILE 134 Ca 0.11 -0.30 -0.04 0.00 0.00 0.00 0.00 60.65 60.42 2i03 s ILE 134 Cb -0.10 -2.78 -0.03 0.00 0.01 0.00 0.00 42.46 39.56 2i03 s ILE 134 CO 0.01 0.50 -0.02 -0.47 0.00 0.00 0.00 174.94 174.96 2i03 s TYR 135 N 0.22 3.03 -0.52 3.97 5.04 0.07 -1.46 117.35 127.70 2i03 s TYR 135 Ca -0.01 -0.39 -0.25 0.00 -2.44 0.00 0.00 57.07 53.97 2i03 s TYR 135 Cb -0.14 -2.03 0.03 0.00 0.35 0.00 0.00 41.96 40.18 2i03 s TYR 135 CO 0.02 -0.15 0.98 0.34 -1.34 0.00 0.00 175.55 175.41 2i03 s ASP 136 N 0.71 6.42 0.41 4.32 -1.08 0.14 -1.49 116.67 126.11 2i03 s ASP 136 Ca -0.01 -0.09 0.10 0.00 -0.52 0.00 0.00 52.55 52.04 2i03 s ASP 136 Cb -0.14 -2.46 0.88 0.00 -1.46 0.00 0.00 42.92 39.73 2i03 s ASP 136 CO 0.02 -1.21 1.97 -0.07 0.52 0.00 0.00 175.17 176.40 2i03 h LEU 137 N 11.00 0.21 0.49 -1.34 3.38 -1.38 0.50 115.31 128.18 2i03 h LEU 137 Ca -0.25 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 2i03 h LEU 137 Cb 1.07 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2i03 h LEU 137 CO 1.09 0.31 -0.24 0.78 0.09 0.00 0.00 178.44 180.47 2i03 h ASN 138 N 0.22 -0.56 0.88 -0.43 2.35 -1.91 -3.22 115.58 112.92 2i03 h ASN 138 Ca 0.05 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 2i03 h ASN 138 Cb 0.26 0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.78 2i03 h ASN 138 CO 0.01 -0.35 0.00 0.29 -1.65 0.00 0.00 177.43 175.74 2i03 n LYS 139 N -4.09 0.07 -3.49 0.81 5.02 -1.18 -4.90 118.16 110.40 2i03 n LYS 139 Ca -0.08 0.18 -0.18 0.00 -2.02 0.00 0.00 58.31 56.20 2i03 n LYS 139 Cb 0.26 -1.61 0.08 0.00 -0.02 0.00 0.00 35.03 33.75 2i03 n LYS 139 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2i03 n ARG 140 N -1.74 -6.52 -3.90 1.97 1.74 0.17 -5.00 116.66 103.39 2i03 n ARG 140 Ca 0.05 0.82 -0.10 0.00 -0.77 0.00 0.00 57.85 57.84 2i03 n ARG 140 Cb 0.29 -5.78 -0.10 0.00 -1.02 0.00 0.00 32.46 25.85 2i03 n ARG 140 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2i03 s GLN 141 N -5.54 0.46 0.26 5.56 2.00 -0.89 -4.98 119.66 116.52 2i03 s GLN 141 Ca 0.06 -0.48 -0.24 0.00 -2.00 0.00 0.00 55.36 52.70 2i03 s GLN 141 Cb -0.03 0.18 -0.09 0.00 0.80 0.00 0.00 33.01 33.88 2i03 s GLN 141 CO 0.74 -0.10 0.83 -0.51 -0.50 0.00 0.00 175.29 175.75 2i03 s LEU 142 N -1.48 4.39 -0.26 3.68 1.43 -1.26 0.23 118.68 125.42 2i03 s LEU 142 Ca -0.14 1.65 -0.17 0.00 -1.03 0.00 0.00 54.13 54.44 2i03 s LEU 142 Cb -0.08 -3.72 -0.03 0.00 0.03 0.00 0.00 46.19 42.39 2i03 s LEU 142 CO 0.00 0.02 0.47 -0.63 0.23 0.00 0.00 176.35 176.44 2i03 s ILE 143 N -1.49 5.11 -1.64 -0.59 1.01 -0.54 -4.89 121.20 118.17 2i03 s ILE 143 Ca 0.45 0.78 0.22 0.00 0.00 0.00 0.00 60.65 62.10 2i03 s ILE 143 Cb -0.19 -3.78 -0.09 0.00 0.01 0.00 0.00 42.46 38.41 2i03 s ILE 143 CO 0.23 0.12 1.01 0.35 0.00 0.00 0.00 174.94 176.65 2i03 n THR 144 N 5.05 0.00 -4.17 2.92 -2.24 -1.26 -4.62 114.28 109.97 2i03 n THR 144 Ca -0.06 -0.17 -0.31 0.00 -2.27 0.00 0.00 64.05 61.24 2i03 n THR 144 Cb 0.50 1.17 -0.08 0.00 -2.10 0.00 0.00 70.33 69.82 2i03 n THR 144 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2i03 s GLU 145 N -2.63 2.66 -1.38 -0.78 1.03 -1.26 -4.55 118.70 111.79 2i03 s GLU 145 Ca 0.14 -0.75 -0.06 0.00 0.03 0.00 0.00 54.97 54.34 2i03 s GLU 145 Cb 0.17 -2.60 0.03 0.00 -0.80 0.00 0.00 34.13 30.93 2i03 s GLU 145 CO 0.67 0.57 0.44 0.39 -1.33 0.00 0.00 175.26 175.99 2i03 n GLU 146 N 0.80 -3.71 -1.03 -4.83 -0.58 -1.26 -4.69 120.64 105.34 2i03 n GLU 146 Ca -0.12 0.69 -0.31 0.00 -0.42 0.00 0.00 57.16 57.00 2i03 n GLU 146 Cb 0.52 -5.44 0.12 0.00 -0.57 0.00 0.00 31.44 26.07 2i03 n GLU 146 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 2i03 s ARG 147 N -5.70 1.73 0.12 3.49 1.70 -1.26 -4.83 118.95 114.20 2i03 s ARG 147 Ca 0.28 1.36 -0.31 0.00 -0.47 0.00 0.00 55.73 56.59 2i03 s ARG 147 Cb -0.14 -1.82 -0.08 0.00 -0.57 0.00 0.00 34.95 32.34 2i03 s ARG 147 CO 0.35 -2.07 1.43 0.42 -1.08 0.00 0.00 175.30 174.35 2i03 s ILE 148 N -2.76 3.16 0.91 4.99 1.01 -1.26 -4.99 121.20 122.27 2i03 s ILE 148 Ca 0.64 0.83 -0.10 0.00 0.00 0.00 0.00 60.65 62.01 2i03 s ILE 148 Cb -0.20 -3.53 0.14 0.00 0.01 0.00 0.00 42.46 38.89 2i03 s ILE 148 CO 0.56 0.06 1.13 -2.16 0.00 0.00 0.00 174.94 174.54 2i03 s PRO 149 N 1.15 1.04 0.82 2.79 0.04 -1.26 -4.36 135.00 135.22 2i03 s PRO 149 Ca 0.66 1.46 -0.12 0.00 0.04 0.00 0.00 61.00 63.04 2i03 s PRO 149 Cb -0.38 -1.74 0.08 0.00 0.04 0.00 0.00 34.50 32.50 2i03 s PRO 149 CO 0.30 -2.59 1.13 -0.80 0.04 0.00 0.00 177.00 175.09 2i03 s ASN 150 N -2.75 4.37 -1.79 6.66 0.01 -1.26 -3.77 114.94 116.41 2i03 s ASN 150 Ca 0.66 1.01 -0.00 0.00 -0.71 0.00 0.00 52.86 53.83 2i03 s ASN 150 Cb -0.22 -1.64 0.00 0.00 0.41 0.00 0.00 41.25 39.80 2i03 s ASN 150 CO 0.58 -2.01 0.01 0.59 -1.51 0.00 0.00 177.10 174.75 2i03 n ASN 151 N -3.42 -5.94 -4.77 -1.22 3.02 -1.16 -4.95 115.26 96.83 2i03 n ASN 151 Ca 0.07 -0.02 -0.39 0.00 -0.03 0.00 0.00 54.58 54.21 2i03 n ASN 151 Cb 0.59 -4.94 -0.03 0.00 -0.61 0.00 0.00 39.78 34.79 2i03 n ASN 151 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2i03 s THR 152 N -3.05 3.32 -0.14 3.41 2.01 -0.75 -4.61 115.64 115.83 2i03 s THR 152 Ca 0.00 1.17 0.15 0.00 0.31 0.00 0.00 61.69 63.33 2i03 s THR 152 Cb -0.00 -3.69 -0.24 0.00 0.01 0.00 0.00 72.50 68.58 2i03 s THR 152 CO 0.00 0.16 0.31 0.00 -0.69 0.00 0.00 174.62 174.41 2i03 n GLN 153 N 0.45 0.67 -3.65 4.92 6.02 0.75 -1.58 117.38 124.95 2i03 n GLN 153 Ca 0.02 0.12 -0.13 0.00 -0.01 0.00 0.00 57.00 57.00 2i03 n GLN 153 Cb 0.46 -1.63 -0.08 0.00 1.02 0.00 0.00 30.24 30.01 2i03 n GLN 153 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2i03 s TRP 154 N -2.54 -0.73 0.06 1.08 -0.11 -1.19 -4.68 118.94 110.84 2i03 s TRP 154 Ca -0.08 1.77 0.04 0.00 1.22 0.00 0.00 56.10 59.04 2i03 s TRP 154 Cb 0.07 0.26 -0.03 0.00 -1.50 0.00 0.00 33.47 32.27 2i03 s TRP 154 CO 0.82 -0.35 -0.12 0.08 -4.62 0.00 0.00 176.95 172.75 2i03 s VAL 155 N 0.42 0.96 -0.28 5.86 1.01 -1.26 -0.12 120.40 126.98 2i03 s VAL 155 Ca -0.01 -1.25 -0.21 0.00 0.00 0.00 0.00 61.98 60.51 2i03 s VAL 155 Cb -0.05 -0.96 0.11 0.00 0.00 0.00 0.00 36.38 35.49 2i03 s VAL 155 CO -0.00 -0.27 0.92 0.28 0.00 0.00 0.00 175.10 176.02 2i03 s THR 156 N -1.32 0.00 0.64 3.92 -1.32 -0.22 -4.98 115.64 112.35 2i03 s THR 156 Ca -0.04 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.33 2i03 s THR 156 Cb -0.10 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.87 2i03 s THR 156 CO 0.02 0.00 1.04 0.26 -2.21 0.00 0.00 174.62 173.73 2i03 s TRP 157 N 0.75 3.42 0.70 9.09 0.52 -1.26 -1.48 118.94 130.68 2i03 s TRP 157 Ca -0.02 1.35 -0.11 0.00 0.02 0.00 0.00 56.10 57.34 2i03 s TRP 157 Cb -0.05 -2.79 0.01 0.00 -1.15 0.00 0.00 33.47 29.50 2i03 s TRP 157 CO -0.09 -0.87 1.06 -1.54 0.02 0.00 0.00 176.95 175.53 2i03 s SER 158 N -3.94 5.29 0.52 2.95 1.04 -0.78 -4.90 113.70 113.87 2i03 s SER 158 Ca 0.57 1.64 0.18 0.00 0.48 0.00 0.00 55.95 58.81 2i03 s SER 158 Cb -0.12 -2.50 1.31 0.00 0.10 0.00 0.00 66.02 64.81 2i03 s SER 158 CO 0.53 -1.51 2.13 -0.65 0.98 0.00 0.00 173.24 174.72 2i03 h PRO 159 N -0.76 0.00 0.00 4.02 0.11 -1.83 -3.42 132.00 130.12 2i03 h PRO 159 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2i03 h PRO 159 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2i03 h PRO 159 CO 0.56 0.00 -0.00 1.33 -0.21 0.00 0.00 178.00 179.68 2i03 n VAL 160 N -4.49 0.03 0.00 3.15 0.24 -1.26 -4.76 118.33 111.24 2i03 n VAL 160 Ca -0.01 0.06 0.00 0.00 -2.04 0.00 0.00 64.34 62.35 2i03 n VAL 160 Cb 0.17 -1.07 0.00 0.00 -1.47 0.00 0.00 33.84 31.47 2i03 n VAL 160 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2i03 n GLY 161 N 3.29 -1.89 1.96 7.63 0.00 -1.26 -3.34 105.19 111.58 2i03 n GLY 161 Ca -0.00 -0.30 0.02 0.00 0.00 0.00 0.00 46.02 45.74 2i03 n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2i03 n HIS 162 N 0.00 0.42 -1.46 1.61 1.44 -1.26 -3.04 115.22 112.92 2i03 n HIS 162 Ca 0.00 -1.07 -0.30 0.00 -2.01 0.00 0.00 57.72 54.34 2i03 n HIS 162 Cb 0.00 -0.16 0.09 0.00 0.12 0.00 0.00 29.99 30.04 2i03 n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 2i03 s LYS 163 N -1.30 2.24 0.01 -1.40 1.02 -1.26 -4.47 119.74 114.57 2i03 s LYS 163 Ca 0.31 0.84 0.00 0.00 0.02 0.00 0.00 55.97 57.14 2i03 s LYS 163 Cb 0.36 -1.92 -0.01 0.00 -0.52 0.00 0.00 37.83 35.74 2i03 s LYS 163 CO -0.12 -1.56 -0.02 -0.51 -0.92 0.00 0.00 175.35 172.21 2i03 s LEU 164 N -5.80 2.14 -0.04 3.17 1.43 0.72 -1.86 118.68 118.44 2i03 s LEU 164 Ca 0.60 -0.29 -0.00 0.00 -1.03 0.00 0.00 54.13 53.42 2i03 s LEU 164 Cb -0.15 0.03 0.03 0.00 0.03 0.00 0.00 46.19 46.13 2i03 s LEU 164 CO 0.55 -0.16 0.01 0.00 0.23 0.00 0.00 176.35 176.98 2i03 s ALA 165 N -0.82 0.33 0.11 4.21 0.00 -0.55 0.19 121.76 125.24 2i03 s ALA 165 Ca -0.09 0.14 0.01 0.00 0.00 0.00 0.00 51.96 52.03 2i03 s ALA 165 Cb -0.06 -0.42 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 2i03 s ALA 165 CO -0.00 -0.19 -0.03 1.52 0.00 0.00 0.00 175.76 177.06 2i03 s TYR 166 N 1.33 0.90 -0.11 0.00 -0.85 -0.57 -1.06 117.35 116.99 2i03 s TYR 166 Ca -0.05 -1.01 0.02 0.00 -0.52 0.00 0.00 57.07 55.51 2i03 s TYR 166 Cb -0.13 -0.53 -0.01 0.00 0.38 0.00 0.00 41.96 41.67 2i03 s TYR 166 CO -0.02 -0.26 -0.19 0.08 -1.52 0.00 0.00 175.55 173.64 2i03 s VAL 167 N -3.74 2.48 -0.07 -3.49 1.01 0.82 -1.06 120.40 116.34 2i03 s VAL 167 Ca 0.16 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 2i03 s VAL 167 Cb 0.06 -1.99 0.04 0.00 0.00 0.00 0.00 36.38 34.49 2i03 s VAL 167 CO -0.03 0.54 0.15 0.86 0.00 0.00 0.00 175.10 176.62 2i03 s TRP 168 N 0.37 -0.16 -1.40 5.22 -0.00 -0.30 -0.18 118.94 122.49 2i03 s TRP 168 Ca -0.15 0.51 -0.10 0.00 -0.00 0.00 0.00 56.10 56.36 2i03 s TRP 168 Cb -0.17 -0.15 0.03 0.00 -0.00 0.00 0.00 33.47 33.18 2i03 s TRP 168 CO 0.07 -0.20 1.13 0.09 -0.00 0.00 0.00 176.95 178.05 2i03 n ASN 169 N 4.57 -5.91 -0.72 5.86 5.03 -1.26 -1.84 115.26 120.98 2i03 n ASN 169 Ca -0.20 -0.61 -0.09 0.00 0.87 0.00 0.00 54.58 54.55 2i03 n ASN 169 Cb 0.51 -4.73 -0.04 0.00 -1.02 0.00 0.00 39.78 34.50 2i03 n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2i03 n ASN 170 N -2.97 -5.35 -4.46 6.41 5.03 -1.26 -4.30 115.26 108.36 2i03 n ASN 170 Ca 0.01 0.23 -0.28 0.00 0.87 0.00 0.00 54.58 55.42 2i03 n ASN 170 Cb 0.55 -3.68 -0.11 0.00 -1.02 0.00 0.00 39.78 35.52 2i03 n ASN 170 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 2i03 s ASP 171 N -2.43 3.67 -0.04 6.41 1.01 -0.77 -1.74 116.67 122.80 2i03 s ASP 171 Ca 0.00 -0.71 -0.14 0.00 0.71 0.00 0.00 52.55 52.40 2i03 s ASP 171 Cb 0.00 -0.41 -0.05 0.00 1.01 0.00 0.00 42.92 43.47 2i03 s ASP 171 CO 0.00 0.15 0.38 -0.63 0.21 0.00 0.00 175.17 175.28 2i03 s ILE 172 N -1.41 5.11 0.05 0.77 1.01 -1.26 -1.15 121.20 124.31 2i03 s ILE 172 Ca 0.19 0.78 0.04 0.00 0.00 0.00 0.00 60.65 61.66 2i03 s ILE 172 Cb -0.09 -3.69 -0.02 0.00 0.01 0.00 0.00 42.46 38.66 2i03 s ILE 172 CO 0.10 0.54 -0.12 -0.31 0.00 0.00 0.00 174.94 175.15 2i03 s TYR 173 N -0.76 1.05 -0.04 3.97 1.51 -0.23 -0.35 117.35 122.49 2i03 s TYR 173 Ca 0.23 -0.39 0.03 0.00 -1.01 0.00 0.00 57.07 55.93 2i03 s TYR 173 Cb -0.16 -0.61 0.00 0.00 -0.11 0.00 0.00 41.96 41.08 2i03 s TYR 173 CO 0.11 0.01 -0.14 0.08 -1.11 0.00 0.00 175.55 174.50 2i03 s VAL 174 N -1.03 1.23 -0.22 0.71 1.01 0.08 -1.50 120.40 120.67 2i03 s VAL 174 Ca -0.02 -0.59 0.00 0.00 0.00 0.00 0.00 61.98 61.37 2i03 s VAL 174 Cb -0.08 -1.08 0.03 0.00 0.00 0.00 0.00 36.38 35.25 2i03 s VAL 174 CO 0.01 0.37 -0.13 -0.54 0.00 0.00 0.00 175.10 174.81 2i03 s LYS 175 N 0.21 2.77 0.24 2.72 1.02 0.13 0.09 119.74 126.92 2i03 s LYS 175 Ca -0.06 -1.00 0.11 0.00 0.02 0.00 0.00 55.97 55.04 2i03 s LYS 175 Cb -0.12 -2.80 0.19 0.00 -0.52 0.00 0.00 37.83 34.58 2i03 s LYS 175 CO 0.02 -0.36 1.51 0.82 -0.92 0.00 0.00 175.35 176.42 2i03 h ILE 176 N 6.20 1.40 -3.65 2.17 5.03 -1.85 0.20 117.51 127.01 2i03 h ILE 176 Ca -0.35 -2.46 -0.32 0.00 -0.12 0.00 0.00 64.86 61.61 2i03 h ILE 176 Cb 1.11 2.37 -0.31 0.00 -3.03 0.00 0.00 36.82 36.95 2i03 h ILE 176 CO 0.57 0.68 -0.75 -1.61 -0.68 0.00 0.00 178.15 176.37 2i03 s GLU 177 N -3.26 0.32 0.49 2.37 0.41 -1.26 -4.30 118.70 113.47 2i03 s GLU 177 Ca 0.00 -0.02 0.36 0.00 -0.41 0.00 0.00 54.97 54.90 2i03 s GLU 177 Cb 0.11 -0.40 1.52 0.00 -1.78 0.00 0.00 34.13 33.58 2i03 s GLU 177 CO 0.77 -0.04 1.66 -1.35 -0.49 0.00 0.00 175.26 175.81 2i03 h PRO 178 N 6.71 0.07 -0.20 0.39 0.11 -1.85 -0.84 132.00 136.38 2i03 h PRO 178 Ca -0.35 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2i03 h PRO 178 Cb 1.16 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2i03 h PRO 178 CO 0.49 0.04 0.00 0.27 -0.21 0.00 0.00 178.00 178.60 2i03 n ASN 179 N -4.36 2.54 -4.92 -2.05 0.23 -1.26 -4.83 115.26 100.60 2i03 n ASN 179 Ca 0.36 -1.76 -0.26 0.00 -0.53 0.00 0.00 54.58 52.39 2i03 n ASN 179 Cb 1.52 -0.13 -0.01 0.00 -2.08 0.00 0.00 39.78 39.08 2i03 n ASN 179 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2i03 s LEU 180 N -1.02 3.84 0.52 -4.53 1.02 -0.32 -4.58 118.68 113.61 2i03 s LEU 180 Ca 0.20 0.69 -0.23 0.00 0.02 0.00 0.00 54.13 54.82 2i03 s LEU 180 Cb 0.12 -3.59 -0.06 0.00 0.02 0.00 0.00 46.19 42.68 2i03 s LEU 180 CO 0.17 -0.42 1.36 -2.84 0.02 0.00 0.00 176.35 174.64 2i03 s PRO 181 N -4.47 3.28 0.43 1.29 0.02 -1.26 -4.84 135.00 129.45 2i03 s PRO 181 Ca 0.44 2.25 -0.14 0.00 0.02 0.00 0.00 61.00 63.57 2i03 s PRO 181 Cb -0.10 -2.35 -0.08 0.00 0.02 0.00 0.00 34.50 32.00 2i03 s PRO 181 CO 0.40 -1.08 0.84 0.45 -0.33 0.00 0.00 177.00 177.28 2i03 s SER 182 N -0.88 6.62 -0.20 2.53 0.15 -1.26 -4.74 113.70 115.92 2i03 s SER 182 Ca 0.69 1.32 -0.09 0.00 0.70 0.00 0.00 55.95 58.57 2i03 s SER 182 Cb -0.40 -2.40 -0.04 0.00 -1.71 0.00 0.00 66.02 61.46 2i03 s SER 182 CO 0.49 -0.42 0.10 -0.31 1.20 0.00 0.00 173.24 174.30 2i03 s TYR 183 N -2.37 3.31 -0.24 3.44 2.02 0.11 -4.89 117.35 118.73 2i03 s TYR 183 Ca 0.55 0.17 -0.25 0.00 -0.37 0.00 0.00 57.07 57.16 2i03 s TYR 183 Cb -0.10 -2.14 -0.00 0.00 -0.40 0.00 0.00 41.96 39.31 2i03 s TYR 183 CO 0.28 0.17 0.84 0.50 -1.57 0.00 0.00 175.55 175.76 2i03 s ARG 184 N 0.53 4.19 -0.04 -0.62 3.52 -1.26 -0.74 118.95 124.52 2i03 s ARG 184 Ca 0.06 0.97 -0.01 0.00 -0.13 0.00 0.00 55.73 56.61 2i03 s ARG 184 Cb -0.12 -3.64 -0.26 0.00 -1.56 0.00 0.00 34.95 29.36 2i03 s ARG 184 CO 0.00 -0.52 0.68 0.82 -0.81 0.00 0.00 175.30 175.47 2i03 h ILE 185 N 5.42 0.94 -3.65 4.11 1.08 -1.06 -3.39 117.51 120.96 2i03 h ILE 185 Ca -0.23 -2.64 -0.38 0.00 -0.39 0.00 0.00 64.86 61.21 2i03 h ILE 185 Cb 1.09 2.62 -0.18 0.00 -3.07 0.00 0.00 36.82 37.28 2i03 h ILE 185 CO 0.88 0.77 -0.75 0.28 -0.69 0.00 0.00 178.15 178.64 2i03 s THR 186 N -2.60 1.19 -0.02 -0.27 -1.32 -1.20 -4.80 115.64 106.62 2i03 s THR 186 Ca -0.12 -1.66 0.03 0.00 -1.21 0.00 0.00 61.69 58.73 2i03 s THR 186 Cb 0.07 -1.44 0.04 0.00 -1.51 0.00 0.00 72.50 69.67 2i03 s THR 186 CO 0.82 -0.45 0.86 0.79 -2.21 0.00 0.00 174.62 174.44 2i03 n TRP 187 N 0.60 0.00 0.64 9.09 7.02 -1.26 -4.50 117.44 129.03 2i03 n TRP 187 Ca -0.16 -0.35 0.10 0.00 -1.02 0.00 0.00 57.50 56.06 2i03 n TRP 187 Cb 0.57 -0.05 0.10 0.00 -2.42 0.00 0.00 31.31 29.52 2i03 n TRP 187 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 2i03 n THR 188 N -0.42 0.14 -1.68 -0.99 -2.24 -1.26 -4.99 114.28 102.84 2i03 n THR 188 Ca 0.02 -0.57 -0.43 0.00 -2.27 0.00 0.00 64.05 60.80 2i03 n THR 188 Cb 0.44 1.27 -0.01 0.00 -2.10 0.00 0.00 70.33 69.94 2i03 n THR 188 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2i03 n GLY 189 N 1.09 0.53 3.53 3.38 0.00 -1.26 -4.66 105.19 107.80 2i03 n GLY 189 Ca 0.12 0.36 -0.03 0.00 0.00 0.00 0.00 46.02 46.47 2i03 n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2i03 s LYS 190 N -1.52 0.51 0.02 1.61 2.20 -0.90 -4.92 119.74 116.75 2i03 s LYS 190 Ca 0.59 1.33 -0.37 0.00 -0.36 0.00 0.00 55.97 57.15 2i03 s LYS 190 Cb -0.60 0.71 -0.19 0.00 -1.51 0.00 0.00 37.83 36.24 2i03 s LYS 190 CO 0.59 -0.23 0.98 -1.91 -0.36 0.00 0.00 175.35 174.42 2i03 n GLU 191 N 5.43 0.00 -1.23 4.03 2.13 -1.26 -0.86 120.64 128.88 2i03 n GLU 191 Ca -0.11 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.61 2i03 n GLU 191 Cb 0.49 -1.39 -0.05 0.00 0.27 0.00 0.00 31.44 30.76 2i03 n GLU 191 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2i03 n ASP 192 N 1.48 -3.89 0.07 4.31 8.00 -1.26 -4.67 116.55 120.59 2i03 n ASP 192 Ca 0.19 0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.95 2i03 n ASP 192 Cb 0.09 -3.27 0.00 0.00 -0.02 0.00 0.00 41.12 37.92 2i03 n ASP 192 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2i03 n ILE 193 N -1.81 0.34 -4.14 0.53 2.08 -0.04 -4.68 119.36 111.64 2i03 n ILE 193 Ca -0.11 0.11 -0.34 0.00 0.56 0.00 0.00 62.75 62.97 2i03 n ILE 193 Cb 0.44 -0.76 -0.14 0.00 -0.75 0.00 0.00 39.64 38.43 2i03 n ILE 193 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 2i03 s ILE 194 N -1.67 3.31 -0.20 1.39 -1.09 -0.63 0.62 121.20 122.93 2i03 s ILE 194 Ca 0.00 -0.53 -0.02 0.00 -2.23 0.00 0.00 60.65 57.87 2i03 s ILE 194 Cb 0.00 -2.48 0.00 0.00 -1.58 0.00 0.00 42.46 38.41 2i03 s ILE 194 CO 0.00 0.45 -0.11 -0.31 -1.23 0.00 0.00 174.94 173.74 2i03 s TYR 195 N 1.13 2.88 -0.21 3.97 1.51 0.08 -2.11 117.35 124.60 2i03 s TYR 195 Ca 0.01 -1.25 -0.04 0.00 -1.01 0.00 0.00 57.07 54.79 2i03 s TYR 195 Cb -0.14 -2.02 -0.01 0.00 -0.11 0.00 0.00 41.96 39.68 2i03 s TYR 195 CO -0.01 -0.66 -0.05 -0.80 -1.11 0.00 0.00 175.55 172.92 2i03 s ASN 196 N 1.38 4.28 0.00 2.29 0.01 -0.71 -0.68 114.94 121.50 2i03 s ASN 196 Ca 0.05 -0.39 0.00 0.00 -0.71 0.00 0.00 52.86 51.81 2i03 s ASN 196 Cb -0.14 -1.73 0.00 0.00 0.41 0.00 0.00 41.25 39.79 2i03 s ASN 196 CO -0.07 -0.01 0.00 0.61 -1.51 0.00 0.00 177.10 176.12 2i03 n GLY 197 N 4.71 1.06 3.09 0.66 0.00 -0.84 -4.39 105.19 109.47 2i03 n GLY 197 Ca -0.18 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.71 2i03 n GLY 197 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2i03 s ILE 198 N -3.43 0.62 0.45 -0.61 -4.36 -1.26 0.40 121.20 113.01 2i03 s ILE 198 Ca 0.00 -1.23 -0.07 0.00 -0.26 0.00 0.00 60.65 59.09 2i03 s ILE 198 Cb 0.00 -0.81 -0.05 0.00 1.25 0.00 0.00 42.46 42.85 2i03 s ILE 198 CO 0.00 -0.44 0.78 0.42 0.24 0.00 0.00 174.94 175.94 2i03 s THR 199 N -1.71 4.86 0.17 8.37 -4.23 0.91 -4.70 115.64 119.31 2i03 s THR 199 Ca -0.06 0.37 -0.01 0.00 -1.18 0.00 0.00 61.69 60.82 2i03 s THR 199 Cb -0.08 -3.81 0.03 0.00 1.34 0.00 0.00 72.50 69.98 2i03 s THR 199 CO -0.00 -0.73 0.23 -0.90 -0.54 0.00 0.00 174.62 172.68 2i03 n ASP 200 N -1.90 0.22 0.18 3.99 5.75 -1.26 -4.79 116.55 118.75 2i03 n ASP 200 Ca 0.01 -1.21 -0.14 0.00 -0.01 0.00 0.00 54.79 53.44 2i03 n ASP 200 Cb 0.55 -0.16 -0.07 0.00 -1.03 0.00 0.00 41.12 40.41 2i03 n ASP 200 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 2i03 h TRP 201 N -0.60 -0.73 -0.08 2.11 7.01 -1.99 -2.10 115.95 119.57 2i03 h TRP 201 Ca -0.08 0.00 -0.10 0.00 2.11 0.00 0.00 58.89 60.83 2i03 h TRP 201 Cb 0.26 0.29 -0.01 0.00 -2.10 0.00 0.00 29.16 27.59 2i03 h TRP 201 CO 0.00 -0.40 -0.42 -0.24 -2.79 0.00 0.00 178.44 174.59 2i03 h VAL 202 N -0.58 1.31 -0.03 2.65 3.04 -1.95 -2.46 116.25 118.23 2i03 h VAL 202 Ca -0.01 -1.52 -0.18 0.00 -1.01 0.00 0.00 66.70 63.99 2i03 h VAL 202 Cb 0.54 1.72 -0.01 0.00 -2.01 0.00 0.00 31.29 31.52 2i03 h VAL 202 CO -0.06 0.45 -0.76 1.88 -1.01 0.00 0.00 177.57 178.07 2i03 h TYR 203 N 0.15 0.32 -0.12 3.17 -1.99 -1.93 -0.33 116.97 116.25 2i03 h TYR 203 Ca 0.01 -0.15 -0.02 0.00 2.00 0.00 0.00 58.73 60.57 2i03 h TYR 203 Cb 0.81 -0.05 -0.00 0.00 2.00 0.00 0.00 36.73 39.49 2i03 h TYR 203 CO 0.01 0.90 -0.01 1.49 -0.00 0.00 0.00 178.16 180.55 2i03 h GLU 204 N 0.15 0.22 0.09 4.88 4.81 -1.25 0.22 114.58 123.70 2i03 h GLU 204 Ca -0.03 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 59.12 2i03 h GLU 204 Cb 1.33 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.69 2i03 h GLU 204 CO 0.12 0.49 -0.04 1.49 -0.73 0.00 0.00 179.01 180.34 2i03 h GLU 205 N -0.07 -0.12 0.00 1.92 4.57 -1.47 -0.65 114.58 118.77 2i03 h GLU 205 Ca 0.03 0.01 -0.29 0.00 -1.18 0.00 0.00 59.36 57.93 2i03 h GLU 205 Cb 0.40 0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.97 2i03 h GLU 205 CO 0.01 0.35 -1.67 0.93 -1.18 0.00 0.00 179.01 177.44 2i03 h GLU 206 N -0.93 0.00 0.00 1.92 4.39 -1.20 -3.39 114.58 115.36 2i03 h GLU 206 Ca -0.01 -0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.46 2i03 h GLU 206 Cb 0.52 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.14 2i03 h GLU 206 CO 0.02 0.52 -1.78 1.55 -1.16 0.00 0.00 179.01 178.16 2i03 n VAL 207 N -3.06 0.77 0.61 3.13 3.14 -1.08 -4.80 118.33 117.03 2i03 n VAL 207 Ca -0.16 -0.23 0.11 0.00 -2.96 0.00 0.00 64.34 61.09 2i03 n VAL 207 Cb 1.05 -1.42 -0.08 0.00 -1.06 0.00 0.00 33.84 32.33 2i03 n VAL 207 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 2i03 n PHE 208 N -3.35 0.08 -3.81 1.45 3.72 0.74 -4.96 117.46 111.33 2i03 n PHE 208 Ca -0.26 0.02 -0.30 0.00 -0.05 0.00 0.00 57.45 56.86 2i03 n PHE 208 Cb 0.72 -0.27 -0.00 0.00 -0.94 0.00 0.00 39.48 38.99 2i03 n PHE 208 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2i03 n SER 209 N -1.84 -3.92 -3.46 4.37 7.64 -0.27 -4.91 113.62 111.23 2i03 n SER 209 Ca 0.01 -0.71 -0.11 0.00 1.01 0.00 0.00 58.87 59.07 2i03 n SER 209 Cb 0.42 -3.20 -0.02 0.00 -1.01 0.00 0.00 64.21 60.40 2i03 n SER 209 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2i03 s ALA 210 N -3.15 -1.69 -0.05 -0.43 0.00 -1.06 -4.98 121.76 110.40 2i03 s ALA 210 Ca 0.60 0.75 0.09 0.00 0.00 0.00 0.00 51.96 53.40 2i03 s ALA 210 Cb -0.31 0.62 -0.24 0.00 0.00 0.00 0.00 23.12 23.19 2i03 s ALA 210 CO 0.73 -0.69 0.63 -0.92 0.00 0.00 0.00 175.76 175.51 2i03 h TYR 211 N 2.11 0.10 -3.17 0.00 3.20 -1.88 -3.38 116.97 113.96 2i03 h TYR 211 Ca -0.29 -0.07 -0.53 0.00 3.14 0.00 0.00 58.73 60.98 2i03 h TYR 211 Cb 1.27 -0.00 0.03 0.00 1.54 0.00 0.00 36.73 39.57 2i03 h TYR 211 CO 0.25 1.15 0.72 0.45 -1.64 0.00 0.00 178.16 179.09 2i03 s SER 212 N -6.29 6.80 -0.29 -2.11 0.15 -1.26 -0.06 113.70 110.63 2i03 s SER 212 Ca -0.08 2.43 0.15 0.00 0.70 0.00 0.00 55.95 59.15 2i03 s SER 212 Cb 0.08 -2.60 0.48 0.00 -1.71 0.00 0.00 66.02 62.26 2i03 s SER 212 CO 0.82 -0.64 1.13 0.00 1.20 0.00 0.00 173.24 175.75 2i03 n ALA 213 N 3.27 3.84 -2.92 5.45 0.00 0.16 -4.68 120.51 125.63 2i03 n ALA 213 Ca 0.09 -3.33 -0.10 0.00 0.00 0.00 0.00 53.44 50.10 2i03 n ALA 213 Cb 0.42 -0.63 -0.11 0.00 0.00 0.00 0.00 19.45 19.12 2i03 n ALA 213 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2i03 s LEU 214 N -3.64 2.25 -0.12 0.00 0.05 -1.24 -1.95 118.68 114.03 2i03 s LEU 214 Ca 0.38 -0.53 -0.04 0.00 0.05 0.00 0.00 54.13 54.00 2i03 s LEU 214 Cb 0.38 0.02 0.05 0.00 -2.05 0.00 0.00 46.19 44.58 2i03 s LEU 214 CO -0.01 -0.28 0.11 0.26 -0.55 0.00 0.00 176.35 175.88 2i03 s TRP 215 N -1.50 0.02 0.48 3.48 0.51 0.12 -4.98 118.94 117.07 2i03 s TRP 215 Ca -0.13 0.12 -0.21 0.00 -2.12 0.00 0.00 56.10 53.75 2i03 s TRP 215 Cb -0.10 -0.50 -0.08 0.00 -0.81 0.00 0.00 33.47 31.99 2i03 s TRP 215 CO -0.01 -0.37 1.09 -1.58 -0.51 0.00 0.00 176.95 175.56 2i03 s TRP 216 N 2.20 2.95 0.85 -1.98 0.52 -1.26 -0.75 118.94 121.46 2i03 s TRP 216 Ca 0.04 1.57 -0.12 0.00 0.02 0.00 0.00 56.10 57.62 2i03 s TRP 216 Cb -0.14 -3.19 0.10 0.00 -1.15 0.00 0.00 33.47 29.09 2i03 s TRP 216 CO -0.07 -1.09 1.10 -1.54 0.02 0.00 0.00 176.95 175.37 2i03 s SER 217 N -1.74 4.03 0.17 2.95 1.04 -0.11 -4.91 113.70 115.14 2i03 s SER 217 Ca 0.66 1.30 -0.25 0.00 0.48 0.00 0.00 55.95 58.14 2i03 s SER 217 Cb -0.21 -1.99 0.05 0.00 0.10 0.00 0.00 66.02 63.96 2i03 s SER 217 CO 0.26 -2.26 1.56 -0.65 0.98 0.00 0.00 173.24 173.13 2i03 h PRO 218 N -1.29 -0.18 0.00 4.02 0.11 -1.90 -1.99 132.00 130.77 2i03 h PRO 218 Ca -0.48 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2i03 h PRO 218 Cb 1.28 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2i03 h PRO 218 CO 0.58 -0.12 -0.37 0.27 -0.21 0.00 0.00 178.00 178.15 2i03 n ASN 219 N -5.40 0.43 0.00 -2.05 0.23 -1.26 -4.53 115.26 102.68 2i03 n ASN 219 Ca 0.03 0.06 0.00 0.00 -0.53 0.00 0.00 54.58 54.13 2i03 n ASN 219 Cb 0.35 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 38.04 2i03 n ASN 219 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2i03 n GLY 220 N 1.46 0.72 0.15 4.83 0.00 -0.75 -4.45 105.19 107.15 2i03 n GLY 220 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.96 2i03 n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2i03 h THR 221 N 0.00 1.26 -2.78 2.61 2.02 -1.93 -3.45 112.91 110.63 2i03 h THR 221 Ca 0.00 -0.90 -0.58 0.00 0.77 0.00 0.00 66.41 65.69 2i03 h THR 221 Cb 0.00 1.36 -0.07 0.00 -1.74 0.00 0.00 68.15 67.69 2i03 h THR 221 CO 0.00 0.28 -0.57 -0.36 0.37 0.00 0.00 175.52 175.24 2i03 s PHE 222 N -4.99 3.15 -0.16 3.16 0.08 -1.26 -0.81 117.98 117.15 2i03 s PHE 222 Ca -0.14 -0.00 -0.00 0.00 0.12 0.00 0.00 56.93 56.91 2i03 s PHE 222 Cb 0.07 -1.53 0.04 0.00 -0.57 0.00 0.00 43.02 41.04 2i03 s PHE 222 CO 0.75 0.52 -0.06 -1.17 -0.10 0.00 0.00 175.22 175.16 2i03 s LEU 223 N -2.98 1.59 0.00 -0.37 2.96 0.33 -0.94 118.68 119.28 2i03 s LEU 223 Ca 0.31 -0.63 -0.03 0.00 -0.22 0.00 0.00 54.13 53.56 2i03 s LEU 223 Cb -0.10 -0.92 -0.04 0.00 0.50 0.00 0.00 46.19 45.62 2i03 s LEU 223 CO 0.23 -0.17 0.20 0.00 -1.32 0.00 0.00 176.35 175.28 2i03 s ALA 224 N 1.63 3.95 0.02 5.97 0.00 0.07 -1.04 121.76 132.36 2i03 s ALA 224 Ca 0.01 -0.75 -0.20 0.00 0.00 0.00 0.00 51.96 51.02 2i03 s ALA 224 Cb -0.15 -1.90 0.04 0.00 0.00 0.00 0.00 23.12 21.11 2i03 s ALA 224 CO -0.08 0.75 0.46 1.52 0.00 0.00 0.00 175.76 178.40 2i03 s TYR 225 N -1.35 -0.34 0.10 0.00 1.13 -0.37 0.11 117.35 116.63 2i03 s TYR 225 Ca 0.28 0.43 0.04 0.00 -1.41 0.00 0.00 57.07 56.41 2i03 s TYR 225 Cb -0.13 0.25 -0.04 0.00 -1.10 0.00 0.00 41.96 40.94 2i03 s TYR 225 CO 0.20 -0.55 0.08 0.00 -2.51 0.00 0.00 175.55 172.76 2i03 s ALA 226 N -2.02 3.52 -0.08 9.51 0.00 -0.82 -0.29 121.76 131.58 2i03 s ALA 226 Ca -0.08 -1.07 0.03 0.00 0.00 0.00 0.00 51.96 50.84 2i03 s ALA 226 Cb -0.02 -1.38 0.01 0.00 0.00 0.00 0.00 23.12 21.73 2i03 s ALA 226 CO 0.01 0.70 -0.17 -1.14 0.00 0.00 0.00 175.76 175.16 2i03 s GLN 227 N -2.51 2.17 -0.06 0.00 0.74 0.28 -1.99 119.66 118.29 2i03 s GLN 227 Ca 0.29 -0.59 0.01 0.00 0.05 0.00 0.00 55.36 55.12 2i03 s GLN 227 Cb -0.12 -1.73 -0.03 0.00 1.10 0.00 0.00 33.01 32.24 2i03 s GLN 227 CO 0.22 0.10 -0.07 -0.06 -0.55 0.00 0.00 175.29 174.92 2i03 s PHE 228 N 0.50 2.93 -0.32 1.67 0.08 0.14 -1.46 117.98 121.52 2i03 s PHE 228 Ca -0.15 0.01 0.01 0.00 0.12 0.00 0.00 56.93 56.92 2i03 s PHE 228 Cb -0.16 -1.70 0.08 0.00 -0.57 0.00 0.00 43.02 40.67 2i03 s PHE 228 CO 0.05 0.34 0.03 1.21 -0.10 0.00 0.00 175.22 176.75 2i03 s ASN 229 N -0.88 4.82 -0.20 1.36 3.84 -0.56 -0.74 114.94 122.58 2i03 s ASN 229 Ca 0.13 -1.70 0.15 0.00 0.21 0.00 0.00 52.86 51.65 2i03 s ASN 229 Cb -0.11 -1.67 0.79 0.00 -0.55 0.00 0.00 41.25 39.71 2i03 s ASN 229 CO 0.02 -0.33 1.71 0.47 -2.79 0.00 0.00 177.10 176.18 2i03 n ASP 230 N 4.46 5.48 -0.25 -4.21 9.92 0.20 -2.14 116.55 130.01 2i03 n ASP 230 Ca -0.06 -2.80 0.01 0.00 -0.53 0.00 0.00 54.79 51.41 2i03 n ASP 230 Cb 0.42 -0.66 0.08 0.00 -0.64 0.00 0.00 41.12 40.32 2i03 n ASP 230 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 2i03 h THR 231 N 4.01 0.26 -0.50 -3.53 2.02 -1.84 -2.15 112.91 111.19 2i03 h THR 231 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2i03 h THR 231 Cb 1.84 0.26 0.00 0.00 -1.74 0.00 0.00 68.15 68.51 2i03 h THR 231 CO 0.43 0.00 0.00 -0.62 0.37 0.00 0.00 175.52 175.70 2i03 n GLU 232 N -5.49 3.72 -2.62 6.66 1.02 -1.26 -4.95 120.64 117.72 2i03 n GLU 232 Ca 0.10 -2.85 -0.42 0.00 -0.02 0.00 0.00 57.16 53.97 2i03 n GLU 232 Cb 0.38 -1.90 -0.03 0.00 -0.02 0.00 0.00 31.44 29.87 2i03 n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2i03 s VAL 233 N -2.22 4.62 0.91 2.62 1.01 -0.81 -4.74 120.40 121.78 2i03 s VAL 233 Ca 0.47 1.89 -0.11 0.00 0.00 0.00 0.00 61.98 64.23 2i03 s VAL 233 Cb 0.33 -4.21 0.14 0.00 0.00 0.00 0.00 36.38 32.64 2i03 s VAL 233 CO 0.18 0.10 1.11 -2.84 0.00 0.00 0.00 175.10 173.65 2i03 s PRO 234 N 1.36 1.12 -0.06 2.72 0.02 -1.26 -4.73 135.00 134.18 2i03 s PRO 234 Ca 0.53 1.27 0.00 0.00 0.02 0.00 0.00 61.00 62.83 2i03 s PRO 234 Cb -0.22 -1.76 -0.03 0.00 0.02 0.00 0.00 34.50 32.50 2i03 s PRO 234 CO 0.25 -2.47 -0.03 -0.51 -0.33 0.00 0.00 177.00 173.92 2i03 s LEU 235 N -6.46 3.38 -0.14 -5.54 1.43 -1.26 -1.58 118.68 108.50 2i03 s LEU 235 Ca 0.65 0.03 -0.16 0.00 -1.03 0.00 0.00 54.13 53.62 2i03 s LEU 235 Cb -0.21 -1.81 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 2i03 s LEU 235 CO 0.58 0.35 0.38 -0.51 0.23 0.00 0.00 176.35 177.38 2i03 s ILE 236 N -0.90 5.25 -0.08 -0.59 1.10 0.41 -4.88 121.20 121.50 2i03 s ILE 236 Ca 0.14 0.73 0.05 0.00 -0.51 0.00 0.00 60.65 61.06 2i03 s ILE 236 Cb -0.11 -3.72 -0.00 0.00 0.15 0.00 0.00 42.46 38.78 2i03 s ILE 236 CO 0.04 0.35 -0.24 -1.61 -2.11 0.00 0.00 174.94 171.37 2i03 s GLU 237 N 0.58 2.82 0.05 3.50 2.02 -1.26 -1.79 118.70 124.62 2i03 s GLU 237 Ca 0.21 -0.87 -0.14 0.00 0.02 0.00 0.00 54.97 54.18 2i03 s GLU 237 Cb -0.14 -2.21 0.02 0.00 0.10 0.00 0.00 34.13 31.90 2i03 s GLU 237 CO 0.07 0.24 0.32 1.52 0.02 0.00 0.00 175.26 177.43 2i03 s TYR 238 N 0.18 -0.13 0.42 1.61 1.13 -0.56 -4.97 117.35 115.03 2i03 s TYR 238 Ca -0.14 0.01 -0.20 0.00 -1.41 0.00 0.00 57.07 55.33 2i03 s TYR 238 Cb -0.16 0.12 -0.11 0.00 -1.10 0.00 0.00 41.96 40.71 2i03 s TYR 238 CO 0.07 -0.52 0.92 -1.12 -2.51 0.00 0.00 175.55 172.39 2i03 s SER 239 N -2.07 6.90 -0.09 -0.18 0.01 -1.26 -0.10 113.70 116.91 2i03 s SER 239 Ca -0.05 1.62 -0.00 0.00 1.31 0.00 0.00 55.95 58.83 2i03 s SER 239 Cb -0.01 -2.51 0.02 0.00 0.21 0.00 0.00 66.02 63.74 2i03 s SER 239 CO -0.03 -0.34 -0.04 0.12 0.41 0.00 0.00 173.24 173.35 2i03 s PHE 240 N -2.17 1.07 -0.19 2.43 5.36 0.11 -4.71 117.98 119.89 2i03 s PHE 240 Ca 0.61 -0.44 0.20 0.00 -0.96 0.00 0.00 56.93 56.34 2i03 s PHE 240 Cb -0.09 -0.99 -0.05 0.00 -0.34 0.00 0.00 43.02 41.56 2i03 s PHE 240 CO 0.14 -0.39 0.98 1.88 -1.46 0.00 0.00 175.22 176.38 2i03 h TYR 241 N 8.05 0.00 -1.63 10.12 -1.99 -1.96 -0.54 116.97 129.02 2i03 h TYR 241 Ca -0.27 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.46 2i03 h TYR 241 Cb 1.13 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.86 2i03 h TYR 241 CO 0.48 0.28 0.00 0.45 -0.00 0.00 0.00 178.16 179.36 2i03 n SER 242 N -2.81 -4.89 -4.60 3.88 2.88 -1.26 -4.68 113.62 102.15 2i03 n SER 242 Ca -0.04 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.18 2i03 n SER 242 Cb 0.68 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 64.29 2i03 n SER 242 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2i03 n ASP 243 N -3.10 -0.20 -0.20 -3.46 8.00 -1.26 -4.85 116.55 111.47 2i03 n ASP 243 Ca 0.00 0.44 0.26 0.00 0.71 0.00 0.00 54.79 56.20 2i03 n ASP 243 Cb 0.00 -1.41 0.66 0.00 -0.02 0.00 0.00 41.12 40.36 2i03 n ASP 243 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 2i03 h GLU 244 N -1.57 0.11 0.00 -1.24 4.81 -2.06 -1.49 114.58 113.15 2i03 h GLU 244 Ca -0.44 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 58.77 2i03 h GLU 244 Cb 1.28 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.63 2i03 h GLU 244 CO 0.40 0.07 -0.06 0.66 -0.73 0.00 0.00 179.01 179.36 2i03 h SER 245 N 0.12 0.00 -2.63 1.04 4.64 -1.93 -3.43 113.55 111.36 2i03 h SER 245 Ca 0.45 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 61.21 2i03 h SER 245 Cb 1.58 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.66 2i03 h SER 245 CO -0.06 0.06 1.17 -0.22 -0.87 0.00 0.00 176.83 176.91 2i03 s LEU 246 N -6.45 3.94 0.13 5.97 0.20 -0.56 -4.88 118.68 117.03 2i03 s LEU 246 Ca -0.00 1.81 -0.10 0.00 0.69 0.00 0.00 54.13 56.52 2i03 s LEU 246 Cb 0.10 -3.53 -0.09 0.00 -0.43 0.00 0.00 46.19 42.25 2i03 s LEU 246 CO 0.55 -1.28 1.37 -0.61 -0.29 0.00 0.00 176.35 176.10 2i03 h GLN 247 N 11.04 0.78 -5.25 1.98 4.15 -1.89 -3.43 115.11 122.49 2i03 h GLN 247 Ca -0.36 -0.56 -0.67 0.00 0.77 0.00 0.00 58.65 57.82 2i03 h GLN 247 Cb 1.17 0.09 -0.31 0.00 0.21 0.00 0.00 27.48 28.64 2i03 h GLN 247 CO 0.99 1.18 -0.83 0.71 -1.93 0.00 0.00 178.83 178.95 2i03 s TYR 248 N -3.91 2.71 0.58 3.99 1.51 -1.26 -5.10 117.35 115.86 2i03 s TYR 248 Ca -0.10 -1.06 -0.20 0.00 -1.01 0.00 0.00 57.07 54.70 2i03 s TYR 248 Cb 0.10 -1.82 -0.04 0.00 -0.11 0.00 0.00 41.96 40.08 2i03 s TYR 248 CO 0.89 -0.46 1.24 -2.30 -1.11 0.00 0.00 175.55 173.81 2i03 n PRO 249 N 3.86 1.35 -4.01 -1.71 -0.02 -1.26 -5.00 135.00 128.21 2i03 n PRO 249 Ca -0.19 0.51 -0.30 0.00 -2.02 0.00 0.00 63.50 61.49 2i03 n PRO 249 Cb 0.52 -2.45 -0.05 0.00 -0.02 0.00 0.00 33.50 31.49 2i03 n PRO 249 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2i03 s LYS 250 N -2.95 3.07 -0.26 -0.52 -2.85 -0.21 -4.92 119.74 111.10 2i03 s LYS 250 Ca 0.75 -0.63 -0.09 0.00 -1.00 0.00 0.00 55.97 55.00 2i03 s LYS 250 Cb -0.41 -2.82 -0.04 0.00 -2.06 0.00 0.00 37.83 32.49 2i03 s LYS 250 CO 0.47 0.57 0.13 0.99 0.10 0.00 0.00 175.35 177.61 2i03 s THR 251 N -1.47 4.92 -0.09 3.79 2.01 -1.26 0.09 115.64 123.63 2i03 s THR 251 Ca 0.31 0.03 -0.17 0.00 0.31 0.00 0.00 61.69 62.18 2i03 s THR 251 Cb -0.12 -3.32 -0.05 0.00 0.01 0.00 0.00 72.50 69.03 2i03 s THR 251 CO 0.24 0.31 0.43 -0.69 -0.69 0.00 0.00 174.62 174.22 2i03 s VAL 252 N 1.51 5.16 -0.09 3.82 1.01 0.86 -4.92 120.40 127.75 2i03 s VAL 252 Ca 0.06 0.86 -0.02 0.00 0.00 0.00 0.00 61.98 62.89 2i03 s VAL 252 Cb -0.15 -3.76 0.04 0.00 0.00 0.00 0.00 36.38 32.50 2i03 s VAL 252 CO 0.07 0.40 0.04 0.00 0.00 0.00 0.00 175.10 175.61 2i03 s ARG 253 N 0.15 0.26 0.05 2.72 1.70 -1.26 -1.49 118.95 121.09 2i03 s ARG 253 Ca 0.24 0.14 0.07 0.00 -0.47 0.00 0.00 55.73 55.70 2i03 s ARG 253 Cb -0.15 -1.03 -0.03 0.00 -0.57 0.00 0.00 34.95 33.17 2i03 s ARG 253 CO 0.10 -0.40 -0.18 0.54 -1.08 0.00 0.00 175.30 174.28 2i03 s VAL 254 N 2.07 1.46 -0.07 4.99 0.11 -0.74 -4.91 120.40 123.31 2i03 s VAL 254 Ca 0.04 -1.20 -0.30 0.00 -2.93 0.00 0.00 61.98 57.59 2i03 s VAL 254 Cb -0.13 -1.30 -0.06 0.00 -1.53 0.00 0.00 36.38 33.36 2i03 s VAL 254 CO -0.05 0.07 1.70 -2.84 -3.33 0.00 0.00 175.10 170.65 2i03 s PRO 255 N -1.33 4.10 -0.17 1.54 0.02 -1.26 -0.44 135.00 137.45 2i03 s PRO 255 Ca 0.05 2.18 -0.04 0.00 0.02 0.00 0.00 61.00 63.20 2i03 s PRO 255 Cb -0.09 -4.02 0.08 0.00 0.02 0.00 0.00 34.50 30.49 2i03 s PRO 255 CO 0.02 -0.95 0.22 -0.47 -0.33 0.00 0.00 177.00 175.49 2i03 s TYR 256 N 4.35 -0.27 -0.51 6.54 6.14 -0.62 -4.54 117.35 128.44 2i03 s TYR 256 Ca 0.76 0.37 -0.26 0.00 0.64 0.00 0.00 57.07 58.57 2i03 s TYR 256 Cb -0.33 -0.31 0.03 0.00 0.42 0.00 0.00 41.96 41.77 2i03 s TYR 256 CO 0.31 -0.52 1.03 -1.25 0.64 0.00 0.00 175.55 175.76 2i03 s PRO 257 N 2.33 3.52 0.66 4.97 0.04 -1.26 -4.57 135.00 140.69 2i03 s PRO 257 Ca 0.05 0.16 -0.11 0.00 0.04 0.00 0.00 61.00 61.15 2i03 s PRO 257 Cb -0.15 -3.97 -0.02 0.00 0.04 0.00 0.00 34.50 30.41 2i03 s PRO 257 CO -0.11 -1.41 1.05 0.15 0.04 0.00 0.00 177.00 176.72 2i03 s LYS 258 N 4.19 3.29 -0.18 4.56 1.02 -1.26 -0.57 119.74 130.79 2i03 s LYS 258 Ca 0.39 0.78 -0.42 0.00 0.02 0.00 0.00 55.97 56.73 2i03 s LYS 258 Cb -0.09 -2.04 -0.20 0.00 -0.52 0.00 0.00 37.83 34.98 2i03 s LYS 258 CO 0.26 -0.80 1.30 0.00 -0.92 0.00 0.00 175.35 175.19 2i03 n ALA 259 N -2.90 -2.51 0.00 5.17 0.00 -0.09 -1.00 120.51 119.18 2i03 n ALA 259 Ca 0.07 0.55 0.00 0.00 0.00 0.00 0.00 53.44 54.05 2i03 n ALA 259 Cb 0.54 -1.86 0.00 0.00 0.00 0.00 0.00 19.45 18.13 2i03 n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2i03 n GLY 260 N 2.57 2.60 3.92 0.00 0.00 -1.26 -4.86 105.19 108.15 2i03 n GLY 260 Ca 0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 2i03 n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i03 s ALA 261 N -2.60 2.42 0.12 4.61 0.00 -0.17 -4.99 121.76 121.15 2i03 s ALA 261 Ca 0.00 -0.95 -0.31 0.00 0.00 0.00 0.00 51.96 50.70 2i03 s ALA 261 Cb 0.00 -2.86 -0.09 0.00 0.00 0.00 0.00 23.12 20.17 2i03 s ALA 261 CO 0.00 -2.10 1.57 0.08 0.00 0.00 0.00 175.76 175.31 2i03 s VAL 262 N -3.75 2.90 0.40 0.00 1.01 -1.26 -4.90 120.40 114.80 2i03 s VAL 262 Ca 0.69 0.55 -0.01 0.00 0.00 0.00 0.00 61.98 63.21 2i03 s VAL 262 Cb -0.07 -3.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 2i03 s VAL 262 CO 0.51 0.02 0.62 0.20 0.00 0.00 0.00 175.10 176.46 2i03 s ASN 263 N 1.62 6.18 0.51 3.32 -0.87 -1.26 -4.51 114.94 119.92 2i03 s ASN 263 Ca 0.70 0.50 -0.18 0.00 -1.57 0.00 0.00 52.86 52.31 2i03 s ASN 263 Cb -0.41 -1.96 -0.08 0.00 -0.02 0.00 0.00 41.25 38.79 2i03 s ASN 263 CO 0.31 -0.44 1.01 -2.16 -2.57 0.00 0.00 177.10 173.25 2i03 s PRO 264 N -4.45 3.82 0.40 -0.60 0.04 -1.26 -4.82 135.00 128.13 2i03 s PRO 264 Ca 0.43 1.16 0.08 0.00 0.04 0.00 0.00 61.00 62.71 2i03 s PRO 264 Cb -0.10 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.34 2i03 s PRO 264 CO 0.38 -0.39 0.54 0.95 0.04 0.00 0.00 177.00 178.52 2i03 s THR 265 N -2.31 3.17 -0.03 1.26 -4.23 -0.91 -4.90 115.64 107.69 2i03 s THR 265 Ca 0.63 -1.02 -0.06 0.00 -1.18 0.00 0.00 61.69 60.05 2i03 s THR 265 Cb -0.13 -3.07 0.01 0.00 1.34 0.00 0.00 72.50 70.65 2i03 s THR 265 CO 0.25 -0.03 0.15 0.54 -0.54 0.00 0.00 174.62 174.99 2i03 s VAL 266 N -2.33 0.04 0.08 2.29 0.11 -1.26 -1.49 120.40 117.84 2i03 s VAL 266 Ca 0.53 -0.35 0.05 0.00 -2.93 0.00 0.00 61.98 59.28 2i03 s VAL 266 Cb -0.10 -0.33 -0.03 0.00 -1.53 0.00 0.00 36.38 34.39 2i03 s VAL 266 CO 0.32 -0.19 -0.14 -0.54 -3.33 0.00 0.00 175.10 171.21 2i03 s LYS 267 N -0.66 0.86 0.01 1.54 1.02 -0.54 -4.98 119.74 117.00 2i03 s LYS 267 Ca -0.07 -1.00 0.05 0.00 0.02 0.00 0.00 55.97 54.97 2i03 s LYS 267 Cb -0.04 -0.86 -0.03 0.00 -0.52 0.00 0.00 37.83 36.38 2i03 s LYS 267 CO 0.01 0.19 -0.15 0.12 -0.92 0.00 0.00 175.35 174.60 2i03 s PHE 268 N -1.39 2.66 0.10 3.18 5.36 -1.26 -0.55 117.98 126.08 2i03 s PHE 268 Ca -0.00 -0.19 -0.00 0.00 -0.96 0.00 0.00 56.93 55.78 2i03 s PHE 268 Cb -0.09 -1.53 -0.04 0.00 -0.34 0.00 0.00 43.02 41.02 2i03 s PHE 268 CO 0.02 0.27 -0.01 -0.06 -1.46 0.00 0.00 175.22 173.98 2i03 s PHE 269 N -0.90 0.77 -0.09 10.12 0.40 0.60 -2.20 117.98 126.68 2i03 s PHE 269 Ca 0.15 -1.08 -0.05 0.00 -0.60 0.00 0.00 56.93 55.35 2i03 s PHE 269 Cb -0.11 -0.48 0.04 0.00 0.51 0.00 0.00 43.02 42.98 2i03 s PHE 269 CO 0.05 -0.35 0.21 0.08 0.70 0.00 0.00 175.22 175.91 2i03 s VAL 270 N -3.86 -0.03 -0.01 -0.44 1.01 0.29 -1.24 120.40 116.12 2i03 s VAL 270 Ca 0.15 0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.28 2i03 s VAL 270 Cb 0.07 -0.32 -0.01 0.00 0.00 0.00 0.00 36.38 36.12 2i03 s VAL 270 CO -0.04 0.05 -0.12 0.54 0.00 0.00 0.00 175.10 175.53 2i03 s VAL 271 N 0.95 0.94 -0.50 2.92 0.11 -0.20 -0.76 120.40 123.86 2i03 s VAL 271 Ca -0.07 -0.51 -0.23 0.00 -2.93 0.00 0.00 61.98 58.24 2i03 s VAL 271 Cb -0.08 -0.79 0.04 0.00 -1.53 0.00 0.00 36.38 34.01 2i03 s VAL 271 CO -0.06 0.27 0.84 0.21 -3.33 0.00 0.00 175.10 173.03 2i03 s ASN 272 N -0.28 6.36 0.00 3.54 3.04 -1.26 -0.51 114.94 125.83 2i03 s ASN 272 Ca 0.05 -0.30 0.16 0.00 0.04 0.00 0.00 52.86 52.80 2i03 s ASN 272 Cb -0.05 -2.40 0.77 0.00 -1.54 0.00 0.00 41.25 38.03 2i03 s ASN 272 CO -0.00 -1.06 1.48 0.35 -3.04 0.00 0.00 177.10 174.82 2i03 n THR 273 N 6.12 0.66 0.89 -5.21 -2.24 0.01 -2.73 114.28 111.79 2i03 n THR 273 Ca 0.01 0.17 0.12 0.00 -2.27 0.00 0.00 64.05 62.07 2i03 n THR 273 Cb 0.48 -0.90 0.18 0.00 -2.10 0.00 0.00 70.33 67.99 2i03 n THR 273 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2i03 n ASP 274 N -1.36 0.58 -0.84 3.42 8.00 -1.26 -4.18 116.55 120.92 2i03 n ASP 274 Ca 0.06 -0.26 0.08 0.00 0.71 0.00 0.00 54.79 55.38 2i03 n ASP 274 Cb 0.15 0.37 0.24 0.00 -0.02 0.00 0.00 41.12 41.86 2i03 n ASP 274 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2i03 n SER 275 N -1.63 3.72 -4.81 -2.24 3.41 -1.10 -5.00 113.62 105.96 2i03 n SER 275 Ca 0.05 -2.85 -0.39 0.00 -0.26 0.00 0.00 58.87 55.42 2i03 n SER 275 Cb 0.36 -0.49 -0.06 0.00 -0.26 0.00 0.00 64.21 63.76 2i03 n SER 275 CO 0.00 0.00 0.00 -1.48 -0.16 0.00 0.00 175.04 173.40 2i03 s LEU 276 N -2.53 4.53 0.00 1.04 2.34 -1.26 -5.01 118.68 117.78 2i03 s LEU 276 Ca 0.39 1.32 0.00 0.00 0.06 0.00 0.00 54.13 55.90 2i03 s LEU 276 Cb 0.30 -3.00 0.00 0.00 -0.56 0.00 0.00 46.19 42.93 2i03 s LEU 276 CO 0.10 0.25 0.00 -1.54 -1.06 0.00 0.00 176.35 174.10 2i03 n SER 277 N 1.62 0.00 0.00 1.48 3.41 -1.26 -5.06 113.62 113.82 2i03 n SER 277 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 2i03 n SER 277 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 2i03 n SER 277 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2i03 n SER 278 N -1.23 0.00 -0.11 4.04 3.41 -1.26 -4.96 113.62 113.51 2i03 n SER 278 Ca 0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.44 2i03 n SER 278 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 2i03 n SER 278 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2i03 n VAL 279 N 0.00 1.50 -2.82 -3.33 0.31 -1.26 -4.90 118.33 107.84 2i03 n VAL 279 Ca 0.00 -0.05 -0.42 0.00 -0.01 0.00 0.00 64.34 63.86 2i03 n VAL 279 Cb 0.00 -2.16 -0.03 0.00 -0.91 0.00 0.00 33.84 30.73 2i03 n VAL 279 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2i03 s THR 280 N -2.65 4.81 0.46 2.52 2.01 -1.26 -5.01 115.64 116.51 2i03 s THR 280 Ca -0.31 1.74 -0.25 0.00 0.31 0.00 0.00 61.69 63.18 2i03 s THR 280 Cb 0.08 -4.19 -0.08 0.00 0.01 0.00 0.00 72.50 68.32 2i03 s THR 280 CO 0.44 -0.06 1.42 0.59 -0.69 0.00 0.00 174.62 176.32 2i03 n ASN 281 N 5.77 3.21 -4.70 3.53 3.02 -1.26 -4.37 115.26 120.45 2i03 n ASN 281 Ca 0.07 1.10 -0.39 0.00 -0.03 0.00 0.00 54.58 55.33 2i03 n ASN 281 Cb 0.48 -1.60 0.04 0.00 -0.61 0.00 0.00 39.78 38.09 2i03 n ASN 281 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2i03 n ALA 282 N -0.33 1.19 -2.99 5.41 0.00 -1.26 -5.00 120.51 117.54 2i03 n ALA 282 Ca 0.06 0.14 -0.36 0.00 0.00 0.00 0.00 53.44 53.28 2i03 n ALA 282 Cb 0.42 -2.28 -0.12 0.00 0.00 0.00 0.00 19.45 17.47 2i03 n ALA 282 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2i03 s THR 283 N -1.31 4.39 -0.24 0.00 2.01 -1.26 -5.02 115.64 114.21 2i03 s THR 283 Ca 0.70 -0.15 -0.07 0.00 0.31 0.00 0.00 61.69 62.47 2i03 s THR 283 Cb -0.44 -3.03 -0.03 0.00 0.01 0.00 0.00 72.50 69.01 2i03 s THR 283 CO 0.51 0.37 0.07 -0.44 -0.69 0.00 0.00 174.62 174.44 2i03 s SER 284 N 1.25 5.15 -0.10 3.53 0.01 -1.26 -4.52 113.70 117.76 2i03 s SER 284 Ca 0.05 -0.19 -0.24 0.00 1.31 0.00 0.00 55.95 56.88 2i03 s SER 284 Cb -0.15 -1.92 -0.03 0.00 0.21 0.00 0.00 66.02 64.13 2i03 s SER 284 CO 0.03 -0.02 0.74 -0.63 0.41 0.00 0.00 173.24 173.77 2i03 s ILE 285 N 1.53 5.00 -0.17 1.44 -1.09 0.06 -4.84 121.20 123.13 2i03 s ILE 285 Ca 0.06 1.49 -0.14 0.00 -2.23 0.00 0.00 60.65 59.84 2i03 s ILE 285 Cb -0.15 -4.07 -0.05 0.00 -1.58 0.00 0.00 42.46 36.62 2i03 s ILE 285 CO 0.04 0.18 0.28 -1.58 -1.23 0.00 0.00 174.94 172.63 2i03 s GLN 286 N 1.22 4.25 -0.37 2.79 0.74 -1.26 -0.55 119.66 126.48 2i03 s GLN 286 Ca 0.38 0.07 -0.13 0.00 0.05 0.00 0.00 55.36 55.73 2i03 s GLN 286 Cb -0.17 -3.43 0.01 0.00 1.10 0.00 0.00 33.01 30.51 2i03 s GLN 286 CO 0.17 0.23 0.25 0.42 -0.55 0.00 0.00 175.29 175.80 2i03 s ILE 287 N 0.50 5.06 0.00 -2.34 1.01 -0.93 -4.91 121.20 119.58 2i03 s ILE 287 Ca 0.16 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.27 2i03 s ILE 287 Cb -0.13 -3.73 0.00 0.00 0.01 0.00 0.00 42.46 38.61 2i03 s ILE 287 CO 0.03 -0.16 0.00 0.35 0.00 0.00 0.00 174.94 175.16 2i03 n THR 288 N 5.09 0.00 -2.49 2.92 -2.24 -1.26 -4.07 114.28 112.23 2i03 n THR 288 Ca -0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 2i03 n THR 288 Cb 0.48 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 2i03 n THR 288 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2i03 n ALA 289 N -3.00 0.00 -1.65 6.98 0.00 -1.26 -5.00 120.51 116.58 2i03 n ALA 289 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 2i03 n ALA 289 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 2i03 n ALA 289 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2i03 s PRO 290 N 0.00 3.19 0.25 0.00 0.02 -1.26 -4.84 135.00 132.36 2i03 s PRO 290 Ca 0.00 1.01 -0.06 0.00 0.02 0.00 0.00 61.00 61.97 2i03 s PRO 290 Cb 0.00 -2.02 0.27 0.00 0.02 0.00 0.00 34.50 32.76 2i03 s PRO 290 CO 0.00 -0.90 1.93 0.00 -0.33 0.00 0.00 177.00 177.70 2i03 h ALA 291 N -0.20 1.29 0.00 -1.55 0.00 -1.97 0.42 119.26 117.24 2i03 h ALA 291 Ca -0.45 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2i03 h ALA 291 Cb 1.21 -0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2i03 h ALA 291 CO 0.58 0.66 0.00 0.66 0.00 0.00 0.00 179.25 181.15 2i03 h SER 292 N 1.36 0.00 0.00 0.00 4.64 -2.02 -2.26 113.55 115.28 2i03 h SER 292 Ca 0.37 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.33 2i03 h SER 292 Cb -0.15 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 61.88 2i03 h SER 292 CO -0.08 0.00 -2.38 0.80 -0.87 0.00 0.00 176.83 174.30 2i03 n MET 293 N -2.34 0.64 0.30 4.77 0.00 -0.31 -4.42 117.12 115.77 2i03 n MET 293 Ca 0.00 0.12 0.20 0.00 0.00 0.00 0.00 57.70 58.02 2i03 n MET 293 Cb 0.13 -1.49 0.97 0.00 0.00 0.00 0.00 33.22 32.83 2i03 n MET 293 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 2i03 h LEU 294 N 0.00 0.00 -1.53 -0.89 3.38 0.28 -2.95 115.31 113.61 2i03 h LEU 294 Ca -0.54 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.43 2i03 h LEU 294 Cb 1.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.63 2i03 h LEU 294 CO -0.07 0.00 0.00 0.16 0.09 0.00 0.00 178.44 178.62 2i03 h ILE 295 N 0.00 0.00 -1.65 1.22 3.07 -1.63 -3.45 117.51 115.06 2i03 h ILE 295 Ca 0.00 -0.00 0.01 0.00 1.55 0.00 0.00 64.86 66.42 2i03 h ILE 295 Cb 0.20 0.51 -0.00 0.00 -0.27 0.00 0.00 36.82 37.26 2i03 h ILE 295 CO 0.00 0.00 0.03 0.61 -1.05 0.00 0.00 178.15 177.74 2i03 n GLY 296 N -1.28 1.32 3.67 0.16 0.00 -1.11 -5.14 105.19 102.81 2i03 n GLY 296 Ca -0.02 -0.94 -0.44 0.00 0.00 0.00 0.00 46.02 44.63 2i03 n GLY 296 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2i03 n ASP 297 N -0.64 2.59 -3.16 1.61 9.92 -1.26 -4.93 116.55 120.69 2i03 n ASP 297 Ca -0.00 1.17 -0.12 0.00 -0.53 0.00 0.00 54.79 55.30 2i03 n ASP 297 Cb 0.03 -1.43 -0.02 0.00 -0.64 0.00 0.00 41.12 39.06 2i03 n ASP 297 CO 0.00 0.00 0.00 -1.38 0.13 0.00 0.00 177.20 175.95 2i03 s HIS 298 N -0.47 0.65 0.04 1.24 -3.43 -1.26 -1.45 115.29 110.61 2i03 s HIS 298 Ca 0.64 -1.07 -0.02 0.00 -0.80 0.00 0.00 55.06 53.81 2i03 s HIS 298 Cb -0.63 0.30 -0.03 0.00 -1.43 0.00 0.00 32.58 30.79 2i03 s HIS 298 CO 0.54 -1.30 -0.00 0.71 -2.00 0.00 0.00 174.74 172.69 2i03 s TYR 299 N -2.81 0.36 -0.30 0.38 2.02 0.89 -4.84 117.35 113.05 2i03 s TYR 299 Ca 0.24 -0.76 -0.12 0.00 -0.37 0.00 0.00 57.07 56.07 2i03 s TYR 299 Cb -0.02 -0.27 -0.04 0.00 -0.40 0.00 0.00 41.96 41.23 2i03 s TYR 299 CO 0.16 -0.31 0.22 -1.17 -1.57 0.00 0.00 175.55 172.89 2i03 s LEU 300 N -2.22 4.19 0.00 -1.29 2.96 -1.26 -0.80 118.68 120.26 2i03 s LEU 300 Ca -0.04 -0.12 0.09 0.00 -0.22 0.00 0.00 54.13 53.84 2i03 s LEU 300 Cb -0.01 -2.16 -0.02 0.00 0.50 0.00 0.00 46.19 44.51 2i03 s LEU 300 CO -0.06 -0.13 0.54 0.00 -1.32 0.00 0.00 176.35 175.39 2i03 s ASP 302 N -1.37 -0.25 -0.04 0.00 -1.08 -1.16 -4.91 116.67 107.86 2i03 s ASP 302 Ca 0.06 0.47 0.00 0.00 -0.52 0.00 0.00 52.55 52.57 2i03 s ASP 302 Cb 0.07 0.59 0.03 0.00 -1.46 0.00 0.00 42.92 42.14 2i03 s ASP 302 CO 0.25 -0.08 -0.01 0.54 0.52 0.00 0.00 175.17 176.39 2i03 s VAL 303 N 0.31 0.30 -0.03 1.11 0.11 -1.26 0.72 120.40 121.66 2i03 s VAL 303 Ca 0.03 0.04 -0.01 0.00 -2.93 0.00 0.00 61.98 59.11 2i03 s VAL 303 Cb -0.05 -0.40 0.03 0.00 -1.53 0.00 0.00 36.38 34.44 2i03 s VAL 303 CO -0.11 0.19 0.05 -0.89 -3.33 0.00 0.00 175.10 171.01 2i03 s THR 304 N 1.20 -0.09 0.04 5.04 2.01 0.26 -4.97 115.64 119.13 2i03 s THR 304 Ca -0.07 0.34 -0.30 0.00 0.31 0.00 0.00 61.69 61.97 2i03 s THR 304 Cb -0.13 -0.13 -0.05 0.00 0.01 0.00 0.00 72.50 72.19 2i03 s THR 304 CO -0.02 0.14 1.23 0.26 -0.69 0.00 0.00 174.62 175.54 2i03 s TRP 305 N 1.73 3.33 -0.11 4.92 0.52 -1.26 0.11 118.94 128.17 2i03 s TRP 305 Ca -0.01 1.22 -0.11 0.00 0.02 0.00 0.00 56.10 57.22 2i03 s TRP 305 Cb -0.12 -3.46 -0.27 0.00 -1.15 0.00 0.00 33.47 28.47 2i03 s TRP 305 CO -0.03 -1.46 0.45 0.00 0.02 0.00 0.00 176.95 175.93 2i03 h ALA 306 N 7.01 0.31 -2.56 0.98 0.00 -0.47 -3.47 119.26 121.06 2i03 h ALA 306 Ca -0.40 -1.27 0.00 0.00 0.00 0.00 0.00 54.91 53.24 2i03 h ALA 306 Cb 1.20 0.62 0.00 0.00 0.00 0.00 0.00 17.79 19.61 2i03 h ALA 306 CO 0.84 1.11 0.00 0.25 0.00 0.00 0.00 179.25 181.44 2i03 n THR 307 N -3.68 0.00 0.25 0.00 -2.24 -0.74 -4.37 114.28 103.51 2i03 n THR 307 Ca -0.29 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.61 2i03 n THR 307 Cb 0.99 0.00 0.66 0.00 -2.10 0.00 0.00 70.33 69.88 2i03 n THR 307 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2i03 h GLN 308 N 0.00 0.00 0.00 -0.78 1.08 -1.96 -3.20 115.11 110.24 2i03 h GLN 308 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2i03 h GLN 308 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 2i03 h GLN 308 CO 0.00 0.15 -0.23 0.39 -0.95 0.00 0.00 178.83 178.19 2i03 n GLU 309 N -3.54 0.71 -3.99 1.46 1.02 -1.26 -4.87 120.64 110.17 2i03 n GLU 309 Ca -0.01 -1.76 -0.20 0.00 -0.02 0.00 0.00 57.16 55.17 2i03 n GLU 309 Cb 0.29 -1.00 -0.17 0.00 -0.02 0.00 0.00 31.44 30.55 2i03 n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2i03 s ARG 310 N -1.42 0.60 0.06 3.49 3.52 -1.21 -0.51 118.95 123.48 2i03 s ARG 310 Ca 0.15 0.01 0.07 0.00 -0.13 0.00 0.00 55.73 55.84 2i03 s ARG 310 Cb 0.13 -0.76 -0.03 0.00 -1.56 0.00 0.00 34.95 32.74 2i03 s ARG 310 CO 0.01 -0.16 -0.20 -1.50 -0.81 0.00 0.00 175.30 172.65 2i03 s ILE 311 N 1.23 1.59 -0.13 4.11 2.07 -0.07 0.30 121.20 130.31 2i03 s ILE 311 Ca -0.06 -1.26 0.01 0.00 -1.41 0.00 0.00 60.65 57.93 2i03 s ILE 311 Cb -0.14 -1.41 -0.01 0.00 0.13 0.00 0.00 42.46 41.04 2i03 s ILE 311 CO -0.02 0.11 -0.16 -0.94 -1.91 0.00 0.00 174.94 172.02 2i03 s SER 312 N -1.36 3.74 -0.07 4.50 1.04 0.30 -0.73 113.70 121.12 2i03 s SER 312 Ca 0.06 -0.41 0.05 0.00 0.48 0.00 0.00 55.95 56.14 2i03 s SER 312 Cb -0.09 -1.56 -0.01 0.00 0.10 0.00 0.00 66.02 64.46 2i03 s SER 312 CO 0.02 0.14 -0.24 -0.76 0.98 0.00 0.00 173.24 173.39 2i03 s LEU 313 N 0.48 2.15 -0.15 2.42 1.02 -0.03 0.93 118.68 125.50 2i03 s LEU 313 Ca -0.11 -0.49 -0.01 0.00 0.02 0.00 0.00 54.13 53.55 2i03 s LEU 313 Cb -0.16 -1.40 -0.01 0.00 0.02 0.00 0.00 46.19 44.64 2i03 s LEU 313 CO 0.05 0.24 -0.12 -1.10 0.02 0.00 0.00 176.35 175.43 2i03 s GLN 314 N -0.12 3.34 0.15 1.70 -0.21 0.22 0.14 119.66 124.88 2i03 s GLN 314 Ca -0.05 -0.69 0.08 0.00 0.02 0.00 0.00 55.36 54.72 2i03 s GLN 314 Cb -0.14 -2.69 -0.04 0.00 1.00 0.00 0.00 33.01 31.13 2i03 s GLN 314 CO 0.04 0.09 -0.08 -1.58 -2.12 0.00 0.00 175.29 171.63 2i03 s TRP 315 N 0.68 2.70 0.01 0.91 0.52 0.24 -1.27 118.94 122.73 2i03 s TRP 315 Ca -0.06 -0.19 0.02 0.00 0.02 0.00 0.00 56.10 55.89 2i03 s TRP 315 Cb -0.15 -1.35 -0.01 0.00 -1.15 0.00 0.00 33.47 30.80 2i03 s TRP 315 CO 0.02 0.48 -0.07 -1.17 0.02 0.00 0.00 176.95 176.23 2i03 s LEU 316 N -2.61 2.09 0.62 2.99 2.96 0.02 -1.16 118.68 123.57 2i03 s LEU 316 Ca 0.24 -0.25 -0.11 0.00 -0.22 0.00 0.00 54.13 53.79 2i03 s LEU 316 Cb -0.10 -0.30 -0.04 0.00 0.50 0.00 0.00 46.19 46.26 2i03 s LEU 316 CO 0.15 -0.00 1.03 -0.13 -1.32 0.00 0.00 176.35 176.08 2i03 s ARG 317 N -0.59 3.59 0.54 1.98 0.52 -0.92 -0.07 118.95 124.00 2i03 s ARG 317 Ca -0.01 0.77 0.22 0.00 -0.52 0.00 0.00 55.73 56.19 2i03 s ARG 317 Cb -0.05 -2.08 1.41 0.00 0.52 0.00 0.00 34.95 34.75 2i03 s ARG 317 CO 0.00 -0.58 2.11 -0.09 0.02 0.00 0.00 175.30 176.76 2i03 h ARG 318 N -0.26 0.00 -4.35 3.54 2.43 -1.57 -2.79 114.38 111.37 2i03 h ARG 318 Ca -0.44 0.00 -0.75 0.00 -0.81 0.00 0.00 59.98 57.98 2i03 h ARG 318 Cb 1.19 0.00 -0.22 0.00 -0.42 0.00 0.00 29.97 30.52 2i03 h ARG 318 CO 0.62 0.00 0.39 0.42 -1.51 0.00 0.00 179.97 179.89 2i03 s ILE 319 N -4.95 5.22 0.00 1.20 -1.09 -1.26 -4.78 121.20 115.53 2i03 s ILE 319 Ca -0.05 -2.04 0.00 0.00 -2.23 0.00 0.00 60.65 56.33 2i03 s ILE 319 Cb 0.17 -4.59 0.00 0.00 -1.58 0.00 0.00 42.46 36.46 2i03 s ILE 319 CO 0.66 -1.22 0.00 0.00 -1.23 0.00 0.00 174.94 173.15 2i03 n GLN 320 N 5.12 0.00 0.07 2.79 6.02 -1.06 -3.31 117.38 127.01 2i03 n GLN 320 Ca 0.17 0.00 0.09 0.00 -0.01 0.00 0.00 57.00 57.25 2i03 n GLN 320 Cb 0.48 -1.40 -0.04 0.00 1.02 0.00 0.00 30.24 30.30 2i03 n GLN 320 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2i03 n ASN 321 N 1.50 0.71 -3.93 1.08 3.02 -1.26 -0.96 115.26 115.42 2i03 n ASN 321 Ca 0.00 0.28 -0.15 0.00 -0.03 0.00 0.00 54.58 54.68 2i03 n ASN 321 Cb 0.00 0.64 -0.14 0.00 -0.61 0.00 0.00 39.78 39.67 2i03 n ASN 321 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2i03 s TYR 322 N -3.31 0.33 -0.02 3.10 6.14 -1.21 -1.69 117.35 120.69 2i03 s TYR 322 Ca -0.02 -0.06 -0.09 0.00 0.64 0.00 0.00 57.07 57.54 2i03 s TYR 322 Cb 0.10 -0.21 0.01 0.00 0.42 0.00 0.00 41.96 42.28 2i03 s TYR 322 CO 0.81 -0.01 0.19 -1.54 0.64 0.00 0.00 175.55 175.64 2i03 s SER 323 N -0.07 -0.07 0.00 4.32 1.04 -0.85 -2.16 113.70 115.91 2i03 s SER 323 Ca 0.01 -0.01 0.08 0.00 0.48 0.00 0.00 55.95 56.51 2i03 s SER 323 Cb -0.02 0.28 -0.02 0.00 0.10 0.00 0.00 66.02 66.36 2i03 s SER 323 CO -0.00 -0.32 -0.25 -0.69 0.98 0.00 0.00 173.24 172.96 2i03 s VAL 324 N -1.05 1.96 -0.25 5.02 1.01 -0.31 -1.70 120.40 125.08 2i03 s VAL 324 Ca -0.11 -1.15 -0.02 0.00 0.00 0.00 0.00 61.98 60.70 2i03 s VAL 324 Cb -0.06 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.70 2i03 s VAL 324 CO 0.02 0.46 -0.06 -0.32 0.00 0.00 0.00 175.10 175.20 2i03 s MET 325 N -0.81 2.85 -0.03 2.72 1.75 0.02 -0.59 119.30 125.21 2i03 s MET 325 Ca 0.10 -0.97 -0.06 0.00 -1.25 0.00 0.00 55.69 53.51 2i03 s MET 325 Cb -0.09 -2.99 -0.04 0.00 2.84 0.00 0.00 34.83 34.54 2i03 s MET 325 CO 0.00 -0.40 0.21 -0.51 -0.65 0.00 0.00 175.02 173.68 2i03 s ASP 326 N 1.33 6.44 -0.31 1.11 1.01 0.12 -1.71 116.67 124.66 2i03 s ASP 326 Ca 0.00 0.48 0.04 0.00 0.71 0.00 0.00 52.55 53.78 2i03 s ASP 326 Cb -0.17 -2.06 0.08 0.00 1.01 0.00 0.00 42.92 41.79 2i03 s ASP 326 CO -0.04 0.30 -0.01 -0.63 0.21 0.00 0.00 175.17 174.99 2i03 s ILE 327 N -1.23 2.21 -0.17 0.77 1.01 -1.26 -0.85 121.20 121.68 2i03 s ILE 327 Ca 0.24 -2.05 -0.08 0.00 0.00 0.00 0.00 60.65 58.76 2i03 s ILE 327 Cb -0.13 -2.51 -0.04 0.00 0.01 0.00 0.00 42.46 39.79 2i03 s ILE 327 CO 0.14 -0.38 0.09 0.00 0.00 0.00 0.00 174.94 174.79 2i03 s ASP 329 N 0.02 4.68 0.12 0.00 1.11 0.54 -0.89 116.67 122.26 2i03 s ASP 329 Ca 0.07 -0.27 -0.30 0.00 0.18 0.00 0.00 52.55 52.24 2i03 s ASP 329 Cb -0.12 -1.02 -0.06 0.00 1.07 0.00 0.00 42.92 42.79 2i03 s ASP 329 CO 0.00 0.19 1.00 -0.47 1.18 0.00 0.00 175.17 177.08 2i03 s TYR 330 N -1.22 3.75 -0.97 4.23 5.04 0.33 -1.43 117.35 127.08 2i03 s TYR 330 Ca 0.22 1.74 -0.13 0.00 -2.44 0.00 0.00 57.07 56.46 2i03 s TYR 330 Cb -0.11 -3.12 0.23 0.00 0.35 0.00 0.00 41.96 39.30 2i03 s TYR 330 CO 0.15 -0.03 0.98 0.34 -1.34 0.00 0.00 175.55 175.65 2i03 s ASP 331 N 0.02 6.97 0.20 4.32 -1.08 -0.52 -4.93 116.67 121.64 2i03 s ASP 331 Ca 0.48 -2.95 -0.05 0.00 -0.52 0.00 0.00 52.55 49.51 2i03 s ASP 331 Cb -0.25 -2.25 0.34 0.00 -1.46 0.00 0.00 42.92 39.30 2i03 s ASP 331 CO 0.31 -0.55 1.08 1.21 0.52 0.00 0.00 175.17 177.74 2i03 n GLU 332 N 3.98 -0.06 -2.44 4.34 4.07 -1.26 -1.19 120.64 128.08 2i03 n GLU 332 Ca 0.20 1.07 -0.39 0.00 -0.06 0.00 0.00 57.16 57.99 2i03 n GLU 332 Cb 0.44 -1.61 0.02 0.00 -0.06 0.00 0.00 31.44 30.23 2i03 n GLU 332 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 2i03 n SER 333 N -5.11 7.02 0.00 4.31 7.64 -1.26 -4.14 113.62 122.09 2i03 n SER 333 Ca 0.12 -3.74 0.00 0.00 1.01 0.00 0.00 58.87 56.26 2i03 n SER 333 Cb 0.37 -1.05 0.00 0.00 -1.01 0.00 0.00 64.21 62.52 2i03 n SER 333 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2i03 n SER 334 N -0.24 0.00 0.00 6.43 7.64 -0.33 -5.03 113.62 122.08 2i03 n SER 334 Ca 0.47 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.35 2i03 n SER 334 Cb 0.28 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 2i03 n SER 334 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2i03 n GLY 335 N -0.13 2.66 3.96 0.23 0.00 -0.34 -5.00 105.19 106.57 2i03 n GLY 335 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2i03 n GLY 335 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2i03 s ARG 336 N -0.02 2.27 -0.06 1.61 1.04 -1.26 -4.79 118.95 117.74 2i03 s ARG 336 Ca 0.00 -0.65 -0.01 0.00 -1.04 0.00 0.00 55.73 54.03 2i03 s ARG 336 Cb 0.00 -2.35 -0.03 0.00 -2.04 0.00 0.00 34.95 30.53 2i03 s ARG 336 CO 0.00 -1.02 0.02 -1.58 -0.04 0.00 0.00 175.30 172.68 2i03 s TRP 337 N -3.00 3.18 -0.04 5.89 0.52 -1.26 -1.44 118.94 122.78 2i03 s TRP 337 Ca 0.60 0.18 0.03 0.00 0.02 0.00 0.00 56.10 56.93 2i03 s TRP 337 Cb -0.10 -1.76 0.00 0.00 -1.15 0.00 0.00 33.47 30.47 2i03 s TRP 337 CO 0.42 0.49 -0.12 -0.80 0.02 0.00 0.00 176.95 176.96 2i03 s ASN 338 N -1.17 1.58 -0.67 2.95 -0.87 -0.52 -4.94 114.94 111.30 2i03 s ASN 338 Ca 0.16 -0.25 -0.05 0.00 -1.57 0.00 0.00 52.86 51.15 2i03 s ASN 338 Cb -0.11 -0.52 0.17 0.00 -0.02 0.00 0.00 41.25 40.77 2i03 s ASN 338 CO 0.06 0.07 0.50 0.00 -2.57 0.00 0.00 177.10 175.17 2i03 n LEU 340 N 3.57 3.00 -4.60 0.00 4.77 -1.25 -4.90 117.00 117.59 2i03 n LEU 340 Ca 0.09 1.02 -0.29 0.00 -0.03 0.00 0.00 56.01 56.81 2i03 n LEU 340 Cb 0.39 -1.31 0.21 0.00 -2.33 0.00 0.00 43.42 40.38 2i03 n LEU 340 CO 0.34 -0.25 0.59 0.54 -1.33 0.00 0.00 177.39 177.28 2i03 s VAL 341 N 3.26 2.10 0.00 4.08 0.11 -1.26 -2.06 120.40 126.63 2i03 s VAL 341 Ca 0.92 0.03 0.00 0.00 -2.93 0.00 0.00 61.98 60.00 2i03 s VAL 341 Cb -0.81 -2.32 0.00 0.00 -1.53 0.00 0.00 36.38 31.72 2i03 s VAL 341 CO 0.53 -0.04 0.00 0.00 -3.33 0.00 0.00 175.10 172.26 2i03 n ALA 342 N -4.48 0.00 -0.15 1.54 0.00 -1.26 -4.61 120.51 111.55 2i03 n ALA 342 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2i03 n ALA 342 Cb 0.56 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.50 2i03 n ALA 342 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2i03 n ARG 343 N -1.93 0.47 -4.05 0.00 0.63 -0.87 -4.70 116.66 106.20 2i03 n ARG 343 Ca 0.00 -0.78 -0.32 0.00 -0.92 0.00 0.00 57.85 55.82 2i03 n ARG 343 Cb 0.02 -0.93 -0.06 0.00 0.45 0.00 0.00 32.46 31.94 2i03 n ARG 343 CO 0.00 0.00 0.00 1.14 -2.51 0.00 0.00 177.63 176.26 2i03 s GLN 344 N -0.33 3.12 -0.08 -0.14 -2.07 -1.25 -4.35 119.66 114.56 2i03 s GLN 344 Ca 0.00 -0.49 0.03 0.00 -1.82 0.00 0.00 55.36 53.08 2i03 s GLN 344 Cb 0.00 -2.89 -0.02 0.00 -1.09 0.00 0.00 33.01 29.02 2i03 s GLN 344 CO 0.00 0.63 -0.18 -1.01 -1.32 0.00 0.00 175.29 173.41 2i03 s HIS 345 N -1.27 2.63 -0.02 9.60 3.76 -0.70 -4.92 115.29 124.38 2i03 s HIS 345 Ca 0.26 -0.55 -0.09 0.00 -0.15 0.00 0.00 55.06 54.52 2i03 s HIS 345 Cb -0.12 -1.69 -0.05 0.00 1.11 0.00 0.00 32.58 31.83 2i03 s HIS 345 CO 0.17 -0.11 0.28 0.42 -0.85 0.00 0.00 174.74 174.65 2i03 s ILE 346 N -0.14 5.27 -0.16 0.60 1.01 -1.26 -0.80 121.20 125.71 2i03 s ILE 346 Ca -0.02 0.37 -0.02 0.00 0.00 0.00 0.00 60.65 60.97 2i03 s ILE 346 Cb -0.14 -3.57 0.05 0.00 0.01 0.00 0.00 42.46 38.82 2i03 s ILE 346 CO 0.04 0.48 0.02 -0.70 0.00 0.00 0.00 174.94 174.78 2i03 s GLU 347 N -1.42 0.66 0.18 2.79 2.12 -0.69 -5.01 118.70 117.33 2i03 s GLU 347 Ca 0.24 -0.26 0.03 0.00 0.36 0.00 0.00 54.97 55.33 2i03 s GLU 347 Cb -0.14 -1.77 -0.05 0.00 0.26 0.00 0.00 34.13 32.43 2i03 s GLU 347 CO 0.12 -0.53 -0.02 0.00 -0.54 0.00 0.00 175.26 174.29 2i03 s MET 348 N 1.89 1.13 0.04 4.30 0.23 -1.26 -2.01 119.30 123.63 2i03 s MET 348 Ca 0.01 -1.54 0.03 0.00 -1.03 0.00 0.00 55.69 53.16 2i03 s MET 348 Cb -0.16 -0.41 -0.02 0.00 -1.53 0.00 0.00 34.83 32.71 2i03 s MET 348 CO -0.07 -0.08 -0.09 0.45 -2.03 0.00 0.00 175.02 173.20 2i03 s SER 349 N -3.19 1.00 -0.01 -1.18 0.15 -0.68 -5.02 113.70 104.77 2i03 s SER 349 Ca 0.23 -0.54 0.06 0.00 0.70 0.00 0.00 55.95 56.40 2i03 s SER 349 Cb 0.05 0.01 -0.09 0.00 -1.71 0.00 0.00 66.02 64.28 2i03 s SER 349 CO 0.04 -0.16 0.16 0.35 1.20 0.00 0.00 173.24 174.83 2i03 n THR 350 N 1.52 0.00 0.03 6.45 -2.24 -1.26 -4.62 114.28 114.16 2i03 n THR 350 Ca -0.22 -0.19 0.06 0.00 -2.27 0.00 0.00 64.05 61.43 2i03 n THR 350 Cb 0.55 0.49 -0.08 0.00 -2.10 0.00 0.00 70.33 69.19 2i03 n THR 350 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2i03 n THR 351 N -1.60 0.70 0.00 4.28 -2.24 -1.26 -5.04 114.28 109.12 2i03 n THR 351 Ca -0.01 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 2i03 n THR 351 Cb 0.15 -0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.00 2i03 n THR 351 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2i03 n GLY 352 N 1.32 2.65 3.89 3.38 0.00 -1.26 -4.81 105.19 110.35 2i03 n GLY 352 Ca -0.07 0.10 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 2i03 n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2i03 s TRP 353 N 1.18 1.95 -0.21 1.61 -2.14 -1.26 -4.68 118.94 115.39 2i03 s TRP 353 Ca 0.00 -0.73 -0.15 0.00 2.66 0.00 0.00 56.10 57.88 2i03 s TRP 353 Cb 0.00 -2.00 -0.04 0.00 -3.10 0.00 0.00 33.47 28.33 2i03 s TRP 353 CO 0.00 -0.38 0.37 0.08 -2.66 0.00 0.00 176.95 174.36 2i03 s VAL 354 N -2.68 5.22 0.00 -0.66 1.01 -0.13 -4.77 120.40 118.38 2i03 s VAL 354 Ca 0.40 0.63 0.00 0.00 0.00 0.00 0.00 61.98 63.01 2i03 s VAL 354 Cb -0.02 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.66 2i03 s VAL 354 CO 0.24 0.26 0.00 0.61 0.00 0.00 0.00 175.10 176.21 2i03 n GLY 355 N 4.01 -1.15 0.16 4.51 0.00 -1.26 -3.47 105.19 107.99 2i03 n GLY 355 Ca -0.09 -1.62 -0.13 0.00 0.00 0.00 0.00 46.02 44.18 2i03 n GLY 355 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2i03 h ARG 356 N 0.00 -0.30 0.00 1.61 3.08 -1.93 -3.39 114.38 113.46 2i03 h ARG 356 Ca 0.00 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2i03 h ARG 356 Cb 0.00 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.12 2i03 h ARG 356 CO 0.00 0.05 -0.06 1.19 -1.07 0.00 0.00 179.97 180.07 2i03 n PHE 357 N -5.06 0.00 0.00 3.04 3.72 -1.26 -4.90 117.46 112.99 2i03 n PHE 357 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 2i03 n PHE 357 Cb 0.25 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.79 2i03 n PHE 357 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 2i03 n ARG 358 N -0.75 0.00 -1.56 -1.08 1.85 -1.25 -5.00 116.66 108.88 2i03 n ARG 358 Ca 0.00 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.44 2i03 n ARG 358 Cb 0.00 0.00 0.01 0.00 -1.05 0.00 0.00 32.46 31.42 2i03 n ARG 358 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 2i03 n PRO 359 N -0.02 1.06 -1.43 2.89 -0.02 -1.23 -4.29 135.00 131.96 2i03 n PRO 359 Ca 0.00 0.38 -0.31 0.00 -2.02 0.00 0.00 63.50 61.55 2i03 n PRO 359 Cb 0.00 -1.87 0.07 0.00 -0.02 0.00 0.00 33.50 31.68 2i03 n PRO 359 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2i03 s SER 360 N -0.84 4.87 0.07 2.55 1.04 -1.26 -4.98 113.70 115.15 2i03 s SER 360 Ca 0.64 1.66 -0.24 0.00 0.48 0.00 0.00 55.95 58.49 2i03 s SER 360 Cb -0.57 -2.45 -0.06 0.00 0.10 0.00 0.00 66.02 63.04 2i03 s SER 360 CO 0.56 -1.77 0.74 -0.70 0.98 0.00 0.00 173.24 173.05 2i03 s GLU 361 N -5.00 4.48 0.33 4.02 2.12 -1.26 -4.94 118.70 118.45 2i03 s GLU 361 Ca 0.60 1.04 -0.22 0.00 0.36 0.00 0.00 54.97 56.75 2i03 s GLU 361 Cb -0.15 -3.33 -0.10 0.00 0.26 0.00 0.00 34.13 30.81 2i03 s GLU 361 CO 0.55 0.38 0.87 -1.25 -0.54 0.00 0.00 175.26 175.27 2i03 s PRO 362 N -0.37 4.35 -0.38 4.30 0.04 -1.26 -4.63 135.00 137.05 2i03 s PRO 362 Ca 0.37 1.09 0.03 0.00 0.04 0.00 0.00 61.00 62.52 2i03 s PRO 362 Cb -0.21 -2.62 0.11 0.00 0.04 0.00 0.00 34.50 31.82 2i03 s PRO 362 CO 0.23 0.21 0.11 -1.01 0.04 0.00 0.00 177.00 176.58 2i03 s HIS 363 N -1.78 3.24 0.57 0.56 3.76 0.52 -4.95 115.29 117.21 2i03 s HIS 363 Ca 0.52 -2.82 -0.17 0.00 -0.15 0.00 0.00 55.06 52.44 2i03 s HIS 363 Cb -0.15 -2.67 -0.04 0.00 1.11 0.00 0.00 32.58 30.83 2i03 s HIS 363 CO 0.20 -0.89 1.06 -0.06 -0.85 0.00 0.00 174.74 174.20 2i03 s PHE 364 N 0.75 2.93 0.38 1.40 0.40 -1.26 -1.06 117.98 121.52 2i03 s PHE 364 Ca 0.12 1.53 -0.17 0.00 -0.60 0.00 0.00 56.93 57.81 2i03 s PHE 364 Cb -0.20 -3.05 -0.09 0.00 0.51 0.00 0.00 43.02 40.18 2i03 s PHE 364 CO -0.09 -1.15 0.84 0.95 0.70 0.00 0.00 175.22 176.48 2i03 s THR 365 N -2.30 4.57 0.26 0.64 -4.23 -0.02 -4.88 115.64 109.67 2i03 s THR 365 Ca 0.65 1.14 0.14 0.00 -1.18 0.00 0.00 61.69 62.44 2i03 s THR 365 Cb -0.17 -3.62 0.25 0.00 1.34 0.00 0.00 72.50 70.30 2i03 s THR 365 CO 0.33 -0.30 1.11 -0.11 -0.54 0.00 0.00 174.62 175.11 2i03 n LEU 366 N -0.65 0.22 -0.18 4.79 7.94 -1.26 0.23 117.00 128.09 2i03 n LEU 366 Ca 0.05 1.17 0.15 0.00 -1.11 0.00 0.00 56.01 56.27 2i03 n LEU 366 Cb 0.54 -0.56 0.68 0.00 0.53 0.00 0.00 43.42 44.61 2i03 n LEU 366 CO 0.41 -1.30 0.94 -0.90 -1.11 0.00 0.00 177.39 175.43 2i03 n ASP 367 N -4.62 0.61 -3.75 1.96 5.75 -1.26 -4.94 116.55 110.30 2i03 n ASP 367 Ca 0.26 -0.95 -0.25 0.00 -0.01 0.00 0.00 54.79 53.84 2i03 n ASP 367 Cb 0.87 -0.03 0.04 0.00 -1.03 0.00 0.00 41.12 40.98 2i03 n ASP 367 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2i03 n GLY 368 N 1.17 -0.43 0.00 6.12 0.00 0.64 -4.87 105.19 107.82 2i03 n GLY 368 Ca 0.18 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.38 2i03 n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2i03 n ASN 369 N -2.96 1.07 -3.80 1.61 5.03 -1.26 -4.94 115.26 110.00 2i03 n ASN 369 Ca -0.10 -0.39 -0.09 0.00 0.87 0.00 0.00 54.58 54.87 2i03 n ASN 369 Cb 0.59 0.99 -0.06 0.00 -1.02 0.00 0.00 39.78 40.28 2i03 n ASN 369 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2i03 s SER 370 N -1.21 -0.02 0.12 6.41 1.04 -1.26 -1.53 113.70 117.26 2i03 s SER 370 Ca 0.00 -0.58 -0.16 0.00 0.48 0.00 0.00 55.95 55.69 2i03 s SER 370 Cb 0.00 0.41 0.03 0.00 0.10 0.00 0.00 66.02 66.56 2i03 s SER 370 CO 0.00 -0.81 0.40 0.72 0.98 0.00 0.00 173.24 174.53 2i03 s PHE 371 N -3.86 -0.20 0.05 5.02 -0.12 -0.78 -0.84 117.98 117.24 2i03 s PHE 371 Ca 0.07 -0.10 0.07 0.00 -0.05 0.00 0.00 56.93 56.92 2i03 s PHE 371 Cb 0.03 0.25 -0.03 0.00 -0.63 0.00 0.00 43.02 42.64 2i03 s PHE 371 CO -0.09 -0.69 -0.15 0.71 -0.05 0.00 0.00 175.22 174.94 2i03 s TYR 372 N -3.73 2.63 -0.24 3.49 1.51 -0.22 -0.53 117.35 120.26 2i03 s TYR 372 Ca 0.02 -0.21 -0.27 0.00 -1.01 0.00 0.00 57.07 55.60 2i03 s TYR 372 Cb 0.02 -1.47 0.13 0.00 -0.11 0.00 0.00 41.96 40.54 2i03 s TYR 372 CO -0.11 0.31 1.08 -1.59 -1.11 0.00 0.00 175.55 174.12 2i03 s LYS 373 N -1.62 0.47 0.03 -0.62 -2.85 -0.99 -0.36 119.74 113.80 2i03 s LYS 373 Ca 0.16 0.35 -0.30 0.00 -1.00 0.00 0.00 55.97 55.18 2i03 s LYS 373 Cb -0.11 0.23 -0.04 0.00 -2.06 0.00 0.00 37.83 35.85 2i03 s LYS 373 CO 0.07 -0.10 1.07 0.42 0.10 0.00 0.00 175.35 176.92 2i03 s ILE 374 N -0.34 4.51 0.07 3.79 1.01 -1.26 -1.40 121.20 127.56 2i03 s ILE 374 Ca 0.02 1.81 -0.08 0.00 0.00 0.00 0.00 60.65 62.40 2i03 s ILE 374 Cb -0.03 -4.16 -0.00 0.00 0.01 0.00 0.00 42.46 38.28 2i03 s ILE 374 CO -0.04 0.15 0.16 0.27 0.00 0.00 0.00 174.94 175.47 2i03 s ILE 375 N 0.99 0.14 0.20 2.92 -4.36 -0.66 -4.52 121.20 115.92 2i03 s ILE 375 Ca 0.55 -1.16 -0.30 0.00 -0.26 0.00 0.00 60.65 59.47 2i03 s ILE 375 Cb -0.25 -1.21 -0.09 0.00 1.25 0.00 0.00 42.46 42.16 2i03 s ILE 375 CO 0.29 -0.64 1.42 -0.55 0.24 0.00 0.00 174.94 175.70 2i03 s SER 376 N -2.60 6.73 1.41 4.36 0.15 -1.26 -1.83 113.70 120.65 2i03 s SER 376 Ca 0.02 2.54 -0.22 0.00 0.70 0.00 0.00 55.95 58.99 2i03 s SER 376 Cb 0.03 -2.61 0.34 0.00 -1.71 0.00 0.00 66.02 62.08 2i03 s SER 376 CO -0.09 -0.67 0.87 0.59 1.20 0.00 0.00 173.24 175.14 2i03 n ASN 377 N 2.93 -3.59 0.11 5.45 3.02 0.24 -4.84 115.26 118.59 2i03 n ASN 377 Ca 0.09 -0.90 0.12 0.00 -0.03 0.00 0.00 54.58 53.86 2i03 n ASN 377 Cb 0.41 -0.94 0.17 0.00 -0.61 0.00 0.00 39.78 38.81 2i03 n ASN 377 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2i03 h GLU 378 N 0.00 0.00 -0.03 3.52 4.57 -1.95 -2.99 114.58 117.70 2i03 h GLU 378 Ca -0.37 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.81 2i03 h GLU 378 Cb 1.23 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.82 2i03 h GLU 378 CO 0.23 0.00 -0.07 -1.91 -1.18 0.00 0.00 179.01 176.08 2i03 n GLU 379 N -2.49 2.08 -0.28 1.92 2.13 -1.26 -4.97 120.64 117.77 2i03 n GLU 379 Ca 0.03 -1.68 0.00 0.00 0.66 0.00 0.00 57.16 56.17 2i03 n GLU 379 Cb 0.48 -1.47 0.00 0.00 0.27 0.00 0.00 31.44 30.73 2i03 n GLU 379 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2i03 n GLY 380 N 1.34 0.65 3.80 8.31 0.00 -1.13 -4.82 105.19 113.33 2i03 n GLY 380 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 2i03 n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2i03 s TYR 381 N -2.56 3.44 -0.27 1.61 1.51 -1.26 0.01 117.35 119.83 2i03 s TYR 381 Ca 0.00 0.40 -0.29 0.00 -1.01 0.00 0.00 57.07 56.17 2i03 s TYR 381 Cb 0.00 -1.90 0.01 0.00 -0.11 0.00 0.00 41.96 39.96 2i03 s TYR 381 CO 0.00 0.62 1.06 1.03 -1.11 0.00 0.00 175.55 177.14 2i03 s ARG 382 N -0.89 4.18 0.22 -0.62 0.52 -1.26 0.82 118.95 121.92 2i03 s ARG 382 Ca 0.14 1.24 0.01 0.00 -0.52 0.00 0.00 55.73 56.61 2i03 s ARG 382 Cb -0.12 -3.68 -0.05 0.00 0.52 0.00 0.00 34.95 31.62 2i03 s ARG 382 CO 0.03 -0.74 0.06 -1.01 0.02 0.00 0.00 175.30 173.66 2i03 s HIS 383 N 3.39 1.41 -0.20 -0.53 3.76 -0.76 -1.85 115.29 120.51 2i03 s HIS 383 Ca 0.45 -1.12 -0.29 0.00 -0.15 0.00 0.00 55.06 53.95 2i03 s HIS 383 Cb -0.14 -0.82 0.00 0.00 1.11 0.00 0.00 32.58 32.74 2i03 s HIS 383 CO 0.10 -0.29 1.10 0.42 -0.85 0.00 0.00 174.74 175.22 2i03 s ILE 384 N -3.72 4.58 -0.05 0.60 1.01 -1.26 -1.65 121.20 120.71 2i03 s ILE 384 Ca 0.32 1.90 0.00 0.00 0.00 0.00 0.00 60.65 62.87 2i03 s ILE 384 Cb 0.07 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 2i03 s ILE 384 CO 0.10 -0.15 -0.03 0.00 0.00 0.00 0.00 174.94 174.86 2i03 s TYR 386 N -0.91 3.27 0.29 0.00 5.04 -0.62 -2.35 117.35 122.07 2i03 s TYR 386 Ca 0.15 0.15 0.10 0.00 -2.44 0.00 0.00 57.07 55.03 2i03 s TYR 386 Cb -0.11 -2.28 -0.05 0.00 0.35 0.00 0.00 41.96 39.87 2i03 s TYR 386 CO 0.04 -0.01 -0.05 -0.06 -1.34 0.00 0.00 175.55 174.13 2i03 s PHE 387 N 1.20 2.56 -0.13 4.97 0.40 0.30 -1.03 117.98 126.25 2i03 s PHE 387 Ca 0.07 -0.30 0.02 0.00 -0.60 0.00 0.00 56.93 56.13 2i03 s PHE 387 Cb -0.14 -1.20 0.01 0.00 0.51 0.00 0.00 43.02 42.19 2i03 s PHE 387 CO 0.06 0.61 -0.21 -0.65 0.70 0.00 0.00 175.22 175.73 2i03 s GLN 388 N -3.64 2.88 0.30 0.44 1.11 -1.26 -1.86 119.66 117.63 2i03 s GLN 388 Ca 0.32 -0.80 0.06 0.00 0.01 0.00 0.00 55.36 54.94 2i03 s GLN 388 Cb -0.05 -2.33 0.31 0.00 -1.01 0.00 0.00 33.01 29.93 2i03 s GLN 388 CO 0.19 -0.01 0.98 0.44 0.01 0.00 0.00 175.29 176.89 2i03 n ILE 389 N 4.05 0.31 0.00 1.08 -5.35 -0.58 -0.66 119.36 118.21 2i03 n ILE 389 Ca -0.20 0.73 0.00 0.00 -0.27 0.00 0.00 62.75 63.01 2i03 n ILE 389 Cb 0.52 -1.73 0.00 0.00 -1.74 0.00 0.00 39.64 36.69 2i03 n ILE 389 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2i03 n ASP 390 N -1.83 2.98 -4.69 7.28 5.68 -1.26 -4.50 116.55 120.22 2i03 n ASP 390 Ca -0.00 -0.15 -0.42 0.00 -0.50 0.00 0.00 54.79 53.71 2i03 n ASP 390 Cb 0.53 0.89 -0.03 0.00 -1.14 0.00 0.00 41.12 41.38 2i03 n ASP 390 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 2i03 s LYS 391 N -1.49 4.39 0.30 0.11 3.01 0.17 -4.80 119.74 121.43 2i03 s LYS 391 Ca 0.00 1.53 0.05 0.00 -1.01 0.00 0.00 55.97 56.55 2i03 s LYS 391 Cb 0.00 -3.55 0.48 0.00 -1.01 0.00 0.00 37.83 33.75 2i03 s LYS 391 CO 0.00 -0.38 1.73 1.57 0.51 0.00 0.00 175.35 178.78 2i03 h LYS 392 N 7.27 0.32 -5.77 1.68 2.10 -1.91 -3.39 116.57 116.87 2i03 h LYS 392 Ca -0.33 -0.13 -0.66 0.00 -2.00 0.00 0.00 60.65 57.53 2i03 h LYS 392 Cb 1.15 -0.01 -0.08 0.00 -0.90 0.00 0.00 32.23 32.39 2i03 h LYS 392 CO 0.87 0.62 -0.51 -0.51 -2.00 0.00 0.00 179.45 177.91 2i03 s ASP 393 N -6.86 6.17 0.40 7.07 1.01 -1.26 -4.96 116.67 118.24 2i03 s ASP 393 Ca -0.05 0.36 0.05 0.00 0.71 0.00 0.00 52.55 53.62 2i03 s ASP 393 Cb 0.14 -1.93 0.05 0.00 1.01 0.00 0.00 42.92 42.18 2i03 s ASP 393 CO 0.77 0.35 0.41 0.00 0.21 0.00 0.00 175.17 176.91 2i03 s THR 395 N -1.81 0.40 0.23 0.00 2.01 -0.20 -4.87 115.64 111.40 2i03 s THR 395 Ca 0.31 -0.62 -0.32 0.00 0.31 0.00 0.00 61.69 61.37 2i03 s THR 395 Cb -0.02 -1.03 -0.12 0.00 0.01 0.00 0.00 72.50 71.33 2i03 s THR 395 CO 0.20 -0.34 1.67 0.49 -0.69 0.00 0.00 174.62 175.95 2i03 n PHE 396 N 5.08 2.72 0.62 4.92 3.72 -1.26 -1.59 117.46 131.68 2i03 n PHE 396 Ca -0.07 0.13 0.09 0.00 -0.05 0.00 0.00 57.45 57.54 2i03 n PHE 396 Cb 0.46 -2.64 -0.11 0.00 -0.94 0.00 0.00 39.48 36.25 2i03 n PHE 396 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 2i03 n ILE 397 N 3.36 0.00 -4.24 4.37 -5.35 -0.34 -4.93 119.36 112.22 2i03 n ILE 397 Ca 0.14 -0.17 -0.14 0.00 -0.27 0.00 0.00 62.75 62.31 2i03 n ILE 397 Cb 0.35 0.75 -0.10 0.00 -1.74 0.00 0.00 39.64 38.89 2i03 n ILE 397 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2i03 s THR 398 N -2.87 1.13 0.16 7.28 -4.23 -1.26 -4.92 115.64 110.94 2i03 s THR 398 Ca 0.03 -2.02 -0.24 0.00 -1.18 0.00 0.00 61.69 58.28 2i03 s THR 398 Cb 0.13 -1.80 0.06 0.00 1.34 0.00 0.00 72.50 72.23 2i03 s THR 398 CO 0.75 -0.74 0.82 -1.59 -0.54 0.00 0.00 174.62 173.33 2i03 s LYS 399 N -3.67 1.31 0.00 3.99 -2.85 -1.26 -4.63 119.74 112.63 2i03 s LYS 399 Ca 0.16 -0.66 0.00 0.00 -1.00 0.00 0.00 55.97 54.47 2i03 s LYS 399 Cb 0.02 0.49 0.00 0.00 -2.06 0.00 0.00 37.83 36.28 2i03 s LYS 399 CO 0.00 -0.59 0.00 0.41 0.10 0.00 0.00 175.35 175.27 2i03 n GLY 400 N -0.41 3.25 2.37 0.59 0.00 -1.26 -4.90 105.19 104.83 2i03 n GLY 400 Ca -0.08 -1.78 -0.30 0.00 0.00 0.00 0.00 46.02 43.86 2i03 n GLY 400 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2i03 n THR 401 N -1.82 4.04 -3.98 2.61 -2.24 -1.26 -4.77 114.28 106.87 2i03 n THR 401 Ca 0.00 -3.09 -0.13 0.00 -2.27 0.00 0.00 64.05 58.56 2i03 n THR 401 Cb 0.00 -1.98 -0.01 0.00 -2.10 0.00 0.00 70.33 66.24 2i03 n THR 401 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 2i03 n TRP 402 N 1.86 -1.74 -4.11 4.78 4.27 -1.26 -5.05 117.44 116.18 2i03 n TRP 402 Ca 0.57 -2.23 -0.11 0.00 -3.89 0.00 0.00 57.50 51.84 2i03 n TRP 402 Cb 0.47 0.67 -0.11 0.00 -1.36 0.00 0.00 31.31 30.99 2i03 n TRP 402 CO 0.00 0.00 0.00 -1.21 -2.29 0.00 0.00 177.69 174.19 2i03 s GLU 403 N -2.59 0.67 -0.28 -2.67 2.02 -1.26 -4.55 118.70 110.03 2i03 s GLU 403 Ca 0.25 -1.06 -0.18 0.00 0.02 0.00 0.00 54.97 54.00 2i03 s GLU 403 Cb -0.02 -0.21 -0.02 0.00 0.10 0.00 0.00 34.13 33.98 2i03 s GLU 403 CO 0.18 0.00 0.53 0.08 0.02 0.00 0.00 175.26 176.08 2i03 s VAL 404 N -2.61 5.04 0.07 2.63 1.01 -0.77 -2.39 120.40 123.38 2i03 s VAL 404 Ca 0.01 0.79 -0.16 0.00 0.00 0.00 0.00 61.98 62.62 2i03 s VAL 404 Cb -0.02 -3.88 -0.15 0.00 0.00 0.00 0.00 36.38 32.34 2i03 s VAL 404 CO -0.03 -0.00 1.30 0.40 0.00 0.00 0.00 175.10 176.77 2i03 h ILE 405 N 5.46 1.33 -1.51 2.22 1.08 -0.53 -3.46 117.51 122.10 2i03 h ILE 405 Ca -0.28 -1.76 0.19 0.00 -0.39 0.00 0.00 64.86 62.61 2i03 h ILE 405 Cb 1.13 1.97 -0.21 0.00 -3.07 0.00 0.00 36.82 36.64 2i03 h ILE 405 CO 0.74 0.54 0.73 -0.83 -0.69 0.00 0.00 178.15 178.65 2i03 s GLY 406 N -3.90 -0.22 -0.22 5.37 0.00 -1.17 -5.00 107.32 102.19 2i03 s GLY 406 Ca -0.12 1.91 -0.21 0.00 0.00 0.00 0.00 44.72 46.31 2i03 s GLY 406 CO 0.85 0.77 0.63 -0.42 0.00 0.00 0.00 173.10 174.92 2i03 s ILE 407 N -1.85 5.01 -0.21 0.90 1.01 -1.26 -0.99 121.20 123.81 2i03 s ILE 407 Ca 0.06 1.17 -0.02 0.00 0.00 0.00 0.00 60.65 61.86 2i03 s ILE 407 Cb -0.01 -3.94 -0.20 0.00 0.01 0.00 0.00 42.46 38.32 2i03 s ILE 407 CO -0.04 0.08 -0.02 -0.62 0.00 0.00 0.00 174.94 174.35 2i03 n GLU 408 N 5.25 0.69 -3.79 2.79 -0.58 -0.25 -4.98 120.64 119.78 2i03 n GLU 408 Ca -0.01 0.20 -0.13 0.00 -0.42 0.00 0.00 57.16 56.80 2i03 n GLU 408 Cb 0.49 -1.59 -0.09 0.00 -0.57 0.00 0.00 31.44 29.68 2i03 n GLU 408 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2i03 s ALA 409 N -2.53 -0.67 -0.14 0.62 0.00 -1.13 -4.92 121.76 112.99 2i03 s ALA 409 Ca -0.31 0.31 -0.02 0.00 0.00 0.00 0.00 51.96 51.95 2i03 s ALA 409 Cb 0.08 -0.02 0.05 0.00 0.00 0.00 0.00 23.12 23.23 2i03 s ALA 409 CO 0.66 -0.23 0.02 -1.17 0.00 0.00 0.00 175.76 175.04 2i03 s LEU 410 N -1.07 0.93 0.17 0.00 2.96 -1.26 -0.36 118.68 120.05 2i03 s LEU 410 Ca -0.11 -0.49 0.11 0.00 -0.22 0.00 0.00 54.13 53.41 2i03 s LEU 410 Cb -0.05 -0.54 -0.04 0.00 0.50 0.00 0.00 46.19 46.05 2i03 s LEU 410 CO 0.03 -0.25 -0.21 0.42 -1.32 0.00 0.00 176.35 175.02 2i03 s THR 411 N 1.90 2.54 -1.40 3.68 -4.23 0.26 -4.97 115.64 113.43 2i03 s THR 411 Ca 0.02 -1.87 0.00 0.00 -1.18 0.00 0.00 61.69 58.66 2i03 s THR 411 Cb -0.15 -2.21 0.00 0.00 1.34 0.00 0.00 72.50 71.48 2i03 s THR 411 CO -0.07 -0.06 0.65 -1.54 -0.54 0.00 0.00 174.62 173.06 2i03 n SER 412 N 0.38 0.00 -0.07 3.99 3.41 -1.26 -2.41 113.62 117.65 2i03 n SER 412 Ca -0.13 0.19 -0.12 0.00 -0.26 0.00 0.00 58.87 58.55 2i03 n SER 412 Cb 0.55 -0.19 -0.04 0.00 -0.26 0.00 0.00 64.21 64.27 2i03 n SER 412 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2i03 n ASP 413 N -1.15 1.70 -4.23 4.04 -0.08 -1.26 -4.99 116.55 110.57 2i03 n ASP 413 Ca 0.00 0.28 -0.23 0.00 -1.51 0.00 0.00 54.79 53.33 2i03 n ASP 413 Cb 0.02 -0.65 -0.09 0.00 2.34 0.00 0.00 41.12 42.74 2i03 n ASP 413 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 2i03 s TYR 414 N -2.63 1.81 -0.14 -0.67 1.51 -1.01 -3.31 117.35 112.91 2i03 s TYR 414 Ca -0.25 -1.18 -0.01 0.00 -1.01 0.00 0.00 57.07 54.62 2i03 s TYR 414 Cb 0.06 -1.16 0.04 0.00 -0.11 0.00 0.00 41.96 40.78 2i03 s TYR 414 CO 0.35 -0.22 -0.04 -1.17 -1.11 0.00 0.00 175.55 173.36 2i03 s LEU 415 N -3.54 1.28 -0.07 -1.29 1.98 -0.99 -0.57 118.68 115.47 2i03 s LEU 415 Ca 0.29 -0.47 -0.05 0.00 -2.89 0.00 0.00 54.13 51.02 2i03 s LEU 415 Cb 0.05 -0.79 -0.04 0.00 0.66 0.00 0.00 46.19 46.07 2i03 s LEU 415 CO 0.15 -0.18 0.13 -0.31 -1.89 0.00 0.00 176.35 174.26 2i03 s TYR 416 N 1.73 3.51 0.21 5.38 1.51 0.52 -0.83 117.35 129.38 2i03 s TYR 416 Ca 0.03 0.41 -0.15 0.00 -1.01 0.00 0.00 57.07 56.35 2i03 s TYR 416 Cb -0.14 -1.87 0.01 0.00 -0.11 0.00 0.00 41.96 39.85 2i03 s TYR 416 CO -0.08 0.67 0.47 1.52 -1.11 0.00 0.00 175.55 177.02 2i03 s TYR 417 N -1.13 0.12 -0.06 2.71 -0.85 -0.08 -1.09 117.35 116.97 2i03 s TYR 417 Ca 0.19 -0.48 0.02 0.00 -0.52 0.00 0.00 57.07 56.29 2i03 s TYR 417 Cb -0.12 0.26 -0.03 0.00 0.38 0.00 0.00 41.96 42.45 2i03 s TYR 417 CO 0.09 -0.91 -0.10 0.42 -1.52 0.00 0.00 175.55 173.53 2i03 s ILE 418 N -3.93 3.41 0.26 -3.49 -1.09 -0.16 -0.37 121.20 115.82 2i03 s ILE 418 Ca 0.14 -0.59 -0.14 0.00 -2.23 0.00 0.00 60.65 57.83 2i03 s ILE 418 Cb -0.00 -2.37 0.00 0.00 -1.58 0.00 0.00 42.46 38.51 2i03 s ILE 418 CO 0.01 0.59 0.53 -0.94 -1.23 0.00 0.00 174.94 173.91 2i03 s SER 419 N -0.75 -0.10 -0.31 3.58 1.04 -0.69 0.26 113.70 116.73 2i03 s SER 419 Ca 0.12 -0.88 0.08 0.00 0.48 0.00 0.00 55.95 55.74 2i03 s SER 419 Cb -0.11 0.62 0.51 0.00 0.10 0.00 0.00 66.02 67.14 2i03 s SER 419 CO 0.01 -1.19 1.49 -0.46 0.98 0.00 0.00 173.24 174.07 2i03 n ASN 420 N -0.43 2.83 -0.13 7.02 0.23 -1.01 -1.83 115.26 121.95 2i03 n ASN 420 Ca -0.02 -3.79 -0.12 0.00 -0.53 0.00 0.00 54.58 50.12 2i03 n ASN 420 Cb 0.61 -0.64 -0.02 0.00 -2.08 0.00 0.00 39.78 37.65 2i03 n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2i03 h GLU 421 N 1.11 0.85 -6.25 -3.83 4.81 -1.86 -3.32 114.58 106.09 2i03 h GLU 421 Ca 0.26 -0.38 -0.69 0.00 -0.13 0.00 0.00 59.36 58.42 2i03 h GLU 421 Cb 1.66 -0.02 0.05 0.00 0.63 0.00 0.00 28.75 31.07 2i03 h GLU 421 CO 0.48 1.02 0.50 0.98 -0.73 0.00 0.00 179.01 181.27 2i03 n TYR 422 N -4.21 1.56 -1.05 0.92 9.36 -1.26 -0.21 117.16 122.27 2i03 n TYR 422 Ca -0.02 0.63 -0.05 0.00 3.32 0.00 0.00 57.90 61.78 2i03 n TYR 422 Cb 0.44 -2.34 -0.02 0.00 -0.63 0.00 0.00 39.34 36.79 2i03 n TYR 422 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 2i03 n LYS 423 N 2.84 -1.82 -2.25 2.98 4.01 -1.26 -2.49 118.16 120.17 2i03 n LYS 423 Ca 0.19 0.61 -0.16 0.00 -0.51 0.00 0.00 58.31 58.45 2i03 n LYS 423 Cb 0.18 -4.85 -0.02 0.00 -0.51 0.00 0.00 35.03 29.83 2i03 n LYS 423 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2i03 n GLY 424 N 0.50 -0.13 3.27 0.72 0.00 0.71 -4.95 105.19 105.32 2i03 n GLY 424 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 2i03 n GLY 424 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2i03 s MET 425 N -4.73 2.60 0.65 1.61 0.23 -1.04 -4.98 119.30 113.64 2i03 s MET 425 Ca 0.00 -1.28 0.28 0.00 -1.03 0.00 0.00 55.69 53.66 2i03 s MET 425 Cb 0.00 -3.58 1.48 0.00 -1.53 0.00 0.00 34.83 31.20 2i03 s MET 425 CO 0.00 -0.77 1.85 -1.00 -2.03 0.00 0.00 175.02 173.07 2i03 h PRO 426 N 8.28 0.00 -0.74 3.16 0.13 -1.88 -2.32 132.00 138.64 2i03 h PRO 426 Ca -0.23 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.77 2i03 h PRO 426 Cb 1.08 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.13 2i03 h PRO 426 CO 0.66 0.00 0.17 0.41 -0.23 0.00 0.00 178.00 179.00 2i03 n GLY 427 N -1.31 3.22 3.40 1.56 0.00 -1.26 -4.88 105.19 105.91 2i03 n GLY 427 Ca 0.01 -0.86 -0.23 0.00 0.00 0.00 0.00 46.02 44.94 2i03 n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2i03 s GLY 428 N -0.78 1.62 0.01 -0.02 0.00 -0.88 -1.35 107.32 105.92 2i03 s GLY 428 Ca 0.49 -1.68 0.02 0.00 0.00 0.00 0.00 44.72 43.55 2i03 s GLY 428 CO 0.13 -1.75 -0.08 0.50 0.00 0.00 0.00 173.10 171.90 2i03 s ARG 429 N -3.19 0.59 0.04 2.90 1.81 0.99 -4.14 118.95 117.94 2i03 s ARG 429 Ca 0.23 -0.39 -0.17 0.00 -1.72 0.00 0.00 55.73 53.68 2i03 s ARG 429 Cb -0.05 -0.53 0.03 0.00 -0.45 0.00 0.00 34.95 33.95 2i03 s ARG 429 CO 0.10 0.14 0.38 -0.80 -0.68 0.00 0.00 175.30 174.44 2i03 s ASN 430 N -0.51 -0.24 -0.17 0.23 0.01 -0.76 -1.98 114.94 111.52 2i03 s ASN 430 Ca 0.00 -0.04 -0.10 0.00 -0.71 0.00 0.00 52.86 52.02 2i03 s ASN 430 Cb -0.04 0.40 -0.05 0.00 0.41 0.00 0.00 41.25 41.97 2i03 s ASN 430 CO 0.00 -0.64 0.17 -0.22 -1.51 0.00 0.00 177.10 174.90 2i03 s LEU 431 N -1.97 4.26 0.24 0.60 2.96 -1.26 -1.70 118.68 121.81 2i03 s LEU 431 Ca -0.06 0.36 0.04 0.00 -0.22 0.00 0.00 54.13 54.25 2i03 s LEU 431 Cb -0.01 -2.16 -0.05 0.00 0.50 0.00 0.00 46.19 44.47 2i03 s LEU 431 CO -0.02 0.22 -0.02 -0.31 -1.32 0.00 0.00 176.35 174.90 2i03 s TYR 432 N 0.03 1.62 -0.03 5.38 1.51 0.50 0.85 117.35 127.21 2i03 s TYR 432 Ca 0.12 -0.88 -0.01 0.00 -1.01 0.00 0.00 57.07 55.29 2i03 s TYR 432 Cb -0.12 -0.93 0.03 0.00 -0.11 0.00 0.00 41.96 40.83 2i03 s TYR 432 CO 0.01 0.02 0.04 -1.59 -1.11 0.00 0.00 175.55 172.92 2i03 s LYS 433 N -3.83 0.01 -0.21 -0.62 -2.85 0.12 -0.90 119.74 111.45 2i03 s LYS 433 Ca 0.28 0.23 -0.06 0.00 -1.00 0.00 0.00 55.97 55.43 2i03 s LYS 433 Cb 0.05 -0.39 -0.03 0.00 -2.06 0.00 0.00 37.83 35.40 2i03 s LYS 433 CO 0.09 -0.22 0.03 -1.50 0.10 0.00 0.00 175.35 173.84 2i03 s ILE 434 N 1.46 4.15 0.01 3.79 2.07 -0.01 -0.98 121.20 131.70 2i03 s ILE 434 Ca -0.04 -0.24 -0.30 0.00 -1.41 0.00 0.00 60.65 58.66 2i03 s ILE 434 Cb -0.13 -2.89 -0.06 0.00 0.13 0.00 0.00 42.46 39.51 2i03 s ILE 434 CO -0.03 0.41 1.54 -1.58 -1.91 0.00 0.00 174.94 173.37 2i03 s GLN 435 N 1.06 4.23 0.21 3.50 0.74 -0.93 -2.35 119.66 126.11 2i03 s GLN 435 Ca 0.03 2.14 0.19 0.00 0.05 0.00 0.00 55.36 57.76 2i03 s GLN 435 Cb -0.14 -3.66 0.86 0.00 1.10 0.00 0.00 33.01 31.18 2i03 s GLN 435 CO 0.02 -0.69 1.57 1.28 -0.55 0.00 0.00 175.29 176.93 2i03 n LEU 436 N 5.78 0.45 0.06 3.68 4.32 -1.21 -2.50 117.00 127.59 2i03 n LEU 436 Ca 0.15 0.65 -0.22 0.00 -0.02 0.00 0.00 56.01 56.57 2i03 n LEU 436 Cb 0.42 -0.63 -0.15 0.00 -1.62 0.00 0.00 43.42 41.44 2i03 n LEU 436 CO 0.61 -0.63 -0.19 0.28 -1.22 0.00 0.00 177.39 176.24 2i03 h SER 437 N 0.00 0.53 -3.09 -1.43 0.02 -1.89 -3.43 113.55 104.25 2i03 h SER 437 Ca 0.00 -0.92 -0.54 0.00 -0.84 0.00 0.00 61.79 59.49 2i03 h SER 437 Cb 0.19 -0.17 -0.40 0.00 0.14 0.00 0.00 62.40 62.16 2i03 h SER 437 CO 0.00 1.55 -0.76 -0.62 -1.14 0.00 0.00 176.83 175.86 2i03 s ASP 438 N -7.14 3.49 0.00 3.07 2.15 -1.04 -4.98 116.67 112.22 2i03 s ASP 438 Ca -0.15 -1.25 0.03 0.00 0.43 0.00 0.00 52.55 51.61 2i03 s ASP 438 Cb 0.03 -0.62 0.20 0.00 -0.30 0.00 0.00 42.92 42.23 2i03 s ASP 438 CO 0.84 -0.39 0.68 -1.22 -0.17 0.00 0.00 175.17 174.91 2i03 n TYR 439 N 5.04 0.00 0.48 -5.34 4.01 -1.23 -0.42 117.16 119.69 2i03 n TYR 439 Ca -0.05 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.80 2i03 n TYR 439 Cb 0.44 -0.01 0.09 0.00 -0.31 0.00 0.00 39.34 39.55 2i03 n TYR 439 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 2i03 n THR 440 N -1.01 0.33 -3.42 -0.72 -1.04 -1.26 -4.62 114.28 102.55 2i03 n THR 440 Ca 0.02 -0.31 -0.44 0.00 -2.04 0.00 0.00 64.05 61.28 2i03 n THR 440 Cb 0.01 -0.05 -0.03 0.00 -1.82 0.00 0.00 70.33 68.44 2i03 n THR 440 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2i03 s LYS 441 N -3.22 3.62 -0.19 -2.82 1.02 0.44 -5.02 119.74 113.57 2i03 s LYS 441 Ca 0.04 -2.80 -0.03 0.00 0.02 0.00 0.00 55.97 53.21 2i03 s LYS 441 Cb 0.13 -4.32 -0.01 0.00 -0.52 0.00 0.00 37.83 33.11 2i03 s LYS 441 CO 0.76 -1.26 -0.07 0.54 -0.92 0.00 0.00 175.35 174.40 2i03 s VAL 442 N -0.48 3.24 -0.15 3.17 0.11 -1.26 -2.19 120.40 122.84 2i03 s VAL 442 Ca 0.23 -0.55 -0.02 0.00 -2.93 0.00 0.00 61.98 58.71 2i03 s VAL 442 Cb -0.11 -2.44 -0.02 0.00 -1.53 0.00 0.00 36.38 32.28 2i03 s VAL 442 CO -0.08 0.46 -0.09 -0.89 -3.33 0.00 0.00 175.10 171.17 2i03 s THR 443 N 1.15 3.37 0.20 5.04 2.01 -0.15 -4.94 115.64 122.33 2i03 s THR 443 Ca 0.02 -0.54 -0.30 0.00 0.31 0.00 0.00 61.69 61.18 2i03 s THR 443 Cb -0.14 -2.46 -0.08 0.00 0.01 0.00 0.00 72.50 69.83 2i03 s THR 443 CO -0.02 0.50 0.97 0.00 -0.69 0.00 0.00 174.62 175.38 2i03 n LEU 445 N 1.89 0.71 0.00 0.00 4.77 0.25 -4.68 117.00 119.94 2i03 n LEU 445 Ca -0.00 -0.48 0.00 0.00 -0.03 0.00 0.00 56.01 55.49 2i03 n LEU 445 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2i03 n LEU 445 CO 0.51 0.18 -0.15 -1.54 -1.33 0.00 0.00 177.39 175.06 2i03 n SER 446 N -1.40 1.51 -0.30 -1.43 3.41 -1.22 -4.80 113.62 109.40 2i03 n SER 446 Ca 0.03 -0.14 -0.01 0.00 -0.26 0.00 0.00 58.87 58.49 2i03 n SER 446 Cb 0.25 0.58 0.05 0.00 -0.26 0.00 0.00 64.21 64.84 2i03 n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2i03 n GLU 448 N -5.49 0.05 -0.32 0.00 4.71 -1.26 -4.10 120.64 114.23 2i03 n GLU 448 Ca 0.09 -0.04 0.24 0.00 -0.01 0.00 0.00 57.16 57.44 2i03 n GLU 448 Cb 0.40 -1.50 0.46 0.00 -1.01 0.00 0.00 31.44 29.79 2i03 n GLU 448 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 2i03 h LEU 449 N 0.09 0.19 -5.00 -4.62 3.38 -1.81 -3.35 115.31 104.20 2i03 h LEU 449 Ca 0.00 0.23 -0.06 0.00 0.09 0.00 0.00 57.88 58.15 2i03 h LEU 449 Cb 0.51 0.27 -0.14 0.00 0.09 0.00 0.00 40.66 41.38 2i03 h LEU 449 CO 0.00 -0.30 -0.15 -3.20 0.09 0.00 0.00 178.44 174.88 2i03 n ASN 450 N -5.23 -1.69 0.17 -0.43 2.85 -1.26 -5.04 115.26 104.63 2i03 n ASN 450 Ca 0.31 -1.69 0.19 0.00 -0.11 0.00 0.00 54.58 53.28 2i03 n ASN 450 Cb 1.02 0.91 0.78 0.00 1.24 0.00 0.00 39.78 43.74 2i03 n ASN 450 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2i03 h PRO 451 N 3.79 0.00 -0.05 1.20 0.13 -1.71 0.42 132.00 135.79 2i03 h PRO 451 Ca -0.11 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.97 2i03 h PRO 451 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2i03 h PRO 451 CO -0.09 0.00 -0.14 0.93 -0.23 0.00 0.00 178.00 178.47 2i03 h GLU 452 N 0.00 0.18 0.00 0.86 4.39 -1.95 -3.38 114.58 114.68 2i03 h GLU 452 Ca 0.13 -0.13 -0.22 0.00 0.34 0.00 0.00 59.36 59.48 2i03 h GLU 452 Cb 0.87 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.50 2i03 h GLU 452 CO -0.00 0.75 -2.09 -2.13 -1.16 0.00 0.00 179.01 174.38 2i03 n ARG 453 N -4.62 0.67 -4.08 2.33 0.63 -0.93 -4.70 116.66 105.96 2i03 n ARG 453 Ca -0.08 -0.03 -0.32 0.00 -0.92 0.00 0.00 57.85 56.50 2i03 n ARG 453 Cb 0.39 -1.57 -0.16 0.00 0.45 0.00 0.00 32.46 31.56 2i03 n ARG 453 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2i03 n GLN 455 N 4.67 -0.00 -3.66 0.00 6.02 0.32 -4.33 117.38 120.40 2i03 n GLN 455 Ca -0.19 -0.13 -0.30 0.00 -0.01 0.00 0.00 57.00 56.38 2i03 n GLN 455 Cb 0.50 -0.51 -0.15 0.00 1.02 0.00 0.00 30.24 31.11 2i03 n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 2i03 s TYR 456 N -0.00 1.31 0.25 1.08 6.14 -1.18 -0.01 117.35 124.94 2i03 s TYR 456 Ca 0.00 -1.56 0.09 0.00 0.64 0.00 0.00 57.07 56.23 2i03 s TYR 456 Cb 0.00 -1.47 -0.04 0.00 0.42 0.00 0.00 41.96 40.87 2i03 s TYR 456 CO 0.00 -0.86 0.05 0.71 0.64 0.00 0.00 175.55 176.10 2i03 s TYR 457 N 1.61 2.83 0.05 4.97 1.51 -0.84 -0.69 117.35 126.79 2i03 s TYR 457 Ca 0.11 -0.18 -0.08 0.00 -1.01 0.00 0.00 57.07 55.91 2i03 s TYR 457 Cb -0.18 -1.28 -0.00 0.00 -0.11 0.00 0.00 41.96 40.39 2i03 s TYR 457 CO -0.25 0.58 0.17 -1.54 -1.11 0.00 0.00 175.55 173.40 2i03 s SER 458 N -3.62 0.09 0.10 2.29 1.04 -0.87 -4.56 113.70 108.17 2i03 s SER 458 Ca 0.31 -0.48 0.02 0.00 0.48 0.00 0.00 55.95 56.28 2i03 s SER 458 Cb -0.07 0.29 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 2i03 s SER 458 CO 0.21 -0.59 -0.07 0.54 0.98 0.00 0.00 173.24 174.31 2i03 s VAL 459 N -2.93 0.74 -0.20 5.02 0.11 -1.26 -1.56 120.40 120.33 2i03 s VAL 459 Ca -0.02 -1.88 -0.05 0.00 -2.93 0.00 0.00 61.98 57.10 2i03 s VAL 459 Cb 0.01 -1.61 0.07 0.00 -1.53 0.00 0.00 36.38 33.31 2i03 s VAL 459 CO -0.06 -0.81 0.10 -0.55 -3.33 0.00 0.00 175.10 170.45 2i03 s SER 460 N -2.93 2.59 0.47 3.54 0.15 -0.72 -4.98 113.70 111.82 2i03 s SER 460 Ca 0.11 -0.75 -0.03 0.00 0.70 0.00 0.00 55.95 55.97 2i03 s SER 460 Cb 0.04 -0.26 -0.02 0.00 -1.71 0.00 0.00 66.02 64.07 2i03 s SER 460 CO -0.04 -0.37 0.73 -0.36 1.20 0.00 0.00 173.24 174.41 2i03 s PHE 461 N 2.13 3.40 0.65 3.44 0.40 -1.26 -0.86 117.98 125.88 2i03 s PHE 461 Ca 0.04 0.53 -0.07 0.00 -0.60 0.00 0.00 56.93 56.83 2i03 s PHE 461 Cb -0.16 -2.32 0.03 0.00 0.51 0.00 0.00 43.02 41.08 2i03 s PHE 461 CO -0.15 -0.34 0.97 -1.54 0.70 0.00 0.00 175.22 174.86 2i03 s SER 462 N -4.16 5.21 0.17 1.36 1.04 -0.47 -4.88 113.70 111.97 2i03 s SER 462 Ca 0.48 0.63 -0.10 0.00 0.48 0.00 0.00 55.95 57.43 2i03 s SER 462 Cb -0.10 -1.44 0.22 0.00 0.10 0.00 0.00 66.02 64.79 2i03 s SER 462 CO 0.41 -1.34 1.07 0.29 0.98 0.00 0.00 173.24 174.66 2i03 n LYS 463 N -2.78 -0.13 -0.64 4.02 4.76 -1.09 0.15 118.16 122.46 2i03 n LYS 463 Ca 0.06 1.06 0.03 0.00 -2.87 0.00 0.00 58.31 56.60 2i03 n LYS 463 Cb 0.59 -1.58 0.26 0.00 -1.84 0.00 0.00 35.03 32.45 2i03 n LYS 463 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2i03 n GLU 464 N -5.05 2.88 -2.90 1.97 -0.58 -1.26 -4.94 120.64 110.75 2i03 n GLU 464 Ca 0.08 -2.97 -0.22 0.00 -0.42 0.00 0.00 57.16 53.64 2i03 n GLU 464 Cb 0.30 -1.92 0.03 0.00 -0.57 0.00 0.00 31.44 29.28 2i03 n GLU 464 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2i03 n ALA 465 N -0.56 -0.89 0.07 0.62 0.00 0.12 -4.88 120.51 115.00 2i03 n ALA 465 Ca 0.28 0.27 -0.16 0.00 0.00 0.00 0.00 53.44 53.82 2i03 n ALA 465 Cb 1.02 -3.57 -0.08 0.00 0.00 0.00 0.00 19.45 16.82 2i03 n ALA 465 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2i03 h LYS 466 N -1.15 0.47 -4.84 0.00 3.64 -1.80 -3.42 116.57 109.47 2i03 h LYS 466 Ca -0.51 -0.55 -0.29 0.00 -1.27 0.00 0.00 60.65 58.03 2i03 h LYS 466 Cb 1.36 0.17 -0.15 0.00 -0.41 0.00 0.00 32.23 33.20 2i03 h LYS 466 CO 0.56 1.20 -0.68 0.71 -2.27 0.00 0.00 179.45 178.96 2i03 s TYR 467 N -3.16 1.16 -0.13 1.91 2.02 -1.26 -1.47 117.35 116.42 2i03 s TYR 467 Ca -0.07 -0.93 -0.13 0.00 -0.37 0.00 0.00 57.07 55.57 2i03 s TYR 467 Cb 0.08 -0.65 0.04 0.00 -0.40 0.00 0.00 41.96 41.02 2i03 s TYR 467 CO 0.89 -0.12 0.37 1.52 -1.57 0.00 0.00 175.55 176.64 2i03 s TYR 468 N -3.56 -0.40 -0.13 2.71 1.13 -0.89 -1.37 117.35 114.85 2i03 s TYR 468 Ca 0.19 0.96 -0.07 0.00 -1.41 0.00 0.00 57.07 56.75 2i03 s TYR 468 Cb 0.05 0.14 -0.04 0.00 -1.10 0.00 0.00 41.96 41.01 2i03 s TYR 468 CO 0.01 -0.21 0.12 -1.14 -2.51 0.00 0.00 175.55 171.82 2i03 s GLN 469 N 0.10 3.50 -0.06 -3.49 0.74 -0.04 -1.16 119.66 119.25 2i03 s GLN 469 Ca -0.01 -0.17 0.03 0.00 0.05 0.00 0.00 55.36 55.26 2i03 s GLN 469 Cb -0.03 -3.18 -0.02 0.00 1.10 0.00 0.00 33.01 30.88 2i03 s GLN 469 CO 0.01 0.70 -0.14 -0.51 -0.55 0.00 0.00 175.29 174.80 2i03 s LEU 470 N -0.81 2.74 -0.20 3.68 1.43 0.07 -1.75 118.68 123.83 2i03 s LEU 470 Ca 0.14 -0.21 0.01 0.00 -1.03 0.00 0.00 54.13 53.04 2i03 s LEU 470 Cb -0.12 -1.56 0.05 0.00 0.03 0.00 0.00 46.19 44.58 2i03 s LEU 470 CO 0.03 0.33 -0.10 -0.13 0.23 0.00 0.00 176.35 176.71 2i03 s ARG 471 N -0.62 1.97 -0.22 1.70 0.52 -0.60 -1.59 118.95 120.11 2i03 s ARG 471 Ca 0.09 -0.87 -0.16 0.00 -0.52 0.00 0.00 55.73 54.27 2i03 s ARG 471 Cb -0.11 -2.45 -0.04 0.00 0.52 0.00 0.00 34.95 32.87 2i03 s ARG 471 CO 0.01 -0.45 0.40 0.00 0.02 0.00 0.00 175.30 175.27 2i03 n SER 473 N 4.66 2.94 0.00 0.00 3.41 0.13 -1.82 113.62 122.94 2i03 n SER 473 Ca -0.08 -1.96 0.00 0.00 -0.26 0.00 0.00 58.87 56.57 2i03 n SER 473 Cb 0.51 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 2i03 n SER 473 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2i03 n GLY 474 N 0.63 0.64 0.00 5.00 0.00 -1.25 0.06 105.19 110.27 2i03 n GLY 474 Ca 0.12 -1.15 0.11 0.00 0.00 0.00 0.00 46.02 45.10 2i03 n GLY 474 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2i03 n PRO 475 N -0.84 0.00 -2.30 1.61 -0.04 -0.41 -0.52 135.00 132.50 2i03 n PRO 475 Ca 0.00 0.11 -0.17 0.00 -0.04 0.00 0.00 63.50 63.39 2i03 n PRO 475 Cb 0.00 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.04 2i03 n PRO 475 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2i03 n GLY 476 N 0.86 1.10 3.70 0.55 0.00 -0.70 -4.49 105.19 106.21 2i03 n GLY 476 Ca 0.05 -2.08 -0.44 0.00 0.00 0.00 0.00 46.02 43.56 2i03 n GLY 476 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2i03 n LEU 477 N 0.00 3.64 -4.53 0.99 4.77 -1.26 -4.62 117.00 115.99 2i03 n LEU 477 Ca 0.13 1.12 -0.48 0.00 -0.03 0.00 0.00 56.01 56.76 2i03 n LEU 477 Cb 0.47 -1.50 -0.03 0.00 -2.33 0.00 0.00 43.42 40.03 2i03 n LEU 477 CO 0.31 -0.15 0.47 -2.65 -1.33 0.00 0.00 177.39 174.04 2i03 n PRO 478 N 2.57 0.85 -4.13 3.23 -0.02 -1.26 -4.83 135.00 131.40 2i03 n PRO 478 Ca 0.12 0.30 -0.25 0.00 -2.02 0.00 0.00 63.50 61.65 2i03 n PRO 478 Cb 0.33 -1.62 -0.17 0.00 -0.02 0.00 0.00 33.50 32.02 2i03 n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2i03 s LEU 479 N 1.15 1.32 -0.25 2.45 2.96 -0.75 -4.15 118.68 121.41 2i03 s LEU 479 Ca 0.67 -0.28 -0.06 0.00 -0.22 0.00 0.00 54.13 54.24 2i03 s LEU 479 Cb -0.85 -0.79 -0.01 0.00 0.50 0.00 0.00 46.19 45.04 2i03 s LEU 479 CO 0.56 -0.07 0.03 -0.31 -1.32 0.00 0.00 176.35 175.25 2i03 s TYR 480 N 1.33 3.06 0.18 5.38 1.51 0.17 -1.36 117.35 127.62 2i03 s TYR 480 Ca -0.02 -0.76 0.08 0.00 -1.01 0.00 0.00 57.07 55.35 2i03 s TYR 480 Cb -0.14 -2.20 -0.04 0.00 -0.11 0.00 0.00 41.96 39.47 2i03 s TYR 480 CO -0.04 -0.49 -0.15 0.95 -1.11 0.00 0.00 175.55 174.71 2i03 s THR 481 N 1.53 1.70 0.03 -0.71 -4.23 -0.62 -0.03 115.64 113.31 2i03 s THR 481 Ca 0.05 -2.08 0.07 0.00 -1.18 0.00 0.00 61.69 58.55 2i03 s THR 481 Cb -0.15 -1.93 -0.03 0.00 1.34 0.00 0.00 72.50 71.72 2i03 s THR 481 CO 0.01 -0.51 -0.18 -0.22 -0.54 0.00 0.00 174.62 173.18 2i03 s LEU 482 N -3.05 2.60 0.14 4.79 0.20 -0.44 -0.75 118.68 122.17 2i03 s LEU 482 Ca 0.19 -0.40 -0.01 0.00 0.69 0.00 0.00 54.13 54.60 2i03 s LEU 482 Cb -0.02 -1.52 -0.04 0.00 -0.43 0.00 0.00 46.19 44.18 2i03 s LEU 482 CO 0.06 0.27 0.06 -1.00 -0.29 0.00 0.00 176.35 175.46 2i03 s HIS 483 N -0.89 0.94 -0.22 5.38 3.76 -0.31 -0.84 115.29 123.11 2i03 s HIS 483 Ca 0.14 -1.25 -0.04 0.00 -0.15 0.00 0.00 55.06 53.77 2i03 s HIS 483 Cb -0.10 -0.51 -0.01 0.00 1.11 0.00 0.00 32.58 33.07 2i03 s HIS 483 CO 0.04 -0.52 -0.04 -1.54 -0.85 0.00 0.00 174.74 171.83 2i03 s SER 484 N -3.08 4.33 0.15 1.40 1.04 -0.07 -2.09 113.70 115.38 2i03 s SER 484 Ca 0.27 -0.38 -0.22 0.00 0.48 0.00 0.00 55.95 56.09 2i03 s SER 484 Cb 0.07 -1.74 0.02 0.00 0.10 0.00 0.00 66.02 64.47 2i03 s SER 484 CO 0.04 -0.01 1.64 0.28 0.98 0.00 0.00 173.24 176.16 2i03 h SER 485 N 8.07 -0.71 -0.18 7.02 0.02 -1.51 0.36 113.55 126.62 2i03 h SER 485 Ca -0.41 0.13 0.02 0.00 -0.84 0.00 0.00 61.79 60.68 2i03 h SER 485 Cb 1.16 0.34 -0.02 0.00 0.14 0.00 0.00 62.40 64.02 2i03 h SER 485 CO 0.60 -0.26 -0.10 0.55 -1.14 0.00 0.00 176.83 176.47 2i03 n VAL 486 N -5.36 -0.12 -0.81 2.27 3.14 -1.26 -1.65 118.33 114.53 2i03 n VAL 486 Ca -0.01 0.59 0.04 0.00 -2.96 0.00 0.00 64.34 62.00 2i03 n VAL 486 Cb 0.28 -0.75 0.06 0.00 -1.06 0.00 0.00 33.84 32.37 2i03 n VAL 486 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 2i03 n ASN 487 N -3.57 1.68 -2.63 6.55 5.03 -1.22 -4.98 115.26 116.13 2i03 n ASN 487 Ca 0.00 -2.35 -0.21 0.00 0.87 0.00 0.00 54.58 52.89 2i03 n ASN 487 Cb 0.05 -0.21 0.02 0.00 -1.02 0.00 0.00 39.78 38.62 2i03 n ASN 487 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 2i03 n ASP 488 N -0.78 -5.85 -4.74 6.41 10.43 0.12 -4.94 116.55 117.20 2i03 n ASP 488 Ca 0.07 -0.17 -0.41 0.00 2.57 0.00 0.00 54.79 56.85 2i03 n ASP 488 Cb 0.50 -4.75 -0.03 0.00 1.84 0.00 0.00 41.12 38.67 2i03 n ASP 488 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 2i03 s LYS 489 N -5.37 4.49 -0.28 -1.24 1.02 -0.92 -4.74 119.74 112.69 2i03 s LYS 489 Ca 0.17 1.92 -0.29 0.00 0.02 0.00 0.00 55.97 57.78 2i03 s LYS 489 Cb -0.07 -3.21 0.00 0.00 -0.52 0.00 0.00 37.83 34.03 2i03 s LYS 489 CO 0.21 -0.07 1.20 0.20 -0.92 0.00 0.00 175.35 175.97 2i03 s GLY 490 N -0.07 1.51 -0.15 -3.33 0.00 -1.26 -0.89 107.32 103.13 2i03 s GLY 490 Ca 0.52 0.12 -0.26 0.00 0.00 0.00 0.00 44.72 45.10 2i03 s GLY 490 CO 0.39 2.43 0.63 1.41 0.00 0.00 0.00 173.10 177.96 2i03 h LEU 491 N 10.29 0.06 -7.16 0.66 3.38 -1.32 -3.48 115.31 117.74 2i03 h LEU 491 Ca -0.24 -0.87 0.34 0.00 0.09 0.00 0.00 57.88 57.21 2i03 h LEU 491 Cb 1.08 -0.02 -0.13 0.00 0.09 0.00 0.00 40.66 41.68 2i03 h LEU 491 CO 1.02 1.19 0.87 0.00 0.09 0.00 0.00 178.44 181.61 2i03 s ARG 492 N -2.29 0.30 -0.32 1.13 1.70 -1.16 -5.01 118.95 113.31 2i03 s ARG 492 Ca -0.21 -0.16 -0.14 0.00 -0.47 0.00 0.00 55.73 54.74 2i03 s ARG 492 Cb -0.00 0.10 -0.02 0.00 -0.57 0.00 0.00 34.95 34.46 2i03 s ARG 492 CO 0.68 -0.14 0.33 0.08 -1.08 0.00 0.00 175.30 175.17 2i03 s VAL 493 N -2.32 5.20 0.02 4.99 1.01 -1.26 -1.33 120.40 126.71 2i03 s VAL 493 Ca 0.14 0.15 0.10 0.00 0.00 0.00 0.00 61.98 62.38 2i03 s VAL 493 Cb 0.05 -3.74 -0.19 0.00 0.00 0.00 0.00 36.38 32.50 2i03 s VAL 493 CO -0.05 0.02 1.02 -0.07 0.00 0.00 0.00 175.10 176.02 2i03 h LEU 494 N 8.64 0.00 -6.72 3.92 3.38 -0.79 -3.47 115.31 120.27 2i03 h LEU 494 Ca -0.31 0.00 0.14 0.00 0.09 0.00 0.00 57.88 57.80 2i03 h LEU 494 Cb 1.16 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.67 2i03 h LEU 494 CO 0.66 0.93 0.18 -0.70 0.09 0.00 0.00 178.44 179.59 2i03 s GLU 495 N -2.70 0.38 0.00 1.13 2.56 -0.80 -4.97 118.70 114.30 2i03 s GLU 495 Ca -0.01 0.88 0.06 0.00 0.00 0.00 0.00 54.97 55.90 2i03 s GLU 495 Cb 0.09 0.44 0.07 0.00 2.00 0.00 0.00 34.13 36.73 2i03 s GLU 495 CO 0.82 -0.12 0.80 -0.40 -0.56 0.00 0.00 175.26 175.79 2i03 n ASP 496 N 4.79 1.73 -2.18 -1.70 5.68 -1.26 0.42 116.55 124.03 2i03 n ASP 496 Ca -0.12 -1.44 -0.21 0.00 -0.50 0.00 0.00 54.79 52.53 2i03 n ASP 496 Cb 0.53 -0.03 -0.03 0.00 -1.14 0.00 0.00 41.12 40.45 2i03 n ASP 496 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2i03 n ASN 497 N 0.23 -5.83 -0.15 -1.12 3.02 -1.26 -4.81 115.26 105.34 2i03 n ASN 497 Ca 0.04 0.12 0.20 0.00 -0.03 0.00 0.00 54.58 54.91 2i03 n ASN 497 Cb 0.19 -4.92 0.59 0.00 -0.61 0.00 0.00 39.78 35.03 2i03 n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2i03 h SER 498 N 0.00 0.23 0.09 6.41 4.64 -1.94 -1.67 113.55 121.31 2i03 h SER 498 Ca -0.48 0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2i03 h SER 498 Cb 1.37 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 2i03 h SER 498 CO 0.60 0.11 -0.04 0.00 -0.87 0.00 0.00 176.83 176.62 2i03 h ALA 499 N 1.64 -0.12 -0.86 5.18 0.00 -2.00 -2.43 119.26 120.67 2i03 h ALA 499 Ca 0.38 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.16 2i03 h ALA 499 Cb 1.14 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 2i03 h ALA 499 CO -0.09 -0.41 0.56 1.25 0.00 0.00 0.00 179.25 180.56 2i03 h LEU 500 N -0.43 0.94 -1.00 0.00 5.85 -1.68 -2.26 115.31 116.73 2i03 h LEU 500 Ca -0.01 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.76 2i03 h LEU 500 Cb 0.36 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 41.11 2i03 h LEU 500 CO 0.02 0.65 0.65 -0.78 -0.34 0.00 0.00 178.44 178.64 2i03 h ASP 501 N 1.10 1.04 -0.59 1.25 3.58 -1.25 0.23 116.42 121.78 2i03 h ASP 501 Ca 0.34 0.01 -0.10 0.00 0.42 0.00 0.00 57.03 57.69 2i03 h ASP 501 Cb -0.03 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 40.79 2i03 h ASP 501 CO -0.11 0.66 -0.04 0.11 -2.88 0.00 0.00 179.24 176.99 2i03 h LYS 502 N 1.18 1.06 -0.61 0.28 1.79 -0.92 -2.81 116.57 116.54 2i03 h LYS 502 Ca 0.43 -0.36 -0.06 0.00 -2.18 0.00 0.00 60.65 58.47 2i03 h LYS 502 Cb 0.16 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 30.69 2i03 h LYS 502 CO -0.17 1.06 0.13 0.52 -1.08 0.00 0.00 179.45 179.91 2i03 h MET 503 N 0.96 0.97 0.00 3.15 2.86 -0.68 -3.07 114.93 119.12 2i03 h MET 503 Ca 0.16 -0.23 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 2i03 h MET 503 Cb 0.61 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.14 2i03 h MET 503 CO 0.04 0.88 0.00 1.28 1.06 0.00 0.00 176.91 180.17 2i03 n LEU 504 N -4.24 0.00 -0.13 1.22 4.77 0.68 -2.77 117.00 116.53 2i03 n LEU 504 Ca 0.04 0.19 0.13 0.00 -0.03 0.00 0.00 56.01 56.34 2i03 n LEU 504 Cb 0.26 -0.19 0.40 0.00 -2.33 0.00 0.00 43.42 41.56 2i03 n LEU 504 CO 0.41 -0.07 0.66 0.00 -1.33 0.00 0.00 177.39 177.07 2i03 n GLN 505 N -1.19 0.52 -0.13 3.23 10.64 -1.16 -3.26 117.38 126.03 2i03 n GLN 505 Ca 0.11 -0.27 0.12 0.00 -1.83 0.00 0.00 57.00 55.13 2i03 n GLN 505 Cb 0.13 -1.49 0.25 0.00 -0.86 0.00 0.00 30.24 28.27 2i03 n GLN 505 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2i03 n ASN 506 N -1.01 2.85 -4.08 2.61 3.02 -1.12 -4.91 115.26 112.62 2i03 n ASN 506 Ca 0.10 -1.90 -0.20 0.00 -0.03 0.00 0.00 54.58 52.55 2i03 n ASN 506 Cb 0.33 -0.17 -0.15 0.00 -0.61 0.00 0.00 39.78 39.18 2i03 n ASN 506 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2i03 s VAL 507 N -1.66 0.95 -0.70 2.41 0.11 -1.20 -3.91 120.40 116.40 2i03 s VAL 507 Ca 0.36 -0.60 -0.27 0.00 -2.93 0.00 0.00 61.98 58.54 2i03 s VAL 507 Cb 0.21 -0.81 0.02 0.00 -1.53 0.00 0.00 36.38 34.27 2i03 s VAL 507 CO 0.30 0.21 1.37 -1.10 -3.33 0.00 0.00 175.10 172.54 2i03 s GLN 508 N -0.45 3.14 0.14 1.54 -0.21 -0.54 -4.98 119.66 118.31 2i03 s GLN 508 Ca 0.04 -0.05 -0.13 0.00 0.02 0.00 0.00 55.36 55.24 2i03 s GLN 508 Cb -0.05 -4.20 -0.07 0.00 1.00 0.00 0.00 33.01 29.69 2i03 s GLN 508 CO -0.00 -2.19 0.52 -1.64 -2.12 0.00 0.00 175.29 169.86 2i03 s MET 509 N 5.86 3.92 0.75 2.91 -1.94 -1.26 -4.13 119.30 125.41 2i03 s MET 509 Ca 0.41 0.41 -0.12 0.00 -1.71 0.00 0.00 55.69 54.68 2i03 s MET 509 Cb -0.09 -2.91 0.04 0.00 2.01 0.00 0.00 34.83 33.89 2i03 s MET 509 CO 0.17 0.47 1.11 -1.25 -0.01 0.00 0.00 175.02 175.52 2i03 s PRO 510 N -2.06 2.49 0.32 2.03 0.04 -1.26 -4.51 135.00 132.06 2i03 s PRO 510 Ca 0.38 0.43 0.08 0.00 0.04 0.00 0.00 61.00 61.93 2i03 s PRO 510 Cb -0.14 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 2i03 s PRO 510 CO 0.19 -1.29 0.21 -1.54 0.04 0.00 0.00 177.00 174.61 2i03 s SER 511 N -4.29 5.03 -0.04 6.66 1.04 0.33 -4.90 113.70 117.53 2i03 s SER 511 Ca 0.60 -0.59 0.06 0.00 0.48 0.00 0.00 55.95 56.50 2i03 s SER 511 Cb -0.12 -0.91 -0.01 0.00 0.10 0.00 0.00 66.02 65.07 2i03 s SER 511 CO 0.52 -0.28 -0.24 -0.75 0.98 0.00 0.00 173.24 173.47 2i03 s LYS 512 N -3.90 2.30 -0.15 4.02 2.20 -1.26 0.13 119.74 123.07 2i03 s LYS 512 Ca 0.38 -0.87 0.02 0.00 -0.36 0.00 0.00 55.97 55.14 2i03 s LYS 512 Cb -0.05 -2.03 0.01 0.00 -1.51 0.00 0.00 37.83 34.26 2i03 s LYS 512 CO 0.24 0.42 -0.21 0.21 -0.36 0.00 0.00 175.35 175.65 2i03 s LYS 513 N -0.28 2.97 -0.23 4.03 2.20 0.11 -4.95 119.74 123.59 2i03 s LYS 513 Ca 0.01 -0.84 -0.01 0.00 -0.36 0.00 0.00 55.97 54.77 2i03 s LYS 513 Cb -0.12 -2.44 0.02 0.00 -1.51 0.00 0.00 37.83 33.78 2i03 s LYS 513 CO 0.02 -0.06 -0.09 -1.17 -0.36 0.00 0.00 175.35 173.69 2i03 s LEU 514 N 0.93 2.92 0.00 5.43 0.20 -1.26 -0.10 118.68 126.79 2i03 s LEU 514 Ca -0.04 -0.75 0.00 0.00 0.69 0.00 0.00 54.13 54.03 2i03 s LEU 514 Cb -0.15 -1.64 0.00 0.00 -0.43 0.00 0.00 46.19 43.97 2i03 s LEU 514 CO -0.04 -0.08 0.00 -0.67 -0.29 0.00 0.00 176.35 175.27 2i03 n ASP 515 N 4.68 0.00 -3.87 3.68 4.64 -0.62 -5.01 116.55 120.04 2i03 n ASP 515 Ca -0.18 -0.36 -0.09 0.00 -1.38 0.00 0.00 54.79 52.78 2i03 n ASP 515 Cb 0.48 0.00 -0.07 0.00 -1.04 0.00 0.00 41.12 40.49 2i03 n ASP 515 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 2i03 s PHE 516 N -3.89 0.20 0.38 -0.67 -0.71 -1.26 -0.56 117.98 111.46 2i03 s PHE 516 Ca 0.00 -0.60 0.05 0.00 -1.04 0.00 0.00 56.93 55.35 2i03 s PHE 516 Cb 0.00 -0.02 -0.07 0.00 -1.21 0.00 0.00 43.02 41.71 2i03 s PHE 516 CO 0.00 -0.62 0.03 0.96 -1.34 0.00 0.00 175.22 174.25 2i03 s ILE 517 N -3.89 1.63 -0.21 -4.49 -4.36 -0.63 -4.96 121.20 104.29 2i03 s ILE 517 Ca 0.09 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.48 2i03 s ILE 517 Cb 0.04 -2.89 0.02 0.00 1.25 0.00 0.00 42.46 40.88 2i03 s ILE 517 CO -0.07 0.00 -0.14 -0.63 0.24 0.00 0.00 174.94 174.33 2i03 s ILE 518 N -2.97 2.39 -0.16 8.37 1.01 -1.26 -1.37 121.20 127.21 2i03 s ILE 518 Ca 0.35 -0.98 -0.02 0.00 0.00 0.00 0.00 60.65 60.00 2i03 s ILE 518 Cb 0.09 -2.10 -0.02 0.00 0.01 0.00 0.00 42.46 40.44 2i03 s ILE 518 CO 0.17 0.40 -0.08 -0.76 0.00 0.00 0.00 174.94 174.67 2i03 s LEU 519 N 1.30 2.96 0.00 2.97 1.43 0.13 -4.84 118.68 122.63 2i03 s LEU 519 Ca 0.03 -0.26 0.00 0.00 -1.03 0.00 0.00 54.13 52.87 2i03 s LEU 519 Cb -0.15 -1.70 0.00 0.00 0.03 0.00 0.00 46.19 44.37 2i03 s LEU 519 CO -0.09 0.13 0.00 -0.46 0.23 0.00 0.00 176.35 176.16 2i03 n ASN 520 N 3.76 0.00 0.00 2.29 6.94 -1.26 -0.41 115.26 126.58 2i03 n ASN 520 Ca -0.18 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.38 2i03 n ASN 520 Cb 0.52 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.94 2i03 n ASN 520 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2i03 n GLU 521 N -0.25 0.00 -4.03 -3.83 -0.58 -1.26 -5.04 120.64 105.65 2i03 n GLU 521 Ca 0.00 0.00 -0.25 0.00 -0.42 0.00 0.00 57.16 56.49 2i03 n GLU 521 Cb 0.00 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 30.83 2i03 n GLU 521 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2i03 s THR 522 N -0.98 4.85 -0.28 2.62 2.01 0.45 -5.10 115.64 119.21 2i03 s THR 522 Ca 0.00 -0.95 -0.09 0.00 0.31 0.00 0.00 61.69 60.96 2i03 s THR 522 Cb 0.00 -3.50 -0.02 0.00 0.01 0.00 0.00 72.50 68.98 2i03 s THR 522 CO 0.00 -0.14 0.12 -1.59 -0.69 0.00 0.00 174.62 172.33 2i03 s LYS 523 N -3.27 3.55 -0.16 4.92 -2.85 -1.26 0.20 119.74 120.87 2i03 s LYS 523 Ca 0.33 -0.56 -0.04 0.00 -1.00 0.00 0.00 55.97 54.69 2i03 s LYS 523 Cb -0.10 -3.47 -0.03 0.00 -2.06 0.00 0.00 37.83 32.16 2i03 s LYS 523 CO 0.26 -0.29 -0.02 -0.06 0.10 0.00 0.00 175.35 175.34 2i03 s PHE 524 N 1.63 3.07 0.46 1.78 0.40 -0.47 -4.92 117.98 119.93 2i03 s PHE 524 Ca 0.06 -0.22 -0.06 0.00 -0.60 0.00 0.00 56.93 56.11 2i03 s PHE 524 Cb -0.16 -1.98 -0.04 0.00 0.51 0.00 0.00 43.02 41.35 2i03 s PHE 524 CO 0.06 0.01 0.77 -1.58 0.70 0.00 0.00 175.22 175.17 2i03 s TRP 525 N 0.35 3.55 0.25 0.36 0.52 -1.26 -1.61 118.94 121.10 2i03 s TRP 525 Ca -0.03 0.83 -0.12 0.00 0.02 0.00 0.00 56.10 56.80 2i03 s TRP 525 Cb -0.14 -2.30 -0.01 0.00 -1.15 0.00 0.00 33.47 29.87 2i03 s TRP 525 CO 0.02 -0.23 0.47 1.52 0.02 0.00 0.00 176.95 178.76 2i03 s TYR 526 N -2.65 0.40 0.01 -1.98 -0.85 0.27 -1.29 117.35 111.26 2i03 s TYR 526 Ca 0.48 -0.75 -0.06 0.00 -0.52 0.00 0.00 57.07 56.22 2i03 s TYR 526 Cb -0.10 0.17 -0.00 0.00 0.38 0.00 0.00 41.96 42.40 2i03 s TYR 526 CO 0.42 -0.99 0.10 1.14 -1.52 0.00 0.00 175.55 174.70 2i03 s GLN 527 N -3.99 0.45 -0.03 -3.49 -2.07 -0.58 -1.59 119.66 108.35 2i03 s GLN 527 Ca 0.23 -0.47 0.01 0.00 -1.82 0.00 0.00 55.36 53.31 2i03 s GLN 527 Cb -0.00 0.18 0.02 0.00 -1.09 0.00 0.00 33.01 32.11 2i03 s GLN 527 CO 0.09 -0.10 -0.03 -1.64 -1.32 0.00 0.00 175.29 172.30 2i03 s MET 528 N -1.45 0.49 -0.40 9.60 -1.94 0.85 -1.31 119.30 125.14 2i03 s MET 528 Ca -0.15 -0.05 -0.18 0.00 -1.71 0.00 0.00 55.69 53.61 2i03 s MET 528 Cb -0.08 -0.56 0.01 0.00 2.01 0.00 0.00 34.83 36.21 2i03 s MET 528 CO 0.01 -0.05 0.46 0.42 -0.01 0.00 0.00 175.02 175.85 2i03 s ILE 529 N 0.66 5.05 -0.12 2.53 -1.09 -0.35 0.04 121.20 127.92 2i03 s ILE 529 Ca -0.07 -0.11 -0.09 0.00 -2.23 0.00 0.00 60.65 58.15 2i03 s ILE 529 Cb -0.11 -4.01 -0.04 0.00 -1.58 0.00 0.00 42.46 36.72 2i03 s ILE 529 CO -0.01 -0.36 0.18 -0.76 -1.23 0.00 0.00 174.94 172.77 2i03 s LEU 530 N 2.25 4.37 0.87 2.97 1.43 0.35 -2.98 118.68 127.94 2i03 s LEU 530 Ca 0.14 0.50 -0.12 0.00 -1.03 0.00 0.00 54.13 53.62 2i03 s LEU 530 Cb -0.16 -2.15 0.09 0.00 0.03 0.00 0.00 46.19 44.00 2i03 s LEU 530 CO 0.14 0.35 1.00 -2.65 0.23 0.00 0.00 176.35 175.42 2i03 n PRO 531 N 2.27 -0.15 -1.73 1.29 -0.02 -1.26 -0.51 135.00 134.89 2i03 n PRO 531 Ca -0.18 0.03 -0.38 0.00 -2.02 0.00 0.00 63.50 60.94 2i03 n PRO 531 Cb 0.54 -2.28 0.04 0.00 -0.02 0.00 0.00 33.50 31.79 2i03 n PRO 531 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2i03 n PRO 532 N -3.24 1.58 -3.77 0.52 -0.02 -1.26 -2.64 135.00 126.18 2i03 n PRO 532 Ca 0.12 0.59 -0.25 0.00 -2.02 0.00 0.00 63.50 61.93 2i03 n PRO 532 Cb 0.52 -2.53 0.04 0.00 -0.02 0.00 0.00 33.50 31.50 2i03 n PRO 532 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2i03 n HIS 533 N -1.14 -2.21 -1.67 6.00 8.25 -1.26 -4.82 115.22 118.37 2i03 n HIS 533 Ca 0.11 0.90 -0.48 0.00 -0.26 0.00 0.00 57.72 57.99 2i03 n HIS 533 Cb 0.45 -4.32 -0.05 0.00 1.12 0.00 0.00 29.99 27.19 2i03 n HIS 533 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2i03 n PHE 534 N -4.53 2.26 -3.78 4.41 7.35 -1.08 -4.94 117.46 117.15 2i03 n PHE 534 Ca -0.12 0.17 -0.36 0.00 -0.76 0.00 0.00 57.45 56.38 2i03 n PHE 534 Cb 0.60 -2.59 -0.11 0.00 0.35 0.00 0.00 39.48 37.73 2i03 n PHE 534 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2i03 s ASP 535 N 2.34 5.23 0.00 -2.13 -1.08 -1.26 -4.96 116.67 114.81 2i03 s ASP 535 Ca 0.86 -2.18 0.00 0.00 -0.52 0.00 0.00 52.55 50.71 2i03 s ASP 535 Cb -0.71 -1.82 0.00 0.00 -1.46 0.00 0.00 42.92 38.93 2i03 s ASP 535 CO 0.45 -0.51 0.68 2.29 0.52 0.00 0.00 175.17 178.60 2i03 n LYS 536 N 4.39 0.00 0.02 4.34 2.85 -1.26 -0.97 118.16 127.52 2i03 n LYS 536 Ca -0.00 0.23 -0.02 0.00 -1.05 0.00 0.00 58.31 57.47 2i03 n LYS 536 Cb 0.41 -1.58 -0.10 0.00 -0.65 0.00 0.00 35.03 33.11 2i03 n LYS 536 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2i03 n SER 537 N -1.18 0.82 -4.90 -5.58 3.41 -1.26 -3.83 113.62 101.10 2i03 n SER 537 Ca 0.00 0.37 -0.29 0.00 -0.26 0.00 0.00 58.87 58.69 2i03 n SER 537 Cb 0.08 0.18 0.09 0.00 -0.26 0.00 0.00 64.21 64.30 2i03 n SER 537 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2i03 s LYS 538 N -2.85 2.00 -0.32 4.33 1.02 -0.15 -4.89 119.74 118.88 2i03 s LYS 538 Ca -0.04 0.11 -0.01 0.00 0.02 0.00 0.00 55.97 56.05 2i03 s LYS 538 Cb 0.09 -1.96 0.07 0.00 -0.52 0.00 0.00 37.83 35.50 2i03 s LYS 538 CO 0.82 -1.57 0.04 0.15 -0.92 0.00 0.00 175.35 173.87 2i03 s LYS 539 N -5.56 2.21 0.32 1.68 1.02 -1.26 -4.18 119.74 113.97 2i03 s LYS 539 Ca 0.62 -1.46 -0.10 0.00 0.02 0.00 0.00 55.97 55.05 2i03 s LYS 539 Cb -0.11 -3.24 -0.07 0.00 -0.52 0.00 0.00 37.83 33.90 2i03 s LYS 539 CO 0.49 -0.75 0.66 0.71 -0.92 0.00 0.00 175.35 175.54 2i03 s TYR 540 N 1.17 3.44 0.42 3.18 1.51 0.04 -4.33 117.35 122.78 2i03 s TYR 540 Ca -0.01 0.94 -0.22 0.00 -1.01 0.00 0.00 57.07 56.77 2i03 s TYR 540 Cb -0.20 -2.33 -0.10 0.00 -0.11 0.00 0.00 41.96 39.21 2i03 s TYR 540 CO -0.03 0.08 0.98 -2.14 -1.11 0.00 0.00 175.55 173.33 2i03 s PRO 541 N -3.40 4.20 -0.09 -1.71 0.02 -1.26 -0.88 135.00 131.87 2i03 s PRO 541 Ca 0.49 1.26 0.04 0.00 0.02 0.00 0.00 61.00 62.81 2i03 s PRO 541 Cb -0.11 -2.32 0.00 0.00 0.02 0.00 0.00 34.50 32.09 2i03 s PRO 541 CO 0.26 -0.07 -0.22 -1.17 -0.33 0.00 0.00 177.00 175.47 2i03 s LEU 542 N -2.97 2.02 -0.22 -5.54 0.20 0.74 -2.28 118.68 110.62 2i03 s LEU 542 Ca 0.60 -0.51 -0.04 0.00 0.69 0.00 0.00 54.13 54.87 2i03 s LEU 542 Cb -0.14 -1.31 -0.01 0.00 -0.43 0.00 0.00 46.19 44.31 2i03 s LEU 542 CO 0.18 0.15 -0.03 -0.22 -0.29 0.00 0.00 176.35 176.14 2i03 s LEU 543 N 0.31 2.96 -0.26 -0.68 1.98 0.69 0.13 118.68 123.81 2i03 s LEU 543 Ca -0.16 -0.40 -0.20 0.00 -2.89 0.00 0.00 54.13 50.48 2i03 s LEU 543 Cb -0.17 -1.75 -0.02 0.00 0.66 0.00 0.00 46.19 44.91 2i03 s LEU 543 CO 0.07 -0.03 0.61 -0.22 -1.89 0.00 0.00 176.35 174.89 2i03 s LEU 544 N 1.48 4.06 -0.37 -0.68 2.96 0.18 -0.94 118.68 125.37 2i03 s LEU 544 Ca 0.06 0.68 -0.17 0.00 -0.22 0.00 0.00 54.13 54.47 2i03 s LEU 544 Cb -0.14 -2.82 0.00 0.00 0.50 0.00 0.00 46.19 43.72 2i03 s LEU 544 CO -0.03 -0.36 0.45 -0.62 -1.32 0.00 0.00 176.35 174.47 2i03 s ASP 545 N 1.48 6.24 0.16 3.68 -1.08 0.12 -0.76 116.67 126.51 2i03 s ASP 545 Ca 0.25 -0.26 0.10 0.00 -0.52 0.00 0.00 52.55 52.12 2i03 s ASP 545 Cb -0.16 -2.23 -0.04 0.00 -1.46 0.00 0.00 42.92 39.03 2i03 s ASP 545 CO 0.09 -0.46 -0.23 0.54 0.52 0.00 0.00 175.17 175.62 2i03 s VAL 546 N 2.22 2.14 0.00 1.11 0.11 -0.16 -4.34 120.40 121.48 2i03 s VAL 546 Ca 0.15 -1.89 0.00 0.00 -2.93 0.00 0.00 61.98 57.31 2i03 s VAL 546 Cb -0.16 -1.97 0.00 0.00 -1.53 0.00 0.00 36.38 32.72 2i03 s VAL 546 CO 0.13 -0.10 0.00 0.00 -3.33 0.00 0.00 175.10 171.80 2i03 n TYR 547 N 0.52 0.00 -1.51 1.54 9.36 -1.26 -4.11 117.16 121.69 2i03 n TYR 547 Ca -0.15 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 60.92 2i03 n TYR 547 Cb 0.55 0.11 -0.06 0.00 -0.63 0.00 0.00 39.34 39.31 2i03 n TYR 547 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2i03 n ALA 548 N -1.40 -0.25 -1.45 2.98 0.00 -1.26 -3.32 120.51 115.80 2i03 n ALA 548 Ca 0.00 0.24 -0.31 0.00 0.00 0.00 0.00 53.44 53.37 2i03 n ALA 548 Cb 0.00 -1.66 0.07 0.00 0.00 0.00 0.00 19.45 17.86 2i03 n ALA 548 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2i03 s GLY 549 N -2.80 1.67 0.14 0.00 0.00 -1.26 -4.86 107.32 100.20 2i03 s GLY 549 Ca 0.00 0.14 -0.34 0.00 0.00 0.00 0.00 44.72 44.51 2i03 s GLY 549 CO 0.00 0.47 1.55 -1.55 0.00 0.00 0.00 173.10 173.57 2i03 n PRO 550 N -3.31 1.98 -1.29 2.90 -0.04 -1.26 -1.73 135.00 132.25 2i03 n PRO 550 Ca 0.08 0.71 -0.07 0.00 -0.04 0.00 0.00 63.50 64.18 2i03 n PRO 550 Cb 0.53 -2.46 -0.03 0.00 -0.04 0.00 0.00 33.50 31.50 2i03 n PRO 550 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2i03 s SER 552 N -2.91 4.84 -0.25 0.00 1.04 -0.71 -4.07 113.70 111.64 2i03 s SER 552 Ca 0.00 0.04 -0.02 0.00 0.48 0.00 0.00 55.95 56.45 2i03 s SER 552 Cb 0.00 -0.71 0.14 0.00 0.10 0.00 0.00 66.02 65.56 2i03 s SER 552 CO 0.00 -1.51 0.42 -1.58 0.98 0.00 0.00 173.24 171.55 2i03 s GLN 553 N -5.03 0.39 0.00 4.02 0.74 -1.26 -1.96 119.66 116.56 2i03 s GLN 553 Ca 0.61 0.61 0.19 0.00 0.05 0.00 0.00 55.36 56.82 2i03 s GLN 553 Cb -0.09 -0.29 0.26 0.00 1.10 0.00 0.00 33.01 33.99 2i03 s GLN 553 CO 0.42 -0.65 1.19 1.63 -0.55 0.00 0.00 175.29 177.34 2i03 n LYS 554 N 5.38 1.95 -4.00 1.67 4.76 -1.26 -4.80 118.16 121.85 2i03 n LYS 554 Ca -0.03 -1.85 -0.31 0.00 -2.87 0.00 0.00 58.31 53.25 2i03 n LYS 554 Cb 0.50 -1.39 -0.15 0.00 -1.84 0.00 0.00 35.03 32.16 2i03 n LYS 554 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2i03 s ALA 555 N -1.40 2.64 0.32 7.82 0.00 -1.26 -4.71 121.76 125.16 2i03 s ALA 555 Ca 0.27 -2.21 0.03 0.00 0.00 0.00 0.00 51.96 50.06 2i03 s ALA 555 Cb 0.17 -1.82 -0.01 0.00 0.00 0.00 0.00 23.12 21.46 2i03 s ALA 555 CO 0.24 -1.54 0.35 -0.40 0.00 0.00 0.00 175.76 174.41 2i03 n ASP 556 N 4.37 -0.93 -1.90 0.00 5.68 -1.26 -4.34 116.55 118.17 2i03 n ASP 556 Ca -0.02 -2.92 0.02 0.00 -0.50 0.00 0.00 54.79 51.38 2i03 n ASP 556 Cb 0.42 1.92 0.37 0.00 -1.14 0.00 0.00 41.12 42.68 2i03 n ASP 556 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2i03 n THR 557 N -0.57 2.83 -2.87 2.12 -2.24 -0.46 -4.95 114.28 108.15 2i03 n THR 557 Ca 0.04 -1.52 -0.40 0.00 -2.27 0.00 0.00 64.05 59.90 2i03 n THR 557 Cb 0.55 -0.31 -0.05 0.00 -2.10 0.00 0.00 70.33 68.43 2i03 n THR 557 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2i03 s VAL 558 N -2.87 4.62 -0.13 2.28 1.01 -1.26 -1.28 120.40 122.76 2i03 s VAL 558 Ca 0.55 1.83 -0.29 0.00 0.00 0.00 0.00 61.98 64.07 2i03 s VAL 558 Cb 0.43 -4.21 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 2i03 s VAL 558 CO 0.15 0.35 1.01 0.12 0.00 0.00 0.00 175.10 176.72 2i03 s PHE 559 N -0.05 3.48 0.01 5.22 5.36 0.11 -4.91 117.98 127.19 2i03 s PHE 559 Ca 0.42 1.56 0.03 0.00 -0.96 0.00 0.00 56.93 57.98 2i03 s PHE 559 Cb -0.22 -3.20 -0.01 0.00 -0.34 0.00 0.00 43.02 39.25 2i03 s PHE 559 CO 0.26 -0.28 -0.08 1.03 -1.46 0.00 0.00 175.22 174.69 2i03 s ARG 560 N 2.27 0.65 -0.51 10.12 0.52 -1.26 -4.90 118.95 125.83 2i03 s ARG 560 Ca 0.47 -0.39 0.03 0.00 -0.52 0.00 0.00 55.73 55.32 2i03 s ARG 560 Cb -0.18 -0.60 0.13 0.00 0.52 0.00 0.00 34.95 34.82 2i03 s ARG 560 CO 0.15 0.16 0.26 -0.51 0.02 0.00 0.00 175.30 175.38 2i03 s LEU 561 N -0.47 4.53 0.00 2.53 1.02 -1.26 -4.86 118.68 120.17 2i03 s LEU 561 Ca 0.01 -2.85 0.00 0.00 0.02 0.00 0.00 54.13 51.31 2i03 s LEU 561 Cb -0.04 -1.67 0.00 0.00 0.02 0.00 0.00 46.19 44.49 2i03 s LEU 561 CO -0.00 -0.28 0.00 -0.46 0.02 0.00 0.00 176.35 175.63 2i03 n ASN 562 N 3.35 0.35 -0.23 2.29 0.23 -1.26 -5.00 115.26 114.99 2i03 n ASN 562 Ca 0.05 0.00 -0.06 0.00 -0.53 0.00 0.00 54.58 54.04 2i03 n ASN 562 Cb 0.34 0.00 0.04 0.00 -2.08 0.00 0.00 39.78 38.09 2i03 n ASN 562 CO 0.00 0.00 0.00 -0.25 -0.93 0.00 0.00 177.26 176.08 2i03 h TRP 563 N 0.00 0.91 -0.68 -2.53 7.01 -1.97 -2.01 115.95 116.68 2i03 h TRP 563 Ca 0.00 -0.03 0.09 0.00 2.11 0.00 0.00 58.89 61.06 2i03 h TRP 563 Cb 0.00 -0.29 -0.07 0.00 -2.10 0.00 0.00 29.16 26.70 2i03 h TRP 563 CO 0.00 0.67 0.33 0.00 -2.79 0.00 0.00 178.44 176.64 2i03 h ALA 564 N 1.16 0.93 -0.50 2.65 0.00 -1.98 -0.73 119.26 120.78 2i03 h ALA 564 Ca 0.23 0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.29 2i03 h ALA 564 Cb 0.07 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 17.75 2i03 h ALA 564 CO -0.03 -0.07 0.05 1.15 0.00 0.00 0.00 179.25 180.34 2i03 h THR 565 N 0.56 0.65 -0.19 0.00 2.02 -1.70 -0.32 112.91 113.94 2i03 h THR 565 Ca 0.33 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 67.44 2i03 h THR 565 Cb 0.35 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 2i03 h THR 565 CO -0.27 0.03 0.07 0.22 0.37 0.00 0.00 175.52 175.94 2i03 h TYR 566 N 0.17 0.29 -0.81 3.16 3.20 -1.06 -0.41 116.97 121.51 2i03 h TYR 566 Ca 0.26 -0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.16 2i03 h TYR 566 Cb 0.37 -0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.50 2i03 h TYR 566 CO -0.27 0.36 0.49 -0.07 -1.64 0.00 0.00 178.16 177.03 2i03 h LEU 567 N 0.14 0.76 0.01 2.82 3.38 -0.56 0.20 115.31 122.06 2i03 h LEU 567 Ca 0.06 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2i03 h LEU 567 Cb 0.20 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2i03 h LEU 567 CO -0.00 0.49 -0.01 0.00 0.09 0.00 0.00 178.44 179.01 2i03 h ALA 568 N 1.39 -0.01 -0.31 1.53 0.00 -0.98 -1.03 119.26 119.85 2i03 h ALA 568 Ca 0.36 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 2i03 h ALA 568 Cb 0.18 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2i03 h ALA 568 CO -0.18 -0.17 -0.08 1.03 0.00 0.00 0.00 179.25 179.85 2i03 h SER 569 N -0.69 0.62 0.00 0.00 0.87 -0.96 -2.79 113.55 110.60 2i03 h SER 569 Ca -0.00 -0.37 -0.21 0.00 -1.23 0.00 0.00 61.79 59.98 2i03 h SER 569 Cb 0.66 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.42 2i03 h SER 569 CO 0.00 0.84 -1.37 0.41 -0.53 0.00 0.00 176.83 176.18 2i03 n THR 570 N -4.45 1.50 1.51 2.23 -1.04 0.68 -4.49 114.28 110.22 2i03 n THR 570 Ca -0.03 -0.04 0.11 0.00 -2.04 0.00 0.00 64.05 62.06 2i03 n THR 570 Cb 0.33 -2.11 0.49 0.00 -1.82 0.00 0.00 70.33 67.22 2i03 n THR 570 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2i03 n GLU 571 N -4.43 1.50 -3.97 -2.82 -0.58 -0.73 -4.94 120.64 104.66 2i03 n GLU 571 Ca -0.30 -0.75 -0.26 0.00 -0.42 0.00 0.00 57.16 55.43 2i03 n GLU 571 Cb 0.62 -1.40 -0.02 0.00 -0.57 0.00 0.00 31.44 30.07 2i03 n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2i03 n ASN 572 N -0.05 -0.44 -4.46 1.62 4.13 -0.49 -4.92 115.26 110.64 2i03 n ASN 572 Ca 0.17 -1.04 -0.33 0.00 1.68 0.00 0.00 54.58 55.06 2i03 n ASN 572 Cb 0.26 -2.92 -0.13 0.00 -1.54 0.00 0.00 39.78 35.45 2i03 n ASN 572 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2i03 s ILE 573 N -3.97 3.20 -0.20 2.41 1.01 -0.63 -4.54 121.20 118.47 2i03 s ILE 573 Ca 0.03 -0.65 -0.24 0.00 0.00 0.00 0.00 60.65 59.79 2i03 s ILE 573 Cb -0.01 -2.29 -0.01 0.00 0.01 0.00 0.00 42.46 40.15 2i03 s ILE 573 CO 0.90 0.57 0.78 -0.63 0.00 0.00 0.00 174.94 176.56 2i03 s ILE 574 N -0.40 4.90 -0.28 2.92 1.01 -0.97 -3.42 121.20 124.97 2i03 s ILE 574 Ca 0.05 1.50 -0.07 0.00 0.00 0.00 0.00 60.65 62.13 2i03 s ILE 574 Cb -0.12 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 38.27 2i03 s ILE 574 CO 0.02 0.01 0.07 -0.69 0.00 0.00 0.00 174.94 174.36 2i03 s VAL 575 N 2.32 3.98 0.16 2.92 1.01 -1.16 -0.22 120.40 129.41 2i03 s VAL 575 Ca 0.35 -0.58 0.11 0.00 0.00 0.00 0.00 61.98 61.85 2i03 s VAL 575 Cb -0.16 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 2i03 s VAL 575 CO 0.10 0.15 -0.25 0.00 0.00 0.00 0.00 175.10 175.11 2i03 s ALA 576 N 1.52 2.48 0.09 5.51 0.00 -0.12 -1.21 121.76 130.03 2i03 s ALA 576 Ca 0.04 -1.53 0.06 0.00 0.00 0.00 0.00 51.96 50.52 2i03 s ALA 576 Cb -0.17 -0.39 -0.03 0.00 0.00 0.00 0.00 23.12 22.54 2i03 s ALA 576 CO 0.02 0.50 -0.16 -1.12 0.00 0.00 0.00 175.76 174.99 2i03 s SER 577 N -2.34 1.99 -0.06 0.00 0.01 -0.43 0.13 113.70 113.00 2i03 s SER 577 Ca 0.17 -0.66 -0.02 0.00 1.31 0.00 0.00 55.95 56.75 2i03 s SER 577 Cb -0.09 -0.08 0.04 0.00 0.21 0.00 0.00 66.02 66.10 2i03 s SER 577 CO 0.08 -0.04 0.12 0.12 0.41 0.00 0.00 173.24 173.93 2i03 s PHE 578 N -1.33 -0.12 -0.53 2.43 5.36 -1.26 -1.53 117.98 121.00 2i03 s PHE 578 Ca 0.02 0.43 -0.16 0.00 -0.96 0.00 0.00 56.93 56.26 2i03 s PHE 578 Cb -0.09 -0.17 0.12 0.00 -0.34 0.00 0.00 43.02 42.53 2i03 s PHE 578 CO 0.03 -0.18 0.49 -0.51 -1.46 0.00 0.00 175.22 173.60 2i03 s ASP 579 N 1.46 6.18 0.00 6.13 1.01 -0.41 -4.87 116.67 126.17 2i03 s ASP 579 Ca -0.06 -1.69 0.00 0.00 0.71 0.00 0.00 52.55 51.51 2i03 s ASP 579 Cb -0.12 -2.21 0.00 0.00 1.01 0.00 0.00 42.92 41.60 2i03 s ASP 579 CO -0.05 -0.84 0.00 0.61 0.21 0.00 0.00 175.17 175.10 2i03 n GLY 580 N 5.24 2.43 3.71 0.21 0.00 -1.26 -4.02 105.19 111.49 2i03 n GLY 580 Ca -0.13 -1.83 -0.43 0.00 0.00 0.00 0.00 46.02 43.62 2i03 n GLY 580 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i03 n ARG 581 N 0.00 2.30 0.00 1.61 3.00 -1.26 -1.53 116.66 120.79 2i03 n ARG 581 Ca 0.00 0.82 0.00 0.00 -0.01 0.00 0.00 57.85 58.66 2i03 n ARG 581 Cb 0.00 -2.51 0.00 0.00 0.00 0.00 0.00 32.46 29.95 2i03 n ARG 581 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2i03 n GLY 582 N 1.85 3.20 3.44 -0.13 0.00 0.56 -4.15 105.19 109.96 2i03 n GLY 582 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 2i03 n GLY 582 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2i03 n SER 583 N 0.00 -1.73 -4.89 1.61 7.64 -0.58 -0.14 113.62 115.53 2i03 n SER 583 Ca 0.00 0.41 -0.28 0.00 1.01 0.00 0.00 58.87 60.01 2i03 n SER 583 Cb 0.00 -1.22 -0.01 0.00 -1.01 0.00 0.00 64.21 61.97 2i03 n SER 583 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2i03 s GLY 584 N -1.87 2.49 -1.67 0.23 0.00 -0.83 -3.28 107.32 102.38 2i03 s GLY 584 Ca 0.60 -1.05 0.00 0.00 0.00 0.00 0.00 44.72 44.27 2i03 s GLY 584 CO 0.64 -1.99 0.00 -1.72 0.00 0.00 0.00 173.10 170.03 2i03 n TYR 585 N -1.72 0.00 -0.44 1.90 4.01 -1.26 -4.78 117.16 114.87 2i03 n TYR 585 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 2i03 n TYR 585 Cb 0.65 -2.91 0.00 0.00 -0.31 0.00 0.00 39.34 36.77 2i03 n TYR 585 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2i03 n GLN 586 N -2.10 1.14 0.00 -0.72 6.02 -1.26 -4.55 117.38 115.90 2i03 n GLN 586 Ca -0.16 -0.87 0.00 0.00 -0.01 0.00 0.00 57.00 55.96 2i03 n GLN 586 Cb 0.57 -0.78 0.00 0.00 1.02 0.00 0.00 30.24 31.05 2i03 n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2i03 n GLY 587 N -0.21 2.37 0.20 1.08 0.00 -1.26 -4.70 105.19 102.67 2i03 n GLY 587 Ca 0.00 -1.93 0.01 0.00 0.00 0.00 0.00 46.02 44.10 2i03 n GLY 587 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2i03 h ASP 588 N 0.00 0.14 -0.35 1.61 5.19 -0.73 -2.56 116.42 119.71 2i03 h ASP 588 Ca 0.00 -0.05 0.04 0.00 -0.62 0.00 0.00 57.03 56.40 2i03 h ASP 588 Cb 0.00 -0.04 -0.04 0.00 0.18 0.00 0.00 39.33 39.44 2i03 h ASP 588 CO 0.00 0.48 0.13 0.50 -3.12 0.00 0.00 179.24 177.24 2i03 h LYS 589 N 0.12 0.28 -0.05 3.56 3.64 -1.88 0.19 116.57 122.42 2i03 h LYS 589 Ca 0.01 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 2i03 h LYS 589 Cb 0.68 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 2i03 h LYS 589 CO 0.05 0.18 -0.11 0.82 -2.27 0.00 0.00 179.45 178.13 2i03 h ILE 590 N 0.28 1.43 -0.54 2.00 2.04 -1.83 -3.22 117.51 117.69 2i03 h ILE 590 Ca 0.16 -1.44 -0.10 0.00 1.00 0.00 0.00 64.86 64.48 2i03 h ILE 590 Cb 0.12 2.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.45 2i03 h ILE 590 CO -0.15 0.40 -0.04 -0.03 0.00 0.00 0.00 178.15 178.32 2i03 h MET 591 N -0.36 0.97 -0.17 2.37 4.05 -1.32 0.16 114.93 120.64 2i03 h MET 591 Ca 0.00 -0.33 0.00 0.00 -0.28 0.00 0.00 59.70 59.09 2i03 h MET 591 Cb 0.69 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.42 2i03 h MET 591 CO 0.02 1.00 0.00 0.72 0.23 0.00 0.00 176.91 178.89 2i03 n HIS 592 N -4.23 0.22 0.27 1.39 8.25 0.64 -4.04 115.22 117.73 2i03 n HIS 592 Ca 0.01 -0.11 0.10 0.00 -0.26 0.00 0.00 57.72 57.47 2i03 n HIS 592 Cb 0.36 0.00 0.74 0.00 1.12 0.00 0.00 29.99 32.20 2i03 n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2i03 h ALA 593 N 3.60 1.83 -0.51 -1.41 0.00 -1.53 -1.89 119.26 119.36 2i03 h ALA 593 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2i03 h ALA 593 Cb 0.29 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2i03 h ALA 593 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 179.25 179.69 2i03 n ILE 594 N -4.30 2.29 -1.67 0.00 -5.35 -1.26 -4.92 119.36 104.16 2i03 n ILE 594 Ca -0.03 -1.44 -0.45 0.00 -0.27 0.00 0.00 62.75 60.56 2i03 n ILE 594 Cb 0.09 -0.11 -0.03 0.00 -1.74 0.00 0.00 39.64 37.85 2i03 n ILE 594 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 2i03 n ASN 595 N 0.48 2.75 0.00 7.28 4.05 -0.71 -0.65 115.26 128.46 2i03 n ASN 595 Ca 0.25 1.14 0.00 0.00 0.45 0.00 0.00 54.58 56.42 2i03 n ASN 595 Cb 0.99 -1.42 0.00 0.00 1.23 0.00 0.00 39.78 40.58 2i03 n ASN 595 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 2i03 n ARG 596 N 2.12 0.00 -2.88 1.20 1.74 0.21 -4.75 116.66 114.29 2i03 n ARG 596 Ca 0.12 0.00 -0.22 0.00 -0.77 0.00 0.00 57.85 56.98 2i03 n ARG 596 Cb 0.31 -3.83 -0.02 0.00 -1.02 0.00 0.00 32.46 27.90 2i03 n ARG 596 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 2i03 n ARG 597 N -1.43 2.31 -2.28 5.56 3.00 0.17 -4.83 116.66 119.16 2i03 n ARG 597 Ca 0.00 -4.12 -0.36 0.00 -0.00 0.00 0.00 57.85 53.36 2i03 n ARG 597 Cb 0.00 -1.94 -0.01 0.00 0.00 0.00 0.00 32.46 30.52 2i03 n ARG 597 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2i03 s LEU 598 N -3.14 3.92 0.00 6.15 1.43 -1.20 -3.59 118.68 122.25 2i03 s LEU 598 Ca 0.43 2.24 0.00 0.00 -1.03 0.00 0.00 54.13 55.77 2i03 s LEU 598 Cb 0.35 -4.37 0.00 0.00 0.03 0.00 0.00 46.19 42.20 2i03 s LEU 598 CO -0.10 -1.01 0.00 0.61 0.23 0.00 0.00 176.35 176.08 2i03 n GLY 599 N 0.32 0.44 0.00 -3.19 0.00 -1.26 -4.82 105.19 96.68 2i03 n GLY 599 Ca 0.09 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.24 2i03 n GLY 599 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2i03 n THR 600 N -3.75 0.00 -0.29 2.61 -2.24 -1.24 -4.84 114.28 104.54 2i03 n THR 600 Ca 0.00 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.86 2i03 n THR 600 Cb 0.42 0.00 0.30 0.00 -2.10 0.00 0.00 70.33 68.95 2i03 n THR 600 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2i03 h PHE 601 N 0.00 0.96 0.00 4.78 0.04 -1.93 -0.18 116.94 120.60 2i03 h PHE 601 Ca 0.00 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.75 2i03 h PHE 601 Cb 0.00 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 37.84 2i03 h PHE 601 CO 0.00 0.43 -0.23 1.05 -0.60 0.00 0.00 178.31 178.96 2i03 h GLU 602 N 0.87 0.00 0.11 1.51 9.09 -1.92 0.22 114.58 124.47 2i03 h GLU 602 Ca 0.42 0.00 -0.33 0.00 0.05 0.00 0.00 59.36 59.50 2i03 h GLU 602 Cb 0.45 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.53 2i03 h GLU 602 CO -0.19 0.23 -1.74 -0.24 0.05 0.00 0.00 179.01 177.12 2i03 h VAL 603 N 0.00 0.90 -0.74 -1.06 3.04 -1.64 -3.12 116.25 113.63 2i03 h VAL 603 Ca -0.00 -2.60 -0.02 0.00 -1.01 0.00 0.00 66.70 63.07 2i03 h VAL 603 Cb 0.43 2.62 -0.03 0.00 -2.01 0.00 0.00 31.29 32.29 2i03 h VAL 603 CO 0.03 0.79 0.39 -0.33 -1.01 0.00 0.00 177.57 177.44 2i03 h GLU 604 N 0.06 1.05 0.00 4.17 5.08 -0.73 -1.99 114.58 122.22 2i03 h GLU 604 Ca -0.32 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 57.87 2i03 h GLU 604 Cb 2.03 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 31.08 2i03 h GLU 604 CO 0.13 0.79 -0.19 -0.44 -1.00 0.00 0.00 179.01 178.30 2i03 h ASP 605 N 1.03 0.00 0.41 1.42 5.19 -0.68 -1.29 116.42 122.50 2i03 h ASP 605 Ca 0.26 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.48 2i03 h ASP 605 Cb 0.06 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.57 2i03 h ASP 605 CO -0.04 0.19 -0.80 -0.61 -3.12 0.00 0.00 179.24 174.86 2i03 h GLN 606 N 0.00 0.30 -0.11 3.56 5.75 -1.30 -1.28 115.11 122.03 2i03 h GLN 606 Ca -0.00 -0.28 -0.07 0.00 -0.15 0.00 0.00 58.65 58.15 2i03 h GLN 606 Cb 0.50 0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.12 2i03 h GLN 606 CO 0.02 0.95 -0.21 0.82 -2.65 0.00 0.00 178.83 177.77 2i03 h ILE 607 N 0.19 1.38 -1.00 2.39 2.04 -0.96 -2.97 117.51 118.58 2i03 h ILE 607 Ca -0.04 -1.48 0.06 0.00 1.00 0.00 0.00 64.86 64.40 2i03 h ILE 607 Cb 1.39 2.08 -0.07 0.00 -0.74 0.00 0.00 36.82 39.49 2i03 h ILE 607 CO 0.13 0.43 0.65 -0.08 0.00 0.00 0.00 178.15 179.28 2i03 h GLU 608 N -0.10 1.16 -0.81 2.37 4.57 -1.22 -1.77 114.58 118.79 2i03 h GLU 608 Ca 0.00 -0.07 0.03 0.00 -1.18 0.00 0.00 59.36 58.15 2i03 h GLU 608 Cb 0.79 -0.26 -0.05 0.00 -0.16 0.00 0.00 28.75 29.07 2i03 h GLU 608 CO 0.05 0.77 0.51 0.00 -1.18 0.00 0.00 179.01 179.16 2i03 h ALA 609 N 1.44 1.07 -0.31 2.92 0.00 -1.18 0.08 119.26 123.28 2i03 h ALA 609 Ca 0.43 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2i03 h ALA 609 Cb 0.13 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2i03 h ALA 609 CO -0.16 0.33 0.20 0.00 0.00 0.00 0.00 179.25 179.62 2i03 h ALA 610 N 1.34 0.39 -0.41 0.00 0.00 -1.17 -0.37 119.26 119.05 2i03 h ALA 610 Ca 0.33 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.25 2i03 h ALA 610 Cb 0.03 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2i03 h ALA 610 CO -0.12 -0.15 0.20 0.00 0.00 0.00 0.00 179.25 179.18 2i03 h ARG 611 N 0.41 0.40 -0.43 0.00 3.08 -0.99 0.16 114.38 117.02 2i03 h ARG 611 Ca 0.11 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 2i03 h ARG 611 Cb -0.04 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 2i03 h ARG 611 CO -0.03 0.26 0.23 1.96 -1.07 0.00 0.00 179.97 181.32 2i03 h GLN 612 N 0.41 0.58 -0.02 0.04 1.08 -0.56 -0.67 115.11 115.97 2i03 h GLN 612 Ca 0.17 -0.05 -0.04 0.00 -1.45 0.00 0.00 58.65 57.28 2i03 h GLN 612 Cb 0.08 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.39 2i03 h GLN 612 CO -0.12 0.43 -0.13 0.74 -0.95 0.00 0.00 178.83 178.80 2i03 h PHE 613 N 0.59 0.16 -0.88 2.96 0.04 -0.29 -3.27 116.94 116.26 2i03 h PHE 613 Ca 0.15 -0.08 0.11 0.00 2.80 0.00 0.00 57.97 60.96 2i03 h PHE 613 Cb 0.02 -0.02 -0.06 0.00 2.20 0.00 0.00 35.95 38.08 2i03 h PHE 613 CO 0.00 0.81 0.57 0.66 -0.60 0.00 0.00 178.31 179.75 2i03 h SER 614 N -0.53 0.74 -0.20 2.17 4.64 -0.36 0.27 113.55 120.28 2i03 h SER 614 Ca -0.01 0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.28 2i03 h SER 614 Cb 0.83 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.76 2i03 h SER 614 CO 0.03 0.42 0.07 0.29 -0.87 0.00 0.00 176.83 176.76 2i03 n LYS 615 N -4.54 1.77 0.00 4.77 4.76 -0.29 -2.88 118.16 121.75 2i03 n LYS 615 Ca 0.16 -0.82 0.09 0.00 -2.87 0.00 0.00 58.31 54.86 2i03 n LYS 615 Cb 0.36 -1.56 -0.06 0.00 -1.84 0.00 0.00 35.03 31.93 2i03 n LYS 615 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 2i03 n MET 616 N 0.13 1.25 0.00 1.97 2.81 0.08 -5.03 117.12 118.33 2i03 n MET 616 Ca 0.11 -0.42 0.00 0.00 -1.81 0.00 0.00 57.70 55.57 2i03 n MET 616 Cb 0.62 -1.36 0.00 0.00 -0.71 0.00 0.00 33.22 31.77 2i03 n MET 616 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2i03 n GLY 617 N 1.36 3.07 1.06 3.03 0.00 -1.14 -4.91 105.19 107.65 2i03 n GLY 617 Ca 0.05 -0.86 -0.02 0.00 0.00 0.00 0.00 46.02 45.20 2i03 n GLY 617 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2i03 n PHE 618 N 0.00 0.60 -4.30 1.61 1.16 -1.25 -4.74 117.46 110.54 2i03 n PHE 618 Ca 0.00 -0.50 -0.33 0.00 -1.87 0.00 0.00 57.45 54.75 2i03 n PHE 618 Cb 0.00 -0.31 -0.16 0.00 -1.61 0.00 0.00 39.48 37.40 2i03 n PHE 618 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 2i03 s VAL 619 N -1.07 2.18 -0.68 1.97 1.01 -1.26 -0.78 120.40 121.77 2i03 s VAL 619 Ca 0.13 -0.91 -0.27 0.00 0.00 0.00 0.00 61.98 60.92 2i03 s VAL 619 Cb 0.10 -1.91 0.03 0.00 0.00 0.00 0.00 36.38 34.60 2i03 s VAL 619 CO 0.03 0.53 1.30 -0.62 0.00 0.00 0.00 175.10 176.34 2i03 s ASP 620 N 1.13 6.19 0.00 3.32 -1.08 -0.06 -4.80 116.67 121.36 2i03 s ASP 620 Ca 0.01 -0.21 0.09 0.00 -0.52 0.00 0.00 52.55 51.91 2i03 s ASP 620 Cb -0.14 -2.56 0.51 0.00 -1.46 0.00 0.00 42.92 39.28 2i03 s ASP 620 CO -0.08 -1.77 1.03 -0.46 0.52 0.00 0.00 175.17 174.41 2i03 n ASN 621 N 9.32 0.00 -0.16 -0.34 0.23 -1.26 -1.35 115.26 121.70 2i03 n ASN 621 Ca 0.06 -0.17 0.12 0.00 -0.53 0.00 0.00 54.58 54.06 2i03 n ASN 621 Cb 0.49 -0.07 0.24 0.00 -2.08 0.00 0.00 39.78 38.36 2i03 n ASN 621 CO 0.00 0.00 0.00 1.17 -0.93 0.00 0.00 177.26 177.50 2i03 n LYS 622 N -1.07 0.50 -3.28 -3.83 4.81 -1.26 -4.49 118.16 109.53 2i03 n LYS 622 Ca 0.06 -0.33 -0.25 0.00 -0.87 0.00 0.00 58.31 56.92 2i03 n LYS 622 Cb 0.04 -1.49 -0.08 0.00 0.02 0.00 0.00 35.03 33.52 2i03 n LYS 622 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2i03 n ARG 623 N -0.96 0.78 -4.16 1.64 1.74 -0.45 -4.80 116.66 110.44 2i03 n ARG 623 Ca 0.09 -3.38 -0.33 0.00 -0.77 0.00 0.00 57.85 53.45 2i03 n ARG 623 Cb 0.36 -1.45 -0.16 0.00 -1.02 0.00 0.00 32.46 30.18 2i03 n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2i03 s ILE 624 N -1.00 2.23 0.41 0.55 1.01 -1.26 -0.19 121.20 122.95 2i03 s ILE 624 Ca 0.35 -0.89 0.07 0.00 0.00 0.00 0.00 60.65 60.18 2i03 s ILE 624 Cb 0.13 -1.94 -0.06 0.00 0.01 0.00 0.00 42.46 40.60 2i03 s ILE 624 CO -0.13 0.53 0.15 0.00 0.00 0.00 0.00 174.94 175.49 2i03 s ALA 625 N 1.25 3.52 -0.15 9.38 0.00 0.35 -1.28 121.76 134.84 2i03 s ALA 625 Ca 0.04 -2.14 -0.12 0.00 0.00 0.00 0.00 51.96 49.73 2i03 s ALA 625 Cb -0.13 -0.28 0.04 0.00 0.00 0.00 0.00 23.12 22.75 2i03 s ALA 625 CO -0.10 -0.16 0.39 -1.50 0.00 0.00 0.00 175.76 174.38 2i03 s ILE 626 N -2.62 -0.01 0.05 0.00 2.07 -1.14 0.50 121.20 120.05 2i03 s ILE 626 Ca 0.40 0.02 -0.16 0.00 -1.41 0.00 0.00 60.65 59.50 2i03 s ILE 626 Cb 0.05 -0.55 0.03 0.00 0.13 0.00 0.00 42.46 42.12 2i03 s ILE 626 CO 0.22 0.01 0.37 -1.66 -1.91 0.00 0.00 174.94 171.96 2i03 s TRP 627 N 0.42 -0.19 0.09 3.50 1.48 0.06 -1.42 118.94 122.87 2i03 s TRP 627 Ca -0.02 0.08 -0.27 0.00 -1.06 0.00 0.00 56.10 54.83 2i03 s TRP 627 Cb -0.04 0.17 0.08 0.00 -1.16 0.00 0.00 33.47 32.52 2i03 s TRP 627 CO -0.02 -0.56 0.99 0.20 -4.06 0.00 0.00 176.95 173.50 2i03 s GLY 628 N -2.12 -0.31 0.03 3.67 0.00 -1.04 -0.99 107.32 106.56 2i03 s GLY 628 Ca -0.04 0.44 0.08 0.00 0.00 0.00 0.00 44.72 45.19 2i03 s GLY 628 CO -0.04 0.11 -0.23 0.86 0.00 0.00 0.00 173.10 173.80 2i03 s TRP 629 N -3.13 2.00 0.00 1.90 -0.11 -1.26 -1.98 118.94 116.37 2i03 s TRP 629 Ca 0.11 -0.39 0.00 0.00 1.22 0.00 0.00 56.10 57.04 2i03 s TRP 629 Cb -0.01 -1.22 0.00 0.00 -1.50 0.00 0.00 33.47 30.75 2i03 s TRP 629 CO -0.01 0.07 0.00 0.45 -4.62 0.00 0.00 176.95 172.84 2i03 n SER 630 N 1.98 0.00 -0.27 5.86 2.88 -0.51 0.07 113.62 123.63 2i03 n SER 630 Ca -0.17 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.32 2i03 n SER 630 Cb 0.53 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 64.05 2i03 n SER 630 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 2i03 h TYR 631 N 0.00 1.01 -0.46 0.66 5.03 -1.87 -0.85 116.97 120.50 2i03 h TYR 631 Ca 0.00 -0.02 0.06 0.00 2.58 0.00 0.00 58.73 61.36 2i03 h TYR 631 Cb 0.00 -0.33 -0.03 0.00 1.55 0.00 0.00 36.73 37.93 2i03 h TYR 631 CO 0.00 0.70 0.31 0.78 -1.32 0.00 0.00 178.16 178.63 2i03 h GLY 632 N 1.03 0.44 1.66 1.82 0.00 -0.36 0.13 103.07 107.79 2i03 h GLY 632 Ca 0.27 -0.14 -0.18 0.00 0.00 0.00 0.00 47.33 47.27 2i03 h GLY 632 CO -0.05 0.11 -0.76 -1.33 0.00 0.00 0.00 176.54 174.51 2i03 h GLY 633 N 0.35 0.36 0.79 4.60 0.00 -1.15 -0.79 103.07 107.24 2i03 h GLY 633 Ca 0.20 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 2i03 h GLY 633 CO -0.05 0.48 -0.20 -1.82 0.00 0.00 0.00 176.54 174.95 2i03 h TYR 634 N 0.22 -0.52 -0.41 5.60 3.20 0.49 -2.07 116.97 123.47 2i03 h TYR 634 Ca -0.03 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.86 2i03 h TYR 634 Cb 1.34 0.17 -0.04 0.00 1.54 0.00 0.00 36.73 39.75 2i03 h TYR 634 CO 0.04 -0.22 0.19 0.28 -1.64 0.00 0.00 178.16 176.80 2i03 h VAL 635 N -0.78 0.94 -0.55 1.81 2.07 -0.95 -0.42 116.25 118.38 2i03 h VAL 635 Ca -0.06 -0.13 0.11 0.00 0.82 0.00 0.00 66.70 67.44 2i03 h VAL 635 Cb 0.53 0.53 -0.08 0.00 -1.52 0.00 0.00 31.29 30.74 2i03 h VAL 635 CO 0.09 0.07 0.05 0.74 0.02 0.00 0.00 177.57 178.55 2i03 h THR 636 N 0.38 0.62 -0.58 2.57 2.02 -1.11 0.25 112.91 117.05 2i03 h THR 636 Ca 0.18 -0.06 -0.09 0.00 0.77 0.00 0.00 66.41 67.21 2i03 h THR 636 Cb 0.12 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 2i03 h THR 636 CO -0.15 0.03 0.00 0.28 0.37 0.00 0.00 175.52 176.05 2i03 h SER 637 N 0.18 0.99 -0.47 4.18 0.02 -0.79 -0.28 113.55 117.37 2i03 h SER 637 Ca 0.28 -0.27 -0.05 0.00 -0.84 0.00 0.00 61.79 60.91 2i03 h SER 637 Cb 0.42 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 2i03 h SER 637 CO -0.42 1.04 0.11 0.24 -1.14 0.00 0.00 176.83 176.67 2i03 h MET 638 N 0.93 0.75 0.02 3.45 2.86 0.07 -1.10 114.93 121.92 2i03 h MET 638 Ca 0.17 -0.18 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2i03 h MET 638 Cb 0.54 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.10 2i03 h MET 638 CO 0.03 0.74 -0.01 0.28 1.06 0.00 0.00 176.91 179.00 2i03 h VAL 639 N 0.63 1.10 0.00 -2.22 2.07 -0.40 -2.39 116.25 115.03 2i03 h VAL 639 Ca 0.15 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 2i03 h VAL 639 Cb 0.33 1.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.44 2i03 h VAL 639 CO 0.00 0.10 -0.00 -0.07 0.02 0.00 0.00 177.57 177.61 2i03 h LEU 640 N -0.19 0.00 -2.87 2.57 3.38 -0.90 -1.08 115.31 116.21 2i03 h LEU 640 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2i03 h LEU 640 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2i03 h LEU 640 CO 0.01 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.15 2i03 n GLY 641 N -1.12 2.61 0.07 0.83 0.00 -0.43 -4.44 105.19 102.72 2i03 n GLY 641 Ca -0.03 -0.78 -0.06 0.00 0.00 0.00 0.00 46.02 45.15 2i03 n GLY 641 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2i03 h SER 642 N 4.04 0.00 0.00 1.61 4.64 -0.71 -3.42 113.55 119.71 2i03 h SER 642 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2i03 h SER 642 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2i03 h SER 642 CO 0.06 0.93 0.00 0.61 -0.87 0.00 0.00 176.83 177.56 2i03 n GLY 643 N 1.17 0.53 0.23 -0.77 0.00 -1.26 -4.94 105.19 100.15 2i03 n GLY 643 Ca -0.00 -0.69 0.10 0.00 0.00 0.00 0.00 46.02 45.43 2i03 n GLY 643 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2i03 h SER 644 N 0.00 0.00 0.00 1.61 4.64 -1.92 -3.46 113.55 114.42 2i03 h SER 644 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2i03 h SER 644 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2i03 h SER 644 CO 0.00 0.21 0.00 0.61 -0.87 0.00 0.00 176.83 176.78 2i03 n GLY 645 N -0.39 0.73 0.21 -0.77 0.00 -1.26 -4.89 105.19 98.82 2i03 n GLY 645 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 2i03 n GLY 645 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2i03 h VAL 646 N 0.00 1.29 -2.87 1.61 2.07 -1.96 -3.46 116.25 112.94 2i03 h VAL 646 Ca 0.00 -1.99 -0.66 0.00 0.82 0.00 0.00 66.70 64.86 2i03 h VAL 646 Cb 0.03 2.07 -0.09 0.00 -1.52 0.00 0.00 31.29 31.78 2i03 h VAL 646 CO 0.00 0.63 -0.52 -0.36 0.02 0.00 0.00 177.57 177.33 2i03 s PHE 647 N -3.67 3.46 -0.08 1.57 0.40 -1.26 -4.61 117.98 113.79 2i03 s PHE 647 Ca -0.11 0.39 -0.18 0.00 -0.60 0.00 0.00 56.93 56.43 2i03 s PHE 647 Cb 0.08 -1.86 -0.29 0.00 0.51 0.00 0.00 43.02 41.46 2i03 s PHE 647 CO 0.90 0.65 0.69 -0.22 0.70 0.00 0.00 175.22 177.94 2i03 h LYS 648 N 4.69 0.28 -4.07 0.44 3.64 -1.50 -3.46 116.57 116.58 2i03 h LYS 648 Ca -0.52 -0.47 -0.28 0.00 -1.27 0.00 0.00 60.65 58.11 2i03 h LYS 648 Cb 1.21 0.18 -0.07 0.00 -0.41 0.00 0.00 32.23 33.13 2i03 h LYS 648 CO 0.60 1.23 -0.15 0.00 -2.27 0.00 0.00 179.45 178.85 2i03 s GLY 650 N -3.25 -0.37 -0.05 0.00 0.00 -0.68 -2.90 107.32 100.08 2i03 s GLY 650 Ca 0.30 1.26 0.03 0.00 0.00 0.00 0.00 44.72 46.30 2i03 s GLY 650 CO 0.21 0.41 -0.12 -0.42 0.00 0.00 0.00 173.10 173.18 2i03 s ILE 651 N -2.74 1.05 -0.17 0.90 1.01 -0.51 -1.70 121.20 119.04 2i03 s ILE 651 Ca 0.08 -0.46 0.01 0.00 0.00 0.00 0.00 60.65 60.28 2i03 s ILE 651 Cb -0.01 -0.95 0.02 0.00 0.01 0.00 0.00 42.46 41.53 2i03 s ILE 651 CO -0.06 0.33 -0.20 0.00 0.00 0.00 0.00 174.94 175.00 2i03 s ALA 652 N 0.47 2.32 -0.19 9.38 0.00 -0.21 -2.50 121.76 131.03 2i03 s ALA 652 Ca -0.10 -1.20 -0.04 0.00 0.00 0.00 0.00 51.96 50.62 2i03 s ALA 652 Cb -0.13 -1.15 -0.02 0.00 0.00 0.00 0.00 23.12 21.81 2i03 s ALA 652 CO 0.02 -0.30 -0.04 0.08 0.00 0.00 0.00 175.76 175.52 2i03 s VAL 653 N 1.22 3.64 -1.31 0.00 1.01 -0.84 -1.04 120.40 123.08 2i03 s VAL 653 Ca 0.03 -0.43 -0.19 0.00 0.00 0.00 0.00 61.98 61.40 2i03 s VAL 653 Cb -0.13 -2.62 0.02 0.00 0.00 0.00 0.00 36.38 33.65 2i03 s VAL 653 CO -0.11 0.46 0.50 0.00 0.00 0.00 0.00 175.10 175.94 2i03 n ALA 654 N 4.13 -2.37 -2.21 5.51 0.00 0.86 -1.42 120.51 125.00 2i03 n ALA 654 Ca -0.18 -0.44 -0.31 0.00 0.00 0.00 0.00 53.44 52.51 2i03 n ALA 654 Cb 0.52 -2.30 -0.05 0.00 0.00 0.00 0.00 19.45 17.62 2i03 n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2i03 s PRO 655 N -7.03 3.86 0.35 0.00 0.04 -1.26 -2.79 135.00 128.17 2i03 s PRO 655 Ca 0.30 0.50 -0.25 0.00 0.04 0.00 0.00 61.00 61.59 2i03 s PRO 655 Cb -0.15 -2.45 -0.10 0.00 0.04 0.00 0.00 34.50 31.84 2i03 s PRO 655 CO 0.95 0.09 0.96 0.08 0.04 0.00 0.00 177.00 179.12 2i03 s VAL 656 N -2.15 4.19 -0.02 -0.36 1.01 -1.24 -4.49 120.40 117.34 2i03 s VAL 656 Ca 0.52 1.70 0.02 0.00 0.00 0.00 0.00 61.98 64.21 2i03 s VAL 656 Cb -0.10 -3.89 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 2i03 s VAL 656 CO 0.25 0.03 0.01 -1.54 0.00 0.00 0.00 175.10 173.84 2i03 n SER 657 N 0.24 4.41 -3.68 3.32 3.41 -1.26 -4.36 113.62 115.70 2i03 n SER 657 Ca 0.03 -0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.55 2i03 n SER 657 Cb 0.51 0.54 -0.10 0.00 -0.26 0.00 0.00 64.21 64.90 2i03 n SER 657 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2i03 s ARG 658 N -2.06 0.47 0.62 4.33 1.70 -1.26 -0.86 118.95 121.89 2i03 s ARG 658 Ca -0.01 0.90 0.30 0.00 -0.47 0.00 0.00 55.73 56.44 2i03 s ARG 658 Cb 0.01 0.02 1.61 0.00 -0.57 0.00 0.00 34.95 36.02 2i03 s ARG 658 CO 0.09 -0.16 1.98 -1.49 -1.08 0.00 0.00 175.30 174.65 2i03 h TRP 659 N 7.08 0.00 0.00 5.89 4.06 -1.87 0.75 115.95 131.86 2i03 h TRP 659 Ca -0.35 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.60 2i03 h TRP 659 Cb 1.19 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.35 2i03 h TRP 659 CO 0.20 0.00 0.00 0.39 -3.56 0.00 0.00 178.44 175.47 2i03 n GLU 660 N -3.44 0.25 0.04 0.49 1.02 -1.26 -2.47 120.64 115.27 2i03 n GLU 660 Ca 0.03 0.11 0.06 0.00 -0.02 0.00 0.00 57.16 57.34 2i03 n GLU 660 Cb 0.46 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.30 2i03 n GLU 660 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2i03 n TYR 661 N -1.30 0.71 -2.50 -0.32 4.01 0.26 -3.88 117.16 114.14 2i03 n TYR 661 Ca 0.09 0.22 -0.24 0.00 -0.16 0.00 0.00 57.90 57.81 2i03 n TYR 661 Cb 0.15 -0.92 0.04 0.00 -0.31 0.00 0.00 39.34 38.31 2i03 n TYR 661 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 2i03 s TYR 662 N -3.18 3.02 0.61 -0.72 5.04 -1.03 -4.82 117.35 116.26 2i03 s TYR 662 Ca -0.04 0.31 -0.18 0.00 -2.44 0.00 0.00 57.07 54.73 2i03 s TYR 662 Cb 0.10 -2.83 -0.03 0.00 0.35 0.00 0.00 41.96 39.56 2i03 s TYR 662 CO 0.82 -0.96 1.20 0.16 -1.34 0.00 0.00 175.55 175.44 2i03 s ASP 663 N -4.40 5.11 0.08 4.32 1.47 -1.26 -0.92 116.67 121.08 2i03 s ASP 663 Ca 0.56 2.37 -0.33 0.00 1.18 0.00 0.00 52.55 56.33 2i03 s ASP 663 Cb -0.10 -2.60 -0.17 0.00 -0.34 0.00 0.00 42.92 39.71 2i03 s ASP 663 CO 0.42 -1.65 1.61 0.77 0.68 0.00 0.00 175.17 177.00 2i03 h SER 664 N 0.75 -0.90 -0.84 2.11 4.64 -1.02 -2.11 113.55 116.19 2i03 h SER 664 Ca -0.50 0.05 0.20 0.00 -0.47 0.00 0.00 61.79 61.07 2i03 h SER 664 Cb 1.29 0.27 -0.12 0.00 -0.31 0.00 0.00 62.40 63.53 2i03 h SER 664 CO 0.55 -0.56 0.28 0.58 -0.87 0.00 0.00 176.83 176.81 2i03 h VAL 665 N -0.88 0.46 0.02 0.95 2.07 -1.94 0.97 116.25 117.90 2i03 h VAL 665 Ca -0.07 -0.11 -0.04 0.00 0.82 0.00 0.00 66.70 67.31 2i03 h VAL 665 Cb 0.72 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2i03 h VAL 665 CO 0.06 0.06 -0.19 0.22 0.02 0.00 0.00 177.57 177.74 2i03 h TYR 666 N 0.32 0.07 0.26 1.57 5.03 -1.93 -3.28 116.97 119.00 2i03 h TYR 666 Ca 0.51 -0.05 -0.01 0.00 2.58 0.00 0.00 58.73 61.76 2i03 h TYR 666 Cb 0.94 -0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.22 2i03 h TYR 666 CO -0.21 1.07 -0.13 1.15 -1.32 0.00 0.00 178.16 178.72 2i03 h THR 667 N -0.92 0.77 -0.27 1.81 2.02 -1.06 -3.10 112.91 112.16 2i03 h THR 667 Ca -0.04 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.93 2i03 h THR 667 Cb 1.10 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 68.39 2i03 h THR 667 CO 0.00 0.05 0.18 -0.33 0.37 0.00 0.00 175.52 175.79 2i03 h GLU 668 N -0.46 0.35 -0.50 6.66 5.08 -0.97 0.60 114.58 125.33 2i03 h GLU 668 Ca -0.04 -0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.45 2i03 h GLU 668 Cb 0.35 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 2i03 h GLU 668 CO 0.06 0.23 0.39 -0.09 -1.00 0.00 0.00 179.01 178.60 2i03 h ARG 669 N 0.36 0.00 0.00 2.33 2.43 -1.60 0.33 114.38 118.24 2i03 h ARG 669 Ca 0.10 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 59.09 2i03 h ARG 669 Cb -0.04 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 2i03 h ARG 669 CO -0.02 0.00 -1.70 0.66 -1.51 0.00 0.00 179.97 177.40 2i03 n TYR 670 N -4.24 0.00 1.01 2.20 4.01 -0.77 -4.64 117.16 114.73 2i03 n TYR 670 Ca 0.09 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.94 2i03 n TYR 670 Cb 0.60 -0.48 0.01 0.00 -0.31 0.00 0.00 39.34 39.16 2i03 n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2i03 n MET 671 N -2.72 0.10 0.00 -0.72 2.81 0.13 0.63 117.12 117.36 2i03 n MET 671 Ca -0.20 -0.07 0.00 0.00 -1.81 0.00 0.00 57.70 55.61 2i03 n MET 671 Cb 0.76 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.77 2i03 n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2i03 n GLY 672 N 1.49 -0.49 3.91 3.03 0.00 0.12 -4.60 105.19 108.63 2i03 n GLY 672 Ca 0.05 -1.10 -0.33 0.00 0.00 0.00 0.00 46.02 44.64 2i03 n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i03 s LEU 673 N 0.00 4.37 -0.03 0.99 1.02 -1.26 -4.17 118.68 119.60 2i03 s LEU 673 Ca 0.00 0.35 -0.06 0.00 0.02 0.00 0.00 54.13 54.45 2i03 s LEU 673 Cb 0.00 -2.69 -0.24 0.00 0.02 0.00 0.00 46.19 43.28 2i03 s LEU 673 CO 0.00 0.24 3.53 -0.81 0.02 0.00 0.00 176.35 179.34 2i03 n PRO 674 N 0.83 2.01 -4.34 1.29 -0.04 -1.26 -1.74 135.00 131.75 2i03 n PRO 674 Ca -0.10 -1.08 -0.26 0.00 -0.04 0.00 0.00 63.50 62.02 2i03 n PRO 674 Cb 0.52 -1.99 -0.10 0.00 -0.04 0.00 0.00 33.50 31.89 2i03 n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2i03 s THR 675 N 0.73 2.93 0.45 0.52 -4.23 -1.26 -4.64 115.64 110.14 2i03 s THR 675 Ca 0.65 -1.83 0.35 0.00 -1.18 0.00 0.00 61.69 59.68 2i03 s THR 675 Cb 0.32 -2.45 0.37 0.00 1.34 0.00 0.00 72.50 72.08 2i03 s THR 675 CO -0.02 -0.15 2.18 1.55 -0.54 0.00 0.00 174.62 177.64 2i03 h PRO 676 N 2.88 0.00 0.00 3.99 0.13 -1.95 0.25 132.00 137.29 2i03 h PRO 676 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2i03 h PRO 676 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2i03 h PRO 676 CO 0.53 0.04 0.00 0.93 -0.23 0.00 0.00 178.00 179.27 2i03 h GLU 677 N 0.00 0.00 0.00 0.86 3.07 -1.95 -3.44 114.58 113.12 2i03 h GLU 677 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2i03 h GLU 677 Cb 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 2i03 h GLU 677 CO 0.01 0.00 0.00 -3.47 -1.40 0.00 0.00 179.01 174.15 2i03 n ASP 678 N -2.91 0.00 -0.58 1.42 -0.08 -0.03 -5.02 116.55 109.35 2i03 n ASP 678 Ca 0.03 0.00 0.06 0.00 -1.51 0.00 0.00 54.79 53.37 2i03 n ASP 678 Cb 0.44 0.00 0.14 0.00 2.34 0.00 0.00 41.12 44.04 2i03 n ASP 678 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 2i03 n ASN 679 N 0.00 1.63 -0.27 1.67 4.05 -0.71 -4.87 115.26 116.76 2i03 n ASN 679 Ca 0.00 -3.23 0.02 0.00 0.45 0.00 0.00 54.58 51.82 2i03 n ASN 679 Cb 0.00 -0.44 0.15 0.00 1.23 0.00 0.00 39.78 40.72 2i03 n ASN 679 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 2i03 h LEU 680 N 0.64 0.58 -0.62 1.20 5.85 -1.36 -2.55 115.31 119.06 2i03 h LEU 680 Ca -0.04 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.80 2i03 h LEU 680 Cb 1.17 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 42.09 2i03 h LEU 680 CO 0.02 0.33 0.31 0.44 -0.34 0.00 0.00 178.44 179.20 2i03 h ASP 681 N 0.70 0.43 0.30 1.25 3.32 -1.89 -0.52 116.42 120.01 2i03 h ASP 681 Ca 0.37 0.04 -0.14 0.00 0.02 0.00 0.00 57.03 57.33 2i03 h ASP 681 Cb 0.36 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 2i03 h ASP 681 CO -0.26 0.28 -0.54 -0.74 -1.72 0.00 0.00 179.24 176.26 2i03 h HIS 682 N 0.58 0.33 -0.99 4.55 2.76 -1.88 -1.38 115.15 119.12 2i03 h HIS 682 Ca 0.28 -0.11 0.08 0.00 -2.20 0.00 0.00 60.37 58.42 2i03 h HIS 682 Cb 0.22 -0.06 -0.07 0.00 1.55 0.00 0.00 27.41 29.05 2i03 h HIS 682 CO -0.10 0.75 0.64 1.88 -1.30 0.00 0.00 177.93 179.79 2i03 h TYR 683 N 0.21 1.16 0.00 5.26 0.05 -0.86 -0.43 116.97 122.35 2i03 h TYR 683 Ca 0.00 0.03 -0.04 0.00 0.05 0.00 0.00 58.73 58.78 2i03 h TYR 683 Cb 1.02 -0.38 -0.01 0.00 1.01 0.00 0.00 36.73 38.38 2i03 h TYR 683 CO 0.02 0.55 -0.18 0.00 -1.05 0.00 0.00 178.16 177.50 2i03 h ARG 684 N 1.09 0.00 0.00 4.88 2.47 -0.73 -3.32 114.38 118.77 2i03 h ARG 684 Ca 0.45 0.00 -0.23 0.00 -1.26 0.00 0.00 59.98 58.94 2i03 h ARG 684 Cb 0.28 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.57 2i03 h ARG 684 CO -0.20 0.18 -1.36 -0.91 0.56 0.00 0.00 179.97 178.25 2i03 h ASN 685 N 0.00 0.00 -0.30 7.04 4.21 -0.23 -3.37 115.58 122.94 2i03 h ASN 685 Ca -0.00 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 57.40 2i03 h ASN 685 Cb 1.14 0.00 -0.06 0.00 -1.12 0.00 0.00 38.32 38.28 2i03 h ASN 685 CO 0.02 0.87 0.13 -1.54 -1.29 0.00 0.00 177.43 175.62 2i03 n SER 686 N -3.11 3.04 -4.84 5.81 3.41 -0.27 -4.93 113.62 112.74 2i03 n SER 686 Ca -0.09 -2.48 -0.36 0.00 -0.26 0.00 0.00 58.87 55.68 2i03 n SER 686 Cb 0.95 -0.60 -0.06 0.00 -0.26 0.00 0.00 64.21 64.24 2i03 n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2i03 s THR 687 N -1.40 4.80 0.27 6.66 -4.23 -1.26 -4.80 115.64 115.67 2i03 s THR 687 Ca 0.20 0.95 -0.01 0.00 -1.18 0.00 0.00 61.69 61.65 2i03 s THR 687 Cb 0.16 -3.77 0.10 0.00 1.34 0.00 0.00 72.50 70.33 2i03 s THR 687 CO 0.05 0.28 1.74 0.58 -0.54 0.00 0.00 174.62 176.73 2i03 h VAL 688 N 2.88 1.25 -0.32 2.29 2.07 -1.34 -3.14 116.25 119.93 2i03 h VAL 688 Ca -0.49 -1.09 0.00 0.00 0.82 0.00 0.00 66.70 65.95 2i03 h VAL 688 Cb 1.20 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 2i03 h VAL 688 CO 0.65 0.37 0.20 0.00 0.02 0.00 0.00 177.57 178.82 2i03 h MET 689 N 0.63 0.43 0.00 1.57 -0.00 -1.91 -1.78 114.93 113.86 2i03 h MET 689 Ca 0.11 -0.03 0.00 0.00 -0.00 0.00 0.00 59.70 59.79 2i03 h MET 689 Cb 0.53 -0.10 0.00 0.00 -0.00 0.00 0.00 31.60 32.03 2i03 h MET 689 CO 0.03 0.29 0.00 -1.13 -0.00 0.00 0.00 176.91 176.10 2i03 n SER 690 N -4.48 0.00 -0.69 -0.10 3.41 -1.19 -1.63 113.62 108.94 2i03 n SER 690 Ca 0.02 0.35 0.06 0.00 -0.26 0.00 0.00 58.87 59.05 2i03 n SER 690 Cb 0.07 -0.42 0.18 0.00 -0.26 0.00 0.00 64.21 63.79 2i03 n SER 690 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2i03 n ARG 691 N -1.42 2.88 -0.28 4.33 1.74 -0.67 -4.72 116.66 118.52 2i03 n ARG 691 Ca 0.04 -2.31 0.07 0.00 -0.77 0.00 0.00 57.85 54.88 2i03 n ARG 691 Cb 0.13 -1.46 0.22 0.00 -1.02 0.00 0.00 32.46 30.32 2i03 n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2i03 h ALA 692 N 1.84 1.20 -0.70 7.54 0.00 -1.36 -2.46 119.26 125.32 2i03 h ALA 692 Ca 0.00 0.11 0.13 0.00 0.00 0.00 0.00 54.91 55.14 2i03 h ALA 692 Cb 0.97 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.72 2i03 h ALA 692 CO 0.08 -0.17 0.25 1.49 0.00 0.00 0.00 179.25 180.90 2i03 h GLU 693 N 0.52 0.38 0.00 0.00 4.57 -1.84 -1.77 114.58 116.44 2i03 h GLU 693 Ca 0.45 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.61 2i03 h GLU 693 Cb 0.68 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 29.19 2i03 h GLU 693 CO -0.40 0.25 0.00 0.09 -1.18 0.00 0.00 179.01 177.78 2i03 n ASN 694 N -5.03 0.00 0.06 1.04 5.03 -0.92 -2.80 115.26 112.63 2i03 n ASN 694 Ca 0.12 0.00 0.12 0.00 0.87 0.00 0.00 54.58 55.69 2i03 n ASN 694 Cb 0.37 -0.22 0.47 0.00 -1.02 0.00 0.00 39.78 39.39 2i03 n ASN 694 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 2i03 n PHE 695 N -1.22 0.46 0.30 3.10 3.01 -0.67 -2.95 117.46 119.50 2i03 n PHE 695 Ca 0.06 0.15 0.17 0.00 1.01 0.00 0.00 57.45 58.84 2i03 n PHE 695 Cb 0.08 -0.74 0.97 0.00 -0.01 0.00 0.00 39.48 39.78 2i03 n PHE 695 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 2i03 h LYS 696 N 0.00 0.00 -0.00 -1.08 1.57 -1.72 -1.91 116.57 113.42 2i03 h LYS 696 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2i03 h LYS 696 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 2i03 h LYS 696 CO 0.00 0.01 -0.17 1.04 -0.57 0.00 0.00 179.45 179.76 2i03 n GLN 697 N -3.67 0.61 -4.20 3.15 1.13 -1.15 -4.93 117.38 108.31 2i03 n GLN 697 Ca -0.03 -0.26 -0.12 0.00 -1.94 0.00 0.00 57.00 54.66 2i03 n GLN 697 Cb 0.09 -1.49 -0.10 0.00 0.11 0.00 0.00 30.24 28.85 2i03 n GLN 697 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 2i03 s VAL 698 N -2.57 0.47 -0.23 5.09 -7.23 -0.72 -4.94 120.40 110.28 2i03 s VAL 698 Ca 0.25 -1.95 -0.15 0.00 -1.81 0.00 0.00 61.98 58.32 2i03 s VAL 698 Cb 0.20 -2.07 -0.04 0.00 0.56 0.00 0.00 36.38 35.03 2i03 s VAL 698 CO 0.51 -0.50 0.37 -1.61 -0.31 0.00 0.00 175.10 173.56 2i03 s GLU 699 N -3.96 4.12 -0.05 4.82 2.02 -0.67 -4.97 118.70 120.01 2i03 s GLU 699 Ca 0.23 0.10 0.04 0.00 0.02 0.00 0.00 54.97 55.36 2i03 s GLU 699 Cb 0.07 -3.57 0.00 0.00 0.10 0.00 0.00 34.13 30.73 2i03 s GLU 699 CO 0.03 -0.10 -0.16 -0.47 0.02 0.00 0.00 175.26 174.58 2i03 s TYR 700 N 1.51 1.67 -0.19 1.61 5.04 -1.26 -1.68 117.35 124.05 2i03 s TYR 700 Ca 0.17 -0.53 -0.00 0.00 -2.44 0.00 0.00 57.07 54.27 2i03 s TYR 700 Cb -0.15 -1.15 0.01 0.00 0.35 0.00 0.00 41.96 41.03 2i03 s TYR 700 CO 0.08 -0.21 -0.16 -1.17 -1.34 0.00 0.00 175.55 172.75 2i03 s LEU 701 N 0.22 2.33 -0.19 6.97 0.20 -0.69 -0.23 118.68 127.29 2i03 s LEU 701 Ca -0.08 -0.57 -0.04 0.00 0.69 0.00 0.00 54.13 54.13 2i03 s LEU 701 Cb -0.13 -1.55 -0.02 0.00 -0.43 0.00 0.00 46.19 44.07 2i03 s LEU 701 CO 0.03 0.00 -0.04 -0.22 -0.29 0.00 0.00 176.35 175.83 2i03 s LEU 702 N 1.28 3.01 -0.00 -0.68 0.20 -0.01 -1.04 118.68 121.44 2i03 s LEU 702 Ca 0.04 -0.30 0.04 0.00 0.69 0.00 0.00 54.13 54.61 2i03 s LEU 702 Cb -0.14 -1.75 -0.01 0.00 -0.43 0.00 0.00 46.19 43.87 2i03 s LEU 702 CO -0.09 0.06 -0.14 -0.63 -0.29 0.00 0.00 176.35 175.25 2i03 s ILE 703 N 1.02 1.10 -0.25 6.68 1.01 -0.20 -1.12 121.20 129.44 2i03 s ILE 703 Ca 0.01 -0.66 -0.25 0.00 0.00 0.00 0.00 60.65 59.75 2i03 s ILE 703 Cb -0.15 -0.93 0.07 0.00 0.01 0.00 0.00 42.46 41.46 2i03 s ILE 703 CO 0.00 0.27 0.70 -2.28 0.00 0.00 0.00 174.94 173.62 2i03 s HIS 704 N -0.40 -0.76 0.14 3.97 2.46 -0.95 -0.10 115.29 119.65 2i03 s HIS 704 Ca 0.05 1.82 -0.27 0.00 0.47 0.00 0.00 55.06 57.12 2i03 s HIS 704 Cb -0.06 0.27 -0.07 0.00 -0.13 0.00 0.00 32.58 32.59 2i03 s HIS 704 CO -0.00 -0.38 0.86 0.20 -2.47 0.00 0.00 174.74 172.94 2i03 s GLY 705 N 0.26 2.96 0.49 1.59 0.00 -1.26 -1.60 107.32 109.76 2i03 s GLY 705 Ca -0.01 0.45 0.26 0.00 0.00 0.00 0.00 44.72 45.43 2i03 s GLY 705 CO 0.02 1.14 1.98 -0.91 0.00 0.00 0.00 173.10 175.33 2i03 h THR 706 N 3.66 0.57 -0.73 0.90 1.35 -1.19 -2.95 112.91 114.51 2i03 h THR 706 Ca -0.45 -0.76 -0.36 0.00 -0.55 0.00 0.00 66.41 64.28 2i03 h THR 706 Cb 1.21 1.51 -0.22 0.00 -1.73 0.00 0.00 68.15 68.91 2i03 h THR 706 CO 0.69 0.16 0.35 0.00 -0.25 0.00 0.00 175.52 176.47 2i03 n ALA 707 N -2.26 5.01 -2.21 6.62 0.00 -0.45 -4.69 120.51 122.52 2i03 n ALA 707 Ca -0.01 -2.93 -0.43 0.00 0.00 0.00 0.00 53.44 50.07 2i03 n ALA 707 Cb 0.31 -1.16 -0.02 0.00 0.00 0.00 0.00 19.45 18.58 2i03 n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2i03 s ASP 708 N -1.74 6.61 0.01 0.00 -1.08 -1.12 -4.24 116.67 115.12 2i03 s ASP 708 Ca 0.52 1.69 0.23 0.00 -0.52 0.00 0.00 52.55 54.47 2i03 s ASP 708 Cb 0.45 -2.53 0.09 0.00 -1.46 0.00 0.00 42.92 39.46 2i03 s ASP 708 CO 0.07 -1.05 1.10 -0.90 0.52 0.00 0.00 175.17 174.91 2i03 n ASP 709 N 7.64 0.71 -0.02 -0.34 5.75 -1.26 -3.90 116.55 125.12 2i03 n ASP 709 Ca 0.17 -0.52 -0.02 0.00 -0.01 0.00 0.00 54.79 54.41 2i03 n ASP 709 Cb 0.45 0.71 -0.01 0.00 -1.03 0.00 0.00 41.12 41.25 2i03 n ASP 709 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2i03 n ASN 710 N -1.63 0.56 -4.21 -1.12 2.85 -1.26 -4.75 115.26 105.70 2i03 n ASN 710 Ca 0.04 0.28 -0.40 0.00 -0.11 0.00 0.00 54.58 54.39 2i03 n ASN 710 Cb 0.36 -0.60 -0.10 0.00 1.24 0.00 0.00 39.78 40.69 2i03 n ASN 710 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2i03 s VAL 711 N -1.44 4.01 0.50 3.44 1.01 -1.26 -4.80 120.40 121.86 2i03 s VAL 711 Ca -0.06 -1.72 -0.23 0.00 0.00 0.00 0.00 61.98 59.97 2i03 s VAL 711 Cb 0.01 -3.60 -0.07 0.00 0.00 0.00 0.00 36.38 32.72 2i03 s VAL 711 CO 0.09 -0.67 1.38 1.41 0.00 0.00 0.00 175.10 177.31 2i03 n HIS 712 N 4.85 2.45 0.07 5.22 8.25 -1.25 -4.66 115.22 130.14 2i03 n HIS 712 Ca -0.08 0.44 0.21 0.00 -0.26 0.00 0.00 57.72 58.03 2i03 n HIS 712 Cb 0.41 -2.40 0.73 0.00 1.12 0.00 0.00 29.99 29.85 2i03 n HIS 712 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 2i03 h PHE 713 N 1.81 0.00 -0.78 4.41 3.57 -1.78 -0.39 116.94 123.78 2i03 h PHE 713 Ca -0.51 0.00 0.18 0.00 3.53 0.00 0.00 57.97 61.17 2i03 h PHE 713 Cb 1.29 0.00 -0.12 0.00 2.79 0.00 0.00 35.95 39.91 2i03 h PHE 713 CO 0.47 0.00 0.22 0.37 -2.23 0.00 0.00 178.31 177.14 2i03 h GLN 714 N 0.00 0.28 -0.90 1.11 4.15 -1.93 -0.67 115.11 117.14 2i03 h GLN 714 Ca 0.21 -0.02 0.08 0.00 0.77 0.00 0.00 58.65 59.69 2i03 h GLN 714 Cb 1.19 -0.06 -0.06 0.00 0.21 0.00 0.00 27.48 28.76 2i03 h GLN 714 CO -0.00 0.18 0.58 1.96 -1.93 0.00 0.00 178.83 179.62 2i03 h GLN 715 N 0.29 0.94 0.05 1.69 4.20 -1.37 -1.42 115.11 119.49 2i03 h GLN 715 Ca 0.45 -0.06 -0.25 0.00 0.06 0.00 0.00 58.65 58.86 2i03 h GLN 715 Cb 0.81 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.36 2i03 h GLN 715 CO -0.53 0.62 -1.19 0.77 -0.67 0.00 0.00 178.83 177.83 2i03 h SER 716 N 0.97 0.18 -0.47 1.46 0.02 -1.43 -2.93 113.55 111.34 2i03 h SER 716 Ca 0.40 -0.21 0.06 0.00 -0.84 0.00 0.00 61.79 61.21 2i03 h SER 716 Cb 0.29 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 2i03 h SER 716 CO -0.16 1.16 0.32 0.00 -1.14 0.00 0.00 176.83 177.01 2i03 h ALA 717 N 0.81 1.94 0.01 3.77 0.00 -0.34 -0.76 119.26 124.68 2i03 h ALA 717 Ca -0.09 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.57 2i03 h ALA 717 Cb 1.88 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 19.54 2i03 h ALA 717 CO 0.15 -0.02 -1.16 1.96 0.00 0.00 0.00 179.25 180.18 2i03 h GLN 718 N 0.39 0.01 -0.08 0.00 1.08 -1.28 -2.67 115.11 112.56 2i03 h GLN 718 Ca 0.21 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.37 2i03 h GLN 718 Cb 0.32 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.75 2i03 h GLN 718 CO -0.05 0.91 -0.00 0.82 -0.95 0.00 0.00 178.83 179.55 2i03 h ILE 719 N 0.00 1.26 -0.58 2.54 2.04 -1.09 -2.20 117.51 119.48 2i03 h ILE 719 Ca -0.07 -0.81 -0.07 0.00 1.00 0.00 0.00 64.86 64.91 2i03 h ILE 719 Cb 1.83 1.65 -0.02 0.00 -0.74 0.00 0.00 36.82 39.54 2i03 h ILE 719 CO 0.12 0.22 0.09 0.77 0.00 0.00 0.00 178.15 179.36 2i03 h SER 720 N -0.16 0.92 -0.77 1.72 4.64 -1.28 -1.27 113.55 117.35 2i03 h SER 720 Ca 0.02 -0.26 0.02 0.00 -0.47 0.00 0.00 61.79 61.10 2i03 h SER 720 Cb 0.35 -0.24 -0.04 0.00 -0.31 0.00 0.00 62.40 62.16 2i03 h SER 720 CO 0.00 0.95 0.51 0.50 -0.87 0.00 0.00 176.83 177.92 2i03 h LYS 721 N 0.86 0.98 -0.38 4.77 3.64 -1.46 0.16 116.57 125.15 2i03 h LYS 721 Ca 0.18 -0.06 -0.13 0.00 -1.27 0.00 0.00 60.65 59.37 2i03 h LYS 721 Cb 0.42 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 2i03 h LYS 721 CO 0.01 0.65 -0.27 0.00 -2.27 0.00 0.00 179.45 177.57 2i03 h ALA 722 N 1.53 0.54 -0.54 5.00 0.00 -1.01 -0.80 119.26 123.98 2i03 h ALA 722 Ca 0.29 -0.40 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 2i03 h ALA 722 Cb -0.06 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2i03 h ALA 722 CO -0.07 0.56 0.02 -0.07 0.00 0.00 0.00 179.25 179.68 2i03 h LEU 723 N 0.65 0.88 -0.33 0.00 3.38 -0.45 -2.51 115.31 116.93 2i03 h LEU 723 Ca 0.07 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.74 2i03 h LEU 723 Cb 0.85 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2i03 h LEU 723 CO 0.07 0.93 -0.13 0.58 0.09 0.00 0.00 178.44 179.99 2i03 h VAL 724 N 0.85 1.29 0.00 1.22 2.07 -0.60 0.03 116.25 121.10 2i03 h VAL 724 Ca 0.16 -1.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.46 2i03 h VAL 724 Cb 0.48 1.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.63 2i03 h VAL 724 CO 0.02 0.39 -0.05 0.44 0.02 0.00 0.00 177.57 178.39 2i03 h ASP 725 N 0.43 0.00 -0.20 0.57 3.32 -0.91 -2.01 116.42 117.62 2i03 h ASP 725 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 2i03 h ASP 725 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.19 2i03 h ASP 725 CO 0.04 0.05 0.00 0.55 -1.72 0.00 0.00 179.24 178.16 2i03 n VAL 726 N -3.49 0.28 -2.33 -1.35 3.14 -0.97 -4.99 118.33 108.63 2i03 n VAL 726 Ca -0.02 -0.64 -0.07 0.00 -2.96 0.00 0.00 64.34 60.65 2i03 n VAL 726 Cb 0.17 1.17 0.00 0.00 -1.06 0.00 0.00 33.84 34.12 2i03 n VAL 726 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2i03 n GLY 727 N 1.21 0.20 3.67 7.55 0.00 -0.76 -4.99 105.19 112.08 2i03 n GLY 727 Ca 0.15 -0.55 -0.36 0.00 0.00 0.00 0.00 46.02 45.26 2i03 n GLY 727 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2i03 s VAL 728 N -2.55 5.36 -0.06 1.61 1.01 -0.04 -5.04 120.40 120.69 2i03 s VAL 728 Ca 0.05 0.21 -0.24 0.00 0.00 0.00 0.00 61.98 62.00 2i03 s VAL 728 Cb -0.02 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 2i03 s VAL 728 CO 0.06 0.35 0.73 -0.62 0.00 0.00 0.00 175.10 175.62 2i03 s ASP 729 N 1.00 7.02 0.32 3.32 2.15 -1.26 -4.52 116.67 124.69 2i03 s ASP 729 Ca 0.08 1.22 0.06 0.00 0.43 0.00 0.00 52.55 54.34 2i03 s ASP 729 Cb -0.13 -2.43 -0.02 0.00 -0.30 0.00 0.00 42.92 40.04 2i03 s ASP 729 CO 0.04 -0.13 0.30 2.22 -0.17 0.00 0.00 175.17 177.43 2i03 n PHE 730 N 3.83 -0.87 -4.34 -5.34 -1.74 -1.26 -4.76 117.46 102.97 2i03 n PHE 730 Ca -0.01 -2.58 -0.30 0.00 -0.56 0.00 0.00 57.45 54.01 2i03 n PHE 730 Cb 0.51 0.32 -0.11 0.00 1.52 0.00 0.00 39.48 41.72 2i03 n PHE 730 CO 0.00 0.00 0.00 -0.65 -0.56 0.00 0.00 176.76 175.55 2i03 s GLN 731 N -3.18 1.93 0.18 3.97 -1.52 0.68 -5.01 119.66 116.70 2i03 s GLN 731 Ca 0.36 -1.10 -0.07 0.00 -1.95 0.00 0.00 55.36 52.60 2i03 s GLN 731 Cb 0.01 -2.18 -0.02 0.00 -0.22 0.00 0.00 33.01 30.60 2i03 s GLN 731 CO 0.25 0.50 0.25 0.00 -0.25 0.00 0.00 175.29 176.04 2i03 s ALA 732 N -1.13 0.33 -0.29 6.09 0.00 -1.26 -0.83 121.76 124.67 2i03 s ALA 732 Ca 0.18 -1.14 -0.14 0.00 0.00 0.00 0.00 51.96 50.86 2i03 s ALA 732 Cb -0.11 1.00 0.13 0.00 0.00 0.00 0.00 23.12 24.14 2i03 s ALA 732 CO 0.10 -0.65 0.80 1.41 0.00 0.00 0.00 175.76 177.43 2i03 s MET 733 N -4.03 0.51 0.05 0.00 0.00 -0.28 -4.91 119.30 110.65 2i03 s MET 733 Ca 0.23 1.06 0.03 0.00 0.00 0.00 0.00 55.69 57.02 2i03 s MET 733 Cb 0.04 0.39 -0.04 0.00 0.00 0.00 0.00 34.83 35.22 2i03 s MET 733 CO 0.04 -0.14 0.01 1.67 0.00 0.00 0.00 175.02 176.60 2i03 s TRP 734 N 2.08 3.05 -0.34 4.11 -2.14 -1.26 -2.25 118.94 122.19 2i03 s TRP 734 Ca -0.07 0.03 0.01 0.00 2.66 0.00 0.00 56.10 58.72 2i03 s TRP 734 Cb -0.07 -1.60 0.08 0.00 -3.10 0.00 0.00 33.47 28.78 2i03 s TRP 734 CO -0.18 0.48 0.05 0.71 -2.66 0.00 0.00 176.95 175.35 2i03 s TYR 735 N -1.22 3.52 0.18 1.66 2.02 -0.62 -4.95 117.35 117.93 2i03 s TYR 735 Ca 0.23 -2.46 -0.32 0.00 -0.37 0.00 0.00 57.07 54.16 2i03 s TYR 735 Cb -0.12 -2.65 -0.11 0.00 -0.40 0.00 0.00 41.96 38.68 2i03 s TYR 735 CO 0.15 -0.91 1.60 0.95 -1.57 0.00 0.00 175.55 175.77 2i03 s THR 736 N 1.08 2.47 0.00 -0.71 -4.23 -1.26 -1.38 115.64 111.61 2i03 s THR 736 Ca 0.03 0.34 0.00 0.00 -1.18 0.00 0.00 61.69 60.88 2i03 s THR 736 Cb -0.20 -3.22 0.00 0.00 1.34 0.00 0.00 72.50 70.42 2i03 s THR 736 CO -0.05 0.03 0.00 0.47 -0.54 0.00 0.00 174.62 174.53 2i03 n ASP 737 N 3.87 -2.79 -4.81 3.99 8.00 -1.26 -4.88 116.55 118.66 2i03 n ASP 737 Ca 0.14 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.27 2i03 n ASP 737 Cb 0.38 -1.88 -0.06 0.00 -0.02 0.00 0.00 41.12 39.54 2i03 n ASP 737 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2i03 s GLU 738 N -0.90 4.24 0.00 -1.24 0.41 -1.05 -4.65 118.70 115.51 2i03 s GLU 738 Ca 0.00 0.81 0.00 0.00 -0.41 0.00 0.00 54.97 55.37 2i03 s GLU 738 Cb 0.00 -3.07 0.00 0.00 -1.78 0.00 0.00 34.13 29.28 2i03 s GLU 738 CO 0.00 0.52 0.00 -0.40 -0.49 0.00 0.00 175.26 174.89 2i03 n ASP 739 N 1.22 0.00 0.25 -0.19 5.68 -1.26 -1.34 116.55 120.90 2i03 n ASP 739 Ca -0.06 0.00 0.10 0.00 -0.50 0.00 0.00 54.79 54.33 2i03 n ASP 739 Cb 0.51 0.00 0.66 0.00 -1.14 0.00 0.00 41.12 41.15 2i03 n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 2i03 h HIS 740 N 0.00 0.00 0.00 2.11 -0.00 -1.92 -2.91 115.15 112.43 2i03 h HIS 740 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 60.37 60.21 2i03 h HIS 740 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 27.38 2i03 h HIS 740 CO 0.00 0.14 -1.02 0.78 -0.00 0.00 0.00 177.93 177.83 2i03 h GLY 741 N 0.74 0.00 -6.63 5.26 0.00 -1.98 -3.47 103.07 96.98 2i03 h GLY 741 Ca -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 2i03 h GLY 741 CO 0.02 0.00 -0.89 1.39 0.00 0.00 0.00 176.54 177.06 2i03 n ILE 742 N -3.11 -2.36 0.81 2.60 5.41 -1.10 -4.85 119.36 116.76 2i03 n ILE 742 Ca -0.04 -0.40 0.10 0.00 1.00 0.00 0.00 62.75 63.41 2i03 n ILE 742 Cb 0.83 -2.22 0.10 0.00 -0.71 0.00 0.00 39.64 37.64 2i03 n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2i03 n ALA 743 N -4.42 2.46 -1.74 -1.39 0.00 -1.26 -3.63 120.51 110.53 2i03 n ALA 743 Ca -0.24 -0.70 -0.40 0.00 0.00 0.00 0.00 53.44 52.10 2i03 n ALA 743 Cb 0.65 -0.71 0.02 0.00 0.00 0.00 0.00 19.45 19.41 2i03 n ALA 743 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2i03 n SER 744 N 1.19 2.97 -0.32 0.00 3.41 -1.26 -4.69 113.62 114.92 2i03 n SER 744 Ca 0.13 1.09 0.01 0.00 -0.26 0.00 0.00 58.87 59.84 2i03 n SER 744 Cb 0.53 -1.57 0.08 0.00 -0.26 0.00 0.00 64.21 62.99 2i03 n SER 744 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 2i03 h SER 745 N 2.08 -1.03 -0.26 4.04 0.87 -2.00 0.58 113.55 117.83 2i03 h SER 745 Ca -0.50 0.27 -0.09 0.00 -1.23 0.00 0.00 61.79 60.24 2i03 h SER 745 Cb 1.28 0.61 -0.01 0.00 -0.44 0.00 0.00 62.40 63.85 2i03 h SER 745 CO 0.60 -0.29 -0.20 0.71 -0.53 0.00 0.00 176.83 177.11 2i03 h THR 746 N -0.02 1.31 -0.58 2.23 1.35 -1.98 -2.84 112.91 112.37 2i03 h THR 746 Ca 0.38 -1.34 -0.08 0.00 -0.55 0.00 0.00 66.41 64.82 2i03 h THR 746 Cb 0.62 1.60 -0.02 0.00 -1.73 0.00 0.00 68.15 68.62 2i03 h THR 746 CO -0.90 0.42 0.05 0.00 -0.25 0.00 0.00 175.52 174.84 2i03 h ALA 747 N 0.70 0.99 -0.34 6.62 0.00 -1.71 -1.95 119.26 123.56 2i03 h ALA 747 Ca 0.05 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.73 2i03 h ALA 747 Cb 0.75 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2i03 h ALA 747 CO 0.05 0.63 0.10 1.25 0.00 0.00 0.00 179.25 181.28 2i03 h HIS 748 N 0.91 0.17 -0.22 0.00 2.76 -0.90 0.09 115.15 117.96 2i03 h HIS 748 Ca 0.18 0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.27 2i03 h HIS 748 Cb 0.46 -0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.38 2i03 h HIS 748 CO 0.03 0.06 -0.29 1.96 -1.30 0.00 0.00 177.93 178.39 2i03 h GLN 749 N 0.23 0.43 -0.21 5.26 4.20 -1.32 -2.98 115.11 120.71 2i03 h GLN 749 Ca 0.16 -0.17 -0.14 0.00 0.06 0.00 0.00 58.65 58.55 2i03 h GLN 749 Cb 0.15 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.91 2i03 h GLN 749 CO -0.18 0.68 -0.43 1.25 -0.67 0.00 0.00 178.83 179.48 2i03 h HIS 750 N 0.37 0.84 -0.50 2.96 2.76 -0.71 -2.29 115.15 118.59 2i03 h HIS 750 Ca 0.05 -0.31 -0.11 0.00 -2.20 0.00 0.00 60.37 57.80 2i03 h HIS 750 Cb 0.70 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.49 2i03 h HIS 750 CO 0.02 1.08 -0.13 0.97 -1.30 0.00 0.00 177.93 178.57 2i03 h ILE 751 N 0.37 1.27 -0.04 6.26 2.10 -0.98 -0.66 117.51 125.82 2i03 h ILE 751 Ca 0.01 -1.28 -0.16 0.00 1.08 0.00 0.00 64.86 64.51 2i03 h ILE 751 Cb 1.03 1.06 -0.01 0.00 -1.09 0.00 0.00 36.82 37.81 2i03 h ILE 751 CO 0.10 0.45 -0.67 1.88 -1.08 0.00 0.00 178.15 178.82 2i03 h TYR 752 N 0.83 0.25 -0.42 2.19 0.05 -1.61 -0.50 116.97 117.77 2i03 h TYR 752 Ca 0.12 -0.11 -0.14 0.00 0.05 0.00 0.00 58.73 58.65 2i03 h TYR 752 Cb 0.70 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 38.39 2i03 h TYR 752 CO 0.05 0.80 -0.30 1.15 -1.05 0.00 0.00 178.16 178.81 2i03 h THR 753 N 0.13 1.27 -0.55 -2.88 2.02 -1.28 -1.10 112.91 110.52 2i03 h THR 753 Ca -0.01 -1.47 -0.11 0.00 0.77 0.00 0.00 66.41 65.58 2i03 h THR 753 Cb 1.21 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 68.89 2i03 h THR 753 CO 0.10 0.50 -0.10 -0.74 0.37 0.00 0.00 175.52 175.65 2i03 h HIS 754 N 0.77 1.16 -0.19 3.16 -0.00 -0.99 -2.43 115.15 116.64 2i03 h HIS 754 Ca 0.08 -0.24 -0.12 0.00 -0.00 0.00 0.00 60.37 60.10 2i03 h HIS 754 Cb 0.89 -0.29 -0.01 0.00 -0.00 0.00 0.00 27.41 28.00 2i03 h HIS 754 CO 0.06 1.06 -0.38 0.52 -0.00 0.00 0.00 177.93 179.19 2i03 h MET 755 N 0.92 0.41 0.17 5.26 2.07 -1.00 -2.56 114.93 120.20 2i03 h MET 755 Ca 0.14 -0.19 -0.01 0.00 -2.07 0.00 0.00 59.70 57.57 2i03 h MET 755 Cb 0.67 -0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.39 2i03 h MET 755 CO 0.05 0.73 -0.08 0.77 1.07 0.00 0.00 176.91 179.45 2i03 h SER 756 N 0.34 -0.20 -0.38 1.22 0.02 -1.03 -1.30 113.55 112.23 2i03 h SER 756 Ca 0.03 -0.02 0.07 0.00 -0.84 0.00 0.00 61.79 61.03 2i03 h SER 756 Cb 0.83 0.05 -0.06 0.00 0.14 0.00 0.00 62.40 63.35 2i03 h SER 756 CO 0.07 -0.11 -0.03 0.45 -1.14 0.00 0.00 176.83 176.07 2i03 h HIS 757 N -0.27 -0.09 -0.18 3.45 3.86 -1.34 0.30 115.15 120.89 2i03 h HIS 757 Ca -0.02 0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.26 2i03 h HIS 757 Cb 0.21 0.10 -0.04 0.00 1.06 0.00 0.00 27.41 28.73 2i03 h HIS 757 CO -0.06 -0.11 -0.09 0.35 0.86 0.00 0.00 177.93 178.89 2i03 h PHE 758 N 0.06 -0.20 0.19 2.45 3.57 -1.27 -1.16 116.94 120.57 2i03 h PHE 758 Ca 0.18 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 2i03 h PHE 758 Cb 0.27 0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.13 2i03 h PHE 758 CO -0.29 -0.14 -0.09 0.82 -2.23 0.00 0.00 178.31 176.39 2i03 h ILE 759 N -0.07 0.89 -0.93 1.41 1.08 -0.71 -0.03 117.51 119.15 2i03 h ILE 759 Ca 0.10 -0.35 0.16 0.00 -0.39 0.00 0.00 64.86 64.38 2i03 h ILE 759 Cb 0.21 1.10 -0.08 0.00 -3.07 0.00 0.00 36.82 34.98 2i03 h ILE 759 CO -0.22 0.08 0.60 0.11 -0.69 0.00 0.00 178.15 178.02 2i03 h LYS 760 N -0.42 0.66 -0.39 2.37 1.57 -0.86 0.29 116.57 119.78 2i03 h LYS 760 Ca -0.03 -0.04 -0.15 0.00 -1.87 0.00 0.00 60.65 58.56 2i03 h LYS 760 Cb 0.32 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 2i03 h LYS 760 CO 0.04 0.43 -0.36 0.37 -0.57 0.00 0.00 179.45 179.37 2i03 h GLN 761 N 0.68 0.92 0.00 3.15 -0.00 -0.94 0.99 115.11 119.91 2i03 h GLN 761 Ca 0.49 -0.47 -0.11 0.00 -0.00 0.00 0.00 58.65 58.56 2i03 h GLN 761 Cb 0.84 0.01 -0.02 0.00 0.00 0.00 0.00 27.48 28.31 2i03 h GLN 761 CO -0.24 1.12 -0.52 0.00 0.00 0.00 0.00 178.83 179.19 2i03 n PHE 763 N -3.68 0.63 1.84 0.00 3.72 0.82 -4.98 117.46 115.82 2i03 n PHE 763 Ca -0.01 0.20 0.15 0.00 -0.05 0.00 0.00 57.45 57.74 2i03 n PHE 763 Cb 0.58 -1.07 0.87 0.00 -0.94 0.00 0.00 39.48 38.92 2i03 n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14