#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 2.92 -0.36 1.39 4.12 -1.26 -5.09 117.35 119.07 1n80 s TYR 8 Ca 0.00 -0.07 0.02 0.00 0.02 0.00 0.00 57.07 57.04 1n80 s TYR 8 Cb 0.00 -1.49 0.11 0.00 -1.52 0.00 0.00 41.96 39.06 1n80 s TYR 8 CO 0.00 0.48 0.11 1.03 0.02 0.00 0.00 175.55 177.19 1n80 s ARG 9 N -2.41 1.25 0.19 -0.62 1.81 -1.26 -5.11 118.95 112.80 1n80 s ARG 9 Ca 0.25 -1.71 0.08 0.00 -1.72 0.00 0.00 55.73 52.63 1n80 s ARG 9 Cb -0.11 -2.70 -0.04 0.00 -0.45 0.00 0.00 34.95 31.65 1n80 s ARG 9 CO 0.18 -1.00 -0.01 0.00 -0.68 0.00 0.00 175.30 173.79 1n80 s ALA 10 N 0.94 3.18 -0.10 2.13 0.00 -1.26 -5.14 121.76 121.51 1n80 s ALA 10 Ca 0.12 -1.43 -0.11 0.00 0.00 0.00 0.00 51.96 50.54 1n80 s ALA 10 Cb -0.20 -0.94 0.03 0.00 0.00 0.00 0.00 23.12 22.01 1n80 s ALA 10 CO -0.12 0.44 0.31 0.42 0.00 0.00 0.00 175.76 176.81 1n80 s ILE 11 N -1.83 0.01 -0.18 0.00 -1.09 -1.26 -5.13 121.20 111.72 1n80 s ILE 11 Ca 0.28 -0.08 -0.12 0.00 -2.23 0.00 0.00 60.65 58.50 1n80 s ILE 11 Cb -0.09 -0.46 -0.05 0.00 -1.58 0.00 0.00 42.46 40.28 1n80 s ILE 11 CO 0.19 -0.04 0.21 0.68 -1.23 0.00 0.00 174.94 174.74 1n80 s VAL 12 N -0.07 5.36 0.75 2.92 -7.23 -1.26 -5.08 120.40 115.79 1n80 s VAL 12 Ca -0.02 0.36 -0.07 0.00 -1.81 0.00 0.00 61.98 60.44 1n80 s VAL 12 Cb -0.03 -3.55 0.10 0.00 0.56 0.00 0.00 36.38 33.47 1n80 s VAL 12 CO 0.01 0.42 1.06 0.42 -0.31 0.00 0.00 175.10 176.70 1n80 s THR 13 N 0.40 2.20 0.23 5.32 -4.23 -1.26 -4.96 115.64 113.34 1n80 s THR 13 Ca 0.12 -0.31 0.27 0.00 -1.18 0.00 0.00 61.69 60.60 1n80 s THR 13 Cb -0.12 -2.90 0.28 0.00 1.34 0.00 0.00 72.50 71.11 1n80 s THR 13 CO 0.01 0.00 1.94 0.77 -0.54 0.00 0.00 174.62 176.80 1n80 h SER 14 N -0.77 0.00 0.01 3.99 4.64 -2.01 -2.05 113.55 117.36 1n80 h SER 14 Ca -0.42 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.87 1n80 h SER 14 Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 1n80 h SER 14 CO 0.51 0.15 -0.06 0.11 -0.87 0.00 0.00 176.83 176.67 1n80 h LYS 15 N 0.00 0.14 -0.06 4.77 1.79 -1.93 -1.28 116.57 120.01 1n80 h LYS 15 Ca -0.00 -0.02 -0.05 0.00 -2.18 0.00 0.00 60.65 58.40 1n80 h LYS 15 Cb 0.56 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.18 1n80 h LYS 15 CO 0.02 0.21 -0.20 0.35 -1.08 0.00 0.00 179.45 178.75 1n80 h PHE 16 N 0.14 0.09 -0.42 -1.35 -0.00 -1.74 -1.64 116.94 112.02 1n80 h PHE 16 Ca 0.03 -0.01 -0.14 0.00 -0.00 0.00 0.00 57.97 57.85 1n80 h PHE 16 Cb 0.20 -0.03 -0.01 0.00 -0.00 0.00 0.00 35.95 36.11 1n80 h PHE 16 CO 0.00 0.29 -0.29 0.00 -0.00 0.00 0.00 178.31 178.31 1n80 h ARG 17 N 0.09 0.94 -0.49 1.11 3.08 -1.33 -2.61 114.38 115.16 1n80 h ARG 17 Ca 0.02 -0.45 -0.08 0.00 0.07 0.00 0.00 59.98 59.53 1n80 h ARG 17 Cb 0.40 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1n80 h ARG 17 CO 0.03 1.11 -0.03 1.15 -1.07 0.00 0.00 179.97 181.16 1n80 h THR 18 N 0.77 1.25 -0.40 2.04 2.02 -1.31 -2.88 112.91 114.40 1n80 h THR 18 Ca 0.08 -1.08 -0.01 0.00 0.77 0.00 0.00 66.41 66.17 1n80 h THR 18 Cb 0.87 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 68.17 1n80 h THR 18 CO 0.08 0.38 0.22 -0.08 0.37 0.00 0.00 175.52 176.49 1n80 h GLU 19 N 0.78 0.57 -0.92 6.66 4.57 -1.15 -0.25 114.58 124.84 1n80 h GLU 19 Ca 0.14 -0.07 0.01 0.00 -1.18 0.00 0.00 59.36 58.27 1n80 h GLU 19 Cb 0.51 -0.11 -0.05 0.00 -0.16 0.00 0.00 28.75 28.95 1n80 h GLU 19 CO 0.03 0.46 0.61 0.87 -1.18 0.00 0.00 179.01 179.79 1n80 h LYS 20 N 0.52 1.21 -0.18 1.92 1.57 -1.39 1.04 116.57 121.26 1n80 h LYS 20 Ca 0.14 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1n80 h LYS 20 Cb 0.06 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.09 1n80 h LYS 20 CO -0.02 0.80 0.07 1.98 -0.57 0.00 0.00 179.45 181.71 1n80 h MET 21 N 1.24 0.27 -0.29 3.15 4.05 -1.23 0.03 114.93 122.15 1n80 h MET 21 Ca 0.34 -0.05 -0.08 0.00 -0.28 0.00 0.00 59.70 59.63 1n80 h MET 21 Cb -0.14 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.60 1n80 h MET 21 CO -0.07 0.34 -0.17 1.25 0.23 0.00 0.00 176.91 178.48 1n80 h LEU 22 N 0.14 0.50 -0.62 3.39 5.85 -0.46 0.14 115.31 124.25 1n80 h LEU 22 Ca 0.06 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 1n80 h LEU 22 Cb 0.17 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 1n80 h LEU 22 CO -0.01 0.69 0.32 0.78 -0.34 0.00 0.00 178.44 179.88 1n80 h ASN 23 N 0.46 0.79 0.24 1.25 2.35 0.14 0.28 115.58 121.10 1n80 h ASN 23 Ca 0.08 -0.11 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 1n80 h ASN 23 Cb 0.56 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.73 1n80 h ASN 23 CO 0.04 0.67 -0.12 0.15 -1.65 0.00 0.00 177.43 176.52 1n80 h PHE 24 N 0.84 -0.30 -0.08 1.19 3.04 -0.29 -1.84 116.94 119.50 1n80 h PHE 24 Ca 0.22 -0.01 0.02 0.00 3.98 0.00 0.00 57.97 62.18 1n80 h PHE 24 Cb 0.08 0.10 -0.03 0.00 2.56 0.00 0.00 35.95 38.66 1n80 h PHE 24 CO -0.00 -0.08 -0.07 -0.92 -2.02 0.00 0.00 178.31 175.21 1n80 h TYR 25 N -0.47 -0.17 0.00 0.41 3.20 -0.80 -1.97 116.97 117.16 1n80 h TYR 25 Ca -0.03 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1n80 h TYR 25 Cb 0.36 0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.71 1n80 h TYR 25 CO -0.02 -0.11 0.00 0.09 -1.64 0.00 0.00 178.16 176.48 1n80 n ASN 26 N -5.20 0.17 -0.05 -2.11 3.02 0.07 -2.71 115.26 108.45 1n80 n ASN 26 Ca -0.04 0.55 0.13 0.00 -0.03 0.00 0.00 54.58 55.19 1n80 n ASN 26 Cb 0.13 -0.59 0.40 0.00 -0.61 0.00 0.00 39.78 39.11 1n80 n ASN 26 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1n80 n SER 27 N -1.70 0.47 -4.65 6.41 3.41 -0.70 -4.84 113.62 112.03 1n80 n SER 27 Ca 0.02 -0.24 -0.42 0.00 -0.26 0.00 0.00 58.87 57.96 1n80 n SER 27 Cb 0.12 0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.06 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 -2.84 4.74 0.00 -1.33 1.01 -1.10 0.17 121.20 121.84 1n80 s ILE 28 Ca 0.17 1.72 0.00 0.00 0.00 0.00 0.00 60.65 62.54 1n80 s ILE 28 Cb 0.18 -4.23 0.00 0.00 0.01 0.00 0.00 42.46 38.43 1n80 s ILE 28 CO 0.60 -0.18 0.00 0.61 0.00 0.00 0.00 174.94 175.97 1n80 n GLY 29 N 3.65 1.07 3.12 6.18 0.00 0.11 -4.81 105.19 114.51 1n80 n GLY 29 Ca 0.09 0.16 -0.10 0.00 0.00 0.00 0.00 46.02 46.16 1n80 n GLY 29 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1n80 s SER 30 N 2.00 0.83 0.00 1.61 1.04 -1.26 -4.40 113.70 113.52 1n80 s SER 30 Ca 0.00 -0.90 0.00 0.00 0.48 0.00 0.00 55.95 55.53 1n80 s SER 30 Cb 0.00 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.24 1n80 s SER 30 CO 0.00 -0.46 0.00 0.61 0.98 0.00 0.00 173.24 174.37 1n80 n GLY 31 N 0.34 -0.77 0.02 7.32 0.00 -1.26 -4.20 105.19 106.63 1n80 n GLY 31 Ca -0.15 -1.55 0.01 0.00 0.00 0.00 0.00 46.02 44.33 1n80 n GLY 31 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1n80 n PRO 32 N -0.26 0.01 -0.27 1.61 -0.02 -1.26 -0.62 135.00 134.19 1n80 n PRO 32 Ca 0.00 0.41 0.04 0.00 -2.02 0.00 0.00 63.50 61.93 1n80 n PRO 32 Cb 0.00 -1.68 0.16 0.00 -0.02 0.00 0.00 33.50 31.97 1n80 n PRO 32 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1n80 n ASP 33 N -1.48 2.36 -0.83 2.55 3.85 -1.26 -4.92 116.55 116.81 1n80 n ASP 33 Ca -0.00 -2.18 0.00 0.00 -0.71 0.00 0.00 54.79 51.90 1n80 n ASP 33 Cb 0.13 -0.38 0.00 0.00 -1.35 0.00 0.00 41.12 39.52 1n80 n ASP 33 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1n80 n LYS 34 N 0.39 0.00 -4.17 0.11 5.02 0.21 -4.95 118.16 114.77 1n80 n LYS 34 Ca 0.12 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.29 1n80 n LYS 34 Cb 0.45 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.36 1n80 n LYS 34 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1n80 s ASN 35 N -0.56 1.20 0.08 4.39 0.01 0.44 -4.86 114.94 115.63 1n80 s ASN 35 Ca 0.00 -0.97 0.07 0.00 -0.71 0.00 0.00 52.86 51.26 1n80 s ASN 35 Cb 0.00 0.08 -0.03 0.00 0.41 0.00 0.00 41.25 41.71 1n80 s ASN 35 CO 0.00 -0.43 -0.20 0.42 -1.51 0.00 0.00 177.10 175.39 1n80 s THR 36 N -3.39 1.59 0.07 1.60 -4.23 -1.26 0.07 115.64 110.10 1n80 s THR 36 Ca 0.10 -1.38 0.07 0.00 -1.18 0.00 0.00 61.69 59.31 1n80 s THR 36 Cb 0.04 -1.43 -0.03 0.00 1.34 0.00 0.00 72.50 72.41 1n80 s THR 36 CO -0.04 0.00 -0.19 -0.63 -0.54 0.00 0.00 174.62 173.22 1n80 s ILE 37 N -1.04 1.56 0.01 2.99 -1.09 -1.26 -2.22 121.20 120.15 1n80 s ILE 37 Ca 0.05 -1.34 0.01 0.00 -2.23 0.00 0.00 60.65 57.15 1n80 s ILE 37 Cb -0.09 -1.41 -0.01 0.00 -1.58 0.00 0.00 42.46 39.37 1n80 s ILE 37 CO 0.03 0.02 -0.05 -0.36 -1.23 0.00 0.00 174.94 173.35 1n80 s PHE 38 N -1.02 0.41 -0.18 3.97 0.40 0.23 -1.93 117.98 119.86 1n80 s PHE 38 Ca 0.05 -0.22 -0.04 0.00 -0.60 0.00 0.00 56.93 56.13 1n80 s PHE 38 Cb -0.09 -0.26 -0.02 0.00 0.51 0.00 0.00 43.02 43.15 1n80 s PHE 38 CO 0.03 -0.04 -0.03 -1.50 0.70 0.00 0.00 175.22 174.37 1n80 s ILE 39 N -0.55 3.76 0.20 0.64 -1.16 -0.40 -0.43 121.20 123.27 1n80 s ILE 39 Ca -0.03 -0.39 0.09 0.00 -0.51 0.00 0.00 60.65 59.81 1n80 s ILE 39 Cb -0.04 -2.67 -0.04 0.00 0.61 0.00 0.00 42.46 40.31 1n80 s ILE 39 CO -0.00 0.46 -0.06 0.42 -2.81 0.00 0.00 174.94 172.95 1n80 s THR 40 N 0.76 3.33 0.00 4.00 -4.23 0.99 -1.21 115.64 119.28 1n80 s THR 40 Ca -0.01 -1.70 -0.02 0.00 -1.18 0.00 0.00 61.69 58.77 1n80 s THR 40 Cb -0.14 -2.69 -0.01 0.00 1.34 0.00 0.00 72.50 71.00 1n80 s THR 40 CO 0.02 -0.18 0.04 0.72 -0.54 0.00 0.00 174.62 174.67 1n80 s PHE 41 N -1.88 0.11 0.00 3.99 -0.12 -0.56 -1.98 117.98 117.54 1n80 s PHE 41 Ca 0.27 -0.22 0.00 0.00 -0.05 0.00 0.00 56.93 56.93 1n80 s PHE 41 Cb -0.08 -0.09 0.00 0.00 -0.63 0.00 0.00 43.02 42.22 1n80 s PHE 41 CO 0.17 -0.16 0.00 0.41 -0.05 0.00 0.00 175.22 175.59 1n80 n GLY 42 N 2.02 0.79 1.81 1.99 0.00 -0.82 -0.17 105.19 110.81 1n80 n GLY 42 Ca -0.20 -0.71 -0.00 0.00 0.00 0.00 0.00 46.02 45.10 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 -0.95 0.07 1.61 0.63 0.39 -1.83 116.66 116.58 1n80 n ARG 43 Ca 0.00 1.12 -0.04 0.00 -0.92 0.00 0.00 57.85 58.01 1n80 n ARG 43 Cb 0.00 -2.12 -0.07 0.00 0.45 0.00 0.00 32.46 30.71 1n80 n ARG 43 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1n80 h SER 44 N 0.83 0.00 -2.88 6.15 4.64 -1.81 -3.16 113.55 117.32 1n80 h SER 44 Ca -0.02 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.73 1n80 h SER 44 Cb 0.05 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.10 1n80 h SER 44 CO 0.02 0.80 1.14 -1.61 -0.87 0.00 0.00 176.83 176.32 1n80 s GLU 45 N -2.80 3.64 0.52 4.77 8.01 -1.26 -4.76 118.70 126.82 1n80 s GLU 45 Ca 0.01 1.41 -0.19 0.00 0.01 0.00 0.00 54.97 56.22 1n80 s GLU 45 Cb 0.09 -4.06 -0.12 0.00 -4.31 0.00 0.00 34.13 25.73 1n80 s GLU 45 CO 0.80 -1.49 0.27 -2.30 0.01 0.00 0.00 175.26 172.55 1n80 n PRO 46 N 7.93 0.31 0.11 0.39 -0.02 -1.26 -4.92 135.00 137.54 1n80 n PRO 46 Ca 0.19 0.12 -0.12 0.00 -2.02 0.00 0.00 63.50 61.67 1n80 n PRO 46 Cb 0.46 -1.39 -0.08 0.00 -0.02 0.00 0.00 33.50 32.47 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 0.22 -0.30 -2.88 6.00 4.06 -1.97 -3.48 115.95 117.60 1n80 h TRP 47 Ca -0.43 -0.01 0.08 0.00 2.06 0.00 0.00 58.89 60.60 1n80 h TRP 47 Cb 1.42 0.10 -0.05 0.00 -1.00 0.00 0.00 29.16 29.63 1n80 h TRP 47 CO 0.29 0.07 0.28 -1.54 -3.56 0.00 0.00 178.44 173.98 1n80 s SER 48 N -5.24 -0.22 0.60 -3.49 1.04 -1.26 -5.03 113.70 100.09 1n80 s SER 48 Ca -0.14 -0.62 0.40 0.00 0.48 0.00 0.00 55.95 56.07 1n80 s SER 48 Cb 0.02 0.70 2.14 0.00 0.10 0.00 0.00 66.02 68.97 1n80 s SER 48 CO 0.53 -1.30 2.22 0.77 0.98 0.00 0.00 173.24 176.44 1n80 h SER 49 N 2.00 0.00 -0.31 7.02 4.64 -2.04 -1.49 113.55 123.37 1n80 h SER 49 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1n80 h SER 49 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1n80 h SER 49 CO 0.25 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.75 1n80 n ASN 50 N -2.93 3.05 0.26 4.97 2.04 -1.26 -4.51 115.26 116.88 1n80 n ASN 50 Ca -0.02 -1.94 0.12 0.00 -0.44 0.00 0.00 54.58 52.30 1n80 n ASN 50 Cb 0.08 -0.20 0.64 0.00 -2.53 0.00 0.00 39.78 37.78 1n80 n ASN 50 CO 0.00 0.00 0.00 1.05 -0.44 0.00 0.00 177.26 177.87 1n80 h GLU 51 N 4.04 0.00 -0.01 -3.83 4.11 -1.67 0.29 114.58 117.50 1n80 h GLU 51 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1n80 h GLU 51 Cb 0.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1n80 h GLU 51 CO 0.00 0.00 -0.47 0.09 0.07 0.00 0.00 179.01 178.70 1n80 n ASN 52 N -2.54 1.86 -4.62 3.06 4.13 -1.26 -4.61 115.26 111.28 1n80 n ASN 52 Ca -0.02 -1.43 -0.43 0.00 1.68 0.00 0.00 54.58 54.39 1n80 n ASN 52 Cb 0.32 0.51 -0.03 0.00 -1.54 0.00 0.00 39.78 39.05 1n80 n ASN 52 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1n80 s GLU 53 N -2.36 3.66 -0.21 3.52 2.02 0.10 -4.87 118.70 120.56 1n80 s GLU 53 Ca 0.16 1.56 -0.25 0.00 0.02 0.00 0.00 54.97 56.46 1n80 s GLU 53 Cb 0.17 -4.08 -0.11 0.00 0.10 0.00 0.00 34.13 30.21 1n80 s GLU 53 CO 0.55 -1.46 0.81 1.55 0.02 0.00 0.00 175.26 176.72 1n80 n VAL 54 N 6.73 0.00 -0.63 2.63 3.14 -1.26 -0.84 118.33 128.10 1n80 n VAL 54 Ca 0.20 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.58 1n80 n VAL 54 Cb 0.46 -0.21 0.00 0.00 -1.06 0.00 0.00 33.84 33.02 1n80 n VAL 54 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1n80 n GLY 55 N 1.89 0.64 3.75 7.55 0.00 -1.26 -5.04 105.19 112.73 1n80 n GLY 55 Ca 0.16 -0.39 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 1n80 n GLY 55 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1n80 n PHE 56 N -2.63 2.50 -3.77 1.61 7.35 -0.02 -4.99 117.46 117.50 1n80 n PHE 56 Ca 0.00 0.44 -0.36 0.00 -0.76 0.00 0.00 57.45 56.77 1n80 n PHE 56 Cb 0.00 -2.41 -0.11 0.00 0.35 0.00 0.00 39.48 37.30 1n80 n PHE 56 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1n80 s ALA 57 N -1.24 3.24 0.74 3.13 0.00 -1.26 -4.85 121.76 121.52 1n80 s ALA 57 Ca 0.66 -2.69 -0.13 0.00 0.00 0.00 0.00 51.96 49.80 1n80 s ALA 57 Cb -0.44 -2.45 0.04 0.00 0.00 0.00 0.00 23.12 20.27 1n80 s ALA 57 CO 0.54 -1.86 1.14 -1.25 0.00 0.00 0.00 175.76 174.33 1n80 s PRO 58 N 0.88 2.25 0.71 0.00 0.04 -1.26 -4.96 135.00 132.65 1n80 s PRO 58 Ca 0.10 1.48 -0.15 0.00 0.04 0.00 0.00 61.00 62.48 1n80 s PRO 58 Cb -0.22 -1.87 0.03 0.00 0.04 0.00 0.00 34.50 32.47 1n80 s PRO 58 CO -0.04 -1.70 1.16 -1.25 0.04 0.00 0.00 177.00 175.21 1n80 s PRO 59 N -4.26 2.39 0.16 0.56 0.04 -1.26 -4.94 135.00 127.69 1n80 s PRO 59 Ca 0.68 1.57 -0.30 0.00 0.04 0.00 0.00 61.00 62.99 1n80 s PRO 59 Cb -0.23 -1.88 -0.08 0.00 0.04 0.00 0.00 34.50 32.35 1n80 s PRO 59 CO 0.48 -1.60 1.18 0.71 0.04 0.00 0.00 177.00 177.80 1n80 s TYR 60 N -2.19 3.46 0.61 0.56 1.51 -1.26 -4.67 117.35 115.38 1n80 s TYR 60 Ca 0.70 1.44 -0.17 0.00 -1.01 0.00 0.00 57.07 58.04 1n80 s TYR 60 Cb -0.25 -3.40 -0.02 0.00 -0.11 0.00 0.00 41.96 38.18 1n80 s TYR 60 CO 0.44 -1.09 1.11 -1.25 -1.11 0.00 0.00 175.55 173.65 1n80 s PRO 61 N -0.04 3.03 -0.23 -1.71 0.04 -1.26 -5.00 135.00 129.83 1n80 s PRO 61 Ca 0.53 1.46 -0.07 0.00 0.04 0.00 0.00 61.00 62.96 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 -1.08 0.07 0.99 0.04 0.00 0.00 177.00 177.37 1n80 s THR 62 N -2.14 4.48 -1.30 1.26 2.01 -1.26 -5.02 115.64 113.67 1n80 s THR 62 Ca 0.69 -0.13 -0.17 0.00 0.31 0.00 0.00 61.69 62.39 1n80 s THR 62 Cb -0.21 -3.07 0.08 0.00 0.01 0.00 0.00 72.50 69.31 1n80 s THR 62 CO 0.36 0.38 1.73 -0.67 -0.69 0.00 0.00 174.62 175.73 1n80 n ASP 63 N 4.45 4.93 -3.79 3.53 4.64 -1.26 -3.77 116.55 125.28 1n80 n ASP 63 Ca -0.16 -2.92 -0.09 0.00 -1.38 0.00 0.00 54.79 50.23 1n80 n ASP 63 Cb 0.52 -1.73 -0.04 0.00 -1.04 0.00 0.00 41.12 38.83 1n80 n ASP 63 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 1n80 s SER 64 N 4.05 -0.23 0.34 1.67 1.04 -1.26 -4.97 113.70 114.34 1n80 s SER 64 Ca 0.53 -0.56 0.11 0.00 0.48 0.00 0.00 55.95 56.51 1n80 s SER 64 Cb 0.04 0.59 0.92 0.00 0.10 0.00 0.00 66.02 67.67 1n80 s SER 64 CO 0.07 -1.09 1.75 0.58 0.98 0.00 0.00 173.24 175.53 1n80 h VAL 65 N 2.20 0.57 0.30 5.02 2.07 -2.00 0.00 116.25 124.41 1n80 h VAL 65 Ca -0.27 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 1n80 h VAL 65 Cb 1.26 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1n80 h VAL 65 CO 0.36 0.10 -0.15 0.25 0.02 0.00 0.00 177.57 178.16 1n80 h LEU 66 N 0.56 -0.34 -0.91 2.57 5.85 -1.95 -1.30 115.31 119.78 1n80 h LEU 66 Ca 0.62 -0.13 0.09 0.00 0.84 0.00 0.00 57.88 59.30 1n80 h LEU 66 Cb 1.24 0.09 -0.07 0.00 0.37 0.00 0.00 40.66 42.29 1n80 h LEU 66 CO -0.40 -0.05 0.56 1.23 -0.34 0.00 0.00 178.44 179.43 1n80 h GLY 67 N -0.65 1.43 0.84 3.75 0.00 -1.26 0.28 103.07 107.47 1n80 h GLY 67 Ca -0.04 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 46.90 1n80 h GLY 67 CO 0.07 0.19 -0.01 -2.08 0.00 0.00 0.00 176.54 174.71 1n80 h VAL 68 N 0.94 1.10 -0.44 4.60 2.07 -1.01 -0.52 116.25 122.98 1n80 h VAL 68 Ca 0.43 -0.38 0.06 0.00 0.82 0.00 0.00 66.70 67.63 1n80 h VAL 68 Cb 0.35 1.35 -0.05 0.00 -1.52 0.00 0.00 31.29 31.42 1n80 h VAL 68 CO -0.23 0.10 0.16 0.74 0.02 0.00 0.00 177.57 178.35 1n80 h THR 69 N -0.19 0.86 -0.01 2.57 2.02 -0.49 -0.42 112.91 117.24 1n80 h THR 69 Ca -0.00 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.07 1n80 h THR 69 Cb 0.18 0.51 -0.00 0.00 -1.74 0.00 0.00 68.15 67.10 1n80 h THR 69 CO 0.01 0.06 0.01 -0.78 0.37 0.00 0.00 175.52 175.19 1n80 h ASP 70 N 0.33 0.00 0.77 4.18 1.82 -0.20 -0.49 116.42 122.83 1n80 h ASP 70 Ca 0.21 0.00 -0.22 0.00 -0.39 0.00 0.00 57.03 56.62 1n80 h ASP 70 Cb 0.20 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.19 1n80 h ASP 70 CO -0.21 0.00 -1.03 -0.03 -1.61 0.00 0.00 179.24 176.36 1n80 h MET 71 N 0.00 0.13 -0.16 0.28 4.05 0.51 -3.25 114.93 116.50 1n80 h MET 71 Ca 0.01 -0.20 -0.15 0.00 -0.28 0.00 0.00 59.70 59.08 1n80 h MET 71 Cb 0.03 0.07 0.00 0.00 -0.80 0.00 0.00 31.60 30.90 1n80 h MET 71 CO -0.00 1.05 -0.50 -1.49 0.23 0.00 0.00 176.91 176.20 1n80 h TRP 72 N 0.05 0.81 -0.21 1.39 4.06 -0.25 -2.93 115.95 118.86 1n80 h TRP 72 Ca -0.06 -0.33 0.06 0.00 2.06 0.00 0.00 58.89 60.62 1n80 h TRP 72 Cb 1.75 -0.14 -0.07 0.00 -1.00 0.00 0.00 29.16 29.70 1n80 h TRP 72 CO 0.03 1.11 -0.30 1.15 -3.56 0.00 0.00 178.44 176.86 1n80 h THR 73 N 0.29 0.30 -0.28 1.49 2.02 -1.20 -2.08 112.91 113.45 1n80 h THR 73 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1n80 h THR 73 Cb 1.12 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 1n80 h THR 73 CO 0.11 0.00 0.00 1.41 0.37 0.00 0.00 175.52 177.41 1n80 n HIS 74 N -5.40 0.38 -2.24 3.16 8.25 -1.23 -4.93 115.22 113.22 1n80 n HIS 74 Ca -0.02 -0.19 -0.41 0.00 -0.26 0.00 0.00 57.72 56.84 1n80 n HIS 74 Cb 0.32 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.40 1n80 n HIS 74 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 1n80 s MET 75 N -1.62 4.43 -0.18 -0.41 0.00 -0.79 0.15 119.30 120.88 1n80 s MET 75 Ca 0.19 2.06 -0.06 0.00 0.00 0.00 0.00 55.69 57.88 1n80 s MET 75 Cb 0.10 -3.15 -0.09 0.00 0.00 0.00 0.00 34.83 31.69 1n80 s MET 75 CO 0.13 -0.13 -0.21 -1.33 0.00 0.00 0.00 175.02 173.48 1n80 n MET 76 N 1.68 0.40 -4.09 4.11 2.81 0.76 -4.86 117.12 117.93 1n80 n MET 76 Ca 0.02 0.15 -0.12 0.00 -1.81 0.00 0.00 57.70 55.94 1n80 n MET 76 Cb 0.43 -1.21 -0.06 0.00 -0.71 0.00 0.00 33.22 31.67 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 -5.43 1.10 -0.16 3.03 0.00 -0.65 -4.29 107.32 100.92 1n80 s GLY 77 Ca -0.25 -1.32 -0.09 0.00 0.00 0.00 0.00 44.72 43.07 1n80 s GLY 77 CO 0.34 -0.97 0.38 -0.51 0.00 0.00 0.00 173.10 172.34 1n80 s THR 78 N -3.80 -0.04 -0.04 0.90 -4.23 -1.17 -1.50 115.64 105.77 1n80 s THR 78 Ca 0.30 0.10 0.07 0.00 -1.18 0.00 0.00 61.69 60.98 1n80 s THR 78 Cb 0.02 -0.57 -0.01 0.00 1.34 0.00 0.00 72.50 73.27 1n80 s THR 78 CO 0.13 0.04 -0.24 -0.69 -0.54 0.00 0.00 174.62 173.32 1n80 s VAL 79 N 1.40 1.96 0.34 2.29 1.01 -0.35 -2.25 120.40 124.81 1n80 s VAL 79 Ca -0.09 -1.03 -0.27 0.00 0.00 0.00 0.00 61.98 60.58 1n80 s VAL 79 Cb -0.09 -1.65 -0.09 0.00 0.00 0.00 0.00 36.38 34.55 1n80 s VAL 79 CO -0.12 0.55 1.10 -0.75 0.00 0.00 0.00 175.10 175.88 1n80 s LYS 80 N -0.32 4.36 -0.15 2.72 2.20 -0.90 -1.27 119.74 126.37 1n80 s LYS 80 Ca 0.02 1.71 -0.05 0.00 -0.36 0.00 0.00 55.97 57.29 1n80 s LYS 80 Cb -0.12 -2.86 -0.04 0.00 -1.51 0.00 0.00 37.83 33.30 1n80 s LYS 80 CO 0.02 -0.02 0.02 0.08 -0.36 0.00 0.00 175.35 175.09 1n80 s VAL 81 N -1.38 4.44 0.14 4.02 1.01 -0.81 -4.92 120.40 122.90 1n80 s VAL 81 Ca 0.52 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.36 1n80 s VAL 81 Cb -0.28 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 1n80 s VAL 81 CO 0.36 0.51 0.19 -0.76 0.00 0.00 0.00 175.10 175.40 1n80 s LEU 82 N 0.06 4.06 0.45 3.92 1.43 -1.26 -4.52 118.68 122.82 1n80 s LEU 82 Ca 0.03 0.04 0.18 0.00 -1.03 0.00 0.00 54.13 53.35 1n80 s LEU 82 Cb -0.13 -2.66 1.14 0.00 0.03 0.00 0.00 46.19 44.57 1n80 s LEU 82 CO 0.02 0.08 1.94 1.55 0.23 0.00 0.00 176.35 180.16 1n80 h PRO 83 N 2.47 0.30 0.00 1.29 0.13 -1.94 0.39 132.00 134.64 1n80 h PRO 83 Ca -0.48 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1n80 h PRO 83 Cb 1.19 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1n80 h PRO 83 CO 0.67 0.20 0.00 -1.13 -0.23 0.00 0.00 178.00 177.51 1n80 n SER 84 N -4.45 0.00 -0.38 1.44 3.41 -1.26 -0.89 113.62 111.49 1n80 n SER 84 Ca 0.13 0.36 0.12 0.00 -0.26 0.00 0.00 58.87 59.23 1n80 n SER 84 Cb 0.56 -0.39 0.25 0.00 -0.26 0.00 0.00 64.21 64.37 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 -1.39 1.09 -4.51 4.33 2.81 0.14 -4.90 117.12 114.69 1n80 n MET 85 Ca 0.02 -0.76 -0.33 0.00 -1.81 0.00 0.00 57.70 54.81 1n80 n MET 85 Cb 0.04 -1.48 -0.13 0.00 -0.71 0.00 0.00 33.22 30.94 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 -2.43 3.11 -0.03 4.03 1.43 -0.07 -0.38 118.68 124.34 1n80 s LEU 86 Ca 0.24 -0.18 0.06 0.00 -1.03 0.00 0.00 54.13 53.22 1n80 s LEU 86 Cb 0.19 -1.74 -0.01 0.00 0.03 0.00 0.00 46.19 44.66 1n80 s LEU 86 CO 0.51 0.17 -0.22 -1.81 0.23 0.00 0.00 176.35 175.23 1n80 s ASP 87 N 0.34 2.67 0.01 2.29 1.01 -0.54 -4.96 116.67 117.49 1n80 s ASP 87 Ca -0.06 -0.42 -0.29 0.00 0.71 0.00 0.00 52.55 52.49 1n80 s ASP 87 Cb -0.15 -0.44 -0.04 0.00 1.01 0.00 0.00 42.92 43.30 1n80 s ASP 87 CO 0.04 0.26 0.92 0.00 0.21 0.00 0.00 175.17 176.59 1n80 s ALA 88 N -0.38 3.21 0.11 5.23 0.00 -1.26 -0.80 121.76 127.88 1n80 s ALA 88 Ca 0.05 0.46 0.01 0.00 0.00 0.00 0.00 51.96 52.49 1n80 s ALA 88 Cb -0.10 -3.25 -0.04 0.00 0.00 0.00 0.00 23.12 19.73 1n80 s ALA 88 CO 0.00 -0.16 -0.04 0.14 0.00 0.00 0.00 175.76 175.70 1n80 s VAL 89 N 0.75 0.64 0.23 0.00 -7.23 -0.67 -0.88 120.40 113.24 1n80 s VAL 89 Ca 0.48 -1.94 0.00 0.00 -1.81 0.00 0.00 61.98 58.72 1n80 s VAL 89 Cb -0.21 -1.79 -0.04 0.00 0.56 0.00 0.00 36.38 34.90 1n80 s VAL 89 CO 0.26 -0.77 0.13 0.27 -0.31 0.00 0.00 175.10 174.68 1n80 s ILE 90 N -3.67 0.21 0.31 -0.62 -4.36 -0.88 -3.90 121.20 108.30 1n80 s ILE 90 Ca 0.15 -2.00 -0.29 0.00 -0.26 0.00 0.00 60.65 58.25 1n80 s ILE 90 Cb 0.06 -2.55 -0.10 0.00 1.25 0.00 0.00 42.46 41.12 1n80 s ILE 90 CO -0.03 0.00 1.36 -2.84 0.24 0.00 0.00 174.94 173.67 1n80 s PRO 91 N -4.07 4.31 -0.38 0.37 0.02 -1.26 -2.10 135.00 131.89 1n80 s PRO 91 Ca 0.38 2.28 -0.18 0.00 0.02 0.00 0.00 61.00 63.50 1n80 s PRO 91 Cb 0.07 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.52 1n80 s PRO 91 CO 0.14 -0.29 0.50 0.50 -0.33 0.00 0.00 177.00 177.52 1n80 s ARG 92 N -1.43 3.46 -0.36 5.54 3.52 0.70 -4.68 118.95 125.69 1n80 s ARG 92 Ca 0.52 -0.33 0.01 0.00 -0.13 0.00 0.00 55.73 55.80 1n80 s ARG 92 Cb -0.41 -3.86 0.10 0.00 -1.56 0.00 0.00 34.95 29.22 1n80 s ARG 92 CO 0.51 -0.72 0.10 0.50 -0.81 0.00 0.00 175.30 174.88 1n80 s ARG 93 N 2.37 1.75 -0.10 5.12 6.06 -1.26 -4.80 118.95 128.08 1n80 s ARG 93 Ca 0.17 -1.81 -0.26 0.00 -2.50 0.00 0.00 55.73 51.33 1n80 s ARG 93 Cb -0.16 -3.34 -0.02 0.00 0.06 0.00 0.00 34.95 31.49 1n80 s ARG 93 CO 0.14 -0.97 0.82 -0.51 -2.50 0.00 0.00 175.30 172.29 1n80 s ASP 94 N 1.28 7.05 0.57 -2.12 -0.00 -1.26 -1.47 116.67 120.72 1n80 s ASP 94 Ca 0.09 1.28 -0.20 0.00 -0.00 0.00 0.00 52.55 53.72 1n80 s ASP 94 Cb -0.21 -2.47 -0.06 0.00 -0.00 0.00 0.00 42.92 40.19 1n80 s ASP 94 CO -0.06 -0.29 1.01 1.87 -0.00 0.00 0.00 175.17 177.70 1n80 n TRP 95 N 4.53 1.02 -1.06 4.23 -0.00 -0.60 -2.42 117.44 123.14 1n80 n TRP 95 Ca 0.03 0.45 -0.07 0.00 -0.00 0.00 0.00 57.50 57.91 1n80 n TRP 95 Cb 0.50 -2.17 -0.03 0.00 -0.00 0.00 0.00 31.31 29.60 1n80 n TRP 95 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1n80 n GLY 96 N 1.22 0.71 3.53 5.87 0.00 -0.04 -4.71 105.19 111.76 1n80 n GLY 96 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.65 6.52 0.00 1.61 3.68 -1.02 -4.82 116.67 121.00 1n80 s ASP 97 Ca 0.00 -1.58 0.04 0.00 2.13 0.00 0.00 52.55 53.14 1n80 s ASP 97 Cb 0.00 -2.52 0.21 0.00 -1.45 0.00 0.00 42.92 39.17 1n80 s ASP 97 CO 0.00 -1.39 0.56 0.35 0.13 0.00 0.00 175.17 174.82 1n80 n THR 98 N 6.46 0.00 1.67 1.71 -2.24 -1.26 -2.16 114.28 118.46 1n80 n THR 98 Ca 0.29 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 62.22 1n80 n THR 98 Cb 0.50 -0.55 0.84 0.00 -2.10 0.00 0.00 70.33 69.02 1n80 n THR 98 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1n80 n ARG 99 N -0.70 0.69 -3.93 -0.78 0.63 -1.26 -4.84 116.66 106.47 1n80 n ARG 99 Ca 0.03 0.00 -0.09 0.00 -0.92 0.00 0.00 57.85 56.87 1n80 n ARG 99 Cb 0.01 -1.50 -0.05 0.00 0.45 0.00 0.00 32.46 31.37 1n80 n ARG 99 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1n80 s TYR 100 N -2.30 0.24 1.14 -0.14 1.51 -0.92 -5.18 117.35 111.70 1n80 s TYR 100 Ca 0.37 -0.60 -0.18 0.00 -1.01 0.00 0.00 57.07 55.65 1n80 s TYR 100 Cb 0.21 0.21 0.14 0.00 -0.11 0.00 0.00 41.96 42.41 1n80 s TYR 100 CO 0.41 -0.94 0.19 -2.30 -1.11 0.00 0.00 175.55 171.81 1n80 n PRO 101 N -0.34 -1.80 -2.17 -1.71 -0.02 -1.26 -4.19 135.00 123.50 1n80 n PRO 101 Ca -0.05 -0.51 0.00 0.00 -2.02 0.00 0.00 63.50 60.93 1n80 n PRO 101 Cb 0.62 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.31 1n80 n PRO 101 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1n80 n ASP 102 N -2.31 0.00 -0.04 2.55 4.64 -1.26 -4.83 116.55 115.30 1n80 n ASP 102 Ca 0.01 0.00 0.14 0.00 -1.38 0.00 0.00 54.79 53.56 1n80 n ASP 102 Cb 0.61 0.00 0.53 0.00 -1.04 0.00 0.00 41.12 41.21 1n80 n ASP 102 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 1n80 n PRO 103 N -0.39 0.24 0.00 -0.67 -0.04 -1.26 -4.19 135.00 128.68 1n80 n PRO 103 Ca 0.00 -0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 1n80 n PRO 103 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 1n80 n PRO 103 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1n80 n TYR 104 N -1.32 0.00 -4.17 0.54 4.01 -1.26 -0.86 117.16 114.09 1n80 n TYR 104 Ca 0.09 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.49 1n80 n TYR 104 Cb 0.31 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 39.22 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 -0.25 3.82 0.23 -0.72 2.01 -1.26 0.16 115.64 119.63 1n80 s THR 105 Ca 0.00 -0.37 0.06 0.00 0.31 0.00 0.00 61.69 61.70 1n80 s THR 105 Cb 0.00 -2.71 -0.05 0.00 0.01 0.00 0.00 72.50 69.75 1n80 s THR 105 CO 0.00 0.45 -0.09 -0.36 -0.69 0.00 0.00 174.62 173.93 1n80 s PHE 106 N 0.87 1.74 0.45 4.92 0.08 -1.26 -4.93 117.98 119.85 1n80 s PHE 106 Ca -0.00 -0.69 0.05 0.00 0.12 0.00 0.00 56.93 56.42 1n80 s PHE 106 Cb -0.14 -0.92 -0.04 0.00 -0.57 0.00 0.00 43.02 41.34 1n80 s PHE 106 CO 0.02 0.25 0.11 1.03 -0.10 0.00 0.00 175.22 176.52 1n80 s ARG 107 N -3.72 2.14 0.25 0.44 3.00 -1.26 -4.66 118.95 115.15 1n80 s ARG 107 Ca 0.26 -2.09 -0.30 0.00 0.00 0.00 0.00 55.73 53.60 1n80 s ARG 107 Cb 0.02 -1.77 -0.09 0.00 0.00 0.00 0.00 34.95 33.11 1n80 s ARG 107 CO 0.08 -0.21 1.26 0.42 0.00 0.00 0.00 175.30 176.85 1n80 s ILE 108 N -2.72 3.14 -0.13 1.52 1.01 -1.26 -2.88 121.20 119.88 1n80 s ILE 108 Ca 0.29 1.04 0.00 0.00 0.00 0.00 0.00 60.65 61.98 1n80 s ILE 108 Cb 0.05 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.85 1n80 s ILE 108 CO 0.16 0.20 0.00 0.59 0.00 0.00 0.00 174.94 175.89 1n80 n ASN 109 N 1.78 -3.37 -4.76 3.58 3.02 0.13 -4.95 115.26 110.68 1n80 n ASN 109 Ca 0.03 0.03 -0.39 0.00 -0.03 0.00 0.00 54.58 54.22 1n80 n ASN 109 Cb 0.43 -0.97 -0.06 0.00 -0.61 0.00 0.00 39.78 38.57 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 -2.42 7.43 -0.32 6.41 1.11 -1.14 -4.76 116.67 122.98 1n80 s ASP 110 Ca 0.00 1.97 -0.08 0.00 0.18 0.00 0.00 52.55 54.62 1n80 s ASP 110 Cb 0.00 -2.60 0.02 0.00 1.07 0.00 0.00 42.92 41.41 1n80 s ASP 110 CO 0.00 -0.00 0.12 -0.63 1.18 0.00 0.00 175.17 175.83 1n80 s ILE 111 N -1.35 4.10 0.08 0.77 1.01 -1.26 -1.44 121.20 123.10 1n80 s ILE 111 Ca 0.46 -0.80 0.10 0.00 0.00 0.00 0.00 60.65 60.41 1n80 s ILE 111 Cb -0.24 -3.19 -0.03 0.00 0.01 0.00 0.00 42.46 39.00 1n80 s ILE 111 CO 0.30 -0.04 -0.26 -0.69 0.00 0.00 0.00 174.94 174.26 1n80 s VAL 112 N 1.50 2.25 -0.13 2.92 1.01 -0.32 -4.32 120.40 123.31 1n80 s VAL 112 Ca 0.02 -1.54 -0.03 0.00 0.00 0.00 0.00 61.98 60.42 1n80 s VAL 112 Cb -0.18 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 1n80 s VAL 112 CO 0.04 0.24 -0.01 -0.69 0.00 0.00 0.00 175.10 174.68 1n80 s VAL 113 N -0.93 4.18 0.47 2.92 1.01 -0.54 -0.80 120.40 126.71 1n80 s VAL 113 Ca 0.13 -0.27 0.03 0.00 0.00 0.00 0.00 61.98 61.87 1n80 s VAL 113 Cb -0.10 -2.81 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 1n80 s VAL 113 CO 0.04 0.53 0.02 0.00 0.00 0.00 0.00 175.10 175.70 1n80 n ASN 115 N -1.19 -5.41 -0.07 0.00 5.15 -1.11 -1.66 115.26 110.96 1n80 n ASN 115 Ca -0.14 -0.30 0.01 0.00 -0.60 0.00 0.00 54.58 53.55 1n80 n ASN 115 Cb 0.67 -4.40 0.01 0.00 -0.53 0.00 0.00 39.78 35.52 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 -2.44 1.18 -3.49 1.20 3.41 -1.26 -4.18 113.62 108.04 1n80 n SER 116 Ca -0.09 -1.11 -0.10 0.00 -0.26 0.00 0.00 58.87 57.32 1n80 n SER 116 Cb 0.60 -0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.53 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 -0.18 -1.71 0.28 7.33 0.00 -1.26 -4.98 121.76 121.24 1n80 s ALA 117 Ca 0.02 0.72 0.02 0.00 0.00 0.00 0.00 51.96 52.72 1n80 s ALA 117 Cb 0.02 0.63 0.58 0.00 0.00 0.00 0.00 23.12 24.34 1n80 s ALA 117 CO 0.02 -0.75 1.81 -1.00 0.00 0.00 0.00 175.76 175.85 1n80 h PRO 118 N 2.00 0.87 0.00 0.00 0.13 -1.98 0.57 132.00 133.59 1n80 h PRO 118 Ca -0.27 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1n80 h PRO 118 Cb 1.27 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1n80 h PRO 118 CO 0.33 0.58 0.00 2.48 -0.23 0.00 0.00 178.00 181.16 1n80 n TYR 119 N -4.68 0.58 -0.08 1.56 4.11 -1.26 -2.90 117.16 114.49 1n80 n TYR 119 Ca 0.19 0.24 -0.08 0.00 -0.00 0.00 0.00 57.90 58.25 1n80 n TYR 119 Cb 0.40 -0.88 -0.16 0.00 -0.00 0.00 0.00 39.34 38.70 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 -2.04 0.09 -2.38 9.48 3.02 0.16 -4.86 115.26 118.74 1n80 n ASN 120 Ca 0.02 0.04 -0.28 0.00 -0.03 0.00 0.00 54.58 54.33 1n80 n ASN 120 Cb 0.19 0.96 -0.03 0.00 -0.61 0.00 0.00 39.78 40.30 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 -2.69 -2.09 -0.02 5.41 0.00 0.84 -2.74 120.51 119.23 1n80 n ALA 121 Ca -0.29 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1n80 n ALA 121 Cb 1.10 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 19.65 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 0.36 0.00 -3.21 0.00 -2.24 -1.26 -4.82 114.28 103.11 1n80 n THR 122 Ca 0.10 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.88 1n80 n THR 122 Cb 0.09 0.01 -0.02 0.00 -2.10 0.00 0.00 70.33 68.31 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 0.51 0.14 -0.78 2.12 -1.26 -4.89 118.70 114.53 1n80 s GLU 123 Ca 0.00 0.53 -0.31 0.00 0.36 0.00 0.00 54.97 55.55 1n80 s GLU 123 Cb 0.00 0.10 -0.09 0.00 0.26 0.00 0.00 34.13 34.40 1n80 s GLU 123 CO 0.00 -0.92 1.51 0.45 -0.54 0.00 0.00 175.26 175.76 1n80 s SER 124 N 2.74 6.67 0.00 -1.70 0.15 -1.26 -2.65 113.70 117.65 1n80 s SER 124 Ca 0.12 2.51 0.00 0.00 0.70 0.00 0.00 55.95 59.28 1n80 s SER 124 Cb -0.12 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.60 1n80 s SER 124 CO -0.25 -0.77 0.00 0.61 1.20 0.00 0.00 173.24 174.03 1n80 n GLY 125 N 3.68 0.73 3.82 9.45 0.00 -1.26 -5.06 105.19 116.55 1n80 n GLY 125 Ca 0.13 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.42 3.79 0.27 4.61 0.00 -1.08 -5.13 121.76 121.79 1n80 s ALA 126 Ca 0.00 -1.80 0.00 0.00 0.00 0.00 0.00 51.96 50.16 1n80 s ALA 126 Cb 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 23.12 22.17 1n80 s ALA 126 CO 0.00 -0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.11 1n80 n GLY 127 N -1.35 1.11 3.66 0.00 0.00 -1.26 -5.01 105.19 102.35 1n80 n GLY 127 Ca -0.01 -2.00 -0.45 0.00 0.00 0.00 0.00 46.02 43.56 1n80 n GLY 127 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1n80 n TRP 128 N -1.21 2.10 -4.82 1.61 7.02 -1.23 -4.78 117.44 116.13 1n80 n TRP 128 Ca 0.00 0.45 -0.33 0.00 -1.02 0.00 0.00 57.50 56.60 1n80 n TRP 128 Cb 0.00 -2.45 -0.14 0.00 -2.42 0.00 0.00 31.31 26.30 1n80 n TRP 128 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1n80 s LEU 129 N 0.17 2.68 -0.09 -0.99 1.43 -0.67 -1.63 118.68 119.58 1n80 s LEU 129 Ca 0.69 -0.32 0.00 0.00 -1.03 0.00 0.00 54.13 53.47 1n80 s LEU 129 Cb -0.67 -1.59 -0.03 0.00 0.03 0.00 0.00 46.19 43.94 1n80 s LEU 129 CO 0.49 0.19 -0.08 -0.69 0.23 0.00 0.00 176.35 176.50 1n80 s VAL 130 N 0.19 3.58 0.07 -1.59 1.01 -0.28 0.21 120.40 123.59 1n80 s VAL 130 Ca -0.08 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.40 1n80 s VAL 130 Cb -0.15 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.71 1n80 s VAL 130 CO 0.05 0.57 -0.06 -0.31 0.00 0.00 0.00 175.10 175.35 1n80 s TYR 131 N -0.40 0.71 -0.01 5.22 2.02 0.02 -0.05 117.35 124.86 1n80 s TYR 131 Ca 0.06 -0.81 0.05 0.00 -0.37 0.00 0.00 57.07 55.99 1n80 s TYR 131 Cb -0.12 -0.44 -0.03 0.00 -0.40 0.00 0.00 41.96 40.97 1n80 s TYR 131 CO 0.02 -0.18 -0.15 0.50 -1.57 0.00 0.00 175.55 174.17 1n80 s ARG 132 N -3.11 2.35 -0.18 -0.62 3.52 -0.51 -1.17 118.95 119.23 1n80 s ARG 132 Ca 0.03 -0.81 -0.26 0.00 -0.13 0.00 0.00 55.73 54.56 1n80 s ARG 132 Cb 0.01 -2.32 -0.01 0.00 -1.56 0.00 0.00 34.95 31.07 1n80 s ARG 132 CO -0.04 0.59 0.89 0.00 -0.81 0.00 0.00 175.30 175.92 1n80 n LEU 134 N 5.43 1.87 -3.86 0.00 4.77 -0.76 0.21 117.00 124.67 1n80 n LEU 134 Ca 0.06 0.46 -0.14 0.00 -0.03 0.00 0.00 56.01 56.36 1n80 n LEU 134 Cb 0.48 -0.88 -0.15 0.00 -2.33 0.00 0.00 43.42 40.54 1n80 n LEU 134 CO 0.49 0.05 -0.37 -0.62 -1.33 0.00 0.00 177.39 175.62 1n80 s ASP 135 N -6.55 0.15 0.46 -1.43 3.68 -1.17 -4.79 116.67 107.03 1n80 s ASP 135 Ca -0.27 -0.01 0.07 0.00 2.13 0.00 0.00 52.55 54.47 1n80 s ASP 135 Cb 0.06 -0.05 -0.01 0.00 -1.45 0.00 0.00 42.92 41.48 1n80 s ASP 135 CO 0.45 -0.03 0.33 0.68 0.13 0.00 0.00 175.17 176.73 1n80 s VAL 136 N 0.31 2.16 0.72 1.11 -7.23 -1.26 0.13 120.40 116.35 1n80 s VAL 136 Ca -0.03 -1.50 -0.15 0.00 -1.81 0.00 0.00 61.98 58.49 1n80 s VAL 136 Cb -0.04 -2.67 0.03 0.00 0.56 0.00 0.00 36.38 34.26 1n80 s VAL 136 CO -0.01 0.00 1.20 -2.84 -0.31 0.00 0.00 175.10 173.15 1n80 s PRO 137 N -4.12 2.22 -1.09 4.82 0.02 -1.26 -4.85 135.00 130.74 1n80 s PRO 137 Ca 0.40 1.75 -0.04 0.00 0.02 0.00 0.00 61.00 63.14 1n80 s PRO 137 Cb -0.01 -1.84 0.29 0.00 0.02 0.00 0.00 34.50 32.96 1n80 s PRO 137 CO 0.24 -1.77 1.66 -3.47 -0.33 0.00 0.00 177.00 173.32 1n80 n ASP 138 N -2.63 6.66 -2.74 2.53 -0.08 -1.26 -4.58 116.55 114.45 1n80 n ASP 138 Ca 0.13 -3.46 -0.07 0.00 -1.51 0.00 0.00 54.79 49.89 1n80 n ASP 138 Cb 0.50 -1.26 0.04 0.00 2.34 0.00 0.00 41.12 42.74 1n80 n ASP 138 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 1n80 n THR 139 N 1.11 0.00 -2.73 5.18 5.66 -1.26 -5.02 114.28 117.22 1n80 n THR 139 Ca 0.35 -1.26 0.00 0.00 -3.05 0.00 0.00 64.05 60.09 1n80 n THR 139 Cb 0.31 1.31 0.00 0.00 -1.55 0.00 0.00 70.33 70.40 1n80 n THR 139 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1n80 n GLY 140 N 1.98 2.19 0.00 1.09 0.00 -1.26 0.57 105.19 109.76 1n80 n GLY 140 Ca 0.11 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.23 1n80 n GLY 140 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1n80 n MET 141 N 0.00 2.31 -3.61 1.61 2.81 -0.68 -4.89 117.12 114.67 1n80 n MET 141 Ca 0.00 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.88 1n80 n MET 141 Cb 0.00 0.00 -0.01 0.00 -0.71 0.00 0.00 33.22 32.50 1n80 n MET 141 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1n80 h SER 143 N 2.00 -0.13 -3.58 0.00 0.02 -1.89 -3.41 113.55 106.56 1n80 h SER 143 Ca -0.18 -0.25 -0.62 0.00 -0.84 0.00 0.00 61.79 59.91 1n80 h SER 143 Cb 1.18 0.03 -0.13 0.00 0.14 0.00 0.00 62.40 63.62 1n80 h SER 143 CO 0.25 0.18 0.00 -0.63 -1.14 0.00 0.00 176.83 175.49 1n80 s ILE 144 N -4.94 5.05 0.59 3.27 1.01 -1.26 -4.94 121.20 119.97 1n80 s ILE 144 Ca -0.15 0.84 0.29 0.00 0.00 0.00 0.00 60.65 61.63 1n80 s ILE 144 Cb 0.03 -3.86 0.37 0.00 0.01 0.00 0.00 42.46 39.01 1n80 s ILE 144 CO 0.63 0.04 2.03 0.00 0.00 0.00 0.00 174.94 177.63 1n80 h ALA 145 N 8.07 1.94 -3.00 9.38 0.00 -2.01 -3.23 119.26 130.40 1n80 h ALA 145 Ca -0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1n80 h ALA 145 Cb 1.14 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1n80 h ALA 145 CO 0.73 -0.44 0.00 0.43 0.00 0.00 0.00 179.25 179.97 1n80 n SER 146 N -3.78 0.00 -4.50 0.00 7.64 -1.26 -4.49 113.62 107.23 1n80 n SER 146 Ca 0.04 0.34 -0.41 0.00 1.01 0.00 0.00 58.87 59.85 1n80 n SER 146 Cb 0.44 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.55 1n80 n SER 146 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1n80 n LEU 147 N -0.42 1.38 -0.13 -3.43 4.77 -1.22 -4.75 117.00 113.19 1n80 n LEU 147 Ca 0.00 -0.04 0.13 0.00 -0.03 0.00 0.00 56.01 56.07 1n80 n LEU 147 Cb 0.00 -1.23 0.35 0.00 -2.33 0.00 0.00 43.42 40.21 1n80 n LEU 147 CO 0.00 -1.06 0.59 0.35 -1.33 0.00 0.00 177.39 175.95 1n80 n THR 148 N 7.62 0.00 -3.80 -5.08 -2.24 -1.26 -4.74 114.28 104.79 1n80 n THR 148 Ca 0.51 -0.07 -0.37 0.00 -2.27 0.00 0.00 64.05 61.85 1n80 n THR 148 Cb 0.26 0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 68.71 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 -2.72 6.46 0.06 3.42 -1.08 -1.26 -4.96 116.67 116.59 1n80 s ASP 149 Ca 0.19 0.55 -0.25 0.00 -0.52 0.00 0.00 52.55 52.52 1n80 s ASP 149 Cb 0.19 -2.10 -0.17 0.00 -1.46 0.00 0.00 42.92 39.37 1n80 s ASP 149 CO 0.59 0.38 1.58 0.50 0.52 0.00 0.00 175.17 178.74 1n80 h LYS 150 N 5.04 -0.12 -0.32 4.34 3.64 -1.92 -1.64 116.57 125.59 1n80 h LYS 150 Ca -0.53 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 58.92 1n80 h LYS 150 Cb 1.22 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.99 1n80 h LYS 150 CO 0.60 0.04 -0.40 -0.44 -2.27 0.00 0.00 179.45 176.98 1n80 h ASP 151 N -0.26 -1.31 -0.88 4.20 5.19 -1.99 0.59 116.42 121.97 1n80 h ASP 151 Ca -0.01 0.20 0.07 0.00 -0.62 0.00 0.00 57.03 56.67 1n80 h ASP 151 Cb 0.21 0.57 -0.06 0.00 0.18 0.00 0.00 39.33 40.23 1n80 h ASP 151 CO 0.02 -0.37 0.57 -0.33 -3.12 0.00 0.00 179.24 176.01 1n80 h GLU 152 N -0.35 0.93 -1.68 3.56 4.39 -1.95 -1.18 114.58 118.30 1n80 h GLU 152 Ca 0.13 -0.06 -0.17 0.00 0.34 0.00 0.00 59.36 59.60 1n80 h GLU 152 Cb 0.58 -0.21 -0.08 0.00 -0.10 0.00 0.00 28.75 28.95 1n80 h GLU 152 CO -0.51 0.62 0.22 0.00 -1.16 0.00 0.00 179.01 178.18 1n80 n LEU 154 N 0.80 0.00 -0.08 0.00 4.77 -0.55 -3.07 117.00 118.88 1n80 n LEU 154 Ca 0.16 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 56.09 1n80 n LEU 154 Cb 0.56 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.79 1n80 n LEU 154 CO 0.20 0.00 0.79 0.50 -1.33 0.00 0.00 177.39 177.55 1n80 h LYS 155 N 0.00 0.74 -2.67 3.23 1.63 -1.12 -3.41 116.57 114.97 1n80 h LYS 155 Ca 0.00 -0.25 -0.46 0.00 -0.85 0.00 0.00 60.65 59.09 1n80 h LYS 155 Cb 0.00 -0.06 -0.38 0.00 -0.60 0.00 0.00 32.23 31.19 1n80 h LYS 155 CO 0.00 0.84 -0.73 -0.48 -3.45 0.00 0.00 179.45 175.62 1n80 s LEU 156 N -8.99 0.30 0.00 5.20 0.05 -1.25 -4.93 118.68 109.07 1n80 s LEU 156 Ca -0.09 -1.02 0.00 0.00 0.05 0.00 0.00 54.13 53.07 1n80 s LEU 156 Cb 0.14 -0.10 0.00 0.00 -2.05 0.00 0.00 46.19 44.18 1n80 s LEU 156 CO 0.82 -0.41 0.00 0.61 -0.55 0.00 0.00 176.35 176.82 1n80 n GLY 157 N 5.27 0.00 3.54 -3.48 0.00 -1.26 -4.90 105.19 104.36 1n80 n GLY 157 Ca -0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 1n80 n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n80 n GLY 158 N -1.30 -0.82 2.84 -0.02 0.00 -1.26 -4.91 105.19 99.71 1n80 n GLY 158 Ca 0.00 0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1n80 n GLY 158 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1n80 s LYS 159 N -2.02 1.14 -0.16 1.61 2.47 -1.17 -4.35 119.74 117.25 1n80 s LYS 159 Ca 0.66 -0.74 -0.15 0.00 -1.56 0.00 0.00 55.97 54.19 1n80 s LYS 159 Cb -0.53 -2.35 -0.04 0.00 -1.46 0.00 0.00 37.83 33.44 1n80 s LYS 159 CO 0.55 -0.63 0.35 -0.46 0.16 0.00 0.00 175.35 175.31 1n80 s TRP 160 N 1.61 3.45 -0.31 4.03 -0.11 -1.26 -2.98 118.94 123.37 1n80 s TRP 160 Ca -0.03 0.65 -0.01 0.00 1.22 0.00 0.00 56.10 57.93 1n80 s TRP 160 Cb -0.18 -2.42 0.10 0.00 -1.50 0.00 0.00 33.47 29.47 1n80 s TRP 160 CO -0.08 0.17 0.10 -0.08 -4.62 0.00 0.00 176.95 172.44 1n80 s THR 161 N 0.69 0.89 0.67 5.86 -1.32 -1.25 -4.71 115.64 116.46 1n80 s THR 161 Ca 0.19 -1.41 -0.17 0.00 -1.21 0.00 0.00 61.69 59.09 1n80 s THR 161 Cb -0.14 -1.68 0.00 0.00 -1.51 0.00 0.00 72.50 69.18 1n80 s THR 161 CO 0.06 -0.68 1.20 -2.16 -2.21 0.00 0.00 174.62 170.83 1n80 s PRO 162 N 1.61 2.54 0.04 7.08 0.04 -1.26 -1.69 135.00 143.35 1n80 s PRO 162 Ca 0.10 1.76 0.23 0.00 0.04 0.00 0.00 61.00 63.14 1n80 s PRO 162 Cb -0.17 -1.88 0.20 0.00 0.04 0.00 0.00 34.50 32.68 1n80 s PRO 162 CO -0.25 -1.53 1.17 -1.13 0.04 0.00 0.00 177.00 175.30 1n80 n SER 163 N -2.23 0.63 -4.43 6.66 3.41 0.19 -4.67 113.62 113.19 1n80 n SER 163 Ca 0.13 -0.24 -0.44 0.00 -0.26 0.00 0.00 58.87 58.06 1n80 n SER 163 Cb 0.50 0.56 -0.03 0.00 -0.26 0.00 0.00 64.21 64.98 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 3.37 0.79 7.33 0.00 -1.25 -5.02 121.76 123.85 1n80 s ALA 164 Ca 0.07 -2.52 -0.14 0.00 0.00 0.00 0.00 51.96 49.37 1n80 s ALA 164 Cb 0.15 -3.88 0.06 0.00 0.00 0.00 0.00 23.12 19.45 1n80 s ALA 164 CO 0.77 -2.78 1.10 2.89 0.00 0.00 0.00 175.76 177.73 1n80 n ARG 165 N 6.58 0.27 -1.79 0.00 -4.01 -1.26 -4.84 116.66 111.61 1n80 n ARG 165 Ca 0.12 0.16 -0.41 0.00 -1.04 0.00 0.00 57.85 56.68 1n80 n ARG 165 Cb 0.47 -2.35 -0.00 0.00 -3.04 0.00 0.00 32.46 27.54 1n80 n ARG 165 CO 0.00 0.00 0.00 0.45 -3.04 0.00 0.00 177.63 175.04 1n80 s SER 166 N -1.96 6.32 -0.08 2.89 0.15 0.42 -4.91 113.70 116.53 1n80 s SER 166 Ca 0.73 3.07 0.05 0.00 0.70 0.00 0.00 55.95 60.50 1n80 s SER 166 Cb -0.30 -2.67 -0.09 0.00 -1.71 0.00 0.00 66.02 61.25 1n80 s SER 166 CO 0.51 -0.89 -0.00 0.80 1.20 0.00 0.00 173.24 174.86 1n80 n MET 167 N 0.45 2.10 -4.10 5.44 1.56 -1.26 -4.88 117.12 116.43 1n80 n MET 167 Ca 0.01 0.01 -0.29 0.00 -0.27 0.00 0.00 57.70 57.16 1n80 n MET 167 Cb 0.39 -1.20 -0.17 0.00 2.15 0.00 0.00 33.22 34.39 1n80 n MET 167 CO 0.00 0.00 0.00 -0.08 -0.73 0.00 0.00 175.97 175.16 1n80 s THR 168 N -2.19 1.45 0.41 1.12 -1.32 -1.26 -5.12 115.64 108.73 1n80 s THR 168 Ca -0.06 -0.57 -0.26 0.00 -1.21 0.00 0.00 61.69 59.59 1n80 s THR 168 Cb 0.03 -1.37 -0.09 0.00 -1.51 0.00 0.00 72.50 69.56 1n80 s THR 168 CO 0.30 0.44 1.33 -2.16 -2.21 0.00 0.00 174.62 172.32 1n80 s PRO 169 N 1.41 3.93 0.87 7.08 0.04 -1.26 -4.91 135.00 142.17 1n80 s PRO 169 Ca 0.02 2.22 -0.12 0.00 0.04 0.00 0.00 61.00 63.17 1n80 s PRO 169 Cb -0.13 -2.75 0.10 0.00 0.04 0.00 0.00 34.50 31.75 1n80 s PRO 169 CO -0.08 -0.55 1.01 -0.35 0.04 0.00 0.00 177.00 177.07 1n80 n PRO 170 N 0.10 -0.16 -3.87 0.56 -0.04 -1.26 -5.01 135.00 125.32 1n80 n PRO 170 Ca 0.04 0.02 -0.11 0.00 -0.04 0.00 0.00 63.50 63.41 1n80 n PRO 170 Cb 0.43 -2.29 -0.09 0.00 -0.04 0.00 0.00 33.50 31.51 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 -4.18 0.58 1.13 0.54 -1.05 -1.26 -4.97 118.70 109.49 1n80 s GLU 171 Ca 0.68 -0.52 0.00 0.00 -0.15 0.00 0.00 54.97 54.98 1n80 s GLU 171 Cb -0.26 0.24 0.00 0.00 -0.44 0.00 0.00 34.13 33.67 1n80 s GLU 171 CO 0.57 -0.15 0.00 0.41 0.95 0.00 0.00 175.26 177.04 1n80 n GLY 172 N 1.08 -1.48 0.11 -3.83 0.00 -1.26 -4.46 105.19 95.35 1n80 n GLY 172 Ca -0.21 -1.12 -0.17 0.00 0.00 0.00 0.00 46.02 44.53 1n80 n GLY 172 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1n80 h ARG 173 N 0.00 0.25 0.00 1.61 3.08 -1.98 -3.46 114.38 113.89 1n80 h ARG 173 Ca 0.01 -0.43 0.00 0.00 0.07 0.00 0.00 59.98 59.63 1n80 h ARG 173 Cb 0.56 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.77 1n80 h ARG 173 CO 0.00 1.12 0.00 0.41 -1.07 0.00 0.00 179.97 180.43 1n80 n GLY 174 N 1.66 0.44 3.68 0.04 0.00 -1.26 -4.29 105.19 105.45 1n80 n GLY 174 Ca -0.16 -0.98 -0.31 0.00 0.00 0.00 0.00 46.02 44.57 1n80 n GLY 174 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1n80 s ASP 175 N -4.00 3.07 0.00 1.61 2.15 0.38 -4.73 116.67 115.15 1n80 s ASP 175 Ca 0.00 2.16 0.06 0.00 0.43 0.00 0.00 52.55 55.20 1n80 s ASP 175 Cb 0.00 -2.56 0.34 0.00 -0.30 0.00 0.00 42.92 40.40 1n80 s ASP 175 CO 0.00 -3.00 0.89 0.00 -0.17 0.00 0.00 175.17 172.88 1n80 n ALA 176 N -4.17 1.64 -0.43 3.66 0.00 -1.26 0.17 120.51 120.13 1n80 n ALA 176 Ca 0.12 -0.03 0.03 0.00 0.00 0.00 0.00 53.44 53.55 1n80 n ALA 176 Cb 0.52 -1.10 0.04 0.00 0.00 0.00 0.00 19.45 18.91 1n80 n ALA 176 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1n80 n GLU 177 N -1.09 2.20 -1.13 0.00 1.02 -1.26 -4.64 120.64 115.74 1n80 n GLU 177 Ca 0.04 -1.69 -0.04 0.00 -0.02 0.00 0.00 57.16 55.45 1n80 n GLU 177 Cb 0.03 -1.07 -0.02 0.00 -0.02 0.00 0.00 31.44 30.36 1n80 n GLU 177 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1n80 n GLY 178 N -0.69 0.67 3.69 0.62 0.00 0.46 -4.76 105.19 105.18 1n80 n GLY 178 Ca 0.04 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.94 3.64 -0.06 2.61 2.01 -1.25 -1.56 115.64 119.08 1n80 s THR 179 Ca 0.00 1.05 -0.02 0.00 0.31 0.00 0.00 61.69 63.03 1n80 s THR 179 Cb 0.00 -3.68 0.03 0.00 0.01 0.00 0.00 72.50 68.87 1n80 s THR 179 CO 0.00 0.01 0.04 -0.63 -0.69 0.00 0.00 174.62 173.35 1n80 s ILE 180 N 2.23 0.07 -0.45 1.82 1.01 -0.38 -0.47 121.20 125.03 1n80 s ILE 180 Ca 0.64 0.27 -0.05 0.00 0.00 0.00 0.00 60.65 61.51 1n80 s ILE 180 Cb -0.32 -0.32 0.12 0.00 0.01 0.00 0.00 42.46 41.94 1n80 s ILE 180 CO 0.27 0.17 0.28 -1.61 0.00 0.00 0.00 174.94 174.05 1n80 s GLU 181 N 2.09 2.21 0.00 2.79 2.02 -1.26 -0.98 118.70 125.58 1n80 s GLU 181 Ca 0.05 -1.88 0.11 0.00 0.02 0.00 0.00 54.97 53.27 1n80 s GLU 181 Cb -0.12 -3.71 0.68 0.00 0.10 0.00 0.00 34.13 31.07 1n80 s GLU 181 CO -0.04 -1.12 1.12 -0.35 0.02 0.00 0.00 175.26 174.88 1n80 n PRO 182 N 4.58 0.52 -0.96 0.39 -0.04 -1.25 -4.84 135.00 133.39 1n80 n PRO 182 Ca -0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.43 1n80 n PRO 182 Cb 0.41 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.53 1n80 n PRO 182 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1n80 n GLY 183 N 0.03 0.49 1.45 0.55 0.00 -1.26 -4.88 105.19 101.57 1n80 n GLY 183 Ca 0.08 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.17 4.74 0.00 1.61 5.75 -1.26 -4.92 116.55 122.30 1n80 n ASP 184 Ca 0.00 -2.70 0.00 0.00 -0.01 0.00 0.00 54.79 52.08 1n80 n ASP 184 Cb 0.09 -0.58 0.00 0.00 -1.03 0.00 0.00 41.12 39.60 1n80 n ASP 184 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1n80 n GLY 185 N 0.55 2.96 3.81 6.12 0.00 -1.26 -4.87 105.19 112.50 1n80 n GLY 185 Ca 0.24 -0.43 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.93 3.26 -0.01 1.61 1.51 -1.26 -4.20 117.35 116.34 1n80 s TYR 186 Ca 0.00 1.61 0.06 0.00 -1.01 0.00 0.00 57.07 57.74 1n80 s TYR 186 Cb 0.00 -2.91 -0.02 0.00 -0.11 0.00 0.00 41.96 38.92 1n80 s TYR 186 CO 0.00 -0.28 -0.20 0.08 -1.11 0.00 0.00 175.55 174.05 1n80 s VAL 187 N -2.08 1.56 0.22 0.71 1.01 0.12 -3.86 120.40 118.07 1n80 s VAL 187 Ca 0.62 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.72 1n80 s VAL 187 Cb -0.12 -1.31 -0.05 0.00 0.00 0.00 0.00 36.38 34.91 1n80 s VAL 187 CO 0.16 0.40 0.09 0.26 0.00 0.00 0.00 175.10 176.01 1n80 s TRP 188 N -0.51 1.33 -0.12 5.22 0.52 -0.15 -1.83 118.94 123.40 1n80 s TRP 188 Ca 0.07 -1.21 0.01 0.00 0.02 0.00 0.00 56.10 54.99 1n80 s TRP 188 Cb -0.08 -0.74 0.02 0.00 -1.15 0.00 0.00 33.47 31.52 1n80 s TRP 188 CO -0.00 -0.41 -0.14 -2.00 0.02 0.00 0.00 176.95 174.41 1n80 s GLU 189 N -4.05 2.18 0.10 4.98 2.12 -0.00 -1.25 118.70 122.78 1n80 s GLU 189 Ca 0.35 -0.54 -0.31 0.00 0.36 0.00 0.00 54.97 54.83 1n80 s GLU 189 Cb 0.07 -1.91 -0.07 0.00 0.26 0.00 0.00 34.13 32.48 1n80 s GLU 189 CO 0.11 -0.12 1.31 -0.47 -0.54 0.00 0.00 175.26 175.55 1n80 s TYR 190 N 1.15 3.32 -0.02 5.30 5.04 -0.60 -1.42 117.35 130.12 1n80 s TYR 190 Ca -0.03 1.11 -0.03 0.00 -2.44 0.00 0.00 57.07 55.68 1n80 s TYR 190 Cb -0.14 -3.57 -0.01 0.00 0.35 0.00 0.00 41.96 38.59 1n80 s TYR 190 CO -0.04 -1.91 -0.06 1.28 -1.34 0.00 0.00 175.55 173.48 1n80 n LEU 191 N 3.85 0.36 0.00 6.97 4.77 0.92 -4.81 117.00 129.06 1n80 n LEU 191 Ca 0.10 0.06 -0.04 0.00 -0.03 0.00 0.00 56.01 56.10 1n80 n LEU 191 Cb 0.44 -0.44 0.02 0.00 -2.33 0.00 0.00 43.42 41.10 1n80 n LEU 191 CO 0.57 -0.47 0.52 2.22 -1.33 0.00 0.00 177.39 178.89 1n80 n PHE 192 N -2.86 -1.43 -4.70 -1.77 1.16 -1.12 -4.94 117.46 101.80 1n80 n PHE 192 Ca -0.02 -1.06 -0.24 0.00 -1.87 0.00 0.00 57.45 54.26 1n80 n PHE 192 Cb 0.08 0.52 -0.16 0.00 -1.61 0.00 0.00 39.48 38.32 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 -2.05 1.38 -0.24 3.97 2.12 0.08 -1.12 118.70 122.84 1n80 s GLU 193 Ca 0.15 -0.53 -0.12 0.00 0.36 0.00 0.00 54.97 54.83 1n80 s GLU 193 Cb -0.03 -1.27 -0.05 0.00 0.26 0.00 0.00 34.13 33.05 1n80 s GLU 193 CO 0.06 0.26 0.22 0.42 -0.54 0.00 0.00 175.26 175.68 1n80 s ILE 194 N -0.13 5.32 0.60 -3.70 1.01 -0.65 -4.21 121.20 119.44 1n80 s ILE 194 Ca 0.01 0.29 -0.18 0.00 0.00 0.00 0.00 60.65 60.77 1n80 s ILE 194 Cb -0.08 -3.55 -0.03 0.00 0.01 0.00 0.00 42.46 38.80 1n80 s ILE 194 CO 0.00 0.31 1.19 -2.16 0.00 0.00 0.00 174.94 174.28 1n80 s PRO 195 N 1.23 2.93 0.22 2.79 0.04 -1.26 -3.52 135.00 137.43 1n80 s PRO 195 Ca 0.10 1.77 -0.07 0.00 0.04 0.00 0.00 61.00 62.83 1n80 s PRO 195 Cb -0.14 -1.93 0.33 0.00 0.04 0.00 0.00 34.50 32.80 1n80 s PRO 195 CO 0.06 -1.22 1.76 -1.35 0.04 0.00 0.00 177.00 176.29 1n80 h PRO 196 N 0.76 0.50 -0.17 0.56 0.11 -1.96 -1.12 132.00 130.68 1n80 h PRO 196 Ca -0.50 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.55 1n80 h PRO 196 Cb 1.29 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1n80 h PRO 196 CO 0.55 0.33 -0.05 0.38 -0.21 0.00 0.00 178.00 179.00 1n80 h ASP 197 N 0.52 0.24 -0.10 -2.05 3.04 -2.00 -1.23 116.42 114.84 1n80 h ASP 197 Ca 0.34 -0.04 -0.07 0.00 -3.24 0.00 0.00 57.03 54.03 1n80 h ASP 197 Cb 0.41 -0.06 0.00 0.00 -1.04 0.00 0.00 39.33 38.63 1n80 h ASP 197 CO -0.30 0.33 -0.22 0.58 -2.04 0.00 0.00 179.24 177.59 1n80 h VAL 198 N 0.25 1.39 -0.30 4.15 2.07 -1.62 -2.02 116.25 120.18 1n80 h VAL 198 Ca 0.06 -1.51 0.05 0.00 0.82 0.00 0.00 66.70 66.12 1n80 h VAL 198 Cb 0.25 2.12 -0.05 0.00 -1.52 0.00 0.00 31.29 32.10 1n80 h VAL 198 CO 0.01 0.44 -0.02 0.28 0.02 0.00 0.00 177.57 178.30 1n80 h SER 199 N -0.11 -0.16 -0.50 0.57 0.02 -0.83 0.37 113.55 112.89 1n80 h SER 199 Ca 0.00 0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 1n80 h SER 199 Cb 0.81 0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.47 1n80 h SER 199 CO 0.05 -0.05 0.04 0.40 -1.14 0.00 0.00 176.83 176.13 1n80 h ILE 200 N 0.06 1.26 0.00 3.27 2.04 -1.26 -3.13 117.51 119.74 1n80 h ILE 200 Ca 0.14 -1.02 -0.29 0.00 1.00 0.00 0.00 64.86 64.70 1n80 h ILE 200 Cb 0.20 0.93 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 1n80 h ILE 200 CO -0.26 0.36 -2.07 0.59 0.00 0.00 0.00 178.15 176.77 1n80 n ASN 201 N -4.36 0.30 -0.04 1.72 3.02 -0.76 -4.69 115.26 110.46 1n80 n ASN 201 Ca 0.01 0.14 -0.01 0.00 -0.03 0.00 0.00 54.58 54.69 1n80 n ASN 201 Cb 0.29 0.77 -0.09 0.00 -0.61 0.00 0.00 39.78 40.14 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 -2.78 1.45 -2.48 3.52 5.12 0.13 -5.02 116.66 116.60 1n80 n ARG 202 Ca -0.23 -0.05 -0.26 0.00 -1.93 0.00 0.00 57.85 55.38 1n80 n ARG 202 Cb 1.03 -1.30 0.03 0.00 -1.16 0.00 0.00 32.46 31.07 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 -2.53 0.00 0.43 0.00 -2.24 -0.19 -4.86 114.28 104.89 1n80 n THR 204 Ca 0.05 -0.59 0.13 0.00 -2.27 0.00 0.00 64.05 61.36 1n80 n THR 204 Cb 0.58 0.29 0.46 0.00 -2.10 0.00 0.00 70.33 69.55 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 0.49 0.00 0.00 3.42 -1.07 -1.98 -3.30 115.58 113.14 1n80 h ASN 205 Ca -0.06 0.00 -0.24 0.00 0.07 0.00 0.00 56.30 56.07 1n80 h ASN 205 Cb 0.29 0.00 -0.04 0.00 -2.07 0.00 0.00 38.32 36.50 1n80 h ASN 205 CO 0.09 0.00 -1.90 -0.62 0.07 0.00 0.00 177.43 175.07 1n80 n GLU 206 N -2.51 1.67 -4.67 4.14 4.71 -1.26 -4.74 120.64 117.98 1n80 n GLU 206 Ca 0.03 0.01 -0.27 0.00 -0.01 0.00 0.00 57.16 56.92 1n80 n GLU 206 Cb 0.35 -1.33 -0.14 0.00 -1.01 0.00 0.00 31.44 29.30 1n80 n GLU 206 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 1n80 s TYR 207 N -2.32 1.96 0.14 -0.32 1.51 -1.24 0.25 117.35 117.34 1n80 s TYR 207 Ca -0.09 -0.39 0.10 0.00 -1.01 0.00 0.00 57.07 55.69 1n80 s TYR 207 Cb 0.04 -1.16 -0.04 0.00 -0.11 0.00 0.00 41.96 40.69 1n80 s TYR 207 CO 0.51 0.12 -0.23 0.96 -1.11 0.00 0.00 175.55 175.80 1n80 s ILE 208 N -0.85 2.47 0.25 2.71 -4.36 -0.89 -1.02 121.20 119.50 1n80 s ILE 208 Ca 0.09 -1.75 -0.18 0.00 -0.26 0.00 0.00 60.65 58.55 1n80 s ILE 208 Cb -0.09 -2.13 -0.08 0.00 1.25 0.00 0.00 42.46 41.41 1n80 s ILE 208 CO 0.02 0.04 0.72 -0.69 0.24 0.00 0.00 174.94 175.27 1n80 s VAL 209 N -1.24 4.61 -0.15 8.37 1.01 -1.26 -2.07 120.40 129.68 1n80 s VAL 209 Ca 0.17 1.18 0.02 0.00 0.00 0.00 0.00 61.98 63.34 1n80 s VAL 209 Cb -0.10 -3.79 0.01 0.00 0.00 0.00 0.00 36.38 32.51 1n80 s VAL 209 CO 0.08 0.11 -0.20 -0.69 0.00 0.00 0.00 175.10 174.40 1n80 s VAL 210 N -1.64 1.95 0.46 2.92 1.01 -0.06 -4.95 120.40 120.08 1n80 s VAL 210 Ca 0.46 -0.90 -0.25 0.00 0.00 0.00 0.00 61.98 61.29 1n80 s VAL 210 Cb -0.15 -1.74 -0.08 0.00 0.00 0.00 0.00 36.38 34.41 1n80 s VAL 210 CO 0.20 0.53 1.35 -2.16 0.00 0.00 0.00 175.10 175.02 1n80 s PRO 211 N 1.00 3.67 0.69 2.72 0.04 -1.26 -4.17 135.00 137.69 1n80 s PRO 211 Ca -0.03 2.24 -0.15 0.00 0.04 0.00 0.00 61.00 63.10 1n80 s PRO 211 Cb -0.15 -2.59 0.02 0.00 0.04 0.00 0.00 34.50 31.82 1n80 s PRO 211 CO -0.05 -0.76 1.17 -1.58 0.04 0.00 0.00 177.00 175.82 1n80 s TRP 212 N -1.27 2.28 0.18 0.56 0.52 -1.26 -4.59 118.94 115.35 1n80 s TRP 212 Ca 0.62 1.58 -0.15 0.00 0.02 0.00 0.00 56.10 58.17 1n80 s TRP 212 Cb -0.40 -3.36 0.15 0.00 -1.15 0.00 0.00 33.47 28.70 1n80 s TRP 212 CO 0.50 -2.25 1.69 -1.35 0.02 0.00 0.00 176.95 175.56 1n80 h PRO 213 N -0.08 0.09 -0.12 4.98 0.11 -1.95 -1.96 132.00 133.08 1n80 h PRO 213 Ca -0.48 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1n80 h PRO 213 Cb 1.28 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1n80 h PRO 213 CO 0.52 0.06 0.02 1.49 -0.21 0.00 0.00 178.00 179.88 1n80 h GLU 214 N 0.10 0.20 0.00 1.05 4.57 -1.92 0.25 114.58 118.83 1n80 h GLU 214 Ca 0.22 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1n80 h GLU 214 Cb 0.33 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.90 1n80 h GLU 214 CO -0.38 0.38 -0.00 1.05 -1.18 0.00 0.00 179.01 178.88 1n80 h GLU 215 N -0.02 0.00 0.03 1.92 4.11 -1.93 0.38 114.58 119.07 1n80 h GLU 215 Ca 0.04 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.39 1n80 h GLU 215 Cb 0.28 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.54 1n80 h GLU 215 CO 0.00 0.00 -0.32 1.25 0.07 0.00 0.00 179.01 180.01 1n80 h LEU 216 N 0.00 0.22 -1.44 3.06 5.85 -0.88 -2.71 115.31 119.42 1n80 h LEU 216 Ca -0.00 -0.89 -0.04 0.00 0.84 0.00 0.00 57.88 57.79 1n80 h LEU 216 Cb 0.32 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1n80 h LEU 216 CO 0.00 1.09 -0.10 0.50 -0.34 0.00 0.00 178.44 179.59 1n80 h LYS 217 N -0.62 0.25 -0.18 1.25 3.64 -0.47 -2.61 116.57 117.83 1n80 h LYS 217 Ca -0.05 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.24 1n80 h LYS 217 Cb 1.17 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 1n80 h LYS 217 CO 0.06 0.36 -0.04 1.49 -2.27 0.00 0.00 179.45 179.05 1n80 h GLU 218 N 0.24 0.34 -2.50 1.90 4.57 -0.97 -3.39 114.58 114.77 1n80 h GLU 218 Ca 0.05 -0.13 -0.59 0.00 -1.18 0.00 0.00 59.36 57.51 1n80 h GLU 218 Cb 0.33 -0.02 -0.39 0.00 -0.16 0.00 0.00 28.75 28.51 1n80 h GLU 218 CO 0.02 0.60 -0.91 0.34 -1.18 0.00 0.00 179.01 177.88 1n80 s ASP 219 N -5.93 2.13 0.20 1.04 2.15 -1.02 -4.99 116.67 110.26 1n80 s ASP 219 Ca -0.14 -2.88 -0.08 0.00 0.43 0.00 0.00 52.55 49.88 1n80 s ASP 219 Cb 0.06 -0.53 0.13 0.00 -0.30 0.00 0.00 42.92 42.28 1n80 s ASP 219 CO 0.74 -0.20 1.73 -0.65 -0.17 0.00 0.00 175.17 176.61 1n80 h PRO 220 N 6.02 1.16 -0.85 4.34 0.11 -1.69 -3.01 132.00 138.08 1n80 h PRO 220 Ca 0.19 -0.26 -0.00 0.00 0.11 0.00 0.00 66.00 66.04 1n80 h PRO 220 Cb 0.92 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 31.82 1n80 h PRO 220 CO 0.37 1.00 0.53 1.15 -0.21 0.00 0.00 178.00 180.84 1n80 h THR 221 N 1.11 1.23 -0.99 -1.15 2.02 -1.89 0.41 112.91 113.65 1n80 h THR 221 Ca 0.24 -0.47 0.25 0.00 0.77 0.00 0.00 66.41 67.19 1n80 h THR 221 Cb 0.34 0.02 -0.08 0.00 -1.74 0.00 0.00 68.15 66.69 1n80 h THR 221 CO -0.00 0.23 0.65 -0.09 0.37 0.00 0.00 175.52 176.68 1n80 h ARG 222 N 1.16 0.34 -0.41 6.66 9.65 -1.93 -0.62 114.38 129.23 1n80 h ARG 222 Ca 0.31 -0.02 -0.11 0.00 -1.10 0.00 0.00 59.98 59.05 1n80 h ARG 222 Cb -0.08 -0.08 -0.07 0.00 -1.39 0.00 0.00 29.97 28.36 1n80 h ARG 222 CO -0.06 0.22 0.06 0.91 2.80 0.00 0.00 179.97 183.90 1n80 n TRP 223 N -4.52 1.38 -3.65 2.20 7.02 -0.49 -4.29 117.44 115.09 1n80 n TRP 223 Ca 0.22 -1.18 -0.27 0.00 -1.02 0.00 0.00 57.50 55.25 1n80 n TRP 223 Cb 0.84 -0.47 0.01 0.00 -2.42 0.00 0.00 31.31 29.28 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 -0.62 -0.49 0.19 6.99 0.00 -0.24 -0.74 105.19 110.27 1n80 n GLY 224 Ca 0.30 0.15 0.04 0.00 0.00 0.00 0.00 46.02 46.51 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 -4.40 0.00 0.20 1.61 4.19 0.13 -4.48 117.16 114.42 1n80 n TYR 225 Ca 0.01 0.00 0.11 0.00 3.31 0.00 0.00 57.90 61.33 1n80 n TYR 225 Cb 0.54 0.00 0.59 0.00 0.49 0.00 0.00 39.34 40.96 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 0.96 0.00 -0.41 2.98 9.09 -1.87 0.19 114.58 125.52 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 0.30 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.40 1n80 h GLU 226 CO 0.00 0.00 0.00 -0.25 0.05 0.00 0.00 179.01 178.81 1n80 n ASP 227 N -2.34 3.32 -4.74 3.06 10.43 -1.26 -5.00 116.55 120.01 1n80 n ASP 227 Ca -0.01 -1.94 -0.33 0.00 2.57 0.00 0.00 54.79 55.07 1n80 n ASP 227 Cb 0.20 -0.26 0.08 0.00 1.84 0.00 0.00 41.12 42.97 1n80 n ASP 227 CO 0.00 0.00 0.00 0.21 -1.07 0.00 0.00 177.20 176.34 1n80 s ASN 228 N -1.26 4.50 0.00 -2.24 2.47 0.05 -4.96 114.94 113.51 1n80 s ASN 228 Ca 0.35 2.15 0.00 0.00 0.42 0.00 0.00 52.86 55.78 1n80 s ASN 228 Cb 0.20 -2.57 0.00 0.00 -1.45 0.00 0.00 41.25 37.43 1n80 s ASN 228 CO 0.27 -2.05 0.00 0.18 -3.72 0.00 0.00 177.10 171.79 1n80 n LEU 229 N -2.78 0.00 0.17 3.21 4.32 -1.26 -4.78 117.00 115.87 1n80 n LEU 229 Ca 0.12 -0.14 0.13 0.00 -0.02 0.00 0.00 56.01 56.10 1n80 n LEU 229 Cb 0.51 0.00 0.56 0.00 -1.62 0.00 0.00 43.42 42.87 1n80 n LEU 229 CO 0.48 0.00 0.89 0.71 -1.22 0.00 0.00 177.39 178.25 1n80 h THR 230 N 0.00 0.00 -0.07 -5.08 1.35 -1.92 -2.76 112.91 104.42 1n80 h THR 230 Ca 0.00 -0.24 0.02 0.00 -0.55 0.00 0.00 66.41 65.64 1n80 h THR 230 Cb 0.00 0.99 -0.00 0.00 -1.73 0.00 0.00 68.15 67.41 1n80 h THR 230 CO 0.00 0.00 0.14 4.11 -0.25 0.00 0.00 175.52 179.52 1n80 h TRP 231 N 0.00 0.00 0.00 4.73 5.08 -1.91 -0.78 115.95 123.07 1n80 h TRP 231 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1n80 h TRP 231 Cb 0.33 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.49 1n80 h TRP 231 CO 0.00 0.00 0.05 1.04 -1.28 0.00 0.00 178.44 178.25 1n80 n GLN 232 N -3.43 0.04 0.00 0.12 6.02 -1.04 -1.03 117.38 118.05 1n80 n GLN 232 Ca -0.01 0.51 0.00 0.00 -0.01 0.00 0.00 57.00 57.49 1n80 n GLN 232 Cb 0.22 -1.66 0.00 0.00 1.02 0.00 0.00 30.24 29.82 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 -1.67 1.69 0.00 -1.09 0.00 -0.64 -4.87 117.38 110.80 1n80 n GLN 233 Ca -0.00 0.00 0.12 0.00 0.00 0.00 0.00 57.00 57.11 1n80 n GLN 233 Cb 0.05 -0.45 0.09 0.00 0.00 0.00 0.00 30.24 29.93 1n80 n GLN 233 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.06 176.66 1n80 n ASP 234 N -0.34 2.86 -4.14 2.61 3.85 -0.39 -5.00 116.55 115.99 1n80 n ASP 234 Ca 0.00 -1.93 -0.29 0.00 -0.71 0.00 0.00 54.79 51.86 1n80 n ASP 234 Cb 0.00 0.06 -0.06 0.00 -1.35 0.00 0.00 41.12 39.78 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 1.16 -0.02 -0.85 -1.12 2.03 -0.20 -0.71 116.55 116.83 1n80 n ASP 235 Ca 0.13 -1.13 -0.11 0.00 0.52 0.00 0.00 54.79 54.20 1n80 n ASP 235 Cb 0.58 -2.37 -0.05 0.00 -0.72 0.00 0.00 41.12 38.56 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 -4.47 0.00 -1.33 -0.67 3.72 -1.26 -4.90 117.46 108.55 1n80 n PHE 236 Ca -0.28 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 56.74 1n80 n PHE 236 Cb 0.67 -2.18 -0.03 0.00 -0.94 0.00 0.00 39.48 36.99 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 -1.30 4.26 0.23 1.37 0.00 0.11 -4.21 105.19 105.65 1n80 n GLY 237 Ca -0.11 -1.52 0.06 0.00 0.00 0.00 0.00 46.02 44.45 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 6.88 0.00 -1.40 0.99 5.85 -1.87 -2.22 115.31 123.54 1n80 h LEU 238 Ca 0.85 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 59.52 1n80 h LEU 238 Cb 0.32 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 1n80 h LEU 238 CO 1.73 0.15 -0.13 0.16 -0.34 0.00 0.00 178.44 180.02 1n80 h ILE 239 N 0.00 1.18 -0.01 4.05 3.07 -1.81 -2.40 117.51 121.59 1n80 h ILE 239 Ca -0.00 -0.78 -0.21 0.00 1.55 0.00 0.00 64.86 65.42 1n80 h ILE 239 Cb 0.27 1.21 -0.00 0.00 -0.27 0.00 0.00 36.82 38.03 1n80 h ILE 239 CO 0.02 0.24 -0.90 1.88 -1.05 0.00 0.00 178.15 178.35 1n80 h TYR 240 N 0.23 0.56 -0.90 0.16 -1.99 -1.73 0.31 116.97 113.60 1n80 h TYR 240 Ca 0.05 -0.29 -0.01 0.00 2.00 0.00 0.00 58.73 60.47 1n80 h TYR 240 Cb 0.37 -0.07 -0.04 0.00 2.00 0.00 0.00 36.73 38.99 1n80 h TYR 240 CO 0.01 1.10 0.52 0.00 -0.00 0.00 0.00 178.16 179.79 1n80 h ARG 241 N 0.22 1.24 -0.45 4.88 3.08 -1.23 -2.87 114.38 119.25 1n80 h ARG 241 Ca -0.07 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.86 1n80 h ARG 241 Cb 1.52 -0.25 0.00 0.00 0.08 0.00 0.00 29.97 31.32 1n80 h ARG 241 CO 0.15 0.88 0.00 1.33 -1.07 0.00 0.00 179.97 181.27 1n80 n VAL 242 N -4.35 0.58 -3.21 2.04 0.24 -0.97 -4.96 118.33 107.70 1n80 n VAL 242 Ca 0.10 -0.76 -0.19 0.00 -2.04 0.00 0.00 64.34 61.45 1n80 n VAL 242 Cb 0.08 0.83 0.05 0.00 -1.47 0.00 0.00 33.84 33.33 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 1.44 -5.60 -2.27 7.34 5.02 -0.81 -4.95 118.16 118.33 1n80 n LYS 243 Ca 0.20 0.69 -0.42 0.00 -2.02 0.00 0.00 58.31 56.77 1n80 n LYS 243 Cb 0.59 -5.22 -0.03 0.00 -0.02 0.00 0.00 35.03 30.34 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 -3.19 3.50 0.00 7.82 0.00 0.04 -4.87 121.76 125.06 1n80 s ALA 244 Ca 0.40 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.40 1n80 s ALA 244 Cb -0.17 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.47 1n80 s ALA 244 CO 0.49 -0.51 0.54 0.27 0.00 0.00 0.00 175.76 176.56 1n80 n ASN 245 N 3.10 0.00 -4.22 0.00 0.23 -1.26 -4.07 115.26 109.03 1n80 n ASN 245 Ca 0.07 -1.26 -0.28 0.00 -0.53 0.00 0.00 54.58 52.59 1n80 n ASN 245 Cb 0.44 -0.05 -0.16 0.00 -2.08 0.00 0.00 39.78 37.93 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 0.00 1.70 -0.12 5.53 2.01 -1.25 -0.18 115.64 123.33 1n80 s THR 246 Ca 0.00 -0.91 -0.00 0.00 0.31 0.00 0.00 61.69 61.09 1n80 s THR 246 Cb 0.00 -1.42 -0.02 0.00 0.01 0.00 0.00 72.50 71.07 1n80 s THR 246 CO 0.00 0.48 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.66 1n80 s ILE 247 N -0.36 3.18 -0.19 1.82 1.01 0.24 -1.67 121.20 125.23 1n80 s ILE 247 Ca 0.05 -0.63 -0.03 0.00 0.00 0.00 0.00 60.65 60.04 1n80 s ILE 247 Cb -0.10 -2.33 -0.02 0.00 0.01 0.00 0.00 42.46 40.03 1n80 s ILE 247 CO 0.00 0.53 -0.05 -0.60 0.00 0.00 0.00 174.94 174.82 1n80 s ARG 248 N 0.16 3.47 -0.10 2.79 3.52 0.02 -0.85 118.95 127.96 1n80 s ARG 248 Ca -0.06 -0.60 -0.24 0.00 -0.13 0.00 0.00 55.73 54.69 1n80 s ARG 248 Cb -0.15 -2.92 -0.03 0.00 -1.56 0.00 0.00 34.95 30.29 1n80 s ARG 248 CO 0.05 0.01 0.76 -0.06 -0.81 0.00 0.00 175.30 175.24 1n80 s PHE 249 N 0.95 3.52 -0.67 5.12 0.40 -0.06 -1.46 117.98 125.78 1n80 s PHE 249 Ca -0.00 1.26 0.05 0.00 -0.60 0.00 0.00 56.93 57.64 1n80 s PHE 249 Cb -0.15 -2.90 0.26 0.00 0.51 0.00 0.00 43.02 40.75 1n80 s PHE 249 CO 0.01 -0.04 0.82 1.17 0.70 0.00 0.00 175.22 177.87 1n80 n LYS 250 N 4.34 2.72 -4.27 0.44 3.00 0.49 -3.41 118.16 121.46 1n80 n LYS 250 Ca 0.01 -4.68 -0.24 0.00 -0.00 0.00 0.00 58.31 53.41 1n80 n LYS 250 Cb 0.50 -2.28 -0.07 0.00 0.00 0.00 0.00 35.03 33.18 1n80 n LYS 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1n80 s ALA 251 N -2.55 3.17 0.08 3.14 0.00 -1.16 -4.78 121.76 119.65 1n80 s ALA 251 Ca 0.40 -1.58 0.07 0.00 0.00 0.00 0.00 51.96 50.84 1n80 s ALA 251 Cb 0.15 -0.83 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 1n80 s ALA 251 CO -0.01 0.32 -0.18 0.71 0.00 0.00 0.00 175.76 176.60 1n80 s TYR 252 N -2.17 1.56 -0.38 0.00 2.02 -1.26 -0.66 117.35 116.46 1n80 s TYR 252 Ca 0.30 -0.42 -0.09 0.00 -0.37 0.00 0.00 57.07 56.50 1n80 s TYR 252 Cb -0.07 -0.88 0.05 0.00 -0.40 0.00 0.00 41.96 40.67 1n80 s TYR 252 CO 0.19 0.13 0.19 -0.51 -1.57 0.00 0.00 175.55 173.99 1n80 s LEU 253 N -1.67 4.77 -0.32 -1.29 1.43 -0.16 -4.95 118.68 116.48 1n80 s LEU 253 Ca 0.04 -1.26 -0.15 0.00 -1.03 0.00 0.00 54.13 51.72 1n80 s LEU 253 Cb -0.10 -1.96 -0.02 0.00 0.03 0.00 0.00 46.19 44.15 1n80 s LEU 253 CO 0.03 -0.43 0.38 -0.62 0.23 0.00 0.00 176.35 175.94 1n80 s ASP 254 N 1.72 6.21 0.00 2.29 -1.08 -1.26 -1.62 116.67 122.93 1n80 s ASP 254 Ca 0.01 -0.07 0.00 0.00 -0.52 0.00 0.00 52.55 51.97 1n80 s ASP 254 Cb -0.21 -2.21 0.00 0.00 -1.46 0.00 0.00 42.92 39.05 1n80 s ASP 254 CO 0.03 -0.31 0.78 -1.54 0.52 0.00 0.00 175.17 174.66 1n80 n SER 255 N 5.40 0.00 -0.20 -0.34 3.41 -0.88 -2.28 113.62 118.74 1n80 n SER 255 Ca -0.09 0.30 -0.04 0.00 -0.26 0.00 0.00 58.87 58.79 1n80 n SER 255 Cb 0.50 -0.30 0.06 0.00 -0.26 0.00 0.00 64.21 64.20 1n80 n SER 255 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1n80 h VAL 256 N 0.00 1.03 0.00 -3.33 2.07 -1.81 -2.01 116.25 112.20 1n80 h VAL 256 Ca 0.00 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1n80 h VAL 256 Cb 0.12 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1n80 h VAL 256 CO 0.00 0.12 0.00 -1.22 0.02 0.00 0.00 177.57 176.49 1n80 n TYR 257 N -4.78 0.00 -3.08 1.57 4.02 -0.97 -4.17 117.16 109.75 1n80 n TYR 257 Ca 0.06 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.79 1n80 n TYR 257 Cb 0.11 -0.46 -0.00 0.00 -0.02 0.00 0.00 39.34 38.96 1n80 n TYR 257 CO 0.00 0.00 0.00 1.97 -1.01 0.00 0.00 176.86 177.82 1n80 n PHE 258 N -1.46 -0.54 0.32 -0.72 -1.74 -0.80 -4.94 117.46 107.58 1n80 n PHE 258 Ca 0.07 -3.42 0.20 0.00 -0.56 0.00 0.00 57.45 53.73 1n80 n PHE 258 Cb 0.27 0.06 1.05 0.00 1.52 0.00 0.00 39.48 42.38 1n80 n PHE 258 CO 0.00 0.00 0.00 -1.00 -0.56 0.00 0.00 176.76 175.20 1n80 h PRO 259 N 3.01 0.00 -0.32 3.97 0.13 -1.62 -2.34 132.00 134.83 1n80 h PRO 259 Ca 0.05 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.11 1n80 h PRO 259 Cb 1.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.11 1n80 h PRO 259 CO 0.41 0.01 -0.12 1.05 -0.23 0.00 0.00 178.00 179.12 1n80 h GLU 260 N 0.00 0.55 -0.00 0.86 9.09 -1.92 -2.08 114.58 121.08 1n80 h GLU 260 Ca -0.00 -0.16 0.00 0.00 0.05 0.00 0.00 59.36 59.25 1n80 h GLU 260 Cb 0.12 -0.06 0.00 0.00 -1.65 0.00 0.00 28.75 27.16 1n80 h GLU 260 CO 0.00 0.67 -0.18 0.00 0.05 0.00 0.00 179.01 179.55 1n80 n ALA 261 N -2.48 2.90 -0.23 1.06 0.00 -0.89 -3.60 120.51 117.27 1n80 n ALA 261 Ca 0.01 -0.32 -0.04 0.00 0.00 0.00 0.00 53.44 53.09 1n80 n ALA 261 Cb 0.33 -1.25 0.18 0.00 0.00 0.00 0.00 19.45 18.71 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 -0.89 3.81 -1.40 0.00 0.00 -0.78 -4.82 120.51 116.43 1n80 n ALA 262 Ca 0.13 -1.42 -0.48 0.00 0.00 0.00 0.00 53.44 51.67 1n80 n ALA 262 Cb 0.31 -1.17 -0.03 0.00 0.00 0.00 0.00 19.45 18.56 1n80 n ALA 262 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1n80 n LEU 263 N -0.03 -1.23 0.21 0.00 4.77 -1.24 -4.27 117.00 115.22 1n80 n LEU 263 Ca 0.26 1.12 0.13 0.00 -0.03 0.00 0.00 56.01 57.48 1n80 n LEU 263 Cb 1.00 -0.96 0.46 0.00 -2.33 0.00 0.00 43.42 41.59 1n80 n LEU 263 CO 0.27 -2.99 1.11 -0.65 -1.33 0.00 0.00 177.39 173.80 1n80 h PRO 264 N 1.00 0.00 -0.30 3.23 0.11 -1.93 -2.69 132.00 131.41 1n80 h PRO 264 Ca -0.29 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.56 1n80 h PRO 264 Cb 1.44 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 32.32 1n80 h PRO 264 CO 0.57 0.00 -0.61 0.41 -0.21 0.00 0.00 178.00 178.16 1n80 n GLY 265 N -1.44 1.40 1.16 -0.55 0.00 -1.26 -5.11 105.19 99.39 1n80 n GLY 265 Ca 0.04 -0.48 -0.10 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.45 -1.11 -0.77 1.61 0.23 -1.02 -4.99 115.26 108.76 1n80 n ASN 266 Ca 0.00 -0.79 0.08 0.00 -0.53 0.00 0.00 54.58 53.34 1n80 n ASN 266 Cb 0.84 -0.33 0.13 0.00 -2.08 0.00 0.00 39.78 38.35 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 -2.47 1.93 0.00 -3.83 4.76 -1.26 -4.99 118.16 112.30 1n80 n LYS 267 Ca 0.05 -1.83 0.00 0.00 -2.87 0.00 0.00 58.31 53.66 1n80 n LYS 267 Cb 0.19 -1.34 0.00 0.00 -1.84 0.00 0.00 35.03 32.04 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 0.93 -1.57 3.38 0.72 0.00 -1.26 -4.68 105.19 102.70 1n80 n GLY 268 Ca 0.13 -1.26 -0.21 0.00 0.00 0.00 0.00 46.02 44.67 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 1.92 0.00 1.61 -0.12 -1.25 -4.06 117.98 116.08 1n80 s PHE 269 Ca 0.00 -0.47 0.00 0.00 -0.05 0.00 0.00 56.93 56.41 1n80 s PHE 269 Cb 0.00 -0.90 0.00 0.00 -0.63 0.00 0.00 43.02 41.49 1n80 s PHE 269 CO 0.00 0.44 0.10 0.54 -0.05 0.00 0.00 175.22 176.25 1n80 n ARG 270 N -0.16 0.37 -4.97 1.99 1.74 -0.77 -1.89 116.66 112.97 1n80 n ARG 270 Ca -0.09 -0.10 -0.28 0.00 -0.77 0.00 0.00 57.85 56.61 1n80 n ARG 270 Cb 0.59 -0.49 -0.15 0.00 -1.02 0.00 0.00 32.46 31.39 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 -0.08 1.74 0.03 5.56 -0.21 -0.76 -0.93 119.66 125.01 1n80 s GLN 271 Ca 0.00 -0.91 0.02 0.00 0.02 0.00 0.00 55.36 54.49 1n80 s GLN 271 Cb 0.00 -1.77 -0.02 0.00 1.00 0.00 0.00 33.01 32.22 1n80 s GLN 271 CO 0.00 0.47 -0.08 0.42 -2.12 0.00 0.00 175.29 173.98 1n80 s ILE 272 N -0.66 0.58 0.04 1.08 -1.09 -0.00 -1.94 121.20 119.20 1n80 s ILE 272 Ca 0.09 -0.84 -0.21 0.00 -2.23 0.00 0.00 60.65 57.46 1n80 s ILE 272 Cb -0.09 -0.59 0.05 0.00 -1.58 0.00 0.00 42.46 40.25 1n80 s ILE 272 CO 0.00 -0.20 0.48 -0.94 -1.23 0.00 0.00 174.94 173.05 1n80 s SER 273 N -1.14 -0.38 -0.13 3.58 1.04 -0.83 -0.17 113.70 115.66 1n80 s SER 273 Ca -0.05 0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.51 1n80 s SER 273 Cb -0.08 0.46 -0.01 0.00 0.10 0.00 0.00 66.02 66.49 1n80 s SER 273 CO 0.00 -0.68 -0.14 -0.63 0.98 0.00 0.00 173.24 172.78 1n80 s ILE 274 N -2.33 2.97 -0.05 -1.02 -1.09 -0.76 -0.00 121.20 118.91 1n80 s ILE 274 Ca -0.06 -0.69 0.03 0.00 -2.23 0.00 0.00 60.65 57.70 1n80 s ILE 274 Cb -0.01 -2.24 0.01 0.00 -1.58 0.00 0.00 42.46 38.64 1n80 s ILE 274 CO -0.01 0.53 -0.14 -0.63 -1.23 0.00 0.00 174.94 173.46 1n80 s ILE 275 N 0.32 1.23 -0.09 2.92 1.01 0.43 -2.01 121.20 125.01 1n80 s ILE 275 Ca -0.11 -0.56 -0.02 0.00 0.00 0.00 0.00 60.65 59.96 1n80 s ILE 275 Cb -0.16 -1.09 -0.03 0.00 0.01 0.00 0.00 42.46 41.19 1n80 s ILE 275 CO 0.06 0.37 -0.01 0.42 0.00 0.00 0.00 174.94 175.78 1n80 s THR 276 N 0.38 4.22 -1.38 2.92 -4.23 -0.12 -0.60 115.64 116.83 1n80 s THR 276 Ca -0.10 -0.28 -0.03 0.00 -1.18 0.00 0.00 61.69 60.10 1n80 s THR 276 Cb -0.14 -2.77 0.02 0.00 1.34 0.00 0.00 72.50 70.96 1n80 s THR 276 CO 0.03 0.60 0.71 0.59 -0.54 0.00 0.00 174.62 176.01 1n80 n ASN 277 N 2.21 -1.82 -4.79 3.99 3.02 -0.94 -0.48 115.26 116.45 1n80 n ASN 277 Ca -0.18 -0.85 -0.32 0.00 -0.03 0.00 0.00 54.58 53.20 1n80 n ASN 277 Cb 0.53 -3.81 0.06 0.00 -0.61 0.00 0.00 39.78 35.95 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 -6.24 2.74 0.16 3.52 0.04 -1.26 -3.54 135.00 130.42 1n80 s PRO 278 Ca 0.16 1.16 0.05 0.00 0.04 0.00 0.00 61.00 62.40 1n80 s PRO 278 Cb -0.08 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 1n80 s PRO 278 CO 0.83 -1.27 0.13 -0.51 0.04 0.00 0.00 177.00 176.22 1n80 s LEU 279 N -5.37 3.79 0.54 -3.56 1.43 -1.26 -2.11 118.68 112.13 1n80 s LEU 279 Ca 0.62 -0.13 -0.19 0.00 -1.03 0.00 0.00 54.13 53.41 1n80 s LEU 279 Cb -0.17 -2.41 -0.06 0.00 0.03 0.00 0.00 46.19 43.59 1n80 s LEU 279 CO 0.50 0.08 1.07 -1.61 0.23 0.00 0.00 176.35 176.62 1n80 s GLU 280 N -3.02 3.51 0.77 1.70 2.02 -0.54 0.10 118.70 123.25 1n80 s GLU 280 Ca 0.31 1.38 -0.15 0.00 0.02 0.00 0.00 54.97 56.53 1n80 s GLU 280 Cb -0.10 -2.05 0.02 0.00 0.10 0.00 0.00 34.13 32.10 1n80 s GLU 280 CO 0.23 -0.67 0.90 0.00 0.02 0.00 0.00 175.26 175.74 1n80 n ALA 281 N -1.40 -0.64 -2.45 5.21 0.00 -0.95 -3.87 120.51 116.40 1n80 n ALA 281 Ca 0.10 -0.28 -0.27 0.00 0.00 0.00 0.00 53.44 52.98 1n80 n ALA 281 Cb 0.52 -2.08 -0.13 0.00 0.00 0.00 0.00 19.45 17.76 1n80 n ALA 281 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1n80 s LYS 282 N -3.50 1.34 0.13 0.00 1.02 -1.26 -4.87 119.74 112.60 1n80 s LYS 282 Ca 0.70 -1.21 -0.13 0.00 0.02 0.00 0.00 55.97 55.35 1n80 s LYS 282 Cb -0.32 -1.68 -0.02 0.00 -0.52 0.00 0.00 37.83 35.30 1n80 s LYS 282 CO 0.54 0.40 1.54 0.00 -0.92 0.00 0.00 175.35 176.91 1n80 h ALA 283 N 4.17 0.57 -3.49 5.17 0.00 -1.99 -3.43 119.26 120.26 1n80 h ALA 283 Ca -0.48 -0.31 -0.32 0.00 0.00 0.00 0.00 54.91 53.80 1n80 h ALA 283 Cb 1.17 -0.15 -0.34 0.00 0.00 0.00 0.00 17.79 18.47 1n80 h ALA 283 CO 0.40 0.43 -0.74 -1.01 0.00 0.00 0.00 179.25 178.33 1n80 s HIS 284 N -4.83 0.15 0.58 0.00 3.76 -1.26 -5.03 115.29 108.66 1n80 s HIS 284 Ca -0.12 0.08 0.33 0.00 -0.15 0.00 0.00 55.06 55.20 1n80 s HIS 284 Cb 0.10 -0.33 1.34 0.00 1.11 0.00 0.00 32.58 34.81 1n80 s HIS 284 CO 0.82 -0.11 1.63 -1.00 -0.85 0.00 0.00 174.74 175.22 1n80 h PRO 285 N 7.37 0.00 0.00 8.40 0.13 -2.02 0.71 132.00 146.58 1n80 h PRO 285 Ca -0.42 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.69 1n80 h PRO 285 Cb 1.13 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 1n80 h PRO 285 CO 0.45 0.00 -0.08 -0.97 -0.23 0.00 0.00 178.00 177.18 1n80 h ASN 286 N 0.00 0.00 -4.03 1.44 -0.73 -1.98 -3.46 115.58 106.82 1n80 h ASN 286 Ca 0.48 0.00 -0.54 0.00 1.87 0.00 0.00 56.30 58.12 1n80 h ASN 286 Cb 2.37 0.00 0.19 0.00 0.27 0.00 0.00 38.32 41.15 1n80 h ASN 286 CO -0.01 0.08 0.16 0.47 -0.37 0.00 0.00 177.43 177.76 1n80 n ASP 287 N -3.16 0.43 -4.77 1.15 8.00 0.25 -4.95 116.55 113.50 1n80 n ASP 287 Ca 0.02 0.54 -0.38 0.00 0.71 0.00 0.00 54.79 55.68 1n80 n ASP 287 Cb 0.43 -1.45 -0.01 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 -3.99 3.80 0.20 -0.24 0.04 -1.26 -4.97 135.00 128.58 1n80 s PRO 288 Ca 0.70 1.85 -0.30 0.00 0.04 0.00 0.00 61.00 63.30 1n80 s PRO 288 Cb -0.28 -2.49 -0.09 0.00 0.04 0.00 0.00 34.50 31.68 1n80 s PRO 288 CO 0.54 -0.54 1.32 -0.80 0.04 0.00 0.00 177.00 177.56 1n80 s ASN 289 N -1.22 6.88 -0.14 6.66 0.01 -1.26 -5.03 114.94 120.84 1n80 s ASN 289 Ca 0.62 2.42 0.02 0.00 -0.71 0.00 0.00 52.86 55.21 1n80 s ASN 289 Cb -0.31 -2.61 0.01 0.00 0.41 0.00 0.00 41.25 38.75 1n80 s ASN 289 CO 0.38 -0.54 -0.21 -0.69 -1.51 0.00 0.00 177.10 174.53 1n80 s VAL 290 N 0.13 1.98 0.06 1.60 1.01 -1.26 -5.06 120.40 118.86 1n80 s VAL 290 Ca 0.57 -0.93 -0.31 0.00 0.00 0.00 0.00 61.98 61.31 1n80 s VAL 290 Cb -0.37 -1.76 -0.07 0.00 0.00 0.00 0.00 36.38 34.18 1n80 s VAL 290 CO 0.38 0.53 1.50 -0.54 0.00 0.00 0.00 175.10 176.98 1n80 s LYS 291 N 0.87 4.26 0.01 2.72 -0.14 -1.26 -1.46 119.74 124.73 1n80 s LYS 291 Ca -0.06 2.15 -0.30 0.00 -1.36 0.00 0.00 55.97 56.39 1n80 s LYS 291 Cb -0.15 -3.47 -0.05 0.00 -1.68 0.00 0.00 37.83 32.47 1n80 s LYS 291 CO -0.03 -0.60 1.37 0.00 -0.76 0.00 0.00 175.35 175.33 1n80 s ALA 292 N 2.09 3.56 0.00 5.17 0.00 -0.90 -4.79 121.76 126.90 1n80 s ALA 292 Ca 0.68 0.88 0.00 0.00 0.00 0.00 0.00 51.96 53.52 1n80 s ALA 292 Cb -0.37 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.18 1n80 s ALA 292 CO 0.30 -0.85 0.48 0.39 0.00 0.00 0.00 175.76 176.08 1n80 n GLU 293 N 5.16 0.44 -1.48 0.00 1.02 -1.26 -4.84 120.64 119.68 1n80 n GLU 293 Ca 0.13 -0.60 -0.29 0.00 -0.02 0.00 0.00 57.16 56.38 1n80 n GLU 293 Cb 0.44 -0.74 0.12 0.00 -0.02 0.00 0.00 31.44 31.24 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 -0.23 1.52 0.47 3.49 1.02 -1.26 -4.96 119.74 119.78 1n80 s LYS 294 Ca 0.00 0.52 0.27 0.00 0.02 0.00 0.00 55.97 56.78 1n80 s LYS 294 Cb 0.00 -1.86 0.79 0.00 -0.52 0.00 0.00 37.83 36.24 1n80 s LYS 294 CO 0.00 -1.99 1.77 -0.44 -0.92 0.00 0.00 175.35 173.77 1n80 h ASP 295 N -1.35 0.00 -5.15 2.83 3.32 -1.96 -3.42 116.42 110.69 1n80 h ASP 295 Ca -0.49 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.47 1n80 h ASP 295 Cb 1.30 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.71 1n80 h ASP 295 CO 0.60 0.00 -0.37 -0.47 -1.72 0.00 0.00 179.24 177.28 1n80 s TYR 296 N -3.39 0.14 -0.22 4.55 6.14 -1.26 -2.13 117.35 121.18 1n80 s TYR 296 Ca 0.05 -0.55 -0.13 0.00 0.64 0.00 0.00 57.07 57.08 1n80 s TYR 296 Cb 0.07 -0.05 0.07 0.00 0.42 0.00 0.00 41.96 42.46 1n80 s TYR 296 CO 0.61 -0.53 0.54 0.71 0.64 0.00 0.00 175.55 177.51 1n80 s TYR 297 N -3.74 -0.79 0.07 4.97 2.02 -0.96 -5.01 117.35 113.92 1n80 s TYR 297 Ca 0.04 1.64 -0.30 0.00 -0.37 0.00 0.00 57.07 58.08 1n80 s TYR 297 Cb 0.04 0.41 -0.05 0.00 -0.40 0.00 0.00 41.96 41.96 1n80 s TYR 297 CO -0.10 -0.41 1.00 0.34 -1.57 0.00 0.00 175.55 174.81 1n80 s ASP 298 N 1.37 7.39 0.21 2.29 2.15 -1.26 -3.03 116.67 125.79 1n80 s ASP 298 Ca -0.09 1.79 -0.13 0.00 0.43 0.00 0.00 52.55 54.55 1n80 s ASP 298 Cb -0.07 -2.58 0.27 0.00 -0.30 0.00 0.00 42.92 40.24 1n80 s ASP 298 CO -0.14 -0.19 1.35 -2.65 -0.17 0.00 0.00 175.17 173.37 1n80 n PRO 299 N 3.27 -0.16 0.18 4.34 -0.02 -1.26 0.74 135.00 142.09 1n80 n PRO 299 Ca 0.04 1.34 0.11 0.00 -2.02 0.00 0.00 63.50 62.98 1n80 n PRO 299 Cb 0.49 -2.00 0.61 0.00 -0.02 0.00 0.00 33.50 32.58 1n80 n PRO 299 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1n80 h GLU 300 N 0.00 0.00 -0.39 -0.52 4.11 -1.94 -1.20 114.58 114.63 1n80 h GLU 300 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.77 1n80 h GLU 300 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1n80 h GLU 300 CO -0.87 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 177.96 1n80 n ASP 301 N -2.30 1.94 -4.29 3.06 8.00 0.23 -4.78 116.55 118.41 1n80 n ASP 301 Ca -0.01 -2.05 -0.19 0.00 0.71 0.00 0.00 54.79 53.25 1n80 n ASP 301 Cb 0.08 -0.27 -0.11 0.00 -0.02 0.00 0.00 41.12 40.81 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 -1.03 2.45 -0.41 0.64 1.43 -0.46 -2.23 118.68 119.08 1n80 s LEU 302 Ca 0.23 -0.88 -0.29 0.00 -1.03 0.00 0.00 54.13 52.16 1n80 s LEU 302 Cb 0.12 -0.64 0.02 0.00 0.03 0.00 0.00 46.19 45.72 1n80 s LEU 302 CO 0.14 -0.13 1.26 -0.32 0.23 0.00 0.00 176.35 177.53 1n80 s MET 303 N -2.98 3.73 0.49 1.70 -2.45 0.11 -4.30 119.30 115.61 1n80 s MET 303 Ca 0.14 0.87 -0.23 0.00 -1.25 0.00 0.00 55.69 55.22 1n80 s MET 303 Cb -0.04 -3.93 -0.08 0.00 1.25 0.00 0.00 34.83 32.03 1n80 s MET 303 CO 0.05 -1.36 1.12 2.89 1.05 0.00 0.00 175.02 178.77 1n80 n ARG 304 N 7.75 1.45 -0.97 4.11 1.85 -1.26 -1.72 116.66 127.87 1n80 n ARG 304 Ca 0.14 0.53 0.00 0.00 -1.00 0.00 0.00 57.85 57.52 1n80 n ARG 304 Cb 0.48 -2.25 0.00 0.00 -1.05 0.00 0.00 32.46 29.64 1n80 n ARG 304 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1n80 n HIS 305 N -0.81 0.00 -2.53 2.89 8.25 -1.26 -5.00 115.22 116.75 1n80 n HIS 305 Ca 0.10 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.31 1n80 n HIS 305 Cb 0.42 -0.79 0.03 0.00 1.12 0.00 0.00 29.99 30.77 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 -2.08 5.48 0.57 0.41 1.04 -0.70 -4.92 113.70 113.51 1n80 s SER 306 Ca 0.00 0.48 0.00 0.00 0.48 0.00 0.00 55.95 56.91 1n80 s SER 306 Cb 0.00 -1.46 0.00 0.00 0.10 0.00 0.00 66.02 64.66 1n80 s SER 306 CO 0.00 -1.07 0.00 0.61 0.98 0.00 0.00 173.24 173.76 1n80 n GLY 307 N -2.49 -1.11 2.93 7.32 0.00 -1.23 -4.61 105.19 106.00 1n80 n GLY 307 Ca 0.05 -1.14 -0.27 0.00 0.00 0.00 0.00 46.02 44.66 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 0.00 1.62 -0.61 1.61 0.41 0.37 -4.92 118.70 117.18 1n80 s GLU 308 Ca 0.00 -0.30 -0.27 0.00 -0.41 0.00 0.00 54.97 53.99 1n80 s GLU 308 Cb 0.00 -1.61 0.03 0.00 -1.78 0.00 0.00 34.13 30.78 1n80 s GLU 308 CO 0.00 -0.22 1.15 1.41 -0.49 0.00 0.00 175.26 177.11 1n80 s MET 309 N 1.54 3.40 0.05 1.61 -2.45 -1.26 -0.95 119.30 121.24 1n80 s MET 309 Ca 0.02 0.00 0.22 0.00 -1.25 0.00 0.00 55.69 54.69 1n80 s MET 309 Cb -0.13 -4.06 -0.11 0.00 1.25 0.00 0.00 34.83 31.77 1n80 s MET 309 CO -0.07 -1.74 0.84 0.44 1.05 0.00 0.00 175.02 175.54 1n80 n ILE 310 N 6.49 0.18 -3.81 10.11 -5.35 -0.85 -4.95 119.36 121.17 1n80 n ILE 310 Ca 0.06 -0.36 -0.12 0.00 -0.27 0.00 0.00 62.75 62.05 1n80 n ILE 310 Cb 0.49 0.12 -0.12 0.00 -1.74 0.00 0.00 39.64 38.38 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 -3.31 -0.17 -0.01 4.28 6.14 -1.24 -5.00 117.35 118.03 1n80 s TYR 311 Ca -0.00 0.42 0.00 0.00 0.64 0.00 0.00 57.07 58.12 1n80 s TYR 311 Cb 0.14 0.06 0.01 0.00 0.42 0.00 0.00 41.96 42.58 1n80 s TYR 311 CO 0.84 -0.13 0.00 -1.64 0.64 0.00 0.00 175.55 175.27 1n80 s MET 312 N -0.12 0.02 -0.06 4.97 -1.94 -1.26 -1.82 119.30 119.09 1n80 s MET 312 Ca -0.02 0.04 -0.02 0.00 -1.71 0.00 0.00 55.69 53.97 1n80 s MET 312 Cb -0.02 -0.09 0.04 0.00 2.01 0.00 0.00 34.83 36.77 1n80 s MET 312 CO 0.01 -0.04 0.11 -2.00 -0.01 0.00 0.00 175.02 173.09 1n80 s GLU 313 N 0.27 0.00 0.10 2.03 2.12 0.76 -4.89 118.70 119.09 1n80 s GLU 313 Ca -0.02 0.41 0.03 0.00 0.36 0.00 0.00 54.97 55.75 1n80 s GLU 313 Cb -0.03 -0.31 -0.04 0.00 0.26 0.00 0.00 34.13 34.00 1n80 s GLU 313 CO -0.01 -0.26 0.11 -0.80 -0.54 0.00 0.00 175.26 173.77 1n80 s ASN 314 N 1.82 5.63 0.07 -1.70 0.01 -1.26 -0.82 114.94 118.69 1n80 s ASN 314 Ca -0.01 -0.01 -0.27 0.00 -0.71 0.00 0.00 52.86 51.86 1n80 s ASN 314 Cb -0.12 -1.53 0.08 0.00 0.41 0.00 0.00 41.25 40.09 1n80 s ASN 314 CO -0.05 0.14 0.91 0.00 -1.51 0.00 0.00 177.10 176.59 1n80 s ARG 315 N -2.62 1.01 0.61 -0.60 1.70 -0.10 -4.92 118.95 114.03 1n80 s ARG 315 Ca 0.30 -0.47 -0.19 0.00 -0.47 0.00 0.00 55.73 54.90 1n80 s ARG 315 Cb -0.12 0.40 -0.03 0.00 -0.57 0.00 0.00 34.95 34.64 1n80 s ARG 315 CO 0.23 -0.45 1.27 -2.30 -1.08 0.00 0.00 175.30 172.97 1n80 n PRO 316 N -0.35 1.26 -1.57 3.89 -0.02 -1.26 -4.55 135.00 132.40 1n80 n PRO 316 Ca -0.08 0.48 -0.38 0.00 -2.02 0.00 0.00 63.50 61.50 1n80 n PRO 316 Cb 0.61 -2.50 0.04 0.00 -0.02 0.00 0.00 33.50 31.64 1n80 n PRO 316 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1n80 n PRO 317 N -1.52 0.84 -3.60 0.52 -0.04 -1.26 -4.77 135.00 125.17 1n80 n PRO 317 Ca 0.14 0.32 -0.29 0.00 -0.04 0.00 0.00 63.50 63.63 1n80 n PRO 317 Cb 0.47 -1.99 -0.12 0.00 -0.04 0.00 0.00 33.50 31.82 1n80 n PRO 317 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1n80 s ILE 318 N -1.54 1.01 0.06 0.52 -1.09 -0.79 -4.93 121.20 114.42 1n80 s ILE 318 Ca 0.72 -2.54 -0.31 0.00 -2.23 0.00 0.00 60.65 56.29 1n80 s ILE 318 Cb -0.45 -1.70 -0.07 0.00 -1.58 0.00 0.00 42.46 38.66 1n80 s ILE 318 CO 0.51 -1.00 1.45 -0.63 -1.23 0.00 0.00 174.94 174.04 1n80 s ILE 319 N 0.29 3.41 0.35 2.92 1.01 -1.26 -3.90 121.20 124.01 1n80 s ILE 319 Ca 0.22 0.90 0.08 0.00 0.00 0.00 0.00 60.65 61.85 1n80 s ILE 319 Cb -0.16 -3.58 -0.07 0.00 0.01 0.00 0.00 42.46 38.66 1n80 s ILE 319 CO -0.06 0.02 -0.06 0.00 0.00 0.00 0.00 174.94 174.85 1n80 s MET 320 N 1.98 1.80 0.00 2.79 0.23 -1.26 -5.01 119.30 119.83 1n80 s MET 320 Ca 0.66 -1.95 0.00 0.00 -1.03 0.00 0.00 55.69 53.37 1n80 s MET 320 Cb -0.35 -1.55 0.00 0.00 -1.53 0.00 0.00 34.83 31.40 1n80 s MET 320 CO 0.29 0.06 0.00 0.00 -2.03 0.00 0.00 175.02 173.34 1n80 n ALA 321 N -0.79 0.00 0.03 3.16 0.00 -1.26 -4.84 120.51 116.80 1n80 n ALA 321 Ca -0.05 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.23 1n80 n ALA 321 Cb 0.64 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.95 1n80 n ALA 321 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1n80 h MET 322 N 0.00 0.20 -0.67 0.00 2.86 -1.93 -3.40 114.93 111.99 1n80 h MET 322 Ca 0.00 -0.34 -0.35 0.00 -2.06 0.00 0.00 59.70 56.95 1n80 h MET 322 Cb 0.00 0.13 -0.41 0.00 0.06 0.00 0.00 31.60 31.38 1n80 h MET 322 CO 0.00 1.01 -1.04 -0.25 1.06 0.00 0.00 176.91 177.69 1n80 n ASP 323 N -3.37 2.50 -1.22 1.22 8.00 -1.26 -4.37 116.55 118.05 1n80 n ASP 323 Ca -0.21 -2.63 0.00 0.00 0.71 0.00 0.00 54.79 52.66 1n80 n ASP 323 Cb 1.05 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 41.69 1n80 n ASP 323 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 1n80 n GLN 324 N -0.53 2.21 -3.66 -1.24 7.27 -1.26 -4.92 117.38 115.25 1n80 n GLN 324 Ca 0.18 0.00 -0.13 0.00 0.07 0.00 0.00 57.00 57.11 1n80 n GLN 324 Cb 0.83 0.00 -0.08 0.00 2.41 0.00 0.00 30.24 33.40 1n80 n GLN 324 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 1n80 s THR 325 N 0.70 -0.00 -0.15 1.69 2.01 -1.26 -2.07 115.64 116.56 1n80 s THR 325 Ca 0.00 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 61.96 1n80 s THR 325 Cb 0.00 -0.88 -0.03 0.00 0.01 0.00 0.00 72.50 71.60 1n80 s THR 325 CO 0.00 0.00 -0.01 -1.61 -0.69 0.00 0.00 174.62 172.31 1n80 s GLU 326 N 0.42 3.64 -0.28 4.92 0.41 -0.64 -4.89 118.70 122.28 1n80 s GLU 326 Ca -0.01 -0.47 -0.26 0.00 -0.41 0.00 0.00 54.97 53.83 1n80 s GLU 326 Cb -0.05 -2.96 0.00 0.00 -1.78 0.00 0.00 34.13 29.35 1n80 s GLU 326 CO -0.00 0.32 0.90 -2.00 -0.49 0.00 0.00 175.26 173.98 1n80 s GLU 327 N 0.18 4.08 -0.19 1.61 2.12 -1.26 -0.99 118.70 124.25 1n80 s GLU 327 Ca -0.00 0.89 -0.15 0.00 0.36 0.00 0.00 54.97 56.07 1n80 s GLU 327 Cb -0.13 -3.70 -0.04 0.00 0.26 0.00 0.00 34.13 30.52 1n80 s GLU 327 CO 0.02 -0.68 0.35 0.42 -0.54 0.00 0.00 175.26 174.83 1n80 s ILE 328 N 3.11 5.24 -0.09 -3.70 -1.09 0.16 -5.01 121.20 119.83 1n80 s ILE 328 Ca 0.37 0.61 0.04 0.00 -2.23 0.00 0.00 60.65 59.45 1n80 s ILE 328 Cb -0.14 -3.68 -0.01 0.00 -1.58 0.00 0.00 42.46 37.05 1n80 s ILE 328 CO 0.11 0.30 -0.22 0.20 -1.23 0.00 0.00 174.94 174.10 1n80 s ASN 329 N 0.90 3.30 0.01 3.58 -0.87 -1.26 -2.99 114.94 117.61 1n80 s ASN 329 Ca 0.17 -0.48 0.02 0.00 -1.57 0.00 0.00 52.86 51.00 1n80 s ASN 329 Cb -0.14 -1.19 -0.01 0.00 -0.02 0.00 0.00 41.25 39.88 1n80 s ASN 329 CO 0.07 0.21 -0.06 -0.63 -2.57 0.00 0.00 177.10 174.12 1n80 s ILE 330 N 0.08 0.42 -0.18 0.60 1.01 -1.22 -4.94 121.20 116.97 1n80 s ILE 330 Ca -0.10 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.10 1n80 s ILE 330 Cb -0.16 -0.40 0.01 0.00 0.01 0.00 0.00 42.46 41.93 1n80 s ILE 330 CO 0.06 -0.04 -0.18 -0.76 0.00 0.00 0.00 174.94 174.02 1n80 s LEU 331 N -0.54 2.25 -0.17 2.97 1.43 -1.26 -0.88 118.68 122.49 1n80 s LEU 331 Ca -0.02 -0.61 -0.03 0.00 -1.03 0.00 0.00 54.13 52.45 1n80 s LEU 331 Cb -0.04 -1.52 -0.02 0.00 0.03 0.00 0.00 46.19 44.64 1n80 s LEU 331 CO -0.00 0.00 -0.07 -0.36 0.23 0.00 0.00 176.35 176.15 1n80 s PHE 332 N 1.28 2.93 -0.17 0.29 2.99 -0.03 -4.95 117.98 120.33 1n80 s PHE 332 Ca 0.04 -0.61 -0.00 0.00 0.00 0.00 0.00 56.93 56.36 1n80 s PHE 332 Cb -0.13 -1.97 -0.00 0.00 0.00 0.00 0.00 43.02 40.92 1n80 s PHE 332 CO -0.11 -0.26 -0.14 0.99 -0.00 0.00 0.00 175.22 175.71 1n80 s THR 333 N 0.72 2.73 -2.98 0.64 2.01 -1.26 0.81 115.64 118.31 1n80 s THR 333 Ca -0.03 -0.74 0.24 0.00 0.31 0.00 0.00 61.69 61.47 1n80 s THR 333 Cb -0.15 -2.17 0.21 0.00 0.01 0.00 0.00 72.50 70.40 1n80 s THR 333 CO 0.02 0.50 1.28 0.49 -0.69 0.00 0.00 174.62 176.22