#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 0.07 -2.39 4.33 -4.01 -1.26 -5.00 116.66 108.40 2i03 n ARG 40 Ca 0.00 0.00 -0.25 0.00 -1.04 0.00 0.00 57.85 56.56 2i03 n ARG 40 Cb 0.00 0.00 0.04 0.00 -3.04 0.00 0.00 32.46 29.46 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 -1.32 2.64 0.41 2.89 0.00 -1.25 -4.72 119.74 118.38 2i03 s LYS 41 Ca 0.00 -0.21 0.01 0.00 0.00 0.00 0.00 55.97 55.77 2i03 s LYS 41 Cb 0.00 -2.28 0.08 0.00 0.00 0.00 0.00 37.83 35.63 2i03 s LYS 41 CO 0.00 -0.86 0.56 0.25 0.00 0.00 0.00 175.35 175.30 2i03 n THR 42 N -2.64 0.00 -3.23 3.79 -2.24 -1.26 -0.92 114.28 107.78 2i03 n THR 42 Ca 0.06 -0.96 -0.42 0.00 -2.27 0.00 0.00 64.05 60.45 2i03 n THR 42 Cb 0.59 -1.02 -0.08 0.00 -2.10 0.00 0.00 70.33 67.72 2i03 n THR 42 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2i03 s TYR 43 N -1.57 3.14 0.61 4.78 5.04 -1.26 -4.77 117.35 123.32 2i03 s TYR 43 Ca 0.38 -0.10 0.01 0.00 -2.44 0.00 0.00 57.07 54.91 2i03 s TYR 43 Cb -0.02 -3.05 0.07 0.00 0.35 0.00 0.00 41.96 39.30 2i03 s TYR 43 CO 0.25 -0.71 0.86 0.95 -1.34 0.00 0.00 175.55 175.56 2i03 s THR 44 N 2.44 2.45 0.16 4.34 -4.23 -1.26 -3.91 115.64 115.63 2i03 s THR 44 Ca 0.17 -0.64 -0.13 0.00 -1.18 0.00 0.00 61.69 59.92 2i03 s THR 44 Cb -0.16 -2.81 0.05 0.00 1.34 0.00 0.00 72.50 70.92 2i03 s THR 44 CO 0.15 0.00 1.69 0.25 -0.54 0.00 0.00 174.62 176.17 2i03 h LEU 45 N -0.15 0.78 -0.38 4.79 5.85 -1.97 -2.49 115.31 121.74 2i03 h LEU 45 Ca -0.40 -0.20 0.03 0.00 0.84 0.00 0.00 57.88 58.15 2i03 h LEU 45 Cb 1.29 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.08 2i03 h LEU 45 CO 0.48 0.77 0.18 0.74 -0.34 0.00 0.00 178.44 180.27 2i03 h THR 46 N 0.74 0.97 -0.56 1.05 2.02 -1.97 0.53 112.91 115.68 2i03 h THR 46 Ca 0.17 -0.13 0.10 0.00 0.77 0.00 0.00 66.41 67.33 2i03 h THR 46 Cb 0.27 0.56 -0.08 0.00 -1.74 0.00 0.00 68.15 67.15 2i03 h THR 46 CO -0.01 0.07 0.10 0.44 0.37 0.00 0.00 175.52 176.49 2i03 h ASP 47 N 0.38 -0.03 0.13 4.18 3.32 -1.88 1.04 116.42 123.56 2i03 h ASP 47 Ca 0.16 0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.31 2i03 h ASP 47 Cb 0.08 0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.79 2i03 h ASP 47 CO -0.12 0.00 -0.06 0.22 -1.72 0.00 0.00 179.24 177.56 2i03 h TYR 48 N 0.23 -0.17 -0.03 4.55 3.20 -0.97 0.55 116.97 124.33 2i03 h TYR 48 Ca 0.29 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 62.08 2i03 h TYR 48 Cb 0.42 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 2i03 h TYR 48 CO -0.25 0.03 -0.34 -0.07 -1.64 0.00 0.00 178.16 175.89 2i03 h LEU 49 N -0.33 0.06 -2.20 2.82 3.38 -0.10 -2.76 115.31 116.18 2i03 h LEU 49 Ca -0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2i03 h LEU 49 Cb 0.27 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2i03 h LEU 49 CO 0.03 0.40 0.00 0.29 0.09 0.00 0.00 178.44 179.25 2i03 n LYS 50 N -4.12 2.45 -4.00 1.13 4.76 0.35 -4.96 118.16 113.77 2i03 n LYS 50 Ca -0.02 -2.18 -0.28 0.00 -2.87 0.00 0.00 58.31 52.96 2i03 n LYS 50 Cb 0.39 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 32.05 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 1.42 -0.78 0.21 4.39 4.05 0.11 -4.84 115.26 119.82 2i03 n ASN 51 Ca 0.18 -1.07 0.07 0.00 0.45 0.00 0.00 54.58 54.21 2i03 n ASN 51 Cb 0.60 -2.75 0.43 0.00 1.23 0.00 0.00 39.78 39.29 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 -1.88 0.85 -3.51 -0.44 1.35 -1.63 -3.36 112.91 104.29 2i03 h THR 52 Ca -0.64 -1.24 -0.71 0.00 -0.55 0.00 0.00 66.41 63.26 2i03 h THR 52 Cb 1.38 1.75 -0.33 0.00 -1.73 0.00 0.00 68.15 69.23 2i03 h THR 52 CO 0.62 0.30 -0.35 -0.31 -0.25 0.00 0.00 175.52 175.53 2i03 s TYR 53 N -3.83 3.49 0.03 4.73 2.02 -1.26 -5.07 117.35 117.46 2i03 s TYR 53 Ca -0.01 -2.40 -0.18 0.00 -0.37 0.00 0.00 57.07 54.11 2i03 s TYR 53 Cb 0.12 -3.34 -0.06 0.00 -0.40 0.00 0.00 41.96 38.28 2i03 s TYR 53 CO 0.67 -0.92 0.53 0.50 -1.57 0.00 0.00 175.55 174.76 2i03 s ARG 54 N 0.49 4.16 -0.13 -0.62 6.06 -1.26 -5.07 118.95 122.58 2i03 s ARG 54 Ca 0.13 0.64 -0.14 0.00 -2.50 0.00 0.00 55.73 53.85 2i03 s ARG 54 Cb -0.21 -3.26 -0.05 0.00 0.06 0.00 0.00 34.95 31.50 2i03 s ARG 54 CO -0.04 0.59 0.34 -0.51 -2.50 0.00 0.00 175.30 173.18 2i03 s LEU 55 N -0.87 4.29 0.27 -0.88 1.43 -1.26 -4.76 118.68 116.89 2i03 s LEU 55 Ca 0.28 0.63 -0.14 0.00 -1.03 0.00 0.00 54.13 53.87 2i03 s LEU 55 Cb -0.18 -2.45 -0.08 0.00 0.03 0.00 0.00 46.19 43.50 2i03 s LEU 55 CO 0.17 0.13 0.66 -0.54 0.23 0.00 0.00 176.35 177.00 2i03 s LYS 56 N 0.22 3.97 0.25 1.70 1.02 -1.26 -5.08 119.74 120.55 2i03 s LYS 56 Ca 0.19 0.56 0.00 0.00 0.02 0.00 0.00 55.97 56.74 2i03 s LYS 56 Cb -0.14 -2.58 -0.00 0.00 -0.52 0.00 0.00 37.83 34.59 2i03 s LYS 56 CO 0.06 0.26 0.01 1.28 -0.92 0.00 0.00 175.35 176.04 2i03 n LEU 57 N -0.09 0.00 -3.06 3.17 4.77 -1.26 -4.88 117.00 115.66 2i03 n LEU 57 Ca 0.01 -1.61 -0.15 0.00 -0.03 0.00 0.00 56.01 54.23 2i03 n LEU 57 Cb 0.53 0.23 -0.04 0.00 -2.33 0.00 0.00 43.42 41.81 2i03 n LEU 57 CO 0.43 -0.23 -0.09 0.00 -1.33 0.00 0.00 177.39 176.17 2i03 n TYR 58 N -0.62 -2.47 -3.09 -1.77 4.19 -1.26 -4.94 117.16 107.20 2i03 n TYR 58 Ca -0.10 -2.28 -0.41 0.00 3.31 0.00 0.00 57.90 58.42 2i03 n TYR 58 Cb 0.32 0.91 -0.06 0.00 0.49 0.00 0.00 39.34 41.00 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 0.46 6.48 0.14 2.98 0.01 -1.26 -5.05 113.70 117.47 2i03 s SER 59 Ca 0.31 0.33 0.10 0.00 1.31 0.00 0.00 55.95 58.00 2i03 s SER 59 Cb 0.02 -2.34 -0.04 0.00 0.21 0.00 0.00 66.02 63.87 2i03 s SER 59 CO -0.12 -0.55 -0.23 -1.48 0.41 0.00 0.00 173.24 171.27 2i03 s LEU 60 N 2.70 2.35 -0.25 2.44 0.05 -1.26 -4.38 118.68 120.33 2i03 s LEU 60 Ca 0.26 -0.77 0.02 0.00 0.05 0.00 0.00 54.13 53.69 2i03 s LEU 60 Cb -0.15 -1.02 0.06 0.00 -2.05 0.00 0.00 46.19 43.03 2i03 s LEU 60 CO 0.13 0.09 -0.08 -0.60 -0.55 0.00 0.00 176.35 175.34 2i03 s ARG 61 N -2.25 1.95 0.17 1.48 3.00 0.55 -4.91 118.95 118.94 2i03 s ARG 61 Ca 0.13 -1.22 -0.32 0.00 -1.00 0.00 0.00 55.73 53.32 2i03 s ARG 61 Cb -0.09 -2.77 -0.10 0.00 0.00 0.00 0.00 34.95 31.99 2i03 s ARG 61 CO 0.06 -0.60 1.64 -1.58 0.00 0.00 0.00 175.30 174.82 2i03 s TRP 62 N 1.22 2.90 -0.04 5.12 0.52 -1.26 0.13 118.94 127.52 2i03 s TRP 62 Ca -0.07 0.47 0.14 0.00 0.02 0.00 0.00 56.10 56.66 2i03 s TRP 62 Cb -0.19 -4.01 -0.21 0.00 -1.15 0.00 0.00 33.47 27.91 2i03 s TRP 62 CO -0.06 -3.82 0.26 0.44 0.02 0.00 0.00 176.95 173.79 2i03 n ILE 63 N 4.10 0.17 -2.51 2.03 -5.35 -0.91 -4.90 119.36 111.99 2i03 n ILE 63 Ca 0.15 -0.37 0.00 0.00 -0.27 0.00 0.00 62.75 62.26 2i03 n ILE 63 Cb 0.38 0.02 0.00 0.00 -1.74 0.00 0.00 39.64 38.30 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 -2.09 0.00 -1.14 7.28 3.41 -1.15 -5.01 113.62 114.93 2i03 n SER 64 Ca -0.06 0.00 0.10 0.00 -0.26 0.00 0.00 58.87 58.65 2i03 n SER 64 Cb 0.47 0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.68 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 0.00 3.58 0.00 4.04 2.03 -1.26 -2.22 116.55 122.71 2i03 n ASP 65 Ca 0.00 -1.98 0.00 0.00 0.52 0.00 0.00 54.79 53.33 2i03 n ASP 65 Cb 0.00 -0.36 0.00 0.00 -0.72 0.00 0.00 41.12 40.04 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 1.37 0.00 -4.28 -0.67 8.25 -1.26 -4.62 115.22 114.01 2i03 n HIS 66 Ca 0.20 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.51 2i03 n HIS 66 Cb 0.57 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.58 2i03 n HIS 66 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2i03 s GLU 67 N -0.24 1.14 0.01 -0.41 2.02 -1.26 -1.88 118.70 118.08 2i03 s GLU 67 Ca 0.00 -1.49 -0.14 0.00 0.02 0.00 0.00 54.97 53.36 2i03 s GLU 67 Cb 0.00 -0.76 0.02 0.00 0.10 0.00 0.00 34.13 33.49 2i03 s GLU 67 CO 0.00 0.11 0.29 1.52 0.02 0.00 0.00 175.26 177.19 2i03 s TYR 68 N -3.23 -0.12 -0.15 1.61 -0.85 -0.90 -2.15 117.35 111.56 2i03 s TYR 68 Ca 0.18 0.08 -0.09 0.00 -0.52 0.00 0.00 57.07 56.73 2i03 s TYR 68 Cb 0.02 0.08 -0.05 0.00 0.38 0.00 0.00 41.96 42.39 2i03 s TYR 68 CO 0.02 -0.43 0.16 -0.51 -1.52 0.00 0.00 175.55 173.27 2i03 s LEU 69 N -1.68 4.32 -0.53 -3.49 1.43 0.12 -0.51 118.68 118.34 2i03 s LEU 69 Ca -0.10 0.41 0.04 0.00 -1.03 0.00 0.00 54.13 53.45 2i03 s LEU 69 Cb -0.03 -2.13 0.14 0.00 0.03 0.00 0.00 46.19 44.19 2i03 s LEU 69 CO 0.00 0.30 0.29 -0.47 0.23 0.00 0.00 176.35 176.70 2i03 s TYR 70 N -0.40 2.97 0.48 0.29 5.04 -0.21 -0.33 117.35 125.18 2i03 s TYR 70 Ca 0.13 -3.04 -0.24 0.00 -2.44 0.00 0.00 57.07 51.48 2i03 s TYR 70 Cb -0.12 -2.59 -0.08 0.00 0.35 0.00 0.00 41.96 39.52 2i03 s TYR 70 CO 0.02 -0.72 1.32 1.63 -1.34 0.00 0.00 175.55 176.47 2i03 n LYS 71 N 3.03 1.89 -1.61 4.97 5.02 -1.26 -3.02 118.16 127.18 2i03 n LYS 71 Ca 0.08 0.68 0.00 0.00 -2.02 0.00 0.00 58.31 57.05 2i03 n LYS 71 Cb 0.33 -2.50 0.00 0.00 -0.02 0.00 0.00 35.03 32.84 2i03 n LYS 71 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2i03 n GLN 72 N -0.39 1.80 0.00 1.97 6.02 -1.10 -4.94 117.38 120.73 2i03 n GLN 72 Ca 0.08 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.18 2i03 n GLN 72 Cb 0.42 0.00 0.59 0.00 1.02 0.00 0.00 30.24 32.27 2i03 n GLN 72 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2i03 n GLU 73 N 0.00 0.28 0.07 -1.09 2.13 -1.26 -4.46 120.64 116.32 2i03 n GLU 73 Ca 0.00 0.07 0.00 0.00 0.66 0.00 0.00 57.16 57.89 2i03 n GLU 73 Cb 0.00 -1.50 0.00 0.00 0.27 0.00 0.00 31.44 30.21 2i03 n GLU 73 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2i03 n ASN 74 N -1.33 0.12 -4.35 4.31 3.02 -1.26 -5.11 115.26 110.66 2i03 n ASN 74 Ca 0.10 0.25 -0.26 0.00 -0.03 0.00 0.00 54.58 54.65 2i03 n ASN 74 Cb 0.21 0.13 -0.12 0.00 -0.61 0.00 0.00 39.78 39.38 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 -4.91 2.95 -0.04 6.41 2.20 -1.26 -3.77 114.94 116.52 2i03 s ASN 75 Ca 0.00 -0.77 -0.20 0.00 -0.94 0.00 0.00 52.86 50.95 2i03 s ASN 75 Cb 0.00 -0.19 -0.05 0.00 -2.00 0.00 0.00 41.25 39.02 2i03 s ASN 75 CO 0.00 0.09 0.58 -0.63 -2.94 0.00 0.00 177.10 174.20 2i03 s ILE 76 N -1.39 5.00 0.22 0.54 1.01 -1.10 -2.71 121.20 122.77 2i03 s ILE 76 Ca 0.13 1.20 0.09 0.00 0.00 0.00 0.00 60.65 62.07 2i03 s ILE 76 Cb -0.09 -3.92 -0.04 0.00 0.01 0.00 0.00 42.46 38.42 2i03 s ILE 76 CO 0.06 0.37 -0.00 -0.76 0.00 0.00 0.00 174.94 174.61 2i03 s LEU 77 N 0.14 3.24 -0.18 2.97 1.43 -1.17 -0.12 118.68 124.99 2i03 s LEU 77 Ca 0.31 -0.53 -0.00 0.00 -1.03 0.00 0.00 54.13 52.88 2i03 s LEU 77 Cb -0.17 -1.83 0.01 0.00 0.03 0.00 0.00 46.19 44.23 2i03 s LEU 77 CO 0.16 0.04 -0.15 0.54 0.23 0.00 0.00 176.35 177.17 2i03 s VAL 78 N -2.02 2.53 0.09 -1.59 0.11 -0.37 -1.04 120.40 118.10 2i03 s VAL 78 Ca 0.29 -0.79 0.02 0.00 -2.93 0.00 0.00 61.98 58.57 2i03 s VAL 78 Cb -0.08 -2.09 -0.04 0.00 -1.53 0.00 0.00 36.38 32.65 2i03 s VAL 78 CO 0.19 0.51 0.15 -0.36 -3.33 0.00 0.00 175.10 172.25 2i03 s PHE 79 N 1.18 3.32 -0.42 1.54 0.08 0.34 -1.52 117.98 122.50 2i03 s PHE 79 Ca 0.02 0.13 -0.09 0.00 0.12 0.00 0.00 56.93 57.11 2i03 s PHE 79 Cb -0.14 -1.66 0.08 0.00 -0.57 0.00 0.00 43.02 40.73 2i03 s PHE 79 CO -0.07 0.54 0.27 1.21 -0.10 0.00 0.00 175.22 177.07 2i03 s ASN 80 N -2.56 5.64 0.40 1.36 3.84 -0.28 -2.13 114.94 121.22 2i03 s ASN 80 Ca 0.32 -1.54 0.16 0.00 0.21 0.00 0.00 52.86 52.01 2i03 s ASN 80 Cb -0.12 -1.99 1.04 0.00 -0.55 0.00 0.00 41.25 39.63 2i03 s ASN 80 CO 0.25 -0.55 1.84 0.00 -2.79 0.00 0.00 177.10 175.85 2i03 h ALA 81 N 8.41 2.14 0.76 1.71 0.00 -1.70 1.00 119.26 131.57 2i03 h ALA 81 Ca -0.23 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 2i03 h ALA 81 Cb 1.08 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.85 2i03 h ALA 81 CO 0.76 -0.44 -0.36 1.49 0.00 0.00 0.00 179.25 180.70 2i03 h GLU 82 N 0.46 -0.98 0.01 0.00 4.57 -1.94 -3.36 114.58 113.34 2i03 h GLU 82 Ca 0.50 0.07 -0.35 0.00 -1.18 0.00 0.00 59.36 58.39 2i03 h GLU 82 Cb 1.16 0.22 -0.06 0.00 -0.16 0.00 0.00 28.75 29.92 2i03 h GLU 82 CO -0.21 -0.65 -2.20 0.66 -1.18 0.00 0.00 179.01 175.43 2i03 n TYR 83 N -5.52 0.38 0.00 0.92 4.01 -1.05 -5.00 117.16 110.90 2i03 n TYR 83 Ca -0.14 0.12 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 2i03 n TYR 83 Cb 0.41 -1.06 0.00 0.00 -0.31 0.00 0.00 39.34 38.38 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 1.83 0.52 3.78 2.72 0.00 0.34 -5.05 105.19 109.33 2i03 n GLY 84 Ca -0.31 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.68 6.83 0.30 1.61 4.22 -1.25 -4.68 114.94 119.29 2i03 s ASN 85 Ca 0.00 2.11 0.06 0.00 -2.14 0.00 0.00 52.86 52.89 2i03 s ASN 85 Cb 0.00 -2.60 -0.06 0.00 1.28 0.00 0.00 41.25 39.87 2i03 s ASN 85 CO 0.00 -0.44 -0.02 -0.94 -2.04 0.00 0.00 177.10 173.66 2i03 s SER 86 N -1.40 2.71 -0.12 3.54 1.04 -1.26 -1.12 113.70 117.09 2i03 s SER 86 Ca 0.55 -1.26 -0.07 0.00 0.48 0.00 0.00 55.95 55.65 2i03 s SER 86 Cb -0.25 -0.16 0.05 0.00 0.10 0.00 0.00 66.02 65.76 2i03 s SER 86 CO 0.31 -0.43 0.30 -0.44 0.98 0.00 0.00 173.24 173.96 2i03 s SER 87 N -3.47 -0.34 -0.25 7.02 0.01 -0.58 -4.95 113.70 111.14 2i03 s SER 87 Ca 0.32 0.63 -0.35 0.00 1.31 0.00 0.00 55.95 57.86 2i03 s SER 87 Cb 0.06 0.53 -0.11 0.00 0.21 0.00 0.00 66.02 66.70 2i03 s SER 87 CO 0.13 -0.16 2.04 0.52 0.41 0.00 0.00 173.24 176.18 2i03 n VAL 88 N 4.04 0.34 0.07 3.43 0.31 -1.26 -1.24 118.33 124.02 2i03 n VAL 88 Ca -0.23 -0.20 -0.17 0.00 -0.01 0.00 0.00 64.34 63.72 2i03 n VAL 88 Cb 0.54 -1.75 -0.09 0.00 -0.91 0.00 0.00 33.84 31.63 2i03 n VAL 88 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 2i03 h PHE 89 N 10.98 0.82 -1.60 3.52 3.04 -0.81 -3.46 116.94 129.42 2i03 h PHE 89 Ca -0.38 -0.47 0.10 0.00 3.98 0.00 0.00 57.97 61.20 2i03 h PHE 89 Cb 1.30 -0.08 -0.24 0.00 2.56 0.00 0.00 35.95 39.49 2i03 h PHE 89 CO 0.91 1.30 0.17 -0.48 -2.02 0.00 0.00 178.31 178.19 2i03 s LEU 90 N -7.83 -0.74 0.82 0.59 -0.00 -1.02 -5.02 118.68 105.48 2i03 s LEU 90 Ca -0.08 1.11 -0.14 0.00 -0.00 0.00 0.00 54.13 55.03 2i03 s LEU 90 Cb 0.07 1.98 0.04 0.00 -0.00 0.00 0.00 46.19 48.29 2i03 s LEU 90 CO 0.90 -0.17 0.88 -0.62 -0.00 0.00 0.00 176.35 177.35 2i03 n GLU 91 N 4.46 0.11 0.01 1.48 4.71 -1.26 -2.72 120.64 127.43 2i03 n GLU 91 Ca -0.16 0.10 -0.10 0.00 -0.01 0.00 0.00 57.16 56.99 2i03 n GLU 91 Cb 0.55 -2.18 0.04 0.00 -1.01 0.00 0.00 31.44 28.84 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 -0.91 0.63 0.69 1.62 -1.07 -1.94 -2.95 115.58 111.64 2i03 h ASN 92 Ca -0.45 -0.36 0.00 0.00 0.07 0.00 0.00 56.30 55.56 2i03 h ASN 92 Cb 1.31 -0.18 0.00 0.00 -2.07 0.00 0.00 38.32 37.38 2i03 h ASN 92 CO 0.43 1.08 0.00 -1.54 0.07 0.00 0.00 177.43 177.47 2i03 n SER 93 N -3.93 0.17 0.27 6.14 3.41 -1.26 -3.57 113.62 114.85 2i03 n SER 93 Ca -0.04 0.53 0.17 0.00 -0.26 0.00 0.00 58.87 59.28 2i03 n SER 93 Cb 0.64 -0.57 0.86 0.00 -0.26 0.00 0.00 64.21 64.88 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 0.14 -0.35 6.66 2.02 -1.89 -2.39 112.91 117.10 2i03 h THR 94 Ca 0.00 0.00 -0.26 0.00 0.77 0.00 0.00 66.41 66.92 2i03 h THR 94 Cb 0.34 0.73 -0.36 0.00 -1.74 0.00 0.00 68.15 67.12 2i03 h THR 94 CO 0.00 0.00 -0.97 0.49 0.37 0.00 0.00 175.52 175.41 2i03 n PHE 95 N -3.20 1.14 0.00 3.16 3.72 -1.23 -4.93 117.46 116.12 2i03 n PHE 95 Ca 0.00 -1.71 0.00 0.00 -0.05 0.00 0.00 57.45 55.69 2i03 n PHE 95 Cb 0.38 -0.24 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 2i03 n PHE 95 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2i03 n ASP 96 N -0.42 0.00 -2.85 4.37 8.00 -0.90 -3.27 116.55 121.48 2i03 n ASP 96 Ca 0.16 0.83 -0.28 0.00 0.71 0.00 0.00 54.79 56.21 2i03 n ASP 96 Cb 0.90 -0.33 -0.07 0.00 -0.02 0.00 0.00 41.12 41.60 2i03 n ASP 96 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2i03 n GLU 97 N -1.51 2.92 0.06 -1.24 0.28 -1.26 -4.16 120.64 115.73 2i03 n GLU 97 Ca 0.00 -1.69 0.05 0.00 -0.16 0.00 0.00 57.16 55.36 2i03 n GLU 97 Cb 0.00 -2.48 -0.05 0.00 1.43 0.00 0.00 31.44 30.35 2i03 n GLU 97 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2i03 n PHE 98 N 3.27 0.97 -0.89 -1.84 7.35 -1.20 -4.97 117.46 120.15 2i03 n PHE 98 Ca 0.62 0.30 0.00 0.00 -0.76 0.00 0.00 57.45 57.62 2i03 n PHE 98 Cb 0.44 -1.02 0.00 0.00 0.35 0.00 0.00 39.48 39.25 2i03 n PHE 98 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2i03 n GLY 99 N 1.29 0.73 3.22 7.13 0.00 -1.26 -5.01 105.19 111.29 2i03 n GLY 99 Ca -0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.79 -0.15 -0.41 1.61 3.76 -1.26 -5.12 115.29 110.92 2i03 s HIS 100 Ca 0.00 0.21 -0.22 0.00 -0.15 0.00 0.00 55.06 54.90 2i03 s HIS 100 Cb 0.00 0.08 0.02 0.00 1.11 0.00 0.00 32.58 33.78 2i03 s HIS 100 CO 0.00 -0.38 0.70 0.45 -0.85 0.00 0.00 174.74 174.66 2i03 s SER 101 N -1.34 6.40 -0.14 1.40 0.15 -1.26 -5.03 113.70 113.89 2i03 s SER 101 Ca -0.14 -0.07 -0.29 0.00 0.70 0.00 0.00 55.95 56.15 2i03 s SER 101 Cb -0.06 -2.35 -0.01 0.00 -1.71 0.00 0.00 66.02 61.90 2i03 s SER 101 CO 0.04 -0.76 1.02 -0.63 1.20 0.00 0.00 173.24 174.11 2i03 s ILE 102 N 2.95 4.75 -0.47 6.45 1.01 -1.26 -4.44 121.20 130.19 2i03 s ILE 102 Ca 0.26 2.03 0.23 0.00 0.00 0.00 0.00 60.65 63.18 2i03 s ILE 102 Cb -0.14 -4.31 -0.04 0.00 0.01 0.00 0.00 42.46 37.98 2i03 s ILE 102 CO 0.19 -0.04 1.09 -0.46 0.00 0.00 0.00 174.94 175.71 2i03 n ASN 103 N 5.36 0.68 -3.53 3.58 6.94 -0.30 -4.98 115.26 123.00 2i03 n ASN 103 Ca 0.10 0.07 -0.09 0.00 -0.02 0.00 0.00 54.58 54.64 2i03 n ASN 103 Cb 0.48 0.56 -0.03 0.00 -2.36 0.00 0.00 39.78 38.43 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 -4.50 -0.35 0.52 0.53 2.15 -1.22 -5.05 116.67 108.75 2i03 s ASP 104 Ca 0.02 0.13 0.03 0.00 0.43 0.00 0.00 52.55 53.16 2i03 s ASP 104 Cb 0.13 0.34 0.00 0.00 -0.30 0.00 0.00 42.92 43.09 2i03 s ASP 104 CO 0.78 -0.51 0.15 -0.31 -0.17 0.00 0.00 175.17 175.11 2i03 s TYR 105 N -2.45 1.82 -0.30 -5.34 1.51 -1.26 -1.20 117.35 110.13 2i03 s TYR 105 Ca 0.03 -0.90 -0.06 0.00 -1.01 0.00 0.00 57.07 55.13 2i03 s TYR 105 Cb -0.01 -1.73 0.19 0.00 -0.11 0.00 0.00 41.96 40.30 2i03 s TYR 105 CO -0.05 -0.01 0.89 0.45 -1.11 0.00 0.00 175.55 175.71 2i03 s SER 106 N -4.02 -0.84 -0.05 2.29 0.15 -0.30 -4.90 113.70 106.03 2i03 s SER 106 Ca 0.17 0.20 -0.20 0.00 0.70 0.00 0.00 55.95 56.82 2i03 s SER 106 Cb 0.00 1.57 -0.05 0.00 -1.71 0.00 0.00 66.02 65.84 2i03 s SER 106 CO 0.10 -0.15 0.56 -0.63 1.20 0.00 0.00 173.24 174.32 2i03 s ILE 107 N 2.91 5.04 0.77 6.45 1.01 -1.26 0.83 121.20 136.94 2i03 s ILE 107 Ca 0.17 1.15 -0.13 0.00 0.00 0.00 0.00 60.65 61.84 2i03 s ILE 107 Cb -0.07 -3.90 0.06 0.00 0.01 0.00 0.00 42.46 38.57 2i03 s ILE 107 CO -0.21 0.37 1.16 -0.94 0.00 0.00 0.00 174.94 175.31 2i03 s SER 108 N 0.20 4.08 0.00 3.58 1.04 -0.67 -4.84 113.70 117.10 2i03 s SER 108 Ca 0.30 2.18 0.05 0.00 0.48 0.00 0.00 55.95 58.97 2i03 s SER 108 Cb -0.17 -2.57 0.33 0.00 0.10 0.00 0.00 66.02 63.71 2i03 s SER 108 CO 0.15 -2.33 0.71 -2.65 0.98 0.00 0.00 173.24 170.10 2i03 n PRO 109 N -3.14 0.28 -0.02 4.02 -0.02 -1.22 -1.71 135.00 133.18 2i03 n PRO 109 Ca 0.12 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.43 2i03 n PRO 109 Cb 0.51 -1.31 -0.14 0.00 -0.02 0.00 0.00 33.50 32.54 2i03 n PRO 109 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2i03 n ASP 110 N -0.81 1.65 0.00 2.55 8.00 -1.17 -4.82 116.55 121.96 2i03 n ASP 110 Ca 0.04 0.22 0.00 0.00 0.71 0.00 0.00 54.79 55.76 2i03 n ASP 110 Cb 0.02 -0.50 0.00 0.00 -0.02 0.00 0.00 41.12 40.62 2i03 n ASP 110 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2i03 n GLY 111 N 1.89 1.21 0.17 0.44 0.00 -0.70 -4.88 105.19 103.32 2i03 n GLY 111 Ca -0.29 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.82 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 3.37 0.00 -4.08 1.61 4.20 -1.92 -3.45 115.11 114.84 2i03 h GLN 112 Ca 0.00 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 2i03 h GLN 112 Cb 0.00 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 27.62 2i03 h GLN 112 CO 0.00 0.11 -0.60 -0.06 -0.67 0.00 0.00 178.83 177.61 2i03 s PHE 113 N -3.18 0.39 -0.06 2.96 0.08 -1.26 -1.96 117.98 114.95 2i03 s PHE 113 Ca 0.04 -0.86 0.03 0.00 0.12 0.00 0.00 56.93 56.26 2i03 s PHE 113 Cb 0.07 -0.28 0.01 0.00 -0.57 0.00 0.00 43.02 42.25 2i03 s PHE 113 CO 0.72 -0.39 -0.13 0.42 -0.10 0.00 0.00 175.22 175.74 2i03 s ILE 114 N -3.54 1.15 -0.25 0.64 1.01 -0.67 -1.67 121.20 117.88 2i03 s ILE 114 Ca 0.03 -0.51 -0.12 0.00 0.00 0.00 0.00 60.65 60.05 2i03 s ILE 114 Cb 0.05 -1.04 -0.05 0.00 0.01 0.00 0.00 42.46 41.44 2i03 s ILE 114 CO -0.09 0.35 0.24 -0.22 0.00 0.00 0.00 174.94 175.23 2i03 s LEU 115 N 0.48 4.08 -0.33 2.97 2.96 0.24 -1.29 118.68 127.80 2i03 s LEU 115 Ca -0.11 0.17 -0.10 0.00 -0.22 0.00 0.00 54.13 53.87 2i03 s LEU 115 Cb -0.14 -2.22 0.00 0.00 0.50 0.00 0.00 46.19 44.33 2i03 s LEU 115 CO 0.03 -0.03 0.16 -0.76 -1.32 0.00 0.00 176.35 174.43 2i03 s LEU 116 N 1.47 4.24 -0.18 -0.68 1.43 -0.10 -1.15 118.68 123.70 2i03 s LEU 116 Ca 0.10 -0.67 -0.12 0.00 -1.03 0.00 0.00 54.13 52.41 2i03 s LEU 116 Cb -0.15 -1.99 -0.05 0.00 0.03 0.00 0.00 46.19 44.03 2i03 s LEU 116 CO 0.08 -0.24 0.24 -0.70 0.23 0.00 0.00 176.35 175.95 2i03 s GLU 117 N 1.58 4.23 0.29 1.70 2.12 -0.34 -2.34 118.70 125.94 2i03 s GLU 117 Ca 0.04 -0.02 -0.05 0.00 0.36 0.00 0.00 54.97 55.30 2i03 s GLU 117 Cb -0.18 -3.43 -0.01 0.00 0.26 0.00 0.00 34.13 30.78 2i03 s GLU 117 CO 0.06 0.24 0.41 1.52 -0.54 0.00 0.00 175.26 176.96 2i03 s TYR 118 N 0.48 0.91 -1.46 5.30 1.13 -0.40 -1.15 117.35 122.16 2i03 s TYR 118 Ca 0.13 -1.16 -0.07 0.00 -1.41 0.00 0.00 57.07 54.56 2i03 s TYR 118 Cb -0.12 -0.11 0.01 0.00 -1.10 0.00 0.00 41.96 40.64 2i03 s TYR 118 CO 0.02 -1.01 0.91 0.09 -2.51 0.00 0.00 175.55 173.05 2i03 n ASN 119 N -0.95 -6.25 -4.72 -0.18 3.02 -1.26 0.33 115.26 105.24 2i03 n ASN 119 Ca 0.01 -0.42 -0.42 0.00 -0.03 0.00 0.00 54.58 53.71 2i03 n ASN 119 Cb 0.62 -4.98 -0.03 0.00 -0.61 0.00 0.00 39.78 34.78 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 -3.25 2.94 -0.24 3.10 5.04 -1.26 -4.18 117.35 119.49 2i03 s TYR 120 Ca 0.45 0.41 -0.04 0.00 -2.44 0.00 0.00 57.07 55.45 2i03 s TYR 120 Cb -0.20 -4.10 0.08 0.00 0.35 0.00 0.00 41.96 38.10 2i03 s TYR 120 CO 0.56 -4.12 0.11 0.08 -1.34 0.00 0.00 175.55 170.84 2i03 s VAL 121 N 1.15 -0.04 0.61 3.14 1.01 -0.04 -4.99 120.40 121.24 2i03 s VAL 121 Ca 0.74 -0.54 -0.19 0.00 0.00 0.00 0.00 61.98 61.99 2i03 s VAL 121 Cb -0.48 -0.84 -0.03 0.00 0.00 0.00 0.00 36.38 35.03 2i03 s VAL 121 CO 0.32 -0.54 1.25 -0.75 0.00 0.00 0.00 175.10 175.38 2i03 s LYS 122 N 2.10 2.81 0.00 2.72 2.20 -1.26 -1.64 119.74 126.67 2i03 s LYS 122 Ca 0.06 1.96 0.00 0.00 -0.36 0.00 0.00 55.97 57.63 2i03 s LYS 122 Cb -0.16 -1.92 0.00 0.00 -1.51 0.00 0.00 37.83 34.24 2i03 s LYS 122 CO -0.25 -1.37 0.00 0.94 -0.36 0.00 0.00 175.35 174.31 2i03 n GLN 123 N -1.68 0.00 0.00 4.03 7.27 -0.44 -4.88 117.38 121.69 2i03 n GLN 123 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.21 2i03 n GLN 123 Cb 0.49 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.14 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 -0.10 3.69 5.03 -1.20 -4.96 117.44 119.90 2i03 n TRP 124 Ca 0.00 0.00 -0.13 0.00 3.03 0.00 0.00 57.50 60.40 2i03 n TRP 124 Cb 0.00 0.00 -0.04 0.00 -1.03 0.00 0.00 31.31 30.24 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 0.69 0.00 -0.99 9.65 -1.98 -3.38 114.38 118.36 2i03 h ARG 125 Ca 0.00 -0.35 -0.06 0.00 -1.10 0.00 0.00 59.98 58.47 2i03 h ARG 125 Cb 0.00 0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.57 2i03 h ARG 125 CO 0.00 0.96 -1.25 0.72 2.80 0.00 0.00 179.97 183.19 2i03 n HIS 126 N -4.30 0.00 -2.26 2.20 8.25 -1.26 -5.06 115.22 112.80 2i03 n HIS 126 Ca -0.04 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.08 2i03 n HIS 126 Cb 0.45 -0.18 -0.00 0.00 1.12 0.00 0.00 29.99 31.38 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 -3.30 5.89 -0.02 0.41 1.04 -1.26 -4.70 113.70 111.75 2i03 s SER 127 Ca -0.02 1.99 -0.30 0.00 0.48 0.00 0.00 55.95 58.10 2i03 s SER 127 Cb 0.01 -2.56 0.12 0.00 0.10 0.00 0.00 66.02 63.69 2i03 s SER 127 CO 0.16 -1.09 1.30 -0.72 0.98 0.00 0.00 173.24 173.87 2i03 s TYR 128 N -2.05 -0.03 0.13 5.02 -0.85 -1.26 -1.32 117.35 116.98 2i03 s TYR 128 Ca 0.68 -0.07 0.03 0.00 -0.52 0.00 0.00 57.07 57.19 2i03 s TYR 128 Cb -0.19 0.55 -0.04 0.00 0.38 0.00 0.00 41.96 42.65 2i03 s TYR 128 CO 0.28 -0.26 -0.09 0.95 -1.52 0.00 0.00 175.55 174.91 2i03 s THR 129 N -2.32 0.98 0.20 -3.49 -4.23 -0.65 -4.64 115.64 101.49 2i03 s THR 129 Ca 0.17 -2.01 -0.16 0.00 -1.18 0.00 0.00 61.69 58.51 2i03 s THR 129 Cb 0.04 -1.78 0.06 0.00 1.34 0.00 0.00 72.50 72.17 2i03 s THR 129 CO -0.04 -0.79 0.80 0.00 -0.54 0.00 0.00 174.62 174.05 2i03 n ALA 130 N -0.13 -2.02 -2.56 3.99 0.00 -1.02 -0.86 120.51 117.91 2i03 n ALA 130 Ca -0.11 -0.91 -0.30 0.00 0.00 0.00 0.00 53.44 52.12 2i03 n ALA 130 Cb 0.61 0.58 -0.10 0.00 0.00 0.00 0.00 19.45 20.54 2i03 n ALA 130 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2i03 s SER 131 N -2.94 4.29 0.16 0.00 0.01 0.15 -2.05 113.70 113.32 2i03 s SER 131 Ca 0.17 -0.42 0.03 0.00 1.31 0.00 0.00 55.95 57.04 2i03 s SER 131 Cb -0.03 -0.78 -0.05 0.00 0.21 0.00 0.00 66.02 65.38 2i03 s SER 131 CO 0.06 0.18 -0.05 -0.31 0.41 0.00 0.00 173.24 173.53 2i03 s TYR 132 N -1.20 1.25 -0.02 2.43 1.51 -1.26 -1.27 117.35 118.79 2i03 s TYR 132 Ca 0.21 -0.89 -0.11 0.00 -1.01 0.00 0.00 57.07 55.27 2i03 s TYR 132 Cb -0.11 -0.69 0.01 0.00 -0.11 0.00 0.00 41.96 41.06 2i03 s TYR 132 CO 0.13 -0.06 0.23 -0.51 -1.11 0.00 0.00 175.55 174.23 2i03 s ASP 133 N -3.18 -0.11 -0.20 2.29 1.01 -0.99 -4.61 116.67 110.89 2i03 s ASP 133 Ca 0.20 0.01 -0.00 0.00 0.71 0.00 0.00 52.55 53.47 2i03 s ASP 133 Cb 0.05 0.29 0.01 0.00 1.01 0.00 0.00 42.92 44.28 2i03 s ASP 133 CO 0.02 -0.38 -0.15 -0.63 0.21 0.00 0.00 175.17 174.25 2i03 s ILE 134 N -1.20 2.45 -0.17 0.77 1.01 -1.26 -0.92 121.20 121.87 2i03 s ILE 134 Ca -0.13 -0.85 -0.12 0.00 0.00 0.00 0.00 60.65 59.55 2i03 s ILE 134 Cb -0.06 -2.08 -0.05 0.00 0.01 0.00 0.00 42.46 40.28 2i03 s ILE 134 CO 0.03 0.47 0.23 -0.47 0.00 0.00 0.00 174.94 175.20 2i03 s TYR 135 N 1.34 3.45 -0.21 3.97 5.04 -0.41 -1.42 117.35 129.10 2i03 s TYR 135 Ca 0.05 0.50 -0.25 0.00 -2.44 0.00 0.00 57.07 54.92 2i03 s TYR 135 Cb -0.14 -2.26 -0.01 0.00 0.35 0.00 0.00 41.96 39.90 2i03 s TYR 135 CO -0.10 0.28 0.83 0.34 -1.34 0.00 0.00 175.55 175.56 2i03 s ASP 136 N 0.37 6.88 0.08 4.32 -1.08 0.32 -1.66 116.67 125.90 2i03 s ASP 136 Ca 0.13 1.09 -0.11 0.00 -0.52 0.00 0.00 52.55 53.14 2i03 s ASP 136 Cb -0.12 -2.44 -0.23 0.00 -1.46 0.00 0.00 42.92 38.67 2i03 s ASP 136 CO 0.02 -0.47 1.18 -0.07 0.52 0.00 0.00 175.17 176.35 2i03 h LEU 137 N 8.82 0.78 0.00 -1.34 3.38 -1.69 0.24 115.31 125.50 2i03 h LEU 137 Ca -0.26 -0.67 0.00 0.00 0.09 0.00 0.00 57.88 57.04 2i03 h LEU 137 Cb 1.11 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.62 2i03 h LEU 137 CO 0.86 1.48 0.00 0.59 0.09 0.00 0.00 178.44 181.46 2i03 n ASN 138 N -3.78 0.00 0.00 -0.43 3.02 -1.26 -2.93 115.26 109.88 2i03 n ASN 138 Ca -0.11 0.47 0.08 0.00 -0.03 0.00 0.00 54.58 54.99 2i03 n ASN 138 Cb 0.93 0.00 0.45 0.00 -0.61 0.00 0.00 39.78 40.54 2i03 n ASN 138 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2i03 n LYS 139 N -0.55 0.43 -3.76 3.52 2.85 -1.26 -4.87 118.16 114.53 2i03 n LYS 139 Ca 0.00 0.03 -0.29 0.00 -1.05 0.00 0.00 58.31 57.00 2i03 n LYS 139 Cb 0.00 -1.50 0.03 0.00 -0.65 0.00 0.00 35.03 32.91 2i03 n LYS 139 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2i03 n ARG 140 N -1.07 -2.05 -4.16 -1.58 1.74 -0.02 -4.98 116.66 104.55 2i03 n ARG 140 Ca 0.11 0.45 -0.10 0.00 -0.77 0.00 0.00 57.85 57.54 2i03 n ARG 140 Cb 0.07 -4.30 -0.10 0.00 -1.02 0.00 0.00 32.46 27.11 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 -6.14 0.80 -0.16 5.56 2.00 -0.66 -4.93 119.66 116.12 2i03 s GLN 141 Ca 0.32 -1.30 -0.14 0.00 -2.00 0.00 0.00 55.36 52.24 2i03 s GLN 141 Cb -0.11 -0.17 -0.05 0.00 0.80 0.00 0.00 33.01 33.48 2i03 s GLN 141 CO 0.87 -0.02 0.32 -0.51 -0.50 0.00 0.00 175.29 175.44 2i03 s LEU 142 N -2.96 4.23 -0.02 3.68 1.43 -1.26 0.12 118.68 123.90 2i03 s LEU 142 Ca 0.10 0.53 -0.30 0.00 -1.03 0.00 0.00 54.13 53.43 2i03 s LEU 142 Cb 0.05 -2.41 -0.04 0.00 0.03 0.00 0.00 46.19 43.82 2i03 s LEU 142 CO -0.05 0.07 1.15 -0.63 0.23 0.00 0.00 176.35 177.11 2i03 s ILE 143 N 0.60 4.33 -0.39 -0.59 1.01 -0.51 -4.91 121.20 120.75 2i03 s ILE 143 Ca 0.17 1.66 0.09 0.00 0.00 0.00 0.00 60.65 62.58 2i03 s ILE 143 Cb -0.13 -4.07 -0.11 0.00 0.01 0.00 0.00 42.46 38.16 2i03 s ILE 143 CO 0.05 0.06 0.38 0.35 0.00 0.00 0.00 174.94 175.77 2i03 n THR 144 N 4.29 0.00 -4.02 2.92 -2.24 -1.26 -4.61 114.28 109.36 2i03 n THR 144 Ca 0.09 -0.27 -0.32 0.00 -2.27 0.00 0.00 64.05 61.28 2i03 n THR 144 Cb 0.47 0.91 -0.06 0.00 -2.10 0.00 0.00 70.33 69.55 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 -1.99 3.13 -1.27 -0.78 1.03 -1.26 -4.59 118.70 112.97 2i03 s GLU 145 Ca 0.03 -0.52 -0.18 0.00 0.03 0.00 0.00 54.97 54.32 2i03 s GLU 145 Cb 0.07 -2.88 0.01 0.00 -0.80 0.00 0.00 34.13 30.53 2i03 s GLU 145 CO 0.39 0.62 0.58 0.39 -1.33 0.00 0.00 175.26 175.91 2i03 n GLU 146 N 0.74 -1.34 -2.97 -4.83 -0.58 -1.26 -4.71 120.64 105.69 2i03 n GLU 146 Ca -0.10 0.28 -0.27 0.00 -0.42 0.00 0.00 57.16 56.65 2i03 n GLU 146 Cb 0.52 -3.65 -0.01 0.00 -0.57 0.00 0.00 31.44 27.72 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 -6.73 3.59 0.37 3.49 1.70 -1.26 -4.77 118.95 115.34 2i03 s ARG 147 Ca 0.32 0.10 -0.28 0.00 -0.47 0.00 0.00 55.73 55.40 2i03 s ARG 147 Cb -0.14 -2.49 -0.11 0.00 -0.57 0.00 0.00 34.95 31.63 2i03 s ARG 147 CO 0.92 -0.02 1.36 -0.89 -1.08 0.00 0.00 175.30 175.59 2i03 n ILE 148 N -1.73 2.10 -1.55 4.99 5.41 -1.26 -4.96 119.36 122.35 2i03 n ILE 148 Ca -0.01 -0.50 -0.31 0.00 1.00 0.00 0.00 62.75 62.93 2i03 n ILE 148 Cb 0.55 -1.72 0.06 0.00 -0.71 0.00 0.00 39.64 37.82 2i03 n ILE 148 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2i03 s PRO 149 N -2.02 2.83 0.73 0.38 0.04 -1.26 -4.65 135.00 131.04 2i03 s PRO 149 Ca 0.56 0.94 -0.11 0.00 0.04 0.00 0.00 61.00 62.43 2i03 s PRO 149 Cb -0.53 -1.98 0.03 0.00 0.04 0.00 0.00 34.50 32.06 2i03 s PRO 149 CO 0.62 -1.17 1.07 -0.80 0.04 0.00 0.00 177.00 176.76 2i03 s ASN 150 N -3.78 5.04 -1.33 6.66 0.01 -1.26 -3.65 114.94 116.62 2i03 s ASN 150 Ca 0.58 1.66 -0.01 0.00 -0.71 0.00 0.00 52.86 54.38 2i03 s ASN 150 Cb -0.14 -2.47 0.00 0.00 0.41 0.00 0.00 41.25 39.05 2i03 s ASN 150 CO 0.55 -1.67 0.19 0.59 -1.51 0.00 0.00 177.10 175.25 2i03 n ASN 151 N -3.28 -4.98 -4.76 -1.22 3.02 -1.10 -4.97 115.26 97.98 2i03 n ASN 151 Ca 0.08 -0.10 -0.40 0.00 -0.03 0.00 0.00 54.58 54.13 2i03 n ASN 151 Cb 0.54 -3.98 -0.04 0.00 -0.61 0.00 0.00 39.78 35.69 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 -2.91 3.34 -0.45 3.41 2.01 -0.87 -4.62 115.64 115.56 2i03 s THR 152 Ca 0.09 1.29 0.23 0.00 0.31 0.00 0.00 61.69 63.61 2i03 s THR 152 Cb -0.04 -3.80 -0.09 0.00 0.01 0.00 0.00 72.50 68.58 2i03 s THR 152 CO 0.12 0.26 1.00 0.00 -0.69 0.00 0.00 174.62 175.31 2i03 n GLN 153 N 0.87 0.42 -3.65 4.92 6.02 -0.07 -2.44 117.38 123.46 2i03 n GLN 153 Ca 0.00 0.02 -0.02 0.00 -0.01 0.00 0.00 57.00 56.99 2i03 n GLN 153 Cb 0.45 -1.66 -0.07 0.00 1.02 0.00 0.00 30.24 29.98 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 -3.28 -0.23 0.01 1.08 -0.11 -1.21 -4.71 118.94 110.48 2i03 s TRP 154 Ca 0.01 0.50 0.04 0.00 1.22 0.00 0.00 56.10 57.88 2i03 s TRP 154 Cb 0.13 0.28 -0.01 0.00 -1.50 0.00 0.00 33.47 32.37 2i03 s TRP 154 CO 0.80 -0.11 -0.13 0.08 -4.62 0.00 0.00 176.95 172.97 2i03 s VAL 155 N 0.70 1.00 -0.23 5.86 1.01 -1.26 -0.62 120.40 126.86 2i03 s VAL 155 Ca -0.02 -0.68 -0.13 0.00 0.00 0.00 0.00 61.98 61.16 2i03 s VAL 155 Cb -0.04 -0.86 0.07 0.00 0.00 0.00 0.00 36.38 35.55 2i03 s VAL 155 CO -0.12 0.18 0.56 0.28 0.00 0.00 0.00 175.10 176.00 2i03 s THR 156 N -0.48 -0.05 1.00 3.92 -1.32 -0.49 -5.01 115.64 113.22 2i03 s THR 156 Ca 0.03 0.05 -0.13 0.00 -1.21 0.00 0.00 61.69 60.43 2i03 s THR 156 Cb -0.06 -0.82 0.19 0.00 -1.51 0.00 0.00 72.50 70.30 2i03 s THR 156 CO 0.00 0.02 1.11 0.26 -2.21 0.00 0.00 174.62 173.80 2i03 s TRP 157 N 1.58 2.01 0.64 9.09 0.52 -1.26 -2.02 118.94 129.50 2i03 s TRP 157 Ca -0.10 0.86 -0.08 0.00 0.02 0.00 0.00 56.10 56.80 2i03 s TRP 157 Cb -0.07 -3.35 0.01 0.00 -1.15 0.00 0.00 33.47 28.91 2i03 s TRP 157 CO -0.17 -2.89 0.99 -1.54 0.02 0.00 0.00 176.95 173.36 2i03 s SER 158 N -3.71 5.60 0.46 2.95 1.04 -0.53 -4.85 113.70 114.68 2i03 s SER 158 Ca 0.66 0.94 0.13 0.00 0.48 0.00 0.00 55.95 58.16 2i03 s SER 158 Cb -0.16 -1.87 1.06 0.00 0.10 0.00 0.00 66.02 65.14 2i03 s SER 158 CO 0.56 -1.14 2.05 -0.65 0.98 0.00 0.00 173.24 175.04 2i03 h PRO 159 N -0.37 0.11 0.00 4.02 0.11 -1.82 -3.40 132.00 130.65 2i03 h PRO 159 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2i03 h PRO 159 Cb 1.25 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2i03 h PRO 159 CO 0.62 0.16 -0.94 1.33 -0.21 0.00 0.00 178.00 178.97 2i03 n VAL 160 N -4.43 0.00 0.00 3.15 0.24 -1.26 -4.84 118.33 111.19 2i03 n VAL 160 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 2i03 n VAL 160 Cb 0.16 -0.96 0.00 0.00 -1.47 0.00 0.00 33.84 31.57 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 3.14 0.66 1.53 7.63 0.00 -1.26 -4.11 105.19 112.78 2i03 n GLY 161 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.03 -1.49 1.61 1.44 -1.26 -3.04 115.22 112.51 2i03 n HIS 162 Ca 0.00 -0.69 -0.31 0.00 -2.01 0.00 0.00 57.72 54.71 2i03 n HIS 162 Cb 0.00 0.09 0.06 0.00 0.12 0.00 0.00 29.99 30.27 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 -0.33 2.69 -0.02 -1.40 1.02 -1.26 -4.60 119.74 115.84 2i03 s LYS 163 Ca 0.23 0.98 0.01 0.00 0.02 0.00 0.00 55.97 57.21 2i03 s LYS 163 Cb 0.28 -1.96 0.01 0.00 -0.52 0.00 0.00 37.83 35.64 2i03 s LYS 163 CO -0.11 -1.28 -0.04 -0.51 -0.92 0.00 0.00 175.35 172.49 2i03 s LEU 164 N -5.66 1.57 -0.06 3.17 1.43 0.38 -1.45 118.68 118.06 2i03 s LEU 164 Ca 0.59 -0.10 0.05 0.00 -1.03 0.00 0.00 54.13 53.64 2i03 s LEU 164 Cb -0.15 -0.34 -0.00 0.00 0.03 0.00 0.00 46.19 45.73 2i03 s LEU 164 CO 0.55 -0.01 -0.21 0.00 0.23 0.00 0.00 176.35 176.91 2i03 s ALA 165 N 0.52 1.85 -0.00 4.21 0.00 -0.86 0.66 121.76 128.14 2i03 s ALA 165 Ca -0.06 -0.84 -0.11 0.00 0.00 0.00 0.00 51.96 50.94 2i03 s ALA 165 Cb -0.10 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.40 2i03 s ALA 165 CO -0.00 0.31 0.23 1.52 0.00 0.00 0.00 175.76 177.82 2i03 s TYR 166 N 0.11 -0.07 -0.14 0.00 -0.85 -0.47 -1.39 117.35 114.54 2i03 s TYR 166 Ca -0.08 0.06 -0.04 0.00 -0.52 0.00 0.00 57.07 56.49 2i03 s TYR 166 Cb -0.14 0.03 -0.03 0.00 0.38 0.00 0.00 41.96 42.20 2i03 s TYR 166 CO 0.04 -0.36 -0.02 0.08 -1.52 0.00 0.00 175.55 173.78 2i03 s VAL 167 N -1.50 4.09 -0.06 -3.49 1.01 0.20 -0.78 120.40 119.87 2i03 s VAL 167 Ca -0.13 -0.30 -0.02 0.00 0.00 0.00 0.00 61.98 61.53 2i03 s VAL 167 Cb -0.06 -2.78 0.04 0.00 0.00 0.00 0.00 36.38 33.58 2i03 s VAL 167 CO 0.02 0.52 0.11 0.86 0.00 0.00 0.00 175.10 176.61 2i03 s TRP 168 N 0.06 -0.10 -1.44 5.22 -0.00 -0.24 -0.89 118.94 121.56 2i03 s TRP 168 Ca 0.01 0.40 -0.07 0.00 -0.00 0.00 0.00 56.10 56.44 2i03 s TRP 168 Cb -0.13 -0.19 0.04 0.00 -0.00 0.00 0.00 33.47 33.20 2i03 s TRP 168 CO 0.02 -0.17 0.80 0.09 -0.00 0.00 0.00 176.95 177.69 2i03 n ASN 169 N 4.49 -2.77 0.00 5.86 5.03 -1.26 -1.30 115.26 125.30 2i03 n ASN 169 Ca -0.21 -0.83 0.00 0.00 0.87 0.00 0.00 54.58 54.41 2i03 n ASN 169 Cb 0.51 -3.82 0.00 0.00 -1.02 0.00 0.00 39.78 35.45 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 -2.93 -2.58 -4.55 6.41 5.03 -1.26 -4.47 115.26 110.90 2i03 n ASN 170 Ca -0.13 0.00 -0.29 0.00 0.87 0.00 0.00 54.58 55.02 2i03 n ASN 170 Cb 0.60 -2.29 -0.10 0.00 -1.02 0.00 0.00 39.78 36.98 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 -2.13 4.25 -0.02 6.41 1.01 -0.42 -1.96 116.67 123.82 2i03 s ASP 171 Ca 0.00 -0.45 -0.17 0.00 0.71 0.00 0.00 52.55 52.64 2i03 s ASP 171 Cb 0.00 -0.75 -0.05 0.00 1.01 0.00 0.00 42.92 43.13 2i03 s ASP 171 CO 0.00 0.17 0.45 -0.63 0.21 0.00 0.00 175.17 175.37 2i03 s ILE 172 N -1.25 5.02 0.09 0.77 1.01 -1.26 -1.07 121.20 124.51 2i03 s ILE 172 Ca 0.21 0.94 0.06 0.00 0.00 0.00 0.00 60.65 61.85 2i03 s ILE 172 Cb -0.11 -3.77 -0.03 0.00 0.01 0.00 0.00 42.46 38.56 2i03 s ILE 172 CO 0.13 0.50 -0.15 -0.31 0.00 0.00 0.00 174.94 175.11 2i03 s TYR 173 N -0.58 1.36 -0.05 3.97 1.51 0.04 -0.19 117.35 123.42 2i03 s TYR 173 Ca 0.25 -0.48 0.03 0.00 -1.01 0.00 0.00 57.07 55.86 2i03 s TYR 173 Cb -0.17 -0.75 0.01 0.00 -0.11 0.00 0.00 41.96 40.95 2i03 s TYR 173 CO 0.13 0.11 -0.12 0.08 -1.11 0.00 0.00 175.55 174.64 2i03 s VAL 174 N -1.51 1.09 -0.30 0.71 1.01 -0.05 -1.36 120.40 119.98 2i03 s VAL 174 Ca 0.03 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 61.56 2i03 s VAL 174 Cb -0.08 -0.98 0.08 0.00 0.00 0.00 0.00 36.38 35.39 2i03 s VAL 174 CO 0.03 0.34 -0.02 -0.75 0.00 0.00 0.00 175.10 174.69 2i03 s LYS 175 N 0.49 1.75 0.23 2.72 2.20 0.21 -0.08 119.74 127.26 2i03 s LYS 175 Ca -0.11 -1.54 -0.04 0.00 -0.36 0.00 0.00 55.97 53.92 2i03 s LYS 175 Cb -0.14 -2.96 0.23 0.00 -1.51 0.00 0.00 37.83 33.45 2i03 s LYS 175 CO 0.03 -0.76 1.68 0.82 -0.36 0.00 0.00 175.35 176.76 2i03 h ILE 176 N 6.67 1.26 -3.49 5.43 5.03 -1.84 0.11 117.51 130.69 2i03 h ILE 176 Ca -0.12 -1.17 -0.54 0.00 -0.12 0.00 0.00 64.86 62.91 2i03 h ILE 176 Cb 1.03 1.00 -0.33 0.00 -3.03 0.00 0.00 36.82 35.50 2i03 h ILE 176 CO 0.48 0.41 -0.83 -1.61 -0.68 0.00 0.00 178.15 175.92 2i03 s GLU 177 N -4.83 1.90 0.29 2.37 0.41 -1.26 -4.30 118.70 113.28 2i03 s GLU 177 Ca -0.10 -0.51 0.04 0.00 -0.41 0.00 0.00 54.97 53.99 2i03 s GLU 177 Cb 0.14 -1.55 0.77 0.00 -1.78 0.00 0.00 34.13 31.71 2i03 s GLU 177 CO 0.83 0.08 1.45 -2.30 -0.49 0.00 0.00 175.26 174.84 2i03 n PRO 178 N 3.65 -0.07 0.00 0.39 -0.02 -1.26 -1.15 135.00 136.54 2i03 n PRO 178 Ca -0.21 1.38 0.12 0.00 -2.02 0.00 0.00 63.50 62.76 2i03 n PRO 178 Cb 0.52 -2.22 0.19 0.00 -0.02 0.00 0.00 33.50 31.97 2i03 n PRO 178 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2i03 n ASN 179 N -5.34 1.63 -4.92 2.55 6.94 -1.26 -4.85 115.26 110.01 2i03 n ASN 179 Ca 0.23 -1.28 -0.26 0.00 -0.02 0.00 0.00 54.58 53.26 2i03 n ASN 179 Cb 0.77 0.29 0.01 0.00 -2.36 0.00 0.00 39.78 38.49 2i03 n ASN 179 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2i03 s LEU 180 N -2.44 3.47 0.97 -4.53 1.02 -0.30 -4.49 118.68 112.39 2i03 s LEU 180 Ca 0.22 0.70 -0.11 0.00 0.02 0.00 0.00 54.13 54.96 2i03 s LEU 180 Cb 0.19 -3.58 0.15 0.00 0.02 0.00 0.00 46.19 42.96 2i03 s LEU 180 CO 0.53 -0.80 0.94 -2.65 0.02 0.00 0.00 176.35 174.39 2i03 n PRO 181 N -2.35 -0.79 -4.00 1.29 -0.02 -1.26 -4.83 135.00 123.03 2i03 n PRO 181 Ca 0.02 -0.18 -0.31 0.00 -2.02 0.00 0.00 63.50 61.02 2i03 n PRO 181 Cb 0.57 -2.22 -0.06 0.00 -0.02 0.00 0.00 33.50 31.77 2i03 n PRO 181 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2i03 s SER 182 N -2.45 5.84 -0.14 2.55 0.15 -1.26 -4.70 113.70 113.68 2i03 s SER 182 Ca 0.65 0.10 -0.13 0.00 0.70 0.00 0.00 55.95 57.27 2i03 s SER 182 Cb -0.23 -1.66 -0.05 0.00 -1.71 0.00 0.00 66.02 62.37 2i03 s SER 182 CO 0.61 0.18 0.28 -0.31 1.20 0.00 0.00 173.24 175.20 2i03 s TYR 183 N -1.43 3.49 -0.37 3.44 2.02 0.88 -4.90 117.35 120.49 2i03 s TYR 183 Ca 0.31 0.61 -0.26 0.00 -0.37 0.00 0.00 57.07 57.36 2i03 s TYR 183 Cb -0.12 -2.29 0.01 0.00 -0.40 0.00 0.00 41.96 39.16 2i03 s TYR 183 CO 0.24 0.32 0.93 0.50 -1.57 0.00 0.00 175.55 175.97 2i03 s ARG 184 N 0.19 3.85 0.04 -0.62 3.52 -1.26 -0.87 118.95 123.79 2i03 s ARG 184 Ca 0.16 0.59 0.07 0.00 -0.13 0.00 0.00 55.73 56.43 2i03 s ARG 184 Cb -0.13 -3.80 -0.23 0.00 -1.56 0.00 0.00 34.95 29.23 2i03 s ARG 184 CO 0.04 -0.94 0.97 0.82 -0.81 0.00 0.00 175.30 175.38 2i03 h ILE 185 N 5.82 1.28 -3.93 4.11 1.08 -0.93 -3.39 117.51 121.54 2i03 h ILE 185 Ca -0.23 -3.04 -0.23 0.00 -0.39 0.00 0.00 64.86 60.97 2i03 h ILE 185 Cb 1.08 2.67 -0.18 0.00 -3.07 0.00 0.00 36.82 37.32 2i03 h ILE 185 CO 0.98 0.76 -0.71 0.28 -0.69 0.00 0.00 178.15 178.77 2i03 s THR 186 N -2.65 0.53 0.00 -0.27 -1.32 -1.18 -4.81 115.64 105.95 2i03 s THR 186 Ca -0.03 -1.50 0.00 0.00 -1.21 0.00 0.00 61.69 58.95 2i03 s THR 186 Cb 0.09 -1.12 0.00 0.00 -1.51 0.00 0.00 72.50 69.96 2i03 s THR 186 CO 0.83 -0.66 0.25 0.79 -2.21 0.00 0.00 174.62 173.62 2i03 n TRP 187 N 0.71 0.00 1.45 9.09 7.02 -1.26 -4.48 117.44 129.97 2i03 n TRP 187 Ca -0.18 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.44 2i03 n TRP 187 Cb 0.58 0.00 0.56 0.00 -2.42 0.00 0.00 31.31 30.03 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 -0.04 0.00 -1.67 -0.99 -2.24 -1.26 -4.96 114.28 103.12 2i03 n THR 188 Ca 0.00 -0.13 -0.47 0.00 -2.27 0.00 0.00 64.05 61.18 2i03 n THR 188 Cb 0.11 0.17 -0.05 0.00 -2.10 0.00 0.00 70.33 68.46 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 1.23 1.28 2.94 3.38 0.00 -1.26 -4.73 105.19 108.04 2i03 n GLY 189 Ca 0.16 0.77 -0.14 0.00 0.00 0.00 0.00 46.02 46.81 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 2.59 0.20 0.03 1.61 2.20 -0.96 -4.87 119.74 120.54 2i03 s LYS 190 Ca 0.86 0.59 -0.32 0.00 -0.36 0.00 0.00 55.97 56.74 2i03 s LYS 190 Cb -0.70 -0.39 -0.16 0.00 -1.51 0.00 0.00 37.83 35.07 2i03 s LYS 190 CO 0.46 -0.44 0.83 -1.91 -0.36 0.00 0.00 175.35 173.92 2i03 n GLU 191 N 5.35 0.00 -0.63 4.03 2.13 -1.26 -0.36 120.64 129.89 2i03 n GLU 191 Ca -0.06 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.76 2i03 n GLU 191 Cb 0.50 -1.19 0.00 0.00 0.27 0.00 0.00 31.44 31.01 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 1.32 -1.27 0.04 4.31 8.00 -1.26 -4.64 116.55 123.05 2i03 n ASP 192 Ca 0.17 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.67 2i03 n ASP 192 Cb 0.09 -2.57 0.00 0.00 -0.02 0.00 0.00 41.12 38.62 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 -2.01 0.77 -4.08 0.53 2.08 0.18 -4.64 119.36 112.19 2i03 n ILE 193 Ca 0.00 0.25 -0.32 0.00 0.56 0.00 0.00 62.75 63.25 2i03 n ILE 193 Cb 0.10 -1.43 -0.16 0.00 -0.75 0.00 0.00 39.64 37.40 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 -2.00 1.87 -0.19 1.39 1.01 0.51 0.11 121.20 123.90 2i03 s ILE 194 Ca 0.00 -0.84 -0.03 0.00 0.00 0.00 0.00 60.65 59.78 2i03 s ILE 194 Cb 0.00 -1.72 -0.01 0.00 0.01 0.00 0.00 42.46 40.74 2i03 s ILE 194 CO 0.00 0.49 -0.06 -0.31 0.00 0.00 0.00 174.94 175.06 2i03 s TYR 195 N 1.36 2.94 -0.20 3.97 1.51 -0.17 -2.28 117.35 124.50 2i03 s TYR 195 Ca 0.05 -0.76 -0.01 0.00 -1.01 0.00 0.00 57.07 55.33 2i03 s TYR 195 Cb -0.13 -2.03 0.01 0.00 -0.11 0.00 0.00 41.96 39.69 2i03 s TYR 195 CO -0.12 -0.39 -0.13 -0.80 -1.11 0.00 0.00 175.55 173.00 2i03 s ASN 196 N 1.08 3.67 0.00 2.29 0.01 -0.83 -0.70 114.94 120.47 2i03 s ASN 196 Ca 0.01 -0.53 0.00 0.00 -0.71 0.00 0.00 52.86 51.63 2i03 s ASN 196 Cb -0.15 -1.60 0.00 0.00 0.41 0.00 0.00 41.25 39.91 2i03 s ASN 196 CO -0.00 -0.01 0.00 0.61 -1.51 0.00 0.00 177.10 176.19 2i03 n GLY 197 N 4.69 2.48 3.25 0.66 0.00 -0.92 -4.39 105.19 110.96 2i03 n GLY 197 Ca -0.20 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.17 1.23 0.29 -0.61 -4.36 -1.26 0.75 121.20 114.07 2i03 s ILE 198 Ca 0.00 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.39 2i03 s ILE 198 Cb 0.00 -1.79 -0.04 0.00 1.25 0.00 0.00 42.46 41.88 2i03 s ILE 198 CO 0.00 -0.68 0.48 0.42 0.24 0.00 0.00 174.94 175.40 2i03 s THR 199 N -3.07 5.15 0.87 8.37 -4.23 -0.41 -4.69 115.64 117.63 2i03 s THR 199 Ca 0.15 -0.50 -0.11 0.00 -1.18 0.00 0.00 61.69 60.06 2i03 s THR 199 Cb 0.01 -3.82 0.17 0.00 1.34 0.00 0.00 72.50 70.19 2i03 s THR 199 CO 0.01 -0.41 1.20 1.51 -0.54 0.00 0.00 174.62 176.40 2i03 s ASP 200 N -3.75 3.63 0.14 3.99 -4.77 -1.26 -4.78 116.67 109.88 2i03 s ASP 200 Ca 0.39 0.11 -0.26 0.00 -3.30 0.00 0.00 52.55 49.49 2i03 s ASP 200 Cb -0.10 -0.31 -0.01 0.00 -1.09 0.00 0.00 42.92 41.42 2i03 s ASP 200 CO 0.33 -2.38 1.60 -0.25 0.70 0.00 0.00 175.17 175.16 2i03 h TRP 201 N -1.23 -1.02 -0.35 2.11 7.01 -2.00 -1.72 115.95 118.75 2i03 h TRP 201 Ca -0.42 0.05 -0.06 0.00 2.11 0.00 0.00 58.89 60.57 2i03 h TRP 201 Cb 1.25 0.48 -0.02 0.00 -2.10 0.00 0.00 29.16 28.78 2i03 h TRP 201 CO -0.72 -0.42 -0.05 -0.24 -2.79 0.00 0.00 178.44 174.22 2i03 h VAL 202 N -0.38 1.22 0.00 2.65 3.04 -1.94 -2.01 116.25 118.83 2i03 h VAL 202 Ca 0.11 -0.91 -0.09 0.00 -1.01 0.00 0.00 66.70 64.81 2i03 h VAL 202 Cb 0.57 1.00 -0.01 0.00 -2.01 0.00 0.00 31.29 30.84 2i03 h VAL 202 CO -0.44 0.31 -0.42 1.88 -1.01 0.00 0.00 177.57 177.90 2i03 h TYR 203 N 0.53 0.00 -0.08 3.17 -1.99 -1.86 -0.14 116.97 116.60 2i03 h TYR 203 Ca 0.11 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.74 2i03 h TYR 203 Cb 0.41 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.15 2i03 h TYR 203 CO 0.02 0.42 -0.34 1.49 -0.00 0.00 0.00 178.16 179.74 2i03 h GLU 204 N 0.00 0.37 0.04 4.88 4.81 -0.84 -0.27 114.58 123.58 2i03 h GLU 204 Ca -0.00 -0.29 -0.07 0.00 -0.13 0.00 0.00 59.36 58.86 2i03 h GLU 204 Cb 0.97 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.41 2i03 h GLU 204 CO 0.05 0.93 -0.33 1.49 -0.73 0.00 0.00 179.01 180.42 2i03 h GLU 205 N -0.11 0.09 0.00 1.92 4.57 -1.35 -0.82 114.58 118.89 2i03 h GLU 205 Ca -0.02 -0.16 0.00 0.00 -1.18 0.00 0.00 59.36 58.00 2i03 h GLU 205 Cb 0.99 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.64 2i03 h GLU 205 CO 0.07 1.08 -0.97 0.39 -1.18 0.00 0.00 179.01 178.40 2i03 n GLU 206 N -4.44 0.05 0.00 1.92 -0.58 -0.07 -4.49 120.64 113.03 2i03 n GLU 206 Ca -0.12 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.60 2i03 n GLU 206 Cb 0.60 -1.51 0.00 0.00 -0.57 0.00 0.00 31.44 29.96 2i03 n GLU 206 CO 0.00 0.00 0.00 1.55 -0.48 0.00 0.00 177.13 178.20 2i03 n VAL 207 N -1.57 0.00 -0.01 2.62 3.14 -1.19 -4.87 118.33 116.45 2i03 n VAL 207 Ca 0.04 0.00 0.09 0.00 -2.96 0.00 0.00 64.34 61.51 2i03 n VAL 207 Cb 0.35 -0.77 -0.15 0.00 -1.06 0.00 0.00 33.84 32.21 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 -2.52 0.11 -3.92 1.45 3.72 -0.12 -4.98 117.46 111.21 2i03 n PHE 208 Ca 0.00 0.03 -0.30 0.00 -0.05 0.00 0.00 57.45 57.13 2i03 n PHE 208 Cb 0.32 -0.60 0.02 0.00 -0.94 0.00 0.00 39.48 38.29 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 -2.35 -4.32 -3.53 4.37 7.64 -0.33 -4.93 113.62 110.17 2i03 n SER 209 Ca -0.06 -0.80 -0.11 0.00 1.01 0.00 0.00 58.87 58.90 2i03 n SER 209 Cb 0.62 -3.80 -0.04 0.00 -1.01 0.00 0.00 64.21 59.99 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 -3.34 -1.84 -0.04 -0.43 0.00 -1.12 -4.97 121.76 110.01 2i03 s ALA 210 Ca 0.60 1.26 0.12 0.00 0.00 0.00 0.00 51.96 53.95 2i03 s ALA 210 Cb -0.30 -0.07 -0.15 0.00 0.00 0.00 0.00 23.12 22.60 2i03 s ALA 210 CO 0.84 -0.49 1.03 -0.92 0.00 0.00 0.00 175.76 176.22 2i03 h TYR 211 N 2.39 0.00 -3.90 0.00 3.20 -1.88 -3.39 116.97 113.40 2i03 h TYR 211 Ca -0.22 0.00 -0.53 0.00 3.14 0.00 0.00 58.73 61.12 2i03 h TYR 211 Cb 1.20 0.00 0.07 0.00 1.54 0.00 0.00 36.73 39.54 2i03 h TYR 211 CO 0.29 0.80 0.67 0.45 -1.64 0.00 0.00 178.16 178.73 2i03 s SER 212 N -6.26 6.66 -0.28 -2.11 0.15 -1.26 -1.29 113.70 109.31 2i03 s SER 212 Ca -0.01 2.76 0.21 0.00 0.70 0.00 0.00 55.95 59.61 2i03 s SER 212 Cb 0.09 -2.65 0.49 0.00 -1.71 0.00 0.00 66.02 62.24 2i03 s SER 212 CO 0.81 -0.62 1.10 0.00 1.20 0.00 0.00 173.24 175.73 2i03 n ALA 213 N 0.69 2.76 -3.02 5.45 0.00 0.23 -4.62 120.51 122.01 2i03 n ALA 213 Ca 0.00 -2.72 -0.11 0.00 0.00 0.00 0.00 53.44 50.61 2i03 n ALA 213 Cb 0.41 -0.89 -0.12 0.00 0.00 0.00 0.00 19.45 18.85 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 -3.66 1.71 -0.24 0.00 0.05 -1.25 -1.72 118.68 113.57 2i03 s LEU 214 Ca 0.26 -0.06 -0.02 0.00 0.05 0.00 0.00 54.13 54.36 2i03 s LEU 214 Cb 0.36 0.41 0.08 0.00 -2.05 0.00 0.00 46.19 44.98 2i03 s LEU 214 CO -0.03 -0.19 0.06 0.26 -0.55 0.00 0.00 176.35 175.90 2i03 s TRP 215 N -0.68 1.23 0.77 3.48 0.51 0.46 -4.97 118.94 119.74 2i03 s TRP 215 Ca -0.08 -1.16 -0.14 0.00 -2.12 0.00 0.00 56.10 52.60 2i03 s TRP 215 Cb -0.05 -1.24 0.06 0.00 -0.81 0.00 0.00 33.47 31.43 2i03 s TRP 215 CO 0.00 -0.72 1.20 -1.58 -0.51 0.00 0.00 176.95 175.35 2i03 s TRP 216 N 1.79 1.97 0.62 -1.98 0.52 -1.26 -1.99 118.94 118.61 2i03 s TRP 216 Ca 0.03 1.63 -0.11 0.00 0.02 0.00 0.00 56.10 57.67 2i03 s TRP 216 Cb -0.17 -3.45 -0.04 0.00 -1.15 0.00 0.00 33.47 28.66 2i03 s TRP 216 CO -0.16 -2.66 1.03 -1.54 0.02 0.00 0.00 176.95 173.64 2i03 s SER 217 N -2.16 6.16 0.30 2.95 1.04 -0.38 -4.88 113.70 116.73 2i03 s SER 217 Ca 0.73 1.45 0.02 0.00 0.48 0.00 0.00 55.95 58.63 2i03 s SER 217 Cb -0.28 -2.47 0.75 0.00 0.10 0.00 0.00 66.02 64.11 2i03 s SER 217 CO 0.48 -0.92 1.62 -0.65 0.98 0.00 0.00 173.24 174.75 2i03 h PRO 218 N -0.31 0.12 -0.01 4.02 0.11 -1.90 -0.07 132.00 133.95 2i03 h PRO 218 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2i03 h PRO 218 Cb 1.19 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2i03 h PRO 218 CO 0.61 0.08 -0.39 0.27 -0.21 0.00 0.00 178.00 178.36 2i03 n ASN 219 N -5.32 1.63 0.00 -2.05 0.23 -1.26 -4.47 115.26 104.02 2i03 n ASN 219 Ca 0.22 -1.27 0.00 0.00 -0.53 0.00 0.00 54.58 53.01 2i03 n ASN 219 Cb 0.73 0.35 0.00 0.00 -2.08 0.00 0.00 39.78 38.78 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 1.39 0.74 0.13 4.83 0.00 -0.04 -4.48 105.19 107.77 2i03 n GLY 220 Ca 0.10 -0.08 -0.17 0.00 0.00 0.00 0.00 46.02 45.88 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 1.44 -2.29 2.61 2.02 -1.93 -3.45 112.91 111.32 2i03 h THR 221 Ca 0.00 -2.00 -0.49 0.00 0.77 0.00 0.00 66.41 64.69 2i03 h THR 221 Cb 0.00 2.57 -0.02 0.00 -1.74 0.00 0.00 68.15 68.95 2i03 h THR 221 CO 0.00 0.57 -0.47 -0.36 0.37 0.00 0.00 175.52 175.64 2i03 s PHE 222 N -3.28 3.36 -0.15 3.16 0.08 -1.26 -0.32 117.98 119.57 2i03 s PHE 222 Ca -0.14 -0.02 -0.04 0.00 0.12 0.00 0.00 56.93 56.85 2i03 s PHE 222 Cb 0.03 -1.54 0.06 0.00 -0.57 0.00 0.00 43.02 40.99 2i03 s PHE 222 CO 0.80 0.48 0.08 -1.17 -0.10 0.00 0.00 175.22 175.30 2i03 s LEU 223 N -3.77 0.43 0.14 -0.37 2.96 -0.18 -1.25 118.68 116.65 2i03 s LEU 223 Ca 0.34 -0.54 0.02 0.00 -0.22 0.00 0.00 54.13 53.73 2i03 s LEU 223 Cb -0.09 -0.28 -0.04 0.00 0.50 0.00 0.00 46.19 46.28 2i03 s LEU 223 CO 0.28 -0.33 0.28 0.00 -1.32 0.00 0.00 176.35 175.26 2i03 s ALA 224 N 2.10 3.96 -0.08 5.97 0.00 -0.84 -0.57 121.76 132.30 2i03 s ALA 224 Ca 0.02 -0.98 -0.30 0.00 0.00 0.00 0.00 51.96 50.70 2i03 s ALA 224 Cb -0.16 -1.81 0.10 0.00 0.00 0.00 0.00 23.12 21.25 2i03 s ALA 224 CO -0.08 0.57 0.82 1.52 0.00 0.00 0.00 175.76 178.59 2i03 s TYR 225 N -1.72 -0.51 0.17 0.00 1.13 0.28 -0.40 117.35 116.30 2i03 s TYR 225 Ca 0.35 0.81 0.04 0.00 -1.41 0.00 0.00 57.07 56.87 2i03 s TYR 225 Cb -0.11 0.44 -0.04 0.00 -1.10 0.00 0.00 41.96 41.16 2i03 s TYR 225 CO 0.28 -0.51 0.21 0.00 -2.51 0.00 0.00 175.55 173.02 2i03 s ALA 226 N -1.45 3.73 -0.11 9.51 0.00 -0.70 -1.10 121.76 131.64 2i03 s ALA 226 Ca -0.05 -1.17 0.01 0.00 0.00 0.00 0.00 51.96 50.74 2i03 s ALA 226 Cb -0.00 -1.53 0.02 0.00 0.00 0.00 0.00 23.12 21.61 2i03 s ALA 226 CO 0.04 0.47 -0.13 -1.14 0.00 0.00 0.00 175.76 175.00 2i03 s GLN 227 N -3.29 2.03 -0.13 0.00 0.74 0.12 -2.17 119.66 116.96 2i03 s GLN 227 Ca 0.33 -0.48 -0.04 0.00 0.05 0.00 0.00 55.36 55.22 2i03 s GLN 227 Cb -0.10 -1.82 -0.03 0.00 1.10 0.00 0.00 33.01 32.16 2i03 s GLN 227 CO 0.26 -0.14 0.01 -0.06 -0.55 0.00 0.00 175.29 174.81 2i03 s PHE 228 N 1.22 3.16 -0.33 1.67 0.08 0.12 -1.35 117.98 122.55 2i03 s PHE 228 Ca -0.02 0.05 -0.02 0.00 0.12 0.00 0.00 56.93 57.05 2i03 s PHE 228 Cb -0.14 -1.91 0.07 0.00 -0.57 0.00 0.00 43.02 40.47 2i03 s PHE 228 CO -0.05 0.27 0.06 1.21 -0.10 0.00 0.00 175.22 176.62 2i03 s ASN 229 N -0.27 5.02 -0.15 1.36 3.84 -0.73 -1.00 114.94 123.02 2i03 s ASN 229 Ca 0.06 -1.49 0.17 0.00 0.21 0.00 0.00 52.86 51.81 2i03 s ASN 229 Cb -0.12 -1.75 0.71 0.00 -0.55 0.00 0.00 41.25 39.54 2i03 s ASN 229 CO 0.02 -0.35 1.63 0.47 -2.79 0.00 0.00 177.10 176.08 2i03 n ASP 230 N 4.62 4.87 -0.27 -4.21 9.92 0.12 -2.20 116.55 129.40 2i03 n ASP 230 Ca -0.10 -2.60 0.06 0.00 -0.53 0.00 0.00 54.79 51.62 2i03 n ASP 230 Cb 0.43 -0.59 0.16 0.00 -0.64 0.00 0.00 41.12 40.48 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 3.78 0.30 -0.62 -3.53 2.02 -1.82 -1.66 112.91 111.38 2i03 h THR 231 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 2i03 h THR 231 Cb 1.56 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 2i03 h THR 231 CO 0.29 0.02 0.00 -0.62 0.37 0.00 0.00 175.52 175.57 2i03 n GLU 232 N -5.38 2.73 -2.45 6.66 1.02 -1.26 -4.94 120.64 117.01 2i03 n GLU 232 Ca 0.14 -2.49 -0.42 0.00 -0.02 0.00 0.00 57.16 54.37 2i03 n GLU 232 Cb 0.49 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.39 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 -1.03 4.24 0.95 2.62 1.01 -0.63 -4.77 120.40 122.80 2i03 s VAL 233 Ca 0.42 1.57 -0.11 0.00 0.00 0.00 0.00 61.98 63.86 2i03 s VAL 233 Cb 0.22 -4.01 0.14 0.00 0.00 0.00 0.00 36.38 32.73 2i03 s VAL 233 CO 0.29 -0.01 0.95 -2.65 0.00 0.00 0.00 175.10 173.68 2i03 n PRO 234 N 5.25 -0.63 -4.81 2.72 -0.02 -1.26 -4.66 135.00 131.59 2i03 n PRO 234 Ca 0.11 -0.13 -0.33 0.00 -2.02 0.00 0.00 63.50 61.13 2i03 n PRO 234 Cb 0.46 -2.23 -0.13 0.00 -0.02 0.00 0.00 33.50 31.58 2i03 n PRO 234 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2i03 s LEU 235 N -5.35 2.82 -0.05 2.45 1.43 -1.26 -1.43 118.68 117.28 2i03 s LEU 235 Ca 0.65 -0.19 -0.17 0.00 -1.03 0.00 0.00 54.13 53.38 2i03 s LEU 235 Cb -0.23 -1.60 -0.05 0.00 0.03 0.00 0.00 46.19 44.35 2i03 s LEU 235 CO 0.61 0.31 0.46 -0.51 0.23 0.00 0.00 176.35 177.45 2i03 s ILE 236 N -0.49 5.08 -0.04 -0.59 1.10 -0.78 -4.89 121.20 120.60 2i03 s ILE 236 Ca 0.06 0.94 0.04 0.00 -0.51 0.00 0.00 60.65 61.19 2i03 s ILE 236 Cb -0.12 -3.79 -0.01 0.00 0.15 0.00 0.00 42.46 38.70 2i03 s ILE 236 CO 0.02 0.44 -0.17 -1.61 -2.11 0.00 0.00 174.94 171.51 2i03 s GLU 237 N -0.18 1.68 -0.02 3.50 2.02 -1.26 -1.98 118.70 122.45 2i03 s GLU 237 Ca 0.25 -0.60 -0.23 0.00 0.02 0.00 0.00 54.97 54.42 2i03 s GLU 237 Cb -0.16 -1.49 0.05 0.00 0.10 0.00 0.00 34.13 32.62 2i03 s GLU 237 CO 0.12 0.27 0.49 1.52 0.02 0.00 0.00 175.26 177.68 2i03 s TYR 238 N -0.05 -0.41 0.34 1.61 1.13 -0.21 -4.96 117.35 114.80 2i03 s TYR 238 Ca -0.01 0.66 -0.26 0.00 -1.41 0.00 0.00 57.07 56.04 2i03 s TYR 238 Cb -0.10 0.26 -0.09 0.00 -1.10 0.00 0.00 41.96 40.92 2i03 s TYR 238 CO 0.01 -0.51 1.05 -1.12 -2.51 0.00 0.00 175.55 172.47 2i03 s SER 239 N -1.34 7.04 -0.11 -0.18 0.01 -1.26 -0.05 113.70 117.81 2i03 s SER 239 Ca -0.12 2.10 0.01 0.00 1.31 0.00 0.00 55.95 59.25 2i03 s SER 239 Cb -0.02 -2.60 0.02 0.00 0.21 0.00 0.00 66.02 63.62 2i03 s SER 239 CO 0.06 -0.30 -0.13 0.12 0.41 0.00 0.00 173.24 173.41 2i03 s PHE 240 N -1.45 1.83 -0.09 2.43 5.36 0.59 -4.74 117.98 121.91 2i03 s PHE 240 Ca 0.51 -0.90 0.14 0.00 -0.96 0.00 0.00 56.93 55.73 2i03 s PHE 240 Cb -0.25 -1.37 -0.09 0.00 -0.34 0.00 0.00 43.02 40.96 2i03 s PHE 240 CO 0.32 -0.50 1.09 1.88 -1.46 0.00 0.00 175.22 176.55 2i03 h TYR 241 N 7.69 0.00 -1.14 10.12 -1.99 -1.96 -2.03 116.97 127.65 2i03 h TYR 241 Ca -0.32 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.41 2i03 h TYR 241 Cb 1.16 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.89 2i03 h TYR 241 CO 0.48 0.66 0.00 0.45 -0.00 0.00 0.00 178.16 179.75 2i03 n SER 242 N -3.09 -3.42 -4.71 3.88 2.88 -1.26 -4.74 113.62 103.16 2i03 n SER 242 Ca -0.05 0.00 -0.32 0.00 -1.33 0.00 0.00 58.87 57.17 2i03 n SER 242 Cb 0.84 0.00 0.13 0.00 -0.75 0.00 0.00 64.21 64.43 2i03 n SER 242 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2i03 s ASP 243 N -4.00 3.62 0.34 -3.46 1.01 -1.26 -4.89 116.67 108.03 2i03 s ASP 243 Ca 0.00 2.15 0.11 0.00 0.71 0.00 0.00 52.55 55.51 2i03 s ASP 243 Cb 0.00 -2.56 0.89 0.00 1.01 0.00 0.00 42.92 42.26 2i03 s ASP 243 CO 0.00 -2.63 1.76 -0.08 0.21 0.00 0.00 175.17 174.43 2i03 h GLU 244 N -1.28 0.58 0.00 8.23 4.81 -2.05 -2.11 114.58 122.77 2i03 h GLU 244 Ca -0.44 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2i03 h GLU 244 Cb 1.27 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 30.51 2i03 h GLU 244 CO 0.46 0.39 -0.00 0.66 -0.73 0.00 0.00 179.01 179.79 2i03 h SER 245 N 0.60 0.00 -2.91 1.04 4.64 -1.94 -3.42 113.55 111.57 2i03 h SER 245 Ca 0.60 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 61.35 2i03 h SER 245 Cb 1.16 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.21 2i03 h SER 245 CO -0.38 0.00 1.14 -0.22 -0.87 0.00 0.00 176.83 176.50 2i03 s LEU 246 N -6.16 3.70 0.12 5.97 0.20 -0.79 -4.89 118.68 116.82 2i03 s LEU 246 Ca -0.03 1.29 -0.15 0.00 0.69 0.00 0.00 54.13 55.92 2i03 s LEU 246 Cb 0.12 -3.53 -0.04 0.00 -0.43 0.00 0.00 46.19 42.31 2i03 s LEU 246 CO 0.44 -1.41 1.56 -0.61 -0.29 0.00 0.00 176.35 176.03 2i03 h GLN 247 N 11.19 0.65 -5.30 1.98 4.15 -1.90 -3.43 115.11 122.46 2i03 h GLN 247 Ca -0.31 -0.21 -0.64 0.00 0.77 0.00 0.00 58.65 58.26 2i03 h GLN 247 Cb 1.14 -0.06 -0.23 0.00 0.21 0.00 0.00 27.48 28.55 2i03 h GLN 247 CO 1.03 0.76 -0.68 0.71 -1.93 0.00 0.00 178.83 178.72 2i03 s TYR 248 N -4.98 2.99 0.51 3.99 1.51 -1.26 -5.10 117.35 115.01 2i03 s TYR 248 Ca -0.13 -0.36 -0.22 0.00 -1.01 0.00 0.00 57.07 55.34 2i03 s TYR 248 Cb 0.09 -1.94 -0.06 0.00 -0.11 0.00 0.00 41.96 39.95 2i03 s TYR 248 CO 0.78 -0.07 1.30 -2.14 -1.11 0.00 0.00 175.55 174.32 2i03 s PRO 249 N 0.36 3.39 0.10 -1.71 0.02 -1.26 -5.01 135.00 130.90 2i03 s PRO 249 Ca -0.05 2.10 0.03 0.00 0.02 0.00 0.00 61.00 63.09 2i03 s PRO 249 Cb -0.14 -2.35 -0.04 0.00 0.02 0.00 0.00 34.50 31.99 2i03 s PRO 249 CO 0.03 -0.95 0.16 -1.59 -0.33 0.00 0.00 177.00 174.32 2i03 s LYS 250 N -2.79 3.11 -0.24 5.54 -2.85 -0.77 -4.92 119.74 116.82 2i03 s LYS 250 Ca 0.68 -0.65 -0.09 0.00 -1.00 0.00 0.00 55.97 54.91 2i03 s LYS 250 Cb -0.37 -2.83 -0.04 0.00 -2.06 0.00 0.00 37.83 32.53 2i03 s LYS 250 CO 0.44 0.55 0.12 0.99 0.10 0.00 0.00 175.35 177.56 2i03 s THR 251 N -1.55 4.96 -0.15 3.79 2.01 -1.26 -0.30 115.64 123.14 2i03 s THR 251 Ca 0.32 0.04 -0.16 0.00 0.31 0.00 0.00 61.69 62.20 2i03 s THR 251 Cb -0.12 -3.31 -0.04 0.00 0.01 0.00 0.00 72.50 69.04 2i03 s THR 251 CO 0.25 0.34 0.39 -0.69 -0.69 0.00 0.00 174.62 174.22 2i03 s VAL 252 N 1.23 5.24 -0.05 3.82 1.01 0.93 -4.91 120.40 127.68 2i03 s VAL 252 Ca 0.06 0.74 0.02 0.00 0.00 0.00 0.00 61.98 62.80 2i03 s VAL 252 Cb -0.14 -3.72 0.02 0.00 0.00 0.00 0.00 36.38 32.53 2i03 s VAL 252 CO 0.05 0.34 -0.07 0.00 0.00 0.00 0.00 175.10 175.43 2i03 s ARG 253 N 0.64 1.02 -0.01 2.72 3.03 -1.26 -1.05 118.95 124.05 2i03 s ARG 253 Ca 0.21 -0.20 -0.02 0.00 2.03 0.00 0.00 55.73 57.75 2i03 s ARG 253 Cb -0.14 -0.95 -0.00 0.00 -1.03 0.00 0.00 34.95 32.83 2i03 s ARG 253 CO 0.07 -0.03 0.05 0.54 -1.13 0.00 0.00 175.30 174.80 2i03 s VAL 254 N 0.75 0.04 -0.16 4.99 0.11 -0.84 -4.96 120.40 120.33 2i03 s VAL 254 Ca -0.11 -0.31 -0.29 0.00 -2.93 0.00 0.00 61.98 58.34 2i03 s VAL 254 Cb -0.14 -0.18 -0.06 0.00 -1.53 0.00 0.00 36.38 34.47 2i03 s VAL 254 CO 0.01 -0.17 2.10 -2.84 -3.33 0.00 0.00 175.10 170.88 2i03 s PRO 255 N -0.51 3.43 -0.18 1.54 0.02 -1.26 -1.87 135.00 136.17 2i03 s PRO 255 Ca -0.06 2.13 -0.04 0.00 0.02 0.00 0.00 61.00 63.05 2i03 s PRO 255 Cb -0.04 -4.29 0.08 0.00 0.02 0.00 0.00 34.50 30.27 2i03 s PRO 255 CO 0.00 -1.76 0.15 -0.47 -0.33 0.00 0.00 177.00 174.60 2i03 s TYR 256 N 7.09 -0.03 -0.46 6.54 6.14 -0.52 -4.50 117.35 131.61 2i03 s TYR 256 Ca 0.95 -0.05 -0.28 0.00 0.64 0.00 0.00 57.07 58.33 2i03 s TYR 256 Cb -0.35 -0.53 0.03 0.00 0.42 0.00 0.00 41.96 41.53 2i03 s TYR 256 CO 0.36 -0.55 1.06 -1.25 0.64 0.00 0.00 175.55 175.81 2i03 s PRO 257 N 2.23 3.70 0.84 4.97 0.04 -1.26 -4.57 135.00 140.94 2i03 s PRO 257 Ca 0.04 0.48 -0.13 0.00 0.04 0.00 0.00 61.00 61.44 2i03 s PRO 257 Cb -0.16 -3.90 0.11 0.00 0.04 0.00 0.00 34.50 30.59 2i03 s PRO 257 CO -0.10 -1.28 1.21 0.15 0.04 0.00 0.00 177.00 177.02 2i03 s LYS 258 N 4.14 1.68 -0.08 4.56 1.02 -1.26 -0.54 119.74 129.25 2i03 s LYS 258 Ca 0.44 -0.00 -0.36 0.00 0.02 0.00 0.00 55.97 56.06 2i03 s LYS 258 Cb -0.09 -1.93 -0.14 0.00 -0.52 0.00 0.00 37.83 35.15 2i03 s LYS 258 CO 0.28 -1.77 1.70 0.00 -0.92 0.00 0.00 175.35 174.64 2i03 n ALA 259 N -3.41 0.30 -0.53 5.17 0.00 -0.23 -1.65 120.51 120.16 2i03 n ALA 259 Ca 0.10 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2i03 n ALA 259 Cb 0.61 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.74 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 3.87 1.49 3.94 0.00 0.00 -1.26 -4.83 105.19 108.40 2i03 n GLY 260 Ca 0.22 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.98 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 -3.36 3.14 0.06 4.61 0.00 -0.66 -5.01 121.76 120.54 2i03 s ALA 261 Ca 0.00 -1.15 -0.31 0.00 0.00 0.00 0.00 51.96 50.50 2i03 s ALA 261 Cb 0.00 -2.49 -0.08 0.00 0.00 0.00 0.00 23.12 20.55 2i03 s ALA 261 CO 0.00 -1.51 1.61 0.08 0.00 0.00 0.00 175.76 175.94 2i03 s VAL 262 N -3.32 3.12 0.47 0.00 1.01 -1.26 -4.88 120.40 115.54 2i03 s VAL 262 Ca 0.64 0.58 0.01 0.00 0.00 0.00 0.00 61.98 63.20 2i03 s VAL 262 Cb -0.08 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 32.93 2i03 s VAL 262 CO 0.46 0.00 0.69 0.20 0.00 0.00 0.00 175.10 176.45 2i03 s ASN 263 N 2.24 5.73 0.58 3.32 0.01 -1.26 -4.47 114.94 121.09 2i03 s ASN 263 Ca 0.72 0.22 -0.15 0.00 -0.71 0.00 0.00 52.86 52.94 2i03 s ASN 263 Cb -0.39 -1.40 -0.05 0.00 0.41 0.00 0.00 41.25 39.83 2i03 s ASN 263 CO 0.31 -0.78 1.03 -2.16 -1.51 0.00 0.00 177.10 174.00 2i03 s PRO 264 N -4.59 3.51 0.32 -0.60 0.04 -1.26 -4.81 135.00 127.61 2i03 s PRO 264 Ca 0.50 1.07 0.05 0.00 0.04 0.00 0.00 61.00 62.66 2i03 s PRO 264 Cb -0.10 -2.07 -0.02 0.00 0.04 0.00 0.00 34.50 32.36 2i03 s PRO 264 CO 0.38 -0.64 0.46 0.95 0.04 0.00 0.00 177.00 178.19 2i03 s THR 265 N -2.61 4.50 0.01 1.26 -4.23 -0.93 -4.89 115.64 108.75 2i03 s THR 265 Ca 0.61 -0.92 0.01 0.00 -1.18 0.00 0.00 61.69 60.21 2i03 s THR 265 Cb -0.13 -3.58 -0.01 0.00 1.34 0.00 0.00 72.50 70.11 2i03 s THR 265 CO 0.38 -0.25 -0.03 0.54 -0.54 0.00 0.00 174.62 174.71 2i03 s VAL 266 N -2.15 0.23 0.03 2.29 0.11 -1.26 -1.78 120.40 117.87 2i03 s VAL 266 Ca 0.42 -0.44 0.04 0.00 -2.93 0.00 0.00 61.98 59.07 2i03 s VAL 266 Cb -0.09 -0.26 -0.02 0.00 -1.53 0.00 0.00 36.38 34.48 2i03 s VAL 266 CO 0.31 -0.14 -0.12 -0.54 -3.33 0.00 0.00 175.10 171.29 2i03 s LYS 267 N -0.61 0.81 -0.04 1.54 1.02 -0.46 -4.96 119.74 117.04 2i03 s LYS 267 Ca -0.05 -0.67 0.06 0.00 0.02 0.00 0.00 55.97 55.33 2i03 s LYS 267 Cb -0.04 -0.78 -0.02 0.00 -0.52 0.00 0.00 37.83 36.47 2i03 s LYS 267 CO -0.00 0.19 -0.21 0.12 -0.92 0.00 0.00 175.35 174.53 2i03 s PHE 268 N -0.81 2.50 0.05 3.18 5.36 -1.26 0.14 117.98 127.13 2i03 s PHE 268 Ca -0.00 -0.39 0.01 0.00 -0.96 0.00 0.00 56.93 55.59 2i03 s PHE 268 Cb -0.07 -1.57 -0.03 0.00 -0.34 0.00 0.00 43.02 41.00 2i03 s PHE 268 CO 0.01 0.01 -0.05 -0.06 -1.46 0.00 0.00 175.22 173.67 2i03 s PHE 269 N -0.56 0.58 -0.05 10.12 0.40 -0.26 -1.22 117.98 126.99 2i03 s PHE 269 Ca 0.08 -0.74 -0.01 0.00 -0.60 0.00 0.00 56.93 55.66 2i03 s PHE 269 Cb -0.11 -0.37 0.03 0.00 0.51 0.00 0.00 43.02 43.08 2i03 s PHE 269 CO 0.00 -0.20 -0.00 0.08 0.70 0.00 0.00 175.22 175.80 2i03 s VAL 270 N -2.53 0.32 -0.03 -0.44 1.01 -0.16 -0.56 120.40 118.01 2i03 s VAL 270 Ca -0.02 0.09 0.06 0.00 0.00 0.00 0.00 61.98 62.11 2i03 s VAL 270 Cb -0.02 -0.45 -0.01 0.00 0.00 0.00 0.00 36.38 35.90 2i03 s VAL 270 CO -0.04 0.22 -0.22 0.54 0.00 0.00 0.00 175.10 175.60 2i03 s VAL 271 N 1.56 1.78 -0.17 2.92 0.11 0.26 -1.85 120.40 125.01 2i03 s VAL 271 Ca -0.02 -0.94 -0.29 0.00 -2.93 0.00 0.00 61.98 57.81 2i03 s VAL 271 Cb -0.13 -1.49 -0.00 0.00 -1.53 0.00 0.00 36.38 33.22 2i03 s VAL 271 CO -0.03 0.50 1.08 0.21 -3.33 0.00 0.00 175.10 173.53 2i03 s ASN 272 N -0.30 7.11 -0.07 3.54 3.04 -1.26 -1.01 114.94 125.98 2i03 s ASN 272 Ca 0.02 1.52 0.08 0.00 0.04 0.00 0.00 52.86 54.53 2i03 s ASN 272 Cb -0.11 -2.55 0.38 0.00 -1.54 0.00 0.00 41.25 37.43 2i03 s ASN 272 CO 0.01 -0.61 1.17 0.35 -3.04 0.00 0.00 177.10 174.98 2i03 n THR 273 N 5.03 1.05 0.01 -5.21 -2.24 0.57 -3.39 114.28 110.10 2i03 n THR 273 Ca 0.11 -0.62 0.01 0.00 -2.27 0.00 0.00 64.05 61.28 2i03 n THR 273 Cb 0.47 -0.16 0.01 0.00 -2.10 0.00 0.00 70.33 68.55 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 0.40 1.76 -0.01 3.42 8.00 -1.26 -4.63 116.55 124.24 2i03 n ASP 274 Ca 0.13 -1.67 0.03 0.00 0.71 0.00 0.00 54.79 53.99 2i03 n ASP 274 Cb 0.57 -0.02 -0.03 0.00 -0.02 0.00 0.00 41.12 41.62 2i03 n ASP 274 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2i03 n SER 275 N -0.22 0.33 -4.76 -2.24 7.64 -1.22 -5.03 113.62 108.12 2i03 n SER 275 Ca 0.01 -0.66 -0.41 0.00 1.01 0.00 0.00 58.87 58.82 2i03 n SER 275 Cb 0.19 0.98 -0.02 0.00 -1.01 0.00 0.00 64.21 64.34 2i03 n SER 275 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 2i03 s LEU 276 N -2.26 4.41 0.00 -3.43 -0.00 -1.26 -4.99 118.68 111.15 2i03 s LEU 276 Ca 0.03 2.65 0.00 0.00 -0.00 0.00 0.00 54.13 56.80 2i03 s LEU 276 Cb 0.05 -3.64 0.00 0.00 -0.00 0.00 0.00 46.19 42.60 2i03 s LEU 276 CO 0.26 -0.59 0.00 -1.54 -0.00 0.00 0.00 176.35 174.48 2i03 n SER 277 N 1.50 0.00 0.00 1.48 3.41 -1.26 -5.05 113.62 113.70 2i03 n SER 277 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 2i03 n SER 277 Cb 0.41 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.36 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 -0.38 0.00 -0.09 4.04 3.41 -1.26 -4.96 113.62 114.38 2i03 n SER 278 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.50 2i03 n SER 278 Cb 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 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 1.48 -3.03 -3.33 0.31 -1.26 -4.97 118.33 107.53 2i03 n VAL 279 Ca 0.00 0.09 -0.36 0.00 -0.01 0.00 0.00 64.34 64.06 2i03 n VAL 279 Cb 0.00 -2.29 -0.06 0.00 -0.91 0.00 0.00 33.84 30.57 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 -2.67 4.49 0.11 2.52 2.01 -1.26 -5.04 115.64 115.81 2i03 s THR 280 Ca -0.26 1.40 -0.30 0.00 0.31 0.00 0.00 61.69 62.84 2i03 s THR 280 Cb 0.05 -3.90 -0.07 0.00 0.01 0.00 0.00 72.50 68.59 2i03 s THR 280 CO 0.39 0.21 1.21 0.20 -0.69 0.00 0.00 174.62 175.94 2i03 s ASN 281 N -1.63 7.07 0.42 3.53 -0.87 -1.26 -4.40 114.94 117.80 2i03 s ASN 281 Ca 0.44 2.11 -0.25 0.00 -1.57 0.00 0.00 52.86 53.59 2i03 s ASN 281 Cb -0.17 -2.59 -0.10 0.00 -0.02 0.00 0.00 41.25 38.36 2i03 s ASN 281 CO 0.22 -0.44 1.05 0.00 -2.57 0.00 0.00 177.10 175.35 2i03 n ALA 282 N 3.44 0.33 -2.70 0.60 0.00 -1.26 -4.97 120.51 115.95 2i03 n ALA 282 Ca 0.07 0.24 -0.37 0.00 0.00 0.00 0.00 53.44 53.38 2i03 n ALA 282 Cb 0.45 -2.11 -0.11 0.00 0.00 0.00 0.00 19.45 17.69 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 -1.26 5.12 -0.23 0.00 2.01 -1.26 -5.00 115.64 115.02 2i03 s THR 283 Ca 0.63 0.10 -0.08 0.00 0.31 0.00 0.00 61.69 62.65 2i03 s THR 283 Cb -0.55 -3.41 -0.03 0.00 0.01 0.00 0.00 72.50 68.51 2i03 s THR 283 CO 0.57 0.31 0.08 -0.44 -0.69 0.00 0.00 174.62 174.44 2i03 s SER 284 N 1.45 5.37 -0.19 3.53 0.01 -1.26 -4.45 113.70 118.16 2i03 s SER 284 Ca 0.07 -0.10 -0.16 0.00 1.31 0.00 0.00 55.95 57.07 2i03 s SER 284 Cb -0.15 -1.95 -0.04 0.00 0.21 0.00 0.00 66.02 64.09 2i03 s SER 284 CO 0.07 0.03 0.39 -0.63 0.41 0.00 0.00 173.24 173.51 2i03 s ILE 285 N 1.25 5.22 0.03 1.44 1.09 -0.77 -4.87 121.20 124.58 2i03 s ILE 285 Ca 0.05 0.69 -0.22 0.00 -1.10 0.00 0.00 60.65 60.07 2i03 s ILE 285 Cb -0.14 -3.72 -0.06 0.00 -1.06 0.00 0.00 42.46 37.48 2i03 s ILE 285 CO 0.04 0.28 0.66 -1.58 -0.10 0.00 0.00 174.94 174.24 2i03 s GLN 286 N 1.14 4.38 -0.37 2.79 0.74 -1.26 -0.99 119.66 126.09 2i03 s GLN 286 Ca 0.19 0.88 -0.06 0.00 0.05 0.00 0.00 55.36 56.41 2i03 s GLN 286 Cb -0.14 -3.33 0.06 0.00 1.10 0.00 0.00 33.01 30.69 2i03 s GLN 286 CO 0.07 0.39 0.15 0.42 -0.55 0.00 0.00 175.29 175.77 2i03 s ILE 287 N -0.33 3.77 0.00 -2.34 1.01 -0.36 -4.89 121.20 118.06 2i03 s ILE 287 Ca 0.34 -1.35 0.00 0.00 0.00 0.00 0.00 60.65 59.63 2i03 s ILE 287 Cb -0.19 -3.24 0.00 0.00 0.01 0.00 0.00 42.46 39.03 2i03 s ILE 287 CO 0.20 -0.33 0.00 0.35 0.00 0.00 0.00 174.94 175.16 2i03 n THR 288 N 4.79 0.00 -3.15 2.92 -2.24 -1.26 -4.21 114.28 111.13 2i03 n THR 288 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2i03 n THR 288 Cb 0.44 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 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 -1.74 6.98 0.00 -1.26 -5.00 120.51 116.49 2i03 n ALA 289 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 2i03 n ALA 289 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 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 3.34 0.25 0.00 0.02 -1.26 -4.84 135.00 132.52 2i03 s PRO 290 Ca 0.00 0.86 -0.03 0.00 0.02 0.00 0.00 61.00 61.85 2i03 s PRO 290 Cb 0.00 -2.05 0.40 0.00 0.02 0.00 0.00 34.50 32.87 2i03 s PRO 290 CO 0.00 -0.77 1.85 0.00 -0.33 0.00 0.00 177.00 177.74 2i03 h ALA 291 N -0.38 1.28 0.00 -1.55 0.00 -1.98 0.67 119.26 117.31 2i03 h ALA 291 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2i03 h ALA 291 Cb 1.20 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2i03 h ALA 291 CO 0.60 0.27 0.00 0.66 0.00 0.00 0.00 179.25 180.77 2i03 h SER 292 N 0.98 0.00 0.00 0.00 4.64 -2.03 -2.79 113.55 114.35 2i03 h SER 292 Ca 0.41 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 61.37 2i03 h SER 292 Cb 0.26 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.29 2i03 h SER 292 CO -0.20 0.00 -2.38 0.80 -0.87 0.00 0.00 176.83 174.17 2i03 n MET 293 N -2.57 0.64 0.26 4.77 0.00 0.03 -4.50 117.12 115.75 2i03 n MET 293 Ca -0.01 0.12 0.17 0.00 0.00 0.00 0.00 57.70 57.99 2i03 n MET 293 Cb 0.10 -1.49 0.85 0.00 0.00 0.00 0.00 33.22 32.68 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 0.00 -0.89 3.38 -0.74 -2.80 115.31 114.27 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 1.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.64 2i03 h LEU 294 CO -0.07 0.00 0.00 2.30 0.09 0.00 0.00 178.44 180.76 2i03 n ILE 295 N -2.79 1.11 -3.69 1.22 -5.35 -1.17 -4.85 119.36 103.83 2i03 n ILE 295 Ca -0.01 0.28 0.00 0.00 -0.27 0.00 0.00 62.75 62.75 2i03 n ILE 295 Cb 0.14 -1.16 0.00 0.00 -1.74 0.00 0.00 39.64 36.88 2i03 n ILE 295 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2i03 n GLY 296 N -0.73 0.84 3.74 3.28 0.00 -1.06 -5.14 105.19 106.13 2i03 n GLY 296 Ca 0.03 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.26 3.54 -2.44 1.61 8.00 -1.26 -4.94 116.55 120.80 2i03 n ASP 297 Ca 0.00 1.18 -0.10 0.00 0.71 0.00 0.00 54.79 56.58 2i03 n ASP 297 Cb 0.00 -1.57 -0.01 0.00 -0.02 0.00 0.00 41.12 39.52 2i03 n ASP 297 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2i03 n HIS 298 N 1.28 -1.38 -3.91 1.24 1.44 -1.26 -1.26 115.22 111.37 2i03 n HIS 298 Ca 0.06 -1.65 -0.10 0.00 -2.01 0.00 0.00 57.72 54.01 2i03 n HIS 298 Cb 0.37 0.47 -0.10 0.00 0.12 0.00 0.00 29.99 30.85 2i03 n HIS 298 CO 0.00 0.00 0.00 0.71 -2.81 0.00 0.00 176.34 174.24 2i03 s TYR 299 N -3.60 0.12 -0.25 -1.40 2.02 0.24 -4.79 117.35 109.69 2i03 s TYR 299 Ca 0.19 -0.30 -0.18 0.00 -0.37 0.00 0.00 57.07 56.42 2i03 s TYR 299 Cb -0.01 -0.10 -0.03 0.00 -0.40 0.00 0.00 41.96 41.42 2i03 s TYR 299 CO 0.14 -0.28 0.51 -1.17 -1.57 0.00 0.00 175.55 173.18 2i03 s LEU 300 N -1.56 4.07 0.00 -1.29 2.96 -1.26 -0.14 118.68 121.46 2i03 s LEU 300 Ca -0.13 0.55 0.03 0.00 -0.22 0.00 0.00 54.13 54.35 2i03 s LEU 300 Cb -0.07 -2.67 0.01 0.00 0.50 0.00 0.00 46.19 43.96 2i03 s LEU 300 CO -0.00 -0.26 0.46 0.00 -1.32 0.00 0.00 176.35 175.23 2i03 s ASP 302 N -0.47 -0.31 -0.05 0.00 -1.08 -1.08 -4.91 116.67 108.77 2i03 s ASP 302 Ca 0.03 0.54 0.01 0.00 -0.52 0.00 0.00 52.55 52.60 2i03 s ASP 302 Cb 0.02 0.86 0.02 0.00 -1.46 0.00 0.00 42.92 42.37 2i03 s ASP 302 CO 0.05 -0.09 -0.04 0.54 0.52 0.00 0.00 175.17 176.15 2i03 s VAL 303 N 0.73 0.52 -0.03 1.11 0.11 -1.26 -0.66 120.40 120.92 2i03 s VAL 303 Ca -0.02 -0.08 -0.01 0.00 -2.93 0.00 0.00 61.98 58.94 2i03 s VAL 303 Cb -0.04 -0.57 0.03 0.00 -1.53 0.00 0.00 36.38 34.27 2i03 s VAL 303 CO -0.12 0.24 0.05 -0.89 -3.33 0.00 0.00 175.10 171.05 2i03 s THR 304 N 1.16 -0.08 0.05 5.04 2.01 -0.65 -5.02 115.64 118.14 2i03 s THR 304 Ca -0.07 0.29 -0.30 0.00 0.31 0.00 0.00 61.69 61.92 2i03 s THR 304 Cb -0.14 -0.12 -0.04 0.00 0.01 0.00 0.00 72.50 72.21 2i03 s THR 304 CO -0.01 0.12 1.00 0.26 -0.69 0.00 0.00 174.62 175.30 2i03 s TRP 305 N 1.50 3.69 -0.18 4.92 0.52 -1.26 -0.74 118.94 127.38 2i03 s TRP 305 Ca -0.04 1.69 -0.16 0.00 0.02 0.00 0.00 56.10 57.61 2i03 s TRP 305 Cb -0.13 -3.14 -0.13 0.00 -1.15 0.00 0.00 33.47 28.93 2i03 s TRP 305 CO -0.03 -0.09 0.08 0.00 0.02 0.00 0.00 176.95 176.93 2i03 h ALA 306 N 6.31 0.15 -3.26 0.98 0.00 -1.33 -3.47 119.26 118.64 2i03 h ALA 306 Ca -0.42 -0.87 -0.10 0.00 0.00 0.00 0.00 54.91 53.52 2i03 h ALA 306 Cb 1.22 0.60 -0.02 0.00 0.00 0.00 0.00 17.79 19.58 2i03 h ALA 306 CO 0.74 0.57 -0.08 0.25 0.00 0.00 0.00 179.25 180.73 2i03 n THR 307 N -4.52 0.00 0.19 0.00 -2.24 -0.90 -4.69 114.28 102.12 2i03 n THR 307 Ca -0.21 -0.52 0.16 0.00 -2.27 0.00 0.00 64.05 61.21 2i03 n THR 307 Cb 0.49 0.28 0.79 0.00 -2.10 0.00 0.00 70.33 69.80 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 -3.06 115.11 110.39 2i03 h GLN 308 Ca -0.06 0.00 -0.13 0.00 -1.45 0.00 0.00 58.65 57.01 2i03 h GLN 308 Cb 0.28 0.00 -0.28 0.00 -0.05 0.00 0.00 27.48 27.44 2i03 h GLN 308 CO 0.08 0.00 -0.87 0.39 -0.95 0.00 0.00 178.83 177.48 2i03 n GLU 309 N -3.98 0.36 -3.72 1.46 1.02 -1.26 -4.87 120.64 109.65 2i03 n GLU 309 Ca 0.02 -2.23 -0.15 0.00 -0.02 0.00 0.00 57.16 54.78 2i03 n GLU 309 Cb 0.31 -0.40 -0.15 0.00 -0.02 0.00 0.00 31.44 31.17 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 -0.74 0.06 -0.03 3.49 3.52 -1.16 -1.51 118.95 122.59 2i03 s ARG 310 Ca 0.33 0.43 0.02 0.00 -0.13 0.00 0.00 55.73 56.38 2i03 s ARG 310 Cb 0.36 -0.22 0.01 0.00 -1.56 0.00 0.00 34.95 33.53 2i03 s ARG 310 CO -0.13 -0.22 -0.08 -1.50 -0.81 0.00 0.00 175.30 172.56 2i03 s ILE 311 N 1.57 0.69 -0.07 4.11 2.07 -0.26 -0.80 121.20 128.50 2i03 s ILE 311 Ca -0.05 -0.30 -0.03 0.00 -1.41 0.00 0.00 60.65 58.86 2i03 s ILE 311 Cb -0.12 -0.63 -0.04 0.00 0.13 0.00 0.00 42.46 41.81 2i03 s ILE 311 CO -0.06 0.22 0.06 -0.94 -1.91 0.00 0.00 174.94 172.32 2i03 s SER 312 N 0.25 5.68 0.07 4.50 1.04 0.08 -1.14 113.70 124.17 2i03 s SER 312 Ca -0.04 0.24 0.07 0.00 0.48 0.00 0.00 55.95 56.70 2i03 s SER 312 Cb -0.09 -1.68 -0.03 0.00 0.10 0.00 0.00 66.02 64.32 2i03 s SER 312 CO 0.00 0.36 -0.20 -0.76 0.98 0.00 0.00 173.24 173.63 2i03 s LEU 313 N -1.15 2.22 -0.10 2.42 1.02 0.14 -1.64 118.68 121.59 2i03 s LEU 313 Ca 0.16 -0.58 0.01 0.00 0.02 0.00 0.00 54.13 53.74 2i03 s LEU 313 Cb -0.12 -0.87 0.02 0.00 0.02 0.00 0.00 46.19 45.24 2i03 s LEU 313 CO 0.06 0.09 -0.11 -1.10 0.02 0.00 0.00 176.35 175.32 2i03 s GLN 314 N -1.46 1.72 0.23 1.70 -0.21 0.17 0.28 119.66 122.08 2i03 s GLN 314 Ca 0.06 -0.37 0.08 0.00 0.02 0.00 0.00 55.36 55.15 2i03 s GLN 314 Cb -0.09 -1.58 -0.04 0.00 1.00 0.00 0.00 33.01 32.30 2i03 s GLN 314 CO 0.03 -0.13 0.03 -1.58 -2.12 0.00 0.00 175.29 171.51 2i03 s TRP 315 N 1.20 2.81 -0.01 0.91 0.52 -0.09 -0.64 118.94 123.64 2i03 s TRP 315 Ca -0.04 -0.17 0.00 0.00 0.02 0.00 0.00 56.10 55.91 2i03 s TRP 315 Cb -0.14 -1.30 0.02 0.00 -1.15 0.00 0.00 33.47 30.90 2i03 s TRP 315 CO -0.03 0.56 0.01 -1.17 0.02 0.00 0.00 176.95 176.34 2i03 s LEU 316 N -3.40 1.45 0.67 2.99 2.96 0.80 -1.65 118.68 122.49 2i03 s LEU 316 Ca 0.30 0.00 -0.14 0.00 -0.22 0.00 0.00 54.13 54.07 2i03 s LEU 316 Cb -0.08 -0.09 0.00 0.00 0.50 0.00 0.00 46.19 46.52 2i03 s LEU 316 CO 0.20 -0.07 1.10 -0.13 -1.32 0.00 0.00 176.35 176.13 2i03 s ARG 317 N 0.65 2.82 0.36 1.98 0.52 -0.92 0.79 118.95 125.15 2i03 s ARG 317 Ca -0.06 1.30 0.07 0.00 -0.52 0.00 0.00 55.73 56.52 2i03 s ARG 317 Cb -0.08 -1.96 0.77 0.00 0.52 0.00 0.00 34.95 34.20 2i03 s ARG 317 CO -0.02 -1.22 1.95 -0.09 0.02 0.00 0.00 175.30 175.94 2i03 h ARG 318 N -0.10 0.70 -5.28 3.54 2.43 -1.49 -2.57 114.38 111.62 2i03 h ARG 318 Ca -0.46 -0.04 -0.66 0.00 -0.81 0.00 0.00 59.98 58.00 2i03 h ARG 318 Cb 1.24 -0.16 -0.16 0.00 -0.42 0.00 0.00 29.97 30.47 2i03 h ARG 318 CO 0.54 0.47 0.85 0.42 -1.51 0.00 0.00 179.97 180.74 2i03 s ILE 319 N -5.66 4.52 0.00 1.20 -1.09 -1.26 -4.81 121.20 114.09 2i03 s ILE 319 Ca -0.10 -1.16 0.00 0.00 -2.23 0.00 0.00 60.65 57.16 2i03 s ILE 319 Cb 0.20 -4.80 0.00 0.00 -1.58 0.00 0.00 42.46 36.28 2i03 s ILE 319 CO 0.77 -1.56 0.00 0.00 -1.23 0.00 0.00 174.94 172.93 2i03 n GLN 320 N 7.16 0.00 0.04 2.79 6.02 -0.97 -3.49 117.38 128.93 2i03 n GLN 320 Ca 0.18 0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.95 2i03 n GLN 320 Cb 0.48 -1.45 -0.14 0.00 1.02 0.00 0.00 30.24 30.15 2i03 n GLN 320 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.06 175.14 2i03 h ASN 321 N 3.23 0.50 -3.76 1.08 2.35 -1.83 -2.73 115.58 114.43 2i03 h ASN 321 Ca 0.00 -0.90 -0.69 0.00 -0.55 0.00 0.00 56.30 54.17 2i03 h ASN 321 Cb 0.00 -0.16 -0.31 0.00 0.05 0.00 0.00 38.32 37.89 2i03 h ASN 321 CO 0.00 1.70 -0.87 -0.47 -1.65 0.00 0.00 177.43 176.13 2i03 s TYR 322 N -2.52 2.51 0.04 1.19 6.14 -1.23 -2.37 117.35 121.11 2i03 s TYR 322 Ca -0.18 -0.81 0.01 0.00 0.64 0.00 0.00 57.07 56.73 2i03 s TYR 322 Cb 0.05 -1.65 -0.03 0.00 0.42 0.00 0.00 41.96 40.75 2i03 s TYR 322 CO 0.81 -0.27 -0.06 -1.54 0.64 0.00 0.00 175.55 175.13 2i03 s SER 323 N 0.01 0.67 -0.02 4.32 1.04 -0.73 -2.17 113.70 116.81 2i03 s SER 323 Ca -0.08 -0.64 0.03 0.00 0.48 0.00 0.00 55.95 55.73 2i03 s SER 323 Cb -0.15 0.08 -0.00 0.00 0.10 0.00 0.00 66.02 66.05 2i03 s SER 323 CO 0.05 -0.31 -0.11 -0.69 0.98 0.00 0.00 173.24 173.16 2i03 s VAL 324 N -1.97 0.93 -0.24 5.02 1.01 -0.66 -1.50 120.40 122.99 2i03 s VAL 324 Ca -0.07 -0.47 -0.07 0.00 0.00 0.00 0.00 61.98 61.36 2i03 s VAL 324 Cb -0.06 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 2i03 s VAL 324 CO -0.02 0.28 0.06 -0.32 0.00 0.00 0.00 175.10 175.10 2i03 s MET 325 N -0.05 3.66 0.04 2.72 1.75 -0.25 -0.92 119.30 126.26 2i03 s MET 325 Ca 0.00 -0.48 0.02 0.00 -1.25 0.00 0.00 55.69 53.98 2i03 s MET 325 Cb -0.07 -3.30 -0.04 0.00 2.84 0.00 0.00 34.83 34.26 2i03 s MET 325 CO 0.00 -0.17 0.08 0.34 -0.65 0.00 0.00 175.02 174.62 2i03 s ASP 326 N 1.55 5.57 -0.24 1.11 -1.08 0.14 -1.33 116.67 122.38 2i03 s ASP 326 Ca 0.06 0.05 0.00 0.00 -0.52 0.00 0.00 52.55 52.14 2i03 s ASP 326 Cb -0.15 -1.53 0.06 0.00 -1.46 0.00 0.00 42.92 39.84 2i03 s ASP 326 CO 0.03 0.21 -0.03 -0.63 0.52 0.00 0.00 175.17 175.27 2i03 s ILE 327 N -1.30 1.44 -0.06 4.11 1.01 -1.26 -0.69 121.20 124.45 2i03 s ILE 327 Ca 0.27 -1.22 -0.00 0.00 0.00 0.00 0.00 60.65 59.70 2i03 s ILE 327 Cb -0.12 -1.76 -0.03 0.00 0.01 0.00 0.00 42.46 40.56 2i03 s ILE 327 CO 0.19 -0.16 -0.02 0.00 0.00 0.00 0.00 174.94 174.95 2i03 s ASP 329 N -1.05 4.01 0.11 0.00 1.11 -1.03 -1.11 116.67 118.71 2i03 s ASP 329 Ca 0.15 -0.56 -0.30 0.00 0.18 0.00 0.00 52.55 52.02 2i03 s ASP 329 Cb -0.11 -0.61 -0.06 0.00 1.07 0.00 0.00 42.92 43.21 2i03 s ASP 329 CO 0.04 0.16 1.01 -0.47 1.18 0.00 0.00 175.17 177.10 2i03 s TYR 330 N -1.29 3.72 -1.12 4.23 5.04 -0.57 -1.93 117.35 125.42 2i03 s TYR 330 Ca 0.20 1.71 -0.13 0.00 -2.44 0.00 0.00 57.07 56.41 2i03 s TYR 330 Cb -0.10 -3.14 0.20 0.00 0.35 0.00 0.00 41.96 39.27 2i03 s TYR 330 CO 0.12 -0.12 1.26 0.34 -1.34 0.00 0.00 175.55 175.80 2i03 s ASP 331 N 0.16 7.08 0.00 4.32 -1.08 0.08 -4.93 116.67 122.30 2i03 s ASP 331 Ca 0.49 -3.06 0.00 0.00 -0.52 0.00 0.00 52.55 49.46 2i03 s ASP 331 Cb -0.25 -2.33 0.00 0.00 -1.46 0.00 0.00 42.92 38.88 2i03 s ASP 331 CO 0.31 -0.63 0.00 1.21 0.52 0.00 0.00 175.17 176.58 2i03 n GLU 332 N 4.72 0.00 -1.83 4.34 4.07 -1.26 0.57 120.64 131.25 2i03 n GLU 332 Ca 0.30 0.00 -0.38 0.00 -0.06 0.00 0.00 57.16 57.02 2i03 n GLU 332 Cb 0.43 0.00 0.05 0.00 -0.06 0.00 0.00 31.44 31.85 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 -3.20 7.41 0.00 4.31 7.64 -1.26 -4.14 113.62 124.37 2i03 n SER 333 Ca 0.00 -3.82 0.00 0.00 1.01 0.00 0.00 58.87 56.06 2i03 n SER 333 Cb 0.00 -1.01 0.00 0.00 -1.01 0.00 0.00 64.21 62.19 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 -0.62 0.00 0.00 6.43 7.64 0.19 -5.04 113.62 122.23 2i03 n SER 334 Ca 0.55 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.43 2i03 n SER 334 Cb 0.35 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.55 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 -0.11 2.58 3.94 0.23 0.00 -0.60 -5.01 105.19 106.22 2i03 n GLY 335 Ca 0.00 -0.03 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 2.28 -0.16 1.61 1.04 -1.26 -4.73 118.95 117.73 2i03 s ARG 336 Ca 0.00 -0.39 -0.02 0.00 -1.04 0.00 0.00 55.73 54.28 2i03 s ARG 336 Cb 0.00 -2.25 -0.02 0.00 -2.04 0.00 0.00 34.95 30.64 2i03 s ARG 336 CO 0.00 -1.11 -0.07 -1.58 -0.04 0.00 0.00 175.30 172.50 2i03 s TRP 337 N -3.13 2.93 -0.16 5.89 0.52 -1.26 -0.74 118.94 122.99 2i03 s TRP 337 Ca 0.59 -0.58 -0.02 0.00 0.02 0.00 0.00 56.10 56.11 2i03 s TRP 337 Cb -0.11 -1.96 -0.01 0.00 -1.15 0.00 0.00 33.47 30.24 2i03 s TRP 337 CO 0.43 -0.23 -0.10 -0.80 0.02 0.00 0.00 176.95 176.27 2i03 s ASN 338 N 0.65 4.14 -0.54 2.95 -0.87 -0.81 -4.89 114.94 115.56 2i03 s ASN 338 Ca -0.04 -0.34 -0.13 0.00 -1.57 0.00 0.00 52.86 50.79 2i03 s ASN 338 Cb -0.15 -1.66 0.14 0.00 -0.02 0.00 0.00 41.25 39.56 2i03 s ASN 338 CO 0.02 0.11 0.46 0.00 -2.57 0.00 0.00 177.10 175.12 2i03 n LEU 340 N 4.94 3.98 -4.58 0.00 4.77 -1.25 -4.93 117.00 119.92 2i03 n LEU 340 Ca -0.08 0.98 -0.29 0.00 -0.03 0.00 0.00 56.01 56.59 2i03 n LEU 340 Cb 0.41 -1.53 0.22 0.00 -2.33 0.00 0.00 43.42 40.19 2i03 n LEU 340 CO 0.47 0.14 0.59 0.54 -1.33 0.00 0.00 177.39 177.80 2i03 s VAL 341 N 2.91 1.84 0.00 4.08 0.11 -1.26 -2.30 120.40 125.79 2i03 s VAL 341 Ca 0.83 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.88 2i03 s VAL 341 Cb -0.50 -2.36 0.00 0.00 -1.53 0.00 0.00 36.38 31.99 2i03 s VAL 341 CO 0.39 0.00 0.00 0.00 -3.33 0.00 0.00 175.10 172.16 2i03 n ALA 342 N -4.63 0.00 0.86 1.54 0.00 -1.26 -4.46 120.51 112.56 2i03 n ALA 342 Ca 0.07 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.60 2i03 n ALA 342 Cb 0.57 -0.29 -0.05 0.00 0.00 0.00 0.00 19.45 19.69 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 -1.84 1.23 -3.45 0.00 0.63 -0.97 -4.79 116.66 107.47 2i03 n ARG 343 Ca 0.00 -0.47 -0.27 0.00 -0.92 0.00 0.00 57.85 56.19 2i03 n ARG 343 Cb 0.00 -1.37 -0.03 0.00 0.45 0.00 0.00 32.46 31.51 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 -2.44 3.57 -0.06 -0.14 -2.07 -1.23 -4.61 119.66 112.67 2i03 s GLN 344 Ca 0.12 -0.16 0.05 0.00 -1.82 0.00 0.00 55.36 53.54 2i03 s GLN 344 Cb 0.15 -2.71 -0.00 0.00 -1.09 0.00 0.00 33.01 29.36 2i03 s GLN 344 CO 0.61 0.26 -0.21 -1.01 -1.32 0.00 0.00 175.29 173.62 2i03 s HIS 345 N -2.06 2.16 -0.07 9.60 3.76 -0.44 -4.95 115.29 123.29 2i03 s HIS 345 Ca 0.42 -0.71 -0.14 0.00 -0.15 0.00 0.00 55.06 54.47 2i03 s HIS 345 Cb -0.11 -1.44 -0.05 0.00 1.11 0.00 0.00 32.58 32.09 2i03 s HIS 345 CO 0.31 -0.25 0.36 0.42 -0.85 0.00 0.00 174.74 174.72 2i03 s ILE 346 N 0.08 5.18 -0.19 0.60 1.01 -1.26 -1.09 121.20 125.52 2i03 s ILE 346 Ca -0.08 0.71 -0.02 0.00 0.00 0.00 0.00 60.65 61.26 2i03 s ILE 346 Cb -0.14 -3.67 0.05 0.00 0.01 0.00 0.00 42.46 38.71 2i03 s ILE 346 CO 0.04 0.50 -0.00 -0.70 0.00 0.00 0.00 174.94 174.79 2i03 s GLU 347 N -0.47 0.98 0.36 2.79 2.12 -0.56 -5.02 118.70 118.89 2i03 s GLU 347 Ca 0.21 -0.53 0.03 0.00 0.36 0.00 0.00 54.97 55.05 2i03 s GLU 347 Cb -0.15 -2.13 -0.04 0.00 0.26 0.00 0.00 34.13 32.08 2i03 s GLU 347 CO 0.09 -0.58 0.11 0.00 -0.54 0.00 0.00 175.26 174.35 2i03 s MET 348 N 1.73 1.76 -0.07 4.30 0.23 -1.26 -1.78 119.30 124.21 2i03 s MET 348 Ca -0.01 -2.03 -0.08 0.00 -1.03 0.00 0.00 55.69 52.53 2i03 s MET 348 Cb -0.17 -0.58 0.02 0.00 -1.53 0.00 0.00 34.83 32.57 2i03 s MET 348 CO -0.07 -0.38 0.22 0.45 -2.03 0.00 0.00 175.02 173.21 2i03 s SER 349 N -3.52 -0.20 -0.01 -1.18 0.15 -1.00 -5.00 113.70 102.95 2i03 s SER 349 Ca 0.30 0.34 0.14 0.00 0.70 0.00 0.00 55.95 57.43 2i03 s SER 349 Cb 0.05 0.42 -0.18 0.00 -1.71 0.00 0.00 66.02 64.60 2i03 s SER 349 CO 0.15 -0.15 0.49 0.35 1.20 0.00 0.00 173.24 175.28 2i03 n THR 350 N 2.61 0.00 -0.04 6.45 -2.24 -1.26 -4.48 114.28 115.32 2i03 n THR 350 Ca -0.15 -0.23 -0.09 0.00 -2.27 0.00 0.00 64.05 61.31 2i03 n THR 350 Cb 0.58 0.69 -0.14 0.00 -2.10 0.00 0.00 70.33 69.36 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 -1.57 1.58 0.00 4.28 -2.24 -1.26 -5.06 114.28 110.00 2i03 n THR 351 Ca 0.01 -0.80 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 2i03 n THR 351 Cb 0.27 -0.97 0.00 0.00 -2.10 0.00 0.00 70.33 67.54 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 1.61 2.90 2.32 3.38 0.00 -1.26 -4.82 105.19 109.32 2i03 n GLY 352 Ca -0.20 -0.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.65 2i03 n GLY 352 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2i03 n TRP 353 N 0.00 -3.04 -4.28 1.61 2.14 -1.26 -4.60 117.44 108.01 2i03 n TRP 353 Ca 0.00 -1.08 -0.34 0.00 2.07 0.00 0.00 57.50 58.15 2i03 n TRP 353 Cb 0.00 -0.42 -0.11 0.00 -0.81 0.00 0.00 31.31 29.97 2i03 n TRP 353 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 2i03 s VAL 354 N -1.66 4.25 0.02 -1.67 1.01 -1.03 -4.71 120.40 116.61 2i03 s VAL 354 Ca 0.39 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.13 2i03 s VAL 354 Cb -0.02 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.50 2i03 s VAL 354 CO 0.26 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.48 2i03 n GLY 355 N 3.23 -1.54 0.12 4.51 0.00 -1.26 -3.43 105.19 106.82 2i03 n GLY 355 Ca -0.17 -1.50 -0.16 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 -0.08 0.32 0.00 1.61 3.08 -1.94 -3.40 114.38 113.97 2i03 h ARG 356 Ca -0.00 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.72 2i03 h ARG 356 Cb 0.08 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.22 2i03 h ARG 356 CO 0.00 1.01 -0.66 1.19 -1.07 0.00 0.00 179.97 180.45 2i03 n PHE 357 N -4.35 0.00 -3.51 3.04 3.72 -1.26 -4.86 117.46 110.24 2i03 n PHE 357 Ca -0.10 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.20 2i03 n PHE 357 Cb 0.59 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.10 2i03 n PHE 357 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 2i03 s ARG 358 N -1.46 0.84 0.36 -1.08 1.70 -1.25 -5.01 118.95 113.05 2i03 s ARG 358 Ca 0.00 -0.20 -0.26 0.00 -0.47 0.00 0.00 55.73 54.80 2i03 s ARG 358 Cb 0.00 0.39 -0.12 0.00 -0.57 0.00 0.00 34.95 34.65 2i03 s ARG 358 CO 0.00 -0.35 0.97 -2.30 -1.08 0.00 0.00 175.30 172.55 2i03 n PRO 359 N -0.01 1.31 -1.14 3.89 -0.02 -1.22 -4.28 135.00 133.52 2i03 n PRO 359 Ca -0.11 0.46 -0.31 0.00 -2.02 0.00 0.00 63.50 61.53 2i03 n PRO 359 Cb 0.61 -1.92 0.11 0.00 -0.02 0.00 0.00 33.50 32.28 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 -0.67 4.16 0.07 2.55 1.04 -1.26 -4.96 113.70 114.63 2i03 s SER 360 Ca 0.61 1.89 -0.22 0.00 0.48 0.00 0.00 55.95 58.72 2i03 s SER 360 Cb -0.62 -2.53 -0.07 0.00 0.10 0.00 0.00 66.02 62.91 2i03 s SER 360 CO 0.58 -2.27 0.64 -0.70 0.98 0.00 0.00 173.24 172.48 2i03 s GLU 361 N -4.85 4.34 0.56 4.02 2.12 -1.26 -4.92 118.70 118.71 2i03 s GLU 361 Ca 0.62 0.86 -0.11 0.00 0.36 0.00 0.00 54.97 56.70 2i03 s GLU 361 Cb -0.18 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 30.88 2i03 s GLU 361 CO 0.56 0.52 0.96 -1.25 -0.54 0.00 0.00 175.26 175.52 2i03 s PRO 362 N -0.78 3.68 -0.28 4.30 0.04 -1.26 -4.63 135.00 136.06 2i03 s PRO 362 Ca 0.32 0.69 -0.01 0.00 0.04 0.00 0.00 61.00 62.04 2i03 s PRO 362 Cb -0.20 -2.16 0.09 0.00 0.04 0.00 0.00 34.50 32.27 2i03 s PRO 362 CO 0.21 -0.40 0.08 -1.01 0.04 0.00 0.00 177.00 175.91 2i03 s HIS 363 N -2.92 1.55 0.47 0.56 3.76 0.68 -4.95 115.29 114.45 2i03 s HIS 363 Ca 0.54 -1.53 -0.19 0.00 -0.15 0.00 0.00 55.06 53.73 2i03 s HIS 363 Cb -0.11 -1.54 -0.09 0.00 1.11 0.00 0.00 32.58 31.95 2i03 s HIS 363 CO 0.46 -0.82 0.98 -0.06 -0.85 0.00 0.00 174.74 174.44 2i03 s PHE 364 N 1.67 3.31 0.75 1.40 0.40 -1.26 -0.43 117.98 123.83 2i03 s PHE 364 Ca 0.07 1.55 -0.11 0.00 -0.60 0.00 0.00 56.93 57.84 2i03 s PHE 364 Cb -0.17 -2.86 0.04 0.00 0.51 0.00 0.00 43.02 40.54 2i03 s PHE 364 CO -0.22 -0.32 1.10 0.95 0.70 0.00 0.00 175.22 177.43 2i03 s THR 365 N -2.32 3.21 0.17 0.64 -4.23 0.36 -4.88 115.64 108.60 2i03 s THR 365 Ca 0.62 0.39 -0.27 0.00 -1.18 0.00 0.00 61.69 61.25 2i03 s THR 365 Cb -0.10 -3.28 0.01 0.00 1.34 0.00 0.00 72.50 70.47 2i03 s THR 365 CO 0.21 -0.51 1.55 0.25 -0.54 0.00 0.00 174.62 175.57 2i03 h LEU 366 N -0.88 -1.90 0.00 4.79 5.85 -1.93 0.15 115.31 121.40 2i03 h LEU 366 Ca -0.46 0.31 0.00 0.00 0.84 0.00 0.00 57.88 58.57 2i03 h LEU 366 Cb 1.26 0.86 0.00 0.00 0.37 0.00 0.00 40.66 43.16 2i03 h LEU 366 CO 0.62 -0.27 0.00 -0.90 -0.34 0.00 0.00 178.44 177.55 2i03 n ASP 367 N -5.33 0.00 -1.60 1.25 5.75 -1.26 -4.87 116.55 110.49 2i03 n ASP 367 Ca 0.03 0.31 -0.16 0.00 -0.01 0.00 0.00 54.79 54.96 2i03 n ASP 367 Cb 0.31 -0.39 -0.03 0.00 -1.03 0.00 0.00 41.12 39.98 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 -0.39 0.46 0.68 6.12 0.00 0.52 -4.86 105.19 107.72 2i03 n GLY 368 Ca 0.04 -0.23 0.10 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.90 2.40 -3.62 1.61 4.13 -1.26 -4.93 115.26 112.69 2i03 n ASN 369 Ca -0.18 -1.70 -0.12 0.00 1.68 0.00 0.00 54.58 54.26 2i03 n ASN 369 Cb 0.60 0.16 -0.05 0.00 -1.54 0.00 0.00 39.78 38.95 2i03 n ASN 369 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2i03 s SER 370 N -1.86 -0.32 0.18 6.41 1.04 -1.26 -1.76 113.70 116.13 2i03 s SER 370 Ca 0.21 -0.04 -0.17 0.00 0.48 0.00 0.00 55.95 56.43 2i03 s SER 370 Cb 0.16 0.46 0.03 0.00 0.10 0.00 0.00 66.02 66.77 2i03 s SER 370 CO 0.33 -0.74 0.50 0.72 0.98 0.00 0.00 173.24 175.04 2i03 s PHE 371 N -2.85 -0.12 0.10 5.02 -0.12 -0.82 -0.48 117.98 118.71 2i03 s PHE 371 Ca -0.03 -0.22 0.09 0.00 -0.05 0.00 0.00 56.93 56.72 2i03 s PHE 371 Cb -0.00 0.36 -0.03 0.00 -0.63 0.00 0.00 43.02 42.71 2i03 s PHE 371 CO -0.05 -0.88 -0.23 0.71 -0.05 0.00 0.00 175.22 174.73 2i03 s TYR 372 N -3.87 1.95 -0.15 3.49 1.51 0.43 -0.44 117.35 120.29 2i03 s TYR 372 Ca 0.09 -0.40 -0.29 0.00 -1.01 0.00 0.00 57.07 55.45 2i03 s TYR 372 Cb -0.00 -1.09 0.10 0.00 -0.11 0.00 0.00 41.96 40.85 2i03 s TYR 372 CO -0.04 0.22 0.83 -1.59 -1.11 0.00 0.00 175.55 173.86 2i03 s LYS 373 N -1.79 0.81 -0.02 -0.62 -2.85 -1.01 -0.23 119.74 114.02 2i03 s LYS 373 Ca 0.09 0.37 -0.30 0.00 -1.00 0.00 0.00 55.97 55.12 2i03 s LYS 373 Cb -0.10 0.38 -0.04 0.00 -2.06 0.00 0.00 37.83 36.02 2i03 s LYS 373 CO 0.04 -0.22 1.16 0.42 0.10 0.00 0.00 175.35 176.86 2i03 s ILE 374 N -0.77 4.30 0.13 3.79 1.01 -1.26 -1.58 121.20 126.82 2i03 s ILE 374 Ca -0.05 1.64 -0.01 0.00 0.00 0.00 0.00 60.65 62.23 2i03 s ILE 374 Cb -0.01 -4.05 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 2i03 s ILE 374 CO 0.04 0.05 0.03 0.27 0.00 0.00 0.00 174.94 175.33 2i03 s ILE 375 N 1.77 0.22 0.23 2.92 -4.36 -0.83 -4.46 121.20 116.68 2i03 s ILE 375 Ca 0.56 -1.91 -0.30 0.00 -0.26 0.00 0.00 60.65 58.74 2i03 s ILE 375 Cb -0.25 -1.98 -0.09 0.00 1.25 0.00 0.00 42.46 41.39 2i03 s ILE 375 CO 0.24 -0.54 1.19 -0.55 0.24 0.00 0.00 174.94 175.52 2i03 s SER 376 N -3.05 7.09 1.26 4.36 0.15 -1.26 -1.95 113.70 120.29 2i03 s SER 376 Ca 0.22 2.30 -0.18 0.00 0.70 0.00 0.00 55.95 58.99 2i03 s SER 376 Cb 0.07 -2.62 0.27 0.00 -1.71 0.00 0.00 66.02 62.03 2i03 s SER 376 CO 0.01 -0.34 0.84 -3.20 1.20 0.00 0.00 173.24 171.75 2i03 n ASN 377 N 1.98 -2.44 0.06 5.45 2.85 0.86 -4.88 115.26 119.14 2i03 n ASN 377 Ca 0.03 -0.95 -0.01 0.00 -0.11 0.00 0.00 54.58 53.53 2i03 n ASN 377 Cb 0.44 -0.82 -0.07 0.00 1.24 0.00 0.00 39.78 40.58 2i03 n ASN 377 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 2i03 h GLU 378 N 0.00 0.00 -0.01 1.20 4.57 -1.96 -3.03 114.58 115.35 2i03 h GLU 378 Ca -0.33 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.85 2i03 h GLU 378 Cb 1.04 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 2i03 h GLU 378 CO 0.21 0.43 -0.17 -1.91 -1.18 0.00 0.00 179.01 176.39 2i03 n GLU 379 N -3.03 0.86 -0.45 1.92 2.13 -1.26 -4.93 120.64 115.88 2i03 n GLU 379 Ca -0.07 -0.43 0.00 0.00 0.66 0.00 0.00 57.16 57.32 2i03 n GLU 379 Cb 0.84 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 31.06 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 1.29 0.76 3.60 8.31 0.00 -1.15 -4.80 105.19 113.21 2i03 n GLY 380 Ca 0.14 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.00 3.05 -0.30 1.61 1.51 -1.26 -0.73 117.35 119.23 2i03 s TYR 381 Ca 0.00 0.01 -0.29 0.00 -1.01 0.00 0.00 57.07 55.78 2i03 s TYR 381 Cb 0.00 -1.81 0.02 0.00 -0.11 0.00 0.00 41.96 40.06 2i03 s TYR 381 CO 0.00 0.29 1.07 1.03 -1.11 0.00 0.00 175.55 176.83 2i03 s ARG 382 N -0.52 4.11 0.20 -0.62 0.52 -1.26 -0.10 118.95 121.28 2i03 s ARG 382 Ca 0.08 1.14 0.02 0.00 -0.52 0.00 0.00 55.73 56.46 2i03 s ARG 382 Cb -0.12 -3.72 -0.05 0.00 0.52 0.00 0.00 34.95 31.58 2i03 s ARG 382 CO 0.02 -0.85 0.01 -1.01 0.02 0.00 0.00 175.30 173.50 2i03 s HIS 383 N 3.57 1.35 0.02 -0.53 3.76 -0.82 -0.72 115.29 121.91 2i03 s HIS 383 Ca 0.45 -1.01 -0.30 0.00 -0.15 0.00 0.00 55.06 54.05 2i03 s HIS 383 Cb -0.13 -0.78 -0.06 0.00 1.11 0.00 0.00 32.58 32.73 2i03 s HIS 383 CO 0.13 -0.18 1.32 0.42 -0.85 0.00 0.00 174.74 175.59 2i03 s ILE 384 N -3.60 3.80 -0.05 0.60 1.01 -1.26 -1.97 121.20 119.72 2i03 s ILE 384 Ca 0.27 1.22 0.04 0.00 0.00 0.00 0.00 60.65 62.18 2i03 s ILE 384 Cb 0.06 -3.78 -0.03 0.00 0.01 0.00 0.00 42.46 38.72 2i03 s ILE 384 CO 0.07 0.03 -0.14 0.00 0.00 0.00 0.00 174.94 174.90 2i03 s TYR 386 N -0.72 3.30 0.15 0.00 5.04 0.11 -2.41 117.35 122.81 2i03 s TYR 386 Ca 0.11 0.28 0.09 0.00 -2.44 0.00 0.00 57.07 55.11 2i03 s TYR 386 Cb -0.11 -2.35 -0.04 0.00 0.35 0.00 0.00 41.96 39.81 2i03 s TYR 386 CO 0.01 -0.01 -0.14 -0.06 -1.34 0.00 0.00 175.55 174.00 2i03 s PHE 387 N 1.30 2.57 -0.17 4.97 0.40 0.42 -0.64 117.98 126.83 2i03 s PHE 387 Ca 0.10 -0.25 -0.00 0.00 -0.60 0.00 0.00 56.93 56.18 2i03 s PHE 387 Cb -0.14 -1.31 0.00 0.00 0.51 0.00 0.00 43.02 42.08 2i03 s PHE 387 CO 0.07 0.45 -0.14 -1.14 0.70 0.00 0.00 175.22 175.16 2i03 s GLN 388 N -2.49 3.20 0.65 0.44 2.00 -1.26 -1.94 119.66 120.25 2i03 s GLN 388 Ca 0.21 -0.74 0.15 0.00 -2.00 0.00 0.00 55.36 52.98 2i03 s GLN 388 Cb -0.10 -2.68 0.73 0.00 0.80 0.00 0.00 33.01 31.76 2i03 s GLN 388 CO 0.12 -0.07 1.38 -0.84 -0.50 0.00 0.00 175.29 175.38 2i03 h ILE 389 N 5.73 0.03 0.00 -2.34 3.07 -1.70 -1.81 117.51 120.49 2i03 h ILE 389 Ca -0.37 0.00 -0.26 0.00 1.55 0.00 0.00 64.86 65.78 2i03 h ILE 389 Cb 1.17 0.24 -0.05 0.00 -0.27 0.00 0.00 36.82 37.92 2i03 h ILE 389 CO 0.59 0.00 -1.96 -0.90 -1.05 0.00 0.00 178.15 174.83 2i03 n ASP 390 N -2.83 1.95 -4.74 2.16 5.68 -1.26 -4.56 116.55 112.95 2i03 n ASP 390 Ca 0.04 -0.03 -0.41 0.00 -0.50 0.00 0.00 54.79 53.88 2i03 n ASP 390 Cb 0.88 0.46 -0.02 0.00 -1.14 0.00 0.00 41.12 41.30 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 -2.34 4.26 0.00 0.11 3.01 -0.68 -4.78 119.74 119.32 2i03 s LYS 391 Ca -0.13 2.31 0.30 0.00 -1.01 0.00 0.00 55.97 57.44 2i03 s LYS 391 Cb 0.05 -3.11 1.42 0.00 -1.01 0.00 0.00 37.83 35.17 2i03 s LYS 391 CO 0.51 -0.45 2.00 0.36 0.51 0.00 0.00 175.35 178.29 2i03 n LYS 392 N 2.53 0.31 -4.87 1.68 -0.00 -1.26 -4.56 118.16 111.99 2i03 n LYS 392 Ca 0.08 -0.01 -0.29 0.00 -0.00 0.00 0.00 58.31 58.09 2i03 n LYS 392 Cb 0.40 -1.50 -0.15 0.00 -0.00 0.00 0.00 35.03 33.78 2i03 n LYS 392 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2i03 s ASP 393 N -2.69 2.95 0.40 -5.58 1.01 -1.26 -4.97 116.67 106.52 2i03 s ASP 393 Ca 0.24 -0.56 0.08 0.00 0.71 0.00 0.00 52.55 53.02 2i03 s ASP 393 Cb 0.20 -0.27 -0.03 0.00 1.01 0.00 0.00 42.92 43.83 2i03 s ASP 393 CO 0.48 0.24 0.32 0.00 0.21 0.00 0.00 175.17 176.42 2i03 s THR 395 N -2.47 2.38 0.09 0.00 2.01 0.19 -4.84 115.64 113.00 2i03 s THR 395 Ca 0.45 -0.84 -0.31 0.00 0.31 0.00 0.00 61.69 61.31 2i03 s THR 395 Cb -0.02 -2.02 -0.07 0.00 0.01 0.00 0.00 72.50 70.40 2i03 s THR 395 CO 0.27 0.51 1.34 -0.36 -0.69 0.00 0.00 174.62 175.69 2i03 s PHE 396 N 1.26 3.25 -1.10 4.92 0.08 -1.26 0.06 117.98 125.19 2i03 s PHE 396 Ca 0.04 1.03 0.17 0.00 0.12 0.00 0.00 56.93 58.28 2i03 s PHE 396 Cb -0.14 -3.61 -0.12 0.00 -0.57 0.00 0.00 43.02 38.58 2i03 s PHE 396 CO -0.09 -2.11 0.79 0.44 -0.10 0.00 0.00 175.22 174.15 2i03 n ILE 397 N 4.02 0.00 -4.16 0.64 -5.35 -0.61 -4.94 119.36 108.96 2i03 n ILE 397 Ca 0.11 -0.18 -0.11 0.00 -0.27 0.00 0.00 62.75 62.30 2i03 n ILE 397 Cb 0.43 1.08 -0.10 0.00 -1.74 0.00 0.00 39.64 39.31 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 -2.40 0.72 0.12 7.28 -4.23 -1.25 -4.93 115.64 110.96 2i03 s THR 398 Ca 0.09 -1.79 -0.26 0.00 -1.18 0.00 0.00 61.69 58.56 2i03 s THR 398 Cb 0.13 -1.51 0.08 0.00 1.34 0.00 0.00 72.50 72.55 2i03 s THR 398 CO 0.61 -0.76 1.05 -1.59 -0.54 0.00 0.00 174.62 173.38 2i03 s LYS 399 N -3.40 1.05 0.00 3.99 -2.85 -1.26 -4.65 119.74 112.62 2i03 s LYS 399 Ca 0.08 -0.60 0.00 0.00 -1.00 0.00 0.00 55.97 54.45 2i03 s LYS 399 Cb 0.02 0.34 0.00 0.00 -2.06 0.00 0.00 37.83 36.13 2i03 s LYS 399 CO -0.03 -0.48 0.00 0.41 0.10 0.00 0.00 175.35 175.35 2i03 n GLY 400 N -0.53 2.70 2.78 0.59 0.00 -1.26 -4.90 105.19 104.58 2i03 n GLY 400 Ca -0.06 -1.98 -0.42 0.00 0.00 0.00 0.00 46.02 43.56 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 -1.44 4.12 -3.85 2.61 -2.24 -1.26 -4.77 114.28 107.45 2i03 n THR 401 Ca 0.00 -3.91 -0.05 0.00 -2.27 0.00 0.00 64.05 57.81 2i03 n THR 401 Cb 0.00 -2.43 0.02 0.00 -2.10 0.00 0.00 70.33 65.82 2i03 n THR 401 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 2i03 s TRP 402 N 1.21 0.07 0.03 4.78 1.48 -1.26 -5.03 118.94 120.22 2i03 s TRP 402 Ca 0.43 -0.58 0.02 0.00 -1.06 0.00 0.00 56.10 54.92 2i03 s TRP 402 Cb 0.12 0.75 -0.02 0.00 -1.16 0.00 0.00 33.47 33.16 2i03 s TRP 402 CO -0.03 -1.18 -0.08 -1.21 -4.06 0.00 0.00 176.95 170.39 2i03 s GLU 403 N -2.32 0.55 0.05 3.25 2.02 -1.26 -4.49 118.70 116.51 2i03 s GLU 403 Ca 0.19 -0.58 -0.30 0.00 0.02 0.00 0.00 54.97 54.29 2i03 s GLU 403 Cb -0.04 -0.42 -0.04 0.00 0.10 0.00 0.00 34.13 33.73 2i03 s GLU 403 CO 0.08 0.10 1.00 0.08 0.02 0.00 0.00 175.26 176.53 2i03 s VAL 404 N -0.92 4.61 -0.09 2.63 1.01 0.10 -2.86 120.40 124.88 2i03 s VAL 404 Ca -0.05 1.98 -0.17 0.00 0.00 0.00 0.00 61.98 63.75 2i03 s VAL 404 Cb -0.07 -4.27 -0.28 0.00 0.00 0.00 0.00 36.38 31.76 2i03 s VAL 404 CO 0.00 0.21 0.62 0.40 0.00 0.00 0.00 175.10 176.34 2i03 h ILE 405 N 4.47 1.12 -1.32 2.22 1.08 -0.49 -3.45 117.51 121.13 2i03 h ILE 405 Ca -0.42 -2.43 0.16 0.00 -0.39 0.00 0.00 64.86 61.78 2i03 h ILE 405 Cb 1.22 2.80 -0.25 0.00 -3.07 0.00 0.00 36.82 37.52 2i03 h ILE 405 CO 0.74 0.71 0.74 -0.83 -0.69 0.00 0.00 178.15 178.82 2i03 s GLY 406 N -4.87 -0.10 -0.23 5.37 0.00 -1.09 -5.00 107.32 101.41 2i03 s GLY 406 Ca -0.19 2.42 -0.25 0.00 0.00 0.00 0.00 44.72 46.70 2i03 s GLY 406 CO 0.78 1.07 0.84 -0.42 0.00 0.00 0.00 173.10 175.37 2i03 s ILE 407 N -1.06 4.83 -0.19 0.90 1.01 -1.26 -1.30 121.20 124.14 2i03 s ILE 407 Ca 0.03 1.60 0.14 0.00 0.00 0.00 0.00 60.65 62.43 2i03 s ILE 407 Cb -0.01 -4.13 -0.24 0.00 0.01 0.00 0.00 42.46 38.10 2i03 s ILE 407 CO -0.03 -0.06 0.10 -0.62 0.00 0.00 0.00 174.94 174.33 2i03 n GLU 408 N 5.90 0.68 -3.55 2.79 -0.58 -0.25 -4.98 120.64 120.65 2i03 n GLU 408 Ca 0.06 0.06 -0.12 0.00 -0.42 0.00 0.00 57.16 56.74 2i03 n GLU 408 Cb 0.48 -1.56 -0.04 0.00 -0.57 0.00 0.00 31.44 29.75 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 -2.51 -1.27 -0.13 0.62 0.00 -1.07 -4.88 121.76 112.51 2i03 s ALA 409 Ca -0.13 0.33 -0.06 0.00 0.00 0.00 0.00 51.96 52.09 2i03 s ALA 409 Cb 0.07 0.66 0.06 0.00 0.00 0.00 0.00 23.12 23.91 2i03 s ALA 409 CO 0.79 -0.64 0.29 -1.17 0.00 0.00 0.00 175.76 175.03 2i03 s LEU 410 N -2.53 0.01 0.34 0.00 2.96 -1.26 -0.78 118.68 117.42 2i03 s LEU 410 Ca -0.00 0.63 0.05 0.00 -0.22 0.00 0.00 54.13 54.59 2i03 s LEU 410 Cb 0.00 0.85 -0.07 0.00 0.50 0.00 0.00 46.19 47.47 2i03 s LEU 410 CO -0.09 -0.20 0.04 0.42 -1.32 0.00 0.00 176.35 175.19 2i03 s THR 411 N 1.80 1.43 -0.57 3.68 -4.23 0.18 -4.99 115.64 112.94 2i03 s THR 411 Ca -0.05 -2.01 0.19 0.00 -1.18 0.00 0.00 61.69 58.64 2i03 s THR 411 Cb -0.11 -2.81 0.19 0.00 1.34 0.00 0.00 72.50 71.11 2i03 s THR 411 CO -0.09 -0.03 1.58 -1.54 -0.54 0.00 0.00 174.62 173.99 2i03 n SER 412 N -0.74 0.45 -0.04 3.99 3.41 -1.26 -3.47 113.62 115.96 2i03 n SER 412 Ca -0.03 0.64 -0.03 0.00 -0.26 0.00 0.00 58.87 59.19 2i03 n SER 412 Cb 0.66 -0.72 -0.01 0.00 -0.26 0.00 0.00 64.21 63.88 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 -2.03 0.99 -4.38 4.04 -0.08 -1.26 -4.90 116.55 108.94 2i03 n ASP 413 Ca 0.01 0.46 -0.19 0.00 -1.51 0.00 0.00 54.79 53.56 2i03 n ASP 413 Cb 0.15 -0.70 -0.10 0.00 2.34 0.00 0.00 41.12 42.80 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 -1.69 1.73 -0.22 -0.67 1.51 -1.23 -2.47 117.35 114.31 2i03 s TYR 414 Ca -0.08 -1.00 0.01 0.00 -1.01 0.00 0.00 57.07 54.99 2i03 s TYR 414 Cb 0.01 -1.06 0.04 0.00 -0.11 0.00 0.00 41.96 40.84 2i03 s TYR 414 CO 0.12 -0.10 -0.14 -1.17 -1.11 0.00 0.00 175.55 173.16 2i03 s LEU 415 N -3.38 2.84 -0.04 -1.29 1.98 -0.95 -0.65 118.68 117.18 2i03 s LEU 415 Ca 0.34 -0.99 -0.13 0.00 -2.89 0.00 0.00 54.13 50.45 2i03 s LEU 415 Cb 0.07 -1.54 -0.05 0.00 0.66 0.00 0.00 46.19 45.34 2i03 s LEU 415 CO 0.13 -0.10 0.35 -0.31 -1.89 0.00 0.00 176.35 174.53 2i03 s TYR 416 N 1.22 3.67 0.15 5.38 1.51 0.04 -1.22 117.35 128.09 2i03 s TYR 416 Ca -0.02 0.87 -0.15 0.00 -1.01 0.00 0.00 57.07 56.76 2i03 s TYR 416 Cb -0.16 -2.25 0.03 0.00 -0.11 0.00 0.00 41.96 39.46 2i03 s TYR 416 CO -0.08 0.59 0.42 1.52 -1.11 0.00 0.00 175.55 176.89 2i03 s TYR 417 N -0.81 -0.10 0.04 2.71 -0.85 -0.03 -1.10 117.35 117.20 2i03 s TYR 417 Ca 0.22 -0.23 0.06 0.00 -0.52 0.00 0.00 57.07 56.59 2i03 s TYR 417 Cb -0.15 0.26 -0.03 0.00 0.38 0.00 0.00 41.96 42.41 2i03 s TYR 417 CO 0.11 -0.76 -0.12 0.42 -1.52 0.00 0.00 175.55 173.68 2i03 s ILE 418 N -3.84 3.25 0.27 -3.49 1.01 -0.42 -0.07 121.20 117.91 2i03 s ILE 418 Ca 0.06 -1.06 -0.21 0.00 0.00 0.00 0.00 60.65 59.45 2i03 s ILE 418 Cb 0.01 -2.43 0.03 0.00 0.01 0.00 0.00 42.46 40.09 2i03 s ILE 418 CO -0.08 0.30 0.78 -0.94 0.00 0.00 0.00 174.94 175.00 2i03 s SER 419 N -1.62 -0.21 -0.44 3.58 1.04 -0.77 0.29 113.70 115.57 2i03 s SER 419 Ca 0.17 -0.65 0.04 0.00 0.48 0.00 0.00 55.95 56.00 2i03 s SER 419 Cb -0.11 0.70 0.55 0.00 0.10 0.00 0.00 66.02 67.26 2i03 s SER 419 CO 0.08 -1.31 1.74 -0.46 0.98 0.00 0.00 173.24 174.27 2i03 n ASN 420 N -0.60 4.34 -0.09 7.02 0.23 -1.14 -2.17 115.26 122.85 2i03 n ASN 420 Ca -0.05 -3.72 -0.14 0.00 -0.53 0.00 0.00 54.58 50.14 2i03 n ASN 420 Cb 0.59 -0.77 -0.04 0.00 -2.08 0.00 0.00 39.78 37.49 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 1.33 0.83 -6.30 -3.83 4.81 -1.85 -3.37 114.58 106.21 2i03 h GLU 421 Ca 0.48 -0.49 -0.66 0.00 -0.13 0.00 0.00 59.36 58.56 2i03 h GLU 421 Cb 1.93 0.04 0.04 0.00 0.63 0.00 0.00 28.75 31.39 2i03 h GLU 421 CO 0.97 1.13 0.66 0.98 -0.73 0.00 0.00 179.01 182.02 2i03 n TYR 422 N -4.10 1.85 -1.09 0.92 9.36 -1.26 -1.12 117.16 121.72 2i03 n TYR 422 Ca -0.04 0.48 -0.04 0.00 3.32 0.00 0.00 57.90 61.63 2i03 n TYR 422 Cb 0.57 -2.43 -0.02 0.00 -0.63 0.00 0.00 39.34 36.84 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 3.59 -1.91 -1.47 2.98 4.01 -1.26 -2.46 118.16 121.64 2i03 n LYS 423 Ca 0.20 0.62 -0.16 0.00 -0.51 0.00 0.00 58.31 58.46 2i03 n LYS 423 Cb 0.21 -5.08 -0.07 0.00 -0.51 0.00 0.00 35.03 29.58 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 0.75 1.57 3.37 0.72 0.00 -0.27 -4.95 105.19 106.37 2i03 n GLY 424 Ca -0.04 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 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 -3.36 2.92 0.54 1.61 0.23 -1.03 -4.96 119.30 115.25 2i03 s MET 425 Ca 0.00 -1.01 0.35 0.00 -1.03 0.00 0.00 55.69 54.01 2i03 s MET 425 Cb 0.00 -3.62 1.91 0.00 -1.53 0.00 0.00 34.83 31.59 2i03 s MET 425 CO 0.00 -0.62 2.07 -1.00 -2.03 0.00 0.00 175.02 173.45 2i03 h PRO 426 N 8.37 0.00 -0.31 3.16 0.13 -1.88 -2.15 132.00 139.31 2i03 h PRO 426 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2i03 h PRO 426 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2i03 h PRO 426 CO 0.64 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.82 2i03 n GLY 427 N -1.17 0.56 3.49 1.56 0.00 -1.26 -4.86 105.19 103.51 2i03 n GLY 427 Ca -0.02 -0.39 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.11 1.66 -0.04 -0.02 0.00 -0.81 -2.56 107.32 104.44 2i03 s GLY 428 Ca 0.25 -1.27 0.05 0.00 0.00 0.00 0.00 44.72 43.75 2i03 s GLY 428 CO 0.18 -1.22 -0.21 0.50 0.00 0.00 0.00 173.10 172.35 2i03 s ARG 429 N -1.88 2.01 -0.00 2.90 1.81 0.46 -4.02 118.95 120.22 2i03 s ARG 429 Ca 0.17 -0.74 -0.08 0.00 -1.72 0.00 0.00 55.73 53.36 2i03 s ARG 429 Cb -0.11 -1.77 0.00 0.00 -0.45 0.00 0.00 34.95 32.63 2i03 s ARG 429 CO 0.09 0.34 0.16 -0.80 -0.68 0.00 0.00 175.30 174.41 2i03 s ASN 430 N -0.16 -0.01 -0.08 0.23 0.01 -0.92 -0.88 114.94 113.13 2i03 s ASN 430 Ca -0.01 -0.15 -0.18 0.00 -0.71 0.00 0.00 52.86 51.81 2i03 s ASN 430 Cb -0.11 0.22 -0.05 0.00 0.41 0.00 0.00 41.25 41.73 2i03 s ASN 430 CO 0.02 -0.36 0.49 -0.22 -1.51 0.00 0.00 177.10 175.52 2i03 s LEU 431 N -1.30 4.33 0.22 0.60 2.96 -1.26 -1.85 118.68 122.39 2i03 s LEU 431 Ca -0.14 0.91 0.03 0.00 -0.22 0.00 0.00 54.13 54.71 2i03 s LEU 431 Cb -0.07 -2.73 -0.05 0.00 0.50 0.00 0.00 46.19 43.84 2i03 s LEU 431 CO 0.02 0.07 0.01 -0.31 -1.32 0.00 0.00 176.35 174.82 2i03 s TYR 432 N 0.21 1.48 0.00 5.38 1.51 0.90 0.05 117.35 126.88 2i03 s TYR 432 Ca 0.27 -0.99 -0.00 0.00 -1.01 0.00 0.00 57.07 55.34 2i03 s TYR 432 Cb -0.16 -0.86 -0.00 0.00 -0.11 0.00 0.00 41.96 40.83 2i03 s TYR 432 CO 0.12 -0.13 -0.00 -1.59 -1.11 0.00 0.00 175.55 172.84 2i03 s LYS 433 N -3.90 0.08 -0.08 -0.62 -2.85 -0.51 -0.85 119.74 111.00 2i03 s LYS 433 Ca 0.29 -0.14 0.04 0.00 -1.00 0.00 0.00 55.97 55.15 2i03 s LYS 433 Cb 0.06 0.03 0.00 0.00 -2.06 0.00 0.00 37.83 35.86 2i03 s LYS 433 CO 0.08 -0.01 -0.21 -1.50 0.10 0.00 0.00 175.35 173.81 2i03 s ILE 434 N -0.35 1.79 -0.05 3.79 2.07 -0.36 -1.33 121.20 126.76 2i03 s ILE 434 Ca -0.04 -0.87 -0.30 0.00 -1.41 0.00 0.00 60.65 58.04 2i03 s ILE 434 Cb -0.02 -1.55 -0.06 0.00 0.13 0.00 0.00 42.46 40.96 2i03 s ILE 434 CO -0.00 0.50 1.63 -1.58 -1.91 0.00 0.00 174.94 173.58 2i03 s GLN 435 N 0.37 4.19 0.35 3.50 0.74 -0.87 -2.25 119.66 125.70 2i03 s GLN 435 Ca -0.16 2.18 0.03 0.00 0.05 0.00 0.00 55.36 57.45 2i03 s GLN 435 Cb -0.17 -3.94 0.65 0.00 1.10 0.00 0.00 33.01 30.65 2i03 s GLN 435 CO 0.07 -0.82 2.00 -0.07 -0.55 0.00 0.00 175.29 175.91 2i03 h LEU 436 N 10.04 0.73 -0.59 3.68 4.07 -1.83 -2.62 115.31 128.79 2i03 h LEU 436 Ca -0.39 -0.01 -0.15 0.00 0.08 0.00 0.00 57.88 57.41 2i03 h LEU 436 Cb 1.18 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.73 2i03 h LEU 436 CO 0.95 0.52 -0.46 0.28 -1.08 0.00 0.00 178.44 178.64 2i03 h SER 437 N 0.85 0.64 -2.94 -0.43 0.02 -1.90 -3.41 113.55 106.39 2i03 h SER 437 Ca 0.25 -0.31 -0.53 0.00 -0.84 0.00 0.00 61.79 60.37 2i03 h SER 437 Cb -0.02 -0.18 -0.40 0.00 0.14 0.00 0.00 62.40 61.93 2i03 h SER 437 CO -0.06 1.01 -0.77 -0.62 -1.14 0.00 0.00 176.83 175.24 2i03 s ASP 438 N -6.88 3.37 0.00 3.07 2.15 -1.00 -5.00 116.67 112.39 2i03 s ASP 438 Ca -0.08 -1.20 0.06 0.00 0.43 0.00 0.00 52.55 51.77 2i03 s ASP 438 Cb 0.12 -0.44 0.28 0.00 -0.30 0.00 0.00 42.92 42.58 2i03 s ASP 438 CO 0.84 -0.41 1.14 -1.22 -0.17 0.00 0.00 175.17 175.34 2i03 n TYR 439 N 5.17 0.00 0.58 -5.34 4.01 -1.19 -1.56 117.16 118.83 2i03 n TYR 439 Ca -0.06 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.81 2i03 n TYR 439 Cb 0.44 -0.42 0.34 0.00 -0.31 0.00 0.00 39.34 39.39 2i03 n TYR 439 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 2i03 h THR 440 N 0.00 0.00 -3.74 -0.72 2.02 -1.92 -3.41 112.91 105.14 2i03 h THR 440 Ca 0.00 -0.53 -0.79 0.00 0.77 0.00 0.00 66.41 65.86 2i03 h THR 440 Cb 0.09 1.44 -0.26 0.00 -1.74 0.00 0.00 68.15 67.68 2i03 h THR 440 CO 0.00 0.00 0.19 -0.54 0.37 0.00 0.00 175.52 175.54 2i03 s LYS 441 N -3.12 3.73 -0.20 6.66 1.02 -0.60 -5.02 119.74 122.21 2i03 s LYS 441 Ca 0.09 -2.60 -0.03 0.00 0.02 0.00 0.00 55.97 53.45 2i03 s LYS 441 Cb 0.12 -4.47 -0.01 0.00 -0.52 0.00 0.00 37.83 32.95 2i03 s LYS 441 CO 0.63 -1.29 -0.06 0.54 -0.92 0.00 0.00 175.35 174.25 2i03 s VAL 442 N -0.06 3.37 -0.17 3.17 0.11 -1.26 -2.04 120.40 123.51 2i03 s VAL 442 Ca 0.21 -0.51 -0.03 0.00 -2.93 0.00 0.00 61.98 58.72 2i03 s VAL 442 Cb -0.10 -2.50 -0.02 0.00 -1.53 0.00 0.00 36.38 32.23 2i03 s VAL 442 CO -0.09 0.45 -0.06 -0.89 -3.33 0.00 0.00 175.10 171.19 2i03 s THR 443 N 1.14 3.56 -0.03 5.04 2.01 -0.44 -4.96 115.64 121.97 2i03 s THR 443 Ca 0.02 -0.46 -0.27 0.00 0.31 0.00 0.00 61.69 61.29 2i03 s THR 443 Cb -0.14 -2.57 -0.03 0.00 0.01 0.00 0.00 72.50 69.76 2i03 s THR 443 CO -0.01 0.47 0.85 0.00 -0.69 0.00 0.00 174.62 175.24 2i03 n LEU 445 N 3.83 0.70 0.00 0.00 4.77 0.11 -4.59 117.00 121.82 2i03 n LEU 445 Ca 0.03 -0.28 0.00 0.00 -0.03 0.00 0.00 56.01 55.72 2i03 n LEU 445 Cb 0.51 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2i03 n LEU 445 CO 0.50 0.15 -0.12 -1.54 -1.33 0.00 0.00 177.39 175.05 2i03 n SER 446 N -1.73 1.23 -0.28 -1.43 3.41 -1.22 -4.76 113.62 108.83 2i03 n SER 446 Ca 0.02 -0.21 0.08 0.00 -0.26 0.00 0.00 58.87 58.51 2i03 n SER 446 Cb 0.40 0.66 0.21 0.00 -0.26 0.00 0.00 64.21 65.22 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 -5.35 0.62 -0.35 0.00 4.71 -1.26 -4.13 120.64 114.88 2i03 n GLU 448 Ca 0.17 -0.05 0.32 0.00 -0.01 0.00 0.00 57.16 57.59 2i03 n GLU 448 Cb 0.57 -1.65 0.57 0.00 -1.01 0.00 0.00 31.44 29.91 2i03 n GLU 448 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2i03 n LEU 449 N -2.43 0.26 -2.68 -4.62 4.77 -1.11 -3.79 117.00 107.40 2i03 n LEU 449 Ca -0.02 1.38 -0.05 0.00 -0.03 0.00 0.00 56.01 57.29 2i03 n LEU 449 Cb 0.56 -0.68 0.07 0.00 -2.33 0.00 0.00 43.42 41.04 2i03 n LEU 449 CO 0.43 -1.53 0.53 -3.20 -1.33 0.00 0.00 177.39 172.29 2i03 n ASN 450 N -4.80 -1.55 0.18 -1.43 2.85 -1.26 -5.05 115.26 104.20 2i03 n ASN 450 Ca 0.35 -1.94 0.07 0.00 -0.11 0.00 0.00 54.58 52.96 2i03 n ASN 450 Cb 1.28 0.88 0.39 0.00 1.24 0.00 0.00 39.78 43.56 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 3.37 0.00 0.11 1.20 0.13 -1.72 0.84 132.00 135.93 2i03 h PRO 451 Ca -0.20 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.57 2i03 h PRO 451 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 2i03 h PRO 451 CO -0.11 0.00 -1.97 0.39 -0.23 0.00 0.00 178.00 176.08 2i03 n GLU 452 N -2.12 0.75 -0.03 0.86 1.02 -1.26 -4.48 120.64 115.37 2i03 n GLU 452 Ca -0.01 0.27 0.07 0.00 -0.02 0.00 0.00 57.16 57.47 2i03 n GLU 452 Cb 0.33 -1.72 -0.17 0.00 -0.02 0.00 0.00 31.44 29.87 2i03 n GLU 452 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 2i03 n ARG 453 N -3.43 0.67 -3.98 3.49 0.63 -0.97 -4.63 116.66 108.45 2i03 n ARG 453 Ca -0.30 -0.16 -0.29 0.00 -0.92 0.00 0.00 57.85 56.17 2i03 n ARG 453 Cb 1.05 -1.52 -0.16 0.00 0.45 0.00 0.00 32.46 32.28 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 4.79 -0.04 -3.73 0.00 6.02 0.11 -4.33 117.38 120.19 2i03 n GLN 455 Ca -0.15 -0.08 -0.28 0.00 -0.01 0.00 0.00 57.00 56.48 2i03 n GLN 455 Cb 0.49 -0.53 -0.16 0.00 1.02 0.00 0.00 30.24 31.06 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 -0.01 1.12 0.29 1.08 6.14 -1.09 -0.40 117.35 124.48 2i03 s TYR 456 Ca 0.00 -1.00 0.11 0.00 0.64 0.00 0.00 57.07 56.82 2i03 s TYR 456 Cb 0.00 -1.13 -0.05 0.00 0.42 0.00 0.00 41.96 41.20 2i03 s TYR 456 CO 0.00 -0.66 -0.15 0.71 0.64 0.00 0.00 175.55 176.09 2i03 s TYR 457 N 1.82 2.38 0.03 4.97 1.51 -0.06 -1.32 117.35 126.68 2i03 s TYR 457 Ca 0.01 -0.34 -0.04 0.00 -1.01 0.00 0.00 57.07 55.69 2i03 s TYR 457 Cb -0.17 -1.09 -0.02 0.00 -0.11 0.00 0.00 41.96 40.58 2i03 s TYR 457 CO -0.12 0.68 0.05 -1.54 -1.11 0.00 0.00 175.55 173.52 2i03 s SER 458 N -3.56 0.21 0.04 2.29 1.04 -0.52 -4.59 113.70 108.61 2i03 s SER 458 Ca 0.31 -0.53 0.02 0.00 0.48 0.00 0.00 55.95 56.22 2i03 s SER 458 Cb -0.04 0.19 -0.02 0.00 0.10 0.00 0.00 66.02 66.24 2i03 s SER 458 CO 0.16 -0.44 -0.06 0.54 0.98 0.00 0.00 173.24 174.42 2i03 s VAL 459 N -2.26 0.41 -0.30 5.02 0.11 -1.26 -0.98 120.40 121.13 2i03 s VAL 459 Ca -0.08 -1.03 -0.01 0.00 -2.93 0.00 0.00 61.98 57.93 2i03 s VAL 459 Cb -0.03 -0.50 0.10 0.00 -1.53 0.00 0.00 36.38 34.41 2i03 s VAL 459 CO -0.03 -0.42 0.09 -0.55 -3.33 0.00 0.00 175.10 170.86 2i03 s SER 460 N -1.54 3.95 0.57 3.54 0.15 -0.62 -4.98 113.70 114.76 2i03 s SER 460 Ca -0.12 -1.57 -0.14 0.00 0.70 0.00 0.00 55.95 54.82 2i03 s SER 460 Cb -0.10 -0.82 -0.06 0.00 -1.71 0.00 0.00 66.02 63.33 2i03 s SER 460 CO -0.00 -0.41 1.01 -0.36 1.20 0.00 0.00 173.24 174.68 2i03 s PHE 461 N 1.66 3.43 1.08 3.44 0.40 -1.26 -1.68 117.98 125.04 2i03 s PHE 461 Ca 0.09 1.42 -0.18 0.00 -0.60 0.00 0.00 56.93 57.65 2i03 s PHE 461 Cb -0.17 -2.80 0.25 0.00 0.51 0.00 0.00 43.02 40.81 2i03 s PHE 461 CO -0.25 -0.62 1.26 -1.54 0.70 0.00 0.00 175.22 174.78 2i03 s SER 462 N -3.42 2.04 0.24 1.36 1.04 -0.69 -4.89 113.70 109.37 2i03 s SER 462 Ca 0.58 0.30 -0.06 0.00 0.48 0.00 0.00 55.95 57.25 2i03 s SER 462 Cb -0.11 -0.33 0.43 0.00 0.10 0.00 0.00 66.02 66.10 2i03 s SER 462 CO 0.41 -3.40 1.69 0.11 0.98 0.00 0.00 173.24 173.02 2i03 h LYS 463 N -2.10 0.26 -0.20 4.02 1.79 -1.75 -2.74 116.57 115.84 2i03 h LYS 463 Ca -0.44 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.02 2i03 h LYS 463 Cb 1.24 -0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 31.83 2i03 h LYS 463 CO 0.32 0.17 -0.00 0.39 -1.08 0.00 0.00 179.45 179.24 2i03 n GLU 464 N -5.16 2.56 -2.30 3.15 -0.58 -1.26 -4.96 120.64 112.08 2i03 n GLU 464 Ca 0.13 -2.79 -0.13 0.00 -0.42 0.00 0.00 57.16 53.94 2i03 n GLU 464 Cb 0.43 -1.77 -0.00 0.00 -0.57 0.00 0.00 31.44 29.53 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 -0.72 -0.42 0.09 0.62 0.00 -1.04 -4.91 120.51 114.14 2i03 n ALA 465 Ca 0.20 0.12 -0.13 0.00 0.00 0.00 0.00 53.44 53.63 2i03 n ALA 465 Cb 0.84 -1.70 -0.11 0.00 0.00 0.00 0.00 19.45 18.49 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 -0.09 0.24 -4.93 0.00 3.64 -1.83 -3.42 116.57 110.18 2i03 h LYS 466 Ca -0.32 -0.36 -0.38 0.00 -1.27 0.00 0.00 60.65 58.32 2i03 h LYS 466 Cb 1.23 0.13 -0.14 0.00 -0.41 0.00 0.00 32.23 33.04 2i03 h LYS 466 CO 0.37 1.13 -0.60 0.71 -2.27 0.00 0.00 179.45 178.80 2i03 s TYR 467 N -2.82 1.60 -0.28 1.91 2.02 -1.26 -1.27 117.35 117.26 2i03 s TYR 467 Ca -0.03 -1.19 -0.21 0.00 -0.37 0.00 0.00 57.07 55.27 2i03 s TYR 467 Cb 0.08 -0.94 0.10 0.00 -0.40 0.00 0.00 41.96 40.80 2i03 s TYR 467 CO 0.86 -0.33 0.85 1.52 -1.57 0.00 0.00 175.55 176.88 2i03 s TYR 468 N -3.66 -0.74 -0.22 2.71 1.13 -0.96 -1.71 117.35 113.90 2i03 s TYR 468 Ca 0.37 1.62 -0.10 0.00 -1.41 0.00 0.00 57.07 57.55 2i03 s TYR 468 Cb 0.07 0.41 -0.05 0.00 -1.10 0.00 0.00 41.96 41.29 2i03 s TYR 468 CO 0.14 -0.36 0.14 -1.14 -2.51 0.00 0.00 175.55 171.82 2i03 s GLN 469 N 0.89 4.12 0.02 -3.49 0.74 -0.68 -1.11 119.66 120.15 2i03 s GLN 469 Ca -0.04 -0.25 -0.09 0.00 0.05 0.00 0.00 55.36 55.03 2i03 s GLN 469 Cb -0.05 -3.46 -0.05 0.00 1.10 0.00 0.00 33.01 30.56 2i03 s GLN 469 CO -0.10 0.20 0.32 -0.51 -0.55 0.00 0.00 175.29 174.65 2i03 s LEU 470 N 0.66 4.38 -0.22 3.68 1.43 0.80 -1.59 118.68 127.83 2i03 s LEU 470 Ca 0.07 0.69 0.00 0.00 -1.03 0.00 0.00 54.13 53.87 2i03 s LEU 470 Cb -0.12 -2.71 0.06 0.00 0.03 0.00 0.00 46.19 43.44 2i03 s LEU 470 CO 0.01 0.25 -0.05 -0.13 0.23 0.00 0.00 176.35 176.66 2i03 s ARG 471 N -1.65 1.57 -0.26 1.70 0.52 -0.15 -1.88 118.95 118.80 2i03 s ARG 471 Ca 0.28 -0.86 -0.12 0.00 -0.52 0.00 0.00 55.73 54.51 2i03 s ARG 471 Cb -0.14 -2.45 -0.05 0.00 0.52 0.00 0.00 34.95 32.83 2i03 s ARG 471 CO 0.15 -0.56 0.21 0.00 0.02 0.00 0.00 175.30 175.13 2i03 n SER 473 N 4.77 3.44 0.00 0.00 3.41 -0.43 -1.74 113.62 123.07 2i03 n SER 473 Ca -0.13 -2.69 0.00 0.00 -0.26 0.00 0.00 58.87 55.79 2i03 n SER 473 Cb 0.52 -0.43 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 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 -0.27 1.80 0.09 5.00 0.00 -1.25 -0.25 105.19 110.31 2i03 n GLY 474 Ca 0.17 -1.10 0.12 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.94 0.18 -0.34 1.61 -0.04 -0.70 0.04 135.00 134.81 2i03 n PRO 475 Ca 0.00 0.26 -0.02 0.00 -0.04 0.00 0.00 63.50 63.70 2i03 n PRO 475 Cb 0.00 -1.76 0.01 0.00 -0.04 0.00 0.00 33.50 31.72 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 0.78 -0.61 3.77 0.55 0.00 -0.07 -4.44 105.19 105.18 2i03 n GLY 476 Ca 0.04 -1.76 -0.40 0.00 0.00 0.00 0.00 46.02 43.90 2i03 n GLY 476 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2i03 s LEU 477 N 0.00 4.39 0.23 0.99 1.43 -1.26 -4.58 118.68 119.89 2i03 s LEU 477 Ca 0.06 2.68 -0.29 0.00 -1.03 0.00 0.00 54.13 55.55 2i03 s LEU 477 Cb -0.00 -3.69 -0.15 0.00 0.03 0.00 0.00 46.19 42.37 2i03 s LEU 477 CO 0.04 -0.58 0.89 -2.65 0.23 0.00 0.00 176.35 174.29 2i03 n PRO 478 N 0.69 0.86 -4.02 1.29 -0.02 -1.26 -4.80 135.00 127.75 2i03 n PRO 478 Ca 0.01 0.30 -0.22 0.00 -2.02 0.00 0.00 63.50 61.57 2i03 n PRO 478 Cb 0.42 -1.59 -0.17 0.00 -0.02 0.00 0.00 33.50 32.14 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 1.24 1.08 -0.17 2.45 2.96 -0.71 -4.20 118.68 121.32 2i03 s LEU 479 Ca 0.64 -0.13 -0.04 0.00 -0.22 0.00 0.00 54.13 54.38 2i03 s LEU 479 Cb -0.82 -0.48 -0.02 0.00 0.50 0.00 0.00 46.19 45.37 2i03 s LEU 479 CO 0.57 -0.10 -0.03 -0.31 -1.32 0.00 0.00 176.35 175.15 2i03 s TYR 480 N 1.32 3.00 0.08 5.38 1.51 0.51 -1.71 117.35 127.44 2i03 s TYR 480 Ca -0.05 -0.43 0.03 0.00 -1.01 0.00 0.00 57.07 55.61 2i03 s TYR 480 Cb -0.14 -2.00 -0.03 0.00 -0.11 0.00 0.00 41.96 39.68 2i03 s TYR 480 CO -0.02 -0.16 -0.09 0.95 -1.11 0.00 0.00 175.55 175.12 2i03 s THR 481 N 0.65 0.81 -0.01 -0.71 -4.23 -0.79 -1.04 115.64 110.32 2i03 s THR 481 Ca -0.02 -1.56 0.06 0.00 -1.18 0.00 0.00 61.69 58.99 2i03 s THR 481 Cb -0.14 -1.24 -0.03 0.00 1.34 0.00 0.00 72.50 72.43 2i03 s THR 481 CO 0.02 -0.57 -0.19 -0.22 -0.54 0.00 0.00 174.62 173.13 2i03 s LEU 482 N -2.34 2.49 0.19 4.79 0.20 -1.05 -0.14 118.68 122.82 2i03 s LEU 482 Ca 0.03 -0.35 0.01 0.00 0.69 0.00 0.00 54.13 54.50 2i03 s LEU 482 Cb -0.03 -1.47 -0.05 0.00 -0.43 0.00 0.00 46.19 44.21 2i03 s LEU 482 CO -0.01 0.31 0.05 -1.00 -0.29 0.00 0.00 176.35 175.42 2i03 s HIS 483 N -0.76 1.23 -0.16 5.38 3.76 -0.27 -0.66 115.29 123.82 2i03 s HIS 483 Ca 0.12 -1.15 -0.01 0.00 -0.15 0.00 0.00 55.06 53.87 2i03 s HIS 483 Cb -0.10 -0.70 -0.01 0.00 1.11 0.00 0.00 32.58 32.88 2i03 s HIS 483 CO 0.01 -0.36 -0.11 -1.54 -0.85 0.00 0.00 174.74 171.90 2i03 s SER 484 N -3.19 4.02 0.15 1.40 1.04 -0.01 -2.28 113.70 114.83 2i03 s SER 484 Ca 0.30 -0.37 -0.15 0.00 0.48 0.00 0.00 55.95 56.20 2i03 s SER 484 Cb 0.07 -1.64 0.02 0.00 0.10 0.00 0.00 66.02 64.57 2i03 s SER 484 CO 0.07 0.10 1.74 0.28 0.98 0.00 0.00 173.24 176.41 2i03 h SER 485 N 7.21 0.56 -0.59 7.02 0.02 -1.43 0.17 113.55 126.51 2i03 h SER 485 Ca -0.32 -0.11 0.06 0.00 -0.84 0.00 0.00 61.79 60.58 2i03 h SER 485 Cb 1.19 -0.14 -0.08 0.00 0.14 0.00 0.00 62.40 63.51 2i03 h SER 485 CO 0.58 0.52 -0.31 0.55 -1.14 0.00 0.00 176.83 177.02 2i03 n VAL 486 N -4.67 -0.38 -0.29 2.27 3.14 -1.26 -2.07 118.33 115.07 2i03 n VAL 486 Ca 0.01 1.42 0.00 0.00 -2.96 0.00 0.00 64.34 62.81 2i03 n VAL 486 Cb 0.10 -1.79 0.00 0.00 -1.06 0.00 0.00 33.84 31.09 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 -4.78 1.34 -3.43 6.55 5.03 -1.25 -5.02 115.26 113.71 2i03 n ASN 487 Ca 0.03 -1.63 -0.17 0.00 0.87 0.00 0.00 54.58 53.67 2i03 n ASN 487 Cb 0.18 0.00 0.09 0.00 -1.02 0.00 0.00 39.78 39.03 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 -0.32 -2.31 -4.85 6.41 10.43 0.55 -5.00 116.55 121.46 2i03 n ASP 488 Ca 0.00 -0.61 -0.37 0.00 2.57 0.00 0.00 54.79 56.38 2i03 n ASP 488 Cb 0.29 -5.10 -0.06 0.00 1.84 0.00 0.00 41.12 38.10 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 -5.41 3.83 0.13 -1.24 1.02 -0.93 -4.83 119.74 112.31 2i03 s LYS 489 Ca 0.04 0.30 -0.30 0.00 0.02 0.00 0.00 55.97 56.03 2i03 s LYS 489 Cb -0.02 -3.18 -0.07 0.00 -0.52 0.00 0.00 37.83 34.05 2i03 s LYS 489 CO 0.73 0.68 1.04 0.20 -0.92 0.00 0.00 175.35 177.08 2i03 s GLY 490 N -1.20 2.88 -0.18 -3.33 0.00 -1.26 -0.83 107.32 103.41 2i03 s GLY 490 Ca 0.24 0.70 0.02 0.00 0.00 0.00 0.00 44.72 45.69 2i03 s GLY 490 CO 0.13 1.60 0.12 1.04 0.00 0.00 0.00 173.10 175.99 2i03 n LEU 491 N 2.72 2.21 0.00 0.66 4.77 0.17 -4.93 117.00 122.60 2i03 n LEU 491 Ca 0.03 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 2i03 n LEU 491 Cb 0.48 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.90 2i03 n LEU 491 CO 0.53 0.79 0.00 -2.11 -1.33 0.00 0.00 177.39 175.26 2i03 n ARG 492 N -3.24 -0.37 -3.54 3.23 1.85 -1.24 -5.04 116.66 108.31 2i03 n ARG 492 Ca -0.36 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.13 2i03 n ARG 492 Cb 1.04 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 32.38 2i03 n ARG 492 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2i03 s VAL 493 N -2.00 5.31 -0.14 8.89 1.01 -1.26 -2.52 120.40 129.69 2i03 s VAL 493 Ca 0.00 0.54 -0.02 0.00 0.00 0.00 0.00 61.98 62.50 2i03 s VAL 493 Cb 0.00 -3.63 -0.24 0.00 0.00 0.00 0.00 36.38 32.51 2i03 s VAL 493 CO 0.00 0.40 0.28 0.18 0.00 0.00 0.00 175.10 175.96 2i03 n LEU 494 N 3.52 2.37 -3.65 3.92 4.77 -0.21 -4.95 117.00 122.78 2i03 n LEU 494 Ca -0.12 0.16 -0.06 0.00 -0.03 0.00 0.00 56.01 55.96 2i03 n LEU 494 Cb 0.52 -0.85 -0.07 0.00 -2.33 0.00 0.00 43.42 40.69 2i03 n LEU 494 CO 0.40 0.80 0.28 -0.70 -1.33 0.00 0.00 177.39 176.83 2i03 s GLU 495 N -2.55 0.62 0.00 3.23 2.56 -1.17 -5.00 118.70 116.39 2i03 s GLU 495 Ca -0.22 1.22 0.03 0.00 0.00 0.00 0.00 54.97 56.00 2i03 s GLU 495 Cb 0.07 0.31 0.02 0.00 2.00 0.00 0.00 34.13 36.53 2i03 s GLU 495 CO 0.75 -0.17 0.57 -0.40 -0.56 0.00 0.00 175.26 175.45 2i03 n ASP 496 N 4.65 1.18 -3.13 -1.70 5.68 -1.26 -0.37 116.55 121.60 2i03 n ASP 496 Ca -0.18 -1.09 -0.23 0.00 -0.50 0.00 0.00 54.79 52.79 2i03 n ASP 496 Cb 0.56 0.03 0.03 0.00 -1.14 0.00 0.00 41.12 40.60 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 0.11 -5.79 -0.20 -1.12 3.02 -1.26 -4.81 115.26 105.21 2i03 n ASN 497 Ca 0.01 -0.33 -0.06 0.00 -0.03 0.00 0.00 54.58 54.18 2i03 n ASN 497 Cb 0.06 -4.68 0.10 0.00 -0.61 0.00 0.00 39.78 34.66 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 -1.44 0.96 -0.63 6.41 4.64 -1.95 -1.75 113.55 119.80 2i03 h SER 498 Ca -0.52 -0.20 0.10 0.00 -0.47 0.00 0.00 61.79 60.69 2i03 h SER 498 Cb 1.36 -0.25 -0.07 0.00 -0.31 0.00 0.00 62.40 63.12 2i03 h SER 498 CO 0.57 0.94 0.24 0.00 -0.87 0.00 0.00 176.83 177.71 2i03 h ALA 499 N 1.18 0.82 -0.35 5.18 0.00 -1.99 -0.40 119.26 123.69 2i03 h ALA 499 Ca 0.20 0.09 -0.15 0.00 0.00 0.00 0.00 54.91 55.04 2i03 h ALA 499 Cb 0.37 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2i03 h ALA 499 CO 0.00 -0.19 -0.38 1.25 0.00 0.00 0.00 179.25 179.94 2i03 h LEU 500 N 0.42 0.95 -0.87 0.00 5.85 -1.79 -2.84 115.31 117.02 2i03 h LEU 500 Ca 0.32 -0.47 0.08 0.00 0.84 0.00 0.00 57.88 58.65 2i03 h LEU 500 Cb 0.40 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.09 2i03 h LEU 500 CO -0.31 1.23 0.53 -0.78 -0.34 0.00 0.00 178.44 178.76 2i03 h ASP 501 N 0.68 0.80 -0.44 1.25 3.58 -0.40 0.50 116.42 122.39 2i03 h ASP 501 Ca 0.05 0.03 -0.09 0.00 0.42 0.00 0.00 57.03 57.44 2i03 h ASP 501 Cb 0.97 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.87 2i03 h ASP 501 CO 0.09 0.48 -0.06 0.11 -2.88 0.00 0.00 179.24 176.98 2i03 h LYS 502 N 0.92 0.89 -0.50 0.28 1.79 -1.02 -2.80 116.57 116.12 2i03 h LYS 502 Ca 0.40 -0.29 -0.09 0.00 -2.18 0.00 0.00 60.65 58.49 2i03 h LYS 502 Cb 0.28 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.84 2i03 h LYS 502 CO -0.21 0.92 -0.05 0.52 -1.08 0.00 0.00 179.45 179.55 2i03 h MET 503 N 0.81 0.92 0.00 3.15 2.86 -0.97 -3.17 114.93 118.53 2i03 h MET 503 Ca 0.14 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 2i03 h MET 503 Cb 0.57 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.16 2i03 h MET 503 CO 0.03 0.97 0.00 1.28 1.06 0.00 0.00 176.91 180.26 2i03 n LEU 504 N -4.26 0.71 0.00 1.22 4.77 0.04 -2.92 117.00 116.56 2i03 n LEU 504 Ca 0.01 0.60 0.12 0.00 -0.03 0.00 0.00 56.01 56.71 2i03 n LEU 504 Cb 0.35 -0.43 0.57 0.00 -2.33 0.00 0.00 43.42 41.59 2i03 n LEU 504 CO 0.43 -0.31 0.90 0.00 -1.33 0.00 0.00 177.39 177.08 2i03 n GLN 505 N -2.20 0.19 -0.64 3.23 10.64 -1.07 -2.32 117.38 125.21 2i03 n GLN 505 Ca 0.04 0.07 0.09 0.00 -1.83 0.00 0.00 57.00 55.37 2i03 n GLN 505 Cb 0.35 -1.50 0.35 0.00 -0.86 0.00 0.00 30.24 28.58 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 -1.38 4.81 -3.94 2.61 3.02 -1.15 -4.94 115.26 114.29 2i03 n ASN 506 Ca 0.09 -2.59 -0.10 0.00 -0.03 0.00 0.00 54.58 51.95 2i03 n ASN 506 Cb 0.24 -0.58 -0.12 0.00 -0.61 0.00 0.00 39.78 38.71 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 -2.10 0.08 -1.26 2.41 0.11 -0.98 -3.89 120.40 114.77 2i03 s VAL 507 Ca 0.50 -0.65 -0.18 0.00 -2.93 0.00 0.00 61.98 58.71 2i03 s VAL 507 Cb 0.34 -0.21 0.07 0.00 -1.53 0.00 0.00 36.38 35.05 2i03 s VAL 507 CO 0.21 -0.36 1.68 -1.10 -3.33 0.00 0.00 175.10 172.21 2i03 s GLN 508 N -1.06 3.95 0.43 1.54 -0.21 -0.10 -4.98 119.66 119.22 2i03 s GLN 508 Ca -0.12 -1.93 -0.23 0.00 0.02 0.00 0.00 55.36 53.11 2i03 s GLN 508 Cb -0.07 -5.49 -0.09 0.00 1.00 0.00 0.00 33.01 28.36 2i03 s GLN 508 CO -0.01 -2.22 1.05 -1.64 -2.12 0.00 0.00 175.29 170.35 2i03 s MET 509 N 4.15 4.04 0.94 2.91 -1.94 -1.26 -4.37 119.30 123.77 2i03 s MET 509 Ca 0.52 1.47 -0.13 0.00 -1.71 0.00 0.00 55.69 55.84 2i03 s MET 509 Cb 0.03 -2.39 0.16 0.00 2.01 0.00 0.00 34.83 34.63 2i03 s MET 509 CO 0.05 -0.25 1.16 -1.25 -0.01 0.00 0.00 175.02 174.73 2i03 s PRO 510 N -2.74 0.89 0.34 2.03 0.04 -1.26 -4.50 135.00 129.79 2i03 s PRO 510 Ca 0.61 0.14 0.08 0.00 0.04 0.00 0.00 61.00 61.88 2i03 s PRO 510 Cb -0.20 -1.82 -0.05 0.00 0.04 0.00 0.00 34.50 32.47 2i03 s PRO 510 CO 0.25 -2.34 0.10 -1.54 0.04 0.00 0.00 177.00 173.51 2i03 s SER 511 N -4.18 4.50 -0.09 6.66 1.04 0.09 -4.92 113.70 116.81 2i03 s SER 511 Ca 0.66 -0.85 0.01 0.00 0.48 0.00 0.00 55.95 56.24 2i03 s SER 511 Cb -0.12 -0.66 0.02 0.00 0.10 0.00 0.00 66.02 65.36 2i03 s SER 511 CO 0.53 -0.28 -0.10 -0.75 0.98 0.00 0.00 173.24 173.62 2i03 s LYS 512 N -3.80 1.67 -0.23 4.02 2.20 -1.26 0.28 119.74 122.61 2i03 s LYS 512 Ca 0.37 -0.35 -0.06 0.00 -0.36 0.00 0.00 55.97 55.57 2i03 s LYS 512 Cb -0.01 -1.54 -0.02 0.00 -1.51 0.00 0.00 37.83 34.75 2i03 s LYS 512 CO 0.21 -0.12 0.02 0.21 -0.36 0.00 0.00 175.35 175.31 2i03 s LYS 513 N 1.19 3.56 -0.22 4.03 2.20 -0.35 -4.94 119.74 125.20 2i03 s LYS 513 Ca -0.04 -0.53 -0.07 0.00 -0.36 0.00 0.00 55.97 54.97 2i03 s LYS 513 Cb -0.14 -3.18 -0.03 0.00 -1.51 0.00 0.00 37.83 32.97 2i03 s LYS 513 CO -0.03 -0.16 0.04 -1.17 -0.36 0.00 0.00 175.35 173.68 2i03 s LEU 514 N 1.46 3.46 0.00 5.43 0.20 -1.26 -1.51 118.68 126.46 2i03 s LEU 514 Ca 0.05 -0.14 0.00 0.00 0.69 0.00 0.00 54.13 54.73 2i03 s LEU 514 Cb -0.15 -1.90 0.00 0.00 -0.43 0.00 0.00 46.19 43.71 2i03 s LEU 514 CO 0.01 0.05 0.00 -0.67 -0.29 0.00 0.00 176.35 175.45 2i03 n ASP 515 N 4.38 0.00 -3.93 3.68 4.64 -0.65 -5.02 116.55 119.66 2i03 n ASP 515 Ca -0.17 -0.76 -0.10 0.00 -1.38 0.00 0.00 54.79 52.39 2i03 n ASP 515 Cb 0.52 0.00 -0.06 0.00 -1.04 0.00 0.00 41.12 40.54 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 -7.37 0.31 0.32 -0.67 -0.71 -1.26 -0.58 117.98 108.01 2i03 s PHE 516 Ca 0.00 -0.66 0.05 0.00 -1.04 0.00 0.00 56.93 55.27 2i03 s PHE 516 Cb 0.00 0.06 -0.06 0.00 -1.21 0.00 0.00 43.02 41.80 2i03 s PHE 516 CO 0.00 -0.79 0.03 0.96 -1.34 0.00 0.00 175.22 174.07 2i03 s ILE 517 N -3.96 1.34 -0.25 -4.49 -4.36 -0.50 -4.93 121.20 104.05 2i03 s ILE 517 Ca 0.17 -2.03 0.02 0.00 -0.26 0.00 0.00 60.65 58.55 2i03 s ILE 517 Cb 0.02 -2.72 0.05 0.00 1.25 0.00 0.00 42.46 41.06 2i03 s ILE 517 CO 0.01 -0.08 -0.11 -0.63 0.24 0.00 0.00 174.94 174.37 2i03 s ILE 518 N -3.20 2.30 -0.29 8.37 1.01 -1.26 -1.08 121.20 127.06 2i03 s ILE 518 Ca 0.35 -1.45 -0.09 0.00 0.00 0.00 0.00 60.65 59.45 2i03 s ILE 518 Cb 0.08 -2.28 -0.02 0.00 0.01 0.00 0.00 42.46 40.25 2i03 s ILE 518 CO 0.15 0.07 0.14 -0.76 0.00 0.00 0.00 174.94 174.54 2i03 s LEU 519 N 1.17 3.94 -0.05 2.97 1.43 -0.36 -4.78 118.68 123.00 2i03 s LEU 519 Ca -0.06 -0.34 -0.05 0.00 -1.03 0.00 0.00 54.13 52.66 2i03 s LEU 519 Cb -0.19 -2.01 0.01 0.00 0.03 0.00 0.00 46.19 44.03 2i03 s LEU 519 CO -0.06 -0.13 0.08 -0.46 0.23 0.00 0.00 176.35 176.01 2i03 n ASN 520 N 4.99 -0.97 0.00 2.29 6.94 -1.26 -1.98 115.26 125.26 2i03 n ASN 520 Ca -0.14 -0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.42 2i03 n ASN 520 Cb 0.50 -0.27 0.00 0.00 -2.36 0.00 0.00 39.78 37.66 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 0.16 0.00 -3.98 -3.83 -0.58 -1.26 -5.00 120.64 106.16 2i03 n GLU 521 Ca -0.01 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.43 2i03 n GLU 521 Cb 0.11 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 30.93 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 -0.35 5.03 -0.15 2.62 2.01 -0.84 -5.09 115.64 118.87 2i03 s THR 522 Ca 0.00 -0.61 -0.10 0.00 0.31 0.00 0.00 61.69 61.30 2i03 s THR 522 Cb 0.00 -3.47 -0.05 0.00 0.01 0.00 0.00 72.50 68.99 2i03 s THR 522 CO 0.00 0.08 0.17 -1.59 -0.69 0.00 0.00 174.62 172.60 2i03 s LYS 523 N -2.61 3.88 -0.12 4.92 0.00 -1.26 -1.23 119.74 123.31 2i03 s LYS 523 Ca 0.33 -0.10 0.02 0.00 0.00 0.00 0.00 55.97 56.21 2i03 s LYS 523 Cb -0.12 -3.32 0.01 0.00 0.00 0.00 0.00 37.83 34.40 2i03 s LYS 523 CO 0.26 0.51 -0.18 -0.06 0.00 0.00 0.00 175.35 175.87 2i03 s PHE 524 N -0.28 2.30 0.39 1.78 0.40 -0.24 -4.95 117.98 117.39 2i03 s PHE 524 Ca 0.13 -1.12 -0.15 0.00 -0.60 0.00 0.00 56.93 55.19 2i03 s PHE 524 Cb -0.12 -1.61 -0.08 0.00 0.51 0.00 0.00 43.02 41.72 2i03 s PHE 524 CO 0.02 -0.54 0.82 -1.58 0.70 0.00 0.00 175.22 174.64 2i03 s TRP 525 N 0.91 3.40 0.15 0.36 0.52 -1.26 -1.41 118.94 121.61 2i03 s TRP 525 Ca -0.07 1.27 -0.11 0.00 0.02 0.00 0.00 56.10 57.22 2i03 s TRP 525 Cb -0.15 -2.60 0.00 0.00 -1.15 0.00 0.00 33.47 29.57 2i03 s TRP 525 CO -0.02 -0.07 0.30 1.52 0.02 0.00 0.00 176.95 178.71 2i03 s TYR 526 N -2.22 0.22 0.02 -1.98 -0.85 0.26 -1.00 117.35 111.79 2i03 s TYR 526 Ca 0.55 -0.59 0.01 0.00 -0.52 0.00 0.00 57.07 56.52 2i03 s TYR 526 Cb -0.10 0.03 -0.02 0.00 0.38 0.00 0.00 41.96 42.25 2i03 s TYR 526 CO 0.23 -0.70 -0.04 1.14 -1.52 0.00 0.00 175.55 174.66 2i03 s GLN 527 N -3.91 0.36 -0.03 -3.49 -2.07 -0.27 -1.64 119.66 108.60 2i03 s GLN 527 Ca 0.12 -0.61 0.03 0.00 -1.82 0.00 0.00 55.36 53.07 2i03 s GLN 527 Cb 0.03 -0.01 0.00 0.00 -1.09 0.00 0.00 33.01 31.94 2i03 s GLN 527 CO -0.04 -0.02 -0.10 -1.64 -1.32 0.00 0.00 175.29 172.17 2i03 s MET 528 N -1.40 1.02 -0.43 9.60 -1.94 -0.57 -1.27 119.30 124.31 2i03 s MET 528 Ca -0.13 -0.34 -0.16 0.00 -1.71 0.00 0.00 55.69 53.35 2i03 s MET 528 Cb -0.09 -0.95 0.03 0.00 2.01 0.00 0.00 34.83 35.83 2i03 s MET 528 CO -0.01 0.14 0.39 0.42 -0.01 0.00 0.00 175.02 175.95 2i03 s ILE 529 N 0.13 5.17 -0.07 2.53 -1.09 0.66 -1.21 121.20 127.32 2i03 s ILE 529 Ca -0.02 -0.61 -0.11 0.00 -2.23 0.00 0.00 60.65 57.68 2i03 s ILE 529 Cb -0.08 -4.03 -0.05 0.00 -1.58 0.00 0.00 42.46 36.72 2i03 s ILE 529 CO 0.00 -0.43 0.26 -0.76 -1.23 0.00 0.00 174.94 172.78 2i03 s LEU 530 N 1.90 4.42 0.74 2.97 1.43 0.14 -2.28 118.68 128.02 2i03 s LEU 530 Ca 0.08 0.69 -0.15 0.00 -1.03 0.00 0.00 54.13 53.72 2i03 s LEU 530 Cb -0.19 -2.31 0.05 0.00 0.03 0.00 0.00 46.19 43.76 2i03 s LEU 530 CO 0.11 0.36 1.20 -2.84 0.23 0.00 0.00 176.35 175.41 2i03 s PRO 531 N -0.96 2.06 0.56 1.29 0.02 -1.26 -0.73 135.00 135.97 2i03 s PRO 531 Ca 0.19 1.75 -0.21 0.00 0.02 0.00 0.00 61.00 62.74 2i03 s PRO 531 Cb -0.14 -1.82 -0.04 0.00 0.02 0.00 0.00 34.50 32.51 2i03 s PRO 531 CO 0.08 -1.90 1.36 -2.14 -0.33 0.00 0.00 177.00 174.07 2i03 s PRO 532 N -3.97 3.08 -1.70 5.54 0.02 -1.26 -2.12 135.00 134.60 2i03 s PRO 532 Ca 0.74 2.23 -0.00 0.00 0.02 0.00 0.00 61.00 63.99 2i03 s PRO 532 Cb -0.29 -2.22 0.00 0.00 0.02 0.00 0.00 34.50 32.01 2i03 s PRO 532 CO 0.46 -1.23 0.01 0.72 -0.33 0.00 0.00 177.00 176.63 2i03 n HIS 533 N -1.11 -0.97 -1.69 6.54 8.25 -1.26 -4.83 115.22 120.15 2i03 n HIS 533 Ca 0.11 0.01 -0.58 0.00 -0.26 0.00 0.00 57.72 57.00 2i03 n HIS 533 Cb 0.45 -3.85 -0.07 0.00 1.12 0.00 0.00 29.99 27.63 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 -4.03 2.00 -3.65 4.41 7.35 -0.90 -4.90 117.46 117.74 2i03 n PHE 534 Ca -0.23 0.55 -0.39 0.00 -0.76 0.00 0.00 57.45 56.62 2i03 n PHE 534 Cb 0.68 -2.45 -0.10 0.00 0.35 0.00 0.00 39.48 37.96 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 3.82 5.51 0.00 -2.13 -1.08 -1.26 -4.94 116.67 116.58 2i03 s ASP 535 Ca 1.00 -2.07 0.00 0.00 -0.52 0.00 0.00 52.55 50.96 2i03 s ASP 535 Cb -1.09 -1.93 0.01 0.00 -1.46 0.00 0.00 42.92 38.45 2i03 s ASP 535 CO 0.66 -0.60 0.08 2.29 0.52 0.00 0.00 175.17 178.12 2i03 n LYS 536 N 4.62 0.03 -0.00 4.34 2.85 -1.26 0.34 118.16 129.08 2i03 n LYS 536 Ca -0.04 0.00 0.08 0.00 -1.05 0.00 0.00 58.31 57.31 2i03 n LYS 536 Cb 0.41 -1.05 -0.12 0.00 -0.65 0.00 0.00 35.03 33.62 2i03 n LYS 536 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2i03 n SER 537 N -0.55 0.90 -4.95 -5.58 2.88 -1.26 -4.32 113.62 100.74 2i03 n SER 537 Ca 0.00 -0.45 -0.23 0.00 -1.33 0.00 0.00 58.87 56.87 2i03 n SER 537 Cb 0.00 1.40 0.01 0.00 -0.75 0.00 0.00 64.21 64.87 2i03 n SER 537 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 2i03 s LYS 538 N -2.91 3.08 -0.39 -1.46 2.20 0.15 -4.98 119.74 115.43 2i03 s LYS 538 Ca -0.00 -0.51 -0.02 0.00 -0.36 0.00 0.00 55.97 55.08 2i03 s LYS 538 Cb 0.12 -2.57 0.10 0.00 -1.51 0.00 0.00 37.83 33.97 2i03 s LYS 538 CO 0.71 -0.24 0.17 0.15 -0.36 0.00 0.00 175.35 175.79 2i03 s LYS 539 N -4.53 2.02 0.32 4.03 1.02 -1.26 -4.27 119.74 117.07 2i03 s LYS 539 Ca 0.48 -1.75 -0.07 0.00 0.02 0.00 0.00 55.97 54.64 2i03 s LYS 539 Cb -0.10 -3.52 -0.06 0.00 -0.52 0.00 0.00 37.83 33.64 2i03 s LYS 539 CO 0.37 -1.01 0.62 0.71 -0.92 0.00 0.00 175.35 175.12 2i03 s TYR 540 N 1.14 3.47 0.52 3.18 1.51 -0.79 -4.30 117.35 122.09 2i03 s TYR 540 Ca 0.07 0.79 -0.17 0.00 -1.01 0.00 0.00 57.07 56.74 2i03 s TYR 540 Cb -0.22 -2.22 -0.07 0.00 -0.11 0.00 0.00 41.96 39.33 2i03 s TYR 540 CO -0.04 0.10 1.01 -1.25 -1.11 0.00 0.00 175.55 174.26 2i03 s PRO 541 N -3.56 3.78 -0.05 -1.71 0.04 -1.26 -0.40 135.00 131.84 2i03 s PRO 541 Ca 0.46 1.10 0.03 0.00 0.04 0.00 0.00 61.00 62.63 2i03 s PRO 541 Cb -0.11 -2.10 0.01 0.00 0.04 0.00 0.00 34.50 32.34 2i03 s PRO 541 CO 0.29 -0.42 -0.13 -1.17 0.04 0.00 0.00 177.00 175.61 2i03 s LEU 542 N -4.02 1.74 -0.27 -3.56 0.20 -0.24 -2.01 118.68 110.52 2i03 s LEU 542 Ca 0.62 -0.29 -0.07 0.00 0.69 0.00 0.00 54.13 55.07 2i03 s LEU 542 Cb -0.12 -0.81 -0.01 0.00 -0.43 0.00 0.00 46.19 44.81 2i03 s LEU 542 CO 0.29 0.07 0.08 -0.22 -0.29 0.00 0.00 176.35 176.28 2i03 s LEU 543 N 0.43 3.66 -0.35 -0.68 0.20 0.10 -0.33 118.68 121.70 2i03 s LEU 543 Ca -0.10 -0.46 -0.23 0.00 0.69 0.00 0.00 54.13 54.03 2i03 s LEU 543 Cb -0.13 -1.90 0.01 0.00 -0.43 0.00 0.00 46.19 43.73 2i03 s LEU 543 CO 0.03 -0.12 0.76 -0.22 -0.29 0.00 0.00 176.35 176.50 2i03 s LEU 544 N 1.56 4.14 -0.51 -0.68 2.96 0.14 -1.38 118.68 124.91 2i03 s LEU 544 Ca 0.05 0.38 -0.19 0.00 -0.22 0.00 0.00 54.13 54.14 2i03 s LEU 544 Cb -0.16 -2.99 0.06 0.00 0.50 0.00 0.00 46.19 43.60 2i03 s LEU 544 CO 0.03 -0.68 0.62 -0.62 -1.32 0.00 0.00 176.35 174.38 2i03 s ASP 545 N 1.79 6.22 0.20 3.68 -1.08 0.14 -0.69 116.67 126.93 2i03 s ASP 545 Ca 0.30 -0.94 0.09 0.00 -0.52 0.00 0.00 52.55 51.48 2i03 s ASP 545 Cb -0.14 -2.29 -0.04 0.00 -1.46 0.00 0.00 42.92 38.99 2i03 s ASP 545 CO 0.16 -0.90 -0.10 0.54 0.52 0.00 0.00 175.17 175.39 2i03 s VAL 546 N 2.61 3.09 0.00 1.11 0.11 -0.19 -4.31 120.40 122.82 2i03 s VAL 546 Ca 0.15 -1.78 0.00 0.00 -2.93 0.00 0.00 61.98 57.41 2i03 s VAL 546 Cb -0.20 -2.55 0.00 0.00 -1.53 0.00 0.00 36.38 32.10 2i03 s VAL 546 CO 0.12 -0.17 0.00 0.00 -3.33 0.00 0.00 175.10 171.72 2i03 n TYR 547 N -0.11 0.00 -2.13 1.54 9.36 -1.26 -4.22 117.16 120.33 2i03 n TYR 547 Ca -0.10 0.00 -0.18 0.00 3.32 0.00 0.00 57.90 60.94 2i03 n TYR 547 Cb 0.56 0.18 -0.03 0.00 -0.63 0.00 0.00 39.34 39.43 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 -1.64 -0.47 -1.94 2.98 0.00 -1.26 -3.48 120.51 114.71 2i03 n ALA 548 Ca 0.00 0.18 -0.30 0.00 0.00 0.00 0.00 53.44 53.32 2i03 n ALA 548 Cb 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 17.52 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 -2.35 1.66 0.14 0.00 0.00 -1.26 -4.92 107.32 100.60 2i03 s GLY 549 Ca 0.00 -0.14 -0.34 0.00 0.00 0.00 0.00 44.72 44.24 2i03 s GLY 549 CO 0.00 0.11 1.14 -1.05 0.00 0.00 0.00 173.10 173.30 2i03 n PRO 550 N -2.57 0.95 -2.58 2.90 -0.02 -1.26 -1.64 135.00 130.77 2i03 n PRO 550 Ca 0.05 0.34 -0.21 0.00 -2.02 0.00 0.00 63.50 61.66 2i03 n PRO 550 Cb 0.54 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 2i03 n PRO 550 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2i03 s SER 552 N -2.26 5.96 -0.19 0.00 1.04 -0.65 -4.13 113.70 113.46 2i03 s SER 552 Ca 0.09 -0.05 -0.04 0.00 0.48 0.00 0.00 55.95 56.43 2i03 s SER 552 Cb -0.04 -1.35 0.08 0.00 0.10 0.00 0.00 66.02 64.81 2i03 s SER 552 CO 0.11 -0.47 0.16 -1.58 0.98 0.00 0.00 173.24 172.45 2i03 s GLN 553 N -4.25 0.14 0.00 4.02 0.74 -1.26 -1.91 119.66 117.13 2i03 s GLN 553 Ca 0.45 0.05 0.17 0.00 0.05 0.00 0.00 55.36 56.08 2i03 s GLN 553 Cb -0.10 -1.46 0.21 0.00 1.10 0.00 0.00 33.01 32.76 2i03 s GLN 553 CO 0.33 -0.68 1.12 1.63 -0.55 0.00 0.00 175.29 177.13 2i03 n LYS 554 N 5.30 1.69 -3.95 1.67 4.76 -1.26 -4.83 118.16 121.54 2i03 n LYS 554 Ca -0.06 -1.70 -0.31 0.00 -2.87 0.00 0.00 58.31 53.37 2i03 n LYS 554 Cb 0.49 -1.35 -0.15 0.00 -1.84 0.00 0.00 35.03 32.18 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 -1.35 2.22 0.11 7.82 0.00 -1.26 -4.76 121.76 124.54 2i03 s ALA 555 Ca 0.23 -1.75 0.01 0.00 0.00 0.00 0.00 51.96 50.46 2i03 s ALA 555 Cb 0.15 -1.61 -0.00 0.00 0.00 0.00 0.00 23.12 21.66 2i03 s ALA 555 CO 0.22 -1.38 0.13 -0.40 0.00 0.00 0.00 175.76 174.33 2i03 n ASP 556 N 4.56 -0.35 -1.73 0.00 5.68 -1.26 -4.46 116.55 118.99 2i03 n ASP 556 Ca -0.07 -1.68 -0.12 0.00 -0.50 0.00 0.00 54.79 52.42 2i03 n ASP 556 Cb 0.43 0.70 0.21 0.00 -1.14 0.00 0.00 41.12 41.32 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 -0.20 2.88 -3.19 2.12 -2.24 -1.06 -4.91 114.28 107.67 2i03 n THR 557 Ca 0.01 -2.18 -0.39 0.00 -2.27 0.00 0.00 64.05 59.23 2i03 n THR 557 Cb 0.20 -0.39 -0.05 0.00 -2.10 0.00 0.00 70.33 67.99 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 -3.21 5.06 0.04 2.28 1.01 -1.26 -1.72 120.40 122.60 2i03 s VAL 558 Ca 0.51 1.20 -0.30 0.00 0.00 0.00 0.00 61.98 63.39 2i03 s VAL 558 Cb 0.44 -3.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 2i03 s VAL 558 CO 0.07 0.33 1.14 0.12 0.00 0.00 0.00 175.10 176.76 2i03 s PHE 559 N 0.45 3.49 0.00 5.22 5.36 0.66 -4.94 117.98 128.22 2i03 s PHE 559 Ca 0.31 1.40 0.01 0.00 -0.96 0.00 0.00 56.93 57.69 2i03 s PHE 559 Cb -0.17 -3.34 -0.00 0.00 -0.34 0.00 0.00 43.02 39.16 2i03 s PHE 559 CO 0.15 -0.95 -0.02 1.03 -1.46 0.00 0.00 175.22 173.96 2i03 s ARG 560 N 1.07 0.18 -0.61 10.12 0.52 -1.26 -4.93 118.95 124.04 2i03 s ARG 560 Ca 0.57 -0.15 0.02 0.00 -0.52 0.00 0.00 55.73 55.65 2i03 s ARG 560 Cb -0.27 -0.12 0.15 0.00 0.52 0.00 0.00 34.95 35.23 2i03 s ARG 560 CO 0.29 0.03 0.39 -0.51 0.02 0.00 0.00 175.30 175.52 2i03 s LEU 561 N -0.26 4.75 0.00 2.53 1.02 -1.26 -4.86 118.68 120.59 2i03 s LEU 561 Ca -0.02 -3.18 0.00 0.00 0.02 0.00 0.00 54.13 50.96 2i03 s LEU 561 Cb -0.02 -1.72 0.00 0.00 0.02 0.00 0.00 46.19 44.47 2i03 s LEU 561 CO -0.00 -0.24 0.00 -0.46 0.02 0.00 0.00 176.35 175.67 2i03 n ASN 562 N 2.95 0.67 0.06 2.29 0.23 -1.26 -5.01 115.26 115.19 2i03 n ASN 562 Ca 0.10 -0.30 0.04 0.00 -0.53 0.00 0.00 54.58 53.88 2i03 n ASN 562 Cb 0.34 0.00 0.45 0.00 -2.08 0.00 0.00 39.78 38.49 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 0.30 0.40 -0.21 -2.53 7.01 -1.97 -1.88 115.95 117.08 2i03 h TRP 563 Ca 0.00 0.00 -0.09 0.00 2.11 0.00 0.00 58.89 60.91 2i03 h TRP 563 Cb 0.00 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 26.91 2i03 h TRP 563 CO 0.00 0.29 -0.26 0.00 -2.79 0.00 0.00 178.44 175.67 2i03 h ALA 564 N 1.76 1.16 -0.37 2.65 0.00 -1.97 -1.86 119.26 120.63 2i03 h ALA 564 Ca 0.11 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.70 2i03 h ALA 564 Cb 0.02 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2i03 h ALA 564 CO -0.02 0.54 0.22 1.15 0.00 0.00 0.00 179.25 181.14 2i03 h THR 565 N 0.35 1.05 -0.11 0.00 2.02 -1.67 -0.81 112.91 113.74 2i03 h THR 565 Ca 0.05 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.07 2i03 h THR 565 Cb 0.65 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 2i03 h THR 565 CO 0.05 0.08 0.06 0.22 0.37 0.00 0.00 175.52 176.30 2i03 h TYR 566 N 0.45 0.15 -0.86 3.16 3.20 -1.39 0.67 116.97 122.36 2i03 h TYR 566 Ca 0.14 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.02 2i03 h TYR 566 Cb -0.01 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.17 2i03 h TYR 566 CO -0.07 0.18 0.57 -0.07 -1.64 0.00 0.00 178.16 177.13 2i03 h LEU 567 N 0.08 0.98 0.25 2.82 3.38 -1.06 0.96 115.31 122.72 2i03 h LEU 567 Ca 0.04 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2i03 h LEU 567 Cb 0.08 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.58 2i03 h LEU 567 CO -0.01 0.71 -0.12 0.00 0.09 0.00 0.00 178.44 179.11 2i03 h ALA 568 N 1.32 -0.33 0.13 1.53 0.00 -1.04 -0.85 119.26 120.03 2i03 h ALA 568 Ca 0.32 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2i03 h ALA 568 Cb -0.12 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2i03 h ALA 568 CO -0.07 -0.41 -0.21 1.03 0.00 0.00 0.00 179.25 179.59 2i03 h SER 569 N -0.89 -0.59 0.04 0.00 0.87 -0.78 -1.94 113.55 110.27 2i03 h SER 569 Ca -0.03 0.07 -0.30 0.00 -1.23 0.00 0.00 61.79 60.30 2i03 h SER 569 Cb 0.51 0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 62.65 2i03 h SER 569 CO 0.06 -0.30 -1.63 0.41 -0.53 0.00 0.00 176.83 174.83 2i03 n THR 570 N -5.34 1.60 1.33 2.23 -1.04 0.32 -4.45 114.28 108.94 2i03 n THR 570 Ca -0.07 -0.26 0.14 0.00 -2.04 0.00 0.00 64.05 61.82 2i03 n THR 570 Cb 0.25 -1.92 0.50 0.00 -1.82 0.00 0.00 70.33 67.34 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 -4.11 0.78 -3.58 -2.82 -0.58 -0.79 -4.96 120.64 104.58 2i03 n GLU 571 Ca -0.35 -0.37 -0.21 0.00 -0.42 0.00 0.00 57.16 55.81 2i03 n GLU 571 Cb 0.81 -1.49 0.07 0.00 -0.57 0.00 0.00 31.44 30.26 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 -0.79 -3.11 -4.49 1.62 5.03 -0.41 -4.93 115.26 108.19 2i03 n ASN 572 Ca 0.13 -0.67 -0.31 0.00 0.87 0.00 0.00 54.58 54.60 2i03 n ASN 572 Cb 0.31 -4.73 -0.12 0.00 -1.02 0.00 0.00 39.78 34.22 2i03 n ASN 572 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2i03 s ILE 573 N -3.42 3.02 -0.20 2.41 1.01 -0.71 -4.50 121.20 118.81 2i03 s ILE 573 Ca 0.20 -1.00 -0.19 0.00 0.00 0.00 0.00 60.65 59.67 2i03 s ILE 573 Cb -0.09 -2.26 -0.03 0.00 0.01 0.00 0.00 42.46 40.09 2i03 s ILE 573 CO 0.76 0.41 0.54 -0.63 0.00 0.00 0.00 174.94 176.02 2i03 s ILE 574 N -0.89 5.09 -0.35 2.92 1.01 -0.85 -3.49 121.20 124.63 2i03 s ILE 574 Ca 0.14 1.00 -0.07 0.00 0.00 0.00 0.00 60.65 61.72 2i03 s ILE 574 Cb -0.11 -3.86 0.04 0.00 0.01 0.00 0.00 42.46 38.54 2i03 s ILE 574 CO 0.05 0.16 0.13 -0.69 0.00 0.00 0.00 174.94 174.58 2i03 s VAL 575 N 1.71 3.86 0.16 2.92 1.01 -0.96 0.02 120.40 129.12 2i03 s VAL 575 Ca 0.25 -1.15 0.08 0.00 0.00 0.00 0.00 61.98 61.16 2i03 s VAL 575 Cb -0.15 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 2i03 s VAL 575 CO 0.10 -0.22 -0.10 0.00 0.00 0.00 0.00 175.10 174.88 2i03 s ALA 576 N 1.41 2.93 -0.00 5.51 0.00 -0.48 -0.24 121.76 130.89 2i03 s ALA 576 Ca -0.01 -1.42 0.01 0.00 0.00 0.00 0.00 51.96 50.55 2i03 s ALA 576 Cb -0.20 -0.77 -0.00 0.00 0.00 0.00 0.00 23.12 22.15 2i03 s ALA 576 CO 0.03 0.51 -0.04 -1.12 0.00 0.00 0.00 175.76 175.14 2i03 s SER 577 N -2.66 0.47 -0.06 0.00 0.01 -0.39 0.26 113.70 111.32 2i03 s SER 577 Ca 0.24 -0.08 0.03 0.00 1.31 0.00 0.00 55.95 57.45 2i03 s SER 577 Cb -0.09 -0.05 0.00 0.00 0.21 0.00 0.00 66.02 66.09 2i03 s SER 577 CO 0.15 0.04 -0.16 0.12 0.41 0.00 0.00 173.24 173.80 2i03 s PHE 578 N -0.13 1.70 -0.58 2.43 5.36 -1.26 -1.12 117.98 124.39 2i03 s PHE 578 Ca 0.01 -0.57 -0.16 0.00 -0.96 0.00 0.00 56.93 55.25 2i03 s PHE 578 Cb -0.02 -1.18 0.14 0.00 -0.34 0.00 0.00 43.02 41.62 2i03 s PHE 578 CO -0.00 -0.24 0.53 -0.51 -1.46 0.00 0.00 175.22 173.54 2i03 s ASP 579 N 0.31 6.25 0.00 6.13 1.01 -0.17 -4.86 116.67 125.34 2i03 s ASP 579 Ca -0.10 -1.92 0.00 0.00 0.71 0.00 0.00 52.55 51.25 2i03 s ASP 579 Cb -0.14 -2.20 0.00 0.00 1.01 0.00 0.00 42.92 41.59 2i03 s ASP 579 CO 0.04 -0.82 0.00 0.61 0.21 0.00 0.00 175.17 175.21 2i03 n GLY 580 N 5.07 1.88 3.69 0.21 0.00 -1.26 -4.10 105.19 110.67 2i03 n GLY 580 Ca -0.10 -1.96 -0.44 0.00 0.00 0.00 0.00 46.02 43.52 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 2.26 0.00 1.61 3.00 -1.26 -1.44 116.66 120.82 2i03 n ARG 581 Ca 0.00 0.81 0.00 0.00 -0.01 0.00 0.00 57.85 58.65 2i03 n ARG 581 Cb 0.00 -2.52 0.00 0.00 0.00 0.00 0.00 32.46 29.94 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 2.39 2.28 3.72 -0.13 0.00 0.22 -3.91 105.19 109.76 2i03 n GLY 582 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 2i03 n GLY 582 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2i03 s SER 583 N -1.49 3.78 0.56 1.61 0.01 -0.52 0.21 113.70 117.85 2i03 s SER 583 Ca 0.00 2.11 0.06 0.00 1.31 0.00 0.00 55.95 59.44 2i03 s SER 583 Cb 0.00 -2.56 0.06 0.00 0.21 0.00 0.00 66.02 63.73 2i03 s SER 583 CO 0.00 -2.53 0.52 0.61 0.41 0.00 0.00 173.24 172.25 2i03 n GLY 584 N -0.19 2.53 2.63 3.44 0.00 -0.80 -3.27 105.19 109.53 2i03 n GLY 584 Ca 0.11 -2.28 -0.03 0.00 0.00 0.00 0.00 46.02 43.83 2i03 n GLY 584 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2i03 n TYR 585 N -1.93 0.00 -1.15 1.61 4.01 -1.26 -4.80 117.16 113.65 2i03 n TYR 585 Ca 0.03 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.81 2i03 n TYR 585 Cb 0.62 -1.59 0.06 0.00 -0.31 0.00 0.00 39.34 38.11 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 -0.73 1.05 0.00 -0.72 6.02 -1.26 -4.52 117.38 117.22 2i03 n GLN 586 Ca -0.03 -1.68 0.00 0.00 -0.01 0.00 0.00 57.00 55.29 2i03 n GLN 586 Cb 0.37 -1.00 0.00 0.00 1.02 0.00 0.00 30.24 30.63 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 -0.68 1.08 0.22 1.08 0.00 -1.26 -4.58 105.19 101.05 2i03 n GLY 587 Ca 0.07 -1.80 0.09 0.00 0.00 0.00 0.00 46.02 44.38 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 0.00 -0.69 1.61 5.19 -1.24 -2.17 116.42 119.12 2i03 h ASP 588 Ca 0.00 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.40 2i03 h ASP 588 Cb 0.00 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.48 2i03 h ASP 588 CO 0.00 0.26 0.40 0.50 -3.12 0.00 0.00 179.24 177.28 2i03 h LYS 589 N 0.00 0.96 0.06 3.56 3.11 -1.85 0.65 116.57 123.06 2i03 h LYS 589 Ca -0.00 -0.09 -0.17 0.00 -2.81 0.00 0.00 60.65 57.57 2i03 h LYS 589 Cb 0.69 -0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 31.71 2i03 h LYS 589 CO 0.03 0.69 -0.87 0.82 -2.81 0.00 0.00 179.45 177.32 2i03 h ILE 590 N 0.97 1.30 -0.50 2.00 2.04 -1.77 -3.32 117.51 118.24 2i03 h ILE 590 Ca 0.25 -2.36 -0.09 0.00 1.00 0.00 0.00 64.86 63.67 2i03 h ILE 590 Cb -0.00 2.88 -0.02 0.00 -0.74 0.00 0.00 36.82 38.93 2i03 h ILE 590 CO -0.04 0.59 -0.04 -0.03 0.00 0.00 0.00 178.15 178.62 2i03 h MET 591 N -0.68 0.88 -0.33 2.37 4.05 -1.31 0.68 114.93 120.58 2i03 h MET 591 Ca -0.20 -0.27 0.00 0.00 -0.28 0.00 0.00 59.70 58.95 2i03 h MET 591 Cb 1.41 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 32.13 2i03 h MET 591 CO -0.01 0.90 0.00 0.72 0.23 0.00 0.00 176.91 178.76 2i03 n HIS 592 N -4.18 0.44 0.27 1.39 8.25 0.21 -4.11 115.22 117.48 2i03 n HIS 592 Ca 0.02 -0.22 0.14 0.00 -0.26 0.00 0.00 57.72 57.40 2i03 n HIS 592 Cb 0.34 0.00 0.73 0.00 1.12 0.00 0.00 29.99 32.18 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 3.74 1.20 -0.49 -1.41 0.00 -1.63 -2.43 119.26 118.25 2i03 h ALA 593 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2i03 h ALA 593 Cb 0.49 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2i03 h ALA 593 CO 0.00 0.14 0.00 0.44 0.00 0.00 0.00 179.25 179.83 2i03 n ILE 594 N -3.51 0.68 -1.60 0.00 -5.35 -1.26 -4.92 119.36 103.41 2i03 n ILE 594 Ca -0.01 -0.84 -0.50 0.00 -0.27 0.00 0.00 62.75 61.12 2i03 n ILE 594 Cb 0.26 0.81 -0.05 0.00 -1.74 0.00 0.00 39.64 38.91 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 1.45 1.74 -0.88 7.28 4.05 -0.92 0.73 115.26 128.71 2i03 n ASN 595 Ca 0.20 1.12 -0.10 0.00 0.45 0.00 0.00 54.58 56.25 2i03 n ASN 595 Cb 0.59 -1.23 -0.04 0.00 1.23 0.00 0.00 39.78 40.33 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 2.34 -1.63 -2.71 1.20 1.74 0.50 -4.78 116.66 113.32 2i03 n ARG 596 Ca 0.17 0.75 -0.06 0.00 -0.77 0.00 0.00 57.85 57.94 2i03 n ARG 596 Cb 0.22 -4.98 0.05 0.00 -1.02 0.00 0.00 32.46 26.73 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 -0.93 1.31 -1.92 5.56 3.00 0.22 -4.90 116.66 119.01 2i03 n ARG 597 Ca -0.10 -3.05 -0.35 0.00 -0.00 0.00 0.00 57.85 54.35 2i03 n ARG 597 Cb 0.49 -1.11 0.04 0.00 0.00 0.00 0.00 32.46 31.88 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 -3.35 3.60 -0.01 6.15 1.43 -1.19 -3.30 118.68 122.00 2i03 s LEU 598 Ca 0.26 2.35 0.00 0.00 -1.03 0.00 0.00 54.13 55.71 2i03 s LEU 598 Cb 0.42 -4.59 0.00 0.00 0.03 0.00 0.00 46.19 42.04 2i03 s LEU 598 CO -0.00 -1.69 0.00 0.61 0.23 0.00 0.00 176.35 175.50 2i03 n GLY 599 N 0.41 0.38 0.00 -3.19 0.00 -1.26 -4.84 105.19 96.68 2i03 n GLY 599 Ca 0.13 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.17 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 -3.54 0.00 -0.25 2.61 -2.24 -1.21 -4.85 114.28 104.80 2i03 n THR 600 Ca -0.00 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.74 2i03 n THR 600 Cb 0.28 0.00 0.07 0.00 -2.10 0.00 0.00 70.33 68.58 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 0.82 0.00 4.78 0.04 -1.92 -0.39 116.94 120.27 2i03 h PHE 601 Ca 0.00 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.76 2i03 h PHE 601 Cb 0.00 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 37.87 2i03 h PHE 601 CO 0.00 0.48 -0.15 1.05 -0.60 0.00 0.00 178.31 179.08 2i03 h GLU 602 N 0.86 0.00 0.06 1.51 9.09 -1.91 0.15 114.58 124.34 2i03 h GLU 602 Ca 0.28 0.00 -0.14 0.00 0.05 0.00 0.00 59.36 59.54 2i03 h GLU 602 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.10 2i03 h GLU 602 CO -0.10 0.15 -0.71 -0.24 0.05 0.00 0.00 179.01 178.17 2i03 h VAL 603 N 0.00 1.41 -0.69 -1.06 3.04 -1.78 -3.06 116.25 114.11 2i03 h VAL 603 Ca -0.00 -2.37 0.08 0.00 -1.01 0.00 0.00 66.70 63.40 2i03 h VAL 603 Cb 0.29 3.00 -0.04 0.00 -2.01 0.00 0.00 31.29 32.52 2i03 h VAL 603 CO 0.02 0.60 0.45 -0.33 -1.01 0.00 0.00 177.57 177.30 2i03 h GLU 604 N -0.71 0.62 -0.05 4.17 5.08 -0.90 -0.45 114.58 122.33 2i03 h GLU 604 Ca -0.16 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.06 2i03 h GLU 604 Cb 1.36 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 2i03 h GLU 604 CO 0.01 0.41 -0.44 -0.44 -1.00 0.00 0.00 179.01 177.55 2i03 h ASP 605 N 0.63 0.11 0.75 1.42 5.19 -0.80 -1.68 116.42 122.06 2i03 h ASP 605 Ca 0.31 -0.05 -0.06 0.00 -0.62 0.00 0.00 57.03 56.61 2i03 h ASP 605 Cb 0.38 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 39.85 2i03 h ASP 605 CO -0.10 0.54 -0.30 -0.61 -3.12 0.00 0.00 179.24 175.65 2i03 h GLN 606 N 0.09 0.00 0.17 3.56 5.75 -0.98 -1.26 115.11 122.44 2i03 h GLN 606 Ca 0.01 0.00 -0.29 0.00 -0.15 0.00 0.00 58.65 58.21 2i03 h GLN 606 Cb 0.81 0.00 0.02 0.00 1.07 0.00 0.00 27.48 29.38 2i03 h GLN 606 CO 0.06 0.30 -1.40 0.82 -2.65 0.00 0.00 178.83 175.96 2i03 h ILE 607 N 0.00 1.16 0.00 2.39 2.04 -1.10 -3.24 117.51 118.75 2i03 h ILE 607 Ca -0.00 -2.53 -0.04 0.00 1.00 0.00 0.00 64.86 63.29 2i03 h ILE 607 Cb 0.75 2.91 -0.01 0.00 -0.74 0.00 0.00 36.82 39.73 2i03 h ILE 607 CO 0.04 0.77 -0.20 -0.08 0.00 0.00 0.00 178.15 178.68 2i03 h GLU 608 N -0.10 0.00 -0.29 2.37 4.57 -1.19 -2.25 114.58 117.69 2i03 h GLU 608 Ca -0.27 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 57.80 2i03 h GLU 608 Cb 1.93 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.51 2i03 h GLU 608 CO 0.16 0.20 -0.24 0.00 -1.18 0.00 0.00 179.01 177.95 2i03 h ALA 609 N 1.80 0.42 0.00 2.92 0.00 -1.31 -1.74 119.26 121.35 2i03 h ALA 609 Ca -0.00 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 2i03 h ALA 609 Cb 0.52 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2i03 h ALA 609 CO 0.03 0.40 -0.21 0.00 0.00 0.00 0.00 179.25 179.46 2i03 h ALA 610 N 0.71 1.07 -0.05 0.00 0.00 -1.50 0.40 119.26 119.90 2i03 h ALA 610 Ca 0.05 -0.19 -0.22 0.00 0.00 0.00 0.00 54.91 54.55 2i03 h ALA 610 Cb 0.80 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2i03 h ALA 610 CO 0.06 0.26 -0.86 0.00 0.00 0.00 0.00 179.25 178.72 2i03 h ARG 611 N 0.00 0.52 -0.27 0.00 3.08 -1.20 -2.45 114.38 114.05 2i03 h ARG 611 Ca -0.00 -0.49 -0.10 0.00 0.07 0.00 0.00 59.98 59.46 2i03 h ARG 611 Cb 0.66 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 2i03 h ARG 611 CO 0.03 1.12 -0.21 1.96 -1.07 0.00 0.00 179.97 181.79 2i03 h GLN 612 N 0.33 0.62 -0.15 0.04 1.08 -0.67 -2.38 115.11 113.98 2i03 h GLN 612 Ca -0.07 -0.31 -0.01 0.00 -1.45 0.00 0.00 58.65 56.82 2i03 h GLN 612 Cb 1.47 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.90 2i03 h GLN 612 CO 0.16 0.90 0.05 0.74 -0.95 0.00 0.00 178.83 179.73 2i03 h PHE 613 N 0.35 0.24 -0.04 2.96 0.04 -0.97 -2.47 116.94 117.05 2i03 h PHE 613 Ca 0.05 -0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.81 2i03 h PHE 613 Cb 0.76 -0.07 -0.00 0.00 2.20 0.00 0.00 35.95 38.84 2i03 h PHE 613 CO 0.07 0.34 0.03 0.66 -0.60 0.00 0.00 178.31 178.81 2i03 h SER 614 N 0.06 0.00 -0.32 2.17 4.64 -1.46 0.16 113.55 118.81 2i03 h SER 614 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2i03 h SER 614 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2i03 h SER 614 CO -0.00 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.25 2i03 n LYS 615 N -4.23 2.16 0.03 4.77 4.76 -0.90 -3.28 118.16 121.47 2i03 n LYS 615 Ca -0.02 -1.32 0.11 0.00 -2.87 0.00 0.00 58.31 54.21 2i03 n LYS 615 Cb 0.13 -1.48 0.02 0.00 -1.84 0.00 0.00 35.03 31.86 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 0.44 0.30 0.00 1.97 2.81 0.57 -5.01 117.12 118.20 2i03 n MET 616 Ca 0.12 -0.01 0.00 0.00 -1.81 0.00 0.00 57.70 56.01 2i03 n MET 616 Cb 0.43 -1.59 0.00 0.00 -0.71 0.00 0.00 33.22 31.35 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 2.73 1.64 3.03 0.00 -1.20 -4.93 105.19 107.81 2i03 n GLY 617 Ca 0.02 -0.40 -0.07 0.00 0.00 0.00 0.00 46.02 45.57 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 1.74 -4.78 1.61 1.16 -1.26 -4.73 117.46 111.19 2i03 n PHE 618 Ca 0.00 -0.99 -0.26 0.00 -1.87 0.00 0.00 57.45 54.33 2i03 n PHE 618 Cb 0.00 -0.56 -0.16 0.00 -1.61 0.00 0.00 39.48 37.15 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 -2.16 1.36 -0.66 1.97 1.01 -1.26 -1.88 120.40 118.79 2i03 s VAL 619 Ca 0.37 -0.67 -0.27 0.00 0.00 0.00 0.00 61.98 61.40 2i03 s VAL 619 Cb 0.30 -1.18 0.03 0.00 0.00 0.00 0.00 36.38 35.53 2i03 s VAL 619 CO 0.09 0.40 1.19 -0.62 0.00 0.00 0.00 175.10 176.15 2i03 s ASP 620 N 0.09 6.28 0.41 3.32 -1.08 0.47 -4.77 116.67 121.39 2i03 s ASP 620 Ca -0.05 -0.29 0.28 0.00 -0.52 0.00 0.00 52.55 51.97 2i03 s ASP 620 Cb -0.12 -2.53 1.46 0.00 -1.46 0.00 0.00 42.92 40.27 2i03 s ASP 620 CO 0.02 -1.62 1.85 -0.55 0.52 0.00 0.00 175.17 175.39 2i03 h ASN 621 N 9.75 0.00 -0.03 -0.34 7.08 -1.92 -0.28 115.58 129.84 2i03 h ASN 621 Ca -0.27 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.95 2i03 h ASN 621 Cb 1.06 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.30 2i03 h ASN 621 CO 1.22 0.00 0.00 0.29 -2.08 0.00 0.00 177.43 176.86 2i03 n LYS 622 N -2.48 1.53 -3.21 4.14 5.02 -1.26 -4.34 118.16 117.55 2i03 n LYS 622 Ca -0.01 -0.77 -0.24 0.00 -2.02 0.00 0.00 58.31 55.27 2i03 n LYS 622 Cb 0.08 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.55 2i03 n LYS 622 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2i03 n ARG 623 N -0.06 1.00 -4.68 1.97 1.74 -0.12 -4.88 116.66 111.64 2i03 n ARG 623 Ca 0.19 -3.43 -0.33 0.00 -0.77 0.00 0.00 57.85 53.51 2i03 n ARG 623 Cb 0.30 -1.41 -0.16 0.00 -1.02 0.00 0.00 32.46 30.16 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 -1.57 2.24 0.33 0.55 1.01 -1.26 -1.08 121.20 121.43 2i03 s ILE 624 Ca 0.37 -0.92 0.08 0.00 0.00 0.00 0.00 60.65 60.17 2i03 s ILE 624 Cb 0.20 -1.91 -0.06 0.00 0.01 0.00 0.00 42.46 40.69 2i03 s ILE 624 CO -0.10 0.54 -0.05 0.00 0.00 0.00 0.00 174.94 175.33 2i03 s ALA 625 N 0.77 2.75 -0.01 9.38 0.00 0.55 -0.58 121.76 134.62 2i03 s ALA 625 Ca -0.08 -2.07 -0.07 0.00 0.00 0.00 0.00 51.96 49.74 2i03 s ALA 625 Cb -0.16 0.12 0.01 0.00 0.00 0.00 0.00 23.12 23.09 2i03 s ALA 625 CO -0.00 -0.03 0.15 -1.50 0.00 0.00 0.00 175.76 174.38 2i03 s ILE 626 N -2.81 0.07 0.04 0.00 2.07 -1.06 0.26 121.20 119.77 2i03 s ILE 626 Ca 0.32 -0.54 -0.24 0.00 -1.41 0.00 0.00 60.65 58.78 2i03 s ILE 626 Cb 0.05 -0.41 0.06 0.00 0.13 0.00 0.00 42.46 42.29 2i03 s ILE 626 CO 0.15 -0.30 0.55 -1.66 -1.91 0.00 0.00 174.94 171.78 2i03 s TRP 627 N -1.08 -0.47 0.06 3.50 1.48 0.13 -1.33 118.94 121.22 2i03 s TRP 627 Ca -0.12 0.57 -0.27 0.00 -1.06 0.00 0.00 56.10 55.23 2i03 s TRP 627 Cb -0.06 0.37 0.09 0.00 -1.16 0.00 0.00 33.47 32.70 2i03 s TRP 627 CO 0.01 -0.65 0.85 0.20 -4.06 0.00 0.00 176.95 173.30 2i03 s GLY 628 N -1.88 -0.43 0.02 3.67 0.00 -0.95 -1.02 107.32 106.72 2i03 s GLY 628 Ca -0.06 0.70 0.08 0.00 0.00 0.00 0.00 44.72 45.44 2i03 s GLY 628 CO -0.00 0.22 -0.24 0.86 0.00 0.00 0.00 173.10 173.94 2i03 s TRP 629 N -3.29 2.39 0.00 1.90 -0.11 -1.26 -1.75 118.94 116.82 2i03 s TRP 629 Ca 0.06 -0.38 0.00 0.00 1.22 0.00 0.00 56.10 57.00 2i03 s TRP 629 Cb -0.01 -1.45 0.00 0.00 -1.50 0.00 0.00 33.47 30.51 2i03 s TRP 629 CO -0.07 0.10 0.00 0.45 -4.62 0.00 0.00 176.95 172.81 2i03 n SER 630 N 1.97 0.00 0.17 5.86 2.88 -0.37 -0.69 113.62 123.43 2i03 n SER 630 Ca -0.17 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.39 2i03 n SER 630 Cb 0.52 0.00 0.30 0.00 -0.75 0.00 0.00 64.21 64.27 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 0.02 -0.25 0.66 5.03 -1.86 -2.15 116.97 118.42 2i03 h TYR 631 Ca 0.00 -0.00 -0.09 0.00 2.58 0.00 0.00 58.73 61.21 2i03 h TYR 631 Cb 0.00 -0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.26 2i03 h TYR 631 CO 0.00 0.46 -0.24 0.78 -1.32 0.00 0.00 178.16 177.84 2i03 h GLY 632 N 1.33 0.51 1.62 1.82 0.00 -0.94 -1.68 103.07 105.73 2i03 h GLY 632 Ca -0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 47.33 46.82 2i03 h GLY 632 CO 0.06 0.37 -0.29 -1.33 0.00 0.00 0.00 176.54 175.35 2i03 h GLY 633 N 1.01 0.48 0.61 4.60 0.00 -1.25 0.10 103.07 108.62 2i03 h GLY 633 Ca 0.06 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 2i03 h GLY 633 CO 0.05 0.37 -0.14 -1.82 0.00 0.00 0.00 176.54 175.00 2i03 h TYR 634 N 0.38 -0.35 -0.51 5.60 3.20 -1.12 -1.35 116.97 122.82 2i03 h TYR 634 Ca 0.05 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.93 2i03 h TYR 634 Cb 0.71 0.12 -0.03 0.00 1.54 0.00 0.00 36.73 39.07 2i03 h TYR 634 CO 0.02 -0.01 0.33 0.28 -1.64 0.00 0.00 178.16 177.14 2i03 h VAL 635 N -0.77 1.09 -0.73 1.81 2.07 -1.27 0.34 116.25 118.79 2i03 h VAL 635 Ca -0.04 -0.23 0.08 0.00 0.82 0.00 0.00 66.70 67.34 2i03 h VAL 635 Cb 0.50 0.38 -0.07 0.00 -1.52 0.00 0.00 31.29 30.59 2i03 h VAL 635 CO 0.06 0.12 0.40 0.74 0.02 0.00 0.00 177.57 178.91 2i03 h THR 636 N 0.66 0.92 -0.27 2.57 2.02 -0.82 0.56 112.91 118.54 2i03 h THR 636 Ca 0.20 -0.24 -0.12 0.00 0.77 0.00 0.00 66.41 67.02 2i03 h THR 636 Cb -0.03 0.15 -0.00 0.00 -1.74 0.00 0.00 68.15 66.53 2i03 h THR 636 CO -0.07 0.13 -0.29 0.28 0.37 0.00 0.00 175.52 175.94 2i03 h SER 637 N 0.70 0.73 -0.86 4.18 0.02 -0.42 -0.13 113.55 117.77 2i03 h SER 637 Ca 0.35 -0.48 -0.03 0.00 -0.84 0.00 0.00 61.79 60.79 2i03 h SER 637 Cb 0.29 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.59 2i03 h SER 637 CO -0.23 1.06 0.42 0.24 -1.14 0.00 0.00 176.83 177.18 2i03 h MET 638 N 0.41 1.23 0.01 3.45 2.86 0.39 -0.52 114.93 122.76 2i03 h MET 638 Ca 0.04 -0.17 -0.00 0.00 -2.06 0.00 0.00 59.70 57.50 2i03 h MET 638 Cb 0.86 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.30 2i03 h MET 638 CO 0.07 0.93 -0.01 0.28 1.06 0.00 0.00 176.91 179.25 2i03 h VAL 639 N 1.21 1.16 0.00 -2.22 2.07 0.25 -2.52 116.25 116.20 2i03 h VAL 639 Ca 0.29 -0.53 0.00 0.00 0.82 0.00 0.00 66.70 67.29 2i03 h VAL 639 Cb 0.10 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 2i03 h VAL 639 CO -0.04 0.14 0.00 -0.07 0.02 0.00 0.00 177.57 177.62 2i03 h LEU 640 N -0.25 0.00 -2.97 2.57 3.38 -0.71 -1.69 115.31 115.65 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 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2i03 h LEU 640 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 2i03 n GLY 641 N -0.91 2.84 0.15 0.83 0.00 -0.23 -4.41 105.19 103.46 2i03 n GLY 641 Ca -0.02 -0.70 0.05 0.00 0.00 0.00 0.00 46.02 45.35 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 3.21 0.00 -0.04 1.61 4.64 -0.89 -3.43 113.55 118.65 2i03 h SER 642 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2i03 h SER 642 Cb 1.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 2i03 h SER 642 CO 0.10 0.34 -0.01 0.61 -0.87 0.00 0.00 176.83 176.99 2i03 n GLY 643 N 1.21 0.48 0.32 -0.77 0.00 -1.26 -4.92 105.19 100.25 2i03 n GLY 643 Ca 0.01 -0.56 0.21 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2i03 h SER 644 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2i03 h SER 644 CO 0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.60 2i03 n GLY 645 N -0.76 1.63 0.19 -0.77 0.00 -1.26 -4.86 105.19 99.36 2i03 n GLY 645 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 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 1.35 -3.23 1.61 2.07 -1.96 -3.45 116.25 112.64 2i03 h VAL 646 Ca 0.00 -1.99 -0.68 0.00 0.82 0.00 0.00 66.70 64.86 2i03 h VAL 646 Cb 0.00 1.97 -0.13 0.00 -1.52 0.00 0.00 31.29 31.61 2i03 h VAL 646 CO 0.00 0.61 -0.60 -0.36 0.02 0.00 0.00 177.57 177.23 2i03 s PHE 647 N -3.77 3.21 -0.11 1.57 0.40 -1.26 -4.64 117.98 113.38 2i03 s PHE 647 Ca -0.06 0.22 -0.22 0.00 -0.60 0.00 0.00 56.93 56.27 2i03 s PHE 647 Cb 0.11 -1.79 -0.27 0.00 0.51 0.00 0.00 43.02 41.58 2i03 s PHE 647 CO 0.84 0.51 0.68 -0.22 0.70 0.00 0.00 175.22 177.73 2i03 h LYS 648 N 4.95 0.17 -3.81 0.44 3.64 -1.16 -3.46 116.57 117.34 2i03 h LYS 648 Ca -0.51 -0.29 -0.10 0.00 -1.27 0.00 0.00 60.65 58.48 2i03 h LYS 648 Cb 1.19 0.11 -0.10 0.00 -0.41 0.00 0.00 32.23 33.03 2i03 h LYS 648 CO 0.56 1.14 -0.19 0.00 -2.27 0.00 0.00 179.45 178.69 2i03 s GLY 650 N -3.06 -0.50 -0.06 0.00 0.00 0.01 -2.57 107.32 101.15 2i03 s GLY 650 Ca 0.25 0.94 0.03 0.00 0.00 0.00 0.00 44.72 45.94 2i03 s GLY 650 CO 0.10 0.33 -0.15 -0.42 0.00 0.00 0.00 173.10 172.97 2i03 s ILE 651 N -3.16 1.30 -0.20 0.90 1.01 -0.44 -1.93 121.20 118.68 2i03 s ILE 651 Ca 0.04 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 60.09 2i03 s ILE 651 Cb -0.01 -1.15 0.04 0.00 0.01 0.00 0.00 42.46 41.35 2i03 s ILE 651 CO -0.09 0.39 -0.14 0.00 0.00 0.00 0.00 174.94 175.09 2i03 s ALA 652 N 0.34 2.18 -0.21 9.38 0.00 -0.83 -2.24 121.76 130.38 2i03 s ALA 652 Ca -0.09 -1.26 -0.06 0.00 0.00 0.00 0.00 51.96 50.54 2i03 s ALA 652 Cb -0.14 -1.27 -0.03 0.00 0.00 0.00 0.00 23.12 21.68 2i03 s ALA 652 CO 0.03 -0.67 0.04 0.08 0.00 0.00 0.00 175.76 175.24 2i03 s VAL 653 N 1.33 4.34 -1.36 0.00 1.01 -0.72 -1.58 120.40 123.42 2i03 s VAL 653 Ca 0.00 -0.18 -0.10 0.00 0.00 0.00 0.00 61.98 61.70 2i03 s VAL 653 Cb -0.15 -2.98 0.01 0.00 0.00 0.00 0.00 36.38 33.26 2i03 s VAL 653 CO -0.09 0.41 0.42 0.00 0.00 0.00 0.00 175.10 175.84 2i03 n ALA 654 N 4.18 -2.22 -2.03 5.51 0.00 0.74 -1.24 120.51 125.45 2i03 n ALA 654 Ca -0.17 -0.37 -0.30 0.00 0.00 0.00 0.00 53.44 52.61 2i03 n ALA 654 Cb 0.52 -1.96 -0.00 0.00 0.00 0.00 0.00 19.45 18.01 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 -6.86 3.65 0.17 0.00 0.04 -1.26 -3.18 135.00 127.58 2i03 s PRO 655 Ca 0.18 0.58 -0.21 0.00 0.04 0.00 0.00 61.00 61.58 2i03 s PRO 655 Cb -0.08 -2.22 -0.08 0.00 0.04 0.00 0.00 34.50 32.16 2i03 s PRO 655 CO 0.93 -0.35 0.70 0.08 0.04 0.00 0.00 177.00 178.41 2i03 s VAL 656 N -2.86 4.55 -0.03 -0.36 1.01 -1.24 -4.44 120.40 117.02 2i03 s VAL 656 Ca 0.53 1.38 0.04 0.00 0.00 0.00 0.00 61.98 63.92 2i03 s VAL 656 Cb -0.11 -3.95 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 2i03 s VAL 656 CO 0.45 0.37 0.03 -1.54 0.00 0.00 0.00 175.10 174.41 2i03 n SER 657 N 1.17 4.06 -3.68 3.32 3.41 -1.26 -4.32 113.62 116.33 2i03 n SER 657 Ca -0.05 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.47 2i03 n SER 657 Cb 0.50 0.75 -0.10 0.00 -0.26 0.00 0.00 64.21 65.11 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 -2.14 0.44 0.66 4.33 1.70 -1.26 -0.32 118.95 122.36 2i03 s ARG 658 Ca -0.02 0.94 0.34 0.00 -0.47 0.00 0.00 55.73 56.52 2i03 s ARG 658 Cb 0.02 0.11 1.85 0.00 -0.57 0.00 0.00 34.95 36.36 2i03 s ARG 658 CO 0.16 -0.18 2.06 -1.49 -1.08 0.00 0.00 175.30 174.77 2i03 h TRP 659 N 7.36 0.00 0.00 5.89 4.06 -1.86 -0.12 115.95 131.28 2i03 h TRP 659 Ca -0.30 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.65 2i03 h TRP 659 Cb 1.17 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.33 2i03 h TRP 659 CO 0.22 0.00 0.00 0.39 -3.56 0.00 0.00 178.44 175.49 2i03 n GLU 660 N -3.05 0.01 0.06 0.49 1.02 -1.26 -2.72 120.64 115.19 2i03 n GLU 660 Ca -0.02 0.16 0.11 0.00 -0.02 0.00 0.00 57.16 57.39 2i03 n GLU 660 Cb 0.30 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.16 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 -1.50 0.63 -2.75 -0.32 4.01 -0.06 -3.80 117.16 113.38 2i03 n TYR 661 Ca 0.05 0.19 -0.26 0.00 -0.16 0.00 0.00 57.90 57.72 2i03 n TYR 661 Cb 0.23 -0.81 0.01 0.00 -0.31 0.00 0.00 39.34 38.46 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 -3.40 3.40 0.66 -0.72 5.04 -1.10 -4.83 117.35 116.40 2i03 s TYR 662 Ca -0.03 0.58 -0.18 0.00 -2.44 0.00 0.00 57.07 55.00 2i03 s TYR 662 Cb 0.11 -2.36 -0.00 0.00 0.35 0.00 0.00 41.96 40.05 2i03 s TYR 662 CO 0.83 -0.38 1.28 0.16 -1.34 0.00 0.00 175.55 176.10 2i03 s ASP 663 N -4.17 4.55 0.06 4.32 1.47 -1.26 -1.07 116.67 120.57 2i03 s ASP 663 Ca 0.48 2.59 -0.26 0.00 1.18 0.00 0.00 52.55 56.54 2i03 s ASP 663 Cb -0.10 -2.61 -0.17 0.00 -0.34 0.00 0.00 42.92 39.70 2i03 s ASP 663 CO 0.42 -2.04 1.59 0.77 0.68 0.00 0.00 175.17 176.59 2i03 h SER 664 N 0.44 -0.22 -0.67 2.11 4.64 -0.97 -2.47 113.55 116.41 2i03 h SER 664 Ca -0.51 -0.08 0.09 0.00 -0.47 0.00 0.00 61.79 60.83 2i03 h SER 664 Cb 1.33 0.06 -0.07 0.00 -0.31 0.00 0.00 62.40 63.41 2i03 h SER 664 CO 0.53 -0.06 0.31 0.58 -0.87 0.00 0.00 176.83 177.32 2i03 h VAL 665 N -0.37 0.83 0.26 0.95 2.07 -1.94 -0.24 116.25 117.81 2i03 h VAL 665 Ca -0.03 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 2i03 h VAL 665 Cb 0.28 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 2i03 h VAL 665 CO 0.04 0.10 -0.12 0.22 0.02 0.00 0.00 177.57 177.83 2i03 h TYR 666 N 0.54 -0.32 -0.32 1.57 5.03 -1.90 -3.18 116.97 118.39 2i03 h TYR 666 Ca 0.33 -0.01 0.06 0.00 2.58 0.00 0.00 58.73 61.69 2i03 h TYR 666 Cb 0.37 0.11 -0.05 0.00 1.55 0.00 0.00 36.73 38.70 2i03 h TYR 666 CO -0.13 -0.06 -0.00 1.15 -1.32 0.00 0.00 178.16 177.80 2i03 h THR 667 N -1.03 0.76 0.00 1.81 2.02 -1.39 -2.03 112.91 113.05 2i03 h THR 667 Ca -0.04 -0.03 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 2i03 h THR 667 Cb 0.40 0.66 -0.00 0.00 -1.74 0.00 0.00 68.15 67.47 2i03 h THR 667 CO 0.06 0.02 -0.08 -0.33 0.37 0.00 0.00 175.52 175.55 2i03 h GLU 668 N 0.09 0.00 0.00 6.66 5.08 -1.21 0.76 114.58 125.96 2i03 h GLU 668 Ca 0.16 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2i03 h GLU 668 Cb 0.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 2i03 h GLU 668 CO -0.27 0.08 -0.02 -0.09 -1.00 0.00 0.00 179.01 177.72 2i03 h ARG 669 N 0.00 0.00 0.00 2.33 2.43 -1.33 -1.98 114.38 115.83 2i03 h ARG 669 Ca -0.00 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.13 2i03 h ARG 669 Cb 0.47 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 2i03 h ARG 669 CO 0.01 0.02 -1.20 0.66 -1.51 0.00 0.00 179.97 177.95 2i03 n TYR 670 N -4.25 0.00 0.73 2.20 4.01 -0.94 -4.60 117.16 114.30 2i03 n TYR 670 Ca -0.03 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.80 2i03 n TYR 670 Cb 0.11 -0.13 -0.12 0.00 -0.31 0.00 0.00 39.34 38.89 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 -1.95 0.67 0.00 -0.72 2.81 0.22 0.19 117.12 118.34 2i03 n MET 671 Ca -0.04 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 2i03 n MET 671 Cb 0.43 -1.41 0.00 0.00 -0.71 0.00 0.00 33.22 31.53 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 1.44 -0.62 3.87 3.03 0.00 -0.75 -4.66 105.19 107.51 2i03 n GLY 672 Ca 0.02 -1.13 -0.33 0.00 0.00 0.00 0.00 46.02 44.59 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 4.24 -0.75 0.99 1.02 -1.26 -4.33 118.68 118.60 2i03 s LEU 673 Ca 0.00 0.28 -0.07 0.00 0.02 0.00 0.00 54.13 54.36 2i03 s LEU 673 Cb 0.00 -2.57 -0.12 0.00 0.02 0.00 0.00 46.19 43.52 2i03 s LEU 673 CO 0.00 0.25 3.14 -0.81 0.02 0.00 0.00 176.35 178.95 2i03 n PRO 674 N 0.91 2.92 -4.39 1.29 -0.04 -1.26 -1.69 135.00 132.73 2i03 n PRO 674 Ca -0.11 -1.88 -0.28 0.00 -0.04 0.00 0.00 63.50 61.19 2i03 n PRO 674 Cb 0.52 -2.35 -0.13 0.00 -0.04 0.00 0.00 33.50 31.50 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 0.63 2.25 0.55 0.52 -4.23 -1.26 -4.64 115.64 109.45 2i03 s THR 675 Ca 0.65 -1.80 0.25 0.00 -1.18 0.00 0.00 61.69 59.62 2i03 s THR 675 Cb 0.27 -2.00 0.37 0.00 1.34 0.00 0.00 72.50 72.48 2i03 s THR 675 CO -0.06 0.05 2.04 1.55 -0.54 0.00 0.00 174.62 177.66 2i03 h PRO 676 N 3.77 0.00 0.00 3.99 0.13 -1.95 0.24 132.00 138.19 2i03 h PRO 676 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2i03 h PRO 676 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2i03 h PRO 676 CO 0.41 0.00 0.00 0.93 -0.23 0.00 0.00 178.00 179.11 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 0.16 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.02 2i03 h GLU 677 Cb 0.72 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.63 2i03 h GLU 677 CO -0.00 0.00 0.00 -3.47 -1.40 0.00 0.00 179.01 174.14 2i03 n ASP 678 N -3.05 0.00 -0.19 1.42 -0.08 0.81 -5.01 116.55 110.45 2i03 n ASP 678 Ca 0.02 0.00 0.08 0.00 -1.51 0.00 0.00 54.79 53.38 2i03 n ASP 678 Cb 0.42 0.00 0.11 0.00 2.34 0.00 0.00 41.12 43.99 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 1.78 -0.31 1.67 4.05 -0.68 -4.86 115.26 116.90 2i03 n ASN 679 Ca 0.00 -2.84 0.12 0.00 0.45 0.00 0.00 54.58 52.31 2i03 n ASN 679 Cb 0.00 -0.38 0.30 0.00 1.23 0.00 0.00 39.78 40.93 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 0.02 0.44 -0.40 1.20 5.85 -1.49 -2.61 115.31 118.33 2i03 h LEU 680 Ca -0.00 0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.88 2i03 h LEU 680 Cb 1.10 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.18 2i03 h LEU 680 CO 0.00 0.08 0.20 0.44 -0.34 0.00 0.00 178.44 178.82 2i03 h ASP 681 N 0.49 0.29 -0.41 1.25 3.32 -1.89 -1.68 116.42 117.80 2i03 h ASP 681 Ca 0.55 0.02 -0.11 0.00 0.02 0.00 0.00 57.03 57.51 2i03 h ASP 681 Cb 0.98 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.47 2i03 h ASP 681 CO -0.48 0.21 -0.14 -0.74 -1.72 0.00 0.00 179.24 176.38 2i03 h HIS 682 N 0.40 0.98 -0.66 4.55 2.76 -1.86 -1.75 115.15 119.58 2i03 h HIS 682 Ca 0.17 -0.20 0.13 0.00 -2.20 0.00 0.00 60.37 58.28 2i03 h HIS 682 Cb 0.08 -0.24 -0.10 0.00 1.55 0.00 0.00 27.41 28.69 2i03 h HIS 682 CO -0.10 0.95 0.11 1.88 -1.30 0.00 0.00 177.93 179.47 2i03 h TYR 683 N 0.78 0.16 0.00 5.26 0.05 -1.09 0.28 116.97 122.41 2i03 h TYR 683 Ca 0.12 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.94 2i03 h TYR 683 Cb 0.66 0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.43 2i03 h TYR 683 CO 0.04 -0.09 0.00 0.00 -1.05 0.00 0.00 178.16 177.06 2i03 h ARG 684 N 0.22 0.00 0.00 4.88 2.47 -0.94 -3.12 114.38 117.89 2i03 h ARG 684 Ca 0.35 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.07 2i03 h ARG 684 Cb 0.57 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.89 2i03 h ARG 684 CO -0.48 0.00 -1.07 0.09 0.56 0.00 0.00 179.97 179.07 2i03 n ASN 685 N -2.73 0.60 -1.99 7.04 4.13 0.69 -4.34 115.26 118.65 2i03 n ASN 685 Ca 0.03 -0.10 -0.08 0.00 1.68 0.00 0.00 54.58 56.11 2i03 n ASN 685 Cb 0.36 0.80 0.28 0.00 -1.54 0.00 0.00 39.78 39.68 2i03 n ASN 685 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2i03 n SER 686 N -2.09 4.59 -4.89 6.41 3.41 0.49 -4.98 113.62 116.56 2i03 n SER 686 Ca 0.01 -3.20 -0.31 0.00 -0.26 0.00 0.00 58.87 55.12 2i03 n SER 686 Cb 0.46 -0.75 -0.04 0.00 -0.26 0.00 0.00 64.21 63.62 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 -2.89 5.03 0.14 6.66 -4.23 -1.26 -4.76 115.64 114.33 2i03 s THR 687 Ca 0.53 0.21 -0.09 0.00 -1.18 0.00 0.00 61.69 61.16 2i03 s THR 687 Cb 0.42 -3.66 -0.08 0.00 1.34 0.00 0.00 72.50 70.52 2i03 s THR 687 CO 0.13 -0.13 1.43 0.58 -0.54 0.00 0.00 174.62 176.09 2i03 h VAL 688 N 1.80 1.29 -0.86 2.29 2.07 -1.00 -3.29 116.25 118.54 2i03 h VAL 688 Ca -0.47 -1.77 0.13 0.00 0.82 0.00 0.00 66.70 65.41 2i03 h VAL 688 Cb 1.17 1.69 -0.07 0.00 -1.52 0.00 0.00 31.29 32.57 2i03 h VAL 688 CO 0.69 0.57 0.56 0.24 0.02 0.00 0.00 177.57 179.65 2i03 h MET 689 N 0.59 0.70 0.00 1.57 2.86 -1.92 -0.95 114.93 117.78 2i03 h MET 689 Ca 0.01 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 2i03 h MET 689 Cb 1.16 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.66 2i03 h MET 689 CO 0.12 0.46 0.00 0.66 1.06 0.00 0.00 176.91 179.21 2i03 h SER 690 N 0.72 0.00 -0.46 1.22 4.64 -1.94 -1.67 113.55 116.05 2i03 h SER 690 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 2i03 h SER 690 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 2i03 h SER 690 CO -0.18 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.32 2i03 n ARG 691 N -2.89 2.34 -0.25 4.77 1.74 -0.36 -4.62 116.66 117.39 2i03 n ARG 691 Ca -0.01 -2.06 0.04 0.00 -0.77 0.00 0.00 57.85 55.06 2i03 n ARG 691 Cb 0.15 -1.48 0.15 0.00 -1.02 0.00 0.00 32.46 30.26 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 4.25 0.74 -0.97 7.54 0.00 -1.35 -1.73 119.26 127.75 2i03 h ALA 692 Ca 0.00 0.24 0.19 0.00 0.00 0.00 0.00 54.91 55.35 2i03 h ALA 692 Cb 0.83 0.43 -0.11 0.00 0.00 0.00 0.00 17.79 18.93 2i03 h ALA 692 CO 0.00 -0.42 0.56 1.49 0.00 0.00 0.00 179.25 180.88 2i03 h GLU 693 N 0.09 0.67 0.00 0.00 4.57 -1.84 -2.01 114.58 116.06 2i03 h GLU 693 Ca 0.40 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.54 2i03 h GLU 693 Cb 0.69 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.13 2i03 h GLU 693 CO -0.66 0.44 0.00 0.09 -1.18 0.00 0.00 179.01 177.70 2i03 n ASN 694 N -4.82 0.70 0.00 1.04 5.03 -0.65 -2.80 115.26 113.76 2i03 n ASN 694 Ca 0.23 0.68 0.10 0.00 0.87 0.00 0.00 54.58 56.46 2i03 n ASN 694 Cb 0.58 -0.83 0.52 0.00 -1.02 0.00 0.00 39.78 39.03 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 -2.29 0.00 0.29 3.10 3.01 -0.75 -2.57 117.46 118.24 2i03 n PHE 695 Ca 0.02 0.00 0.16 0.00 1.01 0.00 0.00 57.45 58.64 2i03 n PHE 695 Cb 0.22 -0.26 0.86 0.00 -0.01 0.00 0.00 39.48 40.29 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 -0.32 -1.08 1.57 -1.71 -2.39 116.57 112.65 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 0.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.48 2i03 h LYS 696 CO 0.00 0.06 0.00 1.04 -0.57 0.00 0.00 179.45 179.98 2i03 n GLN 697 N -3.45 2.21 -4.20 3.15 1.13 -1.06 -4.98 117.38 110.18 2i03 n GLN 697 Ca -0.02 -1.83 -0.12 0.00 -1.94 0.00 0.00 57.00 53.08 2i03 n GLN 697 Cb 0.19 -1.46 -0.10 0.00 0.11 0.00 0.00 30.24 28.98 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 -1.59 0.00 -0.31 5.09 -7.23 -0.90 -4.95 120.40 110.52 2i03 s VAL 698 Ca 0.36 -1.97 -0.10 0.00 -1.81 0.00 0.00 61.98 58.46 2i03 s VAL 698 Cb 0.20 -2.49 -0.02 0.00 0.56 0.00 0.00 36.38 34.64 2i03 s VAL 698 CO 0.29 0.00 0.17 -1.61 -0.31 0.00 0.00 175.10 173.64 2i03 s GLU 699 N -4.09 3.46 -0.07 4.82 2.02 -0.78 -4.97 118.70 119.10 2i03 s GLU 699 Ca 0.38 -0.64 0.04 0.00 0.02 0.00 0.00 54.97 54.78 2i03 s GLU 699 Cb 0.06 -3.60 -0.02 0.00 0.10 0.00 0.00 34.13 30.68 2i03 s GLU 699 CO 0.13 -0.38 -0.20 -0.47 0.02 0.00 0.00 175.26 174.36 2i03 s TYR 700 N 1.65 2.56 -0.20 1.61 5.04 -1.26 -0.81 117.35 125.93 2i03 s TYR 700 Ca 0.05 -0.55 0.02 0.00 -2.44 0.00 0.00 57.07 54.15 2i03 s TYR 700 Cb -0.17 -1.64 0.04 0.00 0.35 0.00 0.00 41.96 40.53 2i03 s TYR 700 CO 0.07 -0.10 -0.15 -1.17 -1.34 0.00 0.00 175.55 172.86 2i03 s LEU 701 N -0.24 2.51 -0.24 6.97 0.20 -0.81 -0.19 118.68 126.87 2i03 s LEU 701 Ca -0.00 -0.90 -0.07 0.00 0.69 0.00 0.00 54.13 53.84 2i03 s LEU 701 Cb -0.13 -1.43 -0.03 0.00 -0.43 0.00 0.00 46.19 44.17 2i03 s LEU 701 CO 0.03 -0.09 0.06 -0.22 -0.29 0.00 0.00 176.35 175.84 2i03 s LEU 702 N 1.27 3.44 0.05 -0.68 0.20 0.04 -1.96 118.68 121.03 2i03 s LEU 702 Ca -0.00 -0.19 0.07 0.00 0.69 0.00 0.00 54.13 54.69 2i03 s LEU 702 Cb -0.16 -1.91 -0.03 0.00 -0.43 0.00 0.00 46.19 43.66 2i03 s LEU 702 CO -0.10 -0.02 -0.20 -0.63 -0.29 0.00 0.00 176.35 175.12 2i03 s ILE 703 N 1.50 1.60 -0.21 6.68 1.01 -0.61 -1.58 121.20 129.59 2i03 s ILE 703 Ca 0.06 -1.20 -0.27 0.00 0.00 0.00 0.00 60.65 59.24 2i03 s ILE 703 Cb -0.15 -1.40 0.09 0.00 0.01 0.00 0.00 42.46 41.00 2i03 s ILE 703 CO 0.03 0.16 0.80 -2.28 0.00 0.00 0.00 174.94 173.65 2i03 s HIS 704 N -0.83 -0.66 -0.10 3.97 2.46 -0.90 -0.19 115.29 119.05 2i03 s HIS 704 Ca 0.07 1.46 -0.23 0.00 0.47 0.00 0.00 55.06 56.83 2i03 s HIS 704 Cb -0.09 0.34 -0.03 0.00 -0.13 0.00 0.00 32.58 32.67 2i03 s HIS 704 CO 0.02 -0.40 0.69 0.20 -2.47 0.00 0.00 174.74 172.77 2i03 s GLY 705 N -0.18 2.46 0.54 1.59 0.00 -1.26 -1.72 107.32 108.75 2i03 s GLY 705 Ca -0.02 0.03 0.28 0.00 0.00 0.00 0.00 44.72 45.01 2i03 s GLY 705 CO 0.02 1.22 2.13 -0.91 0.00 0.00 0.00 173.10 175.56 2i03 h THR 706 N 4.87 0.56 -0.87 0.90 1.35 -1.37 -2.57 112.91 115.77 2i03 h THR 706 Ca -0.38 -0.37 -0.45 0.00 -0.55 0.00 0.00 66.41 64.66 2i03 h THR 706 Cb 1.18 1.24 -0.27 0.00 -1.73 0.00 0.00 68.15 68.57 2i03 h THR 706 CO 0.77 0.08 0.51 0.00 -0.25 0.00 0.00 175.52 176.63 2i03 n ALA 707 N -2.30 5.36 -2.27 6.62 0.00 -0.82 -4.69 120.51 122.41 2i03 n ALA 707 Ca -0.02 -2.95 -0.42 0.00 0.00 0.00 0.00 53.44 50.05 2i03 n ALA 707 Cb 0.19 -1.31 -0.03 0.00 0.00 0.00 0.00 19.45 18.30 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 -1.54 6.04 0.38 0.00 -1.08 -0.97 -4.10 116.67 115.39 2i03 s ASP 708 Ca 0.55 0.63 0.20 0.00 -0.52 0.00 0.00 52.55 53.41 2i03 s ASP 708 Cb 0.47 -2.54 0.34 0.00 -1.46 0.00 0.00 42.92 39.72 2i03 s ASP 708 CO 0.09 -1.71 1.58 -2.24 0.52 0.00 0.00 175.17 173.41 2i03 h ASP 709 N 11.77 0.00 0.00 -0.34 2.03 -1.92 -3.32 116.42 124.65 2i03 h ASP 709 Ca -0.28 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.02 2i03 h ASP 709 Cb 1.12 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.62 2i03 h ASP 709 CO 1.13 0.23 0.00 -3.20 -1.03 0.00 0.00 179.24 176.37 2i03 n ASN 710 N -3.18 0.00 -4.38 4.15 2.85 -1.26 -4.68 115.26 108.77 2i03 n ASN 710 Ca 0.03 0.17 -0.45 0.00 -0.11 0.00 0.00 54.58 54.22 2i03 n ASN 710 Cb 0.59 -0.19 -0.07 0.00 1.24 0.00 0.00 39.78 41.35 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 -0.39 5.17 0.38 3.44 1.01 -1.26 -4.81 120.40 123.95 2i03 s VAL 711 Ca 0.00 -1.09 -0.27 0.00 0.00 0.00 0.00 61.98 60.62 2i03 s VAL 711 Cb 0.00 -4.21 -0.10 0.00 0.00 0.00 0.00 36.38 32.08 2i03 s VAL 711 CO 0.00 -0.69 1.35 -1.00 0.00 0.00 0.00 175.10 174.76 2i03 s HIS 712 N 1.78 2.81 0.54 5.22 3.76 -1.25 -4.66 115.29 123.49 2i03 s HIS 712 Ca 0.05 1.35 0.38 0.00 -0.15 0.00 0.00 55.06 56.70 2i03 s HIS 712 Cb -0.25 -3.76 1.56 0.00 1.11 0.00 0.00 32.58 31.24 2i03 s HIS 712 CO 0.06 -2.26 1.77 0.35 -0.85 0.00 0.00 174.74 173.81 2i03 h PHE 713 N 2.90 0.04 -0.90 1.40 3.57 -1.79 0.20 116.94 122.35 2i03 h PHE 713 Ca -0.50 0.00 0.25 0.00 3.53 0.00 0.00 57.97 61.26 2i03 h PHE 713 Cb 1.24 -0.01 -0.15 0.00 2.79 0.00 0.00 35.95 39.82 2i03 h PHE 713 CO 0.54 -0.00 0.26 0.37 -2.23 0.00 0.00 178.31 177.25 2i03 h GLN 714 N 0.02 0.19 -0.17 1.11 4.15 -1.95 -0.24 115.11 118.22 2i03 h GLN 714 Ca 0.62 -0.01 0.05 0.00 0.77 0.00 0.00 58.65 60.08 2i03 h GLN 714 Cb 2.45 -0.04 -0.05 0.00 0.21 0.00 0.00 27.48 30.04 2i03 h GLN 714 CO -0.03 0.12 -0.17 1.96 -1.93 0.00 0.00 178.83 178.79 2i03 h GLN 715 N 0.19 -0.18 -0.13 1.69 1.08 -0.91 -0.94 115.11 115.91 2i03 h GLN 715 Ca 0.59 0.01 -0.17 0.00 -1.45 0.00 0.00 58.65 57.63 2i03 h GLN 715 Cb 1.22 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.69 2i03 h GLN 715 CO -0.68 -0.12 -0.62 0.77 -0.95 0.00 0.00 178.83 177.23 2i03 h SER 716 N -0.19 0.53 -0.19 1.46 0.02 -1.44 -2.41 113.55 111.33 2i03 h SER 716 Ca 0.11 -0.31 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 2i03 h SER 716 Cb 0.35 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 2i03 h SER 716 CO -0.28 1.02 0.13 0.00 -1.14 0.00 0.00 176.83 176.56 2i03 h ALA 717 N 0.98 1.88 0.00 3.77 0.00 -0.67 0.09 119.26 125.30 2i03 h ALA 717 Ca -0.01 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.67 2i03 h ALA 717 Cb 1.17 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 2i03 h ALA 717 CO 0.11 0.11 -1.12 1.96 0.00 0.00 0.00 179.25 180.32 2i03 h GLN 718 N 0.25 0.00 -0.10 0.00 1.08 -1.00 -2.84 115.11 112.50 2i03 h GLN 718 Ca 0.07 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 2i03 h GLN 718 Cb -0.01 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.41 2i03 h GLN 718 CO -0.02 0.92 0.01 0.82 -0.95 0.00 0.00 178.83 179.62 2i03 h ILE 719 N 0.00 1.23 -0.57 2.54 2.04 -0.62 -2.20 117.51 119.93 2i03 h ILE 719 Ca -0.06 -0.72 -0.03 0.00 1.00 0.00 0.00 64.86 65.05 2i03 h ILE 719 Cb 1.81 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 39.38 2i03 h ILE 719 CO 0.12 0.21 0.22 0.77 0.00 0.00 0.00 178.15 179.47 2i03 h SER 720 N -0.08 0.76 -0.42 1.72 4.64 -1.14 -2.10 113.55 116.93 2i03 h SER 720 Ca 0.03 -0.10 -0.05 0.00 -0.47 0.00 0.00 61.79 61.20 2i03 h SER 720 Cb 0.31 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.19 2i03 h SER 720 CO 0.00 0.69 0.06 0.50 -0.87 0.00 0.00 176.83 177.22 2i03 h LYS 721 N 0.82 0.70 -0.65 4.77 3.64 -1.39 0.25 116.57 124.72 2i03 h LYS 721 Ca 0.19 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 2i03 h LYS 721 Cb 0.18 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 2i03 h LYS 721 CO -0.02 0.74 0.33 0.00 -2.27 0.00 0.00 179.45 178.24 2i03 h ALA 722 N 0.93 1.35 -0.38 5.00 0.00 -1.10 -0.47 119.26 124.59 2i03 h ALA 722 Ca 0.13 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 2i03 h ALA 722 Cb 0.38 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2i03 h ALA 722 CO 0.01 0.52 -0.19 -0.07 0.00 0.00 0.00 179.25 179.52 2i03 h LEU 723 N 0.92 0.82 -0.43 0.00 3.38 -0.98 -2.58 115.31 116.43 2i03 h LEU 723 Ca 0.23 -0.41 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 2i03 h LEU 723 Cb 0.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2i03 h LEU 723 CO -0.03 1.05 0.11 0.58 0.09 0.00 0.00 178.44 180.24 2i03 h VAL 724 N 0.60 1.23 0.00 1.22 2.07 -0.55 -0.92 116.25 119.90 2i03 h VAL 724 Ca 0.08 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 2i03 h VAL 724 Cb 0.74 0.92 -0.00 0.00 -1.52 0.00 0.00 31.29 31.42 2i03 h VAL 724 CO 0.06 0.28 -0.04 0.44 0.02 0.00 0.00 177.57 178.32 2i03 h ASP 725 N 0.57 0.00 0.17 0.57 3.32 -1.00 -1.49 116.42 118.56 2i03 h ASP 725 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 2i03 h ASP 725 Cb 0.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2i03 h ASP 725 CO 0.00 0.04 -0.67 0.52 -1.72 0.00 0.00 179.24 177.41 2i03 n VAL 726 N -4.03 0.00 -2.19 -1.35 0.31 -0.98 -4.99 118.33 105.11 2i03 n VAL 726 Ca -0.03 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 2i03 n VAL 726 Cb 0.13 0.75 0.00 0.00 -0.91 0.00 0.00 33.84 33.80 2i03 n VAL 726 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2i03 n GLY 727 N 1.47 0.80 3.44 2.92 0.00 -0.56 -4.99 105.19 108.26 2i03 n GLY 727 Ca 0.06 -0.70 -0.36 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.62 4.13 0.06 1.61 1.01 -0.44 -5.04 120.40 119.11 2i03 s VAL 728 Ca 0.00 -0.24 -0.29 0.00 0.00 0.00 0.00 61.98 61.45 2i03 s VAL 728 Cb 0.00 -2.91 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 2i03 s VAL 728 CO 0.00 0.38 0.93 -0.62 0.00 0.00 0.00 175.10 175.79 2i03 s ASP 729 N 1.36 7.40 0.30 3.32 2.15 -1.26 -4.53 116.67 125.41 2i03 s ASP 729 Ca 0.05 1.68 -0.07 0.00 0.43 0.00 0.00 52.55 54.64 2i03 s ASP 729 Cb -0.15 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.92 2i03 s ASP 729 CO 0.02 -0.11 0.47 0.72 -0.17 0.00 0.00 175.17 176.10 2i03 s PHE 730 N 0.33 0.78 0.13 -5.34 -0.71 -1.26 -4.75 117.98 107.15 2i03 s PHE 730 Ca 0.47 -1.08 0.05 0.00 -1.04 0.00 0.00 56.93 55.33 2i03 s PHE 730 Cb -0.22 0.03 -0.04 0.00 -1.21 0.00 0.00 43.02 41.58 2i03 s PHE 730 CO 0.28 -1.08 0.08 -0.65 -1.34 0.00 0.00 175.22 172.51 2i03 s GLN 731 N -3.41 2.79 0.20 1.99 -1.52 0.73 -5.03 119.66 115.40 2i03 s GLN 731 Ca 0.28 -0.84 -0.06 0.00 -1.95 0.00 0.00 55.36 52.78 2i03 s GLN 731 Cb -0.00 -2.62 -0.02 0.00 -0.22 0.00 0.00 33.01 30.14 2i03 s GLN 731 CO 0.15 0.51 0.26 0.00 -0.25 0.00 0.00 175.29 175.97 2i03 s ALA 732 N -1.58 0.42 -0.30 6.09 0.00 -1.26 -0.78 121.76 124.35 2i03 s ALA 732 Ca 0.29 -1.22 -0.15 0.00 0.00 0.00 0.00 51.96 50.88 2i03 s ALA 732 Cb -0.11 1.10 0.16 0.00 0.00 0.00 0.00 23.12 24.27 2i03 s ALA 732 CO 0.22 -0.67 0.97 1.41 0.00 0.00 0.00 175.76 177.69 2i03 s MET 733 N -4.06 0.32 0.21 0.00 0.00 -0.61 -4.90 119.30 110.26 2i03 s MET 733 Ca 0.27 0.75 0.06 0.00 0.00 0.00 0.00 55.69 56.77 2i03 s MET 733 Cb 0.04 0.40 -0.04 0.00 0.00 0.00 0.00 34.83 35.23 2i03 s MET 733 CO 0.07 -0.10 0.21 1.67 0.00 0.00 0.00 175.02 176.86 2i03 s TRP 734 N 2.28 3.20 -0.27 4.11 -2.14 -1.26 -2.11 118.94 122.75 2i03 s TRP 734 Ca -0.04 -0.05 0.00 0.00 2.66 0.00 0.00 56.10 58.68 2i03 s TRP 734 Cb -0.06 -1.48 0.08 0.00 -3.10 0.00 0.00 33.47 28.91 2i03 s TRP 734 CO -0.17 0.51 0.03 0.71 -2.66 0.00 0.00 176.95 175.37 2i03 s TYR 735 N -1.96 2.15 0.23 1.66 2.02 -0.70 -4.93 117.35 115.83 2i03 s TYR 735 Ca 0.33 -1.80 -0.31 0.00 -0.37 0.00 0.00 57.07 54.92 2i03 s TYR 735 Cb -0.09 -1.74 -0.11 0.00 -0.40 0.00 0.00 41.96 39.62 2i03 s TYR 735 CO 0.25 -0.81 1.56 0.95 -1.57 0.00 0.00 175.55 175.93 2i03 s THR 736 N 1.47 2.39 -0.60 -0.71 -4.23 -1.26 -1.85 115.64 110.84 2i03 s THR 736 Ca 0.03 0.30 0.00 0.00 -1.18 0.00 0.00 61.69 60.84 2i03 s THR 736 Cb -0.18 -3.19 0.00 0.00 1.34 0.00 0.00 72.50 70.47 2i03 s THR 736 CO -0.13 0.04 0.00 0.47 -0.54 0.00 0.00 174.62 174.45 2i03 n ASP 737 N 3.01 -5.42 -4.76 3.99 8.00 -1.26 -4.91 116.55 115.20 2i03 n ASP 737 Ca 0.11 0.14 -0.37 0.00 0.71 0.00 0.00 54.79 55.38 2i03 n ASP 737 Cb 0.38 -3.42 -0.07 0.00 -0.02 0.00 0.00 41.12 37.99 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 -2.28 4.14 0.00 -1.24 0.41 -1.08 -4.71 118.70 113.94 2i03 s GLU 738 Ca 0.00 0.19 0.00 0.00 -0.41 0.00 0.00 54.97 54.75 2i03 s GLU 738 Cb 0.00 -3.37 0.00 0.00 -1.78 0.00 0.00 34.13 28.98 2i03 s GLU 738 CO 0.00 0.36 0.00 -0.40 -0.49 0.00 0.00 175.26 174.73 2i03 n ASP 739 N 3.12 0.00 0.02 -0.19 5.68 -1.26 -1.95 116.55 121.97 2i03 n ASP 739 Ca -0.12 0.00 0.04 0.00 -0.50 0.00 0.00 54.79 54.20 2i03 n ASP 739 Cb 0.52 0.00 0.42 0.00 -1.14 0.00 0.00 41.12 40.92 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 0.49 0.00 2.11 -0.00 -1.90 -2.90 115.15 112.94 2i03 h HIS 740 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 60.37 60.24 2i03 h HIS 740 Cb 0.00 -0.16 -0.02 0.00 -0.00 0.00 0.00 27.41 27.23 2i03 h HIS 740 CO 0.00 0.34 -0.62 0.78 -0.00 0.00 0.00 177.93 178.43 2i03 h GLY 741 N 0.57 0.00 -6.62 5.26 0.00 -1.98 -3.47 103.07 96.83 2i03 h GLY 741 Ca 0.13 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.94 2i03 h GLY 741 CO -0.02 0.00 -0.89 1.39 0.00 0.00 0.00 176.54 177.02 2i03 n ILE 742 N -3.26 -2.39 -0.40 2.60 5.41 -1.10 -4.84 119.36 115.37 2i03 n ILE 742 Ca 0.01 -0.40 0.10 0.00 1.00 0.00 0.00 62.75 63.46 2i03 n ILE 742 Cb 0.78 -2.25 0.28 0.00 -0.71 0.00 0.00 39.64 37.74 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 2.50 -1.37 -1.39 0.00 -1.26 -3.66 120.51 110.90 2i03 n ALA 743 Ca -0.24 -1.37 -0.33 0.00 0.00 0.00 0.00 53.44 51.51 2i03 n ALA 743 Cb 0.65 -0.80 0.07 0.00 0.00 0.00 0.00 19.45 19.37 2i03 n ALA 743 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2i03 s SER 744 N -1.02 4.65 0.13 0.00 1.04 -1.26 -4.76 113.70 112.48 2i03 s SER 744 Ca 0.43 2.04 -0.27 0.00 0.48 0.00 0.00 55.95 58.62 2i03 s SER 744 Cb 0.24 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.77 2i03 s SER 744 CO 0.26 -1.94 1.61 -1.28 0.98 0.00 0.00 173.24 172.86 2i03 h SER 745 N -0.42 -1.05 -0.39 7.02 0.87 -2.00 -0.44 113.55 117.14 2i03 h SER 745 Ca -0.46 0.14 -0.10 0.00 -1.23 0.00 0.00 61.79 60.14 2i03 h SER 745 Cb 1.25 0.43 -0.02 0.00 -0.44 0.00 0.00 62.40 63.63 2i03 h SER 745 CO 0.52 -0.39 -0.12 0.71 -0.53 0.00 0.00 176.83 177.02 2i03 h THR 746 N -0.45 1.26 -0.31 2.23 1.35 -1.98 -2.75 112.91 112.26 2i03 h THR 746 Ca 0.08 -1.21 -0.14 0.00 -0.55 0.00 0.00 66.41 64.59 2i03 h THR 746 Cb 0.57 1.03 -0.01 0.00 -1.73 0.00 0.00 68.15 68.02 2i03 h THR 746 CO -0.33 0.42 -0.39 0.00 -0.25 0.00 0.00 175.52 174.97 2i03 h ALA 747 N 1.11 0.74 0.46 6.62 0.00 -1.82 -1.74 119.26 124.62 2i03 h ALA 747 Ca 0.12 -0.44 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 2i03 h ALA 747 Cb 0.62 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2i03 h ALA 747 CO 0.04 0.66 -0.22 1.25 0.00 0.00 0.00 179.25 180.98 2i03 h HIS 748 N 0.60 -0.58 -0.56 0.00 2.76 -1.04 -0.77 115.15 115.57 2i03 h HIS 748 Ca 0.05 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.20 2i03 h HIS 748 Cb 0.93 0.19 -0.03 0.00 1.55 0.00 0.00 27.41 30.05 2i03 h HIS 748 CO 0.05 -0.35 0.30 1.96 -1.30 0.00 0.00 177.93 178.59 2i03 h GLN 749 N -0.64 0.76 -0.26 5.26 4.20 -1.48 -2.73 115.11 120.21 2i03 h GLN 749 Ca -0.06 -0.08 -0.16 0.00 0.06 0.00 0.00 58.65 58.41 2i03 h GLN 749 Cb 0.49 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.11 2i03 h GLN 749 CO 0.10 0.56 -0.47 1.25 -0.67 0.00 0.00 178.83 179.61 2i03 h HIS 750 N 0.77 0.98 -0.20 2.96 2.76 -1.08 -2.37 115.15 118.97 2i03 h HIS 750 Ca 0.20 -0.34 -0.20 0.00 -2.20 0.00 0.00 60.37 57.82 2i03 h HIS 750 Cb 0.02 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 28.80 2i03 h HIS 750 CO 0.00 1.14 -0.67 0.97 -1.30 0.00 0.00 177.93 178.08 2i03 h ILE 751 N 0.53 1.29 0.00 6.26 2.10 -1.04 -1.15 117.51 125.49 2i03 h ILE 751 Ca 0.02 -1.88 -0.10 0.00 1.08 0.00 0.00 64.86 63.98 2i03 h ILE 751 Cb 1.07 1.84 -0.01 0.00 -1.09 0.00 0.00 36.82 38.62 2i03 h ILE 751 CO 0.11 0.60 -0.49 1.88 -1.08 0.00 0.00 178.15 179.17 2i03 h TYR 752 N 0.57 0.00 -0.13 2.19 0.05 -1.57 -0.06 116.97 118.01 2i03 h TYR 752 Ca -0.02 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.67 2i03 h TYR 752 Cb 1.28 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.02 2i03 h TYR 752 CO 0.07 0.49 -0.27 1.15 -1.05 0.00 0.00 178.16 178.55 2i03 h THR 753 N 0.00 1.37 -0.83 -2.88 2.02 -1.30 -1.45 112.91 109.84 2i03 h THR 753 Ca -0.00 -1.54 -0.01 0.00 0.77 0.00 0.00 66.41 65.63 2i03 h THR 753 Cb 0.87 2.03 -0.04 0.00 -1.74 0.00 0.00 68.15 69.27 2i03 h THR 753 CO 0.06 0.46 0.50 -0.74 0.37 0.00 0.00 175.52 176.17 2i03 h HIS 754 N 0.02 1.10 0.00 3.16 -0.00 -0.98 -2.15 115.15 116.29 2i03 h HIS 754 Ca 0.00 -0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 60.27 2i03 h HIS 754 Cb 0.87 -0.36 -0.01 0.00 -0.00 0.00 0.00 27.41 27.90 2i03 h HIS 754 CO 0.10 0.73 -0.48 0.52 -0.00 0.00 0.00 177.93 178.80 2i03 h MET 755 N 1.14 0.00 -0.20 5.26 2.07 -0.97 -2.53 114.93 119.69 2i03 h MET 755 Ca 0.30 0.00 -0.04 0.00 -2.07 0.00 0.00 59.70 57.89 2i03 h MET 755 Cb -0.04 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 29.68 2i03 h MET 755 CO -0.06 0.48 -0.02 0.77 1.07 0.00 0.00 176.91 179.16 2i03 h SER 756 N 0.00 0.37 -0.94 1.22 0.02 -0.66 -2.02 113.55 111.55 2i03 h SER 756 Ca -0.00 -0.33 0.02 0.00 -0.84 0.00 0.00 61.79 60.64 2i03 h SER 756 Cb 0.88 -0.10 -0.05 0.00 0.14 0.00 0.00 62.40 63.27 2i03 h SER 756 CO 0.06 0.61 0.62 0.45 -1.14 0.00 0.00 176.83 177.43 2i03 h HIS 757 N 0.12 1.16 -0.30 3.45 3.86 -1.26 0.49 115.15 122.67 2i03 h HIS 757 Ca 0.06 0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.26 2i03 h HIS 757 Cb 0.43 -0.39 -0.01 0.00 1.06 0.00 0.00 27.41 28.50 2i03 h HIS 757 CO 0.04 0.70 0.05 0.35 0.86 0.00 0.00 177.93 179.92 2i03 h PHE 758 N 1.22 0.53 -0.15 2.45 3.57 -1.32 -1.33 116.94 121.91 2i03 h PHE 758 Ca 0.36 -0.07 -0.04 0.00 3.53 0.00 0.00 57.97 61.74 2i03 h PHE 758 Cb -0.06 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 38.53 2i03 h PHE 758 CO -0.00 0.59 -0.08 0.82 -2.23 0.00 0.00 178.31 177.41 2i03 h ILE 759 N 0.32 1.32 -0.57 1.41 1.08 -1.02 -0.54 117.51 119.49 2i03 h ILE 759 Ca 0.09 -1.13 0.06 0.00 -0.39 0.00 0.00 64.86 63.49 2i03 h ILE 759 Cb 0.35 1.76 -0.05 0.00 -3.07 0.00 0.00 36.82 35.80 2i03 h ILE 759 CO 0.01 0.33 0.28 0.11 -0.69 0.00 0.00 178.15 178.19 2i03 h LYS 760 N -0.03 0.51 0.00 2.37 1.79 -0.92 0.34 116.57 120.64 2i03 h LYS 760 Ca 0.03 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2i03 h LYS 760 Cb 0.55 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 2i03 h LYS 760 CO 0.02 0.34 -0.00 0.37 -1.08 0.00 0.00 179.45 179.10 2i03 h GLN 761 N 0.53 -0.00 -0.84 3.15 -0.00 -1.17 0.34 115.11 117.11 2i03 h GLN 761 Ca 0.26 0.00 0.08 0.00 -0.00 0.00 0.00 58.65 58.99 2i03 h GLN 761 Cb 0.21 0.00 -0.07 0.00 0.00 0.00 0.00 27.48 27.62 2i03 h GLN 761 CO -0.20 0.12 0.50 0.00 0.00 0.00 0.00 178.83 179.25 2i03 n PHE 763 N -4.67 0.00 0.00 0.00 3.72 0.07 -5.04 117.46 111.53 2i03 n PHE 763 Ca 0.13 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.53 2i03 n PHE 763 Cb 0.22 -0.42 0.00 0.00 -0.94 0.00 0.00 39.48 38.34 2i03 n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14