#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n80 s TYR 8 N 0.00 3.54 -0.32 1.39 2.02 -1.26 -5.07 117.35 117.65 1n80 s TYR 8 Ca 0.00 0.51 -0.01 0.00 -0.37 0.00 0.00 57.07 57.20 1n80 s TYR 8 Cb 0.00 -2.06 0.11 0.00 -0.40 0.00 0.00 41.96 39.60 1n80 s TYR 8 CO 0.00 0.56 0.12 1.03 -1.57 0.00 0.00 175.55 175.70 1n80 s ARG 9 N -0.52 0.68 0.24 -0.62 1.81 -1.26 -5.12 118.95 114.16 1n80 s ARG 9 Ca 0.14 -1.10 0.00 0.00 -1.72 0.00 0.00 55.73 53.06 1n80 s ARG 9 Cb -0.12 -1.86 -0.05 0.00 -0.45 0.00 0.00 34.95 32.47 1n80 s ARG 9 CO 0.03 -1.02 0.11 0.00 -0.68 0.00 0.00 175.30 173.74 1n80 s ALA 10 N 1.54 1.51 0.10 2.13 0.00 -1.26 -5.17 121.76 120.60 1n80 s ALA 10 Ca 0.11 -1.80 -0.26 0.00 0.00 0.00 0.00 51.96 50.01 1n80 s ALA 10 Cb -0.18 1.18 0.08 0.00 0.00 0.00 0.00 23.12 24.20 1n80 s ALA 10 CO -0.23 -0.51 0.78 0.96 0.00 0.00 0.00 175.76 176.76 1n80 s ILE 11 N -3.91 0.00 -0.13 0.00 -5.25 -1.26 -5.15 121.20 105.49 1n80 s ILE 11 Ca 0.38 -0.18 -0.06 0.00 -0.99 0.00 0.00 60.65 59.80 1n80 s ILE 11 Cb 0.08 -1.23 -0.04 0.00 2.95 0.00 0.00 42.46 44.22 1n80 s ILE 11 CO 0.13 0.00 0.08 0.68 -1.79 0.00 0.00 174.94 174.04 1n80 s VAL 12 N -3.43 4.96 0.77 8.37 -7.23 -1.26 -5.10 120.40 117.48 1n80 s VAL 12 Ca 0.05 0.01 -0.12 0.00 -1.81 0.00 0.00 61.98 60.11 1n80 s VAL 12 Cb -0.02 -3.17 0.05 0.00 0.56 0.00 0.00 36.38 33.81 1n80 s VAL 12 CO -0.07 0.56 1.13 0.42 -0.31 0.00 0.00 175.10 176.83 1n80 s THR 13 N -0.51 2.78 0.47 5.32 -4.23 -1.26 -4.94 115.64 113.26 1n80 s THR 13 Ca 0.11 0.25 0.14 0.00 -1.18 0.00 0.00 61.69 61.01 1n80 s THR 13 Cb -0.12 -3.20 0.29 0.00 1.34 0.00 0.00 72.50 70.81 1n80 s THR 13 CO 0.02 -0.33 2.08 0.77 -0.54 0.00 0.00 174.62 176.62 1n80 h SER 14 N -0.91 0.21 0.12 3.99 4.64 -2.02 -1.99 113.55 117.59 1n80 h SER 14 Ca -0.46 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.84 1n80 h SER 14 Cb 1.29 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1n80 h SER 14 CO 0.64 0.15 -0.07 0.11 -0.87 0.00 0.00 176.83 176.79 1n80 h LYS 15 N 0.25 0.00 -0.67 4.77 1.79 -1.92 -2.51 116.57 118.27 1n80 h LYS 15 Ca 0.12 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.51 1n80 h LYS 15 Cb 0.17 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.80 1n80 h LYS 15 CO -0.02 0.07 0.11 0.35 -1.08 0.00 0.00 179.45 178.88 1n80 h PHE 16 N 0.00 1.17 -0.52 -1.35 -0.00 -1.73 -1.70 116.94 112.81 1n80 h PHE 16 Ca -0.00 -0.16 0.03 0.00 -0.00 0.00 0.00 57.97 57.84 1n80 h PHE 16 Cb 0.15 -0.32 -0.04 0.00 -0.00 0.00 0.00 35.95 35.74 1n80 h PHE 16 CO 0.00 0.98 0.29 0.00 -0.00 0.00 0.00 178.31 179.58 1n80 h ARG 17 N 1.03 0.56 -0.71 1.11 3.08 -1.57 0.07 114.38 117.96 1n80 h ARG 17 Ca 0.21 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.17 1n80 h ARG 17 Cb 0.43 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.32 1n80 h ARG 17 CO 0.01 0.37 0.24 1.15 -1.07 0.00 0.00 179.97 180.67 1n80 h THR 18 N 0.58 1.25 -0.42 2.04 2.02 -1.53 -2.60 112.91 114.25 1n80 h THR 18 Ca 0.22 -0.85 -0.03 0.00 0.77 0.00 0.00 66.41 66.51 1n80 h THR 18 Cb 0.07 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 1n80 h THR 18 CO -0.12 0.34 0.12 -0.08 0.37 0.00 0.00 175.52 176.15 1n80 h GLU 19 N 1.05 0.62 -0.11 6.66 4.81 -0.21 -1.75 114.58 125.65 1n80 h GLU 19 Ca 0.23 -0.10 -0.12 0.00 -0.13 0.00 0.00 59.36 59.24 1n80 h GLU 19 Cb 0.27 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 1n80 h GLU 19 CO -0.01 0.55 -0.47 0.87 -0.73 0.00 0.00 179.01 179.22 1n80 h LYS 20 N 0.61 0.27 0.26 1.92 1.57 -0.67 -1.38 116.57 119.15 1n80 h LYS 20 Ca 0.14 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1n80 h LYS 20 Cb 0.20 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1n80 h LYS 20 CO -0.01 0.69 -0.13 1.98 -0.57 0.00 0.00 179.45 181.42 1n80 h MET 21 N 0.22 -0.34 -0.84 3.15 4.05 -1.15 -2.22 114.93 117.81 1n80 h MET 21 Ca 0.01 0.02 0.03 0.00 -0.28 0.00 0.00 59.70 59.49 1n80 h MET 21 Cb 0.92 0.08 -0.05 0.00 -0.80 0.00 0.00 31.60 31.75 1n80 h MET 21 CO 0.07 -0.10 0.54 1.25 0.23 0.00 0.00 176.91 178.90 1n80 h LEU 22 N -0.54 0.90 -0.45 3.39 5.85 -1.20 -0.68 115.31 122.58 1n80 h LEU 22 Ca -0.04 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.73 1n80 h LEU 22 Cb 0.40 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.18 1n80 h LEU 22 CO 0.06 0.62 0.18 0.78 -0.34 0.00 0.00 178.44 179.74 1n80 h ASN 23 N 1.05 0.22 0.18 1.25 2.35 -1.19 0.54 115.58 119.99 1n80 h ASN 23 Ca 0.33 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 56.12 1n80 h ASN 23 Cb -0.00 0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 1n80 h ASN 23 CO -0.11 0.16 -0.14 0.15 -1.65 0.00 0.00 177.43 175.84 1n80 h PHE 24 N 0.37 -0.36 -0.12 1.19 3.04 -0.62 0.15 116.94 120.57 1n80 h PHE 24 Ca 0.21 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.18 1n80 h PHE 24 Cb 0.18 0.14 -0.02 0.00 2.56 0.00 0.00 35.95 38.80 1n80 h PHE 24 CO -0.14 -0.22 -0.03 -0.92 -2.02 0.00 0.00 178.31 174.99 1n80 h TYR 25 N -0.33 -0.06 0.00 0.41 3.20 -0.70 -2.59 116.97 116.90 1n80 h TYR 25 Ca -0.01 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1n80 h TYR 25 Cb 0.30 0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.61 1n80 h TYR 25 CO -0.11 -0.05 -0.05 -0.91 -1.64 0.00 0.00 178.16 175.41 1n80 h ASN 26 N 0.01 0.00 1.12 -2.11 2.35 0.28 -2.91 115.58 114.32 1n80 h ASN 26 Ca 0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1n80 h ASN 26 Cb 0.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.46 1n80 h ASN 26 CO -0.12 0.05 0.00 -1.54 -1.65 0.00 0.00 177.43 174.17 1n80 n SER 27 N -3.23 0.52 -4.63 5.81 3.41 0.49 -4.75 113.62 111.23 1n80 n SER 27 Ca -0.01 0.57 -0.43 0.00 -0.26 0.00 0.00 58.87 58.74 1n80 n SER 27 Cb 0.25 -0.70 -0.02 0.00 -0.26 0.00 0.00 64.21 63.48 1n80 n SER 27 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1n80 s ILE 28 N -3.11 4.26 0.00 -1.33 1.01 -1.10 -0.09 121.20 120.83 1n80 s ILE 28 Ca 0.10 1.43 0.00 0.00 0.00 0.00 0.00 60.65 62.18 1n80 s ILE 28 Cb 0.13 -4.23 0.00 0.00 0.01 0.00 0.00 42.46 38.37 1n80 s ILE 28 CO 0.51 -0.46 0.00 0.61 0.00 0.00 0.00 174.94 175.59 1n80 n GLY 29 N 4.15 1.04 3.41 6.18 0.00 -0.79 -4.87 105.19 114.30 1n80 n GLY 29 Ca 0.14 -0.09 -0.20 0.00 0.00 0.00 0.00 46.02 45.86 1n80 n GLY 29 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1n80 s SER 30 N 2.00 2.33 0.00 1.61 0.15 -1.26 -4.27 113.70 114.26 1n80 s SER 30 Ca 0.00 -1.27 0.00 0.00 0.70 0.00 0.00 55.95 55.38 1n80 s SER 30 Cb 0.00 -0.08 0.00 0.00 -1.71 0.00 0.00 66.02 64.23 1n80 s SER 30 CO 0.00 -0.49 0.00 0.61 1.20 0.00 0.00 173.24 174.56 1n80 n GLY 31 N -0.57 -3.73 0.22 9.45 0.00 -1.26 -4.23 105.19 105.06 1n80 n GLY 31 Ca -0.04 -2.11 0.12 0.00 0.00 0.00 0.00 46.02 43.99 1n80 n GLY 31 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n80 h PRO 32 N 0.11 0.00 0.00 1.61 0.13 -2.04 -3.26 132.00 128.55 1n80 h PRO 32 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1n80 h PRO 32 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1n80 h PRO 32 CO 0.00 0.07 -0.42 -0.40 -0.23 0.00 0.00 178.00 177.02 1n80 n ASP 33 N -3.13 0.46 -4.92 1.44 3.85 -1.26 -4.92 116.55 108.07 1n80 n ASP 33 Ca 0.03 -0.02 -0.20 0.00 -0.71 0.00 0.00 54.79 53.90 1n80 n ASP 33 Cb 0.51 0.07 -0.02 0.00 -1.35 0.00 0.00 41.12 40.33 1n80 n ASP 33 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 1n80 s LYS 34 N -3.04 2.62 0.14 0.11 -0.14 -1.23 -5.03 119.74 113.17 1n80 s LYS 34 Ca 0.11 -1.45 0.09 0.00 -1.36 0.00 0.00 55.97 53.36 1n80 s LYS 34 Cb 0.17 -2.49 -0.04 0.00 -1.68 0.00 0.00 37.83 33.79 1n80 s LYS 34 CO 0.67 -0.22 -0.18 -0.80 -0.76 0.00 0.00 175.35 174.06 1n80 s ASN 35 N -4.20 3.83 -0.08 2.83 0.01 0.87 -4.79 114.94 113.40 1n80 s ASN 35 Ca 0.50 -0.62 0.01 0.00 -0.71 0.00 0.00 52.86 52.05 1n80 s ASN 35 Cb -0.05 -0.50 -0.03 0.00 0.41 0.00 0.00 41.25 41.08 1n80 s ASN 35 CO 0.29 0.16 -0.09 0.42 -1.51 0.00 0.00 177.10 176.37 1n80 s THR 36 N -1.27 3.46 -0.12 1.60 -4.23 -1.26 -1.89 115.64 111.92 1n80 s THR 36 Ca 0.19 -0.56 0.01 0.00 -1.18 0.00 0.00 61.69 60.15 1n80 s THR 36 Cb -0.10 -2.42 -0.01 0.00 1.34 0.00 0.00 72.50 71.32 1n80 s THR 36 CO 0.10 0.57 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.96 1n80 s ILE 37 N -0.47 2.72 0.06 2.99 1.09 -1.26 -1.16 121.20 125.17 1n80 s ILE 37 Ca 0.07 -0.78 0.09 0.00 -1.10 0.00 0.00 60.65 58.93 1n80 s ILE 37 Cb -0.12 -2.12 -0.03 0.00 -1.06 0.00 0.00 42.46 39.13 1n80 s ILE 37 CO 0.02 0.53 -0.26 -0.36 -0.10 0.00 0.00 174.94 174.77 1n80 s PHE 38 N 0.40 2.34 -0.12 3.97 0.40 -0.61 -0.02 117.98 124.34 1n80 s PHE 38 Ca -0.13 -0.40 -0.04 0.00 -0.60 0.00 0.00 56.93 55.77 1n80 s PHE 38 Cb -0.16 -1.37 -0.03 0.00 0.51 0.00 0.00 43.02 41.96 1n80 s PHE 38 CO 0.06 0.17 0.02 0.42 0.70 0.00 0.00 175.22 176.59 1n80 s ILE 39 N -0.86 4.44 0.14 0.64 1.01 0.02 -1.15 121.20 125.46 1n80 s ILE 39 Ca 0.12 -0.18 0.10 0.00 0.00 0.00 0.00 60.65 60.70 1n80 s ILE 39 Cb -0.10 -2.92 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 1n80 s ILE 39 CO 0.03 0.56 -0.23 0.42 0.00 0.00 0.00 174.94 175.72 1n80 s THR 40 N -0.43 2.49 0.03 2.92 -4.23 0.88 -1.02 115.64 116.27 1n80 s THR 40 Ca 0.08 -1.75 0.04 0.00 -1.18 0.00 0.00 61.69 58.88 1n80 s THR 40 Cb -0.12 -2.14 -0.02 0.00 1.34 0.00 0.00 72.50 71.56 1n80 s THR 40 CO 0.02 0.03 -0.12 0.72 -0.54 0.00 0.00 174.62 174.74 1n80 s PHE 41 N -1.26 1.02 0.00 3.99 -0.12 -0.91 -1.87 117.98 118.83 1n80 s PHE 41 Ca 0.17 -0.32 0.00 0.00 -0.05 0.00 0.00 56.93 56.73 1n80 s PHE 41 Cb -0.10 -0.61 0.00 0.00 -0.63 0.00 0.00 43.02 41.68 1n80 s PHE 41 CO 0.08 0.00 0.00 0.41 -0.05 0.00 0.00 175.22 175.67 1n80 n GLY 42 N 2.07 1.30 2.22 1.99 0.00 -0.53 -0.10 105.19 112.14 1n80 n GLY 42 Ca -0.18 -0.90 -0.01 0.00 0.00 0.00 0.00 46.02 44.93 1n80 n GLY 42 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1n80 n ARG 43 N 0.00 -2.42 0.05 1.61 0.63 -0.17 0.04 116.66 116.40 1n80 n ARG 43 Ca 0.00 2.07 0.11 0.00 -0.92 0.00 0.00 57.85 59.12 1n80 n ARG 43 Cb 0.00 -3.62 0.01 0.00 0.45 0.00 0.00 32.46 29.30 1n80 n ARG 43 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 1n80 n SER 44 N 0.67 0.63 -4.80 6.15 3.41 -1.26 -2.31 113.62 116.11 1n80 n SER 44 Ca -0.10 0.03 -0.39 0.00 -0.26 0.00 0.00 58.87 58.15 1n80 n SER 44 Cb 0.16 0.73 -0.06 0.00 -0.26 0.00 0.00 64.21 64.78 1n80 n SER 44 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1n80 s GLU 45 N -3.28 4.32 0.83 4.33 1.03 -1.26 -4.63 118.70 120.04 1n80 s GLU 45 Ca 0.01 0.88 -0.15 0.00 0.03 0.00 0.00 54.97 55.74 1n80 s GLU 45 Cb 0.13 -3.22 -0.03 0.00 -0.80 0.00 0.00 34.13 30.21 1n80 s GLU 45 CO 0.80 0.60 0.28 -2.30 -1.33 0.00 0.00 175.26 173.31 1n80 n PRO 46 N 1.59 0.04 0.03 -4.83 -0.02 -1.26 -4.95 135.00 125.60 1n80 n PRO 46 Ca -0.08 0.05 -0.22 0.00 -2.02 0.00 0.00 63.50 61.23 1n80 n PRO 46 Cb 0.50 -1.69 -0.14 0.00 -0.02 0.00 0.00 33.50 32.15 1n80 n PRO 46 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 1n80 h TRP 47 N -0.85 0.52 -1.37 6.00 -0.00 -1.97 -3.49 115.95 114.79 1n80 h TRP 47 Ca -0.44 -0.38 0.19 0.00 -0.00 0.00 0.00 58.89 58.25 1n80 h TRP 47 Cb 1.32 -0.02 -0.23 0.00 -0.00 0.00 0.00 29.16 30.23 1n80 h TRP 47 CO 0.34 1.62 0.77 -1.54 -0.00 0.00 0.00 178.44 179.62 1n80 s SER 48 N -7.11 -0.18 0.26 -3.49 1.04 -1.26 -5.05 113.70 97.91 1n80 s SER 48 Ca -0.19 0.15 0.12 0.00 0.48 0.00 0.00 55.95 56.51 1n80 s SER 48 Cb 0.05 0.16 0.65 0.00 0.10 0.00 0.00 66.02 66.98 1n80 s SER 48 CO 0.79 -0.21 1.27 -1.54 0.98 0.00 0.00 173.24 174.53 1n80 n SER 49 N 0.41 0.31 -1.13 7.02 3.41 -1.26 -0.86 113.62 121.51 1n80 n SER 49 Ca -0.04 0.55 0.12 0.00 -0.26 0.00 0.00 58.87 59.24 1n80 n SER 49 Cb 0.58 -0.52 0.21 0.00 -0.26 0.00 0.00 64.21 64.22 1n80 n SER 49 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1n80 n ASN 50 N -1.94 3.40 0.06 4.04 2.04 -1.26 -4.59 115.26 117.01 1n80 n ASN 50 Ca -0.01 -1.99 0.04 0.00 -0.44 0.00 0.00 54.58 52.18 1n80 n ASN 50 Cb 0.24 -0.23 0.19 0.00 -2.53 0.00 0.00 39.78 37.46 1n80 n ASN 50 CO 0.00 0.00 0.00 -1.84 -0.44 0.00 0.00 177.26 174.98 1n80 n GLU 51 N 1.47 0.05 0.00 -3.83 0.28 -0.04 -1.64 120.64 116.92 1n80 n GLU 51 Ca 0.19 0.48 0.10 0.00 -0.16 0.00 0.00 57.16 57.77 1n80 n GLU 51 Cb 0.60 -1.77 -0.02 0.00 1.43 0.00 0.00 31.44 31.68 1n80 n GLU 51 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1n80 n ASN 52 N -1.70 1.71 -4.81 -1.84 5.03 -1.26 -4.48 115.26 107.92 1n80 n ASN 52 Ca -0.00 -1.36 -0.33 0.00 0.87 0.00 0.00 54.58 53.76 1n80 n ASN 52 Cb 0.13 0.58 -0.03 0.00 -1.02 0.00 0.00 39.78 39.44 1n80 n ASN 52 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1n80 s GLU 53 N -2.40 3.76 0.48 3.52 2.02 -0.65 -5.00 118.70 120.43 1n80 s GLU 53 Ca 0.15 1.24 -0.23 0.00 0.02 0.00 0.00 54.97 56.14 1n80 s GLU 53 Cb 0.16 -2.10 -0.07 0.00 0.10 0.00 0.00 34.13 32.23 1n80 s GLU 53 CO 0.57 -0.45 1.28 0.54 0.02 0.00 0.00 175.26 177.22 1n80 s VAL 54 N -2.21 2.57 0.00 2.63 0.11 -1.26 -2.53 120.40 119.71 1n80 s VAL 54 Ca 0.65 0.45 0.00 0.00 -2.93 0.00 0.00 61.98 60.14 1n80 s VAL 54 Cb -0.14 -3.24 0.00 0.00 -1.53 0.00 0.00 36.38 31.47 1n80 s VAL 54 CO 0.25 0.01 0.00 0.61 -3.33 0.00 0.00 175.10 172.64 1n80 n GLY 55 N 0.60 0.93 3.70 6.54 0.00 -1.26 -5.00 105.19 110.71 1n80 n GLY 55 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1n80 n GLY 55 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1n80 s PHE 56 N -3.73 3.15 -0.10 1.61 5.36 -1.05 -5.02 117.98 118.21 1n80 s PHE 56 Ca 0.00 1.01 0.02 0.00 -0.96 0.00 0.00 56.93 56.99 1n80 s PHE 56 Cb 0.00 -3.60 -0.02 0.00 -0.34 0.00 0.00 43.02 39.07 1n80 s PHE 56 CO 0.00 -2.07 -0.16 0.00 -1.46 0.00 0.00 175.22 171.53 1n80 s ALA 57 N 1.61 2.54 0.74 11.12 0.00 -1.26 -4.84 121.76 131.67 1n80 s ALA 57 Ca 0.62 -0.93 -0.07 0.00 0.00 0.00 0.00 51.96 51.58 1n80 s ALA 57 Cb -0.32 -1.06 0.09 0.00 0.00 0.00 0.00 23.12 21.83 1n80 s ALA 57 CO 0.28 0.34 1.05 -1.25 0.00 0.00 0.00 175.76 176.18 1n80 s PRO 58 N 0.04 1.93 0.64 0.00 0.04 -1.26 -5.03 135.00 131.35 1n80 s PRO 58 Ca -0.06 -0.40 -0.13 0.00 0.04 0.00 0.00 61.00 60.45 1n80 s PRO 58 Cb -0.15 -2.16 -0.02 0.00 0.04 0.00 0.00 34.50 32.22 1n80 s PRO 58 CO 0.05 -1.41 1.05 -1.25 0.04 0.00 0.00 177.00 175.48 1n80 s PRO 59 N -5.31 3.15 0.54 0.56 0.04 -1.26 -5.01 135.00 127.72 1n80 s PRO 59 Ca 0.63 1.06 -0.21 0.00 0.04 0.00 0.00 61.00 62.52 1n80 s PRO 59 Cb -0.09 -2.02 -0.05 0.00 0.04 0.00 0.00 34.50 32.38 1n80 s PRO 59 CO 0.46 -0.93 1.21 0.71 0.04 0.00 0.00 177.00 178.48 1n80 s TYR 60 N -2.77 2.56 0.72 0.56 1.51 -1.26 -4.78 117.35 113.90 1n80 s TYR 60 Ca 0.60 1.50 -0.11 0.00 -1.01 0.00 0.00 57.07 58.05 1n80 s TYR 60 Cb -0.15 -3.48 0.02 0.00 -0.11 0.00 0.00 41.96 38.25 1n80 s TYR 60 CO 0.46 -2.03 1.07 -1.25 -1.11 0.00 0.00 175.55 172.69 1n80 s PRO 61 N -3.05 2.71 -0.18 -1.71 0.04 -1.26 -5.03 135.00 126.52 1n80 s PRO 61 Ca 0.71 0.74 -0.05 0.00 0.04 0.00 0.00 61.00 62.44 1n80 s PRO 61 Cb -0.31 -1.98 -0.03 0.00 0.04 0.00 0.00 34.50 32.22 1n80 s PRO 61 CO 0.35 -1.21 0.01 0.99 0.04 0.00 0.00 177.00 177.19 1n80 s THR 62 N -3.15 4.24 -1.20 1.26 2.01 -1.26 -5.04 115.64 112.50 1n80 s THR 62 Ca 0.59 -0.23 -0.14 0.00 0.31 0.00 0.00 61.69 62.22 1n80 s THR 62 Cb -0.13 -2.90 0.16 0.00 0.01 0.00 0.00 72.50 69.64 1n80 s THR 62 CO 0.54 0.46 1.43 -0.62 -0.69 0.00 0.00 174.62 175.74 1n80 s ASP 63 N 0.60 7.04 0.24 3.53 3.68 -1.26 -4.01 116.67 126.49 1n80 s ASP 63 Ca 0.00 -2.93 -0.18 0.00 2.13 0.00 0.00 52.55 51.58 1n80 s ASP 63 Cb -0.14 -2.41 0.02 0.00 -1.45 0.00 0.00 42.92 38.94 1n80 s ASP 63 CO 0.02 -0.78 0.58 -0.94 0.13 0.00 0.00 175.17 174.19 1n80 s SER 64 N 2.92 -0.23 0.52 -0.34 1.04 -1.26 -4.98 113.70 111.37 1n80 s SER 64 Ca 0.43 -0.62 0.24 0.00 0.48 0.00 0.00 55.95 56.48 1n80 s SER 64 Cb -0.03 0.63 1.36 0.00 0.10 0.00 0.00 66.02 68.08 1n80 s SER 64 CO -0.00 -1.18 1.98 0.58 0.98 0.00 0.00 173.24 175.60 1n80 h VAL 65 N 2.13 0.73 -0.12 5.02 2.07 -2.00 0.26 116.25 124.35 1n80 h VAL 65 Ca -0.25 -0.02 -0.07 0.00 0.82 0.00 0.00 66.70 67.18 1n80 h VAL 65 Cb 1.26 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 1n80 h VAL 65 CO 0.32 0.01 -0.20 0.25 0.02 0.00 0.00 177.57 177.97 1n80 h LEU 66 N 0.06 0.38 -0.40 2.57 5.85 -1.95 -1.91 115.31 119.90 1n80 h LEU 66 Ca 0.28 -0.54 0.04 0.00 0.84 0.00 0.00 57.88 58.50 1n80 h LEU 66 Cb 1.04 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.92 1n80 h LEU 66 CO -0.02 0.85 0.17 1.23 -0.34 0.00 0.00 178.44 180.33 1n80 h GLY 67 N -0.08 0.53 0.98 3.75 0.00 -1.13 -0.45 103.07 106.67 1n80 h GLY 67 Ca 0.01 -0.11 0.01 0.00 0.00 0.00 0.00 47.33 47.24 1n80 h GLY 67 CO 0.05 0.06 0.26 -2.08 0.00 0.00 0.00 176.54 174.82 1n80 h VAL 68 N 0.34 1.09 -0.22 4.60 2.07 -1.22 -1.13 116.25 121.78 1n80 h VAL 68 Ca 0.18 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.55 1n80 h VAL 68 Cb 0.13 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.38 1n80 h VAL 68 CO -0.16 0.10 0.03 0.74 0.02 0.00 0.00 177.57 178.30 1n80 h THR 69 N 0.53 0.88 -0.65 2.57 2.02 -1.02 -1.92 112.91 115.32 1n80 h THR 69 Ca 0.15 -0.04 0.06 0.00 0.77 0.00 0.00 66.41 67.35 1n80 h THR 69 Cb -0.05 0.76 -0.05 0.00 -1.74 0.00 0.00 68.15 67.07 1n80 h THR 69 CO -0.04 0.02 0.36 -0.78 0.37 0.00 0.00 175.52 175.45 1n80 h ASP 70 N 0.11 0.53 -0.42 4.18 1.82 -0.73 -0.18 116.42 121.73 1n80 h ASP 70 Ca 0.10 0.03 0.03 0.00 -0.39 0.00 0.00 57.03 56.80 1n80 h ASP 70 Cb 0.11 -0.07 -0.03 0.00 0.68 0.00 0.00 39.33 40.01 1n80 h ASP 70 CO -0.15 0.34 0.22 -0.03 -1.61 0.00 0.00 179.24 178.01 1n80 h MET 71 N 0.66 0.43 -0.36 0.28 4.05 -0.72 -2.27 114.93 116.99 1n80 h MET 71 Ca 0.29 -0.03 -0.04 0.00 -0.28 0.00 0.00 59.70 59.65 1n80 h MET 71 Cb 0.18 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.87 1n80 h MET 71 CO -0.18 0.28 0.08 -1.49 0.23 0.00 0.00 176.91 175.83 1n80 h TRP 72 N 0.44 0.63 0.00 1.39 4.06 -0.71 -1.30 115.95 120.45 1n80 h TRP 72 Ca 0.18 -0.08 -0.00 0.00 2.06 0.00 0.00 58.89 61.04 1n80 h TRP 72 Cb 0.07 -0.17 -0.00 0.00 -1.00 0.00 0.00 29.16 28.05 1n80 h TRP 72 CO -0.09 0.63 -0.01 1.15 -3.56 0.00 0.00 178.44 176.56 1n80 h THR 73 N 0.44 0.77 -0.02 1.49 2.02 -0.83 -1.77 112.91 115.02 1n80 h THR 73 Ca 0.11 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.25 1n80 h THR 73 Cb 0.33 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1n80 h THR 73 CO 0.00 0.01 -0.38 1.41 0.37 0.00 0.00 175.52 176.93 1n80 n HIS 74 N -4.18 0.00 -1.68 3.16 8.25 -0.87 -4.98 115.22 114.92 1n80 n HIS 74 Ca -0.03 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 56.98 1n80 n HIS 74 Cb 0.10 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.17 1n80 n HIS 74 CO 0.00 0.00 0.00 -0.12 0.64 0.00 0.00 176.34 176.86 1n80 n MET 75 N 0.15 2.25 -0.05 -0.41 0.00 -0.51 -1.00 117.12 117.54 1n80 n MET 75 Ca 0.09 0.81 -0.01 0.00 0.00 0.00 0.00 57.70 58.59 1n80 n MET 75 Cb 0.46 -2.59 -0.12 0.00 0.00 0.00 0.00 33.22 30.97 1n80 n MET 75 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 175.97 174.64 1n80 n MET 76 N 3.48 1.19 -3.69 2.12 2.81 0.86 -4.79 117.12 119.10 1n80 n MET 76 Ca 0.17 -0.06 -0.03 0.00 -1.81 0.00 0.00 57.70 55.97 1n80 n MET 76 Cb 0.30 -1.37 -0.01 0.00 -0.71 0.00 0.00 33.22 31.42 1n80 n MET 76 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1n80 s GLY 77 N -4.40 -0.31 0.02 3.03 0.00 -1.08 -4.47 107.32 100.10 1n80 s GLY 77 Ca -0.07 0.43 0.00 0.00 0.00 0.00 0.00 44.72 45.09 1n80 s GLY 77 CO 0.61 0.09 -0.03 -0.51 0.00 0.00 0.00 173.10 173.27 1n80 s THR 78 N -2.99 0.11 -0.03 0.90 -4.23 -0.55 -2.14 115.64 106.71 1n80 s THR 78 Ca 0.12 -0.78 0.02 0.00 -1.18 0.00 0.00 61.69 59.86 1n80 s THR 78 Cb 0.00 -0.23 0.01 0.00 1.34 0.00 0.00 72.50 73.62 1n80 s THR 78 CO -0.01 -0.42 -0.05 -0.69 -0.54 0.00 0.00 174.62 172.90 1n80 s VAL 79 N -1.25 0.53 0.11 2.29 1.01 -0.19 -2.30 120.40 120.60 1n80 s VAL 79 Ca -0.14 -0.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.36 1n80 s VAL 79 Cb -0.09 -0.51 -0.06 0.00 0.00 0.00 0.00 36.38 35.73 1n80 s VAL 79 CO -0.01 0.19 1.09 -0.75 0.00 0.00 0.00 175.10 175.62 1n80 s LYS 80 N 0.46 4.56 -0.16 2.72 2.20 -0.53 -0.80 119.74 128.20 1n80 s LYS 80 Ca -0.06 1.64 -0.15 0.00 -0.36 0.00 0.00 55.97 57.04 1n80 s LYS 80 Cb -0.10 -3.34 -0.04 0.00 -1.51 0.00 0.00 37.83 32.84 1n80 s LYS 80 CO 0.00 -0.01 0.36 0.08 -0.36 0.00 0.00 175.35 175.42 1n80 s VAL 81 N 0.35 5.25 0.21 4.02 1.01 0.97 -4.93 120.40 127.29 1n80 s VAL 81 Ca 0.52 0.68 0.06 0.00 0.00 0.00 0.00 61.98 63.24 1n80 s VAL 81 Cb -0.27 -3.70 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 1n80 s VAL 81 CO 0.31 0.34 0.15 -0.76 0.00 0.00 0.00 175.10 175.14 1n80 s LEU 82 N 0.72 3.75 0.27 3.92 1.43 -1.26 -4.41 118.68 123.10 1n80 s LEU 82 Ca 0.19 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1n80 s LEU 82 Cb -0.14 -2.33 0.60 0.00 0.03 0.00 0.00 46.19 44.36 1n80 s LEU 82 CO 0.06 0.02 1.71 -0.65 0.23 0.00 0.00 176.35 177.72 1n80 h PRO 83 N 1.98 0.42 0.00 1.29 0.11 -1.94 0.78 132.00 134.64 1n80 h PRO 83 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1n80 h PRO 83 Cb 1.22 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1n80 h PRO 83 CO 0.62 0.28 0.00 -1.13 -0.21 0.00 0.00 178.00 177.55 1n80 n SER 84 N -5.02 0.00 -0.37 -2.05 3.41 -1.26 -1.19 113.62 107.14 1n80 n SER 84 Ca 0.19 0.39 0.13 0.00 -0.26 0.00 0.00 58.87 59.31 1n80 n SER 84 Cb 0.54 -0.42 0.37 0.00 -0.26 0.00 0.00 64.21 64.44 1n80 n SER 84 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1n80 n MET 85 N -1.42 1.19 -4.48 4.33 2.81 0.27 -4.87 117.12 114.95 1n80 n MET 85 Ca 0.02 -0.75 -0.34 0.00 -1.81 0.00 0.00 57.70 54.83 1n80 n MET 85 Cb 0.07 -1.48 -0.14 0.00 -0.71 0.00 0.00 33.22 30.96 1n80 n MET 85 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1n80 s LEU 86 N -2.32 2.82 0.02 4.03 1.43 -0.33 -0.73 118.68 123.61 1n80 s LEU 86 Ca 0.28 -0.32 0.08 0.00 -1.03 0.00 0.00 54.13 53.14 1n80 s LEU 86 Cb 0.20 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.73 1n80 s LEU 86 CO 0.46 0.11 -0.25 -1.81 0.23 0.00 0.00 176.35 175.09 1n80 s ASP 87 N 0.67 2.95 0.18 2.29 1.01 -0.72 -4.95 116.67 118.10 1n80 s ASP 87 Ca -0.05 -0.53 -0.28 0.00 0.71 0.00 0.00 52.55 52.40 1n80 s ASP 87 Cb -0.15 -0.28 -0.08 0.00 1.01 0.00 0.00 42.92 43.42 1n80 s ASP 87 CO 0.02 0.26 0.88 0.00 0.21 0.00 0.00 175.17 176.54 1n80 s ALA 88 N -0.73 3.36 0.16 5.23 0.00 -1.26 -0.97 121.76 127.55 1n80 s ALA 88 Ca 0.10 0.50 -0.05 0.00 0.00 0.00 0.00 51.96 52.52 1n80 s ALA 88 Cb -0.10 -3.12 -0.03 0.00 0.00 0.00 0.00 23.12 19.87 1n80 s ALA 88 CO 0.01 0.18 0.17 0.14 0.00 0.00 0.00 175.76 176.26 1n80 s VAL 89 N -0.88 0.07 0.17 0.00 -7.23 -0.25 -1.50 120.40 110.79 1n80 s VAL 89 Ca 0.40 -1.70 -0.08 0.00 -1.81 0.00 0.00 61.98 58.79 1n80 s VAL 89 Cb -0.24 -2.03 -0.01 0.00 0.56 0.00 0.00 36.38 34.65 1n80 s VAL 89 CO 0.29 -0.33 0.25 0.27 -0.31 0.00 0.00 175.10 175.28 1n80 s ILE 90 N -4.03 0.06 0.31 -0.62 -4.36 -0.86 -4.02 121.20 107.68 1n80 s ILE 90 Ca 0.23 -1.51 -0.29 0.00 -0.26 0.00 0.00 60.65 58.83 1n80 s ILE 90 Cb 0.05 -1.94 -0.13 0.00 1.25 0.00 0.00 42.46 41.70 1n80 s ILE 90 CO 0.03 -0.28 1.34 -2.65 0.24 0.00 0.00 174.94 173.62 1n80 n PRO 91 N -0.21 2.14 -3.46 0.37 -0.02 -1.26 -2.27 135.00 130.29 1n80 n PRO 91 Ca -0.06 0.75 -0.38 0.00 -2.02 0.00 0.00 63.50 61.79 1n80 n PRO 91 Cb 0.63 -2.37 -0.09 0.00 -0.02 0.00 0.00 33.50 31.66 1n80 n PRO 91 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1n80 s ARG 92 N -1.41 4.09 -0.25 -0.52 3.52 0.17 -4.69 118.95 119.86 1n80 s ARG 92 Ca 0.59 0.02 -0.00 0.00 -0.13 0.00 0.00 55.73 56.21 1n80 s ARG 92 Cb -0.59 -3.58 0.07 0.00 -1.56 0.00 0.00 34.95 29.30 1n80 s ARG 92 CO 0.58 -0.09 0.02 0.50 -0.81 0.00 0.00 175.30 175.49 1n80 s ARG 93 N 1.50 1.15 -0.10 5.12 6.06 -1.26 -4.87 118.95 126.55 1n80 s ARG 93 Ca 0.15 -0.96 -0.20 0.00 -2.50 0.00 0.00 55.73 52.21 1n80 s ARG 93 Cb -0.15 -2.38 -0.04 0.00 0.06 0.00 0.00 34.95 32.44 1n80 s ARG 93 CO 0.08 -0.74 0.57 -0.51 -2.50 0.00 0.00 175.30 172.20 1n80 s ASP 94 N 1.51 6.80 0.51 -2.12 -0.00 -1.26 -0.05 116.67 122.07 1n80 s ASP 94 Ca 0.01 0.96 -0.23 0.00 -0.00 0.00 0.00 52.55 53.30 1n80 s ASP 94 Cb -0.18 -2.34 -0.06 0.00 -0.00 0.00 0.00 42.92 40.34 1n80 s ASP 94 CO -0.12 -0.06 1.33 0.86 -0.00 0.00 0.00 175.17 177.18 1n80 s TRP 95 N 0.74 2.44 -0.40 4.23 -0.00 -0.37 -3.26 118.94 122.32 1n80 s TRP 95 Ca 0.31 1.39 0.00 0.00 -0.00 0.00 0.00 56.10 57.80 1n80 s TRP 95 Cb -0.16 -3.73 0.00 0.00 -0.00 0.00 0.00 33.47 29.58 1n80 s TRP 95 CO 0.13 -2.62 0.00 0.41 -0.00 0.00 0.00 176.95 174.88 1n80 n GLY 96 N 0.66 0.36 3.57 5.86 0.00 0.07 -4.63 105.19 111.07 1n80 n GLY 96 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 1n80 n GLY 96 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n80 s ASP 97 N -1.64 5.99 0.00 1.61 3.68 -1.20 -4.80 116.67 120.31 1n80 s ASP 97 Ca 0.00 -1.44 0.00 0.00 2.13 0.00 0.00 52.55 53.24 1n80 s ASP 97 Cb 0.00 -2.57 0.00 0.00 -1.45 0.00 0.00 42.92 38.90 1n80 s ASP 97 CO 0.00 -2.00 0.04 0.35 0.13 0.00 0.00 175.17 173.69 1n80 n THR 98 N 7.20 0.00 0.76 1.71 -2.24 -1.26 -1.38 114.28 119.07 1n80 n THR 98 Ca 0.39 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 62.26 1n80 n THR 98 Cb 0.48 -0.13 0.04 0.00 -2.10 0.00 0.00 70.33 68.62 1n80 n THR 98 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1n80 n ARG 99 N 0.24 1.56 -4.10 -0.78 1.74 -1.26 -4.95 116.66 109.12 1n80 n ARG 99 Ca 0.00 -1.28 -0.12 0.00 -0.77 0.00 0.00 57.85 55.69 1n80 n ARG 99 Cb 0.01 -1.33 -0.11 0.00 -1.02 0.00 0.00 32.46 30.01 1n80 n ARG 99 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1n80 s TYR 100 N -1.72 0.71 0.79 -1.55 4.12 -0.48 -5.15 117.35 114.07 1n80 s TYR 100 Ca 0.18 -0.68 -0.14 0.00 0.02 0.00 0.00 57.07 56.45 1n80 s TYR 100 Cb 0.15 -0.43 0.07 0.00 -1.52 0.00 0.00 41.96 40.23 1n80 s TYR 100 CO 0.31 -0.13 1.20 -2.30 0.02 0.00 0.00 175.55 174.65 1n80 n PRO 101 N 0.86 0.30 -3.86 -1.71 -0.02 -1.26 -3.86 135.00 125.45 1n80 n PRO 101 Ca -0.19 0.18 -0.24 0.00 -2.02 0.00 0.00 63.50 61.23 1n80 n PRO 101 Cb 0.57 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1n80 n PRO 101 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1n80 n ASP 102 N -3.02 -0.77 0.16 2.55 10.43 -1.26 -4.87 116.55 119.76 1n80 n ASP 102 Ca 0.14 -0.93 0.13 0.00 2.57 0.00 0.00 54.79 56.70 1n80 n ASP 102 Cb 0.50 -3.45 0.50 0.00 1.84 0.00 0.00 41.12 40.51 1n80 n ASP 102 CO 0.00 0.00 0.00 1.55 -1.07 0.00 0.00 177.20 177.68 1n80 h PRO 103 N -1.85 0.00 0.00 -0.24 0.13 -1.84 -3.16 132.00 125.04 1n80 h PRO 103 Ca -0.62 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 1n80 h PRO 103 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1n80 h PRO 103 CO 0.60 0.00 -0.00 0.66 -0.23 0.00 0.00 178.00 179.03 1n80 n TYR 104 N -2.45 0.00 -4.77 1.56 4.01 -1.26 -0.75 117.16 113.50 1n80 n TYR 104 Ca 0.02 -0.37 -0.26 0.00 -0.16 0.00 0.00 57.90 57.14 1n80 n TYR 104 Cb 0.29 -0.04 -0.16 0.00 -0.31 0.00 0.00 39.34 39.12 1n80 n TYR 104 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1n80 s THR 105 N -0.76 1.35 0.26 -0.72 2.01 -1.20 0.91 115.64 117.49 1n80 s THR 105 Ca 0.01 -0.66 -0.00 0.00 0.31 0.00 0.00 61.69 61.35 1n80 s THR 105 Cb 0.01 -1.18 -0.03 0.00 0.01 0.00 0.00 72.50 71.31 1n80 s THR 105 CO 0.00 0.39 0.25 -0.36 -0.69 0.00 0.00 174.62 174.22 1n80 s PHE 106 N 0.17 1.23 0.19 4.92 0.08 -1.26 -4.84 117.98 118.47 1n80 s PHE 106 Ca -0.06 -1.38 0.05 0.00 0.12 0.00 0.00 56.93 55.66 1n80 s PHE 106 Cb -0.12 -0.46 -0.05 0.00 -0.57 0.00 0.00 43.02 41.82 1n80 s PHE 106 CO 0.03 -0.80 -0.09 1.03 -0.10 0.00 0.00 175.22 175.29 1n80 s ARG 107 N -3.81 1.22 0.03 0.44 3.00 -1.26 -4.41 118.95 114.17 1n80 s ARG 107 Ca 0.37 -1.56 -0.36 0.00 0.00 0.00 0.00 55.73 54.18 1n80 s ARG 107 Cb 0.04 -0.78 -0.14 0.00 0.00 0.00 0.00 34.95 34.07 1n80 s ARG 107 CO 0.17 0.06 1.59 -0.89 0.00 0.00 0.00 175.30 176.23 1n80 n ILE 108 N -0.32 0.15 -0.37 1.52 -0.00 -1.26 -1.38 119.36 117.71 1n80 n ILE 108 Ca -0.08 -0.03 0.00 0.00 -0.00 0.00 0.00 62.75 62.64 1n80 n ILE 108 Cb 0.61 -1.36 0.00 0.00 -0.00 0.00 0.00 39.64 38.90 1n80 n ILE 108 CO 0.00 0.00 0.00 0.59 -0.00 0.00 0.00 176.55 177.14 1n80 n ASN 109 N 4.05 0.00 -4.77 4.38 3.02 -0.50 -4.99 115.26 116.45 1n80 n ASN 109 Ca 0.20 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.34 1n80 n ASN 109 Cb 0.24 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.40 1n80 n ASN 109 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1n80 s ASP 110 N -3.07 6.58 -0.39 6.41 1.11 -0.48 -4.67 116.67 122.16 1n80 s ASP 110 Ca 0.00 2.82 -0.07 0.00 0.18 0.00 0.00 52.55 55.48 1n80 s ASP 110 Cb 0.00 -2.66 0.08 0.00 1.07 0.00 0.00 42.92 41.41 1n80 s ASP 110 CO 0.00 -0.68 0.20 -0.63 1.18 0.00 0.00 175.17 175.24 1n80 s ILE 111 N -1.14 3.82 0.02 0.77 1.01 -1.26 -0.99 121.20 123.44 1n80 s ILE 111 Ca 0.51 -1.50 -0.00 0.00 0.00 0.00 0.00 60.65 59.66 1n80 s ILE 111 Cb -0.42 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 38.65 1n80 s ILE 111 CO 0.56 -0.45 0.14 -0.69 0.00 0.00 0.00 174.94 174.50 1n80 s VAL 112 N 1.34 5.05 -0.12 2.92 1.01 0.59 -4.23 120.40 126.96 1n80 s VAL 112 Ca 0.02 -0.39 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 1n80 s VAL 112 Cb -0.22 -3.38 -0.03 0.00 0.00 0.00 0.00 36.38 32.75 1n80 s VAL 112 CO 0.00 0.26 -0.03 -0.69 0.00 0.00 0.00 175.10 174.65 1n80 s VAL 113 N -1.33 4.01 0.34 2.92 1.01 0.93 -0.07 120.40 128.20 1n80 s VAL 113 Ca 0.28 -0.34 0.05 0.00 0.00 0.00 0.00 61.98 61.97 1n80 s VAL 113 Cb -0.12 -2.72 -0.07 0.00 0.00 0.00 0.00 36.38 33.47 1n80 s VAL 113 CO 0.20 0.54 0.03 0.00 0.00 0.00 0.00 175.10 175.87 1n80 n ASN 115 N -0.74 -1.90 0.00 0.00 5.15 -0.79 -1.26 115.26 115.73 1n80 n ASN 115 Ca -0.03 -0.74 0.00 0.00 -0.60 0.00 0.00 54.58 53.20 1n80 n ASN 115 Cb 0.66 -4.51 0.00 0.00 -0.53 0.00 0.00 39.78 35.40 1n80 n ASN 115 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1n80 n SER 116 N -3.08 0.18 -3.60 1.20 3.41 -1.26 -3.84 113.62 106.62 1n80 n SER 116 Ca -0.28 -1.02 -0.07 0.00 -0.26 0.00 0.00 58.87 57.24 1n80 n SER 116 Cb 0.67 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.60 1n80 n SER 116 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n80 s ALA 117 N -0.02 -1.66 0.56 7.33 0.00 -1.26 -5.00 121.76 121.72 1n80 s ALA 117 Ca 0.00 0.50 0.25 0.00 0.00 0.00 0.00 51.96 52.71 1n80 s ALA 117 Cb 0.00 0.62 1.53 0.00 0.00 0.00 0.00 23.12 25.27 1n80 s ALA 117 CO 0.00 -0.85 2.09 -1.00 0.00 0.00 0.00 175.76 176.01 1n80 h PRO 118 N 2.00 0.00 0.00 0.00 0.13 -1.98 0.59 132.00 132.73 1n80 h PRO 118 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1n80 h PRO 118 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1n80 h PRO 118 CO 0.30 0.00 0.00 2.48 -0.23 0.00 0.00 178.00 180.55 1n80 n TYR 119 N -4.09 0.00 -0.01 1.56 4.11 -1.26 -3.57 117.16 113.90 1n80 n TYR 119 Ca 0.02 0.00 -0.00 0.00 -0.00 0.00 0.00 57.90 57.92 1n80 n TYR 119 Cb 0.33 -0.14 -0.03 0.00 -0.00 0.00 0.00 39.34 39.51 1n80 n TYR 119 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.86 176.95 1n80 n ASN 120 N -1.14 4.21 -2.94 9.48 3.02 0.17 -4.64 115.26 123.43 1n80 n ASN 120 Ca 0.19 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.34 1n80 n ASN 120 Cb 0.17 0.84 -0.06 0.00 -0.61 0.00 0.00 39.78 40.12 1n80 n ASN 120 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n80 n ALA 121 N -1.90 -1.90 -0.07 5.41 0.00 0.51 -1.89 120.51 120.68 1n80 n ALA 121 Ca -0.03 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1n80 n ALA 121 Cb 0.38 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1n80 n ALA 121 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1n80 n THR 122 N 1.57 0.00 -2.89 0.00 -2.24 -1.26 -4.85 114.28 104.61 1n80 n THR 122 Ca 0.15 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.91 1n80 n THR 122 Cb 0.02 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.35 1n80 n THR 122 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1n80 s GLU 123 N 0.00 0.96 0.08 -0.78 2.12 -1.26 -4.98 118.70 114.83 1n80 s GLU 123 Ca 0.00 -0.79 -0.34 0.00 0.36 0.00 0.00 54.97 54.21 1n80 s GLU 123 Cb 0.00 -0.00 -0.13 0.00 0.26 0.00 0.00 34.13 34.26 1n80 s GLU 123 CO 0.00 -1.24 1.71 -1.13 -0.54 0.00 0.00 175.26 174.06 1n80 n SER 124 N 3.37 3.33 0.00 -1.70 3.41 -1.26 -0.59 113.62 120.18 1n80 n SER 124 Ca 0.16 1.04 0.00 0.00 -0.26 0.00 0.00 58.87 59.80 1n80 n SER 124 Cb 0.57 -1.42 0.00 0.00 -0.26 0.00 0.00 64.21 63.09 1n80 n SER 124 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n80 n GLY 125 N 3.84 1.91 3.47 5.00 0.00 -1.26 -5.09 105.19 113.06 1n80 n GLY 125 Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 1n80 n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n80 s ALA 126 N -2.04 2.63 0.94 4.61 0.00 0.24 -5.14 121.76 123.01 1n80 s ALA 126 Ca 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 50.53 1n80 s ALA 126 Cb 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 23.12 22.56 1n80 s ALA 126 CO 0.00 0.55 0.00 0.41 0.00 0.00 0.00 175.76 176.72 1n80 n GLY 127 N 0.66 -0.01 3.76 0.00 0.00 -1.26 -4.92 105.19 103.42 1n80 n GLY 127 Ca -0.15 -1.60 -0.35 0.00 0.00 0.00 0.00 46.02 43.92 1n80 n GLY 127 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1n80 s TRP 128 N 0.13 2.48 -0.08 1.61 0.52 -1.05 -4.80 118.94 117.75 1n80 s TRP 128 Ca 0.00 1.54 0.02 0.00 0.02 0.00 0.00 56.10 57.68 1n80 s TRP 128 Cb 0.00 -3.35 0.02 0.00 -1.15 0.00 0.00 33.47 28.98 1n80 s TRP 128 CO 0.00 -1.96 -0.12 -0.51 0.02 0.00 0.00 176.95 174.38 1n80 s LEU 129 N -4.31 1.57 -0.09 2.99 1.43 -0.39 -0.98 118.68 118.91 1n80 s LEU 129 Ca 0.73 -0.32 -0.00 0.00 -1.03 0.00 0.00 54.13 53.51 1n80 s LEU 129 Cb -0.26 -0.86 -0.03 0.00 0.03 0.00 0.00 46.19 45.07 1n80 s LEU 129 CO 0.35 0.00 -0.06 -0.69 0.23 0.00 0.00 176.35 176.18 1n80 s VAL 130 N 0.90 3.80 0.07 -1.59 1.01 -0.54 0.33 120.40 124.38 1n80 s VAL 130 Ca -0.10 -0.43 0.03 0.00 0.00 0.00 0.00 61.98 61.48 1n80 s VAL 130 Cb -0.15 -2.58 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 1n80 s VAL 130 CO 0.01 0.58 -0.09 -0.31 0.00 0.00 0.00 175.10 175.29 1n80 s TYR 131 N -0.61 0.89 -0.13 5.22 2.02 0.90 -1.59 117.35 124.06 1n80 s TYR 131 Ca 0.09 -0.60 -0.01 0.00 -0.37 0.00 0.00 57.07 56.19 1n80 s TYR 131 Cb -0.12 -0.51 -0.02 0.00 -0.40 0.00 0.00 41.96 40.91 1n80 s TYR 131 CO 0.02 -0.05 -0.09 0.50 -1.57 0.00 0.00 175.55 174.36 1n80 s ARG 132 N -2.27 3.36 0.08 -0.62 3.52 -0.46 -0.30 118.95 122.26 1n80 s ARG 132 Ca -0.01 -0.62 -0.31 0.00 -0.13 0.00 0.00 55.73 54.66 1n80 s ARG 132 Cb -0.06 -2.70 -0.07 0.00 -1.56 0.00 0.00 34.95 30.56 1n80 s ARG 132 CO -0.00 0.30 1.29 0.00 -0.81 0.00 0.00 175.30 176.08 1n80 n LEU 134 N 4.03 0.11 -3.54 0.00 4.77 0.65 -1.40 117.00 121.62 1n80 n LEU 134 Ca 0.10 0.05 -0.11 0.00 -0.03 0.00 0.00 56.01 56.02 1n80 n LEU 134 Cb 0.44 0.38 -0.04 0.00 -2.33 0.00 0.00 43.42 41.87 1n80 n LEU 134 CO 0.57 0.40 0.68 -0.62 -1.33 0.00 0.00 177.39 177.08 1n80 s ASP 135 N -5.40 -0.43 0.33 -1.43 3.68 -1.18 -4.85 116.67 107.40 1n80 s ASP 135 Ca -0.09 0.33 0.05 0.00 2.13 0.00 0.00 52.55 54.97 1n80 s ASP 135 Cb 0.08 0.38 -0.07 0.00 -1.45 0.00 0.00 42.92 41.86 1n80 s ASP 135 CO 0.84 -0.49 0.03 0.68 0.13 0.00 0.00 175.17 176.36 1n80 s VAL 136 N -1.77 1.42 0.52 1.11 -7.23 -1.26 -1.55 120.40 111.65 1n80 s VAL 136 Ca -0.01 -2.02 -0.19 0.00 -1.81 0.00 0.00 61.98 57.94 1n80 s VAL 136 Cb -0.01 -2.77 -0.10 0.00 0.56 0.00 0.00 36.38 34.07 1n80 s VAL 136 CO -0.00 -0.06 0.49 -2.65 -0.31 0.00 0.00 175.10 172.57 1n80 n PRO 137 N -0.72 0.51 0.00 4.82 -0.02 -1.15 -4.88 135.00 133.57 1n80 n PRO 137 Ca -0.03 0.20 0.15 0.00 -2.02 0.00 0.00 63.50 61.80 1n80 n PRO 137 Cb 0.66 -1.61 0.87 0.00 -0.02 0.00 0.00 33.50 33.40 1n80 n PRO 137 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1n80 n ASP 138 N 0.84 0.00 -4.40 2.55 8.00 -1.26 -4.72 116.55 117.56 1n80 n ASP 138 Ca 0.11 -0.67 -0.36 0.00 0.71 0.00 0.00 54.79 54.58 1n80 n ASP 138 Cb 0.45 -0.11 -0.13 0.00 -0.02 0.00 0.00 41.12 41.31 1n80 n ASP 138 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1n80 s THR 139 N -2.22 3.97 -0.02 -3.53 -1.32 -1.26 -4.59 115.64 106.67 1n80 s THR 139 Ca 0.40 -0.29 0.00 0.00 -1.21 0.00 0.00 61.69 60.59 1n80 s THR 139 Cb 0.21 -2.84 0.00 0.00 -1.51 0.00 0.00 72.50 68.36 1n80 s THR 139 CO 0.40 0.37 0.00 0.61 -2.21 0.00 0.00 174.62 173.80 1n80 n GLY 140 N 4.85 -0.83 3.05 6.08 0.00 -1.26 -0.14 105.19 116.94 1n80 n GLY 140 Ca -0.17 -0.23 -0.20 0.00 0.00 0.00 0.00 46.02 45.42 1n80 n GLY 140 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1n80 s MET 141 N -0.01 0.87 -0.04 1.61 -2.45 -0.56 -4.88 119.30 113.84 1n80 s MET 141 Ca 0.00 -0.40 -0.03 0.00 -1.25 0.00 0.00 55.69 54.02 1n80 s MET 141 Cb 0.00 -0.84 -0.04 0.00 1.25 0.00 0.00 34.83 35.20 1n80 s MET 141 CO 0.00 0.23 0.13 0.00 1.05 0.00 0.00 175.02 176.42 1n80 h SER 143 N 4.28 0.19 -3.51 0.00 4.64 -1.32 -2.75 113.55 115.08 1n80 h SER 143 Ca -0.51 0.03 -0.77 0.00 -0.47 0.00 0.00 61.79 60.07 1n80 h SER 143 Cb 1.20 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 63.03 1n80 h SER 143 CO 0.63 0.04 -0.06 -0.63 -0.87 0.00 0.00 176.83 175.95 1n80 s ILE 144 N -5.18 5.38 0.15 0.95 1.01 -1.26 -4.96 121.20 117.28 1n80 s ILE 144 Ca -0.07 -2.06 -0.19 0.00 0.00 0.00 0.00 60.65 58.33 1n80 s ILE 144 Cb 0.23 -4.38 0.06 0.00 0.01 0.00 0.00 42.46 38.38 1n80 s ILE 144 CO 0.79 -0.95 1.19 0.00 0.00 0.00 0.00 174.94 175.97 1n80 n ALA 145 N 4.52 -0.31 -0.25 9.38 0.00 -1.04 -1.61 120.51 131.20 1n80 n ALA 145 Ca 0.02 0.71 0.22 0.00 0.00 0.00 0.00 53.44 54.38 1n80 n ALA 145 Cb 0.44 -0.22 0.55 0.00 0.00 0.00 0.00 19.45 20.22 1n80 n ALA 145 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1n80 h SER 146 N 0.00 0.34 -1.39 0.00 4.64 -1.94 -3.36 113.55 111.85 1n80 h SER 146 Ca 0.19 0.04 -0.45 0.00 -0.47 0.00 0.00 61.79 61.11 1n80 h SER 146 Cb 0.38 -0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 62.40 1n80 h SER 146 CO -0.74 0.12 1.11 -0.76 -0.87 0.00 0.00 176.83 175.68 1n80 s LEU 147 N -9.30 3.27 -0.07 5.97 1.43 -0.63 -4.82 118.68 114.53 1n80 s LEU 147 Ca -0.08 -0.52 0.13 0.00 -1.03 0.00 0.00 54.13 52.64 1n80 s LEU 147 Cb 0.23 -2.55 0.49 0.00 0.03 0.00 0.00 46.19 44.38 1n80 s LEU 147 CO 0.79 -2.26 1.36 0.35 0.23 0.00 0.00 176.35 176.81 1n80 n THR 148 N 7.27 1.17 -4.61 5.49 -2.24 -1.26 -4.17 114.28 115.92 1n80 n THR 148 Ca 0.28 -0.78 -0.31 0.00 -2.27 0.00 0.00 64.05 60.97 1n80 n THR 148 Cb 0.49 0.05 -0.17 0.00 -2.10 0.00 0.00 70.33 68.61 1n80 n THR 148 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1n80 s ASP 149 N -0.80 2.82 0.11 3.42 -1.08 -1.26 -4.91 116.67 114.97 1n80 s ASP 149 Ca 0.35 -0.53 -0.30 0.00 -0.52 0.00 0.00 52.55 51.55 1n80 s ASP 149 Cb 0.22 -1.29 -0.11 0.00 -1.46 0.00 0.00 42.92 40.27 1n80 s ASP 149 CO 0.18 0.06 1.49 0.50 0.52 0.00 0.00 175.17 177.92 1n80 h LYS 150 N 7.32 -0.49 -0.73 4.34 3.64 -1.87 0.62 116.57 129.39 1n80 h LYS 150 Ca -0.31 0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.20 1n80 h LYS 150 Cb 1.19 0.11 -0.08 0.00 -0.41 0.00 0.00 32.23 33.04 1n80 h LYS 150 CO 0.52 -0.33 0.36 -0.44 -2.27 0.00 0.00 179.45 177.30 1n80 h ASP 151 N -0.51 0.46 0.31 4.20 3.32 -1.97 0.32 116.42 122.55 1n80 h ASP 151 Ca 0.03 0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 1n80 h ASP 151 Cb 0.60 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1n80 h ASP 151 CO -0.40 0.25 -0.15 -0.08 -1.72 0.00 0.00 179.24 177.14 1n80 h GLU 152 N 0.60 -0.40 -0.08 3.56 4.81 -1.86 0.29 114.58 121.51 1n80 h GLU 152 Ca 0.37 0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.63 1n80 h GLU 152 Cb 0.41 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.86 1n80 h GLU 152 CO -0.29 -0.20 -0.15 0.00 -0.73 0.00 0.00 179.01 177.64 1n80 h LEU 154 N -0.13 0.34 -0.89 0.00 4.07 -0.35 -0.31 115.31 118.04 1n80 h LEU 154 Ca 0.01 0.02 -0.11 0.00 0.08 0.00 0.00 57.88 57.89 1n80 h LEU 154 Cb 0.17 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 41.85 1n80 h LEU 154 CO -0.14 0.17 -0.36 0.50 -1.08 0.00 0.00 178.44 177.53 1n80 h LYS 155 N 0.36 0.38 0.00 1.13 1.63 0.55 -2.44 116.57 118.19 1n80 h LYS 155 Ca 0.37 -0.17 0.00 0.00 -0.85 0.00 0.00 60.65 60.00 1n80 h LYS 155 Cb 0.92 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.54 1n80 h LYS 155 CO -0.11 0.69 -0.19 1.28 -3.45 0.00 0.00 179.45 177.67 1n80 n LEU 156 N -4.06 0.59 0.00 5.20 4.77 -0.20 -4.92 117.00 118.38 1n80 n LEU 156 Ca -0.01 0.43 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 1n80 n LEU 156 Cb 0.46 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1n80 n LEU 156 CO 0.42 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1n80 n GLY 157 N 1.37 1.07 3.86 -0.72 0.00 -0.64 -5.10 105.19 105.04 1n80 n GLY 157 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 1n80 n GLY 157 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n80 s GLY 158 N -2.00 1.86 -0.36 -0.02 0.00 -0.29 -4.96 107.32 101.56 1n80 s GLY 158 Ca 0.00 -0.02 -0.17 0.00 0.00 0.00 0.00 44.72 44.53 1n80 s GLY 158 CO 0.00 0.24 0.46 1.25 0.00 0.00 0.00 173.10 175.05 1n80 s LYS 159 N -4.48 3.51 -0.08 2.90 2.47 -1.26 -4.03 119.74 118.78 1n80 s LYS 159 Ca 0.56 -0.33 -0.22 0.00 -1.56 0.00 0.00 55.97 54.42 1n80 s LYS 159 Cb -0.10 -3.84 -0.04 0.00 -1.46 0.00 0.00 37.83 32.39 1n80 s LYS 159 CO 0.40 -0.66 0.64 -0.46 0.16 0.00 0.00 175.35 175.44 1n80 s TRP 160 N 2.27 3.57 -0.26 4.03 -0.11 -1.26 -0.85 118.94 126.32 1n80 s TRP 160 Ca 0.16 1.16 0.03 0.00 1.22 0.00 0.00 56.10 58.67 1n80 s TRP 160 Cb -0.16 -2.74 0.06 0.00 -1.50 0.00 0.00 33.47 29.14 1n80 s TRP 160 CO 0.13 0.12 -0.10 -0.08 -4.62 0.00 0.00 176.95 172.40 1n80 s THR 161 N 0.71 2.10 0.67 5.86 -1.32 -0.12 -4.62 115.64 118.92 1n80 s THR 161 Ca 0.34 -1.62 -0.17 0.00 -1.21 0.00 0.00 61.69 59.04 1n80 s THR 161 Cb -0.17 -2.24 0.01 0.00 -1.51 0.00 0.00 72.50 68.59 1n80 s THR 161 CO 0.16 -0.06 1.26 -2.16 -2.21 0.00 0.00 174.62 171.61 1n80 s PRO 162 N 1.13 2.41 0.01 7.08 0.04 -1.26 -1.49 135.00 142.92 1n80 s PRO 162 Ca -0.08 1.96 0.22 0.00 0.04 0.00 0.00 61.00 63.15 1n80 s PRO 162 Cb -0.20 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 1n80 s PRO 162 CO -0.05 -1.68 0.98 -1.13 0.04 0.00 0.00 177.00 175.16 1n80 n SER 163 N -2.17 0.69 -4.54 6.66 3.41 0.81 -4.82 113.62 113.66 1n80 n SER 163 Ca 0.15 -0.52 -0.41 0.00 -0.26 0.00 0.00 58.87 57.82 1n80 n SER 163 Cb 0.49 0.92 -0.09 0.00 -0.26 0.00 0.00 64.21 65.27 1n80 n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n80 s ALA 164 N -3.12 3.49 0.63 7.33 0.00 -1.26 -5.05 121.76 123.78 1n80 s ALA 164 Ca 0.05 -1.20 -0.17 0.00 0.00 0.00 0.00 51.96 50.65 1n80 s ALA 164 Cb 0.15 -2.88 -0.01 0.00 0.00 0.00 0.00 23.12 20.38 1n80 s ALA 164 CO 0.83 -1.15 1.15 -0.98 0.00 0.00 0.00 175.76 175.61 1n80 s ARG 165 N 2.10 2.85 0.16 0.00 1.70 -1.26 -4.82 118.95 119.68 1n80 s ARG 165 Ca 0.13 1.58 -0.31 0.00 -0.47 0.00 0.00 55.73 56.67 1n80 s ARG 165 Cb -0.16 -1.94 -0.08 0.00 -0.57 0.00 0.00 34.95 32.19 1n80 s ARG 165 CO 0.12 -1.24 1.35 0.45 -1.08 0.00 0.00 175.30 174.90 1n80 s SER 166 N -2.11 6.86 -0.16 -2.89 0.15 0.26 -4.94 113.70 110.86 1n80 s SER 166 Ca 0.71 2.37 -0.17 0.00 0.70 0.00 0.00 55.95 59.57 1n80 s SER 166 Cb -0.25 -2.60 -0.14 0.00 -1.71 0.00 0.00 66.02 61.33 1n80 s SER 166 CO 0.37 -0.59 0.21 0.24 1.20 0.00 0.00 173.24 174.67 1n80 h MET 167 N 6.04 0.00 -6.33 5.44 0.00 -1.89 -3.46 114.93 114.73 1n80 h MET 167 Ca -0.43 0.00 -0.60 0.00 0.00 0.00 0.00 59.70 58.66 1n80 h MET 167 Cb 1.21 0.00 -0.23 0.00 0.00 0.00 0.00 31.60 32.58 1n80 h MET 167 CO 0.82 0.61 -0.84 0.99 0.00 0.00 0.00 176.91 178.48 1n80 s THR 168 N -2.18 1.84 0.31 2.22 2.01 -1.26 -5.13 115.64 113.46 1n80 s THR 168 Ca -0.19 -1.48 -0.28 0.00 0.31 0.00 0.00 61.69 60.05 1n80 s THR 168 Cb 0.02 -1.63 -0.09 0.00 0.01 0.00 0.00 72.50 70.80 1n80 s THR 168 CO 0.43 0.08 1.11 -2.16 -0.69 0.00 0.00 174.62 173.39 1n80 s PRO 169 N -1.68 4.49 0.86 4.92 0.04 -1.26 -4.99 135.00 137.38 1n80 s PRO 169 Ca 0.09 1.79 -0.12 0.00 0.04 0.00 0.00 61.00 62.79 1n80 s PRO 169 Cb -0.10 -3.03 0.09 0.00 0.04 0.00 0.00 34.50 31.50 1n80 s PRO 169 CO 0.04 0.08 1.01 -0.35 0.04 0.00 0.00 177.00 177.82 1n80 n PRO 170 N 0.86 -0.10 -3.59 0.56 -0.04 -1.26 -5.02 135.00 126.41 1n80 n PRO 170 Ca 0.00 0.04 -0.13 0.00 -0.04 0.00 0.00 63.50 63.38 1n80 n PRO 170 Cb 0.45 -2.29 -0.05 0.00 -0.04 0.00 0.00 33.50 31.58 1n80 n PRO 170 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1n80 s GLU 171 N -4.11 1.03 0.62 0.54 -1.05 -1.26 -4.98 118.70 109.48 1n80 s GLU 171 Ca 0.68 -0.33 0.00 0.00 -0.15 0.00 0.00 54.97 55.17 1n80 s GLU 171 Cb -0.26 0.46 0.00 0.00 -0.44 0.00 0.00 34.13 33.89 1n80 s GLU 171 CO 0.56 -0.37 0.00 0.41 0.95 0.00 0.00 175.26 176.81 1n80 n GLY 172 N 0.32 -2.18 0.97 -3.83 0.00 -1.26 -4.47 105.19 94.73 1n80 n GLY 172 Ca -0.18 -1.49 0.09 0.00 0.00 0.00 0.00 46.02 44.44 1n80 n GLY 172 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n80 n ARG 173 N -0.35 2.67 0.00 1.61 1.74 -1.26 -4.85 116.66 116.22 1n80 n ARG 173 Ca 0.00 -2.28 0.00 0.00 -0.77 0.00 0.00 57.85 54.80 1n80 n ARG 173 Cb 0.00 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.03 1n80 n ARG 173 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1n80 n GLY 174 N 1.07 0.89 3.36 -0.13 0.00 -1.26 -4.25 105.19 104.87 1n80 n GLY 174 Ca 0.17 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 45.11 1n80 n GLY 174 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1n80 s ASP 175 N -4.00 -0.79 0.38 1.61 1.11 0.14 -4.62 116.67 110.50 1n80 s ASP 175 Ca 0.00 0.73 0.27 0.00 0.18 0.00 0.00 52.55 53.72 1n80 s ASP 175 Cb 0.00 -1.00 1.32 0.00 1.07 0.00 0.00 42.92 44.31 1n80 s ASP 175 CO 0.00 -5.18 1.81 0.00 1.18 0.00 0.00 175.17 172.98 1n80 h ALA 176 N -3.30 1.00 -0.01 5.23 0.00 -1.90 0.69 119.26 120.97 1n80 h ALA 176 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1n80 h ALA 176 Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 1n80 h ALA 176 CO 0.27 0.00 -0.32 -0.85 0.00 0.00 0.00 179.25 178.35 1n80 n GLU 177 N -2.45 1.56 -0.65 0.00 0.28 -1.26 -4.83 120.64 113.29 1n80 n GLU 177 Ca -0.00 -0.99 0.00 0.00 -0.16 0.00 0.00 57.16 56.01 1n80 n GLU 177 Cb 0.12 -1.34 0.00 0.00 1.43 0.00 0.00 31.44 31.65 1n80 n GLU 177 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1n80 n GLY 178 N 1.21 0.71 3.76 -1.84 0.00 0.24 -4.90 105.19 104.37 1n80 n GLY 178 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1n80 n GLY 178 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n80 s THR 179 N -2.30 3.50 -0.04 2.61 2.01 -1.26 -1.85 115.64 118.31 1n80 s THR 179 Ca 0.00 1.48 0.01 0.00 0.31 0.00 0.00 61.69 63.49 1n80 s THR 179 Cb 0.00 -3.94 0.02 0.00 0.01 0.00 0.00 72.50 68.59 1n80 s THR 179 CO 0.00 0.34 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.59 1n80 s ILE 180 N -1.06 0.58 -0.49 1.82 1.01 0.15 0.27 121.20 123.49 1n80 s ILE 180 Ca 0.45 -0.17 0.04 0.00 0.00 0.00 0.00 60.65 60.97 1n80 s ILE 180 Cb -0.32 -0.58 0.13 0.00 0.01 0.00 0.00 42.46 41.69 1n80 s ILE 180 CO 0.41 0.23 0.23 -1.61 0.00 0.00 0.00 174.94 174.19 1n80 s GLU 181 N 0.76 1.83 0.59 2.79 2.02 -1.26 -0.70 118.70 124.73 1n80 s GLU 181 Ca -0.11 -2.45 0.30 0.00 0.02 0.00 0.00 54.97 52.74 1n80 s GLU 181 Cb -0.13 -3.18 1.82 0.00 0.10 0.00 0.00 34.13 32.74 1n80 s GLU 181 CO 0.01 -1.09 2.24 -1.35 0.02 0.00 0.00 175.26 175.08 1n80 h PRO 182 N 6.68 0.00 0.00 0.39 0.11 -1.96 -3.46 132.00 133.76 1n80 h PRO 182 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 1n80 h PRO 182 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1n80 h PRO 182 CO 0.64 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.84 1n80 n GLY 183 N -1.32 2.77 0.14 -0.55 0.00 -1.26 -4.88 105.19 100.09 1n80 n GLY 183 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1n80 n GLY 183 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1n80 n ASP 184 N 0.00 0.20 0.00 1.61 5.68 -1.26 -4.74 116.55 118.04 1n80 n ASP 184 Ca 0.00 -1.46 0.00 0.00 -0.50 0.00 0.00 54.79 52.83 1n80 n ASP 184 Cb 0.00 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 39.88 1n80 n ASP 184 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1n80 n GLY 185 N 0.20 0.64 3.94 6.12 0.00 -1.26 -4.85 105.19 109.98 1n80 n GLY 185 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1n80 n GLY 185 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1n80 s TYR 186 N -2.29 3.48 -0.02 1.61 1.51 -1.26 -2.93 117.35 117.44 1n80 s TYR 186 Ca 0.00 0.22 0.01 0.00 -1.01 0.00 0.00 57.07 56.29 1n80 s TYR 186 Cb 0.00 -1.77 0.02 0.00 -0.11 0.00 0.00 41.96 40.10 1n80 s TYR 186 CO 0.00 0.36 -0.02 0.08 -1.11 0.00 0.00 175.55 174.86 1n80 s VAL 187 N -1.97 0.28 0.18 0.71 1.01 -0.60 -3.91 120.40 116.10 1n80 s VAL 187 Ca 0.37 -0.03 0.08 0.00 0.00 0.00 0.00 61.98 62.39 1n80 s VAL 187 Cb -0.10 -0.31 -0.04 0.00 0.00 0.00 0.00 36.38 35.92 1n80 s VAL 187 CO 0.30 0.14 -0.15 0.26 0.00 0.00 0.00 175.10 175.65 1n80 s TRP 188 N 0.61 1.68 -0.15 5.22 0.52 0.12 -0.25 118.94 126.70 1n80 s TRP 188 Ca -0.06 -0.55 0.00 0.00 0.02 0.00 0.00 56.10 55.51 1n80 s TRP 188 Cb -0.10 -0.81 0.02 0.00 -1.15 0.00 0.00 33.47 31.44 1n80 s TRP 188 CO -0.01 0.31 -0.13 -2.00 0.02 0.00 0.00 176.95 175.15 1n80 s GLU 189 N -3.30 2.15 0.30 4.98 2.12 -0.18 0.33 118.70 125.10 1n80 s GLU 189 Ca 0.19 -0.54 -0.29 0.00 0.36 0.00 0.00 54.97 54.69 1n80 s GLU 189 Cb -0.02 -2.06 -0.10 0.00 0.26 0.00 0.00 34.13 32.21 1n80 s GLU 189 CO 0.06 -0.26 1.37 -0.47 -0.54 0.00 0.00 175.26 175.42 1n80 s TYR 190 N 1.51 2.99 0.01 5.30 5.04 -0.77 -1.36 117.35 130.08 1n80 s TYR 190 Ca 0.04 1.25 -0.05 0.00 -2.44 0.00 0.00 57.07 55.88 1n80 s TYR 190 Cb -0.13 -3.76 -0.02 0.00 0.35 0.00 0.00 41.96 38.40 1n80 s TYR 190 CO -0.10 -2.25 -0.10 1.28 -1.34 0.00 0.00 175.55 173.05 1n80 n LEU 191 N 1.32 1.21 0.00 6.97 4.77 -0.62 -4.89 117.00 125.77 1n80 n LEU 191 Ca 0.02 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 1n80 n LEU 191 Cb 0.41 -0.41 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 1n80 n LEU 191 CO 0.60 -0.50 0.99 2.22 -1.33 0.00 0.00 177.39 179.37 1n80 n PHE 192 N -3.69 -0.78 -4.34 -1.77 1.16 -1.20 -4.95 117.46 101.88 1n80 n PHE 192 Ca -0.06 -0.95 -0.26 0.00 -1.87 0.00 0.00 57.45 54.32 1n80 n PHE 192 Cb 0.22 0.45 -0.12 0.00 -1.61 0.00 0.00 39.48 38.41 1n80 n PHE 192 CO 0.00 0.00 0.00 -2.00 -1.87 0.00 0.00 176.76 172.89 1n80 s GLU 193 N -2.03 1.29 -0.29 3.97 2.12 -0.21 -1.47 118.70 122.09 1n80 s GLU 193 Ca 0.27 -1.31 -0.02 0.00 0.36 0.00 0.00 54.97 54.27 1n80 s GLU 193 Cb -0.02 -1.60 0.04 0.00 0.26 0.00 0.00 34.13 32.82 1n80 s GLU 193 CO 0.02 0.36 -0.00 0.42 -0.54 0.00 0.00 175.26 175.52 1n80 s ILE 194 N -1.34 3.09 0.67 -3.70 1.01 -0.15 -4.52 121.20 116.24 1n80 s ILE 194 Ca 0.12 -1.22 -0.17 0.00 0.00 0.00 0.00 60.65 59.38 1n80 s ILE 194 Cb -0.09 -2.70 0.00 0.00 0.01 0.00 0.00 42.46 39.68 1n80 s ILE 194 CO 0.06 -0.02 1.25 -2.16 0.00 0.00 0.00 174.94 174.07 1n80 s PRO 195 N 1.30 2.47 0.27 2.79 0.04 -1.26 -2.53 135.00 138.08 1n80 s PRO 195 Ca -0.03 1.92 -0.01 0.00 0.04 0.00 0.00 61.00 62.92 1n80 s PRO 195 Cb -0.19 -1.85 0.47 0.00 0.04 0.00 0.00 34.50 32.97 1n80 s PRO 195 CO -0.01 -1.62 1.84 -1.35 0.04 0.00 0.00 177.00 175.90 1n80 h PRO 196 N 0.31 0.97 -0.06 0.56 0.11 -1.97 -0.49 132.00 131.43 1n80 h PRO 196 Ca -0.50 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 65.57 1n80 h PRO 196 Cb 1.32 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 1n80 h PRO 196 CO 0.52 0.64 0.05 0.38 -0.21 0.00 0.00 178.00 179.39 1n80 h ASP 197 N 1.00 0.00 0.00 -2.05 3.04 -1.99 0.12 116.42 116.54 1n80 h ASP 197 Ca 0.45 0.00 -0.17 0.00 -3.24 0.00 0.00 57.03 54.07 1n80 h ASP 197 Cb 0.36 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.62 1n80 h ASP 197 CO -0.23 0.00 -1.00 0.58 -2.04 0.00 0.00 179.24 176.55 1n80 h VAL 198 N 0.00 0.89 -0.87 4.15 2.07 -1.51 -3.17 116.25 117.81 1n80 h VAL 198 Ca 0.03 -2.03 0.06 0.00 0.82 0.00 0.00 66.70 65.57 1n80 h VAL 198 Cb 0.13 2.04 -0.06 0.00 -1.52 0.00 0.00 31.29 31.88 1n80 h VAL 198 CO -0.00 0.30 0.55 0.77 0.02 0.00 0.00 177.57 179.21 1n80 h SER 199 N -1.00 0.87 -0.52 0.57 4.64 -1.01 0.41 113.55 117.50 1n80 h SER 199 Ca -0.26 0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 60.95 1n80 h SER 199 Cb 1.15 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 63.05 1n80 h SER 199 CO -0.16 0.56 -0.14 0.40 -0.87 0.00 0.00 176.83 176.62 1n80 h ILE 200 N 1.00 1.27 0.00 0.95 2.04 -0.94 -3.25 117.51 118.57 1n80 h ILE 200 Ca 0.38 -1.31 -0.00 0.00 1.00 0.00 0.00 64.86 64.93 1n80 h ILE 200 Cb 0.15 1.02 -0.00 0.00 -0.74 0.00 0.00 36.82 37.25 1n80 h ILE 200 CO -0.17 0.46 -1.47 0.59 0.00 0.00 0.00 178.15 177.56 1n80 n ASN 201 N -4.14 2.67 -0.08 1.72 3.02 -1.09 -4.79 115.26 112.57 1n80 n ASN 201 Ca 0.01 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.46 1n80 n ASN 201 Cb 0.42 1.45 -0.10 0.00 -0.61 0.00 0.00 39.78 40.94 1n80 n ASN 201 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1n80 n ARG 202 N -1.87 1.00 -2.33 3.52 5.12 0.14 -5.00 116.66 117.24 1n80 n ARG 202 Ca -0.02 0.05 -0.32 0.00 -1.93 0.00 0.00 57.85 55.63 1n80 n ARG 202 Cb 0.28 -1.38 -0.03 0.00 -1.16 0.00 0.00 32.46 30.17 1n80 n ARG 202 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1n80 n THR 204 N -1.73 0.00 -0.07 0.00 -2.24 0.00 -4.85 114.28 105.39 1n80 n THR 204 Ca 0.06 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.77 1n80 n THR 204 Cb 0.54 0.00 0.09 0.00 -2.10 0.00 0.00 70.33 68.86 1n80 n THR 204 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1n80 h ASN 205 N 0.00 0.76 0.64 3.42 7.08 -1.99 -3.25 115.58 122.23 1n80 h ASN 205 Ca 0.00 -0.29 0.00 0.00 -3.08 0.00 0.00 56.30 52.93 1n80 h ASN 205 Cb 0.00 -0.21 0.00 0.00 -2.08 0.00 0.00 38.32 36.03 1n80 h ASN 205 CO 0.00 0.98 -1.26 -0.62 -2.08 0.00 0.00 177.43 174.45 1n80 n GLU 206 N -4.10 0.56 -4.07 4.14 1.02 -1.26 -4.76 120.64 112.18 1n80 n GLU 206 Ca -0.00 0.02 -0.12 0.00 -0.02 0.00 0.00 57.16 57.04 1n80 n GLU 206 Cb 0.45 -1.71 -0.11 0.00 -0.02 0.00 0.00 31.44 30.06 1n80 n GLU 206 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1n80 s TYR 207 N -3.38 0.65 0.18 -0.32 1.51 -1.23 -0.65 117.35 114.11 1n80 s TYR 207 Ca -0.02 -0.60 0.10 0.00 -1.01 0.00 0.00 57.07 55.54 1n80 s TYR 207 Cb 0.12 -0.39 -0.04 0.00 -0.11 0.00 0.00 41.96 41.53 1n80 s TYR 207 CO 0.82 -0.12 -0.21 0.96 -1.11 0.00 0.00 175.55 175.89 1n80 s ILE 208 N -1.91 2.06 0.24 2.71 -4.36 -0.96 -0.82 121.20 118.17 1n80 s ILE 208 Ca -0.06 -1.96 -0.14 0.00 -0.26 0.00 0.00 60.65 58.22 1n80 s ILE 208 Cb -0.06 -1.96 -0.08 0.00 1.25 0.00 0.00 42.46 41.60 1n80 s ILE 208 CO -0.01 -0.22 0.65 -0.69 0.24 0.00 0.00 174.94 174.90 1n80 s VAL 209 N -1.85 4.76 -0.15 8.37 1.01 -1.26 -2.03 120.40 129.25 1n80 s VAL 209 Ca 0.18 0.86 -0.01 0.00 0.00 0.00 0.00 61.98 63.01 1n80 s VAL 209 Cb -0.07 -3.69 0.04 0.00 0.00 0.00 0.00 36.38 32.66 1n80 s VAL 209 CO 0.08 0.01 -0.04 -0.69 0.00 0.00 0.00 175.10 174.46 1n80 s VAL 210 N -1.74 0.94 0.41 2.92 1.01 -0.56 -4.94 120.40 118.45 1n80 s VAL 210 Ca 0.47 -0.47 -0.24 0.00 0.00 0.00 0.00 61.98 61.74 1n80 s VAL 210 Cb -0.13 -1.12 -0.11 0.00 0.00 0.00 0.00 36.38 35.02 1n80 s VAL 210 CO 0.19 0.16 0.91 -0.81 0.00 0.00 0.00 175.10 175.55 1n80 n PRO 211 N 4.94 1.17 -1.66 2.72 -0.04 -1.26 -4.16 135.00 136.71 1n80 n PRO 211 Ca -0.11 0.42 -0.32 0.00 -0.04 0.00 0.00 63.50 63.45 1n80 n PRO 211 Cb 0.48 -1.91 0.05 0.00 -0.04 0.00 0.00 33.50 32.08 1n80 n PRO 211 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1n80 s TRP 212 N -1.30 2.80 0.28 0.54 0.52 -1.26 -4.56 118.94 115.95 1n80 s TRP 212 Ca 0.63 1.52 -0.00 0.00 0.02 0.00 0.00 56.10 58.27 1n80 s TRP 212 Cb -0.58 -3.04 0.50 0.00 -1.15 0.00 0.00 33.47 29.20 1n80 s TRP 212 CO 0.57 -1.48 1.85 -1.35 0.02 0.00 0.00 176.95 176.56 1n80 h PRO 213 N -0.33 1.03 -0.05 4.98 0.11 -1.94 -2.41 132.00 133.38 1n80 h PRO 213 Ca -0.45 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 1n80 h PRO 213 Cb 1.23 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 1n80 h PRO 213 CO 0.55 0.68 -0.01 1.49 -0.21 0.00 0.00 178.00 180.49 1n80 h GLU 214 N 1.06 0.10 0.00 1.05 4.57 -1.92 -0.32 114.58 119.12 1n80 h GLU 214 Ca 0.47 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.59 1n80 h GLU 214 Cb 0.38 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1n80 h GLU 214 CO -0.23 0.44 -0.10 1.05 -1.18 0.00 0.00 179.01 178.99 1n80 h GLU 215 N -0.24 0.00 0.11 1.92 4.11 -1.94 -1.00 114.58 117.54 1n80 h GLU 215 Ca 0.01 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.44 1n80 h GLU 215 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1n80 h GLU 215 CO 0.01 0.10 -0.05 1.25 0.07 0.00 0.00 179.01 180.38 1n80 h LEU 216 N 0.00 -0.12 -2.25 3.06 5.85 -1.20 -1.92 115.31 118.74 1n80 h LEU 216 Ca -0.00 -0.46 0.01 0.00 0.84 0.00 0.00 57.88 58.27 1n80 h LEU 216 Cb 0.45 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 1n80 h LEU 216 CO 0.01 0.49 0.02 0.50 -0.34 0.00 0.00 178.44 179.12 1n80 h LYS 217 N -0.83 0.00 0.06 1.25 3.64 -0.87 -2.02 116.57 117.80 1n80 h LYS 217 Ca -0.01 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 59.11 1n80 h LYS 217 Cb 0.57 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.40 1n80 h LYS 217 CO 0.02 0.00 -1.09 1.49 -2.27 0.00 0.00 179.45 177.60 1n80 h GLU 218 N 0.00 0.45 -1.79 1.90 4.57 -1.13 -3.40 114.58 115.17 1n80 h GLU 218 Ca 0.01 -0.56 -0.51 0.00 -1.18 0.00 0.00 59.36 57.12 1n80 h GLU 218 Cb 0.05 0.18 -0.35 0.00 -0.16 0.00 0.00 28.75 28.47 1n80 h GLU 218 CO -0.00 1.21 -0.97 -3.47 -1.18 0.00 0.00 179.01 174.60 1n80 n ASP 219 N -3.72 -0.55 -0.24 1.04 -0.08 -0.73 -4.97 116.55 107.31 1n80 n ASP 219 Ca -0.09 -2.70 0.06 0.00 -1.51 0.00 0.00 54.79 50.55 1n80 n ASP 219 Cb 0.92 -0.20 0.31 0.00 2.34 0.00 0.00 41.12 44.49 1n80 n ASP 219 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1n80 h PRO 220 N 4.44 0.84 -0.31 -0.67 0.11 -1.61 -2.23 132.00 132.57 1n80 h PRO 220 Ca 0.09 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.08 1n80 h PRO 220 Cb 0.92 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.82 1n80 h PRO 220 CO 0.40 0.56 -0.12 0.00 -0.21 0.00 0.00 178.00 178.62 1n80 h THR 221 N 0.87 1.23 -0.84 -1.15 1.03 -1.89 0.86 112.91 113.02 1n80 h THR 221 Ca 0.35 -1.04 0.09 0.00 -0.01 0.00 0.00 66.41 65.80 1n80 h THR 221 Cb 0.25 1.14 -0.06 0.00 -1.07 0.00 0.00 68.15 68.41 1n80 h THR 221 CO -0.13 0.34 0.55 -0.09 -0.01 0.00 0.00 175.52 176.18 1n80 h ARG 222 N 0.48 0.82 -0.58 0.00 2.43 -1.79 -0.74 114.38 115.01 1n80 h ARG 222 Ca 0.09 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.11 1n80 h ARG 222 Cb 0.50 -0.18 -0.06 0.00 -0.42 0.00 0.00 29.97 29.81 1n80 h ARG 222 CO 0.03 0.54 0.11 0.91 -1.51 0.00 0.00 179.97 180.05 1n80 n TRP 223 N -4.51 2.00 -3.96 2.20 7.02 -1.05 -4.34 117.44 114.80 1n80 n TRP 223 Ca 0.14 -0.99 -0.28 0.00 -1.02 0.00 0.00 57.50 55.35 1n80 n TRP 223 Cb 0.28 -0.55 -0.00 0.00 -2.42 0.00 0.00 31.31 28.62 1n80 n TRP 223 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1n80 n GLY 224 N 0.03 -0.33 0.25 6.99 0.00 -0.28 -1.04 105.19 110.81 1n80 n GLY 224 Ca 0.32 0.15 0.04 0.00 0.00 0.00 0.00 46.02 46.53 1n80 n GLY 224 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1n80 n TYR 225 N -4.43 0.00 -0.03 1.61 4.19 0.30 -4.47 117.16 114.32 1n80 n TYR 225 Ca -0.16 0.00 0.24 0.00 3.31 0.00 0.00 57.90 61.29 1n80 n TYR 225 Cb 0.61 0.00 0.71 0.00 0.49 0.00 0.00 39.34 41.15 1n80 n TYR 225 CO 0.00 0.00 0.00 1.05 0.91 0.00 0.00 176.86 178.82 1n80 h GLU 226 N 1.21 0.00 0.00 2.98 9.09 -1.86 -1.43 114.58 124.56 1n80 h GLU 226 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1n80 h GLU 226 Cb 0.29 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.39 1n80 h GLU 226 CO 0.00 0.00 -0.70 -0.25 0.05 0.00 0.00 179.01 178.11 1n80 n ASP 227 N -3.80 0.66 -4.64 3.06 10.43 -1.26 -4.96 116.55 116.03 1n80 n ASP 227 Ca 0.13 0.02 -0.40 0.00 2.57 0.00 0.00 54.79 57.10 1n80 n ASP 227 Cb 0.85 0.31 0.02 0.00 1.84 0.00 0.00 41.12 44.14 1n80 n ASP 227 CO 0.00 0.00 0.00 -3.20 -1.07 0.00 0.00 177.20 172.93 1n80 n ASN 228 N -2.02 1.54 -0.01 -2.24 5.15 -0.54 -4.93 115.26 112.20 1n80 n ASN 228 Ca 0.03 1.00 -0.01 0.00 -0.60 0.00 0.00 54.58 55.00 1n80 n ASN 228 Cb 0.43 -1.41 -0.02 0.00 -0.53 0.00 0.00 39.78 38.25 1n80 n ASN 228 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1n80 n LEU 229 N 0.10 0.00 0.13 1.20 7.99 -1.26 -4.68 117.00 120.47 1n80 n LEU 229 Ca 0.10 0.00 0.05 0.00 -0.01 0.00 0.00 56.01 56.15 1n80 n LEU 229 Cb 0.41 0.06 0.27 0.00 -0.11 0.00 0.00 43.42 44.05 1n80 n LEU 229 CO 0.56 0.06 0.73 0.35 -1.51 0.00 0.00 177.39 177.58 1n80 n THR 230 N -2.07 0.72 0.23 -5.08 -2.24 -1.26 -1.09 114.28 103.49 1n80 n THR 230 Ca -0.04 0.69 0.09 0.00 -2.27 0.00 0.00 64.05 62.52 1n80 n THR 230 Cb 0.56 -1.69 0.46 0.00 -2.10 0.00 0.00 70.33 67.56 1n80 n THR 230 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 1n80 n TRP 231 N -1.88 0.60 1.33 4.78 4.27 -1.26 -1.20 117.44 124.08 1n80 n TRP 231 Ca -0.01 0.29 0.12 0.00 -3.89 0.00 0.00 57.50 54.01 1n80 n TRP 231 Cb 0.30 -0.96 0.67 0.00 -1.36 0.00 0.00 31.31 29.97 1n80 n TRP 231 CO 0.00 0.00 0.00 1.04 -2.29 0.00 0.00 177.69 176.44 1n80 n GLN 232 N -2.09 0.53 0.00 -2.67 6.02 -0.25 -2.91 117.38 116.00 1n80 n GLN 232 Ca 0.00 0.03 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 1n80 n GLN 232 Cb 0.09 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.85 1n80 n GLN 232 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1n80 n GLN 233 N -1.17 0.00 -0.45 -1.09 10.64 -0.57 -4.87 117.38 119.87 1n80 n GLN 233 Ca 0.15 0.00 0.05 0.00 -1.83 0.00 0.00 57.00 55.37 1n80 n GLN 233 Cb 0.15 -0.18 0.24 0.00 -0.86 0.00 0.00 30.24 29.59 1n80 n GLN 233 CO 0.00 0.00 0.00 -0.40 -1.83 0.00 0.00 177.06 174.83 1n80 n ASP 234 N -2.28 3.44 -3.92 2.61 3.85 -0.34 -4.96 116.55 114.95 1n80 n ASP 234 Ca 0.00 -2.38 -0.28 0.00 -0.71 0.00 0.00 54.79 51.42 1n80 n ASP 234 Cb 0.04 -0.51 0.01 0.00 -1.35 0.00 0.00 41.12 39.31 1n80 n ASP 234 CO 0.00 0.00 0.00 -0.67 -1.01 0.00 0.00 177.20 175.52 1n80 n ASP 235 N 0.54 -2.43 -2.82 -1.12 2.03 -1.15 0.92 116.55 112.52 1n80 n ASP 235 Ca 0.17 -0.77 -0.20 0.00 0.52 0.00 0.00 54.79 54.51 1n80 n ASP 235 Cb 0.69 -0.93 0.01 0.00 -0.72 0.00 0.00 41.12 40.16 1n80 n ASP 235 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1n80 n PHE 236 N -3.34 -1.60 -1.34 -0.67 3.72 -1.26 -4.85 117.46 108.13 1n80 n PHE 236 Ca -0.07 0.27 -0.22 0.00 -0.05 0.00 0.00 57.45 57.38 1n80 n PHE 236 Cb 0.33 -3.63 -0.09 0.00 -0.94 0.00 0.00 39.48 35.16 1n80 n PHE 236 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1n80 n GLY 237 N -1.17 3.94 0.36 1.37 0.00 0.26 -4.36 105.19 105.59 1n80 n GLY 237 Ca -0.13 -1.67 0.14 0.00 0.00 0.00 0.00 46.02 44.36 1n80 n GLY 237 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1n80 h LEU 238 N 4.22 0.75 -1.32 0.99 5.85 -1.88 -0.65 115.31 123.28 1n80 h LEU 238 Ca 0.33 0.09 0.10 0.00 0.84 0.00 0.00 57.88 59.24 1n80 h LEU 238 Cb 0.96 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.89 1n80 h LEU 238 CO 0.68 0.26 0.53 0.16 -0.34 0.00 0.00 178.44 179.73 1n80 h ILE 239 N 0.73 0.94 -0.13 4.05 3.07 -1.83 -1.80 117.51 122.54 1n80 h ILE 239 Ca 0.58 -0.26 -0.19 0.00 1.55 0.00 0.00 64.86 66.54 1n80 h ILE 239 Cb 0.95 0.12 0.01 0.00 -0.27 0.00 0.00 36.82 37.63 1n80 h ILE 239 CO -0.37 0.14 -0.64 1.88 -1.05 0.00 0.00 178.15 178.11 1n80 h TYR 240 N 0.76 0.90 -0.71 0.16 -1.99 -1.45 -1.23 116.97 113.40 1n80 h TYR 240 Ca 0.38 -0.40 0.18 0.00 2.00 0.00 0.00 58.73 60.90 1n80 h TYR 240 Cb 0.46 -0.14 -0.04 0.00 2.00 0.00 0.00 36.73 39.01 1n80 h TYR 240 CO -0.00 1.20 0.50 0.00 -0.00 0.00 0.00 178.16 179.86 1n80 h ARG 241 N 0.35 0.14 -0.34 4.88 3.08 -0.95 -1.79 114.38 119.73 1n80 h ARG 241 Ca -0.04 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1n80 h ARG 241 Cb 1.28 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.30 1n80 h ARG 241 CO 0.13 0.09 0.00 1.33 -1.07 0.00 0.00 179.97 180.45 1n80 n VAL 242 N -4.39 1.74 -3.84 2.04 0.24 -0.88 -4.98 118.33 108.26 1n80 n VAL 242 Ca 0.14 -1.45 -0.26 0.00 -2.04 0.00 0.00 64.34 60.74 1n80 n VAL 242 Cb 0.69 0.09 0.02 0.00 -1.47 0.00 0.00 33.84 33.16 1n80 n VAL 242 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1n80 n LYS 243 N 0.10 -4.79 -2.61 7.34 5.02 -0.67 -4.92 118.16 117.62 1n80 n LYS 243 Ca 0.18 0.57 -0.42 0.00 -2.02 0.00 0.00 58.31 56.62 1n80 n LYS 243 Cb 0.72 -5.18 -0.03 0.00 -0.02 0.00 0.00 35.03 30.51 1n80 n LYS 243 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n80 s ALA 244 N -3.57 3.25 -0.15 7.82 0.00 -0.49 -4.90 121.76 123.72 1n80 s ALA 244 Ca 0.27 0.66 0.17 0.00 0.00 0.00 0.00 51.96 53.05 1n80 s ALA 244 Cb -0.13 -3.36 0.36 0.00 0.00 0.00 0.00 23.12 19.98 1n80 s ALA 244 CO 0.84 -0.26 1.20 0.27 0.00 0.00 0.00 175.76 177.80 1n80 n ASN 245 N 3.64 0.21 -3.72 0.00 0.23 -1.26 -3.95 115.26 110.41 1n80 n ASN 245 Ca 0.06 -2.05 -0.13 0.00 -0.53 0.00 0.00 54.58 51.92 1n80 n ASN 245 Cb 0.49 -0.01 -0.14 0.00 -2.08 0.00 0.00 39.78 38.04 1n80 n ASN 245 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 1n80 s THR 246 N -1.09 -0.11 -0.00 5.53 2.01 -1.26 -0.33 115.64 120.39 1n80 s THR 246 Ca 0.19 0.20 -0.00 0.00 0.31 0.00 0.00 61.69 62.39 1n80 s THR 246 Cb 0.30 -0.33 -0.04 0.00 0.01 0.00 0.00 72.50 72.44 1n80 s THR 246 CO -0.09 0.08 0.08 -0.63 -0.69 0.00 0.00 174.62 173.38 1n80 s ILE 247 N 1.48 4.73 -0.12 1.82 1.01 -0.10 -1.09 121.20 128.92 1n80 s ILE 247 Ca -0.07 -0.41 0.02 0.00 0.00 0.00 0.00 60.65 60.19 1n80 s ILE 247 Cb -0.11 -3.16 0.01 0.00 0.01 0.00 0.00 42.46 39.21 1n80 s ILE 247 CO -0.07 0.35 -0.18 -0.60 0.00 0.00 0.00 174.94 174.44 1n80 s ARG 248 N -1.73 2.52 0.18 2.79 3.52 -0.15 -1.48 118.95 124.59 1n80 s ARG 248 Ca 0.23 -0.67 -0.20 0.00 -0.13 0.00 0.00 55.73 54.97 1n80 s ARG 248 Cb -0.12 -2.11 -0.08 0.00 -1.56 0.00 0.00 34.95 31.08 1n80 s ARG 248 CO 0.14 -0.06 0.68 -0.06 -0.81 0.00 0.00 175.30 175.19 1n80 s PHE 249 N 0.98 3.70 -0.43 5.12 0.40 -0.19 -1.76 117.98 125.80 1n80 s PHE 249 Ca -0.05 1.36 0.02 0.00 -0.60 0.00 0.00 56.93 57.66 1n80 s PHE 249 Cb -0.15 -2.58 0.15 0.00 0.51 0.00 0.00 43.02 40.95 1n80 s PHE 249 CO -0.03 0.41 0.28 0.21 0.70 0.00 0.00 175.22 176.80 1n80 s LYS 250 N -1.72 1.09 0.39 0.44 2.20 0.09 -3.38 119.74 118.85 1n80 s LYS 250 Ca 0.39 -1.97 0.08 0.00 -0.36 0.00 0.00 55.97 54.11 1n80 s LYS 250 Cb -0.18 -1.90 -0.05 0.00 -1.51 0.00 0.00 37.83 34.19 1n80 s LYS 250 CO 0.21 -1.25 0.13 0.00 -0.36 0.00 0.00 175.35 174.08 1n80 s ALA 251 N 0.30 3.47 0.02 3.13 0.00 -0.49 -4.69 121.76 123.50 1n80 s ALA 251 Ca 0.23 -2.07 0.02 0.00 0.00 0.00 0.00 51.96 50.14 1n80 s ALA 251 Cb -0.14 -0.38 -0.01 0.00 0.00 0.00 0.00 23.12 22.58 1n80 s ALA 251 CO -0.07 -0.09 -0.06 0.71 0.00 0.00 0.00 175.76 176.25 1n80 s TYR 252 N -2.57 0.56 -0.28 0.00 2.02 -1.26 0.03 117.35 115.84 1n80 s TYR 252 Ca 0.39 -0.29 -0.02 0.00 -0.37 0.00 0.00 57.07 56.78 1n80 s TYR 252 Cb 0.03 -0.34 0.04 0.00 -0.40 0.00 0.00 41.96 41.28 1n80 s TYR 252 CO 0.22 -0.05 -0.02 -0.51 -1.57 0.00 0.00 175.55 173.62 1n80 s LEU 253 N -0.84 3.67 -0.36 -1.29 1.43 -0.25 -4.96 118.68 116.08 1n80 s LEU 253 Ca -0.04 -1.12 -0.11 0.00 -1.03 0.00 0.00 54.13 51.83 1n80 s LEU 253 Cb -0.06 -1.70 0.01 0.00 0.03 0.00 0.00 46.19 44.47 1n80 s LEU 253 CO 0.00 -0.21 0.21 -0.62 0.23 0.00 0.00 176.35 175.95 1n80 s ASP 254 N 1.29 5.75 0.54 2.29 3.68 -1.26 -0.85 116.67 128.11 1n80 s ASP 254 Ca -0.03 -0.82 0.22 0.00 2.13 0.00 0.00 52.55 54.04 1n80 s ASP 254 Cb -0.19 -2.04 1.42 0.00 -1.45 0.00 0.00 42.92 40.66 1n80 s ASP 254 CO -0.02 -0.33 2.11 0.77 0.13 0.00 0.00 175.17 177.83 1n80 h SER 255 N 8.44 0.00 -1.16 -0.34 4.64 -1.75 -1.30 113.55 122.08 1n80 h SER 255 Ca -0.28 0.00 0.34 0.00 -0.47 0.00 0.00 61.79 61.38 1n80 h SER 255 Cb 1.12 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.16 1n80 h SER 255 CO 0.66 0.00 0.87 0.58 -0.87 0.00 0.00 176.83 178.07 1n80 h VAL 256 N 0.00 0.36 -0.01 0.95 2.07 -1.80 0.55 116.25 118.38 1n80 h VAL 256 Ca 0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1n80 h VAL 256 Cb 0.34 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1n80 h VAL 256 CO -0.00 0.00 -0.32 -1.22 0.02 0.00 0.00 177.57 176.05 1n80 n TYR 257 N -4.08 0.00 -3.06 1.57 4.01 -0.49 -4.32 117.16 110.79 1n80 n TYR 257 Ca 0.25 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.83 1n80 n TYR 257 Cb 1.25 -0.13 -0.01 0.00 -0.31 0.00 0.00 39.34 40.14 1n80 n TYR 257 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1n80 n PHE 258 N -0.73 0.29 -0.27 -0.72 3.01 0.19 -4.97 117.46 114.26 1n80 n PHE 258 Ca 0.11 -3.54 -0.00 0.00 1.01 0.00 0.00 57.45 55.03 1n80 n PHE 258 Cb 0.36 -0.34 0.12 0.00 -0.01 0.00 0.00 39.48 39.61 1n80 n PHE 258 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1n80 h PRO 259 N 2.99 0.80 0.00 -1.08 0.13 -1.65 -2.02 132.00 131.17 1n80 h PRO 259 Ca 0.05 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1n80 h PRO 259 Cb 1.02 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1n80 h PRO 259 CO 0.49 0.53 0.23 -0.85 -0.23 0.00 0.00 178.00 178.16 1n80 n GLU 260 N -4.71 0.05 0.00 0.86 0.00 -1.26 -0.19 120.64 115.39 1n80 n GLU 260 Ca 0.11 0.46 0.00 0.00 0.00 0.00 0.00 57.16 57.73 1n80 n GLU 260 Cb 0.19 -1.89 0.00 0.00 0.00 0.00 0.00 31.44 29.73 1n80 n GLU 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1n80 n ALA 261 N -1.46 2.18 -1.74 -1.84 0.00 -0.77 -4.65 120.51 112.23 1n80 n ALA 261 Ca -0.01 -0.75 -0.00 0.00 0.00 0.00 0.00 53.44 52.69 1n80 n ALA 261 Cb 0.24 0.00 0.16 0.00 0.00 0.00 0.00 19.45 19.85 1n80 n ALA 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n80 n ALA 262 N -0.25 3.87 -1.77 0.00 0.00 0.73 -4.86 120.51 118.23 1n80 n ALA 262 Ca 0.00 -3.36 -0.37 0.00 0.00 0.00 0.00 53.44 49.71 1n80 n ALA 262 Cb 0.14 -0.37 -0.01 0.00 0.00 0.00 0.00 19.45 19.21 1n80 n ALA 262 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1n80 s LEU 263 N -3.17 4.01 0.00 0.00 1.43 -1.21 -3.36 118.68 116.38 1n80 s LEU 263 Ca 0.40 2.34 0.00 0.00 -1.03 0.00 0.00 54.13 55.84 1n80 s LEU 263 Cb 0.38 -4.23 0.00 0.00 0.03 0.00 0.00 46.19 42.37 1n80 s LEU 263 CO -0.05 -0.94 0.00 -2.65 0.23 0.00 0.00 176.35 172.94 1n80 n PRO 264 N -0.48 0.00 -0.69 1.29 -0.02 -1.26 -0.67 135.00 133.17 1n80 n PRO 264 Ca 0.07 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.61 1n80 n PRO 264 Cb 0.48 0.00 0.17 0.00 -0.02 0.00 0.00 33.50 34.12 1n80 n PRO 264 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n80 n GLY 265 N -0.95 4.31 3.56 -1.23 0.00 -1.26 -5.08 105.19 104.54 1n80 n GLY 265 Ca 0.00 -1.18 -0.34 0.00 0.00 0.00 0.00 46.02 44.50 1n80 n GLY 265 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1n80 n ASN 266 N -0.85 -0.35 -0.40 1.61 0.23 0.16 -4.90 115.26 110.75 1n80 n ASN 266 Ca 0.16 0.52 0.11 0.00 -0.53 0.00 0.00 54.58 54.83 1n80 n ASN 266 Cb 0.76 -1.36 0.44 0.00 -2.08 0.00 0.00 39.78 37.54 1n80 n ASN 266 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1n80 n LYS 267 N -2.28 1.53 0.00 -3.83 4.76 -1.26 -4.93 118.16 112.14 1n80 n LYS 267 Ca 0.11 -0.80 0.00 0.00 -2.87 0.00 0.00 58.31 54.75 1n80 n LYS 267 Cb 0.51 -1.38 0.00 0.00 -1.84 0.00 0.00 35.03 32.33 1n80 n LYS 267 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1n80 n GLY 268 N 1.05 -1.99 3.21 0.72 0.00 -1.26 -4.78 105.19 102.14 1n80 n GLY 268 Ca 0.16 -1.57 -0.20 0.00 0.00 0.00 0.00 46.02 44.41 1n80 n GLY 268 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1n80 s PHE 269 N 0.00 1.40 0.00 1.61 -0.12 -0.93 -4.03 117.98 115.91 1n80 s PHE 269 Ca 0.00 -0.46 0.00 0.00 -0.05 0.00 0.00 56.93 56.42 1n80 s PHE 269 Cb 0.00 -0.77 0.00 0.00 -0.63 0.00 0.00 43.02 41.62 1n80 s PHE 269 CO 0.00 0.11 0.07 0.54 -0.05 0.00 0.00 175.22 175.89 1n80 n ARG 270 N 1.12 2.03 -4.35 1.99 1.74 0.11 -2.52 116.66 116.77 1n80 n ARG 270 Ca -0.20 -0.07 -0.27 0.00 -0.77 0.00 0.00 57.85 56.54 1n80 n ARG 270 Cb 0.54 -0.37 -0.13 0.00 -1.02 0.00 0.00 32.46 31.48 1n80 n ARG 270 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1n80 s GLN 271 N -0.31 1.30 -0.01 5.56 -0.21 -0.10 -0.80 119.66 125.10 1n80 s GLN 271 Ca 0.00 -1.28 -0.02 0.00 0.02 0.00 0.00 55.36 54.08 1n80 s GLN 271 Cb 0.00 -1.71 -0.00 0.00 1.00 0.00 0.00 33.01 32.29 1n80 s GLN 271 CO 0.00 0.40 0.05 0.42 -2.12 0.00 0.00 175.29 174.04 1n80 s ILE 272 N -1.10 0.03 0.20 1.08 -1.09 -0.25 -1.45 121.20 118.62 1n80 s ILE 272 Ca 0.11 -0.25 -0.13 0.00 -2.23 0.00 0.00 60.65 58.15 1n80 s ILE 272 Cb -0.10 -0.15 0.01 0.00 -1.58 0.00 0.00 42.46 40.63 1n80 s ILE 272 CO 0.05 -0.14 0.43 -0.94 -1.23 0.00 0.00 174.94 173.12 1n80 s SER 273 N -0.41 -0.11 -0.12 3.58 1.04 -0.78 0.09 113.70 116.98 1n80 s SER 273 Ca -0.05 -0.72 0.01 0.00 0.48 0.00 0.00 55.95 55.67 1n80 s SER 273 Cb -0.03 0.53 0.02 0.00 0.10 0.00 0.00 66.02 66.64 1n80 s SER 273 CO 0.00 -1.02 -0.14 -0.63 0.98 0.00 0.00 173.24 172.43 1n80 s ILE 274 N -3.94 1.48 -0.12 -1.02 1.01 -0.78 -0.09 121.20 117.74 1n80 s ILE 274 Ca 0.15 -0.61 0.02 0.00 0.00 0.00 0.00 60.65 60.21 1n80 s ILE 274 Cb 0.01 -1.38 -0.00 0.00 0.01 0.00 0.00 42.46 41.09 1n80 s ILE 274 CO 0.01 0.44 -0.19 -0.63 0.00 0.00 0.00 174.94 174.57 1n80 s ILE 275 N 1.24 2.46 -0.11 2.92 1.01 -0.30 -1.66 121.20 126.76 1n80 s ILE 275 Ca -0.01 -0.87 -0.11 0.00 0.00 0.00 0.00 60.65 59.66 1n80 s ILE 275 Cb -0.14 -1.99 -0.05 0.00 0.01 0.00 0.00 42.46 40.29 1n80 s ILE 275 CO -0.06 0.54 0.25 0.42 0.00 0.00 0.00 174.94 176.10 1n80 s THR 276 N 0.46 5.32 -1.25 2.92 -4.23 -0.12 -1.57 115.64 117.16 1n80 s THR 276 Ca -0.13 0.47 -0.04 0.00 -1.18 0.00 0.00 61.69 60.80 1n80 s THR 276 Cb -0.17 -3.56 -0.01 0.00 1.34 0.00 0.00 72.50 70.11 1n80 s THR 276 CO 0.06 0.51 0.75 0.59 -0.54 0.00 0.00 174.62 175.99 1n80 n ASN 277 N 2.64 -2.42 -4.79 3.99 3.02 -0.31 -0.78 115.26 116.62 1n80 n ASN 277 Ca -0.15 -0.83 -0.33 0.00 -0.03 0.00 0.00 54.58 53.24 1n80 n ASN 277 Cb 0.53 -4.12 0.04 0.00 -0.61 0.00 0.00 39.78 35.62 1n80 n ASN 277 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1n80 s PRO 278 N -5.78 2.98 0.30 3.52 0.04 -1.26 -3.44 135.00 131.37 1n80 s PRO 278 Ca 0.12 1.27 0.04 0.00 0.04 0.00 0.00 61.00 62.48 1n80 s PRO 278 Cb -0.03 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.50 1n80 s PRO 278 CO 0.81 -1.09 0.46 -0.51 0.04 0.00 0.00 177.00 176.70 1n80 s LEU 279 N -4.83 4.11 0.53 -3.56 1.43 -1.26 -1.69 118.68 113.41 1n80 s LEU 279 Ca 0.65 0.13 -0.11 0.00 -1.03 0.00 0.00 54.13 53.77 1n80 s LEU 279 Cb -0.18 -2.97 -0.05 0.00 0.03 0.00 0.00 46.19 43.01 1n80 s LEU 279 CO 0.41 -0.26 0.92 -0.70 0.23 0.00 0.00 176.35 176.95 1n80 s GLU 280 N -4.15 3.69 0.66 1.70 2.12 0.18 -1.67 118.70 121.23 1n80 s GLU 280 Ca 0.39 0.62 -0.17 0.00 0.36 0.00 0.00 54.97 56.17 1n80 s GLU 280 Cb -0.09 -2.22 0.00 0.00 0.26 0.00 0.00 34.13 32.08 1n80 s GLU 280 CO 0.32 -0.33 1.24 0.00 -0.54 0.00 0.00 175.26 175.95 1n80 s ALA 281 N -2.81 2.32 -0.03 6.30 0.00 -0.95 -3.94 121.76 122.65 1n80 s ALA 281 Ca 0.53 1.03 0.04 0.00 0.00 0.00 0.00 51.96 53.56 1n80 s ALA 281 Cb -0.10 -3.49 -0.00 0.00 0.00 0.00 0.00 23.12 19.52 1n80 s ALA 281 CO 0.43 -1.59 -0.15 0.15 0.00 0.00 0.00 175.76 174.60 1n80 s LYS 282 N -3.58 1.48 0.18 0.00 1.02 -1.26 -4.89 119.74 112.70 1n80 s LYS 282 Ca 0.78 -0.53 -0.12 0.00 0.02 0.00 0.00 55.97 56.12 1n80 s LYS 282 Cb -0.32 -1.33 0.16 0.00 -0.52 0.00 0.00 37.83 35.82 1n80 s LYS 282 CO 0.40 0.23 1.78 0.00 -0.92 0.00 0.00 175.35 176.84 1n80 h ALA 283 N 6.19 0.67 -3.45 5.17 0.00 -1.98 -3.41 119.26 122.45 1n80 h ALA 283 Ca -0.33 0.03 -0.44 0.00 0.00 0.00 0.00 54.91 54.17 1n80 h ALA 283 Cb 1.17 -0.05 -0.34 0.00 0.00 0.00 0.00 17.79 18.57 1n80 h ALA 283 CO 0.48 -0.11 -0.79 -1.01 0.00 0.00 0.00 179.25 177.83 1n80 s HIS 284 N -6.12 0.97 0.32 0.00 3.76 -1.26 -5.06 115.29 107.90 1n80 s HIS 284 Ca -0.13 -0.31 0.10 0.00 -0.15 0.00 0.00 55.06 54.57 1n80 s HIS 284 Cb 0.14 -0.79 0.97 0.00 1.11 0.00 0.00 32.58 34.02 1n80 s HIS 284 CO 0.74 -0.22 1.48 -2.30 -0.85 0.00 0.00 174.74 173.59 1n80 n PRO 285 N 3.96 -0.07 0.00 8.40 -0.02 -1.26 -0.27 135.00 145.74 1n80 n PRO 285 Ca -0.24 1.36 0.12 0.00 -2.02 0.00 0.00 63.50 62.72 1n80 n PRO 285 Cb 0.51 -2.29 0.60 0.00 -0.02 0.00 0.00 33.50 32.30 1n80 n PRO 285 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1n80 n ASN 286 N -5.28 0.00 -4.54 2.55 5.15 -1.26 -4.88 115.26 107.00 1n80 n ASN 286 Ca 0.28 0.19 -0.31 0.00 -0.60 0.00 0.00 54.58 54.14 1n80 n ASN 286 Cb 0.95 -0.39 0.16 0.00 -0.53 0.00 0.00 39.78 39.98 1n80 n ASN 286 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1n80 n ASP 287 N -1.39 -0.83 -4.74 1.20 8.00 0.62 -4.93 116.55 114.49 1n80 n ASP 287 Ca 0.09 0.29 -0.34 0.00 0.71 0.00 0.00 54.79 55.54 1n80 n ASP 287 Cb 0.25 -1.34 0.07 0.00 -0.02 0.00 0.00 41.12 40.08 1n80 n ASP 287 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1n80 s PRO 288 N -4.22 2.51 0.13 -0.24 0.04 -1.26 -4.98 135.00 126.98 1n80 s PRO 288 Ca 0.63 1.66 -0.28 0.00 0.04 0.00 0.00 61.00 63.06 1n80 s PRO 288 Cb -0.22 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.36 1n80 s PRO 288 CO 0.62 -1.53 0.86 -0.80 0.04 0.00 0.00 177.00 176.20 1n80 s ASN 289 N -2.11 7.42 -0.16 6.66 0.01 -1.26 -5.04 114.94 120.47 1n80 s ASN 289 Ca 0.73 1.70 0.00 0.00 -0.71 0.00 0.00 52.86 54.57 1n80 s ASN 289 Cb -0.27 -2.54 0.03 0.00 0.41 0.00 0.00 41.25 38.88 1n80 s ASN 289 CO 0.41 0.06 -0.12 -0.69 -1.51 0.00 0.00 177.10 175.25 1n80 s VAL 290 N -0.51 1.52 0.09 1.60 1.01 -1.26 -5.03 120.40 117.81 1n80 s VAL 290 Ca 0.41 -0.68 -0.31 0.00 0.00 0.00 0.00 61.98 61.41 1n80 s VAL 290 Cb -0.23 -1.48 -0.09 0.00 0.00 0.00 0.00 36.38 34.58 1n80 s VAL 290 CO 0.28 0.38 1.79 -0.75 0.00 0.00 0.00 175.10 176.79 1n80 s LYS 291 N 1.50 4.16 -0.01 2.72 2.47 -1.26 -0.65 119.74 128.66 1n80 s LYS 291 Ca 0.04 2.50 -0.30 0.00 -1.56 0.00 0.00 55.97 56.64 1n80 s LYS 291 Cb -0.14 -3.69 -0.06 0.00 -1.46 0.00 0.00 37.83 32.48 1n80 s LYS 291 CO -0.10 -0.83 1.61 0.00 0.16 0.00 0.00 175.35 176.19 1n80 s ALA 292 N 3.01 3.63 0.00 3.13 0.00 -0.68 -4.80 121.76 126.05 1n80 s ALA 292 Ca 0.79 0.99 0.00 0.00 0.00 0.00 0.00 51.96 53.75 1n80 s ALA 292 Cb -0.43 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 18.98 1n80 s ALA 292 CO 0.35 -1.24 0.13 0.39 0.00 0.00 0.00 175.76 175.40 1n80 n GLU 293 N 6.42 0.89 -0.96 0.00 1.02 -1.26 -4.82 120.64 121.94 1n80 n GLU 293 Ca 0.16 -0.13 -0.30 0.00 -0.02 0.00 0.00 57.16 56.87 1n80 n GLU 293 Cb 0.42 -0.52 0.17 0.00 -0.02 0.00 0.00 31.44 31.49 1n80 n GLU 293 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1n80 s LYS 294 N -0.16 0.77 0.00 3.49 1.02 -1.26 -4.91 119.74 118.68 1n80 s LYS 294 Ca 0.00 0.99 0.28 0.00 0.02 0.00 0.00 55.97 57.25 1n80 s LYS 294 Cb 0.00 -1.74 1.34 0.00 -0.52 0.00 0.00 37.83 36.91 1n80 s LYS 294 CO 0.00 -2.62 1.93 -0.25 -0.92 0.00 0.00 175.35 173.49 1n80 n ASP 295 N -4.17 0.00 -3.56 2.83 9.92 -1.26 -4.69 116.55 115.61 1n80 n ASP 295 Ca 0.07 0.04 -0.12 0.00 -0.53 0.00 0.00 54.79 54.25 1n80 n ASP 295 Cb 0.54 -0.34 -0.05 0.00 -0.64 0.00 0.00 41.12 40.63 1n80 n ASP 295 CO 0.00 0.00 0.00 -0.72 0.13 0.00 0.00 177.20 176.61 1n80 s TYR 296 N -2.68 -0.44 -0.01 1.24 -0.85 -1.26 -1.45 117.35 111.89 1n80 s TYR 296 Ca 0.23 0.75 -0.07 0.00 -0.52 0.00 0.00 57.07 57.47 1n80 s TYR 296 Cb 0.18 0.44 0.00 0.00 0.38 0.00 0.00 41.96 42.97 1n80 s TYR 296 CO 0.44 -0.41 0.14 0.71 -1.52 0.00 0.00 175.55 174.91 1n80 s TYR 297 N -1.14 -0.00 0.17 -3.49 2.02 -0.97 -5.01 117.35 108.92 1n80 s TYR 297 Ca -0.04 -0.01 -0.28 0.00 -0.37 0.00 0.00 57.07 56.36 1n80 s TYR 297 Cb -0.00 -0.03 -0.08 0.00 -0.40 0.00 0.00 41.96 41.45 1n80 s TYR 297 CO 0.04 -0.24 0.89 0.34 -1.57 0.00 0.00 175.55 175.01 1n80 s ASP 298 N -1.05 7.51 0.45 2.29 3.68 -1.26 -1.48 116.67 126.81 1n80 s ASP 298 Ca -0.11 1.79 0.24 0.00 2.13 0.00 0.00 52.55 56.59 1n80 s ASP 298 Cb -0.06 -2.57 1.24 0.00 -1.45 0.00 0.00 42.92 40.08 1n80 s ASP 298 CO 0.01 0.09 1.81 -0.65 0.13 0.00 0.00 175.17 176.57 1n80 h PRO 299 N 4.73 0.26 0.00 4.34 0.11 -1.87 0.18 132.00 139.75 1n80 h PRO 299 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1n80 h PRO 299 Cb 1.20 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1n80 h PRO 299 CO 0.69 0.17 0.00 0.39 -0.21 0.00 0.00 178.00 179.04 1n80 n GLU 300 N -4.47 0.15 -0.13 1.05 1.02 -1.26 -2.05 120.64 114.96 1n80 n GLU 300 Ca 0.23 0.40 0.11 0.00 -0.02 0.00 0.00 57.16 57.88 1n80 n GLU 300 Cb 0.93 -1.80 0.30 0.00 -0.02 0.00 0.00 31.44 30.85 1n80 n GLU 300 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1n80 n ASP 301 N -2.09 2.36 -4.64 1.62 8.00 0.62 -4.86 116.55 117.55 1n80 n ASP 301 Ca 0.02 -1.84 -0.24 0.00 0.71 0.00 0.00 54.79 53.45 1n80 n ASP 301 Cb 0.21 -0.17 -0.08 0.00 -0.02 0.00 0.00 41.12 41.06 1n80 n ASP 301 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1n80 s LEU 302 N -1.50 3.08 -0.04 0.64 1.43 -0.87 -2.23 118.68 119.19 1n80 s LEU 302 Ca 0.34 -0.83 -0.25 0.00 -1.03 0.00 0.00 54.13 52.36 1n80 s LEU 302 Cb 0.19 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.84 1n80 s LEU 302 CO 0.28 -0.15 0.75 -0.32 0.23 0.00 0.00 176.35 177.14 1n80 s MET 303 N -3.71 4.46 0.23 1.70 -2.45 -0.67 -4.24 119.30 114.62 1n80 s MET 303 Ca 0.34 0.99 -0.31 0.00 -1.25 0.00 0.00 55.69 55.45 1n80 s MET 303 Cb -0.03 -3.43 -0.12 0.00 1.25 0.00 0.00 34.83 32.50 1n80 s MET 303 CO 0.20 0.09 1.67 0.50 1.05 0.00 0.00 175.02 178.53 1n80 s ARG 304 N 0.66 4.13 0.00 4.11 3.52 -1.26 -2.61 118.95 127.50 1n80 s ARG 304 Ca 0.40 2.58 0.00 0.00 -0.13 0.00 0.00 55.73 58.58 1n80 s ARG 304 Cb -0.19 -3.06 0.00 0.00 -1.56 0.00 0.00 34.95 30.14 1n80 s ARG 304 CO 0.20 -0.71 0.00 0.72 -0.81 0.00 0.00 175.30 174.71 1n80 n HIS 305 N 3.44 0.00 -1.87 5.12 8.25 -1.26 -5.01 115.22 123.90 1n80 n HIS 305 Ca 0.13 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.30 1n80 n HIS 305 Cb 0.36 -0.81 0.08 0.00 1.12 0.00 0.00 29.99 30.74 1n80 n HIS 305 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1n80 s SER 306 N -2.19 4.74 0.28 0.41 1.04 -1.07 -4.91 113.70 112.00 1n80 s SER 306 Ca 0.00 0.91 0.00 0.00 0.48 0.00 0.00 55.95 57.34 1n80 s SER 306 Cb 0.00 -1.51 0.00 0.00 0.10 0.00 0.00 66.02 64.61 1n80 s SER 306 CO 0.00 -1.77 0.00 0.61 0.98 0.00 0.00 173.24 173.06 1n80 n GLY 307 N -3.14 -1.88 3.07 7.32 0.00 -1.22 -4.68 105.19 104.66 1n80 n GLY 307 Ca 0.08 -1.31 -0.32 0.00 0.00 0.00 0.00 46.02 44.47 1n80 n GLY 307 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1n80 s GLU 308 N -0.84 2.62 -0.50 1.61 0.41 0.04 -4.90 118.70 117.13 1n80 s GLU 308 Ca 0.00 -0.73 -0.28 0.00 -0.41 0.00 0.00 54.97 53.54 1n80 s GLU 308 Cb 0.00 -2.37 0.03 0.00 -1.78 0.00 0.00 34.13 30.00 1n80 s GLU 308 CO 0.00 -0.25 1.13 1.41 -0.49 0.00 0.00 175.26 177.06 1n80 s MET 309 N 1.37 3.66 -0.00 1.61 -2.45 -1.26 -0.94 119.30 121.28 1n80 s MET 309 Ca 0.04 0.45 0.17 0.00 -1.25 0.00 0.00 55.69 55.11 1n80 s MET 309 Cb -0.13 -3.93 -0.20 0.00 1.25 0.00 0.00 34.83 31.81 1n80 s MET 309 CO -0.12 -1.43 0.68 0.44 1.05 0.00 0.00 175.02 175.65 1n80 n ILE 310 N 6.77 0.00 -3.79 10.11 -5.35 -0.67 -4.97 119.36 121.47 1n80 n ILE 310 Ca 0.11 -0.14 -0.13 0.00 -0.27 0.00 0.00 62.75 62.32 1n80 n ILE 310 Cb 0.49 0.86 -0.11 0.00 -1.74 0.00 0.00 39.64 39.14 1n80 n ILE 310 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 1n80 s TYR 311 N -2.73 -0.25 -0.06 4.28 6.14 -1.23 -4.99 117.35 118.52 1n80 s TYR 311 Ca 0.05 0.59 -0.03 0.00 0.64 0.00 0.00 57.07 58.32 1n80 s TYR 311 Cb 0.13 0.08 0.03 0.00 0.42 0.00 0.00 41.96 42.63 1n80 s TYR 311 CO 0.72 -0.16 0.12 -1.64 0.64 0.00 0.00 175.55 175.23 1n80 s MET 312 N -0.06 0.08 -0.01 4.97 -1.94 -1.26 -1.87 119.30 119.21 1n80 s MET 312 Ca -0.02 0.31 0.00 0.00 -1.71 0.00 0.00 55.69 54.27 1n80 s MET 312 Cb -0.02 -0.15 0.01 0.00 2.01 0.00 0.00 34.83 36.68 1n80 s MET 312 CO 0.01 -0.14 0.01 -2.00 -0.01 0.00 0.00 175.02 172.89 1n80 s GLU 313 N 0.98 -0.01 0.00 2.03 2.12 0.11 -4.84 118.70 119.10 1n80 s GLU 313 Ca -0.08 0.08 0.06 0.00 0.36 0.00 0.00 54.97 55.40 1n80 s GLU 313 Cb -0.10 -0.12 -0.03 0.00 0.26 0.00 0.00 34.13 34.15 1n80 s GLU 313 CO -0.05 -0.07 -0.18 -0.80 -0.54 0.00 0.00 175.26 173.62 1n80 s ASN 314 N 0.47 3.73 0.25 -1.70 0.01 -1.26 -1.08 114.94 115.36 1n80 s ASN 314 Ca -0.04 -0.37 -0.13 0.00 -0.71 0.00 0.00 52.86 51.61 1n80 s ASN 314 Cb -0.06 -0.63 -0.00 0.00 0.41 0.00 0.00 41.25 40.97 1n80 s ASN 314 CO -0.01 0.29 0.49 0.00 -1.51 0.00 0.00 177.10 176.36 1n80 s ARG 315 N -1.08 1.56 0.78 -0.60 1.70 0.02 -4.82 118.95 116.51 1n80 s ARG 315 Ca 0.13 -1.24 -0.13 0.00 -0.47 0.00 0.00 55.73 54.02 1n80 s ARG 315 Cb -0.10 0.48 0.07 0.00 -0.57 0.00 0.00 34.95 34.82 1n80 s ARG 315 CO 0.03 -0.65 1.15 -2.14 -1.08 0.00 0.00 175.30 172.61 1n80 s PRO 316 N -4.01 1.94 0.58 3.89 0.02 -1.26 -4.68 135.00 131.47 1n80 s PRO 316 Ca 0.22 1.51 -0.19 0.00 0.02 0.00 0.00 61.00 62.56 1n80 s PRO 316 Cb -0.01 -1.83 -0.04 0.00 0.02 0.00 0.00 34.50 32.64 1n80 s PRO 316 CO 0.09 -1.94 1.20 -1.25 -0.33 0.00 0.00 177.00 174.78 1n80 s PRO 317 N -4.38 3.04 -0.06 5.54 0.04 -1.26 -4.75 135.00 133.16 1n80 s PRO 317 Ca 0.68 1.82 -0.01 0.00 0.04 0.00 0.00 61.00 63.53 1n80 s PRO 317 Cb -0.23 -1.96 0.03 0.00 0.04 0.00 0.00 34.50 32.38 1n80 s PRO 317 CO 0.51 -1.15 0.01 0.42 0.04 0.00 0.00 177.00 176.83 1n80 s ILE 318 N -1.60 0.26 -0.04 0.56 -1.09 -1.05 -4.95 121.20 113.30 1n80 s ILE 318 Ca 0.77 0.19 -0.25 0.00 -2.23 0.00 0.00 60.65 59.12 1n80 s ILE 318 Cb -0.30 -0.44 -0.04 0.00 -1.58 0.00 0.00 42.46 40.10 1n80 s ILE 318 CO 0.33 0.24 0.77 0.27 -1.23 0.00 0.00 174.94 175.32 1n80 s ILE 319 N 1.96 4.97 -0.11 2.92 -0.00 -1.26 -2.18 121.20 127.51 1n80 s ILE 319 Ca 0.04 1.61 -0.11 0.00 -0.00 0.00 0.00 60.65 62.19 1n80 s ILE 319 Cb -0.12 -4.11 -0.05 0.00 -0.00 0.00 0.00 42.46 38.18 1n80 s ILE 319 CO -0.05 0.24 0.25 -0.04 -0.00 0.00 0.00 174.94 175.35 1n80 s MET 320 N 0.74 3.86 0.05 0.37 -1.94 -1.26 -5.02 119.30 116.10 1n80 s MET 320 Ca 0.41 0.07 0.01 0.00 -1.71 0.00 0.00 55.69 54.46 1n80 s MET 320 Cb -0.19 -3.28 -0.04 0.00 2.01 0.00 0.00 34.83 33.33 1n80 s MET 320 CO 0.21 0.56 0.15 0.00 -0.01 0.00 0.00 175.02 175.94 1n80 s ALA 321 N -0.51 3.82 0.26 3.03 0.00 -1.26 -4.70 121.76 122.40 1n80 s ALA 321 Ca 0.17 -0.89 -0.01 0.00 0.00 0.00 0.00 51.96 51.23 1n80 s ALA 321 Cb -0.13 -1.69 0.58 0.00 0.00 0.00 0.00 23.12 21.88 1n80 s ALA 321 CO 0.06 0.78 1.35 0.00 0.00 0.00 0.00 175.76 177.95 1n80 n MET 322 N 0.50 -0.07 -3.12 0.00 0.00 -1.21 -2.12 117.12 111.09 1n80 n MET 322 Ca -0.08 1.31 -0.25 0.00 0.00 0.00 0.00 57.70 58.68 1n80 n MET 322 Cb 0.52 -2.05 -0.05 0.00 0.00 0.00 0.00 33.22 31.64 1n80 n MET 322 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1n80 n ASP 323 N -5.30 3.33 -4.25 3.17 8.00 -1.26 -3.55 116.55 116.70 1n80 n ASP 323 Ca 0.18 -3.43 -0.18 0.00 0.71 0.00 0.00 54.79 52.08 1n80 n ASP 323 Cb 0.60 -0.60 -0.10 0.00 -0.02 0.00 0.00 41.12 40.99 1n80 n ASP 323 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1n80 s GLN 324 N -2.86 1.48 -0.00 -1.24 -0.21 -0.90 -5.04 119.66 110.89 1n80 s GLN 324 Ca 0.44 -1.82 0.00 0.00 0.02 0.00 0.00 55.36 54.00 1n80 s GLN 324 Cb 0.25 -0.27 0.00 0.00 1.00 0.00 0.00 33.01 33.99 1n80 s GLN 324 CO -0.09 -0.33 0.00 0.99 -2.12 0.00 0.00 175.29 173.74 1n80 s THR 325 N -3.68 -0.00 -0.22 -0.19 2.01 -1.26 -2.55 115.64 109.74 1n80 s THR 325 Ca 0.37 0.02 -0.06 0.00 0.31 0.00 0.00 61.69 62.33 1n80 s THR 325 Cb 0.07 -0.02 -0.02 0.00 0.01 0.00 0.00 72.50 72.54 1n80 s THR 325 CO 0.15 0.01 0.01 -1.61 -0.69 0.00 0.00 174.62 172.49 1n80 s GLU 326 N 0.10 3.56 0.09 4.92 0.41 -0.03 -4.93 118.70 122.83 1n80 s GLU 326 Ca -0.01 -0.53 -0.30 0.00 -0.41 0.00 0.00 54.97 53.72 1n80 s GLU 326 Cb -0.01 -3.15 -0.05 0.00 -1.78 0.00 0.00 34.13 29.13 1n80 s GLU 326 CO -0.00 -0.12 0.98 -2.00 -0.49 0.00 0.00 175.26 173.63 1n80 s GLU 327 N 1.36 4.65 -0.14 1.61 2.12 -1.26 -1.09 118.70 125.95 1n80 s GLU 327 Ca 0.05 1.48 -0.01 0.00 0.36 0.00 0.00 54.97 56.84 1n80 s GLU 327 Cb -0.15 -3.39 -0.01 0.00 0.26 0.00 0.00 34.13 30.84 1n80 s GLU 327 CO 0.01 0.13 -0.12 0.42 -0.54 0.00 0.00 175.26 175.16 1n80 s ILE 328 N 0.25 3.07 0.12 -3.70 -1.09 0.10 -4.98 121.20 114.98 1n80 s ILE 328 Ca 0.49 -0.64 0.10 0.00 -2.23 0.00 0.00 60.65 58.36 1n80 s ILE 328 Cb -0.23 -2.31 -0.04 0.00 -1.58 0.00 0.00 42.46 38.30 1n80 s ILE 328 CO 0.30 0.51 -0.23 0.20 -1.23 0.00 0.00 174.94 174.48 1n80 s ASN 329 N 0.54 3.53 -0.24 3.58 -0.87 -1.26 -1.40 114.94 118.82 1n80 s ASN 329 Ca -0.08 -0.66 -0.22 0.00 -1.57 0.00 0.00 52.86 50.33 1n80 s ASN 329 Cb -0.16 -0.36 0.06 0.00 -0.02 0.00 0.00 41.25 40.78 1n80 s ASN 329 CO 0.04 0.19 0.65 -0.63 -2.57 0.00 0.00 177.10 174.77 1n80 s ILE 330 N -1.07 -0.00 -0.08 0.60 1.01 -1.22 -4.94 121.20 115.51 1n80 s ILE 330 Ca 0.15 0.00 0.01 0.00 0.00 0.00 0.00 60.65 60.81 1n80 s ILE 330 Cb -0.10 -0.90 -0.03 0.00 0.01 0.00 0.00 42.46 41.44 1n80 s ILE 330 CO 0.07 0.00 -0.07 -0.76 0.00 0.00 0.00 174.94 174.18 1n80 s LEU 331 N 0.37 3.13 -0.21 2.97 1.43 -1.26 -1.02 118.68 124.10 1n80 s LEU 331 Ca -0.00 -0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.05 1n80 s LEU 331 Cb -0.05 -1.69 0.05 0.00 0.03 0.00 0.00 46.19 44.54 1n80 s LEU 331 CO 0.00 0.34 -0.08 -0.36 0.23 0.00 0.00 176.35 176.48 1n80 s PHE 332 N -0.65 2.32 -0.22 0.29 2.99 -0.55 -4.98 117.98 117.17 1n80 s PHE 332 Ca 0.10 -1.59 -0.12 0.00 0.00 0.00 0.00 56.93 55.32 1n80 s PHE 332 Cb -0.11 -1.58 -0.05 0.00 0.00 0.00 0.00 43.02 41.28 1n80 s PHE 332 CO 0.02 -0.74 0.22 0.99 -0.00 0.00 0.00 175.22 175.71 1n80 s THR 333 N 1.42 5.32 -2.82 0.64 2.01 -1.26 -0.93 115.64 120.02 1n80 s THR 333 Ca -0.03 0.33 0.23 0.00 0.31 0.00 0.00 61.69 62.52 1n80 s THR 333 Cb -0.17 -3.56 0.18 0.00 0.01 0.00 0.00 72.50 68.96 1n80 s THR 333 CO -0.07 0.33 1.22 0.49 -0.69 0.00 0.00 174.62 175.89