#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nu8 s ARG 40 N 0.00 0.73 0.69 -1.46 3.00 -1.26 -5.04 118.95 115.61 1nu8 s ARG 40 Ca 0.00 0.54 -0.16 0.00 0.00 0.00 0.00 55.73 56.11 1nu8 s ARG 40 Cb 0.00 -1.77 0.02 0.00 0.00 0.00 0.00 34.95 33.19 1nu8 s ARG 40 CO 0.00 -2.53 1.18 -1.59 0.00 0.00 0.00 175.30 172.36 1nu8 s LYS 41 N -5.01 2.46 0.51 3.54 -2.85 -1.23 -4.79 119.74 112.38 1nu8 s LYS 41 Ca 0.65 1.67 -0.01 0.00 -1.00 0.00 0.00 55.97 57.28 1nu8 s LYS 41 Cb -0.18 -1.88 0.01 0.00 -2.06 0.00 0.00 37.83 33.72 1nu8 s LYS 41 CO 0.57 -1.57 0.76 0.99 0.10 0.00 0.00 175.35 176.20 1nu8 s THR 42 N -2.01 3.55 -0.17 3.79 2.01 -1.26 -0.76 115.64 120.79 1nu8 s THR 42 Ca 0.73 -0.42 -0.28 0.00 0.31 0.00 0.00 61.69 62.03 1nu8 s THR 42 Cb -0.27 -3.34 -0.01 0.00 0.01 0.00 0.00 72.50 68.89 1nu8 s THR 42 CO 0.42 -0.27 0.96 -0.47 -0.69 0.00 0.00 174.62 174.57 1nu8 s TYR 43 N -2.72 3.42 0.41 4.92 5.04 -1.26 -4.75 117.35 122.41 1nu8 s TYR 43 Ca 0.52 1.44 0.07 0.00 -2.44 0.00 0.00 57.07 56.66 1nu8 s TYR 43 Cb -0.10 -3.16 -0.05 0.00 0.35 0.00 0.00 41.96 39.00 1nu8 s TYR 43 CO 0.40 -0.32 0.18 0.95 -1.34 0.00 0.00 175.55 175.42 1nu8 s THR 44 N 2.47 2.38 0.17 4.34 -4.23 -1.26 -3.97 115.64 115.55 1nu8 s THR 44 Ca 0.44 -1.69 -0.14 0.00 -1.18 0.00 0.00 61.69 59.12 1nu8 s THR 44 Cb -0.17 -2.99 0.07 0.00 1.34 0.00 0.00 72.50 70.75 1nu8 s THR 44 CO 0.12 -0.02 1.75 0.25 -0.54 0.00 0.00 174.62 176.18 1nu8 h LEU 45 N 1.42 0.16 -0.06 4.79 5.85 -1.96 -1.54 115.31 123.97 1nu8 h LEU 45 Ca -0.43 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.38 1nu8 h LEU 45 Cb 1.25 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 42.26 1nu8 h LEU 45 CO 0.69 0.13 -0.38 0.74 -0.34 0.00 0.00 178.44 179.27 1nu8 h THR 46 N 0.33 0.21 -0.95 1.05 2.02 -1.97 0.23 112.91 113.82 1nu8 h THR 46 Ca 0.21 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.60 1nu8 h THR 46 Cb 0.21 0.21 -0.12 0.00 -1.74 0.00 0.00 68.15 66.71 1nu8 h THR 46 CO -0.22 0.00 0.52 0.44 0.37 0.00 0.00 175.52 176.64 1nu8 h ASP 47 N -0.50 0.60 0.75 4.18 3.32 -1.74 1.44 116.42 124.47 1nu8 h ASP 47 Ca 0.07 0.12 -0.04 0.00 0.02 0.00 0.00 57.03 57.20 1nu8 h ASP 47 Cb 0.61 0.03 0.01 0.00 0.22 0.00 0.00 39.33 40.20 1nu8 h ASP 47 CO -0.34 0.14 -0.36 0.22 -1.72 0.00 0.00 179.24 177.19 1nu8 h TYR 48 N 0.59 -0.93 -0.98 4.55 3.20 -0.13 -2.13 116.97 121.15 1nu8 h TYR 48 Ca 0.58 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.44 1nu8 h TYR 48 Cb 1.01 0.31 -0.05 0.00 1.54 0.00 0.00 36.73 39.54 1nu8 h TYR 48 CO -0.05 -0.58 0.65 -0.07 -1.64 0.00 0.00 178.16 176.47 1nu8 h LEU 49 N -1.26 1.12 -1.40 2.82 4.07 0.36 -2.67 115.31 118.36 1nu8 h LEU 49 Ca -0.10 -0.03 0.00 0.00 0.08 0.00 0.00 57.88 57.83 1nu8 h LEU 49 Cb 0.77 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 42.23 1nu8 h LEU 49 CO 0.17 0.81 0.00 0.29 -1.08 0.00 0.00 178.44 178.63 1nu8 n LYS 50 N -4.39 1.90 -4.05 1.13 5.02 0.48 -4.94 118.16 113.31 1nu8 n LYS 50 Ca 0.12 -1.38 -0.28 0.00 -2.02 0.00 0.00 58.31 54.75 1nu8 n LYS 50 Cb 0.02 -1.36 -0.04 0.00 -0.02 0.00 0.00 35.03 33.63 1nu8 n LYS 50 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1nu8 n ASN 51 N 0.60 -0.44 0.33 4.39 4.05 -0.91 -4.90 115.26 118.40 1nu8 n ASN 51 Ca 0.15 -1.10 -0.15 0.00 0.45 0.00 0.00 54.58 53.93 1nu8 n ASN 51 Cb 0.35 -2.58 -0.08 0.00 1.23 0.00 0.00 39.78 38.71 1nu8 n ASN 51 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 177.26 174.95 1nu8 h THR 52 N -1.87 0.17 -3.21 -0.44 2.02 -1.68 -3.39 112.91 104.52 1nu8 h THR 52 Ca -0.65 -0.31 -0.63 0.00 0.77 0.00 0.00 66.41 65.59 1nu8 h THR 52 Cb 1.38 0.22 -0.14 0.00 -1.74 0.00 0.00 68.15 67.88 1nu8 h THR 52 CO 0.63 0.02 0.42 -0.31 0.37 0.00 0.00 175.52 176.65 1nu8 s TYR 53 N -4.87 2.86 -0.19 3.16 2.02 -1.26 -5.01 117.35 114.06 1nu8 s TYR 53 Ca -0.15 -0.17 -0.09 0.00 -0.37 0.00 0.00 57.07 56.29 1nu8 s TYR 53 Cb 0.02 -3.92 -0.05 0.00 -0.40 0.00 0.00 41.96 37.61 1nu8 s TYR 53 CO 0.47 -1.26 0.10 1.03 -1.57 0.00 0.00 175.55 174.32 1nu8 s ARG 54 N 3.57 4.07 0.13 -0.62 0.52 -1.26 -5.05 118.95 120.31 1nu8 s ARG 54 Ca 0.26 -0.28 -0.30 0.00 -0.52 0.00 0.00 55.73 54.89 1nu8 s ARG 54 Cb -0.15 -3.31 -0.07 0.00 0.52 0.00 0.00 34.95 31.94 1nu8 s ARG 54 CO 0.17 0.30 1.22 -0.51 0.02 0.00 0.00 175.30 176.51 1nu8 s LEU 55 N 0.32 4.41 -0.06 2.53 1.43 -1.26 -4.77 118.68 121.28 1nu8 s LEU 55 Ca 0.06 2.17 -0.13 0.00 -1.03 0.00 0.00 54.13 55.19 1nu8 s LEU 55 Cb -0.12 -3.59 -0.05 0.00 0.03 0.00 0.00 46.19 42.46 1nu8 s LEU 55 CO -0.01 -0.44 0.34 -0.54 0.23 0.00 0.00 176.35 175.93 1nu8 s LYS 56 N 0.40 3.94 0.45 1.70 1.02 -1.26 -5.09 119.74 120.90 1nu8 s LYS 56 Ca 0.56 0.25 0.07 0.00 0.02 0.00 0.00 55.97 56.88 1nu8 s LYS 56 Cb -0.32 -3.28 -0.02 0.00 -0.52 0.00 0.00 37.83 33.69 1nu8 s LYS 56 CO 0.33 0.57 0.28 -0.51 -0.92 0.00 0.00 175.35 175.10 1nu8 s LEU 57 N -0.61 3.08 -0.43 3.17 1.43 -1.26 -4.85 118.68 119.21 1nu8 s LEU 57 Ca 0.21 -1.04 0.05 0.00 -1.03 0.00 0.00 54.13 52.32 1nu8 s LEU 57 Cb -0.15 -1.54 0.17 0.00 0.03 0.00 0.00 46.19 44.70 1nu8 s LEU 57 CO 0.09 -0.71 0.44 -0.47 0.23 0.00 0.00 176.35 175.93 1nu8 s TYR 58 N -2.61 0.17 -0.44 0.29 6.14 -1.26 -4.94 117.35 114.70 1nu8 s TYR 58 Ca 0.40 -1.63 -0.25 0.00 0.64 0.00 0.00 57.07 56.23 1nu8 s TYR 58 Cb 0.00 -0.52 0.02 0.00 0.42 0.00 0.00 41.96 41.89 1nu8 s TYR 58 CO 0.23 -0.97 0.92 -1.12 0.64 0.00 0.00 175.55 175.26 1nu8 s SER 59 N 0.50 6.53 0.16 4.32 0.01 -1.26 -5.04 113.70 118.93 1nu8 s SER 59 Ca 0.29 0.21 0.10 0.00 1.31 0.00 0.00 55.95 57.86 1nu8 s SER 59 Cb -0.01 -2.45 -0.04 0.00 0.21 0.00 0.00 66.02 63.73 1nu8 s SER 59 CO -0.13 -1.00 -0.17 -1.48 0.41 0.00 0.00 173.24 170.87 1nu8 s LEU 60 N 3.68 2.70 -0.29 2.44 2.34 -1.26 -4.66 118.68 123.63 1nu8 s LEU 60 Ca 0.37 -0.65 0.03 0.00 0.06 0.00 0.00 54.13 53.93 1nu8 s LEU 60 Cb -0.11 -1.47 0.08 0.00 -0.56 0.00 0.00 46.19 44.13 1nu8 s LEU 60 CO 0.25 0.14 -0.03 -0.13 -1.06 0.00 0.00 176.35 175.52 1nu8 s ARG 61 N -2.49 1.73 0.20 1.48 0.52 -0.79 -4.95 118.95 114.66 1nu8 s ARG 61 Ca 0.21 -1.43 -0.32 0.00 -0.52 0.00 0.00 55.73 53.66 1nu8 s ARG 61 Cb -0.09 -2.87 -0.15 0.00 0.52 0.00 0.00 34.95 32.37 1nu8 s ARG 61 CO 0.11 -0.73 1.31 0.91 0.02 0.00 0.00 175.30 176.92 1nu8 n TRP 62 N 4.45 1.78 -0.13 -0.53 7.02 -1.26 -0.43 117.44 128.33 1nu8 n TRP 62 Ca -0.06 0.53 0.00 0.00 -1.02 0.00 0.00 57.50 56.95 1nu8 n TRP 62 Cb 0.42 -2.38 0.00 0.00 -2.42 0.00 0.00 31.31 26.93 1nu8 n TRP 62 CO 0.00 0.00 0.00 1.51 -2.02 0.00 0.00 177.69 177.18 1nu8 n ILE 63 N 1.85 0.04 -3.87 -0.99 0.13 0.40 -4.88 119.36 112.05 1nu8 n ILE 63 Ca 0.14 -0.45 0.00 0.00 -1.10 0.00 0.00 62.75 61.34 1nu8 n ILE 63 Cb 0.28 1.11 0.00 0.00 -0.84 0.00 0.00 39.64 40.19 1nu8 n ILE 63 CO 0.00 0.00 0.00 -1.54 2.80 0.00 0.00 176.55 177.81 1nu8 n SER 64 N -0.02 -0.09 0.09 9.51 3.41 -1.22 -4.95 113.62 120.36 1nu8 n SER 64 Ca 0.00 -1.02 0.12 0.00 -0.26 0.00 0.00 58.87 57.72 1nu8 n SER 64 Cb 0.04 0.13 0.45 0.00 -0.26 0.00 0.00 64.21 64.58 1nu8 n SER 64 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1nu8 n ASP 65 N -0.21 0.59 0.00 4.04 5.75 -1.26 -3.01 116.55 122.45 1nu8 n ASP 65 Ca 0.00 0.59 0.00 0.00 -0.01 0.00 0.00 54.79 55.37 1nu8 n ASP 65 Cb 0.04 -0.73 0.00 0.00 -1.03 0.00 0.00 41.12 39.40 1nu8 n ASP 65 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1nu8 n HIS 66 N -2.09 0.00 -4.31 2.11 1.44 -1.26 -4.24 115.22 106.87 1nu8 n HIS 66 Ca 0.04 0.00 -0.24 0.00 -2.01 0.00 0.00 57.72 55.51 1nu8 n HIS 66 Cb 0.33 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.32 1nu8 n HIS 66 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1nu8 s GLU 67 N -0.06 1.14 0.03 -1.40 2.02 -1.26 -0.95 118.70 118.22 1nu8 s GLU 67 Ca 0.00 -1.14 -0.00 0.00 0.02 0.00 0.00 54.97 53.84 1nu8 s GLU 67 Cb 0.00 -1.40 -0.03 0.00 0.10 0.00 0.00 34.13 32.80 1nu8 s GLU 67 CO 0.00 0.33 -0.03 1.52 0.02 0.00 0.00 175.26 177.10 1nu8 s TYR 68 N -1.13 0.36 0.18 1.61 -0.85 -0.28 -0.45 117.35 116.78 1nu8 s TYR 68 Ca 0.06 -0.71 -0.16 0.00 -0.52 0.00 0.00 57.07 55.74 1nu8 s TYR 68 Cb -0.10 -0.26 -0.07 0.00 0.38 0.00 0.00 41.96 41.90 1nu8 s TYR 68 CO 0.04 -0.25 0.62 -0.51 -1.52 0.00 0.00 175.55 173.93 1nu8 s LEU 69 N -1.96 4.34 -0.26 -3.49 1.43 0.43 0.89 118.68 120.05 1nu8 s LEU 69 Ca -0.08 1.21 -0.13 0.00 -1.03 0.00 0.00 54.13 54.10 1nu8 s LEU 69 Cb -0.04 -3.40 0.09 0.00 0.03 0.00 0.00 46.19 42.87 1nu8 s LEU 69 CO -0.04 0.07 0.62 -0.47 0.23 0.00 0.00 176.35 176.76 1nu8 s TYR 70 N -1.49 -1.03 -0.28 0.29 5.04 0.82 -1.88 117.35 118.83 1nu8 s TYR 70 Ca 0.40 1.99 -0.16 0.00 -2.44 0.00 0.00 57.07 56.86 1nu8 s TYR 70 Cb -0.16 0.59 -0.03 0.00 0.35 0.00 0.00 41.96 42.71 1nu8 s TYR 70 CO 0.20 -0.52 0.43 -1.59 -1.34 0.00 0.00 175.55 172.72 1nu8 s LYS 71 N 1.90 3.96 -0.08 4.97 -2.85 -1.26 0.64 119.74 127.04 1nu8 s LYS 71 Ca -0.09 0.07 0.01 0.00 -1.00 0.00 0.00 55.97 54.97 1nu8 s LYS 71 Cb -0.07 -3.68 0.02 0.00 -2.06 0.00 0.00 37.83 32.03 1nu8 s LYS 71 CO -0.18 -0.35 -0.10 -1.14 0.10 0.00 0.00 175.35 173.68 1nu8 s GLN 72 N 2.17 1.53 -1.02 1.78 0.74 -0.28 -4.75 119.66 119.84 1nu8 s GLN 72 Ca 0.17 -0.32 -0.04 0.00 0.05 0.00 0.00 55.36 55.21 1nu8 s GLN 72 Cb -0.16 -1.38 0.04 0.00 1.10 0.00 0.00 33.01 32.61 1nu8 s GLN 72 CO 0.10 -0.07 0.22 0.39 -0.55 0.00 0.00 175.29 175.38 1nu8 n GLU 73 N 4.17 -2.81 -0.97 1.67 1.02 -1.26 -1.01 120.64 121.44 1nu8 n GLU 73 Ca -0.20 0.45 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 1nu8 n GLU 73 Cb 0.51 -5.08 0.00 0.00 -0.02 0.00 0.00 31.44 26.85 1nu8 n GLU 73 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1nu8 n ASN 74 N -1.98 -3.54 -4.84 1.62 4.13 -1.26 -4.88 115.26 104.51 1nu8 n ASN 74 Ca -0.06 0.00 -0.37 0.00 1.68 0.00 0.00 54.58 55.83 1nu8 n ASN 74 Cb 0.56 -1.51 -0.06 0.00 -1.54 0.00 0.00 39.78 37.23 1nu8 n ASN 74 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 1nu8 s ASN 75 N -2.09 6.78 -0.23 6.41 0.01 -0.18 -3.94 114.94 121.71 1nu8 s ASN 75 Ca 0.00 0.95 -0.24 0.00 -0.71 0.00 0.00 52.86 52.86 1nu8 s ASN 75 Cb 0.00 -2.24 -0.01 0.00 0.41 0.00 0.00 41.25 39.41 1nu8 s ASN 75 CO 0.00 0.26 0.81 -0.63 -1.51 0.00 0.00 177.10 176.02 1nu8 s ILE 76 N -1.21 4.86 0.09 0.60 1.01 0.27 -1.12 121.20 125.70 1nu8 s ILE 76 Ca 0.28 1.53 0.07 0.00 0.00 0.00 0.00 60.65 62.54 1nu8 s ILE 76 Cb -0.16 -4.10 -0.04 0.00 0.01 0.00 0.00 42.46 38.17 1nu8 s ILE 76 CO 0.16 -0.04 -0.13 -0.76 0.00 0.00 0.00 174.94 174.16 1nu8 s LEU 77 N 2.68 2.89 -0.19 2.97 1.43 0.21 0.96 118.68 129.63 1nu8 s LEU 77 Ca 0.34 -0.43 -0.07 0.00 -1.03 0.00 0.00 54.13 52.94 1nu8 s LEU 77 Cb -0.15 -1.70 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 1nu8 s LEU 77 CO 0.08 0.19 0.06 -0.69 0.23 0.00 0.00 176.35 176.23 1nu8 s VAL 78 N -1.15 4.77 0.01 -1.59 1.01 -0.86 -0.12 120.40 122.47 1nu8 s VAL 78 Ca 0.19 -0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.15 1nu8 s VAL 78 Cb -0.11 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 1nu8 s VAL 78 CO 0.11 0.45 0.00 -0.36 0.00 0.00 0.00 175.10 175.31 1nu8 s PHE 79 N 0.46 3.07 -0.23 5.22 0.40 0.26 -2.00 117.98 125.16 1nu8 s PHE 79 Ca 0.03 0.07 -0.24 0.00 -0.60 0.00 0.00 56.93 56.19 1nu8 s PHE 79 Cb -0.13 -1.65 -0.01 0.00 0.51 0.00 0.00 43.02 41.74 1nu8 s PHE 79 CO 0.01 0.47 0.78 1.21 0.70 0.00 0.00 175.22 178.38 1nu8 s ASN 80 N -1.67 6.80 0.16 1.36 3.84 -0.29 -1.12 114.94 124.03 1nu8 s ASN 80 Ca 0.21 0.99 -0.12 0.00 0.21 0.00 0.00 52.86 54.15 1nu8 s ASN 80 Cb -0.12 -2.42 0.06 0.00 -0.55 0.00 0.00 41.25 38.22 1nu8 s ASN 80 CO 0.12 -0.45 1.69 0.00 -2.79 0.00 0.00 177.10 175.66 1nu8 h ALA 81 N 7.63 0.74 0.65 1.71 0.00 -1.38 -1.53 119.26 127.08 1nu8 h ALA 81 Ca -0.25 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 1nu8 h ALA 81 Cb 1.11 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.69 1nu8 h ALA 81 CO 0.84 0.40 -0.31 1.49 0.00 0.00 0.00 179.25 181.68 1nu8 h GLU 82 N 0.79 -0.84 0.00 0.00 4.57 -1.94 -3.36 114.58 113.81 1nu8 h GLU 82 Ca 0.18 0.06 -0.13 0.00 -1.18 0.00 0.00 59.36 58.29 1nu8 h GLU 82 Cb 0.29 0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 29.04 1nu8 h GLU 82 CO -0.00 -0.52 -1.93 0.66 -1.18 0.00 0.00 179.01 176.04 1nu8 n TYR 83 N -5.39 0.25 0.00 0.92 4.01 -1.25 -5.00 117.16 110.71 1nu8 n TYR 83 Ca -0.12 0.08 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 1nu8 n TYR 83 Cb 0.37 -0.78 0.00 0.00 -0.31 0.00 0.00 39.34 38.62 1nu8 n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1nu8 n GLY 84 N 1.41 0.83 3.94 2.72 0.00 -0.58 -5.07 105.19 108.45 1nu8 n GLY 84 Ca -0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 1nu8 n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nu8 s ASN 85 N -2.34 6.30 0.02 1.61 4.22 -1.25 -4.82 114.94 118.68 1nu8 s ASN 85 Ca 0.00 0.46 -0.00 0.00 -2.14 0.00 0.00 52.86 51.18 1nu8 s ASN 85 Cb 0.00 -2.04 -0.02 0.00 1.28 0.00 0.00 41.25 40.47 1nu8 s ASN 85 CO 0.00 -0.30 -0.02 -0.94 -2.04 0.00 0.00 177.10 173.80 1nu8 s SER 86 N -4.01 0.26 0.36 3.54 1.04 -1.26 -1.13 113.70 112.49 1nu8 s SER 86 Ca 0.40 -0.54 0.06 0.00 0.48 0.00 0.00 55.95 56.35 1nu8 s SER 86 Cb -0.10 0.11 -0.07 0.00 0.10 0.00 0.00 66.02 66.07 1nu8 s SER 86 CO 0.36 -0.33 0.02 -0.44 0.98 0.00 0.00 173.24 173.82 1nu8 s SER 87 N -1.61 3.19 -0.31 7.02 0.01 -0.85 -4.99 113.70 116.16 1nu8 s SER 87 Ca -0.14 -1.35 -0.13 0.00 1.31 0.00 0.00 55.95 55.65 1nu8 s SER 87 Cb -0.08 -0.25 -0.03 0.00 0.21 0.00 0.00 66.02 65.86 1nu8 s SER 87 CO -0.02 -0.49 0.27 0.54 0.41 0.00 0.00 173.24 173.95 1nu8 s VAL 88 N -2.96 5.25 -0.06 3.43 0.11 -1.26 -2.04 120.40 122.88 1nu8 s VAL 88 Ca 0.35 0.08 -0.19 0.00 -2.93 0.00 0.00 61.98 59.30 1nu8 s VAL 88 Cb 0.09 -3.67 -0.14 0.00 -1.53 0.00 0.00 36.38 31.12 1nu8 s VAL 88 CO 0.16 0.08 0.75 0.15 -3.33 0.00 0.00 175.10 172.92 1nu8 h PHE 89 N 8.40 -0.20 -3.26 1.54 3.57 0.27 -3.46 116.94 123.81 1nu8 h PHE 89 Ca -0.32 -0.00 -0.42 0.00 3.53 0.00 0.00 57.97 60.75 1nu8 h PHE 89 Cb 1.17 0.07 -0.39 0.00 2.79 0.00 0.00 35.95 39.58 1nu8 h PHE 89 CO 0.72 0.21 -0.75 -1.17 -2.23 0.00 0.00 178.31 175.08 1nu8 s LEU 90 N -8.90 0.43 0.49 0.59 1.98 -0.85 -4.99 118.68 107.44 1nu8 s LEU 90 Ca -0.11 -0.11 -0.23 0.00 -2.89 0.00 0.00 54.13 50.78 1nu8 s LEU 90 Cb 0.00 -0.32 -0.06 0.00 0.66 0.00 0.00 46.19 46.47 1nu8 s LEU 90 CO 0.42 -0.24 1.27 -1.61 -1.89 0.00 0.00 176.35 174.30 1nu8 s GLU 91 N 2.06 3.52 0.46 1.98 8.01 -1.26 -0.57 118.70 132.89 1nu8 s GLU 91 Ca 0.04 2.02 0.17 0.00 0.01 0.00 0.00 54.97 57.21 1nu8 s GLU 91 Cb -0.13 -2.39 1.08 0.00 -4.31 0.00 0.00 34.13 28.38 1nu8 s GLU 91 CO -0.05 -0.82 2.00 -2.95 0.01 0.00 0.00 175.26 173.45 1nu8 h ASN 92 N 1.87 0.00 -0.24 -0.19 7.08 -1.90 -2.75 115.58 119.45 1nu8 h ASN 92 Ca -0.50 0.00 -0.10 0.00 -3.08 0.00 0.00 56.30 52.62 1nu8 h ASN 92 Cb 1.27 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 37.49 1nu8 h ASN 92 CO 0.59 0.18 -0.19 0.77 -2.08 0.00 0.00 177.43 176.71 1nu8 h SER 93 N 0.00 0.68 -2.45 6.14 4.64 -1.91 -3.44 113.55 117.21 1nu8 h SER 93 Ca -0.00 -0.22 -0.59 0.00 -0.47 0.00 0.00 61.79 60.50 1nu8 h SER 93 Cb 0.34 -0.19 0.07 0.00 -0.31 0.00 0.00 62.40 62.32 1nu8 h SER 93 CO 0.02 0.87 0.64 0.41 -0.87 0.00 0.00 176.83 177.91 1nu8 n THR 94 N -4.14 0.59 -2.69 2.95 -1.04 -1.04 -2.83 114.28 106.09 1nu8 n THR 94 Ca 0.00 -0.15 -0.00 0.00 -2.04 0.00 0.00 64.05 61.87 1nu8 n THR 94 Cb 0.40 -1.42 0.00 0.00 -1.82 0.00 0.00 70.33 67.49 1nu8 n THR 94 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1nu8 n PHE 95 N 2.39 -2.28 0.00 -1.42 3.72 -1.26 -4.96 117.46 113.65 1nu8 n PHE 95 Ca 0.14 0.87 0.00 0.00 -0.05 0.00 0.00 57.45 58.41 1nu8 n PHE 95 Cb 0.29 -3.49 0.00 0.00 -0.94 0.00 0.00 39.48 35.34 1nu8 n PHE 95 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1nu8 n ASP 96 N -1.58 0.11 -0.30 4.37 9.92 -1.13 -4.64 116.55 123.30 1nu8 n ASP 96 Ca 0.00 -0.27 0.04 0.00 -0.53 0.00 0.00 54.79 54.03 1nu8 n ASP 96 Cb 0.50 0.57 0.03 0.00 -0.64 0.00 0.00 41.12 41.58 1nu8 n ASP 96 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 1nu8 n GLU 97 N -0.58 0.29 0.28 -1.24 2.13 -1.26 -4.70 120.64 115.57 1nu8 n GLU 97 Ca 0.00 -0.93 0.17 0.00 0.66 0.00 0.00 57.16 57.06 1nu8 n GLU 97 Cb 0.00 -1.14 0.80 0.00 0.27 0.00 0.00 31.44 31.37 1nu8 n GLU 97 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 1nu8 h PHE 98 N 1.48 0.00 0.00 4.31 3.57 -1.96 -3.46 116.94 120.87 1nu8 h PHE 98 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1nu8 h PHE 98 Cb 0.32 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.06 1nu8 h PHE 98 CO 0.00 0.05 0.00 0.41 -2.23 0.00 0.00 178.31 176.54 1nu8 n GLY 99 N -0.40 1.58 3.09 2.40 0.00 -1.26 -4.99 105.19 105.61 1nu8 n GLY 99 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 1nu8 n GLY 99 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1nu8 s HIS 100 N -2.36 0.99 0.24 1.61 3.76 -1.26 -5.14 115.29 113.13 1nu8 s HIS 100 Ca 0.00 -0.32 -0.27 0.00 -0.15 0.00 0.00 55.06 54.32 1nu8 s HIS 100 Cb 0.00 -0.60 -0.09 0.00 1.11 0.00 0.00 32.58 33.01 1nu8 s HIS 100 CO 0.00 0.00 0.89 -1.54 -0.85 0.00 0.00 174.74 173.24 1nu8 s SER 101 N -0.97 7.47 -0.26 1.40 1.04 -1.26 -5.02 113.70 116.10 1nu8 s SER 101 Ca -0.00 1.81 -0.05 0.00 0.48 0.00 0.00 55.95 58.19 1nu8 s SER 101 Cb -0.07 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.49 1nu8 s SER 101 CO 0.01 0.11 0.02 -0.63 0.98 0.00 0.00 173.24 173.73 1nu8 s ILE 102 N -1.30 3.64 0.14 -1.02 1.01 -1.26 -4.53 121.20 117.87 1nu8 s ILE 102 Ca 0.42 -0.66 -0.10 0.00 0.00 0.00 0.00 60.65 60.31 1nu8 s ILE 102 Cb -0.23 -2.80 -0.08 0.00 0.01 0.00 0.00 42.46 39.36 1nu8 s ILE 102 CO 0.28 0.21 1.43 -1.13 0.00 0.00 0.00 174.94 175.73 1nu8 h ASN 103 N 8.16 0.94 -5.15 3.58 -0.73 -1.68 -3.48 115.58 117.22 1nu8 h ASN 103 Ca -0.35 -0.50 -0.10 0.00 1.87 0.00 0.00 56.30 57.23 1nu8 h ASN 103 Cb 1.14 -0.27 -0.02 0.00 0.27 0.00 0.00 38.32 39.44 1nu8 h ASN 103 CO 0.59 1.29 0.14 -0.62 -0.37 0.00 0.00 177.43 178.47 1nu8 s ASP 104 N -6.94 0.28 0.21 1.15 -1.08 -1.17 -5.04 116.67 104.09 1nu8 s ASP 104 Ca -0.10 -1.26 -0.15 0.00 -0.52 0.00 0.00 52.55 50.52 1nu8 s ASP 104 Cb 0.10 0.80 0.01 0.00 -1.46 0.00 0.00 42.92 42.38 1nu8 s ASP 104 CO 0.89 -1.59 0.48 -0.72 0.52 0.00 0.00 175.17 174.75 1nu8 s TYR 105 N -2.49 0.12 -0.26 -5.34 -0.85 -1.26 -1.26 117.35 106.00 1nu8 s TYR 105 Ca 0.20 -0.48 -0.12 0.00 -0.52 0.00 0.00 57.07 56.15 1nu8 s TYR 105 Cb -0.04 0.27 0.09 0.00 0.38 0.00 0.00 41.96 42.66 1nu8 s TYR 105 CO 0.14 -0.92 0.60 0.45 -1.52 0.00 0.00 175.55 174.30 1nu8 s SER 106 N -2.94 -0.85 0.03 -0.18 0.15 -0.79 -4.99 113.70 104.13 1nu8 s SER 106 Ca 0.15 1.37 -0.06 0.00 0.70 0.00 0.00 55.95 58.10 1nu8 s SER 106 Cb -0.00 1.51 -0.05 0.00 -1.71 0.00 0.00 66.02 65.77 1nu8 s SER 106 CO 0.02 -0.23 0.29 -0.63 1.20 0.00 0.00 173.24 173.89 1nu8 s ILE 107 N 2.02 5.27 0.57 6.45 1.01 -1.26 -0.75 121.20 134.51 1nu8 s ILE 107 Ca -0.08 0.17 -0.18 0.00 0.00 0.00 0.00 60.65 60.56 1nu8 s ILE 107 Cb -0.08 -3.58 -0.09 0.00 0.01 0.00 0.00 42.46 38.72 1nu8 s ILE 107 CO -0.18 0.32 0.47 -1.20 0.00 0.00 0.00 174.94 174.36 1nu8 n SER 108 N 0.97 -1.25 0.16 3.58 7.64 0.42 -4.90 113.62 120.24 1nu8 n SER 108 Ca -0.10 0.72 -0.13 0.00 1.01 0.00 0.00 58.87 60.37 1nu8 n SER 108 Cb 0.53 -1.15 -0.08 0.00 -1.01 0.00 0.00 64.21 62.50 1nu8 n SER 108 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1nu8 h PRO 109 N 0.18 -0.41 -4.50 1.43 0.11 -1.80 -3.36 132.00 123.66 1nu8 h PRO 109 Ca -0.45 0.03 -0.74 0.00 0.11 0.00 0.00 66.00 64.95 1nu8 h PRO 109 Cb 1.40 0.09 -0.21 0.00 0.11 0.00 0.00 31.00 32.39 1nu8 h PRO 109 CO 0.46 -0.09 0.59 -0.51 -0.21 0.00 0.00 178.00 178.25 1nu8 s ASP 110 N -5.07 6.75 -1.40 -2.05 1.11 -0.67 -4.88 116.67 110.47 1nu8 s ASP 110 Ca -0.14 -2.43 -0.09 0.00 0.18 0.00 0.00 52.55 50.07 1nu8 s ASP 110 Cb 0.02 -2.32 -0.08 0.00 1.07 0.00 0.00 42.92 41.61 1nu8 s ASP 110 CO 0.53 -0.82 2.68 0.61 1.18 0.00 0.00 175.17 179.36 1nu8 n GLY 111 N 4.70 3.88 0.00 0.21 0.00 -1.26 -4.60 105.19 108.12 1nu8 n GLY 111 Ca 0.21 -1.29 0.10 0.00 0.00 0.00 0.00 46.02 45.05 1nu8 n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1nu8 n GLN 112 N 3.80 0.47 -4.28 1.61 6.02 -1.26 -4.84 117.38 118.91 1nu8 n GLN 112 Ca 0.68 -0.08 -0.23 0.00 -0.01 0.00 0.00 57.00 57.35 1nu8 n GLN 112 Cb 0.20 -1.47 -0.12 0.00 1.02 0.00 0.00 30.24 29.87 1nu8 n GLN 112 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1nu8 s PHE 113 N -3.12 1.74 -0.06 1.08 0.08 -1.26 -1.07 117.98 115.37 1nu8 s PHE 113 Ca 0.01 -0.42 0.04 0.00 0.12 0.00 0.00 56.93 56.69 1nu8 s PHE 113 Cb 0.14 -0.95 -0.00 0.00 -0.57 0.00 0.00 43.02 41.64 1nu8 s PHE 113 CO 0.84 0.19 -0.19 -1.50 -0.10 0.00 0.00 175.22 174.46 1nu8 s ILE 114 N -1.18 1.62 -0.16 0.64 2.07 -0.78 -0.44 121.20 122.98 1nu8 s ILE 114 Ca 0.06 -0.81 -0.20 0.00 -1.41 0.00 0.00 60.65 58.29 1nu8 s ILE 114 Cb -0.10 -1.39 -0.03 0.00 0.13 0.00 0.00 42.46 41.06 1nu8 s ILE 114 CO 0.04 0.46 0.56 -0.76 -1.91 0.00 0.00 174.94 173.33 1nu8 s LEU 115 N 0.08 4.21 -0.25 8.50 1.43 0.07 -0.80 118.68 131.92 1nu8 s LEU 115 Ca -0.07 0.83 -0.04 0.00 -1.03 0.00 0.00 54.13 53.82 1nu8 s LEU 115 Cb -0.13 -2.81 0.00 0.00 0.03 0.00 0.00 46.19 43.28 1nu8 s LEU 115 CO 0.03 -0.14 -0.00 -0.76 0.23 0.00 0.00 176.35 175.71 1nu8 s LEU 116 N 1.28 3.25 -0.14 1.79 1.43 -0.11 -1.89 118.68 124.29 1nu8 s LEU 116 Ca 0.28 -0.55 -0.20 0.00 -1.03 0.00 0.00 54.13 52.63 1nu8 s LEU 116 Cb -0.16 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.25 1nu8 s LEU 116 CO 0.11 -0.09 0.55 -0.70 0.23 0.00 0.00 176.35 176.45 1nu8 s GLU 117 N 1.47 4.31 0.29 1.70 2.12 -0.39 -1.97 118.70 126.23 1nu8 s GLU 117 Ca 0.04 0.55 -0.02 0.00 0.36 0.00 0.00 54.97 55.89 1nu8 s GLU 117 Cb -0.16 -3.48 -0.02 0.00 0.26 0.00 0.00 34.13 30.73 1nu8 s GLU 117 CO -0.01 0.02 0.36 1.52 -0.54 0.00 0.00 175.26 176.60 1nu8 s TYR 118 N 1.06 1.08 -1.43 5.30 1.13 -0.77 -1.60 117.35 122.12 1nu8 s TYR 118 Ca 0.28 -1.27 -0.09 0.00 -1.41 0.00 0.00 57.07 54.58 1nu8 s TYR 118 Cb -0.16 -0.26 0.06 0.00 -1.10 0.00 0.00 41.96 40.50 1nu8 s TYR 118 CO 0.12 -0.94 0.67 0.09 -2.51 0.00 0.00 175.55 172.97 1nu8 n ASN 119 N -0.95 -4.76 -4.69 -0.18 3.02 -1.26 -0.80 115.26 105.63 1nu8 n ASN 119 Ca 0.02 -0.46 -0.42 0.00 -0.03 0.00 0.00 54.58 53.69 1nu8 n ASN 119 Cb 0.63 -3.86 -0.03 0.00 -0.61 0.00 0.00 39.78 35.90 1nu8 n ASN 119 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1nu8 s TYR 120 N -3.10 2.19 -0.24 3.10 6.14 -1.26 -4.42 117.35 119.76 1nu8 s TYR 120 Ca 0.45 0.05 0.01 0.00 0.64 0.00 0.00 57.07 58.22 1nu8 s TYR 120 Cb -0.22 -4.13 0.06 0.00 0.42 0.00 0.00 41.96 38.09 1nu8 s TYR 120 CO 0.55 -4.63 -0.07 0.08 0.64 0.00 0.00 175.55 172.12 1nu8 s VAL 121 N 2.76 1.64 0.28 3.14 1.01 0.33 -5.00 120.40 124.57 1nu8 s VAL 121 Ca 0.79 -1.28 -0.29 0.00 0.00 0.00 0.00 61.98 61.20 1nu8 s VAL 121 Cb -0.44 -1.87 -0.10 0.00 0.00 0.00 0.00 36.38 33.97 1nu8 s VAL 121 CO 0.35 -0.07 1.41 -0.75 0.00 0.00 0.00 175.10 176.04 1nu8 s LYS 122 N 1.35 4.28 0.00 2.72 2.20 -1.26 -1.57 119.74 127.45 1nu8 s LYS 122 Ca -0.06 2.30 0.00 0.00 -0.36 0.00 0.00 55.97 57.85 1nu8 s LYS 122 Cb -0.19 -3.09 0.00 0.00 -1.51 0.00 0.00 37.83 33.04 1nu8 s LYS 122 CO -0.06 -0.37 0.00 0.94 -0.36 0.00 0.00 175.35 175.50 1nu8 n GLN 123 N 1.78 0.00 0.00 4.03 7.27 -0.38 -4.90 117.38 125.19 1nu8 n GLN 123 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.12 1nu8 n GLN 123 Cb 0.41 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.06 1nu8 n GLN 123 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 1nu8 n TRP 124 N 0.00 0.00 -0.07 3.69 5.03 -1.15 -4.93 117.44 120.01 1nu8 n TRP 124 Ca 0.00 0.00 -0.06 0.00 3.03 0.00 0.00 57.50 60.47 1nu8 n TRP 124 Cb 0.00 0.00 0.12 0.00 -1.03 0.00 0.00 31.31 30.40 1nu8 n TRP 124 CO 0.00 0.00 0.00 -0.09 -0.03 0.00 0.00 177.69 177.57 1nu8 h ARG 125 N 0.00 0.72 0.00 -0.99 2.43 -2.00 -3.34 114.38 111.21 1nu8 h ARG 125 Ca 0.00 -0.27 -0.07 0.00 -0.81 0.00 0.00 59.98 58.83 1nu8 h ARG 125 Cb 0.00 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1nu8 h ARG 125 CO 0.00 0.86 -1.31 0.72 -1.51 0.00 0.00 179.97 178.73 1nu8 n HIS 126 N -4.13 0.00 -2.64 2.20 8.25 -1.26 -5.06 115.22 112.58 1nu8 n HIS 126 Ca 0.00 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.18 1nu8 n HIS 126 Cb 0.40 -0.22 -0.01 0.00 1.12 0.00 0.00 29.99 31.29 1nu8 n HIS 126 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1nu8 s SER 127 N -3.44 6.36 -0.07 0.41 1.04 -1.26 -4.54 113.70 112.21 1nu8 s SER 127 Ca -0.02 1.05 -0.32 0.00 0.48 0.00 0.00 55.95 57.14 1nu8 s SER 127 Cb 0.02 -2.30 0.12 0.00 0.10 0.00 0.00 66.02 63.96 1nu8 s SER 127 CO 0.20 -0.54 1.25 -0.72 0.98 0.00 0.00 173.24 174.40 1nu8 s TYR 128 N -2.65 -0.08 0.03 5.02 -0.85 -1.26 -1.25 117.35 116.32 1nu8 s TYR 128 Ca 0.50 -0.02 0.07 0.00 -0.52 0.00 0.00 57.07 57.10 1nu8 s TYR 128 Cb -0.10 0.54 -0.02 0.00 0.38 0.00 0.00 41.96 42.75 1nu8 s TYR 128 CO 0.41 -0.28 -0.21 0.99 -1.52 0.00 0.00 175.55 174.94 1nu8 s THR 129 N -2.46 1.71 0.30 -3.49 2.01 -0.61 -4.57 115.64 108.53 1nu8 s THR 129 Ca 0.12 -1.16 -0.15 0.00 0.31 0.00 0.00 61.69 60.81 1nu8 s THR 129 Cb 0.03 -1.47 0.02 0.00 0.01 0.00 0.00 72.50 71.08 1nu8 s THR 129 CO -0.04 0.27 0.63 0.00 -0.69 0.00 0.00 174.62 174.80 1nu8 s ALA 130 N -0.74 -0.60 0.31 7.40 0.00 -0.72 -0.51 121.76 126.90 1nu8 s ALA 130 Ca 0.08 -0.71 0.06 0.00 0.00 0.00 0.00 51.96 51.39 1nu8 s ALA 130 Cb -0.09 0.92 -0.02 0.00 0.00 0.00 0.00 23.12 23.93 1nu8 s ALA 130 CO 0.01 -0.94 0.42 -1.12 0.00 0.00 0.00 175.76 174.13 1nu8 s SER 131 N -3.02 6.01 -0.01 0.00 0.01 0.02 -1.59 113.70 115.12 1nu8 s SER 131 Ca 0.18 -0.14 -0.10 0.00 1.31 0.00 0.00 55.95 57.20 1nu8 s SER 131 Cb -0.04 -1.38 0.01 0.00 0.21 0.00 0.00 66.02 64.83 1nu8 s SER 131 CO 0.10 -0.33 0.20 -0.31 0.41 0.00 0.00 173.24 173.32 1nu8 s TYR 132 N -2.13 -0.06 0.16 2.43 2.02 -1.26 -1.85 117.35 116.66 1nu8 s TYR 132 Ca 0.42 0.09 0.08 0.00 -0.37 0.00 0.00 57.07 57.28 1nu8 s TYR 132 Cb -0.09 0.01 -0.04 0.00 -0.40 0.00 0.00 41.96 41.44 1nu8 s TYR 132 CO 0.30 -0.30 -0.16 -0.51 -1.57 0.00 0.00 175.55 173.31 1nu8 s ASP 133 N -1.18 2.50 -0.15 2.29 1.01 -0.83 -4.59 116.67 115.72 1nu8 s ASP 133 Ca -0.13 -0.89 -0.00 0.00 0.71 0.00 0.00 52.55 52.24 1nu8 s ASP 133 Cb -0.06 -0.13 -0.01 0.00 1.01 0.00 0.00 42.92 43.73 1nu8 s ASP 133 CO 0.02 -0.09 -0.13 -0.63 0.21 0.00 0.00 175.17 174.55 1nu8 s ILE 134 N -2.29 2.87 -0.21 0.77 1.01 -1.26 -0.94 121.20 121.15 1nu8 s ILE 134 Ca 0.16 -0.71 -0.16 0.00 0.00 0.00 0.00 60.65 59.94 1nu8 s ILE 134 Cb -0.04 -2.22 -0.04 0.00 0.01 0.00 0.00 42.46 40.17 1nu8 s ILE 134 CO 0.06 0.51 0.40 -0.47 0.00 0.00 0.00 174.94 175.44 1nu8 s TYR 135 N 0.70 3.36 -0.36 3.97 6.14 0.02 -0.24 117.35 130.93 1nu8 s TYR 135 Ca -0.06 0.60 -0.27 0.00 0.64 0.00 0.00 57.07 57.98 1nu8 s TYR 135 Cb -0.15 -2.54 0.02 0.00 0.42 0.00 0.00 41.96 39.70 1nu8 s TYR 135 CO 0.02 -0.04 0.98 0.34 0.64 0.00 0.00 175.55 177.49 1nu8 s ASP 136 N 1.11 6.74 0.18 4.32 -1.08 0.12 -1.87 116.67 126.20 1nu8 s ASP 136 Ca 0.19 0.70 -0.01 0.00 -0.52 0.00 0.00 52.55 52.91 1nu8 s ASP 136 Cb -0.15 -2.49 0.07 0.00 -1.46 0.00 0.00 42.92 38.89 1nu8 s ASP 136 CO 0.08 -0.88 1.44 -0.07 0.52 0.00 0.00 175.17 176.26 1nu8 h LEU 137 N 10.14 0.46 -0.29 -1.34 4.07 -1.38 -3.26 115.31 123.70 1nu8 h LEU 137 Ca -0.22 -0.30 -0.02 0.00 0.08 0.00 0.00 57.88 57.41 1nu8 h LEU 137 Cb 1.07 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.67 1nu8 h LEU 137 CO 1.00 1.03 0.09 0.78 -1.08 0.00 0.00 178.44 180.26 1nu8 h ASN 138 N 0.26 0.43 -2.43 -0.43 2.35 -1.92 -3.43 115.58 110.41 1nu8 h ASN 138 Ca -0.03 -0.21 -0.47 0.00 -0.55 0.00 0.00 56.30 55.05 1nu8 h ASN 138 Cb 1.30 -0.11 0.10 0.00 0.05 0.00 0.00 38.32 39.66 1nu8 h ASN 138 CO 0.12 0.53 0.18 -0.54 -1.65 0.00 0.00 177.43 176.07 1nu8 s LYS 139 N -5.38 1.33 -0.95 0.81 1.02 -1.23 -5.01 119.74 110.33 1nu8 s LYS 139 Ca -0.13 -1.04 -0.00 0.00 0.02 0.00 0.00 55.97 54.81 1nu8 s LYS 139 Cb 0.08 -2.22 0.33 0.00 -0.52 0.00 0.00 37.83 35.50 1nu8 s LYS 139 CO 0.74 -1.75 1.72 0.54 -0.92 0.00 0.00 175.35 175.68 1nu8 n ARG 140 N -3.08 4.93 -3.77 1.68 1.74 -1.26 -4.75 116.66 112.14 1nu8 n ARG 140 Ca 0.16 -4.60 -0.13 0.00 -0.77 0.00 0.00 57.85 52.51 1nu8 n ARG 140 Cb 0.60 -2.42 -0.12 0.00 -1.02 0.00 0.00 32.46 29.50 1nu8 n ARG 140 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1nu8 s GLN 141 N -4.20 0.27 0.19 5.56 -0.21 -1.24 -5.06 119.66 114.98 1nu8 s GLN 141 Ca 0.41 0.40 -0.30 0.00 0.02 0.00 0.00 55.36 55.90 1nu8 s GLN 141 Cb 0.22 0.07 -0.08 0.00 1.00 0.00 0.00 33.01 34.23 1nu8 s GLN 141 CO -0.16 -0.07 1.04 -0.51 -2.12 0.00 0.00 175.29 173.48 1nu8 s LEU 142 N 0.44 4.53 0.53 2.90 1.43 -1.26 0.15 118.68 127.40 1nu8 s LEU 142 Ca -0.03 2.03 -0.20 0.00 -1.03 0.00 0.00 54.13 54.90 1nu8 s LEU 142 Cb -0.04 -3.61 -0.06 0.00 0.03 0.00 0.00 46.19 42.52 1nu8 s LEU 142 CO -0.02 -0.11 1.17 0.27 0.23 0.00 0.00 176.35 177.89 1nu8 s ILE 143 N -0.50 2.98 0.00 -0.59 -4.36 0.67 -4.89 121.20 114.50 1nu8 s ILE 143 Ca 0.47 0.65 0.00 0.00 -0.26 0.00 0.00 60.65 61.51 1nu8 s ILE 143 Cb -0.28 -3.29 0.00 0.00 1.25 0.00 0.00 42.46 40.14 1nu8 s ILE 143 CO 0.34 -0.09 0.00 0.41 0.24 0.00 0.00 174.94 175.84 1nu8 n THR 144 N -1.10 0.00 -3.37 8.37 -1.04 -1.26 -4.66 114.28 111.22 1nu8 n THR 144 Ca 0.11 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.91 1nu8 n THR 144 Cb 0.49 -0.46 -0.00 0.00 -1.82 0.00 0.00 70.33 68.54 1nu8 n THR 144 CO 0.00 0.00 0.00 -1.83 -0.64 0.00 0.00 175.07 172.60 1nu8 s GLU 145 N -1.67 3.15 -1.56 -2.82 -1.05 -1.26 -4.54 118.70 108.95 1nu8 s GLU 145 Ca 0.00 -0.80 0.00 0.00 -0.15 0.00 0.00 54.97 54.02 1nu8 s GLU 145 Cb 0.00 -2.74 0.00 0.00 -0.44 0.00 0.00 34.13 30.95 1nu8 s GLU 145 CO 0.00 -0.00 0.00 0.39 0.95 0.00 0.00 175.26 176.60 1nu8 n GLU 146 N -1.76 -1.57 -1.44 -4.83 -0.58 -1.26 -4.83 120.64 104.37 1nu8 n GLU 146 Ca -0.01 0.87 -0.44 0.00 -0.42 0.00 0.00 57.16 57.17 1nu8 n GLU 146 Cb 0.58 -5.28 -0.01 0.00 -0.57 0.00 0.00 31.44 26.16 1nu8 n GLU 146 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1nu8 n ARG 147 N -2.33 0.46 -1.70 3.49 1.74 -1.26 -4.88 116.66 112.19 1nu8 n ARG 147 Ca -0.17 0.17 -0.44 0.00 -0.77 0.00 0.00 57.85 56.64 1nu8 n ARG 147 Cb 0.56 -1.35 -0.03 0.00 -1.02 0.00 0.00 32.46 30.61 1nu8 n ARG 147 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1nu8 n ILE 148 N -0.51 0.19 -0.92 0.55 5.41 -1.26 -4.95 119.36 117.87 1nu8 n ILE 148 Ca 0.13 -0.05 -0.29 0.00 1.00 0.00 0.00 62.75 63.54 1nu8 n ILE 148 Cb 0.35 -1.76 0.20 0.00 -0.71 0.00 0.00 39.64 37.72 1nu8 n ILE 148 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1nu8 s PRO 149 N 0.75 -0.03 0.70 0.38 0.04 -1.26 -4.53 135.00 131.07 1nu8 s PRO 149 Ca 0.75 0.69 -0.11 0.00 0.04 0.00 0.00 61.00 62.37 1nu8 s PRO 149 Cb -0.59 -1.67 0.01 0.00 0.04 0.00 0.00 34.50 32.30 1nu8 s PRO 149 CO 0.38 -3.08 1.07 -0.80 0.04 0.00 0.00 177.00 174.60 1nu8 s ASN 150 N -3.07 5.39 -1.34 6.66 0.01 -1.26 -4.13 114.94 117.20 1nu8 s ASN 150 Ca 0.66 1.37 -0.01 0.00 -0.71 0.00 0.00 52.86 54.18 1nu8 s ASN 150 Cb -0.21 -2.24 0.00 0.00 0.41 0.00 0.00 41.25 39.21 1nu8 s ASN 150 CO 0.60 -1.41 0.65 0.59 -1.51 0.00 0.00 177.10 176.03 1nu8 n ASN 151 N -3.08 -1.09 -4.81 -1.22 3.02 -1.09 -4.97 115.26 102.02 1nu8 n ASN 151 Ca 0.07 -0.86 -0.38 0.00 -0.03 0.00 0.00 54.58 53.38 1nu8 n ASN 151 Cb 0.55 -3.84 -0.06 0.00 -0.61 0.00 0.00 39.78 35.82 1nu8 n ASN 151 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1nu8 s THR 152 N -3.72 4.64 -0.15 3.41 2.01 -0.62 -4.51 115.64 116.71 1nu8 s THR 152 Ca 0.03 1.27 0.19 0.00 0.31 0.00 0.00 61.69 63.49 1nu8 s THR 152 Cb -0.01 -3.91 -0.29 0.00 0.01 0.00 0.00 72.50 68.30 1nu8 s THR 152 CO 0.83 0.42 0.48 0.00 -0.69 0.00 0.00 174.62 175.66 1nu8 n GLN 153 N 1.32 0.62 -3.64 4.92 6.02 0.67 -1.76 117.38 125.54 1nu8 n GLN 153 Ca -0.07 -0.15 -0.09 0.00 -0.01 0.00 0.00 57.00 56.68 1nu8 n GLN 153 Cb 0.51 -1.45 -0.07 0.00 1.02 0.00 0.00 30.24 30.25 1nu8 n GLN 153 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 1nu8 s TRP 154 N -3.26 -0.46 0.03 1.08 -0.11 -1.23 -4.55 118.94 110.43 1nu8 s TRP 154 Ca -0.05 1.13 0.02 0.00 1.22 0.00 0.00 56.10 58.41 1nu8 s TRP 154 Cb 0.13 0.37 -0.02 0.00 -1.50 0.00 0.00 33.47 32.44 1nu8 s TRP 154 CO 0.80 -0.23 -0.07 0.08 -4.62 0.00 0.00 176.95 172.92 1nu8 s VAL 155 N 0.19 0.46 -0.13 5.86 1.01 -1.26 -1.42 120.40 125.12 1nu8 s VAL 155 Ca 0.03 -0.90 -0.09 0.00 0.00 0.00 0.00 61.98 61.02 1nu8 s VAL 155 Cb -0.05 -0.52 0.05 0.00 0.00 0.00 0.00 36.38 35.86 1nu8 s VAL 155 CO -0.06 -0.31 0.33 -0.89 0.00 0.00 0.00 175.10 174.17 1nu8 s THR 156 N -1.16 -0.02 0.61 3.92 2.01 0.03 -5.01 115.64 116.03 1nu8 s THR 156 Ca -0.08 0.08 -0.18 0.00 0.31 0.00 0.00 61.69 61.81 1nu8 s THR 156 Cb -0.08 -0.49 -0.03 0.00 0.01 0.00 0.00 72.50 71.91 1nu8 s THR 156 CO 0.00 0.03 1.19 0.26 -0.69 0.00 0.00 174.62 175.42 1nu8 s TRP 157 N 0.92 2.38 0.79 4.92 0.52 -1.26 -0.82 118.94 126.40 1nu8 s TRP 157 Ca -0.06 1.53 -0.11 0.00 0.02 0.00 0.00 56.10 57.48 1nu8 s TRP 157 Cb -0.07 -3.44 0.07 0.00 -1.15 0.00 0.00 33.47 28.87 1nu8 s TRP 157 CO -0.07 -2.18 1.10 -1.54 0.02 0.00 0.00 176.95 174.28 1nu8 s SER 158 N -1.74 4.31 0.31 2.95 1.04 -0.71 -4.88 113.70 114.99 1nu8 s SER 158 Ca 0.76 1.88 0.25 0.00 0.48 0.00 0.00 55.95 59.32 1nu8 s SER 158 Cb -0.29 -2.53 1.05 0.00 0.10 0.00 0.00 66.02 64.36 1nu8 s SER 158 CO 0.35 -2.17 1.76 -0.65 0.98 0.00 0.00 173.24 173.51 1nu8 h PRO 159 N -1.19 0.00 -4.29 4.02 0.11 -1.85 -3.42 132.00 125.37 1nu8 h PRO 159 Ca -0.44 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.54 1nu8 h PRO 159 Cb 1.24 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.20 1nu8 h PRO 159 CO 0.50 0.00 -0.68 0.14 -0.21 0.00 0.00 178.00 177.75 1nu8 s VAL 160 N -3.38 0.25 0.00 3.15 -7.23 -1.26 -4.75 120.40 107.18 1nu8 s VAL 160 Ca 0.04 -1.83 0.00 0.00 -1.81 0.00 0.00 61.98 58.38 1nu8 s VAL 160 Cb 0.09 -1.58 0.00 0.00 0.56 0.00 0.00 36.38 35.45 1nu8 s VAL 160 CO 0.42 -0.94 0.00 0.61 -0.31 0.00 0.00 175.10 174.88 1nu8 n GLY 161 N 0.08 1.17 2.69 2.32 0.00 -1.26 -4.36 105.19 105.83 1nu8 n GLY 161 Ca -0.13 -0.68 -0.02 0.00 0.00 0.00 0.00 46.02 45.19 1nu8 n GLY 161 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1nu8 n HIS 162 N 12.59 -1.81 -1.87 1.61 1.44 -1.26 -1.66 115.22 124.26 1nu8 n HIS 162 Ca 0.00 -1.79 -0.31 0.00 -2.01 0.00 0.00 57.72 53.61 1nu8 n HIS 162 Cb 0.00 1.40 0.03 0.00 0.12 0.00 0.00 29.99 31.54 1nu8 n HIS 162 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 1nu8 s LYS 163 N -0.23 3.29 -0.04 -1.40 1.02 -1.26 -4.58 119.74 116.54 1nu8 s LYS 163 Ca 0.12 0.64 0.01 0.00 0.02 0.00 0.00 55.97 56.76 1nu8 s LYS 163 Cb 0.43 -2.05 0.02 0.00 -0.52 0.00 0.00 37.83 35.71 1nu8 s LYS 163 CO -0.12 -0.77 -0.03 -0.51 -0.92 0.00 0.00 175.35 173.01 1nu8 s LEU 164 N -5.26 1.29 -0.10 3.17 1.43 0.06 -1.73 118.68 117.54 1nu8 s LEU 164 Ca 0.56 -0.09 -0.03 0.00 -1.03 0.00 0.00 54.13 53.55 1nu8 s LEU 164 Cb -0.11 -0.35 -0.03 0.00 0.03 0.00 0.00 46.19 45.72 1nu8 s LEU 164 CO 0.53 -0.07 0.02 0.00 0.23 0.00 0.00 176.35 177.06 1nu8 s ALA 165 N 0.91 3.35 0.08 4.21 0.00 0.00 -0.41 121.76 129.90 1nu8 s ALA 165 Ca -0.11 -0.78 0.01 0.00 0.00 0.00 0.00 51.96 51.07 1nu8 s ALA 165 Cb -0.14 -1.57 -0.04 0.00 0.00 0.00 0.00 23.12 21.38 1nu8 s ALA 165 CO -0.00 0.55 -0.05 1.52 0.00 0.00 0.00 175.76 177.77 1nu8 s TYR 166 N -0.77 0.74 -0.11 0.00 -0.85 -0.47 -0.79 117.35 115.11 1nu8 s TYR 166 Ca 0.12 -0.94 0.03 0.00 -0.52 0.00 0.00 57.07 55.76 1nu8 s TYR 166 Cb -0.12 -0.46 -0.00 0.00 0.38 0.00 0.00 41.96 41.76 1nu8 s TYR 166 CO 0.02 -0.22 -0.20 0.08 -1.52 0.00 0.00 175.55 173.71 1nu8 s VAL 167 N -3.57 2.37 -0.10 -3.49 1.01 -0.50 -1.10 120.40 115.03 1nu8 s VAL 167 Ca 0.09 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 61.12 1nu8 s VAL 167 Cb 0.05 -1.94 0.05 0.00 0.00 0.00 0.00 36.38 34.54 1nu8 s VAL 167 CO -0.06 0.55 0.19 0.86 0.00 0.00 0.00 175.10 176.64 1nu8 s TRP 168 N 0.37 -0.26 -1.44 5.22 -0.00 -0.67 -0.24 118.94 121.92 1nu8 s TRP 168 Ca -0.16 0.72 -0.07 0.00 -0.00 0.00 0.00 56.10 56.58 1nu8 s TRP 168 Cb -0.17 -0.15 0.04 0.00 -0.00 0.00 0.00 33.47 33.18 1nu8 s TRP 168 CO 0.07 -0.28 0.61 0.09 -0.00 0.00 0.00 176.95 177.45 1nu8 n ASN 169 N 5.12 -5.07 -0.16 5.86 5.03 -1.26 -2.12 115.26 122.65 1nu8 n ASN 169 Ca -0.09 -0.37 -0.02 0.00 0.87 0.00 0.00 54.58 54.96 1nu8 n ASN 169 Cb 0.50 -4.12 -0.01 0.00 -1.02 0.00 0.00 39.78 35.13 1nu8 n ASN 169 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1nu8 n ASN 170 N -2.47 -4.00 -4.49 6.41 4.13 -1.26 -4.25 115.26 109.32 1nu8 n ASN 170 Ca -0.06 0.05 -0.31 0.00 1.68 0.00 0.00 54.58 55.94 1nu8 n ASN 170 Cb 0.58 -1.68 -0.12 0.00 -1.54 0.00 0.00 39.78 37.01 1nu8 n ASN 170 CO 0.00 0.00 0.00 -1.81 0.28 0.00 0.00 177.26 175.73 1nu8 s ASP 171 N -2.26 4.04 0.14 6.41 1.01 -0.90 -2.00 116.67 123.10 1nu8 s ASP 171 Ca 0.00 -0.31 -0.20 0.00 0.71 0.00 0.00 52.55 52.75 1nu8 s ASP 171 Cb 0.00 -0.77 -0.07 0.00 1.01 0.00 0.00 42.92 43.09 1nu8 s ASP 171 CO 0.00 0.28 0.65 -0.63 0.21 0.00 0.00 175.17 175.68 1nu8 s ILE 172 N -0.90 4.62 0.09 0.77 1.01 -1.26 -1.67 121.20 123.86 1nu8 s ILE 172 Ca 0.15 1.30 0.03 0.00 0.00 0.00 0.00 60.65 62.13 1nu8 s ILE 172 Cb -0.11 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.40 1nu8 s ILE 172 CO 0.05 0.44 -0.09 -0.31 0.00 0.00 0.00 174.94 175.03 1nu8 s TYR 173 N -1.25 0.96 -0.04 3.97 1.51 -0.25 -1.33 117.35 120.91 1nu8 s TYR 173 Ca 0.35 -0.70 -0.00 0.00 -1.01 0.00 0.00 57.07 55.71 1nu8 s TYR 173 Cb -0.19 -0.54 0.03 0.00 -0.11 0.00 0.00 41.96 41.15 1nu8 s TYR 173 CO 0.21 -0.05 0.00 0.08 -1.11 0.00 0.00 175.55 174.69 1nu8 s VAL 174 N -2.59 0.24 -0.15 0.71 1.01 -0.36 -1.36 120.40 117.89 1nu8 s VAL 174 Ca 0.05 0.11 -0.06 0.00 0.00 0.00 0.00 61.98 62.09 1nu8 s VAL 174 Cb -0.02 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.97 1nu8 s VAL 174 CO -0.01 0.19 0.04 -0.54 0.00 0.00 0.00 175.10 174.78 1nu8 s LYS 175 N 1.40 3.69 -0.15 2.72 1.02 0.45 -0.18 119.74 128.69 1nu8 s LYS 175 Ca -0.04 -0.37 -0.26 0.00 0.02 0.00 0.00 55.97 55.32 1nu8 s LYS 175 Cb -0.13 -3.08 -0.25 0.00 -0.52 0.00 0.00 37.83 33.86 1nu8 s LYS 175 CO -0.03 0.39 0.62 0.82 -0.92 0.00 0.00 175.35 176.23 1nu8 h ILE 176 N 4.72 1.49 -3.69 2.17 1.08 -1.85 0.20 117.51 121.62 1nu8 h ILE 176 Ca -0.40 -2.32 -0.68 0.00 -0.39 0.00 0.00 64.86 61.07 1nu8 h ILE 176 Cb 1.18 3.02 -0.18 0.00 -3.07 0.00 0.00 36.82 37.77 1nu8 h ILE 176 CO 0.65 0.54 -0.73 -1.61 -0.69 0.00 0.00 178.15 176.31 1nu8 s GLU 177 N -2.29 2.37 0.50 2.37 0.41 -1.26 -4.26 118.70 116.54 1nu8 s GLU 177 Ca -0.21 -0.83 0.15 0.00 -0.41 0.00 0.00 54.97 53.67 1nu8 s GLU 177 Cb 0.00 -2.40 1.20 0.00 -1.78 0.00 0.00 34.13 31.16 1nu8 s GLU 177 CO 0.68 0.57 2.12 -1.35 -0.49 0.00 0.00 175.26 176.79 1nu8 h PRO 178 N 4.38 0.04 -0.25 0.39 0.11 -1.88 -2.51 132.00 132.28 1nu8 h PRO 178 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1nu8 h PRO 178 Cb 1.16 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1nu8 h PRO 178 CO 0.52 0.05 0.00 0.27 -0.21 0.00 0.00 178.00 178.63 1nu8 n ASN 179 N -4.50 1.89 -4.96 -2.05 6.94 -1.26 -4.84 115.26 106.47 1nu8 n ASN 179 Ca -0.03 -1.81 -0.23 0.00 -0.02 0.00 0.00 54.58 52.49 1nu8 n ASN 179 Cb 0.11 -0.16 -0.02 0.00 -2.36 0.00 0.00 39.78 37.35 1nu8 n ASN 179 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1nu8 s LEU 180 N -1.39 4.29 0.48 -4.53 2.01 -0.95 -4.67 118.68 113.92 1nu8 s LEU 180 Ca 0.31 0.14 -0.23 0.00 0.01 0.00 0.00 54.13 54.36 1nu8 s LEU 180 Cb 0.16 -2.92 -0.07 0.00 0.01 0.00 0.00 46.19 43.37 1nu8 s LEU 180 CO 0.24 -0.06 1.27 -2.84 1.01 0.00 0.00 176.35 175.97 1nu8 s PRO 181 N -3.81 3.56 0.47 1.29 0.02 -1.26 -4.87 135.00 130.40 1nu8 s PRO 181 Ca 0.35 2.03 -0.14 0.00 0.02 0.00 0.00 61.00 63.26 1nu8 s PRO 181 Cb -0.10 -2.42 -0.07 0.00 0.02 0.00 0.00 34.50 31.93 1nu8 s PRO 181 CO 0.29 -0.79 0.89 -1.54 -0.33 0.00 0.00 177.00 175.53 1nu8 s SER 182 N -1.07 6.57 -0.17 2.53 1.04 -1.26 -4.75 113.70 116.59 1nu8 s SER 182 Ca 0.65 1.37 -0.16 0.00 0.48 0.00 0.00 55.95 58.29 1nu8 s SER 182 Cb -0.35 -2.42 -0.04 0.00 0.10 0.00 0.00 66.02 63.30 1nu8 s SER 182 CO 0.43 -0.51 0.39 -0.31 0.98 0.00 0.00 173.24 174.22 1nu8 s TYR 183 N -2.52 3.44 -0.03 5.02 1.51 0.74 -4.87 117.35 120.64 1nu8 s TYR 183 Ca 0.55 0.68 -0.30 0.00 -1.01 0.00 0.00 57.07 57.00 1nu8 s TYR 183 Cb -0.10 -2.47 -0.03 0.00 -0.11 0.00 0.00 41.96 39.24 1nu8 s TYR 183 CO 0.32 0.12 1.15 0.50 -1.11 0.00 0.00 175.55 176.53 1nu8 s ARG 184 N 0.85 4.40 -0.24 -0.62 3.52 -1.26 -1.22 118.95 124.38 1nu8 s ARG 184 Ca 0.20 1.63 -0.08 0.00 -0.13 0.00 0.00 55.73 57.35 1nu8 s ARG 184 Cb -0.14 -3.51 -0.17 0.00 -1.56 0.00 0.00 34.95 29.57 1nu8 s ARG 184 CO 0.07 -0.35 -0.12 -0.89 -0.81 0.00 0.00 175.30 173.20 1nu8 n ILE 185 N 4.41 1.56 -4.42 4.11 2.08 -0.44 -4.27 119.36 122.38 1nu8 n ILE 185 Ca 0.10 -0.44 -0.24 0.00 0.56 0.00 0.00 62.75 62.72 1nu8 n ILE 185 Cb 0.47 -1.72 -0.11 0.00 -0.75 0.00 0.00 39.64 37.53 1nu8 n ILE 185 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 1nu8 s THR 186 N -2.50 2.25 -0.04 1.39 -4.23 -1.23 -4.79 115.64 106.49 1nu8 s THR 186 Ca -0.34 -2.15 0.06 0.00 -1.18 0.00 0.00 61.69 58.08 1nu8 s THR 186 Cb 0.10 -2.12 0.09 0.00 1.34 0.00 0.00 72.50 71.91 1nu8 s THR 186 CO 0.59 -0.28 0.98 0.79 -0.54 0.00 0.00 174.62 176.15 1nu8 n TRP 187 N -0.07 0.00 0.43 3.99 7.02 -1.26 -4.44 117.44 123.11 1nu8 n TRP 187 Ca -0.10 -0.34 0.10 0.00 -1.02 0.00 0.00 57.50 56.14 1nu8 n TRP 187 Cb 0.58 -0.07 -0.14 0.00 -2.42 0.00 0.00 31.31 29.26 1nu8 n TRP 187 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 1nu8 n THR 188 N -0.47 0.00 -1.47 -0.99 -2.24 -1.26 -4.98 114.28 102.87 1nu8 n THR 188 Ca 0.05 -0.26 -0.57 0.00 -2.27 0.00 0.00 64.05 60.99 1nu8 n THR 188 Cb 0.62 0.49 -0.08 0.00 -2.10 0.00 0.00 70.33 69.26 1nu8 n THR 188 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nu8 n GLY 189 N 1.40 -0.02 2.89 3.38 0.00 -1.25 -4.69 105.19 106.89 1nu8 n GLY 189 Ca -0.00 0.80 -0.16 0.00 0.00 0.00 0.00 46.02 46.66 1nu8 n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1nu8 s LYS 190 N 1.45 0.07 0.00 1.61 2.20 -1.05 -4.91 119.74 119.11 1nu8 s LYS 190 Ca 0.88 0.62 -0.39 0.00 -0.36 0.00 0.00 55.97 56.72 1nu8 s LYS 190 Cb -1.25 -0.20 -0.19 0.00 -1.51 0.00 0.00 37.83 34.68 1nu8 s LYS 190 CO 0.63 -0.30 1.19 -1.91 -0.36 0.00 0.00 175.35 174.61 1nu8 n GLU 191 N 5.32 0.41 -0.91 4.03 2.13 -1.26 -0.71 120.64 129.65 1nu8 n GLU 191 Ca -0.05 0.15 0.00 0.00 0.66 0.00 0.00 57.16 57.92 1nu8 n GLU 191 Cb 0.50 -1.70 0.00 0.00 0.27 0.00 0.00 31.44 30.51 1nu8 n GLU 191 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1nu8 n ASP 192 N 2.02 -3.54 0.04 4.31 8.00 -1.26 -4.73 116.55 121.39 1nu8 n ASP 192 Ca 0.20 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.70 1nu8 n ASP 192 Cb 0.11 -2.20 0.00 0.00 -0.02 0.00 0.00 41.12 39.01 1nu8 n ASP 192 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1nu8 n ILE 193 N -2.25 0.41 -4.70 0.53 5.41 0.11 -4.65 119.36 114.22 1nu8 n ILE 193 Ca 0.00 0.13 -0.33 0.00 1.00 0.00 0.00 62.75 63.56 1nu8 n ILE 193 Cb 0.23 -0.92 -0.15 0.00 -0.71 0.00 0.00 39.64 38.08 1nu8 n ILE 193 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1nu8 s ILE 194 N -1.52 2.59 -0.20 1.39 -1.09 -0.72 0.56 121.20 122.20 1nu8 s ILE 194 Ca 0.00 -0.81 0.01 0.00 -2.23 0.00 0.00 60.65 57.62 1nu8 s ILE 194 Cb 0.00 -2.07 0.03 0.00 -1.58 0.00 0.00 42.46 38.83 1nu8 s ILE 194 CO 0.00 0.53 -0.16 -0.31 -1.23 0.00 0.00 174.94 173.77 1nu8 s TYR 195 N 0.65 2.91 -0.30 3.97 1.51 0.23 -2.53 117.35 123.79 1nu8 s TYR 195 Ca -0.09 -1.74 -0.07 0.00 -1.01 0.00 0.00 57.07 54.17 1nu8 s TYR 195 Cb -0.16 -1.94 0.01 0.00 -0.11 0.00 0.00 41.96 39.76 1nu8 s TYR 195 CO 0.02 -0.80 0.09 -0.80 -1.11 0.00 0.00 175.55 172.95 1nu8 s ASN 196 N 1.27 5.16 0.00 2.29 0.01 -0.85 -0.53 114.94 122.29 1nu8 s ASN 196 Ca 0.02 -0.77 0.00 0.00 -0.71 0.00 0.00 52.86 51.39 1nu8 s ASN 196 Cb -0.15 -1.88 0.00 0.00 0.41 0.00 0.00 41.25 39.63 1nu8 s ASN 196 CO -0.10 -0.21 0.00 0.61 -1.51 0.00 0.00 177.10 175.88 1nu8 n GLY 197 N 4.86 1.02 3.33 0.66 0.00 -0.77 -4.25 105.19 110.05 1nu8 n GLY 197 Ca -0.14 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.70 1nu8 n GLY 197 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1nu8 s ILE 198 N -2.49 1.53 0.14 -0.61 -4.36 -1.26 0.79 121.20 114.94 1nu8 s ILE 198 Ca 0.00 -2.15 -0.04 0.00 -0.26 0.00 0.00 60.65 58.20 1nu8 s ILE 198 Cb 0.00 -2.08 -0.05 0.00 1.25 0.00 0.00 42.46 41.57 1nu8 s ILE 198 CO 0.00 -0.56 0.37 0.42 0.24 0.00 0.00 174.94 175.40 1nu8 s THR 199 N -3.10 5.18 0.18 8.37 -4.23 -0.30 -4.72 115.64 117.03 1nu8 s THR 199 Ca 0.23 -0.00 -0.03 0.00 -1.18 0.00 0.00 61.69 60.71 1nu8 s THR 199 Cb 0.01 -3.63 0.04 0.00 1.34 0.00 0.00 72.50 70.27 1nu8 s THR 199 CO 0.06 0.03 0.25 -0.90 -0.54 0.00 0.00 174.62 173.52 1nu8 n ASP 200 N 0.07 0.07 0.39 3.99 5.75 -1.26 -4.67 116.55 120.88 1nu8 n ASP 200 Ca -0.03 -1.12 -0.17 0.00 -0.01 0.00 0.00 54.79 53.47 1nu8 n ASP 200 Cb 0.52 -0.18 -0.08 0.00 -1.03 0.00 0.00 41.12 40.34 1nu8 n ASP 200 CO 0.00 0.00 0.00 -0.25 -0.11 0.00 0.00 177.20 176.84 1nu8 h TRP 201 N -1.01 -1.11 -0.79 2.11 7.01 -2.00 -0.16 115.95 120.01 1nu8 h TRP 201 Ca -0.08 -0.01 0.06 0.00 2.11 0.00 0.00 58.89 60.97 1nu8 h TRP 201 Cb 0.23 0.39 -0.05 0.00 -2.10 0.00 0.00 29.16 27.63 1nu8 h TRP 201 CO 0.00 -0.64 0.52 -0.39 -2.79 0.00 0.00 178.44 175.14 1nu8 h VAL 202 N -1.06 1.04 -0.61 2.65 -1.51 -1.95 -0.76 116.25 114.05 1nu8 h VAL 202 Ca -0.10 -0.29 -0.10 0.00 -1.23 0.00 0.00 66.70 64.98 1nu8 h VAL 202 Cb 0.84 0.11 -0.02 0.00 -2.13 0.00 0.00 31.29 30.08 1nu8 h VAL 202 CO 0.12 0.16 0.00 1.88 -1.23 0.00 0.00 177.57 178.50 1nu8 h TYR 203 N 0.86 1.17 -0.52 5.19 -1.99 -1.87 0.23 116.97 120.04 1nu8 h TYR 203 Ca 0.34 -0.20 -0.01 0.00 2.00 0.00 0.00 58.73 60.86 1nu8 h TYR 203 Cb 0.23 -0.31 -0.03 0.00 2.00 0.00 0.00 36.73 38.63 1nu8 h TYR 203 CO -0.00 1.03 0.30 1.49 -0.00 0.00 0.00 178.16 180.98 1nu8 h GLU 204 N 0.98 0.72 0.05 4.88 4.81 0.25 -1.50 114.58 124.77 1nu8 h GLU 204 Ca 0.17 -0.07 -0.18 0.00 -0.13 0.00 0.00 59.36 59.15 1nu8 h GLU 204 Cb 0.56 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1nu8 h GLU 204 CO 0.03 0.54 -0.94 1.49 -0.73 0.00 0.00 179.01 179.40 1nu8 h GLU 205 N 0.70 0.12 0.00 1.92 4.57 -1.08 -2.75 114.58 118.06 1nu8 h GLU 205 Ca 0.19 -0.20 -0.15 0.00 -1.18 0.00 0.00 59.36 58.02 1nu8 h GLU 205 Cb 0.01 0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 1nu8 h GLU 205 CO -0.03 1.09 -2.03 0.39 -1.18 0.00 0.00 179.01 177.26 1nu8 n GLU 206 N -4.27 0.83 -0.05 1.92 -0.58 0.81 -4.53 120.64 114.76 1nu8 n GLU 206 Ca -0.22 -0.10 -0.06 0.00 -0.42 0.00 0.00 57.16 56.37 1nu8 n GLU 206 Cb 0.72 -1.45 -0.02 0.00 -0.57 0.00 0.00 31.44 30.12 1nu8 n GLU 206 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1nu8 n VAL 207 N -2.39 0.98 0.71 2.62 0.31 -0.98 -4.81 118.33 114.77 1nu8 n VAL 207 Ca -0.15 0.26 0.11 0.00 -0.01 0.00 0.00 64.34 64.55 1nu8 n VAL 207 Cb 0.76 -2.02 0.12 0.00 -0.91 0.00 0.00 33.84 31.79 1nu8 n VAL 207 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1nu8 n PHE 208 N -3.76 0.13 -3.98 3.52 3.72 -0.60 -4.98 117.46 111.52 1nu8 n PHE 208 Ca -0.09 -0.07 -0.29 0.00 -0.05 0.00 0.00 57.45 56.95 1nu8 n PHE 208 Cb 0.32 -0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.81 1nu8 n PHE 208 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1nu8 n SER 209 N 1.24 -0.38 -3.63 4.37 7.64 -1.11 -4.91 113.62 116.84 1nu8 n SER 209 Ca 0.14 -1.03 -0.07 0.00 1.01 0.00 0.00 58.87 58.91 1nu8 n SER 209 Cb 0.54 -1.27 -0.06 0.00 -1.01 0.00 0.00 64.21 62.41 1nu8 n SER 209 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nu8 s ALA 210 N -4.03 -2.03 0.32 -0.43 0.00 -1.05 -4.99 121.76 109.54 1nu8 s ALA 210 Ca 0.11 1.77 0.07 0.00 0.00 0.00 0.00 51.96 53.91 1nu8 s ALA 210 Cb -0.06 -1.36 0.53 0.00 0.00 0.00 0.00 23.12 22.23 1nu8 s ALA 210 CO 0.80 -0.22 1.76 -0.92 0.00 0.00 0.00 175.76 177.17 1nu8 h TYR 211 N 3.40 0.29 -3.78 0.00 3.20 -1.87 -3.39 116.97 114.83 1nu8 h TYR 211 Ca -0.24 -0.07 -0.52 0.00 3.14 0.00 0.00 58.73 61.04 1nu8 h TYR 211 Cb 1.18 -0.07 0.05 0.00 1.54 0.00 0.00 36.73 39.43 1nu8 h TYR 211 CO 0.28 0.56 0.63 0.45 -1.64 0.00 0.00 178.16 178.44 1nu8 s SER 212 N -6.87 6.85 -0.32 -2.11 0.15 -1.26 -1.15 113.70 108.99 1nu8 s SER 212 Ca -0.05 2.60 0.18 0.00 0.70 0.00 0.00 55.95 59.38 1nu8 s SER 212 Cb 0.14 -2.64 0.47 0.00 -1.71 0.00 0.00 66.02 62.27 1nu8 s SER 212 CO 0.76 -0.49 1.00 0.00 1.20 0.00 0.00 173.24 175.71 1nu8 n ALA 213 N 1.16 3.44 -2.54 5.45 0.00 0.24 -4.60 120.51 123.64 1nu8 n ALA 213 Ca 0.01 -3.17 -0.24 0.00 0.00 0.00 0.00 53.44 50.04 1nu8 n ALA 213 Cb 0.42 -0.88 -0.13 0.00 0.00 0.00 0.00 19.45 18.86 1nu8 n ALA 213 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1nu8 s LEU 214 N -3.29 2.24 -0.32 0.00 1.02 -1.25 -1.46 118.68 115.62 1nu8 s LEU 214 Ca 0.29 -0.60 0.03 0.00 0.02 0.00 0.00 54.13 53.87 1nu8 s LEU 214 Cb 0.43 -0.86 0.16 0.00 0.02 0.00 0.00 46.19 45.94 1nu8 s LEU 214 CO 0.01 0.08 0.44 0.26 0.02 0.00 0.00 176.35 177.16 1nu8 s TRP 215 N -1.01 -1.00 0.33 0.29 0.51 0.14 -4.95 118.94 113.25 1nu8 s TRP 215 Ca 0.06 0.11 -0.29 0.00 -2.12 0.00 0.00 56.10 53.86 1nu8 s TRP 215 Cb -0.09 -0.13 -0.11 0.00 -0.81 0.00 0.00 33.47 32.33 1nu8 s TRP 215 CO 0.03 -1.01 1.46 -1.58 -0.51 0.00 0.00 176.95 175.34 1nu8 s TRP 216 N 2.24 2.79 0.61 -1.98 0.52 -1.26 -1.65 118.94 120.21 1nu8 s TRP 216 Ca 0.12 1.13 -0.18 0.00 0.02 0.00 0.00 56.10 57.19 1nu8 s TRP 216 Cb -0.12 -3.92 -0.08 0.00 -1.15 0.00 0.00 33.47 28.20 1nu8 s TRP 216 CO -0.22 -2.80 0.47 0.45 0.02 0.00 0.00 176.95 174.87 1nu8 n SER 217 N 1.15 -1.31 -0.06 2.95 2.88 0.07 -4.91 113.62 114.39 1nu8 n SER 217 Ca 0.03 0.69 -0.01 0.00 -1.33 0.00 0.00 58.87 58.25 1nu8 n SER 217 Cb 0.40 -1.16 0.27 0.00 -0.75 0.00 0.00 64.21 62.97 1nu8 n SER 217 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1nu8 h PRO 218 N 0.06 0.66 -0.95 -1.46 0.11 -1.90 -2.14 132.00 126.38 1nu8 h PRO 218 Ca -0.45 -0.12 0.02 0.00 0.11 0.00 0.00 66.00 65.55 1nu8 h PRO 218 Cb 1.39 -0.11 -0.05 0.00 0.11 0.00 0.00 31.00 32.34 1nu8 h PRO 218 CO 0.45 0.61 0.63 -0.97 -0.21 0.00 0.00 178.00 178.51 1nu8 h ASN 219 N 0.65 1.08 0.00 -2.05 -0.73 -1.92 -3.42 115.58 109.19 1nu8 h ASN 219 Ca 0.15 -0.02 0.00 0.00 1.87 0.00 0.00 56.30 58.29 1nu8 h ASN 219 Cb 0.25 -0.26 0.00 0.00 0.27 0.00 0.00 38.32 38.58 1nu8 h ASN 219 CO -0.00 0.77 0.00 0.61 -0.37 0.00 0.00 177.43 178.44 1nu8 n GLY 220 N -1.36 2.31 0.29 1.57 0.00 -0.80 -4.63 105.19 102.57 1nu8 n GLY 220 Ca 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.10 1nu8 n GLY 220 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1nu8 h THR 221 N 0.00 0.28 -3.23 2.61 2.02 -1.91 -3.44 112.91 109.24 1nu8 h THR 221 Ca 0.00 0.00 -0.65 0.00 0.77 0.00 0.00 66.41 66.53 1nu8 h THR 221 Cb 0.00 0.28 -0.11 0.00 -1.74 0.00 0.00 68.15 66.58 1nu8 h THR 221 CO 0.00 0.00 -0.61 -0.36 0.37 0.00 0.00 175.52 174.92 1nu8 s PHE 222 N -6.12 3.16 -0.30 3.16 0.08 -1.26 0.55 117.98 117.25 1nu8 s PHE 222 Ca -0.14 0.10 -0.03 0.00 0.12 0.00 0.00 56.93 56.98 1nu8 s PHE 222 Cb 0.17 -1.65 0.05 0.00 -0.57 0.00 0.00 43.02 41.02 1nu8 s PHE 222 CO 0.71 0.51 0.01 -1.17 -0.10 0.00 0.00 175.22 175.18 1nu8 s LEU 223 N -2.02 3.91 0.12 -0.37 0.20 0.73 -0.75 118.68 120.50 1nu8 s LEU 223 Ca 0.25 -1.22 -0.09 0.00 0.69 0.00 0.00 54.13 53.77 1nu8 s LEU 223 Cb -0.12 -1.74 -0.06 0.00 -0.43 0.00 0.00 46.19 43.85 1nu8 s LEU 223 CO 0.17 -0.26 0.42 0.00 -0.29 0.00 0.00 176.35 176.39 1nu8 s ALA 224 N 1.28 3.71 -0.04 5.97 0.00 -0.66 -0.80 121.76 131.23 1nu8 s ALA 224 Ca -0.04 -0.40 -0.30 0.00 0.00 0.00 0.00 51.96 51.21 1nu8 s ALA 224 Cb -0.19 -2.27 0.07 0.00 0.00 0.00 0.00 23.12 20.73 1nu8 s ALA 224 CO -0.01 0.58 0.66 1.52 0.00 0.00 0.00 175.76 178.52 1nu8 s TYR 225 N -1.53 -0.64 0.00 0.00 1.13 0.11 0.24 117.35 116.66 1nu8 s TYR 225 Ca 0.37 1.07 -0.00 0.00 -1.41 0.00 0.00 57.07 57.10 1nu8 s TYR 225 Cb -0.13 0.40 -0.04 0.00 -1.10 0.00 0.00 41.96 41.09 1nu8 s TYR 225 CO 0.20 -0.61 0.09 0.00 -2.51 0.00 0.00 175.55 172.72 1nu8 s ALA 226 N -1.29 3.60 -0.07 9.51 0.00 -0.54 -0.78 121.76 132.19 1nu8 s ALA 226 Ca -0.11 -0.88 0.03 0.00 0.00 0.00 0.00 51.96 51.00 1nu8 s ALA 226 Cb -0.00 -1.58 -0.02 0.00 0.00 0.00 0.00 23.12 21.52 1nu8 s ALA 226 CO 0.09 0.70 -0.15 -1.14 0.00 0.00 0.00 175.76 175.26 1nu8 s GLN 227 N -1.81 2.73 0.04 0.00 0.74 -0.00 -1.86 119.66 119.50 1nu8 s GLN 227 Ca 0.24 -0.71 0.09 0.00 0.05 0.00 0.00 55.36 55.03 1nu8 s GLN 227 Cb -0.12 -2.42 -0.03 0.00 1.10 0.00 0.00 33.01 31.54 1nu8 s GLN 227 CO 0.15 0.50 -0.25 -0.06 -0.55 0.00 0.00 175.29 175.09 1nu8 s PHE 228 N -0.42 2.38 -0.21 1.67 0.08 0.31 -1.45 117.98 120.34 1nu8 s PHE 228 Ca 0.05 -0.38 -0.01 0.00 0.12 0.00 0.00 56.93 56.71 1nu8 s PHE 228 Cb -0.12 -1.41 0.06 0.00 -0.57 0.00 0.00 43.02 40.98 1nu8 s PHE 228 CO 0.02 0.15 -0.03 1.21 -0.10 0.00 0.00 175.22 176.47 1nu8 s ASN 229 N -1.27 3.40 -0.27 1.36 3.84 -0.99 -0.60 114.94 120.41 1nu8 s ASN 229 Ca 0.12 -0.99 0.12 0.00 0.21 0.00 0.00 52.86 52.32 1nu8 s ASN 229 Cb -0.10 -0.96 0.61 0.00 -0.55 0.00 0.00 41.25 40.25 1nu8 s ASN 229 CO 0.03 -0.25 1.60 0.47 -2.79 0.00 0.00 177.10 176.16 1nu8 n ASP 230 N 4.82 3.88 -0.16 -4.21 9.92 0.19 -2.34 116.55 128.65 1nu8 n ASP 230 Ca -0.11 -3.31 0.10 0.00 -0.53 0.00 0.00 54.79 50.94 1nu8 n ASP 230 Cb 0.46 -0.65 0.43 0.00 -0.64 0.00 0.00 41.12 40.71 1nu8 n ASP 230 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 1nu8 h THR 231 N 1.89 0.92 -0.15 -3.53 2.02 -1.85 -1.88 112.91 110.32 1nu8 h THR 231 Ca 0.18 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1nu8 h THR 231 Cb 1.89 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 68.59 1nu8 h THR 231 CO 0.49 0.11 0.00 -0.62 0.37 0.00 0.00 175.52 175.87 1nu8 n GLU 232 N -4.49 2.51 -2.32 6.66 1.02 -1.26 -5.00 120.64 117.77 1nu8 n GLU 232 Ca 0.12 -1.65 -0.42 0.00 -0.02 0.00 0.00 57.16 55.19 1nu8 n GLU 232 Cb 0.35 -1.13 -0.03 0.00 -0.02 0.00 0.00 31.44 30.61 1nu8 n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1nu8 s VAL 233 N -0.93 3.85 0.90 2.62 1.01 -0.71 -4.73 120.40 122.42 1nu8 s VAL 233 Ca 0.11 1.27 -0.11 0.00 0.00 0.00 0.00 61.98 63.25 1nu8 s VAL 233 Cb 0.06 -3.82 0.13 0.00 0.00 0.00 0.00 36.38 32.76 1nu8 s VAL 233 CO 0.08 0.04 1.10 -2.84 0.00 0.00 0.00 175.10 173.48 1nu8 s PRO 234 N 1.82 1.17 -0.17 2.72 0.02 -1.26 -4.68 135.00 134.61 1nu8 s PRO 234 Ca 0.61 1.17 0.00 0.00 0.02 0.00 0.00 61.00 62.80 1nu8 s PRO 234 Cb -0.30 -1.77 0.01 0.00 0.02 0.00 0.00 34.50 32.45 1nu8 s PRO 234 CO 0.27 -2.40 -0.17 -0.51 -0.33 0.00 0.00 177.00 173.86 1nu8 s LEU 235 N -6.40 2.34 -0.14 -5.54 1.43 -1.26 -0.84 118.68 108.27 1nu8 s LEU 235 Ca 0.65 -0.55 -0.27 0.00 -1.03 0.00 0.00 54.13 52.92 1nu8 s LEU 235 Cb -0.20 -1.54 -0.01 0.00 0.03 0.00 0.00 46.19 44.47 1nu8 s LEU 235 CO 0.58 0.04 0.93 -0.51 0.23 0.00 0.00 176.35 177.61 1nu8 s ILE 236 N 1.10 4.83 -0.01 -0.59 -1.16 -0.46 -4.83 121.20 120.07 1nu8 s ILE 236 Ca 0.00 1.85 0.02 0.00 -0.51 0.00 0.00 60.65 62.01 1nu8 s ILE 236 Cb -0.14 -4.23 -0.04 0.00 0.61 0.00 0.00 42.46 38.66 1nu8 s ILE 236 CO -0.06 0.01 -0.01 -1.61 -2.81 0.00 0.00 174.94 170.46 1nu8 s GLU 237 N 2.11 2.76 -0.02 3.50 2.02 -1.26 -1.26 118.70 126.55 1nu8 s GLU 237 Ca 0.43 -0.61 -0.30 0.00 0.02 0.00 0.00 54.97 54.51 1nu8 s GLU 237 Cb -0.17 -2.65 0.07 0.00 0.10 0.00 0.00 34.13 31.48 1nu8 s GLU 237 CO 0.15 0.63 0.68 1.52 0.02 0.00 0.00 175.26 178.26 1nu8 s TYR 238 N -1.06 -0.62 0.19 1.61 1.13 0.52 -4.95 117.35 114.17 1nu8 s TYR 238 Ca 0.19 0.96 -0.30 0.00 -1.41 0.00 0.00 57.07 56.51 1nu8 s TYR 238 Cb -0.11 0.44 -0.08 0.00 -1.10 0.00 0.00 41.96 41.11 1nu8 s TYR 238 CO 0.09 -0.64 0.99 -1.12 -2.51 0.00 0.00 175.55 172.36 1nu8 s SER 239 N -1.47 7.50 -0.13 -0.18 0.01 -1.26 0.12 113.70 118.28 1nu8 s SER 239 Ca -0.08 1.95 0.01 0.00 1.31 0.00 0.00 55.95 59.13 1nu8 s SER 239 Cb -0.00 -2.60 -0.01 0.00 0.21 0.00 0.00 66.02 63.62 1nu8 s SER 239 CO 0.05 -0.01 -0.16 0.12 0.41 0.00 0.00 173.24 173.66 1nu8 s PHE 240 N -0.61 2.76 -0.13 2.43 5.36 0.92 -4.65 117.98 124.05 1nu8 s PHE 240 Ca 0.45 -0.78 0.18 0.00 -0.96 0.00 0.00 56.93 55.81 1nu8 s PHE 240 Cb -0.26 -1.82 -0.23 0.00 -0.34 0.00 0.00 43.02 40.36 1nu8 s PHE 240 CO 0.33 -0.29 0.45 0.66 -1.46 0.00 0.00 175.22 174.90 1nu8 n TYR 241 N 3.61 0.39 -0.88 10.12 4.01 -1.26 -1.58 117.16 131.57 1nu8 n TYR 241 Ca -0.18 0.13 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 1nu8 n TYR 241 Cb 0.53 -0.93 0.00 0.00 -0.31 0.00 0.00 39.34 38.62 1nu8 n TYR 241 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1nu8 n SER 242 N -2.71 0.00 -4.62 7.72 3.41 -1.26 -4.72 113.62 111.44 1nu8 n SER 242 Ca -0.18 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.05 1nu8 n SER 242 Cb 0.92 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.91 1nu8 n SER 242 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1nu8 n ASP 243 N -3.23 0.99 -0.10 4.04 8.00 -1.26 -4.88 116.55 120.11 1nu8 n ASP 243 Ca 0.00 0.87 0.18 0.00 0.71 0.00 0.00 54.79 56.55 1nu8 n ASP 243 Cb 0.00 -1.39 0.59 0.00 -0.02 0.00 0.00 41.12 40.30 1nu8 n ASP 243 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1nu8 h GLU 244 N 0.80 0.22 0.00 -1.24 4.81 -2.05 -0.35 114.58 116.77 1nu8 h GLU 244 Ca -0.48 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1nu8 h GLU 244 Cb 1.35 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1nu8 h GLU 244 CO 0.53 0.14 0.00 -1.13 -0.73 0.00 0.00 179.01 177.82 1nu8 n SER 245 N -4.43 0.78 -4.71 1.04 3.41 -1.26 -4.70 113.62 103.75 1nu8 n SER 245 Ca 0.13 0.61 -0.42 0.00 -0.26 0.00 0.00 58.87 58.93 1nu8 n SER 245 Cb 0.59 -0.81 -0.03 0.00 -0.26 0.00 0.00 64.21 63.70 1nu8 n SER 245 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1nu8 s LEU 246 N -4.54 4.37 -0.22 1.04 0.20 -0.14 -4.94 118.68 114.45 1nu8 s LEU 246 Ca 0.08 2.26 -0.12 0.00 0.69 0.00 0.00 54.13 57.04 1nu8 s LEU 246 Cb 0.11 -3.58 -0.18 0.00 -0.43 0.00 0.00 46.19 42.11 1nu8 s LEU 246 CO 0.52 -0.62 -0.00 1.67 -0.29 0.00 0.00 176.35 177.63 1nu8 n GLN 247 N 4.01 0.63 -3.61 1.98 7.27 -1.26 -4.80 117.38 121.60 1nu8 n GLN 247 Ca 0.11 0.34 -0.38 0.00 0.07 0.00 0.00 57.00 57.14 1nu8 n GLN 247 Cb 0.43 -1.62 -0.11 0.00 2.41 0.00 0.00 30.24 31.35 1nu8 n GLN 247 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 1nu8 s TYR 248 N -2.48 3.20 0.23 3.69 1.51 -1.26 -5.07 117.35 117.18 1nu8 s TYR 248 Ca -0.32 0.05 -0.28 0.00 -1.01 0.00 0.00 57.07 55.52 1nu8 s TYR 248 Cb 0.09 -2.36 -0.16 0.00 -0.11 0.00 0.00 41.96 39.42 1nu8 s TYR 248 CO 0.60 -0.18 0.64 -2.30 -1.11 0.00 0.00 175.55 173.20 1nu8 n PRO 249 N 5.02 0.37 -3.20 -1.71 -0.02 -1.26 -4.98 135.00 129.23 1nu8 n PRO 249 Ca -0.14 0.13 -0.39 0.00 -2.02 0.00 0.00 63.50 61.08 1nu8 n PRO 249 Cb 0.52 -1.23 -0.06 0.00 -0.02 0.00 0.00 33.50 32.70 1nu8 n PRO 249 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1nu8 s LYS 250 N -1.16 4.30 -0.10 -0.52 2.20 -0.61 -4.95 119.74 118.90 1nu8 s LYS 250 Ca 0.62 0.84 -0.19 0.00 -0.36 0.00 0.00 55.97 56.89 1nu8 s LYS 250 Cb -0.85 -3.25 -0.04 0.00 -1.51 0.00 0.00 37.83 32.17 1nu8 s LYS 250 CO 0.57 0.60 0.51 0.99 -0.36 0.00 0.00 175.35 177.66 1nu8 s THR 251 N -1.02 5.15 -0.04 3.43 2.01 -1.26 -0.06 115.64 123.85 1nu8 s THR 251 Ca 0.31 1.03 -0.09 0.00 0.31 0.00 0.00 61.69 63.25 1nu8 s THR 251 Cb -0.20 -3.85 -0.05 0.00 0.01 0.00 0.00 72.50 68.41 1nu8 s THR 251 CO 0.21 0.33 0.26 -0.69 -0.69 0.00 0.00 174.62 174.04 1nu8 s VAL 252 N 0.56 5.30 -0.15 3.82 1.01 0.32 -4.90 120.40 126.35 1nu8 s VAL 252 Ca 0.28 0.38 -0.02 0.00 0.00 0.00 0.00 61.98 62.61 1nu8 s VAL 252 Cb -0.16 -3.55 0.05 0.00 0.00 0.00 0.00 36.38 32.73 1nu8 s VAL 252 CO 0.12 0.52 0.02 -0.13 0.00 0.00 0.00 175.10 175.62 1nu8 s ARG 253 N -1.30 0.72 -0.12 2.72 0.52 -1.26 -0.35 118.95 119.88 1nu8 s ARG 253 Ca 0.22 -0.27 0.00 0.00 -0.52 0.00 0.00 55.73 55.16 1nu8 s ARG 253 Cb -0.14 -1.76 0.02 0.00 0.52 0.00 0.00 34.95 33.59 1nu8 s ARG 253 CO 0.11 -0.52 -0.10 0.08 0.02 0.00 0.00 175.30 174.89 1nu8 s VAL 254 N 1.87 1.20 -0.17 3.52 1.01 -0.39 -4.94 120.40 122.51 1nu8 s VAL 254 Ca 0.01 -0.42 -0.30 0.00 0.00 0.00 0.00 61.98 61.27 1nu8 s VAL 254 Cb -0.15 -1.17 -0.08 0.00 0.00 0.00 0.00 36.38 34.97 1nu8 s VAL 254 CO -0.07 0.39 2.12 -2.65 0.00 0.00 0.00 175.10 174.90 1nu8 n PRO 255 N 4.75 2.06 -3.48 2.72 -0.02 -1.26 -1.36 135.00 138.40 1nu8 n PRO 255 Ca -0.15 0.64 -0.18 0.00 -2.02 0.00 0.00 63.50 61.79 1nu8 n PRO 255 Cb 0.50 -3.00 -0.13 0.00 -0.02 0.00 0.00 33.50 30.86 1nu8 n PRO 255 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1nu8 s TYR 256 N 6.81 -0.28 -0.42 6.00 6.14 -0.02 -4.54 117.35 131.03 1nu8 s TYR 256 Ca 0.99 0.16 -0.28 0.00 0.64 0.00 0.00 57.07 58.58 1nu8 s TYR 256 Cb -0.48 -0.38 0.02 0.00 0.42 0.00 0.00 41.96 41.54 1nu8 s TYR 256 CO 0.41 -0.64 1.03 -1.25 0.64 0.00 0.00 175.55 175.74 1nu8 s PRO 257 N 2.33 3.79 0.69 4.97 0.04 -1.26 -4.57 135.00 140.97 1nu8 s PRO 257 Ca 0.07 0.59 -0.04 0.00 0.04 0.00 0.00 61.00 61.66 1nu8 s PRO 257 Cb -0.16 -3.85 0.08 0.00 0.04 0.00 0.00 34.50 30.61 1nu8 s PRO 257 CO -0.15 -1.15 0.97 0.15 0.04 0.00 0.00 177.00 176.86 1nu8 s LYS 258 N 3.92 2.06 -0.22 4.56 1.02 -1.26 -1.08 119.74 128.75 1nu8 s LYS 258 Ca 0.43 -0.58 -0.35 0.00 0.02 0.00 0.00 55.97 55.49 1nu8 s LYS 258 Cb -0.10 -2.26 -0.11 0.00 -0.52 0.00 0.00 37.83 34.83 1nu8 s LYS 258 CO 0.24 -1.23 2.00 0.00 -0.92 0.00 0.00 175.35 175.44 1nu8 n ALA 259 N -2.81 0.88 -0.43 5.17 0.00 -0.35 -1.13 120.51 121.84 1nu8 n ALA 259 Ca 0.10 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1nu8 n ALA 259 Cb 0.60 -2.52 0.00 0.00 0.00 0.00 0.00 19.45 17.53 1nu8 n ALA 259 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nu8 n GLY 260 N 5.22 0.77 4.01 0.00 0.00 -1.26 -4.78 105.19 109.15 1nu8 n GLY 260 Ca 0.30 -0.10 -0.21 0.00 0.00 0.00 0.00 46.02 46.01 1nu8 n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nu8 s ALA 261 N -2.00 4.29 -0.04 4.61 0.00 -0.28 -5.01 121.76 123.32 1nu8 s ALA 261 Ca 0.00 -1.88 -0.30 0.00 0.00 0.00 0.00 51.96 49.78 1nu8 s ALA 261 Cb 0.00 -1.71 -0.06 0.00 0.00 0.00 0.00 23.12 21.35 1nu8 s ALA 261 CO 0.00 -0.97 1.65 0.08 0.00 0.00 0.00 175.76 176.51 1nu8 s VAL 262 N -2.79 3.54 0.49 0.00 1.01 -1.26 -4.93 120.40 116.46 1nu8 s VAL 262 Ca 0.62 0.70 -0.08 0.00 0.00 0.00 0.00 61.98 63.22 1nu8 s VAL 262 Cb -0.07 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.82 1nu8 s VAL 262 CO 0.40 -0.05 0.83 0.20 0.00 0.00 0.00 175.10 176.48 1nu8 s ASN 263 N 3.22 6.31 0.50 3.32 0.02 -1.26 -4.47 114.94 122.59 1nu8 s ASN 263 Ca 0.73 1.07 -0.23 0.00 -1.02 0.00 0.00 52.86 53.41 1nu8 s ASN 263 Cb -0.34 -2.31 -0.06 0.00 0.02 0.00 0.00 41.25 38.56 1nu8 s ASN 263 CO 0.30 -0.60 1.36 -2.16 0.02 0.00 0.00 177.10 176.01 1nu8 s PRO 264 N -4.64 3.43 0.68 -0.60 0.04 -1.26 -4.82 135.00 127.83 1nu8 s PRO 264 Ca 0.50 2.24 -0.02 0.00 0.04 0.00 0.00 61.00 63.76 1nu8 s PRO 264 Cb -0.10 -2.43 0.09 0.00 0.04 0.00 0.00 34.50 32.10 1nu8 s PRO 264 CO 0.44 -0.96 0.95 0.95 0.04 0.00 0.00 177.00 178.42 1nu8 s THR 265 N -1.29 2.30 -0.14 1.26 -4.23 -0.99 -4.91 115.64 107.64 1nu8 s THR 265 Ca 0.66 -0.53 -0.10 0.00 -1.18 0.00 0.00 61.69 60.54 1nu8 s THR 265 Cb -0.40 -2.77 0.04 0.00 1.34 0.00 0.00 72.50 70.71 1nu8 s THR 265 CO 0.49 0.00 0.35 0.54 -0.54 0.00 0.00 174.62 175.46 1nu8 s VAL 266 N -3.09 -0.01 0.33 2.29 0.11 -1.26 -2.36 120.40 116.42 1nu8 s VAL 266 Ca 0.63 0.05 0.08 0.00 -2.93 0.00 0.00 61.98 59.82 1nu8 s VAL 266 Cb -0.08 -0.51 -0.04 0.00 -1.53 0.00 0.00 36.38 34.22 1nu8 s VAL 266 CO 0.43 0.02 0.12 -0.54 -3.33 0.00 0.00 175.10 171.80 1nu8 s LYS 267 N 0.75 2.34 -0.06 1.54 -0.14 -0.53 -4.97 119.74 118.67 1nu8 s LYS 267 Ca -0.05 -1.55 0.03 0.00 -1.36 0.00 0.00 55.97 53.04 1nu8 s LYS 267 Cb -0.06 -2.15 0.01 0.00 -1.68 0.00 0.00 37.83 33.95 1nu8 s LYS 267 CO -0.05 0.13 -0.15 0.12 -0.76 0.00 0.00 175.35 174.64 1nu8 s PHE 268 N -2.42 1.67 0.10 3.18 5.36 -1.25 -0.82 117.98 123.80 1nu8 s PHE 268 Ca 0.37 -0.59 0.05 0.00 -0.96 0.00 0.00 56.93 55.81 1nu8 s PHE 268 Cb -0.03 -1.17 -0.04 0.00 -0.34 0.00 0.00 43.02 41.45 1nu8 s PHE 268 CO 0.22 -0.26 -0.13 -0.06 -1.46 0.00 0.00 175.22 173.53 1nu8 s PHE 269 N 0.42 1.29 -0.08 10.12 0.08 0.04 -0.05 117.98 129.80 1nu8 s PHE 269 Ca -0.12 -0.55 0.00 0.00 0.12 0.00 0.00 56.93 56.39 1nu8 s PHE 269 Cb -0.15 -0.69 0.02 0.00 -0.57 0.00 0.00 43.02 41.64 1nu8 s PHE 269 CO 0.04 0.09 -0.06 0.08 -0.10 0.00 0.00 175.22 175.27 1nu8 s VAL 270 N -1.98 0.77 -0.03 -0.44 1.01 -0.03 -0.72 120.40 118.98 1nu8 s VAL 270 Ca 0.05 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.86 1nu8 s VAL 270 Cb -0.06 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 1nu8 s VAL 270 CO 0.02 0.30 -0.05 -0.69 0.00 0.00 0.00 175.10 174.69 1nu8 s VAL 271 N 1.36 3.81 -0.37 2.92 1.01 0.02 -0.71 120.40 128.44 1nu8 s VAL 271 Ca -0.03 -0.58 -0.22 0.00 0.00 0.00 0.00 61.98 61.15 1nu8 s VAL 271 Cb -0.14 -2.62 0.01 0.00 0.00 0.00 0.00 36.38 33.63 1nu8 s VAL 271 CO -0.03 0.49 0.71 0.21 0.00 0.00 0.00 175.10 176.48 1nu8 s ASN 272 N -1.15 6.47 0.00 3.32 3.84 -1.26 -0.19 114.94 125.96 1nu8 s ASN 272 Ca 0.15 0.18 0.29 0.00 0.21 0.00 0.00 52.86 53.69 1nu8 s ASN 272 Cb -0.11 -2.36 1.24 0.00 -0.55 0.00 0.00 41.25 39.47 1nu8 s ASN 272 CO 0.05 -0.69 1.92 1.07 -2.79 0.00 0.00 177.10 176.66 1nu8 n THR 273 N 5.73 0.00 1.32 -5.21 5.66 0.19 -3.39 114.28 118.58 1nu8 n THR 273 Ca 0.01 -0.00 0.14 0.00 -3.05 0.00 0.00 64.05 61.14 1nu8 n THR 273 Cb 0.48 -0.44 0.55 0.00 -1.55 0.00 0.00 70.33 69.37 1nu8 n THR 273 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 1nu8 n ASP 274 N -1.46 0.49 -0.53 1.09 8.00 -1.24 -4.22 116.55 118.70 1nu8 n ASP 274 Ca 0.08 -0.49 0.07 0.00 0.71 0.00 0.00 54.79 55.16 1nu8 n ASP 274 Cb 0.32 -0.06 0.18 0.00 -0.02 0.00 0.00 41.12 41.54 1nu8 n ASP 274 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1nu8 n SER 275 N -1.01 1.79 -4.73 -2.24 3.41 -1.22 -5.07 113.62 104.55 1nu8 n SER 275 Ca 0.13 -3.57 -0.41 0.00 -0.26 0.00 0.00 58.87 54.75 1nu8 n SER 275 Cb 0.30 -0.49 -0.04 0.00 -0.26 0.00 0.00 64.21 63.72 1nu8 n SER 275 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1nu8 s LEU 276 N -2.91 4.47 0.16 1.04 1.43 -1.26 -5.04 118.68 116.57 1nu8 s LEU 276 Ca 0.36 1.96 0.04 0.00 -1.03 0.00 0.00 54.13 55.46 1nu8 s LEU 276 Cb 0.34 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.93 1nu8 s LEU 276 CO -0.05 -0.21 0.18 -0.55 0.23 0.00 0.00 176.35 175.95 1nu8 s SER 277 N 0.15 5.77 0.13 2.29 0.15 -1.26 -5.03 113.70 115.90 1nu8 s SER 277 Ca 0.50 -0.04 0.25 0.00 0.70 0.00 0.00 55.95 57.36 1nu8 s SER 277 Cb -0.27 -1.59 0.45 0.00 -1.71 0.00 0.00 66.02 62.90 1nu8 s SER 277 CO 0.32 0.06 1.42 -1.20 1.20 0.00 0.00 173.24 175.04 1nu8 n SER 278 N -0.41 0.72 0.00 5.45 7.64 -1.26 -4.21 113.62 121.55 1nu8 n SER 278 Ca -0.08 0.21 0.00 0.00 1.01 0.00 0.00 58.87 60.01 1nu8 n SER 278 Cb 0.54 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.71 1nu8 n SER 278 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1nu8 n VAL 279 N -2.13 0.00 -3.50 0.44 0.24 -1.26 -4.97 118.33 107.15 1nu8 n VAL 279 Ca 0.04 -0.21 -0.38 0.00 -2.04 0.00 0.00 64.34 61.75 1nu8 n VAL 279 Cb 0.44 0.73 -0.09 0.00 -1.47 0.00 0.00 33.84 33.45 1nu8 n VAL 279 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1nu8 s THR 280 N -1.06 5.26 0.21 3.34 2.01 -1.26 -5.08 115.64 119.06 1nu8 s THR 280 Ca 0.00 0.45 -0.32 0.00 0.31 0.00 0.00 61.69 62.13 1nu8 s THR 280 Cb 0.00 -3.63 -0.13 0.00 0.01 0.00 0.00 72.50 68.75 1nu8 s THR 280 CO 0.00 0.26 1.56 0.59 -0.69 0.00 0.00 174.62 176.35 1nu8 n ASN 281 N 4.64 3.29 -4.68 3.53 3.02 -1.26 -4.31 115.26 119.49 1nu8 n ASN 281 Ca -0.11 1.10 -0.38 0.00 -0.03 0.00 0.00 54.58 55.16 1nu8 n ASN 281 Cb 0.51 -1.48 0.05 0.00 -0.61 0.00 0.00 39.78 38.25 1nu8 n ASN 281 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nu8 n ALA 282 N 2.95 0.85 -2.55 5.41 0.00 -1.26 -4.99 120.51 120.93 1nu8 n ALA 282 Ca 0.14 0.06 -0.41 0.00 0.00 0.00 0.00 53.44 53.23 1nu8 n ALA 282 Cb 0.32 -2.24 -0.10 0.00 0.00 0.00 0.00 19.45 17.43 1nu8 n ALA 282 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1nu8 s THR 283 N -1.39 5.17 -0.21 0.00 2.01 -1.26 -5.01 115.64 114.94 1nu8 s THR 283 Ca 0.75 -0.48 -0.15 0.00 0.31 0.00 0.00 61.69 62.11 1nu8 s THR 283 Cb -0.42 -3.77 -0.04 0.00 0.01 0.00 0.00 72.50 68.28 1nu8 s THR 283 CO 0.47 -0.16 0.37 -0.44 -0.69 0.00 0.00 174.62 174.17 1nu8 s SER 284 N 1.68 6.39 -0.15 3.53 0.01 -1.26 -4.51 113.70 119.38 1nu8 s SER 284 Ca 0.05 0.45 -0.16 0.00 1.31 0.00 0.00 55.95 57.60 1nu8 s SER 284 Cb -0.18 -2.21 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 1nu8 s SER 284 CO 0.10 -0.07 0.39 -0.63 0.41 0.00 0.00 173.24 173.44 1nu8 s ILE 285 N 1.32 5.24 0.18 1.44 1.09 0.11 -4.86 121.20 125.72 1nu8 s ILE 285 Ca 0.17 0.75 -0.30 0.00 -1.10 0.00 0.00 60.65 60.17 1nu8 s ILE 285 Cb -0.15 -3.73 -0.07 0.00 -1.06 0.00 0.00 42.46 37.45 1nu8 s ILE 285 CO 0.08 0.34 1.07 -1.58 -0.10 0.00 0.00 174.94 174.74 1nu8 s GLN 286 N 0.69 4.62 -0.25 2.79 0.74 -1.26 -0.85 119.66 126.14 1nu8 s GLN 286 Ca 0.21 1.67 -0.06 0.00 0.05 0.00 0.00 55.36 57.23 1nu8 s GLN 286 Cb -0.14 -3.29 -0.01 0.00 1.10 0.00 0.00 33.01 30.67 1nu8 s GLN 286 CO 0.07 0.12 0.03 0.42 -0.55 0.00 0.00 175.29 175.38 1nu8 s ILE 287 N -0.29 3.81 0.28 -2.34 1.01 0.93 -4.88 121.20 119.72 1nu8 s ILE 287 Ca 0.48 -0.49 -0.24 0.00 0.00 0.00 0.00 60.65 60.40 1nu8 s ILE 287 Cb -0.28 -2.83 -0.09 0.00 0.01 0.00 0.00 42.46 39.26 1nu8 s ILE 287 CO 0.34 0.28 0.87 -0.89 0.00 0.00 0.00 174.94 175.54 1nu8 s THR 288 N 1.52 4.31 0.78 2.92 2.01 -1.26 -3.81 115.64 122.10 1nu8 s THR 288 Ca 0.05 1.69 -0.11 0.00 0.31 0.00 0.00 61.69 63.63 1nu8 s THR 288 Cb -0.16 -3.99 0.06 0.00 0.01 0.00 0.00 72.50 68.42 1nu8 s THR 288 CO 0.00 0.20 1.10 0.00 -0.69 0.00 0.00 174.62 175.23 1nu8 s ALA 289 N -1.54 2.20 0.71 7.40 0.00 -1.26 -4.99 121.76 124.28 1nu8 s ALA 289 Ca 0.47 0.31 -0.16 0.00 0.00 0.00 0.00 51.96 52.58 1nu8 s ALA 289 Cb -0.19 -3.29 0.03 0.00 0.00 0.00 0.00 23.12 19.67 1nu8 s ALA 289 CO 0.24 -1.82 1.21 -2.14 0.00 0.00 0.00 175.76 173.24 1nu8 s PRO 290 N -4.84 2.27 0.42 0.00 0.02 -1.26 -4.80 135.00 126.80 1nu8 s PRO 290 Ca 0.62 1.77 0.24 0.00 0.02 0.00 0.00 61.00 63.65 1nu8 s PRO 290 Cb -0.18 -1.85 1.28 0.00 0.02 0.00 0.00 34.50 33.77 1nu8 s PRO 290 CO 0.55 -1.74 1.68 0.00 -0.33 0.00 0.00 177.00 177.17 1nu8 h ALA 291 N -0.12 2.48 -0.00 -1.55 0.00 -1.98 0.16 119.26 118.26 1nu8 h ALA 291 Ca -0.48 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1nu8 h ALA 291 Cb 1.30 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1nu8 h ALA 291 CO 0.51 -1.03 -0.04 -1.13 0.00 0.00 0.00 179.25 177.55 1nu8 n SER 292 N -4.70 0.39 -0.05 0.00 3.41 -1.26 -2.74 113.62 108.67 1nu8 n SER 292 Ca 0.32 -0.77 -0.00 0.00 -0.26 0.00 0.00 58.87 58.16 1nu8 n SER 292 Cb 1.19 -0.07 -0.15 0.00 -0.26 0.00 0.00 64.21 64.92 1nu8 n SER 292 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1nu8 n MET 293 N -0.87 0.81 0.00 4.33 2.00 0.49 -4.50 117.12 119.39 1nu8 n MET 293 Ca 0.18 -0.09 0.15 0.00 0.00 0.00 0.00 57.70 57.94 1nu8 n MET 293 Cb 0.23 -1.47 0.79 0.00 0.00 0.00 0.00 33.22 32.76 1nu8 n MET 293 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1nu8 n LEU 294 N -2.46 0.11 0.02 4.03 4.77 -0.73 -3.37 117.00 119.37 1nu8 n LEU 294 Ca -0.18 0.14 0.10 0.00 -0.03 0.00 0.00 56.01 56.04 1nu8 n LEU 294 Cb 0.83 -0.18 0.44 0.00 -2.33 0.00 0.00 43.42 42.19 1nu8 n LEU 294 CO 0.40 0.02 0.83 2.30 -1.33 0.00 0.00 177.39 179.62 1nu8 n ILE 295 N -1.12 0.60 -3.77 -0.08 -5.35 -1.20 -4.93 119.36 103.51 1nu8 n ILE 295 Ca 0.17 0.13 -0.03 0.00 -0.27 0.00 0.00 62.75 62.75 1nu8 n ILE 295 Cb 0.21 -0.81 0.02 0.00 -1.74 0.00 0.00 39.64 37.32 1nu8 n ILE 295 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1nu8 n GLY 296 N 0.62 0.82 3.67 3.28 0.00 -1.22 -5.14 105.19 107.23 1nu8 n GLY 296 Ca 0.05 -1.11 -0.45 0.00 0.00 0.00 0.00 46.02 44.51 1nu8 n GLY 296 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nu8 n ASP 297 N -1.15 2.80 -3.83 1.61 8.00 -1.26 -4.95 116.55 117.76 1nu8 n ASP 297 Ca -0.02 1.13 -0.13 0.00 0.71 0.00 0.00 54.79 56.48 1nu8 n ASP 297 Cb 0.44 -1.42 -0.07 0.00 -0.02 0.00 0.00 41.12 40.05 1nu8 n ASP 297 CO 0.00 0.00 0.00 -1.38 -0.39 0.00 0.00 177.20 175.43 1nu8 s HIS 298 N 0.17 1.05 0.13 1.24 -3.43 -1.26 -1.69 115.29 111.50 1nu8 s HIS 298 Ca 0.71 -1.26 0.03 0.00 -0.80 0.00 0.00 55.06 53.74 1nu8 s HIS 298 Cb -0.66 -0.32 -0.04 0.00 -1.43 0.00 0.00 32.58 30.13 1nu8 s HIS 298 CO 0.47 -0.86 -0.07 0.71 -2.00 0.00 0.00 174.74 172.99 1nu8 s TYR 299 N -3.80 1.07 -0.27 0.38 2.02 -0.28 -4.85 117.35 111.61 1nu8 s TYR 299 Ca 0.34 -0.88 -0.19 0.00 -0.37 0.00 0.00 57.07 55.97 1nu8 s TYR 299 Cb 0.03 -0.59 -0.02 0.00 -0.40 0.00 0.00 41.96 40.98 1nu8 s TYR 299 CO 0.15 -0.08 0.56 -1.17 -1.57 0.00 0.00 175.55 173.44 1nu8 s LEU 300 N -3.11 4.08 -0.01 -1.29 1.98 -1.26 -1.39 118.68 117.69 1nu8 s LEU 300 Ca 0.15 0.52 0.10 0.00 -2.89 0.00 0.00 54.13 52.01 1nu8 s LEU 300 Cb 0.04 -2.73 -0.14 0.00 0.66 0.00 0.00 46.19 44.03 1nu8 s LEU 300 CO -0.02 -0.35 0.31 0.00 -1.89 0.00 0.00 176.35 174.41 1nu8 s ASP 302 N -2.62 -0.50 -0.05 0.00 -1.08 -1.21 -4.85 116.67 106.36 1nu8 s ASP 302 Ca -0.00 0.95 -0.00 0.00 -0.52 0.00 0.00 52.55 52.97 1nu8 s ASP 302 Cb 0.07 0.98 0.03 0.00 -1.46 0.00 0.00 42.92 42.53 1nu8 s ASP 302 CO 0.42 -0.16 -0.01 -0.69 0.52 0.00 0.00 175.17 175.24 1nu8 s VAL 303 N 0.31 0.39 -0.05 1.11 1.01 -1.26 -0.61 120.40 121.31 1nu8 s VAL 303 Ca 0.02 0.04 -0.00 0.00 0.00 0.00 0.00 61.98 62.03 1nu8 s VAL 303 Cb -0.05 -0.49 0.03 0.00 0.00 0.00 0.00 36.38 35.87 1nu8 s VAL 303 CO -0.06 0.22 -0.00 -0.89 0.00 0.00 0.00 175.10 174.37 1nu8 s THR 304 N 1.43 0.30 0.21 3.92 2.01 0.48 -4.99 115.64 119.00 1nu8 s THR 304 Ca -0.03 0.09 -0.30 0.00 0.31 0.00 0.00 61.69 61.76 1nu8 s THR 304 Cb -0.13 -0.42 -0.08 0.00 0.01 0.00 0.00 72.50 71.88 1nu8 s THR 304 CO -0.03 0.21 1.19 0.26 -0.69 0.00 0.00 174.62 175.56 1nu8 s TRP 305 N 1.46 3.42 -0.21 4.92 0.52 -1.26 0.90 118.94 128.68 1nu8 s TRP 305 Ca -0.03 1.46 0.02 0.00 0.02 0.00 0.00 56.10 57.57 1nu8 s TRP 305 Cb -0.13 -3.43 -0.14 0.00 -1.15 0.00 0.00 33.47 28.62 1nu8 s TRP 305 CO -0.03 -1.16 -0.19 0.00 0.02 0.00 0.00 176.95 175.59 1nu8 n ALA 306 N 2.15 1.54 -3.35 0.98 0.00 0.30 -4.88 120.51 117.26 1nu8 n ALA 306 Ca 0.03 -0.92 -0.04 0.00 0.00 0.00 0.00 53.44 52.52 1nu8 n ALA 306 Cb 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.89 1nu8 n ALA 306 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1nu8 n THR 307 N -3.12 0.00 0.30 0.00 -2.24 -1.11 -4.42 114.28 103.68 1nu8 n THR 307 Ca -0.38 -0.57 0.13 0.00 -2.27 0.00 0.00 64.05 60.96 1nu8 n THR 307 Cb 0.91 0.38 0.59 0.00 -2.10 0.00 0.00 70.33 70.10 1nu8 n THR 307 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1nu8 h GLN 308 N 0.00 0.00 0.00 -0.78 1.08 -1.96 -3.24 115.11 110.21 1nu8 h GLN 308 Ca -0.10 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.10 1nu8 h GLN 308 Cb 0.42 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.85 1nu8 h GLN 308 CO 0.13 0.00 -0.22 0.39 -0.95 0.00 0.00 178.83 178.19 1nu8 n GLU 309 N -2.37 0.31 -3.70 1.46 1.02 -1.26 -4.89 120.64 111.21 1nu8 n GLU 309 Ca 0.00 -0.94 -0.19 0.00 -0.02 0.00 0.00 57.16 56.01 1nu8 n GLU 309 Cb 0.15 -0.61 -0.18 0.00 -0.02 0.00 0.00 31.44 30.79 1nu8 n GLU 309 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1nu8 s ARG 310 N -0.28 -0.01 0.06 3.49 3.52 -1.22 -1.44 118.95 123.06 1nu8 s ARG 310 Ca 0.02 0.32 0.07 0.00 -0.13 0.00 0.00 55.73 56.01 1nu8 s ARG 310 Cb 0.02 -0.50 -0.04 0.00 -1.56 0.00 0.00 34.95 32.88 1nu8 s ARG 310 CO 0.00 -0.29 -0.15 0.42 -0.81 0.00 0.00 175.30 174.47 1nu8 s ILE 311 N 1.93 3.02 -0.17 4.11 1.01 -0.25 -0.54 121.20 130.32 1nu8 s ILE 311 Ca 0.02 -1.21 -0.05 0.00 0.00 0.00 0.00 60.65 59.41 1nu8 s ILE 311 Cb -0.12 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 39.99 1nu8 s ILE 311 CO -0.03 0.25 -0.01 -0.55 0.00 0.00 0.00 174.94 174.60 1nu8 s SER 312 N -1.73 4.93 -0.15 3.58 0.15 0.26 -1.26 113.70 119.48 1nu8 s SER 312 Ca 0.17 -0.12 -0.00 0.00 0.70 0.00 0.00 55.95 56.70 1nu8 s SER 312 Cb -0.11 -1.82 0.04 0.00 -1.71 0.00 0.00 66.02 62.42 1nu8 s SER 312 CO 0.08 0.14 -0.06 -0.76 1.20 0.00 0.00 173.24 173.84 1nu8 s LEU 313 N 0.54 1.52 -0.05 3.45 1.43 -0.63 -0.39 118.68 124.56 1nu8 s LEU 313 Ca -0.01 -0.58 -0.03 0.00 -1.03 0.00 0.00 54.13 52.47 1nu8 s LEU 313 Cb -0.14 -0.90 -0.04 0.00 0.03 0.00 0.00 46.19 45.14 1nu8 s LEU 313 CO 0.02 -0.17 0.12 -1.10 0.23 0.00 0.00 176.35 175.45 1nu8 s GLN 314 N 1.65 3.27 0.32 1.70 -0.21 0.22 0.01 119.66 126.62 1nu8 s GLN 314 Ca 0.02 -0.33 0.03 0.00 0.02 0.00 0.00 55.36 55.10 1nu8 s GLN 314 Cb -0.15 -3.02 -0.05 0.00 1.00 0.00 0.00 33.01 30.80 1nu8 s GLN 314 CO -0.08 0.70 0.09 -1.58 -2.12 0.00 0.00 175.29 172.30 1nu8 s TRP 315 N -1.15 1.77 -0.06 0.91 0.52 0.12 -2.70 118.94 118.35 1nu8 s TRP 315 Ca 0.21 -1.12 -0.12 0.00 0.02 0.00 0.00 56.10 55.09 1nu8 s TRP 315 Cb -0.12 -1.11 0.02 0.00 -1.15 0.00 0.00 33.47 31.11 1nu8 s TRP 315 CO 0.11 -0.19 0.29 -1.17 0.02 0.00 0.00 176.95 176.00 1nu8 s LEU 316 N -3.45 0.93 0.80 2.99 2.96 -0.48 -1.64 118.68 120.80 1nu8 s LEU 316 Ca 0.35 0.31 -0.12 0.00 -0.22 0.00 0.00 54.13 54.45 1nu8 s LEU 316 Cb 0.07 1.08 0.07 0.00 0.50 0.00 0.00 46.19 47.92 1nu8 s LEU 316 CO 0.15 -0.27 1.12 -0.13 -1.32 0.00 0.00 176.35 175.90 1nu8 s ARG 317 N -0.60 2.04 0.09 1.98 0.52 -0.26 -1.13 118.95 121.60 1nu8 s ARG 317 Ca -0.07 0.43 -0.10 0.00 -0.52 0.00 0.00 55.73 55.48 1nu8 s ARG 317 Cb -0.04 -1.93 -0.19 0.00 0.52 0.00 0.00 34.95 33.31 1nu8 s ARG 317 CO 0.02 -1.61 1.21 -0.09 0.02 0.00 0.00 175.30 174.86 1nu8 h ARG 318 N -1.07 0.54 -6.24 3.54 2.43 -1.65 -3.32 114.38 108.61 1nu8 h ARG 318 Ca -0.47 -0.63 -0.55 0.00 -0.81 0.00 0.00 59.98 57.52 1nu8 h ARG 318 Cb 1.29 0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 30.99 1nu8 h ARG 318 CO 0.62 1.24 1.25 0.42 -1.51 0.00 0.00 179.97 182.00 1nu8 s ILE 319 N -3.18 3.53 0.00 1.20 1.01 -1.26 -4.78 121.20 117.72 1nu8 s ILE 319 Ca -0.08 0.49 -0.03 0.00 0.00 0.00 0.00 60.65 61.03 1nu8 s ILE 319 Cb 0.07 -3.87 -0.13 0.00 0.01 0.00 0.00 42.46 38.54 1nu8 s ILE 319 CO 0.90 -0.65 2.61 0.00 0.00 0.00 0.00 174.94 177.79 1nu8 n GLN 320 N 8.59 1.38 0.07 2.79 6.02 -1.25 -3.87 117.38 131.11 1nu8 n GLN 320 Ca 0.20 -0.49 0.11 0.00 -0.01 0.00 0.00 57.00 56.82 1nu8 n GLN 320 Cb 0.49 -1.55 -0.01 0.00 1.02 0.00 0.00 30.24 30.19 1nu8 n GLN 320 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1nu8 n ASN 321 N 2.11 0.66 -3.64 1.08 3.02 -1.26 -1.58 115.26 115.65 1nu8 n ASN 321 Ca 0.21 0.16 -0.03 0.00 -0.03 0.00 0.00 54.58 54.89 1nu8 n ASN 321 Cb 0.65 0.72 -0.05 0.00 -0.61 0.00 0.00 39.78 40.49 1nu8 n ASN 321 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1nu8 s TYR 322 N -3.34 -1.26 0.06 3.10 5.04 -1.25 -1.86 117.35 117.85 1nu8 s TYR 322 Ca -0.00 2.26 0.02 0.00 -2.44 0.00 0.00 57.07 56.90 1nu8 s TYR 322 Cb 0.11 0.75 -0.03 0.00 0.35 0.00 0.00 41.96 43.15 1nu8 s TYR 322 CO 0.80 -0.62 -0.07 0.45 -1.34 0.00 0.00 175.55 174.77 1nu8 s SER 323 N 2.54 0.92 -0.02 4.32 0.15 -0.57 -1.10 113.70 119.94 1nu8 s SER 323 Ca -0.07 -0.75 0.02 0.00 0.70 0.00 0.00 55.95 55.85 1nu8 s SER 323 Cb -0.10 0.07 0.00 0.00 -1.71 0.00 0.00 66.02 64.28 1nu8 s SER 323 CO -0.19 -0.33 -0.09 -0.69 1.20 0.00 0.00 173.24 173.14 1nu8 s VAL 324 N -2.41 0.76 -0.20 4.45 1.01 -0.65 -2.08 120.40 121.28 1nu8 s VAL 324 Ca -0.01 -0.35 -0.05 0.00 0.00 0.00 0.00 61.98 61.57 1nu8 s VAL 324 Cb -0.03 -0.68 -0.02 0.00 0.00 0.00 0.00 36.38 35.65 1nu8 s VAL 324 CO -0.02 0.24 -0.00 -0.32 0.00 0.00 0.00 175.10 174.99 1nu8 s MET 325 N 0.17 3.60 -0.14 2.72 -2.45 0.11 0.14 119.30 123.45 1nu8 s MET 325 Ca -0.03 -0.53 -0.04 0.00 -1.25 0.00 0.00 55.69 53.85 1nu8 s MET 325 Cb -0.08 -3.08 -0.03 0.00 1.25 0.00 0.00 34.83 32.89 1nu8 s MET 325 CO 0.00 -0.01 -0.01 0.34 1.05 0.00 0.00 175.02 176.39 1nu8 s ASP 326 N 1.05 5.04 -0.35 1.11 -1.08 0.10 -0.99 116.67 121.55 1nu8 s ASP 326 Ca 0.02 -0.02 -0.07 0.00 -0.52 0.00 0.00 52.55 51.96 1nu8 s ASP 326 Cb -0.14 -1.70 0.04 0.00 -1.46 0.00 0.00 42.92 39.65 1nu8 s ASP 326 CO 0.01 0.23 0.13 -0.63 0.52 0.00 0.00 175.17 175.43 1nu8 s ILE 327 N -0.01 3.97 -0.21 4.11 1.01 -1.26 -1.60 121.20 127.21 1nu8 s ILE 327 Ca 0.02 -1.05 -0.08 0.00 0.00 0.00 0.00 60.65 59.53 1nu8 s ILE 327 Cb -0.13 -3.23 -0.04 0.00 0.01 0.00 0.00 42.46 39.07 1nu8 s ILE 327 CO 0.02 -0.18 0.09 0.00 0.00 0.00 0.00 174.94 174.87 1nu8 s ASP 329 N 0.71 5.96 -0.26 0.00 1.11 -0.06 -1.09 116.67 123.04 1nu8 s ASP 329 Ca 0.05 0.08 -0.11 0.00 0.18 0.00 0.00 52.55 52.75 1nu8 s ASP 329 Cb -0.13 -1.71 -0.05 0.00 1.07 0.00 0.00 42.92 42.10 1nu8 s ASP 329 CO 0.02 0.12 0.18 -0.47 1.18 0.00 0.00 175.17 176.19 1nu8 s TYR 330 N -1.60 3.27 -0.27 4.23 5.04 -0.52 -1.22 117.35 126.28 1nu8 s TYR 330 Ca 0.33 0.17 -0.29 0.00 -2.44 0.00 0.00 57.07 54.83 1nu8 s TYR 330 Cb -0.12 -2.33 0.00 0.00 0.35 0.00 0.00 41.96 39.87 1nu8 s TYR 330 CO 0.26 -0.05 1.19 0.34 -1.34 0.00 0.00 175.55 175.95 1nu8 s ASP 331 N 1.42 6.86 0.12 4.32 2.15 0.20 -4.94 116.67 126.81 1nu8 s ASP 331 Ca 0.07 1.29 -0.19 0.00 0.43 0.00 0.00 52.55 54.16 1nu8 s ASP 331 Cb -0.15 -2.54 -0.05 0.00 -0.30 0.00 0.00 42.92 39.88 1nu8 s ASP 331 CO 0.08 -0.90 1.74 1.05 -0.17 0.00 0.00 175.17 176.97 1nu8 h GLU 332 N 8.46 0.37 -0.08 4.34 9.09 -1.98 -1.19 114.58 133.60 1nu8 h GLU 332 Ca -0.24 -0.04 -0.23 0.00 0.05 0.00 0.00 59.36 58.90 1nu8 h GLU 332 Cb 1.08 -0.08 0.01 0.00 -1.65 0.00 0.00 28.75 28.12 1nu8 h GLU 332 CO 1.01 0.30 -0.88 0.66 0.05 0.00 0.00 179.01 180.15 1nu8 h SER 333 N 0.33 0.84 0.57 3.06 4.64 -1.98 -3.35 113.55 117.66 1nu8 h SER 333 Ca 0.10 -0.60 -0.27 0.00 -0.47 0.00 0.00 61.79 60.54 1nu8 h SER 333 Cb 0.03 -0.25 -0.05 0.00 -0.31 0.00 0.00 62.40 61.83 1nu8 h SER 333 CO -0.02 1.40 -1.60 -1.28 -0.87 0.00 0.00 176.83 174.46 1nu8 h SER 334 N 0.43 0.00 0.00 4.97 0.87 -1.98 -3.48 113.55 114.37 1nu8 h SER 334 Ca -0.08 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 1nu8 h SER 334 Cb 1.51 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.47 1nu8 h SER 334 CO 0.17 0.96 0.00 0.61 -0.53 0.00 0.00 176.83 178.04 1nu8 n GLY 335 N 1.52 0.44 3.98 5.77 0.00 -0.45 -5.03 105.19 111.42 1nu8 n GLY 335 Ca -0.14 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.68 1nu8 n GLY 335 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1nu8 s ARG 336 N -0.29 3.16 -0.21 1.61 3.52 -1.25 -4.90 118.95 120.58 1nu8 s ARG 336 Ca 0.00 -0.86 -0.00 0.00 -0.13 0.00 0.00 55.73 54.73 1nu8 s ARG 336 Cb 0.00 -2.78 0.02 0.00 -1.56 0.00 0.00 34.95 30.64 1nu8 s ARG 336 CO 0.00 0.05 -0.13 -1.58 -0.81 0.00 0.00 175.30 172.83 1nu8 s TRP 337 N -2.22 2.94 -0.12 5.12 0.52 -1.26 -0.63 118.94 123.29 1nu8 s TRP 337 Ca 0.44 -1.60 -0.02 0.00 0.02 0.00 0.00 56.10 54.94 1nu8 s TRP 337 Cb -0.10 -1.99 -0.03 0.00 -1.15 0.00 0.00 33.47 30.21 1nu8 s TRP 337 CO 0.32 -0.76 -0.03 -0.80 0.02 0.00 0.00 176.95 175.70 1nu8 s ASN 338 N 1.31 4.89 -0.41 2.95 0.01 -0.36 -4.89 114.94 118.43 1nu8 s ASN 338 Ca 0.02 -0.03 -0.04 0.00 -0.71 0.00 0.00 52.86 52.10 1nu8 s ASN 338 Cb -0.15 -1.57 0.11 0.00 0.41 0.00 0.00 41.25 40.04 1nu8 s ASN 338 CO -0.08 0.26 0.20 0.00 -1.51 0.00 0.00 177.10 175.97 1nu8 s LEU 340 N 1.18 4.38 0.22 0.00 1.02 -1.26 -4.93 118.68 119.29 1nu8 s LEU 340 Ca 0.07 2.54 -0.08 0.00 0.02 0.00 0.00 54.13 56.67 1nu8 s LEU 340 Cb -0.23 -3.55 0.34 0.00 0.02 0.00 0.00 46.19 42.76 1nu8 s LEU 340 CO -0.03 -0.95 1.71 0.58 0.02 0.00 0.00 176.35 177.67 1nu8 h VAL 341 N 5.04 0.63 0.00 -1.59 2.07 -1.98 0.12 116.25 120.54 1nu8 h VAL 341 Ca -0.44 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1nu8 h VAL 341 Cb 1.21 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 1nu8 h VAL 341 CO 0.94 0.05 0.00 0.00 0.02 0.00 0.00 177.57 178.58 1nu8 n ALA 342 N -2.60 1.62 0.21 1.67 0.00 -1.26 -1.08 120.51 119.08 1nu8 n ALA 342 Ca 0.10 -0.02 0.02 0.00 0.00 0.00 0.00 53.44 53.55 1nu8 n ALA 342 Cb 0.35 -1.05 -0.01 0.00 0.00 0.00 0.00 19.45 18.74 1nu8 n ALA 342 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1nu8 n ARG 343 N -0.90 4.11 -0.97 0.00 0.63 0.40 -4.87 116.66 115.05 1nu8 n ARG 343 Ca 0.02 -0.20 -0.30 0.00 -0.92 0.00 0.00 57.85 56.46 1nu8 n ARG 343 Cb 0.01 -0.80 0.16 0.00 0.45 0.00 0.00 32.46 32.28 1nu8 n ARG 343 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 1nu8 s GLN 344 N -1.16 0.88 -0.05 -0.14 -0.21 -0.24 -4.57 119.66 114.17 1nu8 s GLN 344 Ca 0.03 1.03 -0.01 0.00 0.02 0.00 0.00 55.36 56.42 1nu8 s GLN 344 Cb 0.03 -1.75 0.03 0.00 1.00 0.00 0.00 33.01 32.32 1nu8 s GLN 344 CO 0.15 -2.56 0.02 -1.01 -2.12 0.00 0.00 175.29 169.77 1nu8 s HIS 345 N -2.78 0.40 -0.05 0.91 3.76 -0.17 -4.97 115.29 112.40 1nu8 s HIS 345 Ca 0.65 0.00 -0.01 0.00 -0.15 0.00 0.00 55.06 55.55 1nu8 s HIS 345 Cb -0.20 -0.59 -0.04 0.00 1.11 0.00 0.00 32.58 32.86 1nu8 s HIS 345 CO 0.59 -0.23 0.03 0.42 -0.85 0.00 0.00 174.74 174.70 1nu8 s ILE 346 N 1.72 4.49 -0.04 0.60 1.01 -1.26 0.08 121.20 127.79 1nu8 s ILE 346 Ca 0.00 -0.33 0.02 0.00 0.00 0.00 0.00 60.65 60.35 1nu8 s ILE 346 Cb -0.13 -2.96 0.01 0.00 0.01 0.00 0.00 42.46 39.39 1nu8 s ILE 346 CO -0.03 0.49 -0.08 -1.61 0.00 0.00 0.00 174.94 173.70 1nu8 s GLU 347 N -1.26 1.12 0.14 2.79 2.02 -0.88 -5.02 118.70 117.59 1nu8 s GLU 347 Ca 0.17 -0.27 0.03 0.00 0.02 0.00 0.00 54.97 54.92 1nu8 s GLU 347 Cb -0.12 -1.01 -0.04 0.00 0.10 0.00 0.00 34.13 33.06 1nu8 s GLU 347 CO 0.07 0.03 -0.06 -1.64 0.02 0.00 0.00 175.26 173.68 1nu8 s MET 348 N 0.55 0.99 -0.01 1.61 -1.94 -1.26 -1.51 119.30 117.73 1nu8 s MET 348 Ca -0.09 -1.43 -0.02 0.00 -1.71 0.00 0.00 55.69 52.44 1nu8 s MET 348 Cb -0.13 -0.37 -0.00 0.00 2.01 0.00 0.00 34.83 36.34 1nu8 s MET 348 CO 0.01 -0.01 0.04 0.45 -0.01 0.00 0.00 175.02 175.50 1nu8 s SER 349 N -3.12 0.03 -0.00 3.03 0.15 -0.78 -5.00 113.70 108.00 1nu8 s SER 349 Ca 0.17 -0.07 0.14 0.00 0.70 0.00 0.00 55.95 56.88 1nu8 s SER 349 Cb 0.05 0.11 -0.17 0.00 -1.71 0.00 0.00 66.02 64.30 1nu8 s SER 349 CO -0.01 -0.12 0.56 0.41 1.20 0.00 0.00 173.24 175.28 1nu8 n THR 350 N 2.55 0.00 -0.01 6.45 -1.04 -1.26 -4.52 114.28 116.44 1nu8 n THR 350 Ca -0.16 -0.19 -0.05 0.00 -2.04 0.00 0.00 64.05 61.61 1nu8 n THR 350 Cb 0.58 0.86 -0.12 0.00 -1.82 0.00 0.00 70.33 69.83 1nu8 n THR 350 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1nu8 n THR 351 N -1.45 1.39 0.00 12.58 -1.04 -1.26 -5.05 114.28 119.45 1nu8 n THR 351 Ca 0.02 -0.76 0.00 0.00 -2.04 0.00 0.00 64.05 61.27 1nu8 n THR 351 Cb 0.25 -0.84 0.00 0.00 -1.82 0.00 0.00 70.33 67.92 1nu8 n THR 351 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nu8 n GLY 352 N 1.51 1.50 3.81 3.41 0.00 -1.26 -4.84 105.19 109.32 1nu8 n GLY 352 Ca -0.15 0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 1nu8 n GLY 352 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1nu8 s TRP 353 N 1.52 2.70 -0.36 1.61 -2.14 -1.26 -4.65 118.94 116.36 1nu8 s TRP 353 Ca 0.00 -0.48 -0.24 0.00 2.66 0.00 0.00 56.10 58.04 1nu8 s TRP 353 Cb 0.00 -1.98 0.01 0.00 -3.10 0.00 0.00 33.47 28.40 1nu8 s TRP 353 CO 0.00 0.08 0.83 0.08 -2.66 0.00 0.00 176.95 175.28 1nu8 s VAL 354 N -2.48 4.69 0.00 -0.66 1.01 -0.61 -4.87 120.40 117.48 1nu8 s VAL 354 Ca 0.43 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.43 1nu8 s VAL 354 Cb -0.01 -4.24 0.00 0.00 0.00 0.00 0.00 36.38 32.12 1nu8 s VAL 354 CO 0.25 -0.45 0.00 0.61 0.00 0.00 0.00 175.10 175.52 1nu8 n GLY 355 N 4.45 -0.65 0.19 4.51 0.00 -1.26 -2.80 105.19 109.63 1nu8 n GLY 355 Ca 0.04 -1.70 -0.10 0.00 0.00 0.00 0.00 46.02 44.27 1nu8 n GLY 355 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1nu8 h ARG 356 N 0.00 0.59 0.00 1.61 3.08 -1.95 -3.40 114.38 114.31 1nu8 h ARG 356 Ca 0.00 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.92 1nu8 h ARG 356 Cb 0.00 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 29.97 1nu8 h ARG 356 CO 0.00 0.61 -0.26 1.19 -1.07 0.00 0.00 179.97 180.45 1nu8 n PHE 357 N -4.61 0.00 -3.74 3.04 3.72 -1.26 -4.86 117.46 109.75 1nu8 n PHE 357 Ca -0.01 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.30 1nu8 n PHE 357 Cb 0.19 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.70 1nu8 n PHE 357 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1nu8 s ARG 358 N -0.63 1.50 0.36 -1.08 1.70 -1.26 -5.05 118.95 114.49 1nu8 s ARG 358 Ca 0.00 -0.86 -0.27 0.00 -0.47 0.00 0.00 55.73 54.12 1nu8 s ARG 358 Cb 0.00 0.56 -0.12 0.00 -0.57 0.00 0.00 34.95 34.82 1nu8 s ARG 358 CO 0.00 -0.66 1.30 -2.30 -1.08 0.00 0.00 175.30 172.57 1nu8 n PRO 359 N -0.39 2.13 -0.63 3.89 -0.02 -1.12 -4.16 135.00 134.70 1nu8 n PRO 359 Ca -0.09 0.75 -0.29 0.00 -2.02 0.00 0.00 63.50 61.85 1nu8 n PRO 359 Cb 0.62 -2.37 0.22 0.00 -0.02 0.00 0.00 33.50 31.95 1nu8 n PRO 359 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1nu8 s SER 360 N -0.34 1.75 -0.11 2.55 1.04 -1.26 -4.97 113.70 112.36 1nu8 s SER 360 Ca 0.56 1.75 -0.11 0.00 0.48 0.00 0.00 55.95 58.63 1nu8 s SER 360 Cb -0.55 -2.39 -0.05 0.00 0.10 0.00 0.00 66.02 63.14 1nu8 s SER 360 CO 0.62 -3.76 0.25 -0.70 0.98 0.00 0.00 173.24 170.63 1nu8 s GLU 361 N -4.55 3.87 0.28 4.02 2.12 -1.26 -4.96 118.70 118.22 1nu8 s GLU 361 Ca 0.68 0.06 -0.28 0.00 0.36 0.00 0.00 54.97 55.79 1nu8 s GLU 361 Cb -0.24 -3.29 -0.09 0.00 0.26 0.00 0.00 34.13 30.77 1nu8 s GLU 361 CO 0.62 0.56 0.94 -1.25 -0.54 0.00 0.00 175.26 175.58 1nu8 s PRO 362 N -0.48 4.70 -0.22 4.30 0.04 -1.26 -4.55 135.00 137.54 1nu8 s PRO 362 Ca 0.17 1.39 -0.00 0.00 0.04 0.00 0.00 61.00 62.60 1nu8 s PRO 362 Cb -0.13 -3.02 0.02 0.00 0.04 0.00 0.00 34.50 31.41 1nu8 s PRO 362 CO 0.06 0.39 -0.11 -1.01 0.04 0.00 0.00 177.00 176.36 1nu8 s HIS 363 N -1.42 2.97 0.07 0.56 3.76 -0.14 -4.94 115.29 116.15 1nu8 s HIS 363 Ca 0.46 -1.59 -0.08 0.00 -0.15 0.00 0.00 55.06 53.70 1nu8 s HIS 363 Cb -0.22 -2.00 -0.05 0.00 1.11 0.00 0.00 32.58 31.42 1nu8 s HIS 363 CO 0.27 -0.75 0.35 -0.06 -0.85 0.00 0.00 174.74 173.70 1nu8 s PHE 364 N 1.31 3.56 0.83 1.40 0.40 -1.26 -0.07 117.98 124.15 1nu8 s PHE 364 Ca 0.02 0.68 -0.13 0.00 -0.60 0.00 0.00 56.93 56.89 1nu8 s PHE 364 Cb -0.15 -2.08 0.06 0.00 0.51 0.00 0.00 43.02 41.36 1nu8 s PHE 364 CO -0.07 0.54 0.94 0.25 0.70 0.00 0.00 175.22 177.57 1nu8 n THR 365 N 0.83 1.44 -0.14 0.64 -2.24 -0.39 -4.90 114.28 109.53 1nu8 n THR 365 Ca -0.08 -0.22 -0.04 0.00 -2.27 0.00 0.00 64.05 61.45 1nu8 n THR 365 Cb 0.52 -1.00 0.03 0.00 -2.10 0.00 0.00 70.33 67.78 1nu8 n THR 365 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1nu8 h LEU 366 N -1.02 -0.45 -2.25 3.22 5.85 -1.91 -1.28 115.31 117.47 1nu8 h LEU 366 Ca -0.45 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 1nu8 h LEU 366 Cb 1.30 0.29 -0.00 0.00 0.37 0.00 0.00 40.66 42.63 1nu8 h LEU 366 CO 0.43 -0.16 -0.05 -2.24 -0.34 0.00 0.00 178.44 176.08 1nu8 h ASP 367 N -0.01 0.00 0.00 1.25 3.04 -1.91 -3.46 116.42 115.33 1nu8 h ASP 367 Ca 0.22 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.01 1nu8 h ASP 367 Cb 0.35 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.64 1nu8 h ASP 367 CO -0.48 0.05 0.00 0.61 -2.04 0.00 0.00 179.24 177.38 1nu8 n GLY 368 N -0.78 0.55 0.07 7.15 0.00 -0.48 -4.93 105.19 106.77 1nu8 n GLY 368 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.12 1nu8 n GLY 368 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1nu8 n ASN 369 N 0.00 0.60 -3.91 1.61 3.02 -1.26 -4.93 115.26 110.40 1nu8 n ASN 369 Ca 0.00 -0.39 -0.10 0.00 -0.03 0.00 0.00 54.58 54.07 1nu8 n ASN 369 Cb 0.00 0.17 -0.05 0.00 -0.61 0.00 0.00 39.78 39.29 1nu8 n ASN 369 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1nu8 s SER 370 N -2.85 -0.01 0.22 6.41 1.04 -1.26 -1.01 113.70 116.24 1nu8 s SER 370 Ca 0.15 -0.99 -0.17 0.00 0.48 0.00 0.00 55.95 55.42 1nu8 s SER 370 Cb 0.18 0.60 0.02 0.00 0.10 0.00 0.00 66.02 66.92 1nu8 s SER 370 CO 0.64 -1.17 0.55 0.72 0.98 0.00 0.00 173.24 174.96 1nu8 s PHE 371 N -3.89 -0.04 -0.00 5.02 -0.71 -0.53 -1.26 117.98 116.58 1nu8 s PHE 371 Ca 0.23 -0.33 0.05 0.00 -1.04 0.00 0.00 56.93 55.85 1nu8 s PHE 371 Cb -0.01 0.41 -0.02 0.00 -1.21 0.00 0.00 43.02 42.19 1nu8 s PHE 371 CO 0.10 -0.99 -0.17 0.71 -1.34 0.00 0.00 175.22 173.53 1nu8 s TYR 372 N -3.91 1.54 -0.23 3.49 1.51 0.90 -0.97 117.35 119.69 1nu8 s TYR 372 Ca 0.12 -0.30 -0.26 0.00 -1.01 0.00 0.00 57.07 55.62 1nu8 s TYR 372 Cb -0.02 -0.98 0.07 0.00 -0.11 0.00 0.00 41.96 40.93 1nu8 s TYR 372 CO 0.01 -0.01 0.72 0.21 -1.11 0.00 0.00 175.55 175.37 1nu8 s LYS 373 N -0.55 0.87 0.06 -0.62 2.20 -0.67 -0.96 119.74 120.08 1nu8 s LYS 373 Ca 0.06 0.85 -0.30 0.00 -0.36 0.00 0.00 55.97 56.22 1nu8 s LYS 373 Cb -0.07 0.42 -0.05 0.00 -1.51 0.00 0.00 37.83 36.62 1nu8 s LYS 373 CO -0.00 -0.14 1.08 0.42 -0.36 0.00 0.00 175.35 176.34 1nu8 s ILE 374 N 0.07 4.36 -0.06 5.43 1.01 -1.26 -0.79 121.20 129.97 1nu8 s ILE 374 Ca -0.02 1.77 -0.06 0.00 0.00 0.00 0.00 60.65 62.34 1nu8 s ILE 374 Cb -0.04 -4.14 0.01 0.00 0.01 0.00 0.00 42.46 38.31 1nu8 s ILE 374 CO 0.03 0.18 0.16 -0.63 0.00 0.00 0.00 174.94 174.68 1nu8 s ILE 375 N 0.70 0.01 -0.02 2.92 -1.09 0.64 -4.68 121.20 119.69 1nu8 s ILE 375 Ca 0.53 -0.07 -0.30 0.00 -2.23 0.00 0.00 60.65 58.58 1nu8 s ILE 375 Cb -0.26 -0.26 -0.05 0.00 -1.58 0.00 0.00 42.46 40.32 1nu8 s ILE 375 CO 0.30 -0.04 1.34 -0.55 -1.23 0.00 0.00 174.94 174.76 1nu8 s SER 376 N -0.06 6.91 1.00 3.58 0.15 -1.26 -1.00 113.70 123.02 1nu8 s SER 376 Ca -0.02 2.02 -0.07 0.00 0.70 0.00 0.00 55.95 58.59 1nu8 s SER 376 Cb -0.02 -2.56 0.09 0.00 -1.71 0.00 0.00 66.02 61.82 1nu8 s SER 376 CO 0.00 -0.68 0.54 -0.46 1.20 0.00 0.00 173.24 173.85 1nu8 n ASN 377 N 5.30 0.03 -0.26 5.45 2.04 0.02 -4.87 115.26 122.98 1nu8 n ASN 377 Ca 0.12 -1.19 -0.07 0.00 -0.44 0.00 0.00 54.58 53.00 1nu8 n ASN 377 Cb 0.44 -0.42 0.06 0.00 -2.53 0.00 0.00 39.78 37.34 1nu8 n ASN 377 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 1nu8 h GLU 378 N 0.00 1.15 0.00 -3.83 5.08 -1.95 -2.03 114.58 113.00 1nu8 h GLU 378 Ca -0.18 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 1nu8 h GLU 378 Cb 0.48 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1nu8 h GLU 378 CO 0.12 0.98 0.00 0.39 -1.00 0.00 0.00 179.01 179.51 1nu8 n GLU 379 N -4.25 0.21 -0.13 2.33 4.71 -1.26 -4.87 120.64 117.39 1nu8 n GLU 379 Ca 0.06 0.11 0.00 0.00 -0.01 0.00 0.00 57.16 57.32 1nu8 n GLU 379 Cb 0.24 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.17 1nu8 n GLU 379 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1nu8 n GLY 380 N 0.47 0.93 3.62 0.62 0.00 -0.76 -4.81 105.19 105.26 1nu8 n GLY 380 Ca 0.08 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 1nu8 n GLY 380 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nu8 s TYR 381 N -2.00 3.25 -0.14 1.61 1.51 -1.26 -0.59 117.35 119.73 1nu8 s TYR 381 Ca 0.00 0.05 -0.29 0.00 -1.01 0.00 0.00 57.07 55.82 1nu8 s TYR 381 Cb 0.00 -2.14 -0.03 0.00 -0.11 0.00 0.00 41.96 39.68 1nu8 s TYR 381 CO 0.00 0.08 1.38 1.03 -1.11 0.00 0.00 175.55 176.93 1nu8 s ARG 382 N 0.66 4.21 0.18 -0.62 0.52 -1.26 -0.80 118.95 121.84 1nu8 s ARG 382 Ca 0.04 1.81 -0.04 0.00 -0.52 0.00 0.00 55.73 57.03 1nu8 s ARG 382 Cb -0.13 -3.84 -0.03 0.00 0.52 0.00 0.00 34.95 31.47 1nu8 s ARG 382 CO 0.01 -0.76 0.19 -1.01 0.02 0.00 0.00 175.30 173.75 1nu8 s HIS 383 N 3.70 0.86 -0.11 -0.53 3.76 -0.17 -1.06 115.29 121.74 1nu8 s HIS 383 Ca 0.60 -1.16 -0.22 0.00 -0.15 0.00 0.00 55.06 54.14 1nu8 s HIS 383 Cb -0.25 -0.36 -0.03 0.00 1.11 0.00 0.00 32.58 33.05 1nu8 s HIS 383 CO 0.19 -0.67 0.67 0.42 -0.85 0.00 0.00 174.74 174.49 1nu8 s ILE 384 N -4.08 5.05 -0.10 0.60 1.01 -1.26 -0.26 121.20 122.15 1nu8 s ILE 384 Ca 0.30 1.34 0.00 0.00 0.00 0.00 0.00 60.65 62.29 1nu8 s ILE 384 Cb 0.05 -4.00 -0.02 0.00 0.01 0.00 0.00 42.46 38.50 1nu8 s ILE 384 CO 0.07 0.22 -0.10 0.00 0.00 0.00 0.00 174.94 175.12 1nu8 s TYR 386 N -0.12 3.34 -0.04 0.00 5.04 0.14 -1.67 117.35 124.05 1nu8 s TYR 386 Ca -0.00 0.58 0.05 0.00 -2.44 0.00 0.00 57.07 55.25 1nu8 s TYR 386 Cb -0.13 -2.55 -0.02 0.00 0.35 0.00 0.00 41.96 39.60 1nu8 s TYR 386 CO 0.03 -0.07 -0.17 -0.06 -1.34 0.00 0.00 175.55 173.93 1nu8 s PHE 387 N 1.54 2.61 -0.06 4.97 0.40 -0.14 -1.30 117.98 125.99 1nu8 s PHE 387 Ca 0.18 -0.23 -0.06 0.00 -0.60 0.00 0.00 56.93 56.23 1nu8 s PHE 387 Cb -0.15 -1.59 -0.04 0.00 0.51 0.00 0.00 43.02 41.75 1nu8 s PHE 387 CO 0.08 0.14 0.18 -0.65 0.70 0.00 0.00 175.22 175.67 1nu8 s GLN 388 N -0.74 3.48 0.08 0.44 -0.21 -1.26 -1.45 119.66 120.00 1nu8 s GLN 388 Ca 0.11 -0.16 -0.18 0.00 0.02 0.00 0.00 55.36 55.15 1nu8 s GLN 388 Cb -0.10 -3.14 -0.09 0.00 1.00 0.00 0.00 33.01 30.67 1nu8 s GLN 388 CO 0.00 0.72 1.47 0.82 -2.12 0.00 0.00 175.29 176.18 1nu8 h ILE 389 N 3.45 1.29 0.02 1.08 2.04 -1.43 -3.16 117.51 120.79 1nu8 h ILE 389 Ca -0.52 -1.11 -0.27 0.00 1.00 0.00 0.00 64.86 63.96 1nu8 h ILE 389 Cb 1.21 1.49 0.02 0.00 -0.74 0.00 0.00 36.82 38.80 1nu8 h ILE 389 CO 0.63 0.35 -1.07 0.44 0.00 0.00 0.00 178.15 178.49 1nu8 h ASP 390 N 0.24 0.86 -3.48 1.72 3.32 -1.89 -3.44 116.42 113.74 1nu8 h ASP 390 Ca 0.06 -0.71 -0.43 0.00 0.02 0.00 0.00 57.03 55.97 1nu8 h ASP 390 Cb 0.56 -0.27 0.19 0.00 0.22 0.00 0.00 39.33 40.03 1nu8 h ASP 390 CO 0.03 1.51 0.08 -0.54 -1.72 0.00 0.00 179.24 178.60 1nu8 s LYS 391 N -3.25 -0.70 0.00 3.56 -0.14 -1.20 -4.85 119.74 113.16 1nu8 s LYS 391 Ca -0.09 0.51 0.00 0.00 -1.36 0.00 0.00 55.97 55.03 1nu8 s LYS 391 Cb 0.07 -1.61 0.00 0.00 -1.68 0.00 0.00 37.83 34.61 1nu8 s LYS 391 CO 0.92 -3.49 0.00 1.63 -0.76 0.00 0.00 175.35 173.64 1nu8 n LYS 392 N -4.71 0.00 -2.14 1.68 4.01 -1.26 -4.73 118.16 111.01 1nu8 n LYS 392 Ca 0.05 0.00 -0.26 0.00 -0.51 0.00 0.00 58.31 57.59 1nu8 n LYS 392 Cb 0.57 -0.79 0.07 0.00 -0.51 0.00 0.00 35.03 34.37 1nu8 n LYS 392 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1nu8 s ASP 393 N -4.31 4.75 0.30 4.39 1.01 -1.26 -4.99 116.67 116.57 1nu8 s ASP 393 Ca 0.00 0.51 0.04 0.00 0.71 0.00 0.00 52.55 53.81 1nu8 s ASP 393 Cb 0.00 -1.13 -0.06 0.00 1.01 0.00 0.00 42.92 42.74 1nu8 s ASP 393 CO 0.00 -1.66 0.03 0.00 0.21 0.00 0.00 175.17 173.75 1nu8 s THR 395 N -3.27 4.07 -0.00 0.00 2.01 -0.42 -4.92 115.64 113.10 1nu8 s THR 395 Ca 0.34 -0.29 -0.28 0.00 0.31 0.00 0.00 61.69 61.77 1nu8 s THR 395 Cb 0.08 -2.79 -0.04 0.00 0.01 0.00 0.00 72.50 69.76 1nu8 s THR 395 CO 0.14 0.49 0.89 -0.36 -0.69 0.00 0.00 174.62 175.08 1nu8 s PHE 396 N 0.34 3.66 -0.44 4.92 0.08 -1.26 0.28 117.98 125.56 1nu8 s PHE 396 Ca -0.03 1.57 0.14 0.00 0.12 0.00 0.00 56.93 58.73 1nu8 s PHE 396 Cb -0.14 -3.00 -0.17 0.00 -0.57 0.00 0.00 43.02 39.13 1nu8 s PHE 396 CO 0.02 0.06 0.49 -0.89 -0.10 0.00 0.00 175.22 174.81 1nu8 n ILE 397 N 3.67 0.00 -4.07 0.64 -0.00 -0.19 -4.94 119.36 114.47 1nu8 n ILE 397 Ca 0.03 -0.23 -0.09 0.00 -0.00 0.00 0.00 62.75 62.47 1nu8 n ILE 397 Cb 0.51 0.72 -0.10 0.00 -0.00 0.00 0.00 39.64 40.76 1nu8 n ILE 397 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.55 176.97 1nu8 s THR 398 N -2.54 0.29 0.22 1.39 -4.23 -1.25 -4.88 115.64 104.65 1nu8 s THR 398 Ca 0.02 -1.52 -0.13 0.00 -1.18 0.00 0.00 61.69 58.87 1nu8 s THR 398 Cb 0.10 -1.13 0.00 0.00 1.34 0.00 0.00 72.50 72.82 1nu8 s THR 398 CO 0.58 -0.79 0.45 -1.59 -0.54 0.00 0.00 174.62 172.73 1nu8 s LYS 399 N -3.04 1.42 0.00 3.99 -2.85 -1.26 -4.61 119.74 113.39 1nu8 s LYS 399 Ca 0.00 -1.13 0.00 0.00 -1.00 0.00 0.00 55.97 53.84 1nu8 s LYS 399 Cb 0.01 0.46 0.00 0.00 -2.06 0.00 0.00 37.83 36.25 1nu8 s LYS 399 CO -0.06 -0.58 0.00 0.41 0.10 0.00 0.00 175.35 175.22 1nu8 n GLY 400 N -0.33 1.47 2.11 0.59 0.00 -1.26 -4.85 105.19 102.91 1nu8 n GLY 400 Ca -0.05 -2.26 -0.21 0.00 0.00 0.00 0.00 46.02 43.50 1nu8 n GLY 400 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1nu8 n THR 401 N -0.96 3.01 -4.02 2.61 -1.04 -1.26 -4.79 114.28 107.83 1nu8 n THR 401 Ca 0.00 -2.15 -0.10 0.00 -2.04 0.00 0.00 64.05 59.76 1nu8 n THR 401 Cb 0.00 -1.40 -0.05 0.00 -1.82 0.00 0.00 70.33 67.06 1nu8 n THR 401 CO 0.00 0.00 0.00 -1.66 -0.64 0.00 0.00 175.07 172.77 1nu8 s TRP 402 N -1.96 0.52 0.20 -1.42 1.48 -1.26 -5.05 118.94 111.44 1nu8 s TRP 402 Ca 0.42 -0.86 0.09 0.00 -1.06 0.00 0.00 56.10 54.68 1nu8 s TRP 402 Cb 0.31 0.10 -0.04 0.00 -1.16 0.00 0.00 33.47 32.67 1nu8 s TRP 402 CO -0.07 -1.00 -0.17 -1.21 -4.06 0.00 0.00 176.95 170.44 1nu8 s GLU 403 N -3.85 1.35 0.00 3.25 2.02 -1.26 -4.64 118.70 115.57 1nu8 s GLU 403 Ca 0.25 -1.52 -0.17 0.00 0.02 0.00 0.00 54.97 53.54 1nu8 s GLU 403 Cb -0.00 -1.31 -0.06 0.00 0.10 0.00 0.00 34.13 32.86 1nu8 s GLU 403 CO 0.11 0.25 0.49 0.08 0.02 0.00 0.00 175.26 176.21 1nu8 s VAL 404 N -2.45 4.94 -0.20 2.63 1.01 -0.22 -2.81 120.40 123.30 1nu8 s VAL 404 Ca 0.20 1.02 0.09 0.00 0.00 0.00 0.00 61.98 63.30 1nu8 s VAL 404 Cb -0.04 -3.81 -0.22 0.00 0.00 0.00 0.00 36.38 32.31 1nu8 s VAL 404 CO 0.08 0.51 0.04 -0.38 0.00 0.00 0.00 175.10 175.35 1nu8 n ILE 405 N 2.18 1.48 -3.52 2.22 5.41 0.23 -4.83 119.36 122.53 1nu8 n ILE 405 Ca -0.11 -0.72 -0.11 0.00 1.00 0.00 0.00 62.75 62.80 1nu8 n ILE 405 Cb 0.52 -0.99 -0.04 0.00 -0.71 0.00 0.00 39.64 38.41 1nu8 n ILE 405 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 1nu8 s GLY 406 N -5.86 -0.43 -0.19 7.39 0.00 -1.16 -4.98 107.32 102.09 1nu8 s GLY 406 Ca -0.20 1.38 -0.07 0.00 0.00 0.00 0.00 44.72 45.83 1nu8 s GLY 406 CO 0.74 0.68 0.05 -0.42 0.00 0.00 0.00 173.10 174.14 1nu8 s ILE 407 N -2.10 4.53 -0.12 0.90 1.01 -1.26 -1.46 121.20 122.70 1nu8 s ILE 407 Ca -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.53 1nu8 s ILE 407 Cb -0.01 -3.05 -0.08 0.00 0.01 0.00 0.00 42.46 39.34 1nu8 s ILE 407 CO -0.02 0.44 -0.11 -0.62 0.00 0.00 0.00 174.94 174.63 1nu8 n GLU 408 N 3.82 0.30 -3.73 2.79 -0.58 0.17 -4.99 120.64 118.43 1nu8 n GLU 408 Ca -0.17 0.07 -0.10 0.00 -0.42 0.00 0.00 57.16 56.55 1nu8 n GLU 408 Cb 0.52 -1.22 -0.06 0.00 -0.57 0.00 0.00 31.44 30.12 1nu8 n GLU 408 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1nu8 s ALA 409 N -2.24 -0.63 -0.19 0.62 0.00 -1.19 -4.86 121.76 113.26 1nu8 s ALA 409 Ca -0.17 -0.30 -0.05 0.00 0.00 0.00 0.00 51.96 51.44 1nu8 s ALA 409 Cb 0.04 0.63 0.10 0.00 0.00 0.00 0.00 23.12 23.89 1nu8 s ALA 409 CO 0.28 -0.60 0.35 -1.17 0.00 0.00 0.00 175.76 174.61 1nu8 s LEU 410 N -2.83 -0.50 0.00 0.00 2.96 -1.26 -0.75 118.68 116.29 1nu8 s LEU 410 Ca 0.04 0.55 0.01 0.00 -0.22 0.00 0.00 54.13 54.51 1nu8 s LEU 410 Cb 0.03 1.02 0.01 0.00 0.50 0.00 0.00 46.19 47.74 1nu8 s LEU 410 CO -0.11 -0.26 0.07 0.35 -1.32 0.00 0.00 176.35 175.07 1nu8 n THR 411 N 5.37 0.00 0.24 3.68 -2.24 -0.55 -4.90 114.28 115.88 1nu8 n THR 411 Ca -0.06 -0.23 0.12 0.00 -2.27 0.00 0.00 64.05 61.61 1nu8 n THR 411 Cb 0.50 -0.67 0.57 0.00 -2.10 0.00 0.00 70.33 68.62 1nu8 n THR 411 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1nu8 h SER 412 N 0.05 0.00 0.25 3.42 4.64 -2.01 -3.31 113.55 116.59 1nu8 h SER 412 Ca -0.04 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.00 1nu8 h SER 412 Cb 0.14 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.18 1nu8 h SER 412 CO 0.05 0.17 -2.01 0.47 -0.87 0.00 0.00 176.83 174.64 1nu8 n ASP 413 N -3.41 0.39 -3.81 4.97 8.00 -1.26 -4.78 116.55 116.65 1nu8 n ASP 413 Ca -0.00 0.18 -0.13 0.00 0.71 0.00 0.00 54.79 55.55 1nu8 n ASP 413 Cb 0.36 0.63 -0.13 0.00 -0.02 0.00 0.00 41.12 41.96 1nu8 n ASP 413 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1nu8 s TYR 414 N -2.67 -0.17 -0.18 1.24 2.02 -1.25 -1.11 117.35 115.24 1nu8 s TYR 414 Ca -0.07 0.42 -0.02 0.00 -0.37 0.00 0.00 57.07 57.03 1nu8 s TYR 414 Cb 0.08 0.05 -0.01 0.00 -0.40 0.00 0.00 41.96 41.67 1nu8 s TYR 414 CO 0.83 -0.09 -0.09 -1.17 -1.57 0.00 0.00 175.55 173.46 1nu8 s LEU 415 N 0.19 2.74 -0.16 -1.29 0.20 -0.63 -1.48 118.68 118.26 1nu8 s LEU 415 Ca -0.01 -0.39 -0.12 0.00 0.69 0.00 0.00 54.13 54.29 1nu8 s LEU 415 Cb -0.02 -1.66 -0.05 0.00 -0.43 0.00 0.00 46.19 44.03 1nu8 s LEU 415 CO -0.00 0.05 0.25 -0.31 -0.29 0.00 0.00 176.35 176.05 1nu8 s TYR 416 N 1.01 3.48 0.20 5.38 1.51 0.07 -0.76 117.35 128.24 1nu8 s TYR 416 Ca -0.01 0.56 -0.04 0.00 -1.01 0.00 0.00 57.07 56.57 1nu8 s TYR 416 Cb -0.15 -2.27 -0.03 0.00 -0.11 0.00 0.00 41.96 39.41 1nu8 s TYR 416 CO -0.01 0.32 0.20 1.52 -1.11 0.00 0.00 175.55 176.47 1nu8 s TYR 417 N 0.22 0.89 -0.09 2.71 1.13 -0.43 -0.65 117.35 121.14 1nu8 s TYR 417 Ca 0.15 -1.17 0.01 0.00 -1.41 0.00 0.00 57.07 54.65 1nu8 s TYR 417 Cb -0.13 -0.36 -0.02 0.00 -1.10 0.00 0.00 41.96 40.36 1nu8 s TYR 417 CO 0.03 -0.70 -0.12 0.42 -2.51 0.00 0.00 175.55 172.67 1nu8 s ILE 418 N -4.10 3.19 0.22 -3.49 1.01 -0.53 0.12 121.20 117.61 1nu8 s ILE 418 Ca 0.32 -0.65 -0.03 0.00 0.00 0.00 0.00 60.65 60.29 1nu8 s ILE 418 Cb 0.05 -2.30 -0.03 0.00 0.01 0.00 0.00 42.46 40.19 1nu8 s ILE 418 CO 0.09 0.56 0.21 -0.94 0.00 0.00 0.00 174.94 174.86 1nu8 s SER 419 N -0.28 0.17 -0.45 3.58 1.04 -0.80 0.78 113.70 117.75 1nu8 s SER 419 Ca 0.02 -1.31 0.02 0.00 0.48 0.00 0.00 55.95 55.17 1nu8 s SER 419 Cb -0.13 0.43 0.56 0.00 0.10 0.00 0.00 66.02 66.98 1nu8 s SER 419 CO 0.03 -0.92 1.87 -0.46 0.98 0.00 0.00 173.24 174.75 1nu8 n ASN 420 N -0.36 4.54 0.09 7.02 2.04 -1.12 -1.99 115.26 125.49 1nu8 n ASN 420 Ca 0.01 -3.49 -0.13 0.00 -0.44 0.00 0.00 54.58 50.53 1nu8 n ASN 420 Cb 0.65 -0.85 -0.08 0.00 -2.53 0.00 0.00 39.78 36.97 1nu8 n ASN 420 CO 0.00 0.00 0.00 -0.08 -0.44 0.00 0.00 177.26 176.74 1nu8 h GLU 421 N 1.13 -0.17 -6.11 -3.83 4.81 -1.85 -3.35 114.58 105.21 1nu8 h GLU 421 Ca 0.57 0.01 -0.75 0.00 -0.13 0.00 0.00 59.36 59.06 1nu8 h GLU 421 Cb 2.26 0.04 0.05 0.00 0.63 0.00 0.00 28.75 31.73 1nu8 h GLU 421 CO 1.10 -0.02 0.27 0.98 -0.73 0.00 0.00 179.01 180.60 1nu8 n TYR 422 N -5.12 1.08 -0.92 0.92 9.36 -1.26 -0.80 117.16 120.41 1nu8 n TYR 422 Ca -0.08 0.88 -0.04 0.00 3.32 0.00 0.00 57.90 61.97 1nu8 n TYR 422 Cb 0.14 -2.20 -0.02 0.00 -0.63 0.00 0.00 39.34 36.62 1nu8 n TYR 422 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1nu8 n LYS 423 N 2.12 -1.39 -1.23 2.98 5.02 -1.26 -2.18 118.16 122.23 1nu8 n LYS 423 Ca 0.20 0.30 -0.08 0.00 -2.02 0.00 0.00 58.31 56.71 1nu8 n LYS 423 Cb 0.12 -4.12 -0.03 0.00 -0.02 0.00 0.00 35.03 30.98 1nu8 n LYS 423 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nu8 n GLY 424 N 0.01 0.96 3.48 0.72 0.00 0.01 -4.99 105.19 105.38 1nu8 n GLY 424 Ca -0.04 -0.49 -0.43 0.00 0.00 0.00 0.00 46.02 45.06 1nu8 n GLY 424 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1nu8 s MET 425 N -2.46 3.07 0.29 1.61 -1.94 -0.93 -4.92 119.30 114.03 1nu8 s MET 425 Ca 0.00 -0.81 0.24 0.00 -1.71 0.00 0.00 55.69 53.41 1nu8 s MET 425 Cb 0.00 -3.97 1.05 0.00 2.01 0.00 0.00 34.83 33.92 1nu8 s MET 425 CO 0.00 -0.83 1.73 -1.35 -0.01 0.00 0.00 175.02 174.56 1nu8 h PRO 426 N 8.71 0.00 0.00 2.03 0.11 -1.90 -0.49 132.00 140.46 1nu8 h PRO 426 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1nu8 h PRO 426 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1nu8 h PRO 426 CO 0.78 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.98 1nu8 n GLY 427 N -0.19 -1.01 3.68 -0.55 0.00 -1.26 -4.85 105.19 101.00 1nu8 n GLY 427 Ca 0.01 -0.15 -0.26 0.00 0.00 0.00 0.00 46.02 45.62 1nu8 n GLY 427 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nu8 s GLY 428 N -2.25 1.72 -0.02 -0.02 0.00 -0.19 -2.82 107.32 103.73 1nu8 s GLY 428 Ca 0.35 -1.37 -0.00 0.00 0.00 0.00 0.00 44.72 43.69 1nu8 s GLY 428 CO 0.36 -1.39 0.03 0.50 0.00 0.00 0.00 173.10 172.60 1nu8 s ARG 429 N -3.02 -0.01 0.13 2.90 1.81 -0.81 -3.68 118.95 116.27 1nu8 s ARG 429 Ca 0.28 0.13 -0.17 0.00 -1.72 0.00 0.00 55.73 54.26 1nu8 s ARG 429 Cb -0.09 -0.15 0.04 0.00 -0.45 0.00 0.00 34.95 34.30 1nu8 s ARG 429 CO 0.19 -0.10 0.42 -0.80 -0.68 0.00 0.00 175.30 174.32 1nu8 s ASN 430 N 0.67 -0.26 -0.12 0.23 0.01 -0.84 -1.40 114.94 113.23 1nu8 s ASN 430 Ca -0.06 -0.29 -0.05 0.00 -0.71 0.00 0.00 52.86 51.76 1nu8 s ASN 430 Cb -0.08 0.48 -0.04 0.00 0.41 0.00 0.00 41.25 42.03 1nu8 s ASN 430 CO -0.02 -0.86 0.05 -0.22 -1.51 0.00 0.00 177.10 174.55 1nu8 s LEU 431 N -2.78 3.87 0.10 0.60 2.96 -1.26 -1.89 118.68 120.27 1nu8 s LEU 431 Ca 0.03 0.22 0.04 0.00 -0.22 0.00 0.00 54.13 54.20 1nu8 s LEU 431 Cb 0.02 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 1nu8 s LEU 431 CO -0.12 0.34 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.83 1nu8 s TYR 432 N -0.65 1.17 -0.16 5.38 1.51 0.12 -0.24 117.35 124.48 1nu8 s TYR 432 Ca 0.11 -0.60 -0.01 0.00 -1.01 0.00 0.00 57.07 55.57 1nu8 s TYR 432 Cb -0.12 -0.63 0.04 0.00 -0.11 0.00 0.00 41.96 41.14 1nu8 s TYR 432 CO 0.02 0.05 -0.05 0.21 -1.11 0.00 0.00 175.55 174.67 1nu8 s LYS 433 N -2.62 1.39 -0.16 -0.62 2.20 0.73 -1.31 119.74 119.36 1nu8 s LYS 433 Ca 0.05 -0.47 -0.10 0.00 -0.36 0.00 0.00 55.97 55.09 1nu8 s LYS 433 Cb -0.04 -1.93 -0.05 0.00 -1.51 0.00 0.00 37.83 34.30 1nu8 s LYS 433 CO 0.01 -0.42 0.18 0.42 -0.36 0.00 0.00 175.35 175.19 1nu8 s ILE 434 N 1.66 5.39 -0.10 5.43 1.01 0.06 -1.07 121.20 133.58 1nu8 s ILE 434 Ca 0.01 0.31 -0.29 0.00 0.00 0.00 0.00 60.65 60.68 1nu8 s ILE 434 Cb -0.15 -3.50 -0.01 0.00 0.01 0.00 0.00 42.46 38.81 1nu8 s ILE 434 CO -0.08 0.48 1.00 -1.10 0.00 0.00 0.00 174.94 175.24 1nu8 s GLN 435 N -0.04 4.43 0.01 2.79 -0.21 -0.93 -1.61 119.66 124.10 1nu8 s GLN 435 Ca 0.13 1.38 0.28 0.00 0.02 0.00 0.00 55.36 57.17 1nu8 s GLN 435 Cb -0.12 -3.54 1.11 0.00 1.00 0.00 0.00 33.01 31.46 1nu8 s GLN 435 CO 0.02 -0.30 1.85 1.28 -2.12 0.00 0.00 175.29 176.02 1nu8 n LEU 436 N 4.94 0.12 0.06 2.90 4.77 -0.27 -2.64 117.00 126.88 1nu8 n LEU 436 Ca 0.08 0.44 0.13 0.00 -0.03 0.00 0.00 56.01 56.64 1nu8 n LEU 436 Cb 0.49 -0.45 0.49 0.00 -2.33 0.00 0.00 43.42 41.62 1nu8 n LEU 436 CO 0.52 0.00 0.91 -1.54 -1.33 0.00 0.00 177.39 175.95 1nu8 n SER 437 N -1.55 0.46 -3.15 -1.43 3.41 -1.26 -4.65 113.62 105.44 1nu8 n SER 437 Ca 0.07 0.55 0.05 0.00 -0.26 0.00 0.00 58.87 59.27 1nu8 n SER 437 Cb 0.35 -0.67 -0.01 0.00 -0.26 0.00 0.00 64.21 63.62 1nu8 n SER 437 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1nu8 s ASP 438 N -3.86 -1.06 0.00 4.04 -1.08 -1.08 -5.06 116.67 108.56 1nu8 s ASP 438 Ca 0.12 0.33 0.11 0.00 -0.52 0.00 0.00 52.55 52.59 1nu8 s ASP 438 Cb 0.15 1.76 0.53 0.00 -1.46 0.00 0.00 42.92 43.89 1nu8 s ASP 438 CO 0.55 -0.20 1.30 -1.22 0.52 0.00 0.00 175.17 176.13 1nu8 n TYR 439 N 5.36 0.00 0.58 -5.34 4.01 -1.24 -1.77 117.16 118.75 1nu8 n TYR 439 Ca 0.02 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.89 1nu8 n TYR 439 Cb 0.54 -0.38 0.20 0.00 -0.31 0.00 0.00 39.34 39.39 1nu8 n TYR 439 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1nu8 n THR 440 N -1.38 0.38 -2.89 -0.72 -2.24 -1.26 -4.47 114.28 101.69 1nu8 n THR 440 Ca 0.04 -0.27 -0.44 0.00 -2.27 0.00 0.00 64.05 61.11 1nu8 n THR 440 Cb 0.11 -0.18 -0.02 0.00 -2.10 0.00 0.00 70.33 68.14 1nu8 n THR 440 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1nu8 s LYS 441 N -3.16 3.79 -0.09 -0.78 1.02 -0.73 -4.96 119.74 114.84 1nu8 s LYS 441 Ca 0.07 -2.02 -0.01 0.00 0.02 0.00 0.00 55.97 54.03 1nu8 s LYS 441 Cb 0.13 -5.03 -0.03 0.00 -0.52 0.00 0.00 37.83 32.39 1nu8 s LYS 441 CO 0.71 -1.82 -0.05 0.08 -0.92 0.00 0.00 175.35 173.34 1nu8 s VAL 442 N 2.51 3.83 -0.03 3.17 1.01 -1.26 -2.19 120.40 127.44 1nu8 s VAL 442 Ca 0.38 -0.42 0.07 0.00 0.00 0.00 0.00 61.98 62.01 1nu8 s VAL 442 Cb -0.03 -2.59 -0.02 0.00 0.00 0.00 0.00 36.38 33.74 1nu8 s VAL 442 CO -0.05 0.58 -0.24 0.28 0.00 0.00 0.00 175.10 175.66 1nu8 s THR 443 N -0.57 1.92 -0.18 3.92 -1.32 -0.23 -4.95 115.64 114.22 1nu8 s THR 443 Ca 0.09 -1.03 -0.17 0.00 -1.21 0.00 0.00 61.69 59.37 1nu8 s THR 443 Cb -0.12 -1.60 -0.04 0.00 -1.51 0.00 0.00 72.50 69.23 1nu8 s THR 443 CO 0.02 0.54 0.45 0.00 -2.21 0.00 0.00 174.62 173.42 1nu8 h LEU 445 N 7.53 0.00 0.00 0.00 3.38 -0.97 -3.41 115.31 121.85 1nu8 h LEU 445 Ca -0.36 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.59 1nu8 h LEU 445 Cb 1.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1nu8 h LEU 445 CO 0.73 0.01 -1.12 -1.54 0.09 0.00 0.00 178.44 176.61 1nu8 n SER 446 N -2.69 4.51 -0.34 -0.43 3.41 -1.24 -4.77 113.62 112.07 1nu8 n SER 446 Ca -0.00 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.76 1nu8 n SER 446 Cb 0.55 0.79 0.29 0.00 -0.26 0.00 0.00 64.21 65.59 1nu8 n SER 446 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1nu8 n GLU 448 N -5.44 1.18 -0.03 0.00 -0.58 -1.26 -4.53 120.64 109.98 1nu8 n GLU 448 Ca 0.23 -2.46 -0.13 0.00 -0.42 0.00 0.00 57.16 54.38 1nu8 n GLU 448 Cb 0.76 -1.42 -0.10 0.00 -0.57 0.00 0.00 31.44 30.12 1nu8 n GLU 448 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1nu8 h LEU 449 N 0.03 0.09 -5.74 -4.62 3.38 -1.79 -3.41 115.31 103.26 1nu8 h LEU 449 Ca -0.00 -0.55 -0.43 0.00 0.09 0.00 0.00 57.88 56.99 1nu8 h LEU 449 Cb 1.04 -0.03 -0.30 0.00 0.09 0.00 0.00 40.66 41.46 1nu8 h LEU 449 CO 0.00 0.63 -0.84 0.59 0.09 0.00 0.00 178.44 178.91 1nu8 n ASN 450 N -4.75 -1.28 0.25 -0.43 3.02 -1.26 -5.06 115.26 105.76 1nu8 n ASN 450 Ca -0.08 -2.75 0.15 0.00 -0.03 0.00 0.00 54.58 51.86 1nu8 n ASN 450 Cb 0.31 0.29 0.48 0.00 -0.61 0.00 0.00 39.78 40.26 1nu8 n ASN 450 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1nu8 h PRO 451 N 4.68 0.00 0.08 3.52 0.13 -1.79 0.89 132.00 139.50 1nu8 h PRO 451 Ca 0.09 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.91 1nu8 h PRO 451 Cb 0.96 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.07 1nu8 h PRO 451 CO 0.33 0.03 -1.60 0.93 -0.23 0.00 0.00 178.00 177.45 1nu8 h GLU 452 N 0.00 0.16 0.15 0.86 3.07 -1.97 -3.39 114.58 113.47 1nu8 h GLU 452 Ca -0.00 -0.28 -0.31 0.00 -0.50 0.00 0.00 59.36 58.27 1nu8 h GLU 452 Cb 0.71 0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.73 1nu8 h GLU 452 CO 0.00 0.95 -1.53 -0.09 -1.40 0.00 0.00 179.01 176.95 1nu8 h ARG 453 N 0.04 0.31 -4.46 2.33 2.43 -1.77 -3.42 114.38 109.85 1nu8 h ARG 453 Ca -0.26 -0.53 -0.62 0.00 -0.81 0.00 0.00 59.98 57.75 1nu8 h ARG 453 Cb 2.00 0.20 -0.38 0.00 -0.42 0.00 0.00 29.97 31.37 1nu8 h ARG 453 CO 0.13 1.20 -0.79 0.00 -1.51 0.00 0.00 179.97 179.00 1nu8 n GLN 455 N 4.62 0.22 -3.57 0.00 6.02 0.14 -4.47 117.38 120.34 1nu8 n GLN 455 Ca -0.12 -0.41 -0.29 0.00 -0.01 0.00 0.00 57.00 56.16 1nu8 n GLN 455 Cb 0.44 -0.60 -0.15 0.00 1.02 0.00 0.00 30.24 30.95 1nu8 n GLN 455 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1nu8 s TYR 456 N -0.10 0.55 0.19 1.08 6.14 -1.15 -1.92 117.35 122.14 1nu8 s TYR 456 Ca 0.00 -1.05 0.06 0.00 0.64 0.00 0.00 57.07 56.72 1nu8 s TYR 456 Cb 0.00 -1.03 -0.04 0.00 0.42 0.00 0.00 41.96 41.31 1nu8 s TYR 456 CO 0.00 -0.84 0.14 0.71 0.64 0.00 0.00 175.55 176.20 1nu8 s TYR 457 N 1.98 3.10 0.28 4.97 2.02 -0.49 0.12 117.35 129.33 1nu8 s TYR 457 Ca 0.10 -0.06 0.02 0.00 -0.37 0.00 0.00 57.07 56.76 1nu8 s TYR 457 Cb -0.17 -1.46 -0.05 0.00 -0.40 0.00 0.00 41.96 39.88 1nu8 s TYR 457 CO -0.34 0.52 0.09 -1.54 -1.57 0.00 0.00 175.55 172.72 1nu8 s SER 458 N -3.32 1.56 0.13 2.29 1.04 -0.58 -4.55 113.70 110.26 1nu8 s SER 458 Ca 0.31 -1.41 -0.10 0.00 0.48 0.00 0.00 55.95 55.23 1nu8 s SER 458 Cb -0.09 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.16 1nu8 s SER 458 CO 0.23 -0.72 0.27 0.54 0.98 0.00 0.00 173.24 174.55 1nu8 s VAL 459 N -3.61 0.10 -0.35 5.02 0.11 -1.26 -1.71 120.40 118.69 1nu8 s VAL 459 Ca 0.37 -1.14 0.04 0.00 -2.93 0.00 0.00 61.98 58.32 1nu8 s VAL 459 Cb 0.08 -1.50 0.16 0.00 -1.53 0.00 0.00 36.38 33.59 1nu8 s VAL 459 CO 0.14 -0.45 0.43 -0.55 -3.33 0.00 0.00 175.10 171.35 1nu8 s SER 460 N -2.89 0.41 0.22 3.54 0.15 -1.00 -5.01 113.70 109.12 1nu8 s SER 460 Ca 0.09 -1.04 -0.26 0.00 0.70 0.00 0.00 55.95 55.44 1nu8 s SER 460 Cb 0.04 1.00 -0.09 0.00 -1.71 0.00 0.00 66.02 65.26 1nu8 s SER 460 CO -0.07 -0.27 0.85 -0.36 1.20 0.00 0.00 173.24 174.59 1nu8 s PHE 461 N 1.87 3.88 1.13 3.44 0.08 -1.26 -1.61 117.98 125.51 1nu8 s PHE 461 Ca 0.14 1.72 -0.14 0.00 0.12 0.00 0.00 56.93 58.78 1nu8 s PHE 461 Cb -0.12 -2.84 0.26 0.00 -0.57 0.00 0.00 43.02 39.74 1nu8 s PHE 461 CO -0.13 0.44 1.05 -1.54 -0.10 0.00 0.00 175.22 174.94 1nu8 s SER 462 N -1.27 1.43 0.35 1.36 1.04 0.17 -4.90 113.70 111.87 1nu8 s SER 462 Ca 0.40 1.24 -0.28 0.00 0.48 0.00 0.00 55.95 57.80 1nu8 s SER 462 Cb -0.23 -1.93 -0.12 0.00 0.10 0.00 0.00 66.02 63.84 1nu8 s SER 462 CO 0.27 -3.88 1.23 0.29 0.98 0.00 0.00 173.24 172.13 1nu8 n LYS 463 N -4.68 1.95 -2.50 4.02 5.02 -1.16 -2.11 118.16 118.70 1nu8 n LYS 463 Ca 0.05 0.68 -0.18 0.00 -2.02 0.00 0.00 58.31 56.85 1nu8 n LYS 463 Cb 0.56 -2.24 0.00 0.00 -0.02 0.00 0.00 35.03 33.34 1nu8 n LYS 463 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1nu8 n GLU 464 N 0.51 -2.22 -3.13 1.97 1.02 -1.26 -3.60 120.64 113.93 1nu8 n GLU 464 Ca 0.06 0.81 -0.12 0.00 -0.02 0.00 0.00 57.16 57.88 1nu8 n GLU 464 Cb 0.36 -5.28 -0.04 0.00 -0.02 0.00 0.00 31.44 26.46 1nu8 n GLU 464 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1nu8 n ALA 465 N -2.28 -1.29 0.01 0.62 0.00 -0.89 -4.80 120.51 111.87 1nu8 n ALA 465 Ca -0.17 -0.15 -0.20 0.00 0.00 0.00 0.00 53.44 52.93 1nu8 n ALA 465 Cb 0.64 -0.35 -0.14 0.00 0.00 0.00 0.00 19.45 19.60 1nu8 n ALA 465 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1nu8 h LYS 466 N -0.06 0.21 -5.36 0.00 3.64 -1.75 -3.43 116.57 109.83 1nu8 h LYS 466 Ca -0.24 -0.36 -0.40 0.00 -1.27 0.00 0.00 60.65 58.37 1nu8 h LYS 466 Cb 0.52 0.14 -0.17 0.00 -0.41 0.00 0.00 32.23 32.30 1nu8 h LYS 466 CO 0.27 1.17 -0.75 0.71 -2.27 0.00 0.00 179.45 178.59 1nu8 s TYR 467 N -2.40 1.40 0.01 1.91 1.51 -1.26 -0.00 117.35 118.52 1nu8 s TYR 467 Ca -0.17 -0.60 -0.01 0.00 -1.01 0.00 0.00 57.07 55.28 1nu8 s TYR 467 Cb 0.02 -0.72 -0.01 0.00 -0.11 0.00 0.00 41.96 41.13 1nu8 s TYR 467 CO 0.77 0.16 -0.01 1.52 -1.11 0.00 0.00 175.55 176.88 1nu8 s TYR 468 N -2.47 0.20 -0.01 2.71 1.13 -0.51 0.46 117.35 118.86 1nu8 s TYR 468 Ca 0.12 -0.40 -0.20 0.00 -1.41 0.00 0.00 57.07 55.17 1nu8 s TYR 468 Cb -0.03 -0.15 -0.05 0.00 -1.10 0.00 0.00 41.96 40.63 1nu8 s TYR 468 CO 0.03 -0.16 0.59 -1.14 -2.51 0.00 0.00 175.55 172.36 1nu8 s GLN 469 N -1.18 4.32 0.00 -3.49 0.74 -0.64 -0.94 119.66 118.47 1nu8 s GLN 469 Ca -0.13 0.73 -0.01 0.00 0.05 0.00 0.00 55.36 56.00 1nu8 s GLN 469 Cb -0.08 -3.35 -0.04 0.00 1.10 0.00 0.00 33.01 30.64 1nu8 s GLN 469 CO -0.01 0.36 0.12 -0.51 -0.55 0.00 0.00 175.29 174.70 1nu8 s LEU 470 N -0.14 4.05 -0.25 3.68 1.43 -0.50 -2.36 118.68 124.59 1nu8 s LEU 470 Ca 0.31 0.20 -0.01 0.00 -1.03 0.00 0.00 54.13 53.60 1nu8 s LEU 470 Cb -0.18 -2.42 0.08 0.00 0.03 0.00 0.00 46.19 43.69 1nu8 s LEU 470 CO 0.17 0.26 0.04 -0.60 0.23 0.00 0.00 176.35 176.44 1nu8 s ARG 471 N -1.88 0.93 -0.09 1.70 3.52 -0.69 -1.64 118.95 120.80 1nu8 s ARG 471 Ca 0.25 -0.84 -0.24 0.00 -0.13 0.00 0.00 55.73 54.77 1nu8 s ARG 471 Cb -0.12 -2.21 -0.03 0.00 -1.56 0.00 0.00 34.95 31.02 1nu8 s ARG 471 CO 0.17 -0.77 0.76 0.00 -0.81 0.00 0.00 175.30 174.65 1nu8 n SER 473 N 4.22 2.15 0.00 0.00 7.64 0.12 -1.62 113.62 126.13 1nu8 n SER 473 Ca 0.01 -1.57 0.00 0.00 1.01 0.00 0.00 58.87 58.32 1nu8 n SER 473 Cb 0.51 0.37 0.00 0.00 -1.01 0.00 0.00 64.21 64.07 1nu8 n SER 473 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1nu8 n GLY 474 N 1.33 -2.04 0.07 0.23 0.00 -1.26 -0.59 105.19 102.94 1nu8 n GLY 474 Ca 0.10 -1.18 0.16 0.00 0.00 0.00 0.00 46.02 45.09 1nu8 n GLY 474 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1nu8 n PRO 475 N -0.47 1.02 -1.05 1.61 -0.04 -0.77 0.24 135.00 135.54 1nu8 n PRO 475 Ca 0.00 -0.14 -0.01 0.00 -0.04 0.00 0.00 63.50 63.31 1nu8 n PRO 475 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.97 1nu8 n PRO 475 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1nu8 n GLY 476 N 1.07 1.86 3.74 0.55 0.00 -0.58 -4.40 105.19 107.43 1nu8 n GLY 476 Ca 0.22 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.70 1nu8 n GLY 476 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nu8 n LEU 477 N 0.00 4.38 -4.68 0.99 4.77 -1.26 -4.57 117.00 116.63 1nu8 n LEU 477 Ca 0.01 1.20 -0.40 0.00 -0.03 0.00 0.00 56.01 56.78 1nu8 n LEU 477 Cb 0.02 -1.57 0.02 0.00 -2.33 0.00 0.00 43.42 39.57 1nu8 n LEU 477 CO 0.01 -0.15 0.80 -2.65 -1.33 0.00 0.00 177.39 174.07 1nu8 n PRO 478 N 0.35 1.65 -3.84 3.23 -0.02 -1.26 -4.78 135.00 130.33 1nu8 n PRO 478 Ca 0.03 0.60 -0.20 0.00 -2.02 0.00 0.00 63.50 61.91 1nu8 n PRO 478 Cb 0.38 -2.33 -0.17 0.00 -0.02 0.00 0.00 33.50 31.37 1nu8 n PRO 478 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1nu8 s LEU 479 N -1.82 0.78 -0.22 2.45 0.20 -0.64 -4.40 118.68 115.03 1nu8 s LEU 479 Ca 0.65 -0.03 -0.03 0.00 0.69 0.00 0.00 54.13 55.41 1nu8 s LEU 479 Cb -0.49 -0.29 0.00 0.00 -0.43 0.00 0.00 46.19 44.99 1nu8 s LEU 479 CO 0.55 -0.16 -0.06 -0.31 -0.29 0.00 0.00 176.35 176.08 1nu8 s TYR 480 N 1.56 2.96 0.28 5.38 1.51 -0.04 -1.21 117.35 127.79 1nu8 s TYR 480 Ca -0.02 -1.17 0.12 0.00 -1.01 0.00 0.00 57.07 54.99 1nu8 s TYR 480 Cb -0.13 -2.08 -0.05 0.00 -0.11 0.00 0.00 41.96 39.60 1nu8 s TYR 480 CO -0.03 -0.63 -0.17 0.95 -1.11 0.00 0.00 175.55 174.56 1nu8 s THR 481 N 1.42 2.61 -0.03 -0.71 -4.23 -0.65 -0.64 115.64 113.41 1nu8 s THR 481 Ca 0.04 -2.34 0.07 0.00 -1.18 0.00 0.00 61.69 58.28 1nu8 s THR 481 Cb -0.15 -2.37 -0.01 0.00 1.34 0.00 0.00 72.50 71.31 1nu8 s THR 481 CO -0.05 -0.39 -0.24 -0.22 -0.54 0.00 0.00 174.62 173.18 1nu8 s LEU 482 N -3.53 2.04 0.02 4.79 2.96 0.19 -1.41 118.68 123.75 1nu8 s LEU 482 Ca 0.30 -0.46 -0.00 0.00 -0.22 0.00 0.00 54.13 53.75 1nu8 s LEU 482 Cb -0.05 -1.28 -0.02 0.00 0.50 0.00 0.00 46.19 45.34 1nu8 s LEU 482 CO 0.16 0.27 -0.02 -1.00 -1.32 0.00 0.00 176.35 174.43 1nu8 s HIS 483 N -0.38 0.27 -0.17 5.38 3.76 -0.12 0.25 115.29 124.28 1nu8 s HIS 483 Ca 0.04 -0.55 -0.05 0.00 -0.15 0.00 0.00 55.06 54.35 1nu8 s HIS 483 Cb -0.11 -0.20 -0.03 0.00 1.11 0.00 0.00 32.58 33.35 1nu8 s HIS 483 CO 0.01 -0.21 -0.01 0.45 -0.85 0.00 0.00 174.74 174.13 1nu8 s SER 484 N -1.57 5.03 0.13 1.40 0.15 -0.64 -1.42 113.70 116.78 1nu8 s SER 484 Ca -0.14 -0.08 -0.13 0.00 0.70 0.00 0.00 55.95 56.29 1nu8 s SER 484 Cb -0.08 -1.84 -0.02 0.00 -1.71 0.00 0.00 66.02 62.37 1nu8 s SER 484 CO -0.02 0.16 1.54 0.28 1.20 0.00 0.00 173.24 176.40 1nu8 h SER 485 N 6.81 0.79 -0.00 5.45 0.02 -0.70 -0.81 113.55 125.11 1nu8 h SER 485 Ca -0.33 -0.35 0.00 0.00 -0.84 0.00 0.00 61.79 60.27 1nu8 h SER 485 Cb 1.18 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 63.51 1nu8 h SER 485 CO 0.65 0.96 -0.00 0.52 -1.14 0.00 0.00 176.83 177.81 1nu8 n VAL 486 N -4.34 -0.00 0.05 2.27 0.31 -1.26 -1.76 118.33 113.61 1nu8 n VAL 486 Ca -0.01 0.50 0.03 0.00 -0.01 0.00 0.00 64.34 64.85 1nu8 n VAL 486 Cb 0.35 -0.66 0.06 0.00 -0.91 0.00 0.00 33.84 32.68 1nu8 n VAL 486 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1nu8 n ASN 487 N -2.35 2.09 -2.10 4.52 4.13 -1.26 -4.98 115.26 115.31 1nu8 n ASN 487 Ca 0.00 -1.68 -0.15 0.00 1.68 0.00 0.00 54.58 54.43 1nu8 n ASN 487 Cb 0.00 -0.07 0.02 0.00 -1.54 0.00 0.00 39.78 38.19 1nu8 n ASN 487 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1nu8 n ASP 488 N 0.18 -4.68 -4.73 6.41 8.00 -0.32 -4.99 116.55 116.43 1nu8 n ASP 488 Ca 0.05 -0.18 -0.42 0.00 0.71 0.00 0.00 54.79 54.96 1nu8 n ASP 488 Cb 0.26 -3.57 -0.03 0.00 -0.02 0.00 0.00 41.12 37.77 1nu8 n ASP 488 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1nu8 s LYS 489 N -5.27 4.28 0.26 -1.24 2.36 -1.13 -4.84 119.74 114.15 1nu8 s LYS 489 Ca 0.19 2.24 -0.30 0.00 -2.55 0.00 0.00 55.97 55.54 1nu8 s LYS 489 Cb -0.08 -3.16 -0.11 0.00 -1.05 0.00 0.00 37.83 33.43 1nu8 s LYS 489 CO 0.23 -0.44 1.54 0.20 1.55 0.00 0.00 175.35 178.42 1nu8 s GLY 490 N 0.68 2.10 -0.25 5.54 0.00 -1.26 -1.62 107.32 112.51 1nu8 s GLY 490 Ca 0.62 1.45 -0.12 0.00 0.00 0.00 0.00 44.72 46.68 1nu8 s GLY 490 CO 0.37 2.47 -0.16 1.04 0.00 0.00 0.00 173.10 176.82 1nu8 n LEU 491 N 2.51 2.18 -3.65 0.66 4.77 0.14 -4.89 117.00 118.72 1nu8 n LEU 491 Ca 0.09 0.26 -0.03 0.00 -0.03 0.00 0.00 56.01 56.30 1nu8 n LEU 491 Cb 0.39 -0.89 -0.07 0.00 -2.33 0.00 0.00 43.42 40.52 1nu8 n LEU 491 CO 0.62 0.60 1.00 -0.60 -1.33 0.00 0.00 177.39 177.69 1nu8 s ARG 492 N -2.48 0.17 0.22 3.23 3.52 -1.14 -5.02 118.95 117.45 1nu8 s ARG 492 Ca -0.35 0.23 -0.27 0.00 -0.13 0.00 0.00 55.73 55.21 1nu8 s ARG 492 Cb 0.11 0.07 -0.09 0.00 -1.56 0.00 0.00 34.95 33.49 1nu8 s ARG 492 CO 0.55 -0.02 0.85 0.08 -0.81 0.00 0.00 175.30 175.95 1nu8 s VAL 493 N 0.41 4.25 -0.19 7.11 1.01 -1.26 -0.64 120.40 131.10 1nu8 s VAL 493 Ca 0.02 1.83 -0.13 0.00 0.00 0.00 0.00 61.98 63.70 1nu8 s VAL 493 Cb -0.04 -4.17 -0.08 0.00 0.00 0.00 0.00 36.38 32.09 1nu8 s VAL 493 CO -0.13 0.44 -0.29 0.18 0.00 0.00 0.00 175.10 175.30 1nu8 n LEU 494 N 1.35 1.70 -3.77 3.92 4.77 0.19 -4.91 117.00 120.25 1nu8 n LEU 494 Ca -0.03 0.29 -0.16 0.00 -0.03 0.00 0.00 56.01 56.08 1nu8 n LEU 494 Cb 0.48 -0.67 -0.16 0.00 -2.33 0.00 0.00 43.42 40.74 1nu8 n LEU 494 CO 0.47 0.12 -0.35 -0.70 -1.33 0.00 0.00 177.39 175.60 1nu8 s GLU 495 N -2.56 -0.01 0.00 3.23 2.56 -1.17 -5.02 118.70 115.73 1nu8 s GLU 495 Ca -0.29 0.19 0.03 0.00 0.00 0.00 0.00 54.97 54.91 1nu8 s GLU 495 Cb 0.09 -0.29 -0.02 0.00 2.00 0.00 0.00 34.13 35.90 1nu8 s GLU 495 CO 0.38 -0.18 0.23 -0.40 -0.56 0.00 0.00 175.26 174.74 1nu8 n ASP 496 N 4.26 0.38 -1.95 -1.70 5.68 -1.26 -0.86 116.55 121.10 1nu8 n ASP 496 Ca -0.26 -0.69 -0.17 0.00 -0.50 0.00 0.00 54.79 53.17 1nu8 n ASP 496 Cb 0.50 0.81 -0.01 0.00 -1.14 0.00 0.00 41.12 41.28 1nu8 n ASP 496 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1nu8 n ASN 497 N -0.83 -4.98 -0.12 -1.12 3.02 -1.26 -4.83 115.26 105.14 1nu8 n ASN 497 Ca 0.01 -0.03 -0.08 0.00 -0.03 0.00 0.00 54.58 54.45 1nu8 n ASN 497 Cb 0.06 -4.06 0.08 0.00 -0.61 0.00 0.00 39.78 35.25 1nu8 n ASN 497 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1nu8 h SER 498 N -0.07 0.85 -0.78 6.41 4.64 -1.95 -1.81 113.55 120.84 1nu8 h SER 498 Ca -0.40 -0.28 0.18 0.00 -0.47 0.00 0.00 61.79 60.82 1nu8 h SER 498 Cb 1.30 -0.23 -0.12 0.00 -0.31 0.00 0.00 62.40 63.03 1nu8 h SER 498 CO 0.47 1.00 0.16 0.00 -0.87 0.00 0.00 176.83 177.59 1nu8 h ALA 499 N 1.07 1.00 -0.72 5.18 0.00 -2.00 0.17 119.26 123.97 1nu8 h ALA 499 Ca 0.12 0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.16 1nu8 h ALA 499 Cb 0.67 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 1nu8 h ALA 499 CO 0.05 -0.38 0.21 1.25 0.00 0.00 0.00 179.25 180.38 1nu8 h LEU 500 N 0.23 1.04 -0.20 0.00 6.46 -1.66 -2.78 115.31 118.39 1nu8 h LEU 500 Ca 0.45 -0.20 -0.01 0.00 -0.12 0.00 0.00 57.88 58.01 1nu8 h LEU 500 Cb 0.81 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 1nu8 h LEU 500 CO -0.57 0.97 0.10 -0.78 -0.62 0.00 0.00 178.44 177.54 1nu8 h ASP 501 N 1.07 0.26 -0.38 1.25 3.58 0.03 0.83 116.42 123.05 1nu8 h ASP 501 Ca 0.23 -0.11 0.03 0.00 0.42 0.00 0.00 57.03 57.60 1nu8 h ASP 501 Cb 0.31 -0.07 -0.03 0.00 1.72 0.00 0.00 39.33 41.26 1nu8 h ASP 501 CO -0.01 0.30 0.19 0.11 -2.88 0.00 0.00 179.24 176.96 1nu8 h LYS 502 N 0.21 0.38 -0.10 0.28 1.57 -0.99 -1.60 116.57 116.33 1nu8 h LYS 502 Ca 0.07 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.85 1nu8 h LYS 502 Cb 0.10 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 1nu8 h LYS 502 CO -0.01 0.25 -0.06 0.52 -0.57 0.00 0.00 179.45 179.58 1nu8 h MET 503 N 0.39 -0.07 0.00 3.15 2.86 -1.16 -3.02 114.93 117.09 1nu8 h MET 503 Ca 0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 1nu8 h MET 503 Cb 0.06 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.74 1nu8 h MET 503 CO -0.11 -0.04 0.00 -0.07 1.06 0.00 0.00 176.91 177.75 1nu8 h LEU 504 N -0.07 0.00 -2.81 1.22 3.38 -0.54 -2.02 115.31 114.47 1nu8 h LEU 504 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1nu8 h LEU 504 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1nu8 h LEU 504 CO -0.14 0.00 0.00 1.56 0.09 0.00 0.00 178.44 179.95 1nu8 h GLN 505 N 0.00 0.00 -0.64 1.13 4.20 -1.15 -2.81 115.11 115.84 1nu8 h GLN 505 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1nu8 h GLN 505 Cb 0.46 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.24 1nu8 h GLN 505 CO 0.00 0.00 0.00 0.09 -0.67 0.00 0.00 178.83 178.25 1nu8 n ASN 506 N -3.00 3.80 -4.52 1.46 3.02 -0.76 -4.97 115.26 110.30 1nu8 n ASN 506 Ca -0.03 -2.05 -0.24 0.00 -0.03 0.00 0.00 54.58 52.23 1nu8 n ASN 506 Cb 0.07 -0.44 -0.10 0.00 -0.61 0.00 0.00 39.78 38.71 1nu8 n ASN 506 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1nu8 s VAL 507 N -1.09 2.60 -1.29 2.41 -7.23 -1.06 -3.55 120.40 111.18 1nu8 s VAL 507 Ca 0.43 -2.26 -0.10 0.00 -1.81 0.00 0.00 61.98 58.24 1nu8 s VAL 507 Cb 0.23 -2.49 0.15 0.00 0.56 0.00 0.00 36.38 34.84 1nu8 s VAL 507 CO 0.28 -0.34 1.87 0.00 -0.31 0.00 0.00 175.10 176.60 1nu8 n GLN 508 N -0.72 3.52 -1.94 4.82 6.02 0.06 -4.97 117.38 124.17 1nu8 n GLN 508 Ca -0.05 -3.46 -0.41 0.00 -0.01 0.00 0.00 57.00 53.07 1nu8 n GLN 508 Cb 0.61 -2.98 -0.01 0.00 1.02 0.00 0.00 30.24 28.88 1nu8 n GLN 508 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1nu8 s MET 509 N 0.81 4.16 0.87 -1.09 -1.94 -1.26 -4.48 119.30 116.38 1nu8 s MET 509 Ca 0.41 2.40 -0.12 0.00 -1.71 0.00 0.00 55.69 56.67 1nu8 s MET 509 Cb 0.09 -2.97 0.11 0.00 2.01 0.00 0.00 34.83 34.07 1nu8 s MET 509 CO -0.00 -0.42 1.10 -1.25 -0.01 0.00 0.00 175.02 174.44 1nu8 s PRO 510 N -2.02 1.47 0.43 2.03 0.04 -1.26 -4.08 135.00 131.60 1nu8 s PRO 510 Ca 0.52 0.61 0.06 0.00 0.04 0.00 0.00 61.00 62.24 1nu8 s PRO 510 Cb -0.43 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.20 1nu8 s PRO 510 CO 0.58 -2.04 0.10 -1.54 0.04 0.00 0.00 177.00 174.14 1nu8 s SER 511 N -3.73 4.16 -0.12 6.66 1.04 0.02 -4.91 113.70 116.82 1nu8 s SER 511 Ca 0.63 -1.27 0.01 0.00 0.48 0.00 0.00 55.95 55.80 1nu8 s SER 511 Cb -0.16 -0.31 0.02 0.00 0.10 0.00 0.00 66.02 65.67 1nu8 s SER 511 CO 0.55 -0.56 -0.14 -0.75 0.98 0.00 0.00 173.24 173.33 1nu8 s LYS 512 N -3.83 2.13 -0.25 4.02 2.20 -1.26 0.27 119.74 123.01 1nu8 s LYS 512 Ca 0.35 -0.51 -0.09 0.00 -0.36 0.00 0.00 55.97 55.35 1nu8 s LYS 512 Cb 0.06 -1.90 -0.04 0.00 -1.51 0.00 0.00 37.83 34.44 1nu8 s LYS 512 CO 0.19 -0.15 0.13 0.21 -0.36 0.00 0.00 175.35 175.37 1nu8 s LYS 513 N 1.25 3.88 -0.23 4.03 2.20 0.84 -4.94 119.74 126.77 1nu8 s LYS 513 Ca -0.01 -0.36 -0.02 0.00 -0.36 0.00 0.00 55.97 55.21 1nu8 s LYS 513 Cb -0.14 -3.49 0.01 0.00 -1.51 0.00 0.00 37.83 32.71 1nu8 s LYS 513 CO -0.05 -0.10 -0.07 -1.17 -0.36 0.00 0.00 175.35 173.60 1nu8 s LEU 514 N 1.45 2.97 0.00 5.43 0.20 -1.26 0.20 118.68 127.67 1nu8 s LEU 514 Ca 0.06 -0.65 -0.01 0.00 0.69 0.00 0.00 54.13 54.22 1nu8 s LEU 514 Cb -0.15 -1.68 0.01 0.00 -0.43 0.00 0.00 46.19 43.94 1nu8 s LEU 514 CO 0.07 -0.07 0.15 -0.67 -0.29 0.00 0.00 176.35 175.53 1nu8 n ASP 515 N 4.72 -0.41 -4.11 3.68 -0.08 -0.93 -5.03 116.55 114.39 1nu8 n ASP 515 Ca -0.18 -1.47 -0.14 0.00 -1.51 0.00 0.00 54.79 51.50 1nu8 n ASP 515 Cb 0.49 0.74 -0.11 0.00 2.34 0.00 0.00 41.12 44.58 1nu8 n ASP 515 CO 0.00 0.00 0.00 0.72 0.12 0.00 0.00 177.20 178.04 1nu8 s PHE 516 N -5.19 0.83 0.44 -0.67 -0.12 -1.26 -1.75 117.98 110.26 1nu8 s PHE 516 Ca 0.07 -0.56 0.07 0.00 -0.05 0.00 0.00 56.93 56.46 1nu8 s PHE 516 Cb -0.01 -0.48 -0.01 0.00 -0.63 0.00 0.00 43.02 41.89 1nu8 s PHE 516 CO 0.05 -0.06 0.39 0.96 -0.05 0.00 0.00 175.22 176.51 1nu8 s ILE 517 N -1.76 2.51 -0.12 -4.49 -4.36 0.46 -4.92 121.20 108.51 1nu8 s ILE 517 Ca -0.04 -1.36 -0.01 0.00 -0.26 0.00 0.00 60.65 58.98 1nu8 s ILE 517 Cb -0.07 -2.87 -0.02 0.00 1.25 0.00 0.00 42.46 40.74 1nu8 s ILE 517 CO 0.00 0.00 -0.09 -0.63 0.24 0.00 0.00 174.94 174.46 1nu8 s ILE 518 N -2.52 3.46 -0.05 8.37 -1.09 -1.26 -1.35 121.20 126.76 1nu8 s ILE 518 Ca 0.47 -0.53 0.02 0.00 -2.23 0.00 0.00 60.65 58.37 1nu8 s ILE 518 Cb -0.03 -2.46 0.02 0.00 -1.58 0.00 0.00 42.46 38.41 1nu8 s ILE 518 CO 0.27 0.54 -0.08 -0.76 -1.23 0.00 0.00 174.94 173.68 1nu8 s LEU 519 N 0.02 1.51 -1.03 2.97 1.02 -0.83 -4.90 118.68 117.44 1nu8 s LEU 519 Ca -0.02 -0.21 -0.28 0.00 0.02 0.00 0.00 54.13 53.64 1nu8 s LEU 519 Cb -0.14 -0.63 0.04 0.00 0.02 0.00 0.00 46.19 45.48 1nu8 s LEU 519 CO 0.03 -0.01 0.58 0.59 0.02 0.00 0.00 176.35 177.57 1nu8 n ASN 520 N 3.89 -3.62 0.00 2.29 3.02 -1.26 -1.39 115.26 118.19 1nu8 n ASN 520 Ca -0.24 -1.12 0.00 0.00 -0.03 0.00 0.00 54.58 53.19 1nu8 n ASN 520 Cb 0.51 -1.38 0.00 0.00 -0.61 0.00 0.00 39.78 38.31 1nu8 n ASN 520 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1nu8 n GLU 521 N -4.35 0.00 -3.32 3.52 1.02 -1.26 -4.96 120.64 111.29 1nu8 n GLU 521 Ca -0.12 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.72 1nu8 n GLU 521 Cb 0.50 -0.57 -0.04 0.00 -0.02 0.00 0.00 31.44 31.30 1nu8 n GLU 521 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1nu8 s THR 522 N -0.23 4.96 -0.19 2.62 2.01 -0.48 -5.07 115.64 119.26 1nu8 s THR 522 Ca 0.00 0.29 -0.19 0.00 0.31 0.00 0.00 61.69 62.10 1nu8 s THR 522 Cb 0.00 -3.68 -0.03 0.00 0.01 0.00 0.00 72.50 68.79 1nu8 s THR 522 CO 0.00 -0.23 0.52 -0.54 -0.69 0.00 0.00 174.62 173.68 1nu8 s LYS 523 N -3.27 4.21 0.02 4.92 1.02 -1.26 -1.96 119.74 123.41 1nu8 s LYS 523 Ca 0.46 0.43 0.06 0.00 0.02 0.00 0.00 55.97 56.94 1nu8 s LYS 523 Cb -0.11 -3.55 -0.02 0.00 -0.52 0.00 0.00 37.83 33.63 1nu8 s LYS 523 CO 0.26 -0.12 -0.19 -0.06 -0.92 0.00 0.00 175.35 174.32 1nu8 s PHE 524 N 1.53 1.69 0.09 3.18 0.08 -0.45 -4.99 117.98 119.11 1nu8 s PHE 524 Ca 0.25 -0.34 0.02 0.00 0.12 0.00 0.00 56.93 56.97 1nu8 s PHE 524 Cb -0.15 -1.04 -0.04 0.00 -0.57 0.00 0.00 43.02 41.21 1nu8 s PHE 524 CO 0.10 0.03 0.19 -1.58 -0.10 0.00 0.00 175.22 173.86 1nu8 s TRP 525 N -0.63 3.41 -0.00 0.36 0.52 -1.26 -0.40 118.94 120.94 1nu8 s TRP 525 Ca 0.07 0.16 -0.03 0.00 0.02 0.00 0.00 56.10 56.32 1nu8 s TRP 525 Cb -0.08 -1.69 -0.00 0.00 -1.15 0.00 0.00 33.47 30.55 1nu8 s TRP 525 CO 0.01 0.55 0.05 1.52 0.02 0.00 0.00 176.95 179.10 1nu8 s TYR 526 N -1.56 0.08 0.11 -1.98 1.13 -0.71 -0.68 117.35 113.74 1nu8 s TYR 526 Ca 0.33 -0.17 0.03 0.00 -1.41 0.00 0.00 57.07 55.86 1nu8 s TYR 526 Cb -0.12 -0.07 -0.04 0.00 -1.10 0.00 0.00 41.96 40.63 1nu8 s TYR 526 CO 0.26 -0.16 0.15 1.14 -2.51 0.00 0.00 175.55 174.43 1nu8 s GLN 527 N -0.88 3.05 -0.04 -3.49 -2.07 -0.62 -2.19 119.66 113.42 1nu8 s GLN 527 Ca -0.10 -0.69 0.06 0.00 -1.82 0.00 0.00 55.36 52.80 1nu8 s GLN 527 Cb -0.06 -2.78 -0.01 0.00 -1.09 0.00 0.00 33.01 29.07 1nu8 s GLN 527 CO 0.00 0.54 -0.21 -1.64 -1.32 0.00 0.00 175.29 172.66 1nu8 s MET 528 N -2.75 2.02 -0.29 9.60 -1.94 0.13 -0.41 119.30 125.66 1nu8 s MET 528 Ca 0.31 -0.75 -0.14 0.00 -1.71 0.00 0.00 55.69 53.40 1nu8 s MET 528 Cb -0.11 -1.79 -0.03 0.00 2.01 0.00 0.00 34.83 34.90 1nu8 s MET 528 CO 0.24 0.35 0.33 0.42 -0.01 0.00 0.00 175.02 176.35 1nu8 s ILE 529 N -0.18 5.21 -0.10 2.53 1.01 0.10 -0.11 121.20 129.66 1nu8 s ILE 529 Ca -0.00 0.33 -0.01 0.00 0.00 0.00 0.00 60.65 60.97 1nu8 s ILE 529 Cb -0.11 -3.69 -0.03 0.00 0.01 0.00 0.00 42.46 38.64 1nu8 s ILE 529 CO 0.02 0.11 -0.03 -0.76 0.00 0.00 0.00 174.94 174.28 1nu8 s LEU 530 N 1.98 3.37 0.62 2.97 1.43 0.14 -2.04 118.68 127.16 1nu8 s LEU 530 Ca 0.12 0.03 -0.18 0.00 -1.03 0.00 0.00 54.13 53.07 1nu8 s LEU 530 Cb -0.16 -1.77 -0.05 0.00 0.03 0.00 0.00 46.19 44.24 1nu8 s LEU 530 CO 0.11 0.33 0.77 -2.65 0.23 0.00 0.00 176.35 175.13 1nu8 n PRO 531 N 2.49 0.65 -1.57 1.29 -0.02 -1.26 -0.80 135.00 135.77 1nu8 n PRO 531 Ca -0.18 0.26 -0.42 0.00 -2.02 0.00 0.00 63.50 61.14 1nu8 n PRO 531 Cb 0.53 -1.99 0.01 0.00 -0.02 0.00 0.00 33.50 32.03 1nu8 n PRO 531 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1nu8 n PRO 532 N -0.80 1.16 -3.68 0.52 -0.04 -1.26 -2.68 135.00 128.22 1nu8 n PRO 532 Ca 0.13 0.42 -0.25 0.00 -0.04 0.00 0.00 63.50 63.76 1nu8 n PRO 532 Cb 0.48 -1.91 0.06 0.00 -0.04 0.00 0.00 33.50 32.09 1nu8 n PRO 532 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1nu8 n HIS 533 N -0.55 -2.55 -1.71 0.54 8.25 -1.26 -4.86 115.22 113.08 1nu8 n HIS 533 Ca 0.10 0.96 -0.43 0.00 -0.26 0.00 0.00 57.72 58.09 1nu8 n HIS 533 Cb 0.39 -4.68 -0.03 0.00 1.12 0.00 0.00 29.99 26.79 1nu8 n HIS 533 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1nu8 n PHE 534 N -4.74 2.62 -3.98 4.41 7.35 -1.09 -4.98 117.46 117.05 1nu8 n PHE 534 Ca -0.05 0.16 -0.35 0.00 -0.76 0.00 0.00 57.45 56.46 1nu8 n PHE 534 Cb 0.57 -2.61 -0.14 0.00 0.35 0.00 0.00 39.48 37.65 1nu8 n PHE 534 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1nu8 s ASP 535 N 0.91 4.11 0.00 -2.13 -1.08 -1.26 -4.99 116.67 112.22 1nu8 s ASP 535 Ca 0.73 -0.43 0.16 0.00 -0.52 0.00 0.00 52.55 52.50 1nu8 s ASP 535 Cb -0.55 -1.69 0.72 0.00 -1.46 0.00 0.00 42.92 39.93 1nu8 s ASP 535 CO 0.38 -0.01 1.52 2.29 0.52 0.00 0.00 175.17 179.87 1nu8 n LYS 536 N 4.71 0.03 0.13 4.34 2.85 -1.26 -2.52 118.16 126.44 1nu8 n LYS 536 Ca -0.19 0.21 0.08 0.00 -1.05 0.00 0.00 58.31 57.36 1nu8 n LYS 536 Cb 0.51 -1.50 0.04 0.00 -0.65 0.00 0.00 35.03 33.42 1nu8 n LYS 536 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1nu8 h SER 537 N 0.00 0.00 -4.55 -5.58 4.64 -1.94 -3.39 113.55 102.72 1nu8 h SER 537 Ca 0.00 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.84 1nu8 h SER 537 Cb 0.26 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 62.45 1nu8 h SER 537 CO 0.00 0.17 0.41 -0.54 -0.87 0.00 0.00 176.83 176.00 1nu8 s LYS 538 N -3.19 2.22 -0.30 4.77 1.02 -1.05 -4.95 119.74 118.27 1nu8 s LYS 538 Ca 0.02 0.24 -0.00 0.00 0.02 0.00 0.00 55.97 56.25 1nu8 s LYS 538 Cb 0.08 -1.97 0.06 0.00 -0.52 0.00 0.00 37.83 35.48 1nu8 s LYS 538 CO 0.75 -1.44 -0.02 0.15 -0.92 0.00 0.00 175.35 173.88 1nu8 s LYS 539 N -5.49 2.31 0.02 1.68 1.02 -1.26 -4.11 119.74 113.92 1nu8 s LYS 539 Ca 0.61 -1.35 -0.02 0.00 0.02 0.00 0.00 55.97 55.23 1nu8 s LYS 539 Cb -0.11 -3.13 -0.04 0.00 -0.52 0.00 0.00 37.83 34.03 1nu8 s LYS 539 CO 0.50 -0.65 0.21 0.71 -0.92 0.00 0.00 175.35 175.21 1nu8 s TYR 540 N 1.19 3.54 0.40 3.18 1.51 0.36 -4.56 117.35 122.97 1nu8 s TYR 540 Ca -0.05 0.36 -0.26 0.00 -1.01 0.00 0.00 57.07 56.11 1nu8 s TYR 540 Cb -0.20 -1.83 -0.09 0.00 -0.11 0.00 0.00 41.96 39.73 1nu8 s TYR 540 CO -0.03 0.61 1.29 -1.25 -1.11 0.00 0.00 175.55 175.07 1nu8 s PRO 541 N -2.14 4.00 -0.13 -1.71 0.04 -1.26 -1.04 135.00 132.77 1nu8 s PRO 541 Ca 0.31 2.12 0.01 0.00 0.04 0.00 0.00 61.00 63.48 1nu8 s PRO 541 Cb -0.13 -2.77 0.02 0.00 0.04 0.00 0.00 34.50 31.66 1nu8 s PRO 541 CO 0.22 -0.45 -0.14 -1.17 0.04 0.00 0.00 177.00 175.49 1nu8 s LEU 542 N -2.39 1.66 -0.39 -3.56 0.20 -0.63 -0.45 118.68 113.12 1nu8 s LEU 542 Ca 0.56 -0.44 -0.12 0.00 0.69 0.00 0.00 54.13 54.82 1nu8 s LEU 542 Cb -0.37 -1.11 0.03 0.00 -0.43 0.00 0.00 46.19 44.31 1nu8 s LEU 542 CO 0.48 -0.02 0.24 -0.22 -0.29 0.00 0.00 176.35 176.54 1nu8 s LEU 543 N 1.25 4.89 -0.44 -0.68 0.20 0.14 -1.56 118.68 122.48 1nu8 s LEU 543 Ca -0.01 -0.98 -0.29 0.00 0.69 0.00 0.00 54.13 53.55 1nu8 s LEU 543 Cb -0.14 -2.07 0.01 0.00 -0.43 0.00 0.00 46.19 43.55 1nu8 s LEU 543 CO -0.06 -0.42 1.46 -0.22 -0.29 0.00 0.00 176.35 176.83 1nu8 s LEU 544 N 1.60 3.54 -0.39 -0.68 2.96 -0.40 -0.06 118.68 125.24 1nu8 s LEU 544 Ca 0.03 0.77 -0.21 0.00 -0.22 0.00 0.00 54.13 54.50 1nu8 s LEU 544 Cb -0.19 -3.43 0.01 0.00 0.50 0.00 0.00 46.19 43.08 1nu8 s LEU 544 CO 0.08 -1.53 0.67 -0.62 -1.32 0.00 0.00 176.35 173.62 1nu8 s ASP 545 N 4.34 6.41 -0.01 3.68 -1.08 0.15 -1.05 116.67 129.11 1nu8 s ASP 545 Ca 0.62 0.01 0.06 0.00 -0.52 0.00 0.00 52.55 52.72 1nu8 s ASP 545 Cb -0.14 -2.34 -0.03 0.00 -1.46 0.00 0.00 42.92 38.96 1nu8 s ASP 545 CO 0.31 -0.69 -0.20 0.54 0.52 0.00 0.00 175.17 175.66 1nu8 s VAL 546 N 2.83 2.60 0.06 1.11 0.11 -0.42 -4.38 120.40 122.33 1nu8 s VAL 546 Ca 0.25 -1.01 0.00 0.00 -2.93 0.00 0.00 61.98 58.29 1nu8 s VAL 546 Cb -0.14 -2.01 0.00 0.00 -1.53 0.00 0.00 36.38 32.70 1nu8 s VAL 546 CO 0.17 0.51 0.00 0.00 -3.33 0.00 0.00 175.10 172.45 1nu8 n TYR 547 N 2.13 -0.34 -2.25 1.54 9.36 -1.26 -4.21 117.16 122.13 1nu8 n TYR 547 Ca -0.17 0.06 -0.20 0.00 3.32 0.00 0.00 57.90 60.91 1nu8 n TYR 547 Cb 0.52 0.19 -0.02 0.00 -0.63 0.00 0.00 39.34 39.39 1nu8 n TYR 547 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1nu8 n ALA 548 N -2.87 -0.57 -1.67 2.98 0.00 -1.26 -3.37 120.51 113.75 1nu8 n ALA 548 Ca 0.00 0.19 -0.29 0.00 0.00 0.00 0.00 53.44 53.34 1nu8 n ALA 548 Cb 0.00 -2.11 0.14 0.00 0.00 0.00 0.00 19.45 17.48 1nu8 n ALA 548 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1nu8 s GLY 549 N -2.17 1.61 0.05 0.00 0.00 -1.26 -4.89 107.32 100.66 1nu8 s GLY 549 Ca 0.00 -0.71 -0.30 0.00 0.00 0.00 0.00 44.72 43.71 1nu8 s GLY 549 CO 0.00 -0.11 1.80 -4.14 0.00 0.00 0.00 173.10 170.66 1nu8 s PRO 550 N -5.47 4.16 -0.64 2.90 0.02 -1.26 -1.31 135.00 133.40 1nu8 s PRO 550 Ca 0.66 2.47 0.00 0.00 0.02 0.00 0.00 61.00 64.14 1nu8 s PRO 550 Cb -0.11 -3.85 0.00 0.00 0.02 0.00 0.00 34.50 30.56 1nu8 s PRO 550 CO 0.52 -0.85 0.00 0.00 -0.33 0.00 0.00 177.00 176.34 1nu8 s SER 552 N -2.88 5.82 -0.17 0.00 1.04 -0.43 -4.15 113.70 112.93 1nu8 s SER 552 Ca 0.00 0.96 -0.04 0.00 0.48 0.00 0.00 55.95 57.35 1nu8 s SER 552 Cb 0.00 -2.00 0.08 0.00 0.10 0.00 0.00 66.02 64.20 1nu8 s SER 552 CO 0.00 -0.97 0.21 -1.58 0.98 0.00 0.00 173.24 171.87 1nu8 s GLN 553 N -5.04 0.15 -0.00 4.02 0.74 -1.26 -2.23 119.66 116.04 1nu8 s GLN 553 Ca 0.53 0.33 0.11 0.00 0.05 0.00 0.00 55.36 56.38 1nu8 s GLN 553 Cb -0.11 -0.91 -0.13 0.00 1.10 0.00 0.00 33.01 32.97 1nu8 s GLN 553 CO 0.48 -0.54 0.44 1.63 -0.55 0.00 0.00 175.29 176.74 1nu8 n LYS 554 N 5.32 3.01 -3.67 1.67 4.76 -1.26 -4.86 118.16 123.13 1nu8 n LYS 554 Ca -0.05 -0.01 -0.38 0.00 -2.87 0.00 0.00 58.31 54.99 1nu8 n LYS 554 Cb 0.50 -1.05 -0.12 0.00 -1.84 0.00 0.00 35.03 32.52 1nu8 n LYS 554 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1nu8 s ALA 555 N -2.13 3.27 0.35 7.82 0.00 -1.26 -4.67 121.76 125.13 1nu8 s ALA 555 Ca 0.03 -1.35 -0.16 0.00 0.00 0.00 0.00 51.96 50.49 1nu8 s ALA 555 Cb 0.08 -2.34 0.04 0.00 0.00 0.00 0.00 23.12 20.90 1nu8 s ALA 555 CO 0.45 -0.84 0.73 0.16 0.00 0.00 0.00 175.76 176.26 1nu8 s ASP 556 N 1.62 0.01 0.00 0.00 1.47 -1.26 -4.46 116.67 114.04 1nu8 s ASP 556 Ca 0.05 -1.02 0.20 0.00 1.18 0.00 0.00 52.55 52.95 1nu8 s ASP 556 Cb -0.17 0.79 0.54 0.00 -0.34 0.00 0.00 42.92 43.74 1nu8 s ASP 556 CO 0.06 -1.54 1.44 0.35 0.68 0.00 0.00 175.17 176.16 1nu8 n THR 557 N -0.51 0.48 -2.81 2.11 -2.24 -1.13 -4.98 114.28 105.21 1nu8 n THR 557 Ca -0.06 -0.60 -0.36 0.00 -2.27 0.00 0.00 64.05 60.76 1nu8 n THR 557 Cb 0.60 0.55 -0.07 0.00 -2.10 0.00 0.00 70.33 69.31 1nu8 n THR 557 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1nu8 s VAL 558 N -1.52 4.27 -0.26 2.28 0.11 -1.26 -1.84 120.40 122.18 1nu8 s VAL 558 Ca 0.35 1.71 -0.27 0.00 -2.93 0.00 0.00 61.98 60.84 1nu8 s VAL 558 Cb 0.19 -3.90 0.01 0.00 -1.53 0.00 0.00 36.38 31.15 1nu8 s VAL 558 CO 0.27 0.03 0.97 0.12 -3.33 0.00 0.00 175.10 173.16 1nu8 s PHE 559 N -1.75 3.27 0.07 1.54 5.36 0.24 -4.89 117.98 121.82 1nu8 s PHE 559 Ca 0.53 1.25 0.09 0.00 -0.96 0.00 0.00 56.93 57.84 1nu8 s PHE 559 Cb -0.16 -3.32 -0.03 0.00 -0.34 0.00 0.00 43.02 39.16 1nu8 s PHE 559 CO 0.21 -0.55 -0.24 1.03 -1.46 0.00 0.00 175.22 174.21 1nu8 s ARG 560 N 3.21 1.51 -0.46 10.12 0.52 -1.26 -4.89 118.95 127.69 1nu8 s ARG 560 Ca 0.41 -1.11 -0.05 0.00 -0.52 0.00 0.00 55.73 54.46 1nu8 s ARG 560 Cb -0.14 -1.74 0.12 0.00 0.52 0.00 0.00 34.95 33.71 1nu8 s ARG 560 CO 0.09 0.44 0.29 -0.51 0.02 0.00 0.00 175.30 175.63 1nu8 s LEU 561 N -1.45 5.42 0.00 2.53 1.43 -1.26 -4.90 118.68 120.46 1nu8 s LEU 561 Ca 0.10 -2.11 0.00 0.00 -1.03 0.00 0.00 54.13 51.09 1nu8 s LEU 561 Cb -0.10 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.23 1nu8 s LEU 561 CO 0.03 -0.57 0.00 -0.46 0.23 0.00 0.00 176.35 175.58 1nu8 n ASN 562 N 4.55 0.00 0.09 2.29 2.04 -1.26 -5.00 115.26 117.97 1nu8 n ASN 562 Ca -0.02 -0.59 -0.13 0.00 -0.44 0.00 0.00 54.58 53.39 1nu8 n ASN 562 Cb 0.41 0.00 -0.06 0.00 -2.53 0.00 0.00 39.78 37.60 1nu8 n ASN 562 CO 0.00 0.00 0.00 -0.25 -0.44 0.00 0.00 177.26 176.57 1nu8 h TRP 563 N 0.59 -1.04 -0.89 -2.53 7.01 -1.97 -1.37 115.95 115.76 1nu8 h TRP 563 Ca 0.00 0.03 0.24 0.00 2.11 0.00 0.00 58.89 61.27 1nu8 h TRP 563 Cb 0.00 0.45 -0.15 0.00 -2.10 0.00 0.00 29.16 27.36 1nu8 h TRP 563 CO 0.00 -0.47 0.17 0.00 -2.79 0.00 0.00 178.44 175.35 1nu8 h ALA 564 N 0.03 1.21 -0.89 2.65 0.00 -1.98 0.26 119.26 120.54 1nu8 h ALA 564 Ca 0.04 0.25 0.18 0.00 0.00 0.00 0.00 54.91 55.38 1nu8 h ALA 564 Cb 0.62 0.39 -0.11 0.00 0.00 0.00 0.00 17.79 18.70 1nu8 h ALA 564 CO -0.26 -0.50 0.44 1.15 0.00 0.00 0.00 179.25 180.09 1nu8 h THR 565 N 0.14 0.63 -0.07 0.00 2.02 -1.61 0.53 112.91 114.56 1nu8 h THR 565 Ca 0.55 -0.19 -0.24 0.00 0.77 0.00 0.00 66.41 67.30 1nu8 h THR 565 Cb 1.12 0.02 0.01 0.00 -1.74 0.00 0.00 68.15 67.57 1nu8 h THR 565 CO -0.72 0.10 -0.92 0.22 0.37 0.00 0.00 175.52 174.58 1nu8 h TYR 566 N 0.56 1.01 -0.57 3.16 3.20 -0.18 -1.08 116.97 123.06 1nu8 h TYR 566 Ca 0.52 -0.50 -0.08 0.00 3.14 0.00 0.00 58.73 61.80 1nu8 h TYR 566 Cb 0.85 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.96 1nu8 h TYR 566 CO -0.10 1.34 0.03 -0.07 -1.64 0.00 0.00 178.16 177.72 1nu8 h LEU 567 N 0.44 0.93 -0.02 2.82 3.38 -0.58 -1.42 115.31 120.86 1nu8 h LEU 567 Ca -0.09 -0.24 -0.16 0.00 0.09 0.00 0.00 57.88 57.48 1nu8 h LEU 567 Cb 1.56 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 42.07 1nu8 h LEU 567 CO 0.18 0.97 -0.61 0.00 0.09 0.00 0.00 178.44 179.08 1nu8 h ALA 568 N 1.13 0.10 -0.26 1.53 0.00 -0.93 -0.49 119.26 120.33 1nu8 h ALA 568 Ca 0.17 -0.57 -0.07 0.00 0.00 0.00 0.00 54.91 54.45 1nu8 h ALA 568 Cb 0.49 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1nu8 h ALA 568 CO 0.02 0.37 -0.10 1.03 0.00 0.00 0.00 179.25 180.58 1nu8 h SER 569 N -0.04 0.54 0.00 0.00 0.87 -1.12 -3.17 113.55 110.63 1nu8 h SER 569 Ca -0.07 -0.39 -0.40 0.00 -1.23 0.00 0.00 61.79 59.70 1nu8 h SER 569 Cb 1.31 -0.15 -0.07 0.00 -0.44 0.00 0.00 62.40 63.05 1nu8 h SER 569 CO 0.12 0.81 -2.45 0.41 -0.53 0.00 0.00 176.83 175.19 1nu8 n THR 570 N -4.49 1.44 0.78 2.23 -1.04 -0.54 -4.61 114.28 108.05 1nu8 n THR 570 Ca -0.04 -0.48 0.12 0.00 -2.04 0.00 0.00 64.05 61.61 1nu8 n THR 570 Cb 0.33 -1.55 0.15 0.00 -1.82 0.00 0.00 70.33 67.44 1nu8 n THR 570 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1nu8 n GLU 571 N -3.58 2.38 -2.88 -2.82 -0.58 -0.76 -4.96 120.64 107.45 1nu8 n GLU 571 Ca -0.47 -2.03 -0.21 0.00 -0.42 0.00 0.00 57.16 54.03 1nu8 n GLU 571 Cb 0.94 -1.48 0.02 0.00 -0.57 0.00 0.00 31.44 30.34 1nu8 n GLU 571 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1nu8 n ASN 572 N 1.37 -5.55 -4.69 1.62 3.02 -0.27 -4.91 115.26 105.85 1nu8 n ASN 572 Ca 0.16 -0.20 -0.36 0.00 -0.03 0.00 0.00 54.58 54.15 1nu8 n ASN 572 Cb 0.60 -4.54 -0.09 0.00 -0.61 0.00 0.00 39.78 35.14 1nu8 n ASN 572 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1nu8 s ILE 573 N -3.06 5.36 -0.15 2.41 1.01 -0.74 -4.39 121.20 121.63 1nu8 s ILE 573 Ca 0.22 0.25 -0.29 0.00 0.00 0.00 0.00 60.65 60.83 1nu8 s ILE 573 Cb -0.10 -3.52 -0.02 0.00 0.01 0.00 0.00 42.46 38.83 1nu8 s ILE 573 CO 0.27 0.38 1.39 -0.63 0.00 0.00 0.00 174.94 176.35 1nu8 s ILE 574 N 0.76 4.06 -0.33 2.92 1.01 0.40 -3.67 121.20 126.34 1nu8 s ILE 574 Ca 0.09 1.27 -0.16 0.00 0.00 0.00 0.00 60.65 61.85 1nu8 s ILE 574 Cb -0.13 -3.86 -0.01 0.00 0.01 0.00 0.00 42.46 38.47 1nu8 s ILE 574 CO 0.02 -0.16 0.39 -0.69 0.00 0.00 0.00 174.94 174.50 1nu8 s VAL 575 N 3.82 5.15 0.12 2.92 1.01 -0.86 0.26 120.40 132.81 1nu8 s VAL 575 Ca 0.61 0.18 0.07 0.00 0.00 0.00 0.00 61.98 62.83 1nu8 s VAL 575 Cb -0.24 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.27 1nu8 s VAL 575 CO 0.20 -0.07 -0.06 0.00 0.00 0.00 0.00 175.10 175.17 1nu8 s ALA 576 N 2.09 3.09 0.05 5.51 0.00 0.92 0.02 121.76 133.42 1nu8 s ALA 576 Ca 0.13 -1.24 0.01 0.00 0.00 0.00 0.00 51.96 50.86 1nu8 s ALA 576 Cb -0.16 -0.98 -0.03 0.00 0.00 0.00 0.00 23.12 21.95 1nu8 s ALA 576 CO 0.12 0.62 -0.06 -1.12 0.00 0.00 0.00 175.76 175.32 1nu8 s SER 577 N -2.39 0.75 -0.14 0.00 0.01 0.46 0.34 113.70 112.72 1nu8 s SER 577 Ca 0.24 -0.65 -0.07 0.00 1.31 0.00 0.00 55.95 56.78 1nu8 s SER 577 Cb -0.11 0.07 0.06 0.00 0.21 0.00 0.00 66.02 66.25 1nu8 s SER 577 CO 0.16 -0.30 0.33 0.12 0.41 0.00 0.00 173.24 173.96 1nu8 s PHE 578 N -1.97 -0.50 -0.59 2.43 5.36 -1.26 -1.59 117.98 119.86 1nu8 s PHE 578 Ca -0.06 1.09 -0.19 0.00 -0.96 0.00 0.00 56.93 56.81 1nu8 s PHE 578 Cb -0.06 0.14 0.10 0.00 -0.34 0.00 0.00 43.02 42.86 1nu8 s PHE 578 CO -0.02 -0.33 0.69 -0.51 -1.46 0.00 0.00 175.22 173.60 1nu8 s ASP 579 N 1.72 6.18 0.02 6.13 1.01 0.14 -4.86 116.67 127.02 1nu8 s ASP 579 Ca -0.06 -1.43 0.00 0.00 0.71 0.00 0.00 52.55 51.76 1nu8 s ASP 579 Cb -0.10 -2.30 0.00 0.00 1.01 0.00 0.00 42.92 41.53 1nu8 s ASP 579 CO -0.10 -1.09 0.00 0.61 0.21 0.00 0.00 175.17 174.79 1nu8 n GLY 580 N 5.28 1.44 3.69 0.21 0.00 -1.26 -3.98 105.19 110.56 1nu8 n GLY 580 Ca -0.10 -1.98 -0.34 0.00 0.00 0.00 0.00 46.02 43.60 1nu8 n GLY 580 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nu8 n ARG 581 N -0.11 0.37 0.00 1.61 1.74 -1.26 -1.78 116.66 117.22 1nu8 n ARG 581 Ca 0.00 0.20 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 1nu8 n ARG 581 Cb 0.00 -2.42 0.00 0.00 -1.02 0.00 0.00 32.46 29.02 1nu8 n ARG 581 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nu8 n GLY 582 N 0.69 2.74 3.88 -0.13 0.00 0.90 -4.13 105.19 109.14 1nu8 n GLY 582 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1nu8 n GLY 582 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nu8 s SER 583 N -3.70 5.81 0.54 1.61 1.04 -0.74 0.09 113.70 118.35 1nu8 s SER 583 Ca 0.00 1.20 0.06 0.00 0.48 0.00 0.00 55.95 57.69 1nu8 s SER 583 Cb 0.00 -2.14 0.04 0.00 0.10 0.00 0.00 66.02 64.02 1nu8 s SER 583 CO 0.00 -1.09 0.44 -0.83 0.98 0.00 0.00 173.24 172.74 1nu8 s GLY 584 N -4.27 2.30 -0.01 7.32 0.00 -0.95 -3.46 107.32 108.25 1nu8 s GLY 584 Ca 0.56 -1.38 0.00 0.00 0.00 0.00 0.00 44.72 43.90 1nu8 s GLY 584 CO 0.52 -1.91 0.00 -1.72 0.00 0.00 0.00 173.10 169.99 1nu8 n TYR 585 N -1.81 0.00 -1.02 1.90 4.01 -1.26 -4.79 117.16 114.19 1nu8 n TYR 585 Ca 0.00 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.76 1nu8 n TYR 585 Cb 0.64 -0.93 0.02 0.00 -0.31 0.00 0.00 39.34 38.76 1nu8 n TYR 585 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1nu8 n GLN 586 N -1.17 0.84 0.00 -0.72 6.02 -1.26 -4.41 117.38 116.67 1nu8 n GLN 586 Ca -0.00 -1.11 0.00 0.00 -0.01 0.00 0.00 57.00 55.88 1nu8 n GLN 586 Cb 0.23 -0.74 0.00 0.00 1.02 0.00 0.00 30.24 30.75 1nu8 n GLN 586 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1nu8 n GLY 587 N -0.30 1.66 0.11 1.08 0.00 -1.26 -4.69 105.19 101.80 1nu8 n GLY 587 Ca 0.02 -2.01 -0.07 0.00 0.00 0.00 0.00 46.02 43.96 1nu8 n GLY 587 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1nu8 h ASP 588 N 0.00 0.13 -0.69 1.61 5.19 -1.16 -2.05 116.42 119.45 1nu8 h ASP 588 Ca 0.00 -0.11 0.07 0.00 -0.62 0.00 0.00 57.03 56.37 1nu8 h ASP 588 Cb 0.00 -0.04 -0.06 0.00 0.18 0.00 0.00 39.33 39.41 1nu8 h ASP 588 CO 0.00 0.92 0.36 0.50 -3.12 0.00 0.00 179.24 177.90 1nu8 h LYS 589 N 0.06 0.63 0.01 3.56 3.64 -1.86 0.55 116.57 123.16 1nu8 h LYS 589 Ca -0.03 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.22 1nu8 h LYS 589 Cb 1.47 -0.14 0.01 0.00 -0.41 0.00 0.00 32.23 33.16 1nu8 h LYS 589 CO 0.12 0.42 -0.36 0.82 -2.27 0.00 0.00 179.45 178.18 1nu8 h ILE 590 N 0.65 1.53 -0.20 2.00 2.04 -1.83 -3.28 117.51 118.43 1nu8 h ILE 590 Ca 0.32 -2.05 -0.08 0.00 1.00 0.00 0.00 64.86 64.05 1nu8 h ILE 590 Cb 0.27 2.81 -0.00 0.00 -0.74 0.00 0.00 36.82 39.15 1nu8 h ILE 590 CO -0.22 0.57 -0.18 -0.03 0.00 0.00 0.00 178.15 178.29 1nu8 h MET 591 N -0.44 0.47 0.00 2.37 4.05 -0.90 0.26 114.93 120.74 1nu8 h MET 591 Ca -0.05 -0.24 0.00 0.00 -0.28 0.00 0.00 59.70 59.13 1nu8 h MET 591 Cb 1.13 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.93 1nu8 h MET 591 CO 0.07 0.81 0.00 0.72 0.23 0.00 0.00 176.91 178.74 1nu8 n HIS 592 N -4.47 0.00 0.29 1.39 8.25 0.19 -3.86 115.22 117.01 1nu8 n HIS 592 Ca -0.05 0.00 0.17 0.00 -0.26 0.00 0.00 57.72 57.58 1nu8 n HIS 592 Cb 0.39 0.00 0.81 0.00 1.12 0.00 0.00 29.99 32.31 1nu8 n HIS 592 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1nu8 h ALA 593 N 3.12 1.00 -0.01 -1.41 0.00 -1.58 -1.48 119.26 118.89 1nu8 h ALA 593 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1nu8 h ALA 593 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1nu8 h ALA 593 CO 0.00 0.00 -0.03 1.51 0.00 0.00 0.00 179.25 180.73 1nu8 n ILE 594 N -2.73 0.00 -1.67 0.00 3.06 -1.25 -4.89 119.36 111.88 1nu8 n ILE 594 Ca -0.01 -0.49 -0.58 0.00 -2.50 0.00 0.00 62.75 59.18 1nu8 n ILE 594 Cb 0.15 1.20 -0.07 0.00 0.54 0.00 0.00 39.64 41.46 1nu8 n ILE 594 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 1nu8 n ASN 595 N 0.47 1.79 -0.38 9.51 5.15 -0.56 -0.14 115.26 131.11 1nu8 n ASN 595 Ca 0.06 1.11 -0.05 0.00 -0.60 0.00 0.00 54.58 55.10 1nu8 n ASN 595 Cb 0.25 -1.09 -0.02 0.00 -0.53 0.00 0.00 39.78 38.39 1nu8 n ASN 595 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1nu8 n ARG 596 N 4.06 -1.20 -1.94 1.20 1.74 0.57 -4.80 116.66 116.29 1nu8 n ARG 596 Ca 0.24 0.57 0.00 0.00 -0.77 0.00 0.00 57.85 57.89 1nu8 n ARG 596 Cb 0.11 -4.60 0.03 0.00 -1.02 0.00 0.00 32.46 26.98 1nu8 n ARG 596 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1nu8 n ARG 597 N -1.15 0.67 -1.60 5.56 3.00 0.81 -4.87 116.66 119.08 1nu8 n ARG 597 Ca -0.05 -2.16 -0.46 0.00 -0.01 0.00 0.00 57.85 55.17 1nu8 n ARG 597 Cb 0.38 -0.32 -0.02 0.00 0.00 0.00 0.00 32.46 32.49 1nu8 n ARG 597 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1nu8 n LEU 598 N -0.16 1.89 -0.32 0.55 4.77 -1.18 -3.31 117.00 119.24 1nu8 n LEU 598 Ca -0.03 1.16 0.00 0.00 -0.03 0.00 0.00 56.01 57.12 1nu8 n LEU 598 Cb 0.94 -1.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 1nu8 n LEU 598 CO -0.04 -1.24 0.00 0.61 -1.33 0.00 0.00 177.39 175.39 1nu8 n GLY 599 N 1.60 0.89 0.00 -0.72 0.00 -1.26 -4.84 105.19 100.86 1nu8 n GLY 599 Ca 0.12 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1nu8 n GLY 599 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1nu8 n THR 600 N -1.24 0.00 0.09 2.61 5.66 -1.21 -4.85 114.28 115.34 1nu8 n THR 600 Ca 0.00 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 61.03 1nu8 n THR 600 Cb 0.28 0.00 0.40 0.00 -1.55 0.00 0.00 70.33 69.46 1nu8 n THR 600 CO 0.00 0.00 0.00 -0.26 -3.05 0.00 0.00 175.07 171.76 1nu8 h PHE 601 N 0.00 0.33 -0.09 1.09 0.04 -1.90 -0.41 116.94 116.00 1nu8 h PHE 601 Ca 0.00 -0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.69 1nu8 h PHE 601 Cb 0.00 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.04 1nu8 h PHE 601 CO 0.00 0.36 -0.20 1.05 -0.60 0.00 0.00 178.31 178.93 1nu8 h GLU 602 N 0.32 0.15 0.08 1.51 9.09 -1.91 -1.83 114.58 121.98 1nu8 h GLU 602 Ca 0.07 -0.04 -0.00 0.00 0.05 0.00 0.00 59.36 59.44 1nu8 h GLU 602 Cb 0.26 -0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.34 1nu8 h GLU 602 CO 0.01 0.35 -0.04 0.28 0.05 0.00 0.00 179.01 179.66 1nu8 h VAL 603 N 0.14 0.69 -0.69 -1.06 2.07 -1.56 -3.16 116.25 112.67 1nu8 h VAL 603 Ca 0.03 -1.34 0.14 0.00 0.82 0.00 0.00 66.70 66.35 1nu8 h VAL 603 Cb 0.44 1.25 -0.10 0.00 -1.52 0.00 0.00 31.29 31.36 1nu8 h VAL 603 CO 0.03 0.21 0.17 -0.33 0.02 0.00 0.00 177.57 177.67 1nu8 h GLU 604 N -0.97 0.27 0.00 1.57 5.08 -1.15 -1.47 114.58 117.91 1nu8 h GLU 604 Ca -0.01 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1nu8 h GLU 604 Cb 0.44 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1nu8 h GLU 604 CO 0.02 0.18 -0.21 -0.44 -1.00 0.00 0.00 179.01 177.56 1nu8 h ASP 605 N 0.28 0.00 -0.11 1.42 5.19 -1.46 -0.06 116.42 121.69 1nu8 h ASP 605 Ca 0.38 0.00 -0.18 0.00 -0.62 0.00 0.00 57.03 56.61 1nu8 h ASP 605 Cb 0.61 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.12 1nu8 h ASP 605 CO -0.46 0.21 -0.59 1.56 -3.12 0.00 0.00 179.24 176.84 1nu8 h GLN 606 N 0.00 0.71 -0.08 3.56 1.08 -1.24 -2.01 115.11 117.14 1nu8 h GLN 606 Ca -0.00 -0.47 -0.05 0.00 -1.45 0.00 0.00 58.65 56.68 1nu8 h GLN 606 Cb 0.54 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.03 1nu8 h GLN 606 CO 0.03 1.09 -0.14 0.82 -0.95 0.00 0.00 178.83 179.68 1nu8 h ILE 607 N 0.53 1.40 -0.92 2.54 2.04 -1.10 -1.60 117.51 120.40 1nu8 h ILE 607 Ca 0.00 -1.43 0.17 0.00 1.00 0.00 0.00 64.86 64.60 1nu8 h ILE 607 Cb 1.17 2.16 -0.08 0.00 -0.74 0.00 0.00 36.82 39.33 1nu8 h ILE 607 CO 0.12 0.40 0.59 -0.08 0.00 0.00 0.00 178.15 179.18 1nu8 h GLU 608 N -0.24 0.63 0.10 2.37 4.57 -1.03 0.65 114.58 121.63 1nu8 h GLU 608 Ca 0.00 -0.04 -0.26 0.00 -1.18 0.00 0.00 59.36 57.89 1nu8 h GLU 608 Cb 0.72 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 29.16 1nu8 h GLU 608 CO 0.03 0.42 -1.18 0.00 -1.18 0.00 0.00 179.01 177.10 1nu8 h ALA 609 N 1.61 0.16 -0.29 2.92 0.00 -1.38 -2.14 119.26 120.14 1nu8 h ALA 609 Ca 0.48 -0.88 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 1nu8 h ALA 609 Cb 0.85 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1nu8 h ALA 609 CO -0.23 1.02 0.04 0.00 0.00 0.00 0.00 179.25 180.08 1nu8 h ALA 610 N 0.67 0.38 -0.44 0.00 0.00 -0.21 -0.16 119.26 119.51 1nu8 h ALA 610 Ca -0.11 -0.19 0.09 0.00 0.00 0.00 0.00 54.91 54.70 1nu8 h ALA 610 Cb 1.91 -0.11 -0.10 0.00 0.00 0.00 0.00 17.79 19.50 1nu8 h ALA 610 CO 0.19 0.07 -0.29 0.00 0.00 0.00 0.00 179.25 179.22 1nu8 h ARG 611 N 0.29 -0.20 -0.55 0.00 3.08 0.22 -0.43 114.38 116.80 1nu8 h ARG 611 Ca 0.09 0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 1nu8 h ARG 611 Cb 0.34 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 1nu8 h ARG 611 CO 0.01 -0.13 0.24 1.96 -1.07 0.00 0.00 179.97 180.97 1nu8 h GLN 612 N -0.20 0.81 -0.19 0.04 4.20 -1.16 -1.60 115.11 117.02 1nu8 h GLN 612 Ca 0.19 -0.14 0.05 0.00 0.06 0.00 0.00 58.65 58.82 1nu8 h GLN 612 Cb 0.52 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 1nu8 h GLN 612 CO -0.55 0.69 0.14 0.74 -0.67 0.00 0.00 178.83 179.18 1nu8 h PHE 613 N 0.75 0.01 -0.18 2.96 0.04 -0.64 -2.37 116.94 117.50 1nu8 h PHE 613 Ca 0.19 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.95 1nu8 h PHE 613 Cb 0.17 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.31 1nu8 h PHE 613 CO 0.00 0.00 0.08 0.77 -0.60 0.00 0.00 178.31 178.56 1nu8 h SER 614 N 0.01 0.25 0.45 2.17 0.02 -0.09 -3.08 113.55 113.27 1nu8 h SER 614 Ca 0.09 -0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 60.85 1nu8 h SER 614 Cb 0.35 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.82 1nu8 h SER 614 CO -0.00 0.34 -0.16 0.11 -1.14 0.00 0.00 176.83 175.98 1nu8 h LYS 615 N 0.15 0.00 -7.03 3.45 1.57 -1.07 -3.43 116.57 110.22 1nu8 h LYS 615 Ca 0.06 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.30 1nu8 h LYS 615 Cb 0.16 0.00 0.11 0.00 0.08 0.00 0.00 32.23 32.58 1nu8 h LYS 615 CO -0.01 0.16 0.59 -1.64 -0.57 0.00 0.00 179.45 177.98 1nu8 s MET 616 N -4.12 3.39 -0.17 3.15 -1.94 -1.03 -4.90 119.30 113.68 1nu8 s MET 616 Ca -0.02 2.14 0.05 0.00 -1.71 0.00 0.00 55.69 56.14 1nu8 s MET 616 Cb 0.13 -2.36 0.39 0.00 2.01 0.00 0.00 34.83 35.00 1nu8 s MET 616 CO 0.61 -0.96 1.30 0.41 -0.01 0.00 0.00 175.02 176.37 1nu8 n GLY 617 N 0.64 2.74 0.00 -0.03 0.00 -1.26 -3.28 105.19 104.00 1nu8 n GLY 617 Ca 0.09 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1nu8 n GLY 617 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1nu8 n PHE 618 N 0.01 0.00 -3.83 1.61 1.16 -1.26 -4.69 117.46 110.47 1nu8 n PHE 618 Ca 0.22 0.00 -0.36 0.00 -1.87 0.00 0.00 57.45 55.44 1nu8 n PHE 618 Cb 0.91 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.67 1nu8 n PHE 618 CO 0.00 0.00 0.00 0.14 -1.87 0.00 0.00 176.76 175.03 1nu8 s VAL 619 N -0.37 4.69 -0.52 1.97 -7.23 -1.21 0.13 120.40 117.87 1nu8 s VAL 619 Ca 0.00 -0.05 -0.28 0.00 -1.81 0.00 0.00 61.98 59.84 1nu8 s VAL 619 Cb 0.00 -3.17 0.03 0.00 0.56 0.00 0.00 36.38 33.80 1nu8 s VAL 619 CO 0.00 0.37 1.12 -0.62 -0.31 0.00 0.00 175.10 175.66 1nu8 s ASP 620 N 1.14 6.52 0.00 4.85 2.15 -0.20 -4.80 116.67 126.33 1nu8 s ASP 620 Ca 0.05 0.22 0.15 0.00 0.43 0.00 0.00 52.55 53.40 1nu8 s ASP 620 Cb -0.14 -2.53 0.70 0.00 -0.30 0.00 0.00 42.92 40.65 1nu8 s ASP 620 CO 0.04 -1.32 1.46 -0.46 -0.17 0.00 0.00 175.17 174.71 1nu8 n ASN 621 N 7.98 0.00 0.22 -0.34 2.04 -1.26 -1.78 115.26 122.12 1nu8 n ASN 621 Ca 0.09 0.30 0.12 0.00 -0.44 0.00 0.00 54.58 54.65 1nu8 n ASN 621 Cb 0.49 -0.40 0.28 0.00 -2.53 0.00 0.00 39.78 37.62 1nu8 n ASN 621 CO 0.00 0.00 0.00 0.11 -0.44 0.00 0.00 177.26 176.93 1nu8 h LYS 622 N 0.00 0.00 -2.43 -3.83 1.57 -1.92 -3.35 116.57 106.60 1nu8 h LYS 622 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 1nu8 h LYS 622 Cb 0.20 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.10 1nu8 h LYS 622 CO 0.00 0.08 -0.71 0.54 -0.57 0.00 0.00 179.45 178.79 1nu8 n ARG 623 N -3.14 1.79 -4.09 3.15 1.74 -0.74 -4.68 116.66 110.69 1nu8 n ARG 623 Ca 0.03 -4.23 -0.34 0.00 -0.77 0.00 0.00 57.85 52.54 1nu8 n ARG 623 Cb 0.50 -2.03 -0.15 0.00 -1.02 0.00 0.00 32.46 29.76 1nu8 n ARG 623 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1nu8 s ILE 624 N -1.71 2.78 0.43 0.55 1.01 -1.26 -1.61 121.20 121.39 1nu8 s ILE 624 Ca 0.34 -0.70 0.07 0.00 0.00 0.00 0.00 60.65 60.36 1nu8 s ILE 624 Cb 0.09 -2.22 -0.03 0.00 0.01 0.00 0.00 42.46 40.30 1nu8 s ILE 624 CO -0.09 0.48 0.24 0.00 0.00 0.00 0.00 174.94 175.57 1nu8 s ALA 625 N 1.29 3.80 -0.14 9.38 0.00 -0.60 -0.59 121.76 134.90 1nu8 s ALA 625 Ca 0.04 -1.91 -0.11 0.00 0.00 0.00 0.00 51.96 49.98 1nu8 s ALA 625 Cb -0.14 -0.53 0.04 0.00 0.00 0.00 0.00 23.12 22.49 1nu8 s ALA 625 CO -0.06 -0.21 0.36 -1.50 0.00 0.00 0.00 175.76 174.35 1nu8 s ILE 626 N -2.61 -0.01 -0.01 0.00 2.07 -1.02 -1.28 121.20 118.35 1nu8 s ILE 626 Ca 0.40 0.03 -0.18 0.00 -1.41 0.00 0.00 60.65 59.50 1nu8 s ILE 626 Cb 0.02 -0.52 0.03 0.00 0.13 0.00 0.00 42.46 42.12 1nu8 s ILE 626 CO 0.23 0.01 0.38 -1.66 -1.91 0.00 0.00 174.94 171.99 1nu8 s TRP 627 N 0.53 -0.26 -0.15 3.50 1.48 -0.21 -0.85 118.94 122.96 1nu8 s TRP 627 Ca -0.03 0.39 -0.21 0.00 -1.06 0.00 0.00 56.10 55.19 1nu8 s TRP 627 Cb -0.04 0.16 0.05 0.00 -1.16 0.00 0.00 33.47 32.48 1nu8 s TRP 627 CO -0.03 -0.45 0.55 0.20 -4.06 0.00 0.00 176.95 173.16 1nu8 s GLY 628 N -1.41 -0.42 0.03 3.67 0.00 -0.93 -1.30 107.32 106.96 1nu8 s GLY 628 Ca -0.12 1.37 -0.20 0.00 0.00 0.00 0.00 44.72 45.76 1nu8 s GLY 628 CO 0.04 1.12 0.60 0.86 0.00 0.00 0.00 173.10 175.72 1nu8 s TRP 629 N -0.20 3.73 0.00 1.90 -0.11 -1.26 -1.56 118.94 121.44 1nu8 s TRP 629 Ca -0.04 1.25 0.00 0.00 1.22 0.00 0.00 56.10 58.53 1nu8 s TRP 629 Cb -0.03 -2.59 0.00 0.00 -1.50 0.00 0.00 33.47 29.35 1nu8 s TRP 629 CO 0.03 0.43 0.00 0.45 -4.62 0.00 0.00 176.95 173.24 1nu8 n SER 630 N 2.38 0.00 -0.04 5.86 2.88 0.71 -0.71 113.62 124.71 1nu8 n SER 630 Ca -0.08 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.59 1nu8 n SER 630 Cb 0.51 0.00 0.54 0.00 -0.75 0.00 0.00 64.21 64.51 1nu8 n SER 630 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1nu8 h TYR 631 N 0.00 0.32 -0.80 0.66 5.03 -1.87 0.31 116.97 120.63 1nu8 h TYR 631 Ca 0.00 0.01 0.09 0.00 2.58 0.00 0.00 58.73 61.40 1nu8 h TYR 631 Cb 0.00 -0.10 -0.07 0.00 1.55 0.00 0.00 36.73 38.11 1nu8 h TYR 631 CO 0.00 0.16 0.46 0.78 -1.32 0.00 0.00 178.16 178.24 1nu8 h GLY 632 N 0.31 1.23 1.08 1.82 0.00 -0.92 -0.93 103.07 105.65 1nu8 h GLY 632 Ca 0.24 -0.31 -0.11 0.00 0.00 0.00 0.00 47.33 47.15 1nu8 h GLY 632 CO -0.06 0.15 -0.10 -1.33 0.00 0.00 0.00 176.54 175.21 1nu8 h GLY 633 N 0.79 1.08 0.99 4.60 0.00 -0.20 0.21 103.07 110.54 1nu8 h GLY 633 Ca 0.38 -0.87 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1nu8 h GLY 633 CO -0.23 0.79 0.07 -1.82 0.00 0.00 0.00 176.54 175.36 1nu8 h TYR 634 N 0.87 0.15 -0.11 5.60 3.20 -0.96 0.14 116.97 125.86 1nu8 h TYR 634 Ca 0.14 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 1nu8 h TYR 634 Cb 0.66 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.87 1nu8 h TYR 634 CO 0.05 0.10 0.04 0.28 -1.64 0.00 0.00 178.16 176.99 1nu8 h VAL 635 N 0.15 1.16 -0.86 1.81 2.07 -1.05 0.40 116.25 119.93 1nu8 h VAL 635 Ca 0.04 -0.48 0.15 0.00 0.82 0.00 0.00 66.70 67.23 1nu8 h VAL 635 Cb -0.01 1.29 -0.09 0.00 -1.52 0.00 0.00 31.29 30.96 1nu8 h VAL 635 CO -0.01 0.14 0.45 0.74 0.02 0.00 0.00 177.57 178.91 1nu8 h THR 636 N -0.00 0.74 -0.35 2.57 2.02 -0.44 0.31 112.91 117.75 1nu8 h THR 636 Ca 0.03 -0.22 -0.14 0.00 0.77 0.00 0.00 66.41 66.86 1nu8 h THR 636 Cb 0.19 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.64 1nu8 h THR 636 CO -0.00 0.12 -0.31 0.28 0.37 0.00 0.00 175.52 175.97 1nu8 h SER 637 N 0.64 0.89 -0.61 4.18 0.02 -0.41 0.10 113.55 118.36 1nu8 h SER 637 Ca 0.46 -0.46 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 1nu8 h SER 637 Cb 0.65 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 1nu8 h SER 637 CO -0.36 1.16 0.18 0.24 -1.14 0.00 0.00 176.83 176.92 1nu8 h MET 638 N 0.63 0.99 -0.19 3.45 2.86 0.05 -0.78 114.93 121.93 1nu8 h MET 638 Ca 0.06 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.48 1nu8 h MET 638 Cb 0.89 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.40 1nu8 h MET 638 CO 0.08 0.86 0.07 0.28 1.06 0.00 0.00 176.91 179.26 1nu8 h VAL 639 N 0.95 1.18 0.00 -2.22 2.07 -0.26 -2.31 116.25 115.66 1nu8 h VAL 639 Ca 0.21 -0.55 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 1nu8 h VAL 639 Cb 0.30 1.18 -0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1nu8 h VAL 639 CO -0.01 0.17 -0.01 -0.07 0.02 0.00 0.00 177.57 177.68 1nu8 h LEU 640 N 0.14 0.00 -2.14 2.57 3.38 -0.18 -1.55 115.31 117.53 1nu8 h LEU 640 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1nu8 h LEU 640 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1nu8 h LEU 640 CO -0.00 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1nu8 n GLY 641 N -1.39 1.57 0.20 0.83 0.00 -0.36 -4.30 105.19 101.75 1nu8 n GLY 641 Ca -0.03 -0.68 0.13 0.00 0.00 0.00 0.00 46.02 45.44 1nu8 n GLY 641 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1nu8 h SER 642 N 3.93 0.00 0.00 1.61 4.64 -0.70 -3.43 113.55 119.60 1nu8 h SER 642 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1nu8 h SER 642 Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 1nu8 h SER 642 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1nu8 n GLY 643 N 0.97 0.52 0.32 -0.77 0.00 -1.26 -4.93 105.19 100.03 1nu8 n GLY 643 Ca 0.04 -0.18 0.16 0.00 0.00 0.00 0.00 46.02 46.04 1nu8 n GLY 643 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1nu8 h SER 644 N 0.00 0.00 -0.86 1.61 4.64 -1.90 -3.45 113.55 113.59 1nu8 h SER 644 Ca 0.00 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.00 1nu8 h SER 644 Cb 0.00 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 61.96 1nu8 h SER 644 CO 0.00 0.00 -0.29 0.61 -0.87 0.00 0.00 176.83 176.28 1nu8 n GLY 645 N -1.40 1.51 0.09 -0.77 0.00 -1.26 -4.86 105.19 98.50 1nu8 n GLY 645 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1nu8 n GLY 645 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1nu8 n VAL 646 N -2.22 1.02 -4.36 1.61 0.31 -1.26 -4.88 118.33 108.55 1nu8 n VAL 646 Ca -0.16 -0.68 -0.34 0.00 -0.01 0.00 0.00 64.34 63.15 1nu8 n VAL 646 Cb 0.61 -0.58 -0.11 0.00 -0.91 0.00 0.00 33.84 32.85 1nu8 n VAL 646 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 1nu8 s PHE 647 N -2.98 3.07 0.13 3.52 0.40 -1.26 -4.55 117.98 116.30 1nu8 s PHE 647 Ca -0.04 -0.18 -0.14 0.00 -0.60 0.00 0.00 56.93 55.97 1nu8 s PHE 647 Cb 0.09 -1.94 -0.02 0.00 0.51 0.00 0.00 43.02 41.65 1nu8 s PHE 647 CO 0.82 0.06 1.55 -0.22 0.70 0.00 0.00 175.22 178.14 1nu8 h LYS 648 N 6.46 0.74 -2.61 0.44 3.64 -1.12 -3.45 116.57 120.67 1nu8 h LYS 648 Ca -0.35 -0.26 0.13 0.00 -1.27 0.00 0.00 60.65 58.90 1nu8 h LYS 648 Cb 1.19 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.89 1nu8 h LYS 648 CO 0.63 0.86 0.39 0.00 -2.27 0.00 0.00 179.45 179.06 1nu8 s GLY 650 N -2.97 -0.35 -0.17 0.00 0.00 0.24 -2.42 107.32 101.66 1nu8 s GLY 650 Ca 0.13 0.73 0.01 0.00 0.00 0.00 0.00 44.72 45.59 1nu8 s GLY 650 CO 0.05 0.18 -0.20 -0.42 0.00 0.00 0.00 173.10 172.71 1nu8 s ILE 651 N -2.74 2.11 -0.36 0.90 1.01 -0.03 -1.80 121.20 120.28 1nu8 s ILE 651 Ca 0.12 -0.94 -0.07 0.00 0.00 0.00 0.00 60.65 59.76 1nu8 s ILE 651 Cb 0.01 -1.87 0.05 0.00 0.01 0.00 0.00 42.46 40.67 1nu8 s ILE 651 CO -0.03 0.54 0.15 0.00 0.00 0.00 0.00 174.94 175.60 1nu8 s ALA 652 N 1.12 3.11 -0.25 9.38 0.00 -0.68 -2.19 121.76 132.26 1nu8 s ALA 652 Ca 0.01 -1.91 -0.10 0.00 0.00 0.00 0.00 51.96 49.95 1nu8 s ALA 652 Cb -0.14 -2.37 -0.05 0.00 0.00 0.00 0.00 23.12 20.56 1nu8 s ALA 652 CO -0.09 -1.45 0.16 0.08 0.00 0.00 0.00 175.76 174.46 1nu8 s VAL 653 N 1.38 5.27 -1.10 0.00 1.01 -0.60 -2.63 120.40 123.72 1nu8 s VAL 653 Ca 0.00 0.15 -0.21 0.00 0.00 0.00 0.00 61.98 61.92 1nu8 s VAL 653 Cb -0.21 -3.46 0.00 0.00 0.00 0.00 0.00 36.38 32.71 1nu8 s VAL 653 CO 0.02 0.33 0.76 0.00 0.00 0.00 0.00 175.10 176.21 1nu8 n ALA 654 N 4.45 -2.58 -2.29 5.51 0.00 0.64 -0.21 120.51 126.03 1nu8 n ALA 654 Ca -0.15 -0.29 -0.35 0.00 0.00 0.00 0.00 53.44 52.66 1nu8 n ALA 654 Cb 0.52 -3.53 -0.06 0.00 0.00 0.00 0.00 19.45 16.38 1nu8 n ALA 654 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1nu8 s PRO 655 N -5.98 4.01 0.18 0.00 0.04 -1.26 -2.39 135.00 129.59 1nu8 s PRO 655 Ca 0.42 0.55 -0.31 0.00 0.04 0.00 0.00 61.00 61.70 1nu8 s PRO 655 Cb -0.17 -2.81 -0.10 0.00 0.04 0.00 0.00 34.50 31.47 1nu8 s PRO 655 CO 0.88 0.39 1.50 0.08 0.04 0.00 0.00 177.00 179.89 1nu8 s VAL 656 N -1.60 2.77 -0.08 -0.36 1.01 -1.23 -4.36 120.40 116.55 1nu8 s VAL 656 Ca 0.42 0.58 0.07 0.00 0.00 0.00 0.00 61.98 63.05 1nu8 s VAL 656 Cb -0.14 -3.37 -0.09 0.00 0.00 0.00 0.00 36.38 32.78 1nu8 s VAL 656 CO 0.20 0.06 0.18 -1.54 0.00 0.00 0.00 175.10 173.99 1nu8 n SER 657 N 3.53 2.71 -3.65 3.32 3.41 -1.26 -3.97 113.62 117.70 1nu8 n SER 657 Ca 0.11 -0.16 -0.08 0.00 -0.26 0.00 0.00 58.87 58.48 1nu8 n SER 657 Cb 0.40 1.23 -0.07 0.00 -0.26 0.00 0.00 64.21 65.50 1nu8 n SER 657 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1nu8 s ARG 658 N -2.25 0.68 0.34 4.33 3.52 -1.26 -0.55 118.95 123.76 1nu8 s ARG 658 Ca -0.01 1.15 0.27 0.00 -0.13 0.00 0.00 55.73 57.00 1nu8 s ARG 658 Cb 0.04 0.15 0.97 0.00 -1.56 0.00 0.00 34.95 34.55 1nu8 s ARG 658 CO 0.27 -0.14 1.78 -1.49 -0.81 0.00 0.00 175.30 174.91 1nu8 h TRP 659 N 6.79 0.00 0.00 5.12 4.06 -1.87 -1.55 115.95 128.50 1nu8 h TRP 659 Ca -0.31 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.64 1nu8 h TRP 659 Cb 1.22 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.38 1nu8 h TRP 659 CO 0.11 0.00 0.00 0.39 -3.56 0.00 0.00 178.44 175.38 1nu8 n GLU 660 N -2.55 0.20 0.05 0.49 1.02 -1.26 -2.46 120.64 116.13 1nu8 n GLU 660 Ca 0.03 0.14 0.03 0.00 -0.02 0.00 0.00 57.16 57.34 1nu8 n GLU 660 Cb 0.33 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.18 1nu8 n GLU 660 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1nu8 n TYR 661 N -1.32 0.96 -2.09 -0.32 4.01 -0.58 -3.99 117.16 113.82 1nu8 n TYR 661 Ca 0.07 0.31 -0.27 0.00 -0.16 0.00 0.00 57.90 57.85 1nu8 n TYR 661 Cb 0.15 -1.05 0.10 0.00 -0.31 0.00 0.00 39.34 38.23 1nu8 n TYR 661 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1nu8 s TYR 662 N -3.04 2.53 0.55 -0.72 5.04 -1.03 -4.82 117.35 115.85 1nu8 s TYR 662 Ca -0.02 0.44 -0.16 0.00 -2.44 0.00 0.00 57.07 54.89 1nu8 s TYR 662 Cb 0.09 -3.47 -0.06 0.00 0.35 0.00 0.00 41.96 38.87 1nu8 s TYR 662 CO 0.81 -1.81 1.01 0.16 -1.34 0.00 0.00 175.55 174.37 1nu8 s ASP 663 N -4.64 6.35 0.11 4.32 1.47 -1.26 -1.21 116.67 121.81 1nu8 s ASP 663 Ca 0.64 1.63 -0.25 0.00 1.18 0.00 0.00 52.55 55.75 1nu8 s ASP 663 Cb -0.09 -2.51 -0.09 0.00 -0.34 0.00 0.00 42.92 39.89 1nu8 s ASP 663 CO 0.48 -0.78 1.68 0.77 0.68 0.00 0.00 175.17 178.00 1nu8 h SER 664 N 0.68 -0.41 -0.71 2.11 4.64 -1.29 -2.30 113.55 116.27 1nu8 h SER 664 Ca -0.47 0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 60.86 1nu8 h SER 664 Cb 1.19 0.16 -0.03 0.00 -0.31 0.00 0.00 62.40 63.42 1nu8 h SER 664 CO 0.60 -0.21 0.25 0.58 -0.87 0.00 0.00 176.83 177.18 1nu8 h VAL 665 N -0.27 1.25 0.00 0.95 2.07 -1.93 0.18 116.25 118.50 1nu8 h VAL 665 Ca 0.03 -0.85 -0.00 0.00 0.82 0.00 0.00 66.70 66.71 1nu8 h VAL 665 Cb 0.31 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1nu8 h VAL 665 CO -0.10 0.34 -0.00 0.22 0.02 0.00 0.00 177.57 178.04 1nu8 h TYR 666 N 1.07 -0.00 0.41 1.57 5.03 -1.93 -3.28 116.97 119.83 1nu8 h TYR 666 Ca 0.24 -0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.53 1nu8 h TYR 666 Cb 0.26 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.54 1nu8 h TYR 666 CO 0.02 0.86 -0.20 1.15 -1.32 0.00 0.00 178.16 178.67 1nu8 h THR 667 N -0.89 0.44 -0.14 1.81 2.02 -1.17 -2.84 112.91 112.14 1nu8 h THR 667 Ca -0.00 -0.57 0.04 0.00 0.77 0.00 0.00 66.41 66.65 1nu8 h THR 667 Cb 0.87 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1nu8 h THR 667 CO 0.00 0.08 0.49 -0.33 0.37 0.00 0.00 175.52 176.13 1nu8 h GLU 668 N -0.94 0.00 0.00 6.66 5.08 -0.82 0.57 114.58 125.12 1nu8 h GLU 668 Ca -0.06 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 1nu8 h GLU 668 Cb 0.56 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 1nu8 h GLU 668 CO 0.09 0.00 -0.41 -0.09 -1.00 0.00 0.00 179.01 177.60 1nu8 h ARG 669 N 0.00 0.00 0.00 2.33 2.43 -1.56 -2.15 114.38 115.43 1nu8 h ARG 669 Ca 0.07 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1nu8 h ARG 669 Cb 1.05 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.60 1nu8 h ARG 669 CO -0.00 0.41 -1.42 0.66 -1.51 0.00 0.00 179.97 178.12 1nu8 n TYR 670 N -3.74 0.00 0.03 2.20 4.01 0.05 -4.62 117.16 115.10 1nu8 n TYR 670 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 1nu8 n TYR 670 Cb 0.49 -0.23 0.00 0.00 -0.31 0.00 0.00 39.34 39.29 1nu8 n TYR 670 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 1nu8 n MET 671 N -1.88 2.06 0.00 -0.72 2.81 -0.36 0.21 117.12 119.24 1nu8 n MET 671 Ca -0.03 -0.34 0.00 0.00 -1.81 0.00 0.00 57.70 55.52 1nu8 n MET 671 Cb 0.31 -0.83 0.00 0.00 -0.71 0.00 0.00 33.22 31.99 1nu8 n MET 671 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1nu8 n GLY 672 N 0.42 0.54 3.87 3.03 0.00 -0.81 -4.57 105.19 107.66 1nu8 n GLY 672 Ca 0.00 -0.86 -0.35 0.00 0.00 0.00 0.00 46.02 44.81 1nu8 n GLY 672 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nu8 s LEU 673 N 0.00 4.36 -1.49 0.99 1.43 -1.26 -4.25 118.68 118.46 1nu8 s LEU 673 Ca 0.00 0.72 -0.10 0.00 -1.03 0.00 0.00 54.13 53.72 1nu8 s LEU 673 Cb 0.00 -2.86 0.01 0.00 0.03 0.00 0.00 46.19 43.37 1nu8 s LEU 673 CO 0.00 0.21 2.55 -0.81 0.23 0.00 0.00 176.35 178.53 1nu8 n PRO 674 N 1.02 3.61 -4.31 1.29 -0.04 -1.26 -1.10 135.00 134.21 1nu8 n PRO 674 Ca -0.09 -2.66 -0.20 0.00 -0.04 0.00 0.00 63.50 60.51 1nu8 n PRO 674 Cb 0.52 -2.92 -0.11 0.00 -0.04 0.00 0.00 33.50 30.95 1nu8 n PRO 674 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1nu8 s THR 675 N 1.72 1.64 0.40 0.52 -4.23 -1.26 -4.69 115.64 109.74 1nu8 s THR 675 Ca 0.58 -1.95 0.17 0.00 -1.18 0.00 0.00 61.69 59.31 1nu8 s THR 675 Cb 0.16 -1.81 0.38 0.00 1.34 0.00 0.00 72.50 72.57 1nu8 s THR 675 CO -0.07 -0.43 1.83 -0.65 -0.54 0.00 0.00 174.62 174.76 1nu8 h PRO 676 N 3.13 0.43 0.00 3.99 0.11 -1.96 -1.55 132.00 136.14 1nu8 h PRO 676 Ca -0.40 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1nu8 h PRO 676 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1nu8 h PRO 676 CO 0.54 0.28 0.00 0.39 -0.21 0.00 0.00 178.00 179.01 1nu8 n GLU 677 N -4.56 0.21 0.00 1.05 4.71 -1.26 -4.72 120.64 116.07 1nu8 n GLU 677 Ca 0.21 0.27 0.00 0.00 -0.01 0.00 0.00 57.16 57.63 1nu8 n GLU 677 Cb 0.73 -1.80 0.00 0.00 -1.01 0.00 0.00 31.44 29.36 1nu8 n GLU 677 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 1nu8 n ASP 678 N -2.18 0.00 -0.44 1.62 2.03 -0.84 -5.05 116.55 111.70 1nu8 n ASP 678 Ca 0.04 0.00 0.07 0.00 0.52 0.00 0.00 54.79 55.42 1nu8 n ASP 678 Cb 0.35 0.00 0.18 0.00 -0.72 0.00 0.00 41.12 40.93 1nu8 n ASP 678 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1nu8 n ASN 679 N 0.00 2.24 -0.18 1.67 4.05 -0.26 -4.72 115.26 118.06 1nu8 n ASN 679 Ca 0.00 -3.46 -0.01 0.00 0.45 0.00 0.00 54.58 51.56 1nu8 n ASN 679 Cb 0.00 -0.50 0.09 0.00 1.23 0.00 0.00 39.78 40.60 1nu8 n ASN 679 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 1nu8 h LEU 680 N 0.62 -0.04 -0.25 1.20 7.12 -1.40 -1.82 115.31 120.74 1nu8 h LEU 680 Ca 0.02 0.11 0.05 0.00 0.13 0.00 0.00 57.88 58.18 1nu8 h LEU 680 Cb 1.10 0.15 -0.08 0.00 -0.53 0.00 0.00 40.66 41.30 1nu8 h LEU 680 CO 0.05 0.00 -0.47 0.44 -0.13 0.00 0.00 178.44 178.33 1nu8 h ASP 681 N 0.23 -1.53 0.79 1.25 3.32 -1.84 0.08 116.42 118.71 1nu8 h ASP 681 Ca 0.28 0.20 -0.04 0.00 0.02 0.00 0.00 57.03 57.50 1nu8 h ASP 681 Cb 0.41 0.63 -0.01 0.00 0.22 0.00 0.00 39.33 40.58 1nu8 h ASP 681 CO -0.38 -0.42 -0.19 -0.74 -1.72 0.00 0.00 179.24 175.79 1nu8 h HIS 682 N -0.46 0.00 -0.67 4.55 2.76 -1.84 -1.26 115.15 118.23 1nu8 h HIS 682 Ca 0.08 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.25 1nu8 h HIS 682 Cb 0.63 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.55 1nu8 h HIS 682 CO -0.59 0.19 0.39 1.88 -1.30 0.00 0.00 177.93 178.51 1nu8 h TYR 683 N 0.00 0.89 0.00 5.26 -1.99 -0.21 -2.84 116.97 118.08 1nu8 h TYR 683 Ca -0.00 -0.01 -0.09 0.00 2.00 0.00 0.00 58.73 60.64 1nu8 h TYR 683 Cb 0.64 -0.29 -0.01 0.00 2.00 0.00 0.00 36.73 39.06 1nu8 h TYR 683 CO 0.00 0.61 -0.41 0.00 -0.00 0.00 0.00 178.16 178.37 1nu8 h ARG 684 N 0.91 0.00 0.00 4.88 -0.00 -0.49 -3.29 114.38 116.39 1nu8 h ARG 684 Ca 0.24 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.72 1nu8 h ARG 684 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 29.97 29.96 1nu8 h ARG 684 CO -0.04 0.41 -0.26 -1.71 0.00 0.00 0.00 179.97 178.37 1nu8 n ASN 685 N -3.37 0.79 -1.04 7.04 5.15 -0.53 -4.26 115.26 119.04 1nu8 n ASN 685 Ca 0.01 0.39 -0.01 0.00 -0.60 0.00 0.00 54.58 54.37 1nu8 n ASN 685 Cb 0.60 -0.41 0.20 0.00 -0.53 0.00 0.00 39.78 39.64 1nu8 n ASN 685 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1nu8 n SER 686 N -2.22 2.54 -4.89 1.20 3.41 -1.09 -5.02 113.62 107.54 1nu8 n SER 686 Ca 0.05 -3.69 -0.32 0.00 -0.26 0.00 0.00 58.87 54.65 1nu8 n SER 686 Cb 0.44 -0.61 -0.05 0.00 -0.26 0.00 0.00 64.21 63.73 1nu8 n SER 686 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1nu8 s THR 687 N -3.19 5.10 0.27 6.66 -4.23 -1.26 -4.80 115.64 114.19 1nu8 s THR 687 Ca 0.43 0.20 -0.03 0.00 -1.18 0.00 0.00 61.69 61.11 1nu8 s THR 687 Cb 0.39 -3.63 0.18 0.00 1.34 0.00 0.00 72.50 70.79 1nu8 s THR 687 CO 0.00 0.06 1.85 0.58 -0.54 0.00 0.00 174.62 176.57 1nu8 h VAL 688 N 2.18 1.23 -0.10 2.29 2.07 -1.16 -2.96 116.25 119.81 1nu8 h VAL 688 Ca -0.47 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 66.32 1nu8 h VAL 688 Cb 1.17 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 1nu8 h VAL 688 CO 0.71 0.29 -0.04 0.24 0.02 0.00 0.00 177.57 178.79 1nu8 h MET 689 N 0.99 0.14 0.00 1.57 2.86 -1.91 -2.39 114.93 116.19 1nu8 h MET 689 Ca 0.23 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.86 1nu8 h MET 689 Cb 0.16 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.80 1nu8 h MET 689 CO -0.02 0.19 0.06 0.66 1.06 0.00 0.00 176.91 178.86 1nu8 h SER 690 N 0.14 0.00 -0.53 1.22 4.64 -1.89 -2.72 113.55 114.41 1nu8 h SER 690 Ca 0.03 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.97 1nu8 h SER 690 Cb 0.17 0.00 -0.36 0.00 -0.31 0.00 0.00 62.40 61.90 1nu8 h SER 690 CO 0.01 0.00 -0.85 0.54 -0.87 0.00 0.00 176.83 175.66 1nu8 n ARG 691 N -2.71 2.70 -0.13 4.77 1.74 -0.90 -4.86 116.66 117.27 1nu8 n ARG 691 Ca -0.02 -3.78 -0.09 0.00 -0.77 0.00 0.00 57.85 53.19 1nu8 n ARG 691 Cb 0.12 -1.91 -0.01 0.00 -1.02 0.00 0.00 32.46 29.64 1nu8 n ARG 691 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1nu8 h ALA 692 N 2.03 0.50 -0.89 7.54 0.00 -1.60 -3.18 119.26 123.65 1nu8 h ALA 692 Ca 0.17 -0.17 0.20 0.00 0.00 0.00 0.00 54.91 55.12 1nu8 h ALA 692 Cb 1.42 -0.15 -0.12 0.00 0.00 0.00 0.00 17.79 18.95 1nu8 h ALA 692 CO 0.48 0.14 0.41 0.93 0.00 0.00 0.00 179.25 181.21 1nu8 h GLU 693 N 0.47 0.44 0.00 0.00 4.39 -1.89 -1.22 114.58 116.76 1nu8 h GLU 693 Ca 0.12 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.79 1nu8 h GLU 693 Cb 0.26 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1nu8 h GLU 693 CO -0.00 0.29 -0.01 -0.91 -1.16 0.00 0.00 179.01 177.22 1nu8 h ASN 694 N 0.45 0.00 0.13 1.42 2.35 -1.82 -2.19 115.58 115.92 1nu8 h ASN 694 Ca 0.54 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.29 1nu8 h ASN 694 Cb 0.98 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.35 1nu8 h ASN 694 CO -0.49 0.01 0.00 -0.26 -1.65 0.00 0.00 177.43 175.04 1nu8 h PHE 695 N 0.00 0.00 0.00 1.19 -1.00 -1.36 -2.82 116.94 112.95 1nu8 h PHE 695 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1nu8 h PHE 695 Cb 0.19 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.75 1nu8 h PHE 695 CO 0.00 0.00 0.00 1.57 -1.61 0.00 0.00 178.31 178.27 1nu8 h LYS 696 N 0.00 0.00 0.00 1.51 2.10 -1.58 -2.54 116.57 116.06 1nu8 h LYS 696 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1nu8 h LYS 696 Cb 0.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.39 1nu8 h LYS 696 CO 0.00 0.00 -0.33 1.04 -2.00 0.00 0.00 179.45 178.16 1nu8 n GLN 697 N -3.06 0.04 -4.41 0.07 6.02 -1.07 -4.93 117.38 110.04 1nu8 n GLN 697 Ca -0.00 0.02 -0.21 0.00 -0.01 0.00 0.00 57.00 56.80 1nu8 n GLN 697 Cb 0.24 -1.53 -0.10 0.00 1.02 0.00 0.00 30.24 29.87 1nu8 n GLN 697 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1nu8 s VAL 698 N -3.02 1.76 -0.20 5.09 -7.23 -0.96 -4.96 120.40 110.89 1nu8 s VAL 698 Ca 0.12 -2.18 -0.09 0.00 -1.81 0.00 0.00 61.98 58.02 1nu8 s VAL 698 Cb 0.17 -2.30 -0.04 0.00 0.56 0.00 0.00 36.38 34.77 1nu8 s VAL 698 CO 0.64 -0.41 0.10 -1.61 -0.31 0.00 0.00 175.10 173.51 1nu8 s GLU 699 N -3.68 4.04 -0.09 4.82 2.02 -0.59 -4.96 118.70 120.26 1nu8 s GLU 699 Ca 0.27 -0.30 0.03 0.00 0.02 0.00 0.00 54.97 54.98 1nu8 s GLU 699 Cb 0.01 -3.33 0.01 0.00 0.10 0.00 0.00 34.13 30.92 1nu8 s GLU 699 CO 0.10 0.22 -0.16 -0.47 0.02 0.00 0.00 175.26 174.98 1nu8 s TYR 700 N 0.54 1.87 -0.24 1.61 5.04 -1.26 -0.59 117.35 124.32 1nu8 s TYR 700 Ca 0.05 -0.77 -0.05 0.00 -2.44 0.00 0.00 57.07 53.86 1nu8 s TYR 700 Cb -0.12 -1.33 -0.01 0.00 0.35 0.00 0.00 41.96 40.85 1nu8 s TYR 700 CO 0.00 -0.37 0.01 -1.17 -1.34 0.00 0.00 175.55 172.69 1nu8 s LEU 701 N 0.68 3.20 -0.22 6.97 2.96 -0.75 -0.45 118.68 131.08 1nu8 s LEU 701 Ca -0.13 -0.38 -0.01 0.00 -0.22 0.00 0.00 54.13 53.39 1nu8 s LEU 701 Cb -0.16 -1.82 0.02 0.00 0.50 0.00 0.00 46.19 44.73 1nu8 s LEU 701 CO 0.03 -0.05 -0.10 -0.22 -1.32 0.00 0.00 176.35 174.70 1nu8 s LEU 702 N 1.53 2.83 0.03 -0.68 2.96 0.62 -1.69 118.68 124.27 1nu8 s LEU 702 Ca 0.05 -0.72 0.06 0.00 -0.22 0.00 0.00 54.13 53.31 1nu8 s LEU 702 Cb -0.15 -1.62 -0.02 0.00 0.50 0.00 0.00 46.19 44.89 1nu8 s LEU 702 CO -0.00 -0.07 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.14 1nu8 s ILE 703 N 1.34 1.47 -0.29 6.68 1.01 -1.08 -0.65 121.20 129.68 1nu8 s ILE 703 Ca 0.02 -1.04 -0.15 0.00 0.00 0.00 0.00 60.65 59.49 1nu8 s ILE 703 Cb -0.15 -1.28 0.14 0.00 0.01 0.00 0.00 42.46 41.18 1nu8 s ILE 703 CO -0.07 0.21 0.90 -2.28 0.00 0.00 0.00 174.94 173.70 1nu8 s HIS 704 N -0.71 -0.78 0.29 3.97 2.46 -0.12 -0.26 115.29 120.13 1nu8 s HIS 704 Ca 0.06 1.45 -0.28 0.00 0.47 0.00 0.00 55.06 56.75 1nu8 s HIS 704 Cb -0.08 0.47 -0.09 0.00 -0.13 0.00 0.00 32.58 32.75 1nu8 s HIS 704 CO 0.01 -0.39 1.05 0.20 -2.47 0.00 0.00 174.74 173.14 1nu8 s GLY 705 N 2.02 3.01 0.43 1.59 0.00 -1.26 -2.69 107.32 110.42 1nu8 s GLY 705 Ca -0.06 0.79 0.24 0.00 0.00 0.00 0.00 44.72 45.68 1nu8 s GLY 705 CO -0.17 1.35 1.75 -0.91 0.00 0.00 0.00 173.10 175.12 1nu8 h THR 706 N 2.93 0.46 -0.70 0.90 1.35 -1.53 -3.04 112.91 113.29 1nu8 h THR 706 Ca -0.47 -1.22 -0.38 0.00 -0.55 0.00 0.00 66.41 63.79 1nu8 h THR 706 Cb 1.21 1.88 -0.21 0.00 -1.73 0.00 0.00 68.15 69.30 1nu8 h THR 706 CO 0.66 0.21 0.48 0.00 -0.25 0.00 0.00 175.52 176.63 1nu8 n ALA 707 N -2.19 4.82 -2.20 6.62 0.00 0.08 -4.72 120.51 122.93 1nu8 n ALA 707 Ca 0.01 -2.09 -0.42 0.00 0.00 0.00 0.00 53.44 50.94 1nu8 n ALA 707 Cb 0.48 -1.35 -0.03 0.00 0.00 0.00 0.00 19.45 18.56 1nu8 n ALA 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1nu8 s ASP 708 N -0.61 6.03 0.11 0.00 -1.08 -1.15 -4.12 116.67 115.85 1nu8 s ASP 708 Ca 0.41 0.87 0.25 0.00 -0.52 0.00 0.00 52.55 53.55 1nu8 s ASP 708 Cb 0.34 -2.53 0.47 0.00 -1.46 0.00 0.00 42.92 39.74 1nu8 s ASP 708 CO 0.06 -1.68 1.42 -0.90 0.52 0.00 0.00 175.17 174.60 1nu8 n ASP 709 N 9.88 0.66 0.00 -0.34 5.75 -1.26 -4.07 116.55 127.17 1nu8 n ASP 709 Ca 0.19 0.16 0.00 0.00 -0.01 0.00 0.00 54.79 55.12 1nu8 n ASP 709 Cb 0.48 0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 1nu8 n ASP 709 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1nu8 n ASN 710 N -2.03 0.00 -4.25 -1.12 2.85 -1.26 -4.75 115.26 104.71 1nu8 n ASN 710 Ca 0.04 0.11 -0.43 0.00 -0.11 0.00 0.00 54.58 54.19 1nu8 n ASN 710 Cb 0.42 -0.43 -0.07 0.00 1.24 0.00 0.00 39.78 40.94 1nu8 n ASN 710 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1nu8 s VAL 711 N -0.86 4.62 0.40 3.44 1.01 -1.26 -4.85 120.40 122.90 1nu8 s VAL 711 Ca 0.00 -1.84 -0.27 0.00 0.00 0.00 0.00 61.98 59.87 1nu8 s VAL 711 Cb 0.00 -3.99 -0.09 0.00 0.00 0.00 0.00 36.38 32.29 1nu8 s VAL 711 CO 0.00 -0.84 1.40 -1.00 0.00 0.00 0.00 175.10 174.66 1nu8 s HIS 712 N 1.23 2.66 0.55 5.22 3.76 -1.26 -4.76 115.29 122.68 1nu8 s HIS 712 Ca 0.07 1.29 0.44 0.00 -0.15 0.00 0.00 55.06 56.71 1nu8 s HIS 712 Cb -0.25 -3.86 1.66 0.00 1.11 0.00 0.00 32.58 31.23 1nu8 s HIS 712 CO -0.01 -2.62 1.66 0.35 -0.85 0.00 0.00 174.74 173.28 1nu8 h PHE 713 N 2.74 0.03 -1.01 1.40 3.57 -1.81 0.33 116.94 122.20 1nu8 h PHE 713 Ca -0.50 0.00 0.23 0.00 3.53 0.00 0.00 57.97 61.23 1nu8 h PHE 713 Cb 1.25 -0.01 -0.11 0.00 2.79 0.00 0.00 35.95 39.87 1nu8 h PHE 713 CO 0.52 -0.01 0.62 0.37 -2.23 0.00 0.00 178.31 177.58 1nu8 h GLN 714 N 0.01 0.58 -0.46 1.11 4.15 -1.94 0.30 115.11 118.85 1nu8 h GLN 714 Ca 0.80 -0.03 -0.03 0.00 0.77 0.00 0.00 58.65 60.16 1nu8 h GLN 714 Cb 3.16 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 30.70 1nu8 h GLN 714 CO -0.03 0.38 0.18 1.96 -1.93 0.00 0.00 178.83 179.39 1nu8 h GLN 715 N 0.60 0.69 0.00 1.69 4.20 -0.65 -0.11 115.11 121.53 1nu8 h GLN 715 Ca 0.60 -0.13 -0.13 0.00 0.06 0.00 0.00 58.65 59.05 1nu8 h GLN 715 Cb 1.16 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.81 1nu8 h GLN 715 CO -0.38 0.63 -0.61 0.77 -0.67 0.00 0.00 178.83 178.57 1nu8 h SER 716 N 0.60 0.00 1.10 1.46 0.02 -1.31 -2.91 113.55 112.50 1nu8 h SER 716 Ca 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1nu8 h SER 716 Cb 0.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.74 1nu8 h SER 716 CO -0.01 0.61 0.00 0.00 -1.14 0.00 0.00 176.83 176.29 1nu8 h ALA 717 N 1.39 1.00 0.02 3.77 0.00 -0.53 -1.33 119.26 123.58 1nu8 h ALA 717 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.59 1nu8 h ALA 717 Cb 1.28 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.02 1nu8 h ALA 717 CO 0.08 0.00 -1.81 1.04 0.00 0.00 0.00 179.25 178.56 1nu8 n GLN 718 N -3.03 0.66 0.30 0.00 1.13 -0.10 -3.10 117.38 113.23 1nu8 n GLN 718 Ca 0.01 0.27 -0.17 0.00 -1.94 0.00 0.00 57.00 55.17 1nu8 n GLN 718 Cb 0.32 -1.76 -0.09 0.00 0.11 0.00 0.00 30.24 28.83 1nu8 n GLN 718 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 1nu8 h ILE 719 N 0.01 0.48 -0.65 5.09 2.04 -1.33 -2.45 117.51 120.70 1nu8 h ILE 719 Ca -0.33 -0.04 0.07 0.00 1.00 0.00 0.00 64.86 65.56 1nu8 h ILE 719 Cb 2.03 0.50 -0.04 0.00 -0.74 0.00 0.00 36.82 38.57 1nu8 h ILE 719 CO 0.07 0.01 0.43 0.77 0.00 0.00 0.00 178.15 179.43 1nu8 h SER 720 N -0.73 0.54 -0.37 1.72 4.64 -1.38 -0.30 113.55 117.66 1nu8 h SER 720 Ca -0.07 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.11 1nu8 h SER 720 Cb 0.55 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 1nu8 h SER 720 CO 0.12 0.34 -0.32 0.50 -0.87 0.00 0.00 176.83 176.60 1nu8 h LYS 721 N 0.61 0.87 -0.36 4.77 3.64 -1.52 -0.45 116.57 124.13 1nu8 h LYS 721 Ca 0.29 -0.44 -0.11 0.00 -1.27 0.00 0.00 60.65 59.11 1nu8 h LYS 721 Cb 0.34 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1nu8 h LYS 721 CO -0.09 1.09 -0.23 0.00 -2.27 0.00 0.00 179.45 177.94 1nu8 h ALA 722 N 0.77 0.90 -0.48 5.00 0.00 -0.61 0.18 119.26 125.03 1nu8 h ALA 722 Ca 0.07 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 1nu8 h ALA 722 Cb 0.90 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1nu8 h ALA 722 CO 0.08 0.62 0.17 -0.07 0.00 0.00 0.00 179.25 180.06 1nu8 h LEU 723 N 0.63 0.67 0.13 0.00 3.38 -1.07 -3.18 115.31 115.88 1nu8 h LEU 723 Ca 0.09 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1nu8 h LEU 723 Cb 0.73 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1nu8 h LEU 723 CO 0.06 0.68 -0.06 0.58 0.09 0.00 0.00 178.44 179.78 1nu8 h VAL 724 N 0.63 0.96 0.00 1.22 2.07 -0.23 -2.22 116.25 118.68 1nu8 h VAL 724 Ca 0.16 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.31 1nu8 h VAL 724 Cb 0.23 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 1nu8 h VAL 724 CO -0.01 0.09 0.33 0.47 0.02 0.00 0.00 177.57 178.46 1nu8 n ASP 725 N -5.09 0.05 0.00 0.57 9.92 0.55 -1.42 116.55 121.13 1nu8 n ASP 725 Ca -0.09 0.26 0.00 0.00 -0.53 0.00 0.00 54.79 54.43 1nu8 n ASP 725 Cb 0.16 -0.24 0.00 0.00 -0.64 0.00 0.00 41.12 40.41 1nu8 n ASP 725 CO 0.00 0.00 0.00 0.55 0.13 0.00 0.00 177.20 177.88 1nu8 n VAL 726 N -1.37 0.00 -0.34 2.53 3.14 -0.95 -5.04 118.33 116.31 1nu8 n VAL 726 Ca -0.00 -0.37 0.00 0.00 -2.96 0.00 0.00 64.34 61.01 1nu8 n VAL 726 Cb 0.33 1.05 0.00 0.00 -1.06 0.00 0.00 33.84 34.16 1nu8 n VAL 726 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1nu8 n GLY 727 N 0.60 0.79 3.64 7.55 0.00 -0.51 -5.00 105.19 112.27 1nu8 n GLY 727 Ca 0.00 -0.32 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 1nu8 n GLY 727 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nu8 s VAL 728 N -2.00 5.03 0.56 1.61 1.01 -0.94 -5.05 120.40 120.62 1nu8 s VAL 728 Ca 0.00 1.09 -0.14 0.00 0.00 0.00 0.00 61.98 62.93 1nu8 s VAL 728 Cb 0.00 -3.91 -0.06 0.00 0.00 0.00 0.00 36.38 32.41 1nu8 s VAL 728 CO 0.00 0.09 1.00 -0.62 0.00 0.00 0.00 175.10 175.57 1nu8 s ASP 729 N 1.33 6.46 0.04 3.32 2.15 -1.26 -4.53 116.67 124.17 1nu8 s ASP 729 Ca 0.26 1.50 -0.28 0.00 0.43 0.00 0.00 52.55 54.46 1nu8 s ASP 729 Cb -0.16 -2.49 0.10 0.00 -0.30 0.00 0.00 42.92 40.08 1nu8 s ASP 729 CO 0.09 -0.70 1.21 0.72 -0.17 0.00 0.00 175.17 176.32 1nu8 s PHE 730 N -2.85 -0.03 0.16 -5.34 -0.71 -1.26 -4.83 117.98 103.11 1nu8 s PHE 730 Ca 0.57 -0.14 0.04 0.00 -1.04 0.00 0.00 56.93 56.36 1nu8 s PHE 730 Cb -0.10 0.58 -0.04 0.00 -1.21 0.00 0.00 43.02 42.25 1nu8 s PHE 730 CO 0.41 -0.44 0.17 -0.65 -1.34 0.00 0.00 175.22 173.37 1nu8 s GLN 731 N -2.46 3.04 0.06 1.99 -1.52 0.40 -5.02 119.66 116.15 1nu8 s GLN 731 Ca 0.18 -0.80 0.02 0.00 -1.95 0.00 0.00 55.36 52.81 1nu8 s GLN 731 Cb 0.02 -2.73 -0.03 0.00 -0.22 0.00 0.00 33.01 30.05 1nu8 s GLN 731 CO -0.01 0.49 -0.07 0.00 -0.25 0.00 0.00 175.29 175.45 1nu8 s ALA 732 N -1.75 0.73 -0.18 6.09 0.00 -1.26 -0.28 121.76 125.12 1nu8 s ALA 732 Ca 0.32 -0.99 -0.06 0.00 0.00 0.00 0.00 51.96 51.23 1nu8 s ALA 732 Cb -0.10 0.09 0.09 0.00 0.00 0.00 0.00 23.12 23.19 1nu8 s ALA 732 CO 0.25 -0.10 0.35 1.41 0.00 0.00 0.00 175.76 177.67 1nu8 s MET 733 N -2.44 0.25 0.37 0.00 1.75 0.17 -4.87 119.30 114.53 1nu8 s MET 733 Ca -0.02 0.85 -0.07 0.00 -1.25 0.00 0.00 55.69 55.20 1nu8 s MET 733 Cb -0.04 0.05 -0.05 0.00 2.84 0.00 0.00 34.83 37.63 1nu8 s MET 733 CO -0.02 -0.32 0.68 1.67 -0.65 0.00 0.00 175.02 176.38 1nu8 s TRP 734 N 2.52 3.48 -0.37 4.11 -2.14 -1.26 -0.95 118.94 124.33 1nu8 s TRP 734 Ca 0.01 0.83 0.01 0.00 2.66 0.00 0.00 56.10 59.62 1nu8 s TRP 734 Cb -0.13 -2.27 0.12 0.00 -3.10 0.00 0.00 33.47 28.09 1nu8 s TRP 734 CO -0.11 -0.01 0.15 0.71 -2.66 0.00 0.00 176.95 175.03 1nu8 s TYR 735 N -2.30 2.19 -0.14 1.66 2.02 -1.10 -4.91 117.35 114.77 1nu8 s TYR 735 Ca 0.47 -2.26 -0.33 0.00 -0.37 0.00 0.00 57.07 54.58 1nu8 s TYR 735 Cb -0.10 -2.02 -0.15 0.00 -0.40 0.00 0.00 41.96 39.28 1nu8 s TYR 735 CO 0.33 -0.84 0.98 2.41 -1.57 0.00 0.00 175.55 176.85 1nu8 n THR 736 N 4.17 0.00 -1.68 -0.71 -1.04 -1.26 -2.12 114.28 111.63 1nu8 n THR 736 Ca 0.03 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.84 1nu8 n THR 736 Cb 0.39 -0.14 -0.08 0.00 -1.82 0.00 0.00 70.33 68.67 1nu8 n THR 736 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1nu8 n ASP 737 N 1.87 -5.52 -4.89 8.00 8.00 -1.26 -4.82 116.55 117.92 1nu8 n ASP 737 Ca 0.19 0.46 -0.33 0.00 0.71 0.00 0.00 54.79 55.82 1nu8 n ASP 737 Cb 0.02 -4.81 -0.05 0.00 -0.02 0.00 0.00 41.12 36.26 1nu8 n ASP 737 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1nu8 s GLU 738 N -3.87 3.60 0.00 -1.24 0.41 -0.90 -4.67 118.70 112.02 1nu8 s GLU 738 Ca 0.00 -0.10 0.00 0.00 -0.41 0.00 0.00 54.97 54.46 1nu8 s GLU 738 Cb 0.00 -2.96 0.00 0.00 -1.78 0.00 0.00 34.13 29.39 1nu8 s GLU 738 CO 0.00 0.55 0.00 -0.40 -0.49 0.00 0.00 175.26 174.92 1nu8 n ASP 739 N 0.51 0.00 0.24 -0.19 5.68 -1.26 -0.74 116.55 120.79 1nu8 n ASP 739 Ca -0.06 0.00 0.07 0.00 -0.50 0.00 0.00 54.79 54.30 1nu8 n ASP 739 Cb 0.52 0.00 0.59 0.00 -1.14 0.00 0.00 41.12 41.09 1nu8 n ASP 739 CO 0.00 0.00 0.00 -0.74 -1.33 0.00 0.00 177.20 175.13 1nu8 h HIS 740 N 0.00 0.02 -0.00 2.11 -0.00 -1.92 -2.30 115.15 113.07 1nu8 h HIS 740 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 1nu8 h HIS 740 Cb 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 27.40 1nu8 h HIS 740 CO 0.00 0.07 -0.45 0.41 -0.00 0.00 0.00 177.93 177.96 1nu8 n GLY 741 N -1.38 -1.06 4.16 5.26 0.00 -1.26 -4.97 105.19 105.94 1nu8 n GLY 741 Ca -0.03 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.20 1nu8 n GLY 741 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1nu8 n ILE 742 N -1.25 -2.08 0.48 -0.61 5.41 -0.87 -4.85 119.36 115.58 1nu8 n ILE 742 Ca 0.07 -0.56 0.08 0.00 1.00 0.00 0.00 62.75 63.35 1nu8 n ILE 742 Cb 0.34 -1.82 0.10 0.00 -0.71 0.00 0.00 39.64 37.55 1nu8 n ILE 742 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1nu8 n ALA 743 N -4.92 2.43 -1.77 -1.39 0.00 -1.26 -3.29 120.51 110.31 1nu8 n ALA 743 Ca -0.18 -0.76 -0.39 0.00 0.00 0.00 0.00 53.44 52.12 1nu8 n ALA 743 Cb 0.60 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.47 1nu8 n ALA 743 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1nu8 s SER 744 N -1.29 6.15 0.31 0.00 1.04 -1.26 -4.73 113.70 113.93 1nu8 s SER 744 Ca 0.23 2.61 0.05 0.00 0.48 0.00 0.00 55.95 59.32 1nu8 s SER 744 Cb 0.15 -2.63 0.84 0.00 0.10 0.00 0.00 66.02 64.47 1nu8 s SER 744 CO 0.21 -0.95 1.52 -0.24 0.98 0.00 0.00 173.24 174.76 1nu8 n SER 745 N -0.12 -0.04 -0.03 7.02 2.88 -1.26 -0.76 113.62 121.30 1nu8 n SER 745 Ca 0.05 1.65 -0.14 0.00 -1.33 0.00 0.00 58.87 59.10 1nu8 n SER 745 Cb 0.44 -0.63 -0.10 0.00 -0.75 0.00 0.00 64.21 63.17 1nu8 n SER 745 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1nu8 h THR 746 N 0.00 1.50 -0.75 2.46 1.35 -1.97 -2.77 112.91 112.73 1nu8 h THR 746 Ca 0.63 -1.63 -0.04 0.00 -0.55 0.00 0.00 66.41 64.82 1nu8 h THR 746 Cb 1.37 2.52 -0.03 0.00 -1.73 0.00 0.00 68.15 70.28 1nu8 h THR 746 CO -0.89 0.44 0.30 0.00 -0.25 0.00 0.00 175.52 175.12 1nu8 h ALA 747 N 0.36 0.97 -0.11 6.62 0.00 -1.64 0.10 119.26 125.57 1nu8 h ALA 747 Ca -0.01 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.75 1nu8 h ALA 747 Cb 0.77 -0.29 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 1nu8 h ALA 747 CO 0.02 0.59 -0.44 1.25 0.00 0.00 0.00 179.25 180.67 1nu8 h HIS 748 N 1.08 -1.28 -0.94 0.00 2.76 -0.94 0.39 115.15 116.22 1nu8 h HIS 748 Ca 0.25 0.05 0.03 0.00 -2.20 0.00 0.00 60.37 58.50 1nu8 h HIS 748 Cb 0.21 0.58 -0.05 0.00 1.55 0.00 0.00 27.41 29.70 1nu8 h HIS 748 CO 0.02 -0.50 0.61 1.96 -1.30 0.00 0.00 177.93 178.73 1nu8 h GLN 749 N -0.53 1.15 -0.09 5.26 4.20 -1.12 -2.76 115.11 121.22 1nu8 h GLN 749 Ca 0.06 -0.07 -0.13 0.00 0.06 0.00 0.00 58.65 58.57 1nu8 h GLN 749 Cb 0.65 -0.26 0.01 0.00 0.30 0.00 0.00 27.48 28.17 1nu8 h GLN 749 CO -0.39 0.76 -0.46 1.25 -0.67 0.00 0.00 178.83 179.32 1nu8 h HIS 750 N 1.19 0.65 -0.38 2.96 2.76 -0.38 -0.59 115.15 121.36 1nu8 h HIS 750 Ca 0.37 -0.28 -0.03 0.00 -2.20 0.00 0.00 60.37 58.22 1nu8 h HIS 750 Cb -0.01 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 28.84 1nu8 h HIS 750 CO -0.00 1.05 0.13 0.97 -1.30 0.00 0.00 177.93 178.78 1nu8 h ILE 751 N 0.06 1.21 0.00 6.26 2.10 -0.20 0.47 117.51 127.40 1nu8 h ILE 751 Ca -0.03 -0.68 -0.12 0.00 1.08 0.00 0.00 64.86 65.12 1nu8 h ILE 751 Cb 1.11 0.94 -0.02 0.00 -1.09 0.00 0.00 36.82 37.76 1nu8 h ILE 751 CO 0.10 0.24 -0.55 1.88 -1.08 0.00 0.00 178.15 178.73 1nu8 h TYR 752 N 0.47 0.00 -0.15 2.19 0.05 -1.50 0.10 116.97 118.13 1nu8 h TYR 752 Ca 0.12 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.89 1nu8 h TYR 752 Cb 0.24 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 1nu8 h TYR 752 CO 0.01 0.55 0.04 1.15 -1.05 0.00 0.00 178.16 178.86 1nu8 h THR 753 N 0.00 1.19 -0.65 -2.88 2.02 -0.68 -1.91 112.91 110.00 1nu8 h THR 753 Ca -0.01 -0.60 0.05 0.00 0.77 0.00 0.00 66.41 66.62 1nu8 h THR 753 Cb 1.02 1.31 -0.05 0.00 -1.74 0.00 0.00 68.15 68.69 1nu8 h THR 753 CO 0.07 0.18 0.37 -0.74 0.37 0.00 0.00 175.52 175.77 1nu8 h HIS 754 N 0.05 0.68 -0.12 3.16 -0.00 0.14 -2.64 115.15 116.42 1nu8 h HIS 754 Ca 0.05 0.02 -0.11 0.00 -0.00 0.00 0.00 60.37 60.33 1nu8 h HIS 754 Cb 0.25 -0.21 -0.01 0.00 -0.00 0.00 0.00 27.41 27.43 1nu8 h HIS 754 CO 0.00 0.34 -0.43 0.52 -0.00 0.00 0.00 177.93 178.36 1nu8 h MET 755 N 0.69 0.27 0.23 5.26 2.07 -1.02 -2.47 114.93 119.97 1nu8 h MET 755 Ca 0.29 -0.14 -0.00 0.00 -2.07 0.00 0.00 59.70 57.78 1nu8 h MET 755 Cb 0.15 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 29.88 1nu8 h MET 755 CO -0.17 0.66 -0.16 0.77 1.07 0.00 0.00 176.91 179.09 1nu8 h SER 756 N 0.23 -0.40 -0.96 1.22 0.02 -1.00 -0.87 113.55 111.78 1nu8 h SER 756 Ca 0.02 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1nu8 h SER 756 Cb 0.86 0.12 -0.06 0.00 0.14 0.00 0.00 62.40 63.47 1nu8 h SER 756 CO 0.07 -0.25 0.63 0.45 -1.14 0.00 0.00 176.83 176.59 1nu8 h HIS 757 N -0.38 1.18 -0.48 3.45 3.86 -1.30 0.21 115.15 121.69 1nu8 h HIS 757 Ca -0.02 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.15 1nu8 h HIS 757 Cb 0.33 -0.39 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 1nu8 h HIS 757 CO -0.10 0.68 -0.01 0.35 0.86 0.00 0.00 177.93 179.71 1nu8 h PHE 758 N 1.22 0.85 0.21 2.45 3.57 -1.28 -2.69 116.94 121.27 1nu8 h PHE 758 Ca 0.38 -0.12 -0.29 0.00 3.53 0.00 0.00 57.97 61.47 1nu8 h PHE 758 Cb 0.00 -0.23 0.03 0.00 2.79 0.00 0.00 35.95 38.54 1nu8 h PHE 758 CO -0.01 0.79 -1.28 0.82 -2.23 0.00 0.00 178.31 176.41 1nu8 h ILE 759 N 0.74 1.32 -0.39 1.41 2.04 -0.23 -2.34 117.51 120.06 1nu8 h ILE 759 Ca 0.14 -2.62 0.06 0.00 1.00 0.00 0.00 64.86 63.44 1nu8 h ILE 759 Cb 0.47 3.07 -0.05 0.00 -0.74 0.00 0.00 36.82 39.56 1nu8 h ILE 759 CO 0.02 0.78 0.09 0.11 0.00 0.00 0.00 178.15 179.15 1nu8 h LYS 760 N -0.05 0.21 0.00 2.37 1.57 -0.63 -0.98 116.57 119.06 1nu8 h LYS 760 Ca -0.23 -0.01 -0.15 0.00 -1.87 0.00 0.00 60.65 58.38 1nu8 h LYS 760 Cb 1.98 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 34.22 1nu8 h LYS 760 CO 0.22 0.14 -0.73 -0.56 -0.57 0.00 0.00 179.45 177.95 1nu8 h GLN 761 N 0.22 0.00 -0.93 3.15 -0.00 -1.60 0.72 115.11 116.66 1nu8 h GLN 761 Ca 0.19 0.00 0.03 0.00 -0.00 0.00 0.00 58.65 58.87 1nu8 h GLN 761 Cb 0.22 0.00 -0.05 0.00 -0.00 0.00 0.00 27.48 27.65 1nu8 h GLN 761 CO -0.24 0.73 0.61 0.00 -0.00 0.00 0.00 178.83 179.93 1nu8 n PHE 763 N -4.48 1.47 -4.08 0.00 3.72 -0.41 -4.91 117.46 108.78 1nu8 n PHE 763 Ca 0.12 -0.61 -0.33 0.00 -0.05 0.00 0.00 57.45 56.58 1nu8 n PHE 763 Cb 0.07 -0.42 -0.01 0.00 -0.94 0.00 0.00 39.48 38.18 1nu8 n PHE 763 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1nu8 n SER 764 N 0.26 -3.58 -4.62 4.37 7.64 -0.75 -4.96 113.62 111.97 1nu8 n SER 764 Ca 0.21 -0.92 -0.34 0.00 1.01 0.00 0.00 58.87 58.83 1nu8 n SER 764 Cb 0.93 -3.23 -0.10 0.00 -1.01 0.00 0.00 64.21 60.81 1nu8 n SER 764 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1nu8 s LEU 765 N -7.24 3.73 0.00 -3.43 1.43 0.24 -4.98 118.68 108.43 1nu8 s LEU 765 Ca 0.64 0.06 0.30 0.00 -1.03 0.00 0.00 54.13 54.09 1nu8 s LEU 765 Cb -0.34 -1.93 1.38 0.00 0.03 0.00 0.00 46.19 45.33 1nu8 s LEU 765 CO 0.89 0.18 1.93 -0.81 0.23 0.00 0.00 176.35 178.77