#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 2.60 -0.28 9.51 2.02 -1.26 -5.11 117.35 124.83 1n80 s TYR 8 Ca 0.00 -0.23 -0.02 0.00 -0.37 0.00 0.00 57.07 56.45 1n80 s TYR 8 Cb 0.00 -1.41 0.09 0.00 -0.40 0.00 0.00 41.96 40.25 1n80 s TYR 8 CO 0.00 0.36 0.09 1.03 -1.57 0.00 0.00 175.55 175.46 1n80 s ARG 9 N -1.94 0.59 0.32 -0.62 3.00 -1.26 -5.13 118.95 113.91 1n80 s ARG 9 Ca 0.18 -0.84 0.04 0.00 0.00 0.00 0.00 55.73 55.11 1n80 s ARG 9 Cb -0.11 -1.83 -0.06 0.00 0.00 0.00 0.00 34.95 32.95 1n80 s ARG 9 CO 0.09 -0.93 0.05 0.00 0.00 0.00 0.00 175.30 174.52 1n80 s ALA 10 N 1.77 2.36 0.07 2.13 0.00 -1.26 -5.17 121.76 121.66 1n80 s ALA 10 Ca 0.08 -2.06 -0.26 0.00 0.00 0.00 0.00 51.96 49.72 1n80 s ALA 10 Cb -0.17 0.65 0.07 0.00 0.00 0.00 0.00 23.12 23.66 1n80 s ALA 10 CO -0.25 -0.30 0.62 0.96 0.00 0.00 0.00 175.76 176.79 1n80 s ILE 11 N -3.29 0.00 -0.26 0.00 -5.25 -1.26 -5.13 121.20 106.02 1n80 s ILE 11 Ca 0.36 -0.03 -0.10 0.00 -0.99 0.00 0.00 60.65 59.90 1n80 s ILE 11 Cb 0.09 -1.00 -0.05 0.00 2.95 0.00 0.00 42.46 44.45 1n80 s ILE 11 CO 0.15 -0.01 0.16 0.68 -1.79 0.00 0.00 174.94 174.13 1n80 s VAL 12 N -2.67 5.11 0.80 8.37 -7.23 -1.26 -5.07 120.40 118.45 1n80 s VAL 12 Ca -0.04 0.10 -0.11 0.00 -1.81 0.00 0.00 61.98 60.12 1n80 s VAL 12 Cb -0.01 -3.42 0.07 0.00 0.56 0.00 0.00 36.38 33.59 1n80 s VAL 12 CO -0.03 0.29 1.09 0.42 -0.31 0.00 0.00 175.10 176.56 1n80 s THR 13 N 1.55 3.21 0.57 5.32 -4.23 -1.26 -4.90 115.64 115.89 1n80 s THR 13 Ca 0.07 0.39 0.40 0.00 -1.18 0.00 0.00 61.69 61.37 1n80 s THR 13 Cb -0.15 -2.90 0.42 0.00 1.34 0.00 0.00 72.50 71.21 1n80 s THR 13 CO 0.08 -0.51 2.29 0.77 -0.54 0.00 0.00 174.62 176.71 1n80 h SER 14 N -1.20 0.00 0.52 3.99 4.64 -2.02 -0.49 113.55 118.98 1n80 h SER 14 Ca -0.45 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.86 1n80 h SER 14 Cb 1.24 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1n80 h SER 14 CO 0.52 0.01 -0.07 0.11 -0.87 0.00 0.00 176.83 176.53 1n80 h LYS 15 N 0.00 0.00 -0.01 4.77 1.57 -1.93 -2.04 116.57 118.93 1n80 h LYS 15 Ca -0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1n80 h LYS 15 Cb 0.09 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1n80 h LYS 15 CO 0.00 0.07 -0.37 0.35 -0.57 0.00 0.00 179.45 178.94 1n80 h PHE 16 N 0.00 0.03 -0.27 -1.35 -0.00 -1.43 -1.31 116.94 112.61 1n80 h PHE 16 Ca -0.00 -0.01 -0.06 0.00 -0.00 0.00 0.00 57.97 57.91 1n80 h PHE 16 Cb 0.35 -0.01 -0.01 0.00 -0.00 0.00 0.00 35.95 36.29 1n80 h PHE 16 CO 0.00 0.39 -0.05 0.00 -0.00 0.00 0.00 178.31 178.65 1n80 h ARG 17 N 0.02 0.51 -0.73 1.11 3.08 -1.52 0.11 114.38 116.97 1n80 h ARG 17 Ca -0.00 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 59.84 1n80 h ARG 17 Cb 0.66 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.65 1n80 h ARG 17 CO 0.05 0.71 0.36 1.15 -1.07 0.00 0.00 179.97 181.17 1n80 h THR 18 N 0.27 1.23 -0.46 2.04 2.02 -1.56 -1.50 112.91 114.95 1n80 h THR 18 Ca 0.07 -0.64 0.01 0.00 0.77 0.00 0.00 66.41 66.63 1n80 h THR 18 Cb 0.51 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.18 1n80 h THR 18 CO 0.02 0.27 0.29 -0.08 0.37 0.00 0.00 175.52 176.40 1n80 h GLU 19 N 1.04 0.57 -0.35 6.66 4.57 -0.82 0.10 114.58 126.36 1n80 h GLU 19 Ca 0.25 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.33 1n80 h GLU 19 Cb 0.09 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 1n80 h GLU 19 CO -0.03 0.38 -0.06 0.87 -1.18 0.00 0.00 179.01 178.98 1n80 h LYS 20 N 0.59 0.65 -0.49 1.92 1.57 -0.53 -1.03 116.57 119.25 1n80 h LYS 20 Ca 0.17 -0.24 0.05 0.00 -1.87 0.00 0.00 60.65 58.76 1n80 h LYS 20 Cb -0.04 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.18 1n80 h LYS 20 CO -0.05 0.81 0.23 1.98 -0.57 0.00 0.00 179.45 181.84 1n80 h MET 21 N 0.44 0.43 -0.10 3.15 4.05 -0.82 -1.08 114.93 121.00 1n80 h MET 21 Ca 0.09 -0.03 -0.08 0.00 -0.28 0.00 0.00 59.70 59.41 1n80 h MET 21 Cb 0.55 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.24 1n80 h MET 21 CO 0.03 0.28 -0.29 1.25 0.23 0.00 0.00 176.91 178.41 1n80 h LEU 22 N 0.44 0.19 -0.06 3.39 5.85 -0.65 -1.29 115.31 123.18 1n80 h LEU 22 Ca 0.22 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 1n80 h LEU 22 Cb 0.16 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 1n80 h LEU 22 CO -0.17 0.48 0.03 0.78 -0.34 0.00 0.00 178.44 179.22 1n80 h ASN 23 N 0.17 0.08 0.71 1.25 2.35 -0.40 0.12 115.58 119.86 1n80 h ASN 23 Ca 0.03 -0.14 -0.03 0.00 -0.55 0.00 0.00 56.30 55.61 1n80 h ASN 23 Cb 0.61 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 38.95 1n80 h ASN 23 CO 0.04 0.19 -0.41 0.15 -1.65 0.00 0.00 177.43 175.76 1n80 h PHE 24 N -0.04 -1.09 -0.67 1.19 3.04 -0.94 -0.02 116.94 118.41 1n80 h PHE 24 Ca 0.02 -0.01 0.12 0.00 3.98 0.00 0.00 57.97 62.07 1n80 h PHE 24 Cb 0.14 0.38 -0.08 0.00 2.56 0.00 0.00 35.95 38.95 1n80 h PHE 24 CO -0.03 -0.63 0.25 -0.92 -2.02 0.00 0.00 178.31 174.96 1n80 h TYR 25 N -1.05 0.42 0.00 0.41 3.20 -1.20 -1.62 116.97 117.13 1n80 h TYR 25 Ca -0.09 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.78 1n80 h TYR 25 Cb 0.84 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 39.01 1n80 h TYR 25 CO -0.08 0.07 -0.16 -0.91 -1.64 0.00 0.00 178.16 175.44 1n80 h ASN 26 N 0.41 0.00 0.97 -2.11 2.35 -0.53 -3.14 115.58 113.53 1n80 h ASN 26 Ca 0.35 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 56.00 1n80 h ASN 26 Cb 0.49 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 1n80 h ASN 26 CO -0.36 0.16 -0.48 0.77 -1.65 0.00 0.00 177.43 175.87 1n80 h SER 27 N 0.00 0.00 -2.89 5.81 4.64 0.02 -3.45 113.55 117.68 1n80 h SER 27 Ca -0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 1n80 h SER 27 Cb 0.59 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.72 1n80 h SER 27 CO 0.02 0.48 0.82 -0.63 -0.87 0.00 0.00 176.83 176.65 1n80 s ILE 28 N -3.40 2.86 0.00 0.95 1.01 -1.19 -0.80 121.20 120.63 1n80 s ILE 28 Ca 0.01 0.62 0.00 0.00 0.00 0.00 0.00 60.65 61.27 1n80 s ILE 28 Cb 0.10 -3.39 0.00 0.00 0.01 0.00 0.00 42.46 39.18 1n80 s ILE 28 CO 0.72 0.05 0.00 0.61 0.00 0.00 0.00 174.94 176.32 1n80 n GLY 29 N 3.65 0.69 3.10 6.18 0.00 0.71 -4.78 105.19 114.73 1n80 n GLY 29 Ca 0.13 0.35 -0.12 0.00 0.00 0.00 0.00 46.02 46.38 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 -0.23 0.00 1.61 1.04 -1.26 -4.53 113.70 112.33 1n80 s SER 30 Ca 0.00 0.63 0.00 0.00 0.48 0.00 0.00 55.95 57.06 1n80 s SER 30 Cb 0.00 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1n80 s SER 30 CO 0.00 -0.18 0.00 0.61 0.98 0.00 0.00 173.24 174.65 1n80 n GLY 31 N 4.44 3.01 0.12 7.32 0.00 -1.26 -4.64 105.19 114.18 1n80 n GLY 31 Ca -0.22 -1.97 -0.08 0.00 0.00 0.00 0.00 46.02 43.75 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 0.00 0.14 -0.21 1.61 0.13 -2.01 -2.47 132.00 129.19 1n80 h PRO 32 Ca 0.00 -0.01 -0.12 0.00 -0.87 0.00 0.00 66.00 65.00 1n80 h PRO 32 Cb 0.00 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.09 1n80 h PRO 32 CO 0.00 0.09 -0.39 0.38 -0.23 0.00 0.00 178.00 177.85 1n80 h ASP 33 N 0.15 0.49 -4.37 1.44 3.04 -1.99 -3.44 116.42 111.74 1n80 h ASP 33 Ca 0.11 -0.21 -0.48 0.00 -3.24 0.00 0.00 57.03 53.21 1n80 h ASP 33 Cb 0.11 -0.14 0.11 0.00 -1.04 0.00 0.00 39.33 38.37 1n80 h ASP 33 CO -0.14 0.84 0.36 -0.54 -2.04 0.00 0.00 179.24 177.71 1n80 s LYS 34 N -4.24 2.10 0.02 4.15 -0.14 -0.93 -5.05 119.74 115.66 1n80 s LYS 34 Ca -0.07 0.48 0.09 0.00 -1.36 0.00 0.00 55.97 55.11 1n80 s LYS 34 Cb 0.13 -1.93 -0.02 0.00 -1.68 0.00 0.00 37.83 34.32 1n80 s LYS 34 CO 0.81 -1.57 -0.26 -0.80 -0.76 0.00 0.00 175.35 172.77 1n80 s ASN 35 N -4.12 3.05 0.19 2.83 0.01 0.02 -4.62 114.94 112.31 1n80 s ASN 35 Ca 0.61 -0.53 0.08 0.00 -0.71 0.00 0.00 52.86 52.31 1n80 s ASN 35 Cb -0.13 -0.30 -0.04 0.00 0.41 0.00 0.00 41.25 41.18 1n80 s ASN 35 CO 0.53 0.28 -0.01 0.42 -1.51 0.00 0.00 177.10 176.80 1n80 s THR 36 N -0.72 3.60 -0.08 1.60 -4.23 -1.26 -0.21 115.64 114.35 1n80 s THR 36 Ca 0.11 -1.54 -0.04 0.00 -1.18 0.00 0.00 61.69 59.04 1n80 s THR 36 Cb -0.10 -2.83 0.04 0.00 1.34 0.00 0.00 72.50 70.95 1n80 s THR 36 CO 0.01 -0.16 0.18 -0.51 -0.54 0.00 0.00 174.62 173.60 1n80 s ILE 37 N -1.82 -0.04 0.19 2.99 -1.16 -1.26 -1.76 121.20 118.34 1n80 s ILE 37 Ca 0.28 0.14 0.10 0.00 -0.51 0.00 0.00 60.65 60.65 1n80 s ILE 37 Cb -0.09 -0.28 -0.04 0.00 0.61 0.00 0.00 42.46 42.66 1n80 s ILE 37 CO 0.18 0.06 -0.20 -0.36 -2.81 0.00 0.00 174.94 171.80 1n80 s PHE 38 N 0.99 2.05 0.17 3.50 0.40 -0.35 -0.14 117.98 124.61 1n80 s PHE 38 Ca -0.07 -0.41 0.10 0.00 -0.60 0.00 0.00 56.93 55.94 1n80 s PHE 38 Cb -0.09 -1.00 -0.04 0.00 0.51 0.00 0.00 43.02 42.39 1n80 s PHE 38 CO -0.06 0.44 -0.16 -1.50 0.70 0.00 0.00 175.22 174.64 1n80 s ILE 39 N -1.99 2.83 0.17 0.64 -1.16 0.24 -1.35 121.20 120.58 1n80 s ILE 39 Ca 0.19 -1.77 -0.03 0.00 -0.51 0.00 0.00 60.65 58.54 1n80 s ILE 39 Cb -0.06 -2.37 -0.03 0.00 0.61 0.00 0.00 42.46 40.61 1n80 s ILE 39 CO 0.09 -0.08 0.15 0.42 -2.81 0.00 0.00 174.94 172.71 1n80 s THR 40 N -1.60 0.05 0.15 4.00 -4.23 0.29 -1.44 115.64 112.86 1n80 s THR 40 Ca 0.22 -1.82 -0.19 0.00 -1.18 0.00 0.00 61.69 58.72 1n80 s THR 40 Cb -0.09 -2.18 0.05 0.00 1.34 0.00 0.00 72.50 71.61 1n80 s THR 40 CO 0.12 -0.24 0.49 0.72 -0.54 0.00 0.00 174.62 175.17 1n80 s PHE 41 N -4.07 -0.31 -3.04 3.99 -0.12 -1.12 -1.17 117.98 112.13 1n80 s PHE 41 Ca 0.28 0.02 0.00 0.00 -0.05 0.00 0.00 56.93 57.18 1n80 s PHE 41 Cb 0.06 0.39 0.00 0.00 -0.63 0.00 0.00 43.02 42.84 1n80 s PHE 41 CO 0.06 -0.79 0.00 0.41 -0.05 0.00 0.00 175.22 174.84 1n80 n GLY 42 N -0.30 -0.92 1.01 1.99 0.00 -0.83 -2.46 105.19 103.67 1n80 n GLY 42 Ca -0.15 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.88 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 0.00 0.13 1.61 0.63 -0.90 0.09 116.66 118.22 1n80 n ARG 43 Ca 0.00 0.34 -0.01 0.00 -0.92 0.00 0.00 57.85 57.25 1n80 n ARG 43 Cb 0.00 -0.88 0.14 0.00 0.45 0.00 0.00 32.46 32.17 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 0.00 0.00 -2.63 6.15 4.64 -1.87 -3.26 113.55 116.58 1n80 h SER 44 Ca 0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 1n80 h SER 44 Cb 0.00 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.14 1n80 h SER 44 CO 0.00 0.65 1.04 -0.70 -0.87 0.00 0.00 176.83 176.95 1n80 s GLU 45 N -3.47 4.13 0.41 4.77 2.12 -1.26 -4.67 118.70 120.74 1n80 s GLU 45 Ca -0.01 2.60 -0.23 0.00 0.36 0.00 0.00 54.97 57.69 1n80 s GLU 45 Cb 0.12 -3.24 -0.09 0.00 0.26 0.00 0.00 34.13 31.18 1n80 s GLU 45 CO 0.76 -0.78 1.02 -1.25 -0.54 0.00 0.00 175.26 174.48 1n80 s PRO 46 N 1.65 4.14 0.10 4.30 0.04 -1.26 -4.94 135.00 139.04 1n80 s PRO 46 Ca 0.77 1.41 -0.19 0.00 0.04 0.00 0.00 61.00 63.03 1n80 s PRO 46 Cb -0.48 -2.42 -0.07 0.00 0.04 0.00 0.00 34.50 31.56 1n80 s PRO 46 CO 0.33 -0.15 1.62 -1.49 0.04 0.00 0.00 177.00 177.35 1n80 h TRP 47 N 2.29 0.41 0.00 0.56 4.06 -1.96 -3.47 115.95 117.83 1n80 h TRP 47 Ca -0.48 -0.04 0.00 0.00 2.06 0.00 0.00 58.89 60.43 1n80 h TRP 47 Cb 1.21 -0.12 0.00 0.00 -1.00 0.00 0.00 29.16 29.25 1n80 h TRP 47 CO 0.58 0.45 0.00 -1.13 -3.56 0.00 0.00 178.44 174.78 1n80 n SER 48 N -4.75 0.00 -0.37 -3.49 3.41 -1.26 -5.05 113.62 102.11 1n80 n SER 48 Ca -0.03 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.48 1n80 n SER 48 Cb 0.15 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.01 1n80 n SER 48 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1n80 h SER 49 N 0.00 -1.95 0.00 4.04 4.64 -2.05 -2.61 113.55 115.62 1n80 h SER 49 Ca 0.00 0.30 -0.18 0.00 -0.47 0.00 0.00 61.79 61.44 1n80 h SER 49 Cb 0.00 0.86 -0.01 0.00 -0.31 0.00 0.00 62.40 62.95 1n80 h SER 49 CO 0.00 -0.21 1.23 -0.46 -0.87 0.00 0.00 176.83 176.52 1n80 n ASN 50 N -5.03 2.79 -0.01 4.97 0.23 -1.26 -3.96 115.26 112.98 1n80 n ASN 50 Ca 0.02 -2.07 -0.03 0.00 -0.53 0.00 0.00 54.58 51.97 1n80 n ASN 50 Cb 0.24 -0.75 -0.01 0.00 -2.08 0.00 0.00 39.78 37.18 1n80 n ASN 50 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1n80 n GLU 51 N 3.70 0.06 0.00 -3.83 0.28 -0.98 -4.66 120.64 115.21 1n80 n GLU 51 Ca 0.24 0.03 0.05 0.00 -0.16 0.00 0.00 57.16 57.32 1n80 n GLU 51 Cb 0.21 -0.60 0.28 0.00 1.43 0.00 0.00 31.44 32.76 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 -3.13 0.00 0.00 -1.84 4.13 -1.25 -4.54 115.26 108.63 1n80 n ASN 52 Ca -0.06 -0.56 0.00 0.00 1.68 0.00 0.00 54.58 55.64 1n80 n ASN 52 Cb 0.54 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.78 1n80 n ASN 52 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1n80 n GLU 53 N -0.84 0.00 -3.46 3.52 1.02 -1.26 -5.06 120.64 114.56 1n80 n GLU 53 Ca 0.07 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.17 1n80 n GLU 53 Cb 0.03 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.39 1n80 n GLU 53 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1n80 s VAL 54 N 0.00 -0.79 0.00 2.62 0.11 -1.26 -4.87 120.40 116.21 1n80 s VAL 54 Ca 0.00 0.03 0.00 0.00 -2.93 0.00 0.00 61.98 59.08 1n80 s VAL 54 Cb 0.00 -0.85 0.00 0.00 -1.53 0.00 0.00 36.38 34.00 1n80 s VAL 54 CO 0.00 -0.01 0.00 0.61 -3.33 0.00 0.00 175.10 172.37 1n80 n GLY 55 N 5.40 1.06 3.55 6.54 0.00 -1.26 -5.04 105.19 115.45 1n80 n GLY 55 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.00 2.22 -0.51 1.61 5.36 -1.26 -4.96 117.98 118.43 1n80 s PHE 56 Ca 0.00 -0.11 -0.28 0.00 -0.96 0.00 0.00 56.93 55.58 1n80 s PHE 56 Cb 0.00 -4.50 0.01 0.00 -0.34 0.00 0.00 43.02 38.19 1n80 s PHE 56 CO 0.00 -2.02 1.42 0.00 -1.46 0.00 0.00 175.22 173.16 1n80 s ALA 57 N 6.50 2.87 1.17 11.12 0.00 -1.26 -4.69 121.76 137.47 1n80 s ALA 57 Ca 0.48 -0.51 -0.16 0.00 0.00 0.00 0.00 51.96 51.78 1n80 s ALA 57 Cb -0.06 -4.05 0.27 0.00 0.00 0.00 0.00 23.12 19.28 1n80 s ALA 57 CO 0.05 -2.78 1.05 -1.25 0.00 0.00 0.00 175.76 172.83 1n80 s PRO 58 N 5.35 -0.94 0.65 0.00 0.04 -1.26 -5.00 135.00 133.84 1n80 s PRO 58 Ca 0.55 0.42 -0.14 0.00 0.04 0.00 0.00 61.00 61.88 1n80 s PRO 58 Cb -0.12 -1.59 -0.01 0.00 0.04 0.00 0.00 34.50 32.83 1n80 s PRO 58 CO 0.27 -3.63 1.07 -1.25 0.04 0.00 0.00 177.00 173.50 1n80 s PRO 59 N -4.90 3.02 0.05 0.56 0.04 -1.26 -5.00 135.00 127.51 1n80 s PRO 59 Ca 0.68 1.15 -0.30 0.00 0.04 0.00 0.00 61.00 62.57 1n80 s PRO 59 Cb -0.18 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.32 1n80 s PRO 59 CO 0.60 -1.04 1.04 0.71 0.04 0.00 0.00 177.00 178.34 1n80 s TYR 60 N -2.67 3.63 1.23 0.56 4.12 -1.26 -4.76 117.35 118.21 1n80 s TYR 60 Ca 0.62 1.62 -0.16 0.00 0.02 0.00 0.00 57.07 59.18 1n80 s TYR 60 Cb -0.16 -3.19 0.29 0.00 -1.52 0.00 0.00 41.96 37.38 1n80 s TYR 60 CO 0.45 -0.31 0.83 -0.35 0.02 0.00 0.00 175.55 176.19 1n80 n PRO 61 N 3.56 -2.88 -4.02 -1.71 -0.04 -1.26 -5.01 135.00 123.65 1n80 n PRO 61 Ca 0.06 -0.82 -0.34 0.00 -0.04 0.00 0.00 63.50 62.35 1n80 n PRO 61 Cb 0.49 -2.04 -0.15 0.00 -0.04 0.00 0.00 33.50 31.76 1n80 n PRO 61 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1n80 s THR 62 N -2.31 2.66 -1.22 0.52 -4.23 -1.26 -5.04 115.64 104.75 1n80 s THR 62 Ca 0.66 -0.76 -0.14 0.00 -1.18 0.00 0.00 61.69 60.28 1n80 s THR 62 Cb -0.21 -2.18 0.17 0.00 1.34 0.00 0.00 72.50 71.61 1n80 s THR 62 CO 0.64 0.47 1.47 -0.67 -0.54 0.00 0.00 174.62 175.99 1n80 n ASP 63 N 4.70 5.21 -3.58 3.99 4.64 -1.26 -3.71 116.55 126.54 1n80 n ASP 63 Ca -0.20 -2.98 -0.07 0.00 -1.38 0.00 0.00 54.79 50.17 1n80 n ASP 63 Cb 0.50 -1.57 -0.02 0.00 -1.04 0.00 0.00 41.12 38.99 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 2.76 -0.29 0.47 1.67 1.04 -1.26 -4.96 113.70 113.13 1n80 s SER 64 Ca 0.43 -0.11 0.26 0.00 0.48 0.00 0.00 55.95 57.01 1n80 s SER 64 Cb -0.02 0.39 1.30 0.00 0.10 0.00 0.00 66.02 67.80 1n80 s SER 64 CO 0.01 -0.66 1.82 0.58 0.98 0.00 0.00 173.24 175.96 1n80 h VAL 65 N 2.00 0.52 -0.62 5.02 2.07 -1.98 0.87 116.25 124.12 1n80 h VAL 65 Ca -0.22 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 1n80 h VAL 65 Cb 1.23 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1n80 h VAL 65 CO 0.29 0.04 0.35 0.17 0.02 0.00 0.00 177.57 178.43 1n80 h LEU 66 N 0.20 0.78 0.00 2.57 8.10 -1.94 -1.24 115.31 123.78 1n80 h LEU 66 Ca 0.53 -0.09 -0.00 0.00 0.11 0.00 0.00 57.88 58.43 1n80 h LEU 66 Cb 1.70 -0.20 0.00 0.00 -0.44 0.00 0.00 40.66 41.73 1n80 h LEU 66 CO -0.14 0.64 -0.00 1.23 -4.11 0.00 0.00 178.44 176.06 1n80 h GLY 67 N 0.85 -0.00 1.70 0.17 0.00 0.58 -2.93 103.07 103.45 1n80 h GLY 67 Ca 0.22 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.57 1n80 h GLY 67 CO -0.04 -0.00 0.13 -2.08 0.00 0.00 0.00 176.54 174.55 1n80 h VAL 68 N -0.61 0.26 -0.01 4.60 2.07 -1.02 -0.61 116.25 120.93 1n80 h VAL 68 Ca -0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1n80 h VAL 68 Cb 0.60 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1n80 h VAL 68 CO 0.00 0.00 -0.01 0.74 0.02 0.00 0.00 177.57 178.32 1n80 h THR 69 N 0.00 1.36 0.18 2.57 2.02 -1.10 -2.23 112.91 115.71 1n80 h THR 69 Ca 0.03 -1.09 0.00 0.00 0.77 0.00 0.00 66.41 66.12 1n80 h THR 69 Cb 0.29 2.08 -0.01 0.00 -1.74 0.00 0.00 68.15 68.77 1n80 h THR 69 CO -0.00 0.29 -0.15 0.44 0.37 0.00 0.00 175.52 176.47 1n80 h ASP 70 N -0.42 -0.40 -0.36 4.18 3.32 -0.95 -2.25 116.42 119.54 1n80 h ASP 70 Ca 0.00 0.04 0.08 0.00 0.02 0.00 0.00 57.03 57.17 1n80 h ASP 70 Cb 0.48 0.13 -0.08 0.00 0.22 0.00 0.00 39.33 40.08 1n80 h ASP 70 CO 0.00 -0.24 -0.17 -0.03 -1.72 0.00 0.00 179.24 177.08 1n80 h MET 71 N -0.35 -0.11 -0.49 3.56 4.05 -1.45 -0.35 114.93 119.79 1n80 h MET 71 Ca -0.00 0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.46 1n80 h MET 71 Cb 0.32 0.02 -0.04 0.00 -0.80 0.00 0.00 31.60 31.10 1n80 h MET 71 CO -0.02 -0.07 0.26 -1.49 0.23 0.00 0.00 176.91 175.82 1n80 h TRP 72 N -0.11 0.49 0.43 1.39 4.06 -1.26 -2.71 115.95 118.23 1n80 h TRP 72 Ca 0.18 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 61.13 1n80 h TRP 72 Cb 0.39 -0.15 0.00 0.00 -1.00 0.00 0.00 29.16 28.41 1n80 h TRP 72 CO -0.40 0.25 -0.21 1.79 -3.56 0.00 0.00 178.44 176.32 1n80 h THR 73 N 0.52 0.55 0.00 1.49 1.35 -0.88 -2.53 112.91 113.41 1n80 h THR 73 Ca 0.21 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 1n80 h THR 73 Cb 0.09 0.70 0.00 0.00 -1.73 0.00 0.00 68.15 67.21 1n80 h THR 73 CO -0.13 0.06 0.00 1.41 -0.25 0.00 0.00 175.52 176.60 1n80 n HIS 74 N -5.26 0.00 -0.59 4.73 8.25 -0.19 -4.83 115.22 117.34 1n80 n HIS 74 Ca -0.11 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.05 1n80 n HIS 74 Cb 0.28 -0.03 0.21 0.00 1.12 0.00 0.00 29.99 31.57 1n80 n HIS 74 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1n80 n MET 75 N 0.23 -1.97 0.11 -0.41 2.81 -0.95 -2.11 117.12 114.82 1n80 n MET 75 Ca 0.00 -0.55 0.00 0.00 -1.81 0.00 0.00 57.70 55.34 1n80 n MET 75 Cb 0.08 -1.92 0.00 0.00 -0.71 0.00 0.00 33.22 30.67 1n80 n MET 75 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 1n80 n MET 76 N -3.38 0.00 -4.11 0.03 2.81 -1.03 -4.65 117.12 106.79 1n80 n MET 76 Ca 0.02 0.00 -0.11 0.00 -1.81 0.00 0.00 57.70 55.80 1n80 n MET 76 Cb 0.58 0.00 -0.11 0.00 -0.71 0.00 0.00 33.22 32.99 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 -1.57 0.62 -0.16 3.03 0.00 -1.21 -4.27 107.32 103.76 1n80 s GLY 77 Ca 0.00 -1.06 -0.04 0.00 0.00 0.00 0.00 44.72 43.62 1n80 s GLY 77 CO 0.00 -1.14 0.08 -0.51 0.00 0.00 0.00 173.10 171.53 1n80 s THR 78 N -2.59 -0.01 -0.11 0.90 -4.23 -1.22 -2.80 115.64 105.58 1n80 s THR 78 Ca 0.01 -0.16 -0.06 0.00 -1.18 0.00 0.00 61.69 60.31 1n80 s THR 78 Cb -0.02 -0.59 -0.04 0.00 1.34 0.00 0.00 72.50 73.19 1n80 s THR 78 CO -0.03 -0.23 0.10 -0.69 -0.54 0.00 0.00 174.62 173.24 1n80 s VAL 79 N 2.11 5.18 0.38 2.29 1.01 -0.52 -2.79 120.40 128.06 1n80 s VAL 79 Ca 0.02 0.09 -0.24 0.00 0.00 0.00 0.00 61.98 61.85 1n80 s VAL 79 Cb -0.16 -3.24 -0.10 0.00 0.00 0.00 0.00 36.38 32.87 1n80 s VAL 79 CO -0.08 0.61 0.95 -0.75 0.00 0.00 0.00 175.10 175.83 1n80 s LYS 80 N -0.92 4.40 -0.15 2.72 2.20 -1.07 -0.59 119.74 126.33 1n80 s LYS 80 Ca 0.14 1.24 -0.03 0.00 -0.36 0.00 0.00 55.97 56.95 1n80 s LYS 80 Cb -0.12 -2.49 -0.03 0.00 -1.51 0.00 0.00 37.83 33.68 1n80 s LYS 80 CO 0.03 0.11 -0.03 0.08 -0.36 0.00 0.00 175.35 175.18 1n80 s VAL 81 N -1.89 3.92 0.11 4.02 1.01 0.80 -4.90 120.40 123.47 1n80 s VAL 81 Ca 0.56 -0.35 0.04 0.00 0.00 0.00 0.00 61.98 62.23 1n80 s VAL 81 Cb -0.14 -2.71 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 1n80 s VAL 81 CO 0.19 0.50 0.10 -0.76 0.00 0.00 0.00 175.10 175.13 1n80 s LEU 82 N 0.25 3.82 0.39 3.92 1.43 -1.26 -4.49 118.68 122.74 1n80 s LEU 82 Ca -0.03 -0.04 0.16 0.00 -1.03 0.00 0.00 54.13 53.19 1n80 s LEU 82 Cb -0.14 -2.48 1.03 0.00 0.03 0.00 0.00 46.19 44.63 1n80 s LEU 82 CO 0.03 0.14 1.80 -0.65 0.23 0.00 0.00 176.35 177.90 1n80 h PRO 83 N 3.00 0.46 0.00 1.29 0.11 -1.95 0.76 132.00 135.67 1n80 h PRO 83 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1n80 h PRO 83 Cb 1.17 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1n80 h PRO 83 CO 0.65 0.30 0.04 0.66 -0.21 0.00 0.00 178.00 179.45 1n80 h SER 84 N 0.47 0.00 -0.15 -2.05 4.64 -1.99 0.38 113.55 114.85 1n80 h SER 84 Ca 0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.87 1n80 h SER 84 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1n80 h SER 84 CO -0.27 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 175.92 1n80 n MET 85 N -2.34 1.80 -4.55 4.77 2.81 0.26 -4.86 117.12 115.01 1n80 n MET 85 Ca -0.02 -1.19 -0.33 0.00 -1.81 0.00 0.00 57.70 54.36 1n80 n MET 85 Cb 0.08 -1.42 -0.16 0.00 -0.71 0.00 0.00 33.22 31.01 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 -1.64 2.30 -0.11 4.03 1.43 0.13 -0.31 118.68 124.52 1n80 s LEU 86 Ca 0.34 -0.54 0.04 0.00 -1.03 0.00 0.00 54.13 52.93 1n80 s LEU 86 Cb 0.18 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.90 1n80 s LEU 86 CO 0.28 0.07 -0.24 -1.81 0.23 0.00 0.00 176.35 174.89 1n80 s ASP 87 N 0.86 3.08 -0.01 2.29 1.01 -0.81 -4.96 116.67 118.13 1n80 s ASP 87 Ca -0.05 -0.56 -0.30 0.00 0.71 0.00 0.00 52.55 52.34 1n80 s ASP 87 Cb -0.15 -1.41 -0.04 0.00 1.01 0.00 0.00 42.92 42.33 1n80 s ASP 87 CO -0.02 0.15 1.15 0.00 0.21 0.00 0.00 175.17 176.65 1n80 s ALA 88 N 0.42 3.39 0.23 5.23 0.00 -1.26 -0.15 121.76 129.62 1n80 s ALA 88 Ca -0.17 0.67 0.04 0.00 0.00 0.00 0.00 51.96 52.50 1n80 s ALA 88 Cb -0.18 -3.45 -0.05 0.00 0.00 0.00 0.00 23.12 19.44 1n80 s ALA 88 CO 0.07 -0.54 -0.03 0.14 0.00 0.00 0.00 175.76 175.40 1n80 s VAL 89 N 1.58 1.20 0.10 0.00 -7.23 0.58 -1.70 120.40 114.93 1n80 s VAL 89 Ca 0.56 -2.06 -0.02 0.00 -1.81 0.00 0.00 61.98 58.65 1n80 s VAL 89 Cb -0.25 -2.29 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 1n80 s VAL 89 CO 0.25 -0.38 0.03 0.27 -0.31 0.00 0.00 175.10 174.96 1n80 s ILE 90 N -3.31 0.15 0.26 -0.62 -4.36 -0.76 -3.96 121.20 108.60 1n80 s ILE 90 Ca 0.27 -1.81 -0.31 0.00 -0.26 0.00 0.00 60.65 58.54 1n80 s ILE 90 Cb 0.05 -1.78 -0.11 0.00 1.25 0.00 0.00 42.46 41.87 1n80 s ILE 90 CO 0.08 -0.70 1.61 -2.84 0.24 0.00 0.00 174.94 173.34 1n80 s PRO 91 N -3.98 4.14 -0.26 0.37 0.02 -1.26 -1.77 135.00 132.26 1n80 s PRO 91 Ca 0.16 2.55 -0.22 0.00 0.02 0.00 0.00 61.00 63.51 1n80 s PRO 91 Cb 0.07 -3.05 -0.01 0.00 0.02 0.00 0.00 34.50 31.53 1n80 s PRO 91 CO -0.04 -0.64 0.69 0.50 -0.33 0.00 0.00 177.00 177.18 1n80 s ARG 92 N 0.04 4.11 -0.53 5.54 3.52 0.11 -4.70 118.95 127.05 1n80 s ARG 92 Ca 0.66 0.64 0.04 0.00 -0.13 0.00 0.00 55.73 56.94 1n80 s ARG 92 Cb -0.48 -3.66 0.15 0.00 -1.56 0.00 0.00 34.95 29.41 1n80 s ARG 92 CO 0.42 -0.47 0.33 0.50 -0.81 0.00 0.00 175.30 175.28 1n80 s ARG 93 N 2.63 1.69 0.10 5.12 6.06 -1.26 -4.86 118.95 128.44 1n80 s ARG 93 Ca 0.29 -2.52 -0.31 0.00 -2.50 0.00 0.00 55.73 50.69 1n80 s ARG 93 Cb -0.15 -2.69 -0.07 0.00 0.06 0.00 0.00 34.95 32.10 1n80 s ARG 93 CO 0.09 -1.22 1.30 -0.51 -2.50 0.00 0.00 175.30 172.46 1n80 s ASP 94 N -0.33 6.94 0.11 -2.12 -0.00 -1.26 -2.52 116.67 117.48 1n80 s ASP 94 Ca 0.22 2.21 -0.31 0.00 -0.00 0.00 0.00 52.55 54.67 1n80 s ASP 94 Cb -0.15 -2.59 -0.09 0.00 -0.00 0.00 0.00 42.92 40.10 1n80 s ASP 94 CO -0.08 -0.56 1.64 0.86 -0.00 0.00 0.00 175.17 177.03 1n80 s TRP 95 N 0.96 2.65 0.00 4.23 -0.00 -0.71 -2.77 118.94 123.30 1n80 s TRP 95 Ca 0.61 0.40 0.00 0.00 -0.00 0.00 0.00 56.10 57.11 1n80 s TRP 95 Cb -0.34 -3.98 0.00 0.00 -0.00 0.00 0.00 33.47 29.15 1n80 s TRP 95 CO 0.31 -3.81 0.00 0.41 -0.00 0.00 0.00 176.95 173.86 1n80 n GLY 96 N 3.93 0.65 3.57 5.86 0.00 -0.64 -4.67 105.19 113.90 1n80 n GLY 96 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.23 6.10 0.00 1.61 3.68 -1.11 -4.79 116.67 119.92 1n80 s ASP 97 Ca 0.00 -1.67 0.05 0.00 2.13 0.00 0.00 52.55 53.06 1n80 s ASP 97 Cb 0.00 -2.57 0.27 0.00 -1.45 0.00 0.00 42.92 39.17 1n80 s ASP 97 CO 0.00 -1.90 0.66 0.35 0.13 0.00 0.00 175.17 174.41 1n80 n THR 98 N 7.07 0.00 0.41 1.71 -2.24 -1.26 -1.58 114.28 118.40 1n80 n THR 98 Ca 0.41 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 62.33 1n80 n THR 98 Cb 0.48 -0.75 0.40 0.00 -2.10 0.00 0.00 70.33 68.36 1n80 n THR 98 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1n80 h ARG 99 N 0.00 0.00 -5.37 -0.78 3.08 -2.00 -3.45 114.38 105.86 1n80 h ARG 99 Ca 0.00 0.00 -0.44 0.00 0.07 0.00 0.00 59.98 59.61 1n80 h ARG 99 Cb 0.00 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 29.91 1n80 h ARG 99 CO 0.00 0.00 -0.68 0.71 -1.07 0.00 0.00 179.97 178.93 1n80 s TYR 100 N -3.27 1.74 0.61 3.04 2.02 -0.61 -5.13 117.35 115.75 1n80 s TYR 100 Ca 0.07 -0.74 -0.18 0.00 -0.37 0.00 0.00 57.07 55.85 1n80 s TYR 100 Cb 0.09 -0.96 -0.07 0.00 -0.40 0.00 0.00 41.96 40.62 1n80 s TYR 100 CO 0.57 0.19 0.54 -2.30 -1.57 0.00 0.00 175.55 172.99 1n80 n PRO 101 N -0.47 0.48 -3.10 -1.71 -0.02 -1.26 -4.01 135.00 124.91 1n80 n PRO 101 Ca -0.06 0.19 -0.26 0.00 -2.02 0.00 0.00 63.50 61.35 1n80 n PRO 101 Cb 0.63 -1.76 0.02 0.00 -0.02 0.00 0.00 33.50 32.37 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 0.23 -3.91 -0.07 2.55 10.43 -1.26 -4.86 116.55 119.66 1n80 n ASP 102 Ca 0.11 -0.35 0.14 0.00 2.57 0.00 0.00 54.79 57.27 1n80 n ASP 102 Cb 0.48 -1.19 0.62 0.00 1.84 0.00 0.00 41.12 42.87 1n80 n ASP 102 CO 0.00 0.00 0.00 -2.65 -1.07 0.00 0.00 177.20 173.48 1n80 n PRO 103 N -0.84 0.54 0.00 -0.24 -0.02 -1.26 -4.05 135.00 129.14 1n80 n PRO 103 Ca -0.13 -0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.20 1n80 n PRO 103 Cb 0.52 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.50 1n80 n PRO 103 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1n80 n TYR 104 N -1.10 0.00 -4.36 6.00 4.01 -1.26 -1.62 117.16 118.82 1n80 n TYR 104 Ca 0.13 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.53 1n80 n TYR 104 Cb 0.28 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.19 1n80 n TYR 104 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 1n80 s THR 105 N -0.30 4.05 0.45 -0.72 -4.23 -1.26 0.26 115.64 113.89 1n80 s THR 105 Ca 0.00 -0.31 0.03 0.00 -1.18 0.00 0.00 61.69 60.23 1n80 s THR 105 Cb 0.00 -2.76 -0.02 0.00 1.34 0.00 0.00 72.50 71.05 1n80 s THR 105 CO 0.00 0.51 0.08 -0.36 -0.54 0.00 0.00 174.62 174.31 1n80 s PHE 106 N 0.13 1.84 -0.09 3.99 0.08 -1.26 -4.90 117.98 117.77 1n80 s PHE 106 Ca -0.00 -1.14 -0.08 0.00 0.12 0.00 0.00 56.93 55.83 1n80 s PHE 106 Cb -0.13 -1.35 0.03 0.00 -0.57 0.00 0.00 43.02 40.99 1n80 s PHE 106 CO 0.02 -0.07 0.24 1.03 -0.10 0.00 0.00 175.22 176.34 1n80 s ARG 107 N -3.78 0.27 0.14 0.44 0.52 -1.26 -4.62 118.95 110.66 1n80 s ARG 107 Ca 0.17 0.35 -0.30 0.00 -0.52 0.00 0.00 55.73 55.42 1n80 s ARG 107 Cb 0.02 0.11 -0.17 0.00 0.52 0.00 0.00 34.95 35.43 1n80 s ARG 107 CO 0.10 -0.05 0.66 -0.89 0.02 0.00 0.00 175.30 175.14 1n80 n ILE 108 N 3.08 1.35 -0.55 1.52 5.41 -1.26 -1.33 119.36 127.59 1n80 n ILE 108 Ca -0.14 -0.34 0.00 0.00 1.00 0.00 0.00 62.75 63.27 1n80 n ILE 108 Cb 0.58 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.51 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 1.78 0.00 -4.73 4.38 3.02 -0.09 -4.97 115.26 114.66 1n80 n ASN 109 Ca 0.18 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.32 1n80 n ASN 109 Cb 0.19 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.33 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 -3.36 7.13 -0.25 6.41 -0.00 -0.45 -4.77 116.67 121.38 1n80 s ASP 110 Ca 0.00 2.12 -0.11 0.00 -0.00 0.00 0.00 52.55 54.55 1n80 s ASP 110 Cb 0.00 -2.60 -0.05 0.00 -0.00 0.00 0.00 42.92 40.28 1n80 s ASP 110 CO 0.00 -0.37 0.20 -0.63 -0.00 0.00 0.00 175.17 174.36 1n80 s ILE 111 N 0.32 5.33 -0.02 0.77 1.09 -1.26 -1.49 121.20 125.94 1n80 s ILE 111 Ca 0.54 0.24 0.06 0.00 -1.10 0.00 0.00 60.65 60.39 1n80 s ILE 111 Cb -0.31 -3.53 -0.02 0.00 -1.06 0.00 0.00 42.46 37.54 1n80 s ILE 111 CO 0.33 0.31 -0.21 -0.69 -0.10 0.00 0.00 174.94 174.59 1n80 s VAL 112 N 1.27 2.52 -0.09 2.92 1.01 0.12 -4.35 120.40 123.80 1n80 s VAL 112 Ca 0.09 -0.99 -0.14 0.00 0.00 0.00 0.00 61.98 60.94 1n80 s VAL 112 Cb -0.14 -1.95 -0.05 0.00 0.00 0.00 0.00 36.38 34.24 1n80 s VAL 112 CO 0.06 0.55 0.33 -0.69 0.00 0.00 0.00 175.10 175.35 1n80 s VAL 113 N -0.70 5.23 0.38 2.92 1.01 -1.05 -0.46 120.40 127.73 1n80 s VAL 113 Ca 0.11 0.64 0.04 0.00 0.00 0.00 0.00 61.98 62.77 1n80 s VAL 113 Cb -0.10 -3.64 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 1n80 s VAL 113 CO 0.00 0.48 0.07 0.00 0.00 0.00 0.00 175.10 175.65 1n80 n ASN 115 N -0.96 -5.95 -0.10 0.00 5.15 -1.20 -1.52 115.26 110.68 1n80 n ASN 115 Ca -0.06 -0.35 0.03 0.00 -0.60 0.00 0.00 54.58 53.60 1n80 n ASN 115 Cb 0.66 -4.79 -0.01 0.00 -0.53 0.00 0.00 39.78 35.11 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 -2.60 0.76 -3.66 1.20 3.41 -1.26 -4.26 113.62 107.22 1n80 n SER 116 Ca -0.08 -0.88 -0.09 0.00 -0.26 0.00 0.00 58.87 57.56 1n80 n SER 116 Cb 0.60 0.60 -0.02 0.00 -0.26 0.00 0.00 64.21 65.14 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 -1.13 -1.44 0.20 7.33 0.00 -1.26 -4.99 121.76 120.47 1n80 s ALA 117 Ca 0.04 0.12 -0.13 0.00 0.00 0.00 0.00 51.96 51.99 1n80 s ALA 117 Cb 0.05 0.81 0.23 0.00 0.00 0.00 0.00 23.12 24.21 1n80 s ALA 117 CO 0.17 -0.92 1.65 -1.35 0.00 0.00 0.00 175.76 175.31 1n80 h PRO 118 N 2.00 0.05 0.00 0.00 0.11 -1.97 1.45 132.00 133.65 1n80 h PRO 118 Ca -0.25 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1n80 h PRO 118 Cb 1.27 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1n80 h PRO 118 CO 0.29 0.03 0.00 2.48 -0.21 0.00 0.00 178.00 180.60 1n80 n TYR 119 N -5.33 0.00 -0.11 0.65 4.11 -1.26 -2.93 117.16 112.30 1n80 n TYR 119 Ca 0.07 0.00 -0.16 0.00 -0.00 0.00 0.00 57.90 57.81 1n80 n TYR 119 Cb 0.32 -0.30 -0.09 0.00 -0.00 0.00 0.00 39.34 39.26 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 -1.30 2.26 -1.47 9.48 5.03 0.25 -4.93 115.26 124.58 1n80 n ASN 120 Ca 0.07 -0.06 -0.17 0.00 0.87 0.00 0.00 54.58 55.29 1n80 n ASN 120 Cb 0.12 -0.38 -0.01 0.00 -1.02 0.00 0.00 39.78 38.49 1n80 n ASN 120 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1n80 n ALA 121 N -3.24 -1.61 0.00 5.41 0.00 0.43 -3.25 120.51 118.26 1n80 n ALA 121 Ca -0.38 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1n80 n ALA 121 Cb 0.88 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 19.79 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 0.12 0.00 -3.20 0.00 -2.24 -1.26 -4.82 114.28 102.88 1n80 n THR 122 Ca 0.06 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.84 1n80 n THR 122 Cb 0.07 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.28 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 -0.24 0.53 0.40 -0.78 2.12 -1.26 -4.91 118.70 114.56 1n80 s GLU 123 Ca 0.00 0.35 -0.26 0.00 0.36 0.00 0.00 54.97 55.42 1n80 s GLU 123 Cb 0.00 0.06 -0.09 0.00 0.26 0.00 0.00 34.13 34.36 1n80 s GLU 123 CO 0.00 -1.06 1.23 -1.54 -0.54 0.00 0.00 175.26 173.35 1n80 s SER 124 N 2.66 6.46 0.00 -1.70 1.04 -1.26 -2.87 113.70 118.03 1n80 s SER 124 Ca 0.10 2.48 0.00 0.00 0.48 0.00 0.00 55.95 59.02 1n80 s SER 124 Cb -0.10 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.39 1n80 s SER 124 CO -0.26 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 173.84 1n80 n GLY 125 N 0.68 3.40 3.94 7.32 0.00 -1.26 -5.05 105.19 114.23 1n80 n GLY 125 Ca 0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.75 4.17 0.30 4.61 0.00 -1.14 -5.11 121.76 121.84 1n80 s ALA 126 Ca 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 51.96 50.35 1n80 s ALA 126 Cb 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 23.12 21.67 1n80 s ALA 126 CO 0.00 -0.10 0.00 0.41 0.00 0.00 0.00 175.76 176.07 1n80 n GLY 127 N -1.60 1.14 3.73 0.00 0.00 -1.26 -5.01 105.19 102.19 1n80 n GLY 127 Ca 0.02 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 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 1.44 3.08 -0.10 1.61 0.51 -1.22 -4.80 118.94 119.45 1n80 s TRP 128 Ca 0.00 0.87 -0.03 0.00 -2.12 0.00 0.00 56.10 54.82 1n80 s TRP 128 Cb 0.00 -3.83 -0.03 0.00 -0.81 0.00 0.00 33.47 28.80 1n80 s TRP 128 CO 0.00 -2.88 0.03 -0.51 -0.51 0.00 0.00 176.95 173.08 1n80 s LEU 129 N 0.44 3.71 -0.04 2.99 1.43 -0.58 -1.18 118.68 125.46 1n80 s LEU 129 Ca 0.64 0.17 0.05 0.00 -1.03 0.00 0.00 54.13 53.97 1n80 s LEU 129 Cb -0.42 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 43.91 1n80 s LEU 129 CO 0.36 0.35 -0.18 -0.69 0.23 0.00 0.00 176.35 176.42 1n80 s VAL 130 N -0.70 2.71 0.07 -1.59 1.01 -0.13 0.24 120.40 122.01 1n80 s VAL 130 Ca 0.11 -0.86 0.01 0.00 0.00 0.00 0.00 61.98 61.24 1n80 s VAL 130 Cb -0.12 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 1n80 s VAL 130 CO 0.02 0.58 -0.05 -0.31 0.00 0.00 0.00 175.10 175.34 1n80 s TYR 131 N -0.69 0.73 -0.10 5.22 2.02 0.39 -1.14 117.35 123.78 1n80 s TYR 131 Ca 0.11 -0.90 0.02 0.00 -0.37 0.00 0.00 57.07 55.93 1n80 s TYR 131 Cb -0.10 -0.45 -0.02 0.00 -0.40 0.00 0.00 41.96 40.99 1n80 s TYR 131 CO 0.00 -0.21 -0.16 0.50 -1.57 0.00 0.00 175.55 174.11 1n80 s ARG 132 N -3.49 3.03 -0.43 -0.62 3.52 -0.45 0.15 118.95 120.65 1n80 s ARG 132 Ca 0.07 -0.73 -0.29 0.00 -0.13 0.00 0.00 55.73 54.65 1n80 s ARG 132 Cb 0.04 -2.48 0.01 0.00 -1.56 0.00 0.00 34.95 30.95 1n80 s ARG 132 CO -0.06 0.34 1.46 0.00 -0.81 0.00 0.00 175.30 176.23 1n80 h LEU 134 N 12.58 -0.00 -9.15 0.00 3.38 -1.20 -0.21 115.31 120.71 1n80 h LEU 134 Ca -0.28 -0.21 -0.63 0.00 0.09 0.00 0.00 57.88 56.85 1n80 h LEU 134 Cb 1.11 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.70 1n80 h LEU 134 CO 1.10 0.61 -0.78 -0.62 0.09 0.00 0.00 178.44 178.83 1n80 s ASP 135 N -5.69 3.55 0.23 -0.43 3.68 -1.09 -4.76 116.67 112.16 1n80 s ASP 135 Ca -0.04 -0.96 0.04 0.00 2.13 0.00 0.00 52.55 53.72 1n80 s ASP 135 Cb -0.01 -0.29 -0.05 0.00 -1.45 0.00 0.00 42.92 41.12 1n80 s ASP 135 CO 0.15 0.07 -0.02 0.68 0.13 0.00 0.00 175.17 176.18 1n80 s VAL 136 N -2.18 1.14 0.63 1.11 -7.23 -1.26 -2.24 120.40 110.37 1n80 s VAL 136 Ca 0.26 -2.05 -0.18 0.00 -1.81 0.00 0.00 61.98 58.20 1n80 s VAL 136 Cb -0.06 -2.31 -0.02 0.00 0.56 0.00 0.00 36.38 34.54 1n80 s VAL 136 CO 0.13 -0.36 1.26 -2.16 -0.31 0.00 0.00 175.10 173.66 1n80 s PRO 137 N -3.83 2.70 0.03 4.82 0.04 0.41 -4.79 135.00 134.38 1n80 s PRO 137 Ca 0.27 1.97 -0.11 0.00 0.04 0.00 0.00 61.00 63.17 1n80 s PRO 137 Cb 0.05 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.67 1n80 s PRO 137 CO 0.08 -1.46 1.18 -0.44 0.04 0.00 0.00 177.00 176.41 1n80 h ASP 138 N 0.65 -0.52 -2.37 6.66 5.19 -1.93 -3.43 116.42 120.68 1n80 h ASP 138 Ca -0.51 0.05 -0.56 0.00 -0.62 0.00 0.00 57.03 55.40 1n80 h ASP 138 Cb 1.32 0.19 0.04 0.00 0.18 0.00 0.00 39.33 41.07 1n80 h ASP 138 CO 0.54 -0.19 1.01 0.35 -3.12 0.00 0.00 179.24 177.83 1n80 n THR 139 N -3.43 0.26 0.00 0.35 -2.24 -1.26 -4.79 114.28 103.17 1n80 n THR 139 Ca -0.03 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1n80 n THR 139 Cb 0.14 -1.90 0.00 0.00 -2.10 0.00 0.00 70.33 66.47 1n80 n THR 139 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n80 n GLY 140 N 4.00 0.85 3.28 3.38 0.00 -1.26 -2.62 105.19 112.82 1n80 n GLY 140 Ca 0.18 -0.83 -0.39 0.00 0.00 0.00 0.00 46.02 44.98 1n80 n GLY 140 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1n80 s MET 141 N -2.00 2.61 0.00 1.61 -1.94 -1.03 -4.75 119.30 113.79 1n80 s MET 141 Ca 0.00 -1.30 0.00 0.00 -1.71 0.00 0.00 55.69 52.68 1n80 s MET 141 Cb 0.00 -3.62 0.00 0.00 2.01 0.00 0.00 34.83 33.22 1n80 s MET 141 CO 0.00 -0.80 0.57 0.00 -0.01 0.00 0.00 175.02 174.78 1n80 n SER 143 N -1.07 -4.86 -3.13 0.00 3.41 -1.26 -4.23 113.62 102.48 1n80 n SER 143 Ca 0.00 -0.52 0.05 0.00 -0.26 0.00 0.00 58.87 58.14 1n80 n SER 143 Cb 0.36 -3.93 0.00 0.00 -0.26 0.00 0.00 64.21 60.38 1n80 n SER 143 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1n80 s ILE 144 N -3.15 -0.34 0.00 -1.33 -4.36 -1.26 -4.91 121.20 105.86 1n80 s ILE 144 Ca 0.49 0.00 0.00 0.00 -0.26 0.00 0.00 60.65 60.88 1n80 s ILE 144 Cb -0.24 -0.32 0.00 0.00 1.25 0.00 0.00 42.46 43.15 1n80 s ILE 144 CO 0.60 0.00 0.00 0.00 0.24 0.00 0.00 174.94 175.78 1n80 n ALA 145 N 5.06 0.00 -1.77 2.27 0.00 -1.26 -4.12 120.51 120.70 1n80 n ALA 145 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1n80 n ALA 145 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 1n80 n ALA 145 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1n80 n SER 146 N 8.77 0.00 -4.06 0.00 3.41 -1.26 -4.95 113.62 115.53 1n80 n SER 146 Ca 0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.28 1n80 n SER 146 Cb 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 1n80 n SER 146 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1n80 n LEU 147 N -0.30 -0.89 -4.56 1.04 4.77 -1.26 -4.37 117.00 111.44 1n80 n LEU 147 Ca 0.00 -0.85 -0.34 0.00 -0.03 0.00 0.00 56.01 54.79 1n80 n LEU 147 Cb 0.00 -1.62 -0.11 0.00 -2.33 0.00 0.00 43.42 39.35 1n80 n LEU 147 CO 0.00 0.12 -0.37 0.42 -1.33 0.00 0.00 177.39 176.23 1n80 s THR 148 N -3.02 3.80 0.00 -5.08 -4.23 -1.26 -3.32 115.64 102.53 1n80 s THR 148 Ca 0.65 -0.42 0.00 0.00 -1.18 0.00 0.00 61.69 60.74 1n80 s THR 148 Cb -0.37 -2.60 0.00 0.00 1.34 0.00 0.00 72.50 70.87 1n80 s THR 148 CO 0.80 0.56 0.00 -0.67 -0.54 0.00 0.00 174.62 174.77 1n80 n ASP 149 N 2.69 0.00 0.00 3.99 2.03 -1.26 -4.96 116.55 119.04 1n80 n ASP 149 Ca -0.18 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.13 1n80 n ASP 149 Cb 0.53 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1n80 n ASP 149 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1n80 n LYS 150 N 0.00 0.00 -1.88 -0.67 4.01 -1.26 -4.73 118.16 113.64 1n80 n LYS 150 Ca 0.00 0.00 -0.39 0.00 -0.51 0.00 0.00 58.31 57.41 1n80 n LYS 150 Cb 0.00 0.00 -0.01 0.00 -0.51 0.00 0.00 35.03 34.51 1n80 n LYS 150 CO 0.00 0.00 0.00 -0.25 -1.11 0.00 0.00 177.40 176.04 1n80 n ASP 151 N -0.33 7.96 0.00 4.39 8.00 -1.26 -4.36 116.55 130.95 1n80 n ASP 151 Ca 0.00 -3.09 0.00 0.00 0.71 0.00 0.00 54.79 52.41 1n80 n ASP 151 Cb 0.00 -1.37 0.00 0.00 -0.02 0.00 0.00 41.12 39.73 1n80 n ASP 151 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1n80 n GLU 152 N 1.82 0.00 0.00 -1.24 2.13 -1.26 -4.36 120.64 117.74 1n80 n GLU 152 Ca 0.63 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.45 1n80 n GLU 152 Cb 0.28 -0.01 0.00 0.00 0.27 0.00 0.00 31.44 31.98 1n80 n GLU 152 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1n80 n LEU 154 N -1.03 2.69 -0.28 0.00 7.99 -1.26 0.14 117.00 125.25 1n80 n LEU 154 Ca 0.00 -0.10 0.00 0.00 -0.01 0.00 0.00 56.01 55.90 1n80 n LEU 154 Cb 0.03 -0.61 0.00 0.00 -0.11 0.00 0.00 43.42 42.74 1n80 n LEU 154 CO 0.00 0.80 0.15 1.17 -1.51 0.00 0.00 177.39 178.01 1n80 n LYS 155 N -3.05 0.43 -0.49 3.23 3.00 0.27 -1.95 118.16 119.60 1n80 n LYS 155 Ca -0.35 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 57.96 1n80 n LYS 155 Cb 0.90 -1.12 0.00 0.00 0.00 0.00 0.00 35.03 34.81 1n80 n LYS 155 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.40 178.87 1n80 n LEU 156 N -0.07 0.00 -3.59 3.14 -0.00 -1.16 -5.03 117.00 110.29 1n80 n LEU 156 Ca 0.00 -0.99 -0.27 0.00 -0.00 0.00 0.00 56.01 54.75 1n80 n LEU 156 Cb 0.06 0.00 0.05 0.00 -0.00 0.00 0.00 43.42 43.53 1n80 n LEU 156 CO 0.00 0.84 -0.05 0.61 -0.00 0.00 0.00 177.39 178.79 1n80 n GLY 157 N 0.00 -0.97 3.44 1.47 0.00 -0.82 -4.99 105.19 103.32 1n80 n GLY 157 Ca 0.00 0.46 -0.33 0.00 0.00 0.00 0.00 46.02 46.15 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 -3.53 1.63 0.57 -0.02 0.00 0.12 -5.02 107.32 101.07 1n80 s GLY 158 Ca 0.43 -0.85 -0.18 0.00 0.00 0.00 0.00 44.72 44.12 1n80 s GLY 158 CO 0.83 -0.14 0.59 1.17 0.00 0.00 0.00 173.10 175.55 1n80 n LYS 159 N 3.50 0.57 -3.68 2.90 3.00 -1.26 -4.58 118.16 118.61 1n80 n LYS 159 Ca -0.18 0.22 -0.21 0.00 -0.00 0.00 0.00 58.31 58.15 1n80 n LYS 159 Cb 0.53 -1.76 -0.18 0.00 0.00 0.00 0.00 35.03 33.62 1n80 n LYS 159 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.40 176.94 1n80 s TRP 160 N -1.68 0.13 -0.36 5.64 -0.11 -1.26 -4.35 118.94 116.94 1n80 s TRP 160 Ca 0.70 0.18 0.00 0.00 1.22 0.00 0.00 56.10 58.20 1n80 s TRP 160 Cb -0.45 -0.52 0.10 0.00 -1.50 0.00 0.00 33.47 31.10 1n80 s TRP 160 CO 0.53 -0.22 0.11 0.99 -4.62 0.00 0.00 176.95 173.74 1n80 s THR 161 N 2.15 2.78 0.00 5.86 2.01 -1.25 -4.71 115.64 122.48 1n80 s THR 161 Ca 0.05 -2.11 0.00 0.00 0.31 0.00 0.00 61.69 59.93 1n80 s THR 161 Cb -0.12 -2.93 0.00 0.00 0.01 0.00 0.00 72.50 69.46 1n80 s THR 161 CO -0.04 -0.58 0.00 -2.65 -0.69 0.00 0.00 174.62 170.66 1n80 n PRO 162 N 4.44 1.01 0.00 4.92 -0.02 -1.26 -2.47 135.00 141.61 1n80 n PRO 162 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 1n80 n PRO 162 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.90 1n80 n PRO 162 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1n80 n SER 163 N 0.00 0.00 -3.06 2.55 3.41 -1.08 -4.66 113.62 110.78 1n80 n SER 163 Ca 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.47 1n80 n SER 163 Cb 0.00 0.08 -0.01 0.00 -0.26 0.00 0.00 64.21 64.01 1n80 n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n80 n ALA 164 N -1.86 3.37 0.00 7.33 0.00 -1.26 -4.90 120.51 123.20 1n80 n ALA 164 Ca 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 53.44 52.20 1n80 n ALA 164 Cb 0.00 -2.78 0.00 0.00 0.00 0.00 0.00 19.45 16.67 1n80 n ALA 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1n80 n ARG 165 N 4.36 0.00 -2.59 0.00 1.74 -1.26 -4.85 116.66 114.06 1n80 n ARG 165 Ca 0.28 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.93 1n80 n ARG 165 Cb 0.10 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.52 1n80 n ARG 165 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1n80 s SER 166 N 0.00 7.15 -0.01 0.55 0.15 0.14 -4.92 113.70 116.76 1n80 s SER 166 Ca 0.00 1.62 0.10 0.00 0.70 0.00 0.00 55.95 58.37 1n80 s SER 166 Cb 0.00 -2.55 -0.13 0.00 -1.71 0.00 0.00 66.02 61.63 1n80 s SER 166 CO 0.00 -0.53 0.29 0.80 1.20 0.00 0.00 173.24 175.00 1n80 n MET 167 N 5.29 1.81 -3.84 5.44 1.56 -1.26 -4.80 117.12 121.32 1n80 n MET 167 Ca 0.10 -0.05 -0.25 0.00 -0.27 0.00 0.00 57.70 57.23 1n80 n MET 167 Cb 0.47 -1.11 -0.17 0.00 2.15 0.00 0.00 33.22 34.56 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 -2.34 0.74 0.31 1.12 -1.32 -1.26 -5.13 115.64 107.76 1n80 s THR 168 Ca -0.01 -0.14 -0.29 0.00 -1.21 0.00 0.00 61.69 60.04 1n80 s THR 168 Cb 0.07 -0.84 -0.11 0.00 -1.51 0.00 0.00 72.50 70.11 1n80 s THR 168 CO 0.39 0.29 1.48 -2.84 -2.21 0.00 0.00 174.62 171.73 1n80 s PRO 169 N 1.82 4.19 0.28 7.08 0.02 -1.26 -4.90 135.00 142.24 1n80 s PRO 169 Ca 0.05 2.45 -0.29 0.00 0.02 0.00 0.00 61.00 63.22 1n80 s PRO 169 Cb -0.13 -3.04 -0.10 0.00 0.02 0.00 0.00 34.50 31.26 1n80 s PRO 169 CO -0.07 -0.48 1.15 -1.25 -0.33 0.00 0.00 177.00 176.02 1n80 s PRO 170 N -1.11 4.57 0.31 5.54 0.04 -1.26 -5.04 135.00 138.06 1n80 s PRO 170 Ca 0.57 1.89 0.06 0.00 0.04 0.00 0.00 61.00 63.56 1n80 s PRO 170 Cb -0.45 -3.17 -0.06 0.00 0.04 0.00 0.00 34.50 30.86 1n80 s PRO 170 CO 0.52 0.11 -0.01 -1.83 0.04 0.00 0.00 177.00 175.83 1n80 s GLU 171 N -1.45 1.65 1.77 4.56 -1.05 -1.26 -4.97 118.70 117.95 1n80 s GLU 171 Ca 0.46 -1.88 0.00 0.00 -0.15 0.00 0.00 54.97 53.40 1n80 s GLU 171 Cb -0.34 -1.16 0.00 0.00 -0.44 0.00 0.00 34.13 32.20 1n80 s GLU 171 CO 0.43 -0.04 0.00 0.41 0.95 0.00 0.00 175.26 177.01 1n80 n GLY 172 N -0.68 -1.17 1.37 -3.83 0.00 -1.26 -4.31 105.19 95.30 1n80 n GLY 172 Ca -0.04 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.85 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 -1.18 2.98 0.00 1.61 1.74 -1.26 -4.90 116.66 115.66 1n80 n ARG 173 Ca 0.00 -3.02 0.00 0.00 -0.77 0.00 0.00 57.85 54.06 1n80 n ARG 173 Cb 0.00 -1.98 0.00 0.00 -1.02 0.00 0.00 32.46 29.46 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 -0.52 0.82 0.00 -0.13 0.00 -1.26 -3.81 105.19 100.29 1n80 n GLY 174 Ca 0.31 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1n80 n GLY 174 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1n80 n ASP 175 N -3.29 0.00 0.00 1.61 3.85 -0.96 -4.60 116.55 113.16 1n80 n ASP 175 Ca 0.00 -0.60 0.00 0.00 -0.71 0.00 0.00 54.79 53.48 1n80 n ASP 175 Cb 0.00 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.77 1n80 n ASP 175 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1n80 n ALA 176 N -3.00 0.94 -0.62 2.12 0.00 -1.26 0.79 120.51 119.48 1n80 n ALA 176 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1n80 n ALA 176 Cb 0.00 -0.74 0.01 0.00 0.00 0.00 0.00 19.45 18.72 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 -1.11 1.53 -0.99 0.00 1.02 -1.26 -4.83 120.64 114.98 1n80 n GLU 177 Ca 0.00 -1.22 0.00 0.00 -0.02 0.00 0.00 57.16 55.92 1n80 n GLU 177 Cb 0.06 -0.84 0.00 0.00 -0.02 0.00 0.00 31.44 30.65 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 -0.38 0.23 3.75 0.62 0.00 0.24 -4.72 105.19 104.92 1n80 n GLY 178 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 1n80 n GLY 178 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1n80 s THR 179 N -1.46 3.66 -0.01 2.61 -4.23 -1.26 0.61 115.64 115.56 1n80 s THR 179 Ca 0.00 1.61 0.01 0.00 -1.18 0.00 0.00 61.69 62.13 1n80 s THR 179 Cb 0.00 -4.03 0.01 0.00 1.34 0.00 0.00 72.50 69.82 1n80 s THR 179 CO 0.00 0.36 -0.02 -0.63 -0.54 0.00 0.00 174.62 173.79 1n80 s ILE 180 N -0.95 0.20 -0.36 2.99 1.01 0.37 -2.26 121.20 122.19 1n80 s ILE 180 Ca 0.45 -0.06 0.01 0.00 0.00 0.00 0.00 60.65 61.05 1n80 s ILE 180 Cb -0.30 -0.21 0.11 0.00 0.01 0.00 0.00 42.46 42.07 1n80 s ILE 180 CO 0.38 0.08 0.14 -1.61 0.00 0.00 0.00 174.94 173.93 1n80 s GLU 181 N 0.22 1.09 0.10 2.79 2.02 -1.26 -0.01 118.70 123.64 1n80 s GLU 181 Ca -0.02 -1.58 -0.26 0.00 0.02 0.00 0.00 54.97 53.13 1n80 s GLU 181 Cb -0.04 -2.39 -0.11 0.00 0.10 0.00 0.00 34.13 31.69 1n80 s GLU 181 CO -0.01 -1.04 1.67 -1.35 0.02 0.00 0.00 175.26 174.55 1n80 h PRO 182 N 7.51 -0.37 0.00 0.39 0.11 -1.91 -3.47 132.00 134.26 1n80 h PRO 182 Ca -0.08 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.06 1n80 h PRO 182 Cb 0.98 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1n80 h PRO 182 CO 0.49 -0.25 0.00 0.41 -0.21 0.00 0.00 178.00 178.44 1n80 n GLY 183 N -1.31 0.78 2.02 -0.55 0.00 -1.26 -5.00 105.19 99.87 1n80 n GLY 183 Ca -0.07 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.86 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 4.68 0.00 1.61 5.68 -1.26 -4.86 116.55 122.40 1n80 n ASP 184 Ca 0.00 -3.29 0.00 0.00 -0.50 0.00 0.00 54.79 51.00 1n80 n ASP 184 Cb 0.00 -0.76 0.00 0.00 -1.14 0.00 0.00 41.12 39.22 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 -0.30 0.47 3.27 6.12 0.00 -1.26 -4.80 105.19 108.69 1n80 n GLY 185 Ca 0.43 -0.64 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.00 1.95 -0.02 1.61 1.51 -1.26 -0.45 117.35 118.69 1n80 s TYR 186 Ca 0.00 -0.38 0.04 0.00 -1.01 0.00 0.00 57.07 55.71 1n80 s TYR 186 Cb 0.00 -1.16 -0.00 0.00 -0.11 0.00 0.00 41.96 40.68 1n80 s TYR 186 CO 0.00 0.10 -0.12 0.08 -1.11 0.00 0.00 175.55 174.49 1n80 s VAL 187 N -0.79 1.02 0.18 0.71 1.01 -0.95 -3.72 120.40 117.86 1n80 s VAL 187 Ca 0.09 -0.52 0.06 0.00 0.00 0.00 0.00 61.98 61.61 1n80 s VAL 187 Cb -0.09 -0.87 -0.05 0.00 0.00 0.00 0.00 36.38 35.37 1n80 s VAL 187 CO 0.02 0.30 -0.11 0.26 0.00 0.00 0.00 175.10 175.57 1n80 s TRP 188 N -0.05 1.50 -0.12 5.22 0.52 0.98 -0.63 118.94 126.35 1n80 s TRP 188 Ca 0.00 -0.70 0.02 0.00 0.02 0.00 0.00 56.10 55.44 1n80 s TRP 188 Cb -0.08 -0.75 0.01 0.00 -1.15 0.00 0.00 33.47 31.50 1n80 s TRP 188 CO 0.00 0.19 -0.19 -2.00 0.02 0.00 0.00 176.95 174.97 1n80 s GLU 189 N -3.72 2.63 0.14 4.98 2.12 -0.32 0.14 118.70 124.67 1n80 s GLU 189 Ca 0.21 -0.71 -0.31 0.00 0.36 0.00 0.00 54.97 54.52 1n80 s GLU 189 Cb 0.02 -2.16 -0.08 0.00 0.26 0.00 0.00 34.13 32.17 1n80 s GLU 189 CO 0.04 -0.03 1.32 -0.47 -0.54 0.00 0.00 175.26 175.59 1n80 s TYR 190 N 0.87 3.29 0.00 5.30 5.04 0.20 -1.34 117.35 130.71 1n80 s TYR 190 Ca -0.08 1.13 0.00 0.00 -2.44 0.00 0.00 57.07 55.68 1n80 s TYR 190 Cb -0.15 -3.60 0.00 0.00 0.35 0.00 0.00 41.96 38.56 1n80 s TYR 190 CO -0.01 -1.97 0.00 1.28 -1.34 0.00 0.00 175.55 173.51 1n80 n LEU 191 N 3.42 0.00 0.00 6.97 4.77 -0.29 -4.82 117.00 127.05 1n80 n LEU 191 Ca 0.09 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 56.04 1n80 n LEU 191 Cb 0.43 -0.28 0.01 0.00 -2.33 0.00 0.00 43.42 41.25 1n80 n LEU 191 CO 0.58 -0.43 0.30 2.22 -1.33 0.00 0.00 177.39 178.72 1n80 n PHE 192 N -2.34 -1.24 -4.59 -1.77 1.16 -1.21 -4.89 117.46 102.58 1n80 n PHE 192 Ca 0.00 -0.68 -0.22 0.00 -1.87 0.00 0.00 57.45 54.68 1n80 n PHE 192 Cb 0.00 0.34 -0.15 0.00 -1.61 0.00 0.00 39.48 38.06 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 1.12 -0.22 3.97 2.12 -0.57 -0.95 118.70 122.14 1n80 s GLU 193 Ca 0.09 -0.59 -0.10 0.00 0.36 0.00 0.00 54.97 54.73 1n80 s GLU 193 Cb -0.02 -1.10 -0.05 0.00 0.26 0.00 0.00 34.13 33.23 1n80 s GLU 193 CO 0.04 0.29 0.14 0.42 -0.54 0.00 0.00 175.26 175.61 1n80 s ILE 194 N -0.47 5.29 0.41 -3.70 1.01 -0.33 -4.16 121.20 119.25 1n80 s ILE 194 Ca 0.05 0.15 -0.26 0.00 0.00 0.00 0.00 60.65 60.59 1n80 s ILE 194 Cb -0.06 -3.44 -0.09 0.00 0.01 0.00 0.00 42.46 38.88 1n80 s ILE 194 CO -0.00 0.39 1.29 -2.84 0.00 0.00 0.00 174.94 173.78 1n80 s PRO 195 N 0.77 3.95 0.33 2.79 0.02 -1.26 -3.45 135.00 138.16 1n80 s PRO 195 Ca 0.07 2.13 0.11 0.00 0.02 0.00 0.00 61.00 63.33 1n80 s PRO 195 Cb -0.13 -2.73 0.97 0.00 0.02 0.00 0.00 34.50 32.63 1n80 s PRO 195 CO 0.02 -0.50 1.70 -1.35 -0.33 0.00 0.00 177.00 176.54 1n80 h PRO 196 N 2.64 0.45 -0.59 5.54 0.11 -1.96 0.18 132.00 138.37 1n80 h PRO 196 Ca -0.50 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.53 1n80 h PRO 196 Cb 1.25 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 1n80 h PRO 196 CO 0.62 0.30 0.12 0.38 -0.21 0.00 0.00 178.00 179.21 1n80 h ASP 197 N 0.47 0.88 -0.22 -2.05 3.04 -2.00 -2.23 116.42 114.30 1n80 h ASP 197 Ca 0.68 -0.18 -0.18 0.00 -3.24 0.00 0.00 57.03 54.11 1n80 h ASP 197 Cb 1.41 -0.23 -0.00 0.00 -1.04 0.00 0.00 39.33 39.47 1n80 h ASP 197 CO -0.53 0.87 -0.55 0.58 -2.04 0.00 0.00 179.24 177.57 1n80 h VAL 198 N 0.89 1.28 -0.28 4.15 2.07 -1.03 -2.00 116.25 121.33 1n80 h VAL 198 Ca 0.19 -1.75 0.02 0.00 0.82 0.00 0.00 66.70 65.98 1n80 h VAL 198 Cb 0.35 1.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 1n80 h VAL 198 CO 0.00 0.57 0.12 0.28 0.02 0.00 0.00 177.57 178.56 1n80 h SER 199 N 0.63 0.16 0.13 0.57 0.02 -1.12 0.22 113.55 114.16 1n80 h SER 199 Ca 0.01 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 1n80 h SER 199 Cb 1.15 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.68 1n80 h SER 199 CO 0.12 0.13 -0.06 0.40 -1.14 0.00 0.00 176.83 176.28 1n80 h ILE 200 N 0.26 1.02 0.00 3.27 2.04 -1.39 -3.20 117.51 119.52 1n80 h ILE 200 Ca 0.12 -0.69 0.00 0.00 1.00 0.00 0.00 64.86 65.29 1n80 h ILE 200 Cb 0.06 1.44 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1n80 h ILE 200 CO -0.10 0.16 -0.90 0.78 0.00 0.00 0.00 178.15 178.09 1n80 h ASN 201 N -0.51 0.00 0.00 1.72 -0.26 -1.34 -3.42 115.58 111.77 1n80 h ASN 201 Ca -0.02 -0.07 -0.03 0.00 -0.56 0.00 0.00 56.30 55.62 1n80 h ASN 201 Cb 0.40 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.66 1n80 h ASN 201 CO 0.03 0.03 -1.13 0.54 -1.06 0.00 0.00 177.43 175.84 1n80 n ARG 202 N -2.52 2.31 -2.12 0.81 5.12 0.73 -5.05 116.66 115.93 1n80 n ARG 202 Ca 0.01 0.00 -0.28 0.00 -1.93 0.00 0.00 57.85 55.66 1n80 n ARG 202 Cb 0.52 -1.05 0.05 0.00 -1.16 0.00 0.00 32.46 30.83 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 -2.91 0.00 0.30 0.00 -2.24 -0.21 -4.84 114.28 104.39 1n80 n THR 204 Ca 0.07 -2.41 0.17 0.00 -2.27 0.00 0.00 64.05 59.61 1n80 n THR 204 Cb 0.59 1.22 0.79 0.00 -2.10 0.00 0.00 70.33 70.83 1n80 n THR 204 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 175.07 173.37 1n80 h ASN 205 N 2.07 0.00 0.00 3.42 -0.73 -1.98 -3.20 115.58 115.16 1n80 h ASN 205 Ca -0.24 0.00 -0.38 0.00 1.87 0.00 0.00 56.30 57.55 1n80 h ASN 205 Cb 1.21 0.00 -0.07 0.00 0.27 0.00 0.00 38.32 39.74 1n80 h ASN 205 CO 0.35 0.00 -2.42 -0.62 -0.37 0.00 0.00 177.43 174.36 1n80 n GLU 206 N -2.83 0.65 -4.20 6.67 -0.58 -1.26 -4.82 120.64 114.26 1n80 n GLU 206 Ca -0.00 0.13 -0.20 0.00 -0.42 0.00 0.00 57.16 56.67 1n80 n GLU 206 Cb 0.19 -1.50 -0.12 0.00 -0.57 0.00 0.00 31.44 29.44 1n80 n GLU 206 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 1n80 s TYR 207 N -2.50 1.36 0.10 -0.32 2.02 -1.21 0.09 117.35 116.89 1n80 s TYR 207 Ca -0.32 -0.46 0.09 0.00 -0.37 0.00 0.00 57.07 56.01 1n80 s TYR 207 Cb 0.08 -0.75 -0.04 0.00 -0.40 0.00 0.00 41.96 40.85 1n80 s TYR 207 CO 0.60 0.10 -0.19 0.96 -1.57 0.00 0.00 175.55 175.45 1n80 s ILE 208 N -1.31 2.79 0.29 2.71 -4.36 -0.73 -1.04 121.20 119.56 1n80 s ILE 208 Ca 0.01 -1.46 -0.23 0.00 -0.26 0.00 0.00 60.65 58.70 1n80 s ILE 208 Cb -0.10 -2.25 -0.09 0.00 1.25 0.00 0.00 42.46 41.27 1n80 s ILE 208 CO 0.03 0.15 0.86 -0.69 0.24 0.00 0.00 174.94 175.52 1n80 s VAL 209 N -1.09 4.37 -0.13 8.37 1.01 -1.26 -1.83 120.40 129.84 1n80 s VAL 209 Ca 0.17 1.57 0.01 0.00 0.00 0.00 0.00 61.98 63.73 1n80 s VAL 209 Cb -0.11 -3.91 0.02 0.00 0.00 0.00 0.00 36.38 32.38 1n80 s VAL 209 CO 0.09 0.12 -0.13 -0.69 0.00 0.00 0.00 175.10 174.50 1n80 s VAL 210 N -1.63 1.40 0.53 2.92 1.01 -0.69 -4.94 120.40 118.99 1n80 s VAL 210 Ca 0.48 -0.54 -0.22 0.00 0.00 0.00 0.00 61.98 61.71 1n80 s VAL 210 Cb -0.17 -1.32 -0.06 0.00 0.00 0.00 0.00 36.38 34.83 1n80 s VAL 210 CO 0.22 0.43 1.19 -0.81 0.00 0.00 0.00 175.10 176.12 1n80 n PRO 211 N 4.63 1.45 -2.35 2.72 -0.04 -1.26 -4.27 135.00 135.87 1n80 n PRO 211 Ca -0.17 0.53 -0.34 0.00 -0.04 0.00 0.00 63.50 63.49 1n80 n PRO 211 Cb 0.50 -2.36 -0.02 0.00 -0.04 0.00 0.00 33.50 31.59 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 -1.34 2.92 0.30 0.54 0.52 -1.26 -4.53 118.94 116.10 1n80 s TRP 212 Ca 0.70 1.55 0.06 0.00 0.02 0.00 0.00 56.10 58.44 1n80 s TRP 212 Cb -0.45 -3.10 0.74 0.00 -1.15 0.00 0.00 33.47 29.52 1n80 s TRP 212 CO 0.51 -1.06 1.78 -1.35 0.02 0.00 0.00 176.95 176.84 1n80 h PRO 213 N 1.19 0.74 0.11 4.98 0.11 -1.95 -1.42 132.00 135.77 1n80 h PRO 213 Ca -0.49 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.57 1n80 h PRO 213 Cb 1.23 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1n80 h PRO 213 CO 0.58 0.49 -0.06 1.49 -0.21 0.00 0.00 178.00 180.30 1n80 h GLU 214 N 0.76 -0.15 0.00 1.05 4.81 -1.92 -0.01 114.58 119.12 1n80 h GLU 214 Ca 0.58 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.82 1n80 h GLU 214 Cb 0.90 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.32 1n80 h GLU 214 CO -0.38 0.20 0.00 1.05 -0.73 0.00 0.00 179.01 179.15 1n80 h GLU 215 N -0.52 0.00 0.21 1.92 4.11 -1.88 -0.77 114.58 117.65 1n80 h GLU 215 Ca -0.02 0.00 -0.34 0.00 0.07 0.00 0.00 59.36 59.07 1n80 h GLU 215 Cb 0.42 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.69 1n80 h GLU 215 CO 0.03 0.00 -1.62 1.25 0.07 0.00 0.00 179.01 178.74 1n80 h LEU 216 N 0.00 0.69 -1.01 3.06 5.85 -0.98 -2.69 115.31 120.24 1n80 h LEU 216 Ca 0.00 -0.89 -0.09 0.00 0.84 0.00 0.00 57.88 57.74 1n80 h LEU 216 Cb 0.27 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 1n80 h LEU 216 CO 0.00 1.72 -0.31 0.50 -0.34 0.00 0.00 178.44 180.02 1n80 h LYS 217 N 0.12 0.33 0.03 1.25 3.64 -0.19 -2.73 116.57 119.02 1n80 h LYS 217 Ca -0.30 -0.13 -0.22 0.00 -1.27 0.00 0.00 60.65 58.73 1n80 h LYS 217 Cb 2.12 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.90 1n80 h LYS 217 CO 0.22 0.61 -1.03 0.93 -2.27 0.00 0.00 179.45 177.91 1n80 h GLU 218 N 0.29 0.07 -1.81 1.90 5.08 -1.25 -3.40 114.58 115.47 1n80 h GLU 218 Ca 0.04 -0.11 -0.50 0.00 -1.00 0.00 0.00 59.36 57.78 1n80 h GLU 218 Cb 0.69 0.04 -0.37 0.00 0.50 0.00 0.00 28.75 29.61 1n80 h GLU 218 CO 0.05 1.03 -1.07 -3.47 -1.00 0.00 0.00 179.01 174.55 1n80 n ASP 219 N -3.43 0.07 -0.11 1.42 -0.08 -1.01 -5.00 116.55 108.42 1n80 n ASP 219 Ca -0.02 -2.85 -0.05 0.00 -1.51 0.00 0.00 54.79 50.36 1n80 n ASP 219 Cb 0.94 -0.39 0.02 0.00 2.34 0.00 0.00 41.12 44.03 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 3.69 0.13 0.00 -0.67 0.11 -1.72 -2.33 132.00 131.20 1n80 h PRO 220 Ca 0.06 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.15 1n80 h PRO 220 Cb 0.92 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 1n80 h PRO 220 CO 0.45 0.09 -0.07 1.79 -0.21 0.00 0.00 178.00 180.04 1n80 h THR 221 N 0.13 0.79 0.00 -1.15 1.35 -1.90 0.34 112.91 112.47 1n80 h THR 221 Ca 0.19 -0.28 -0.02 0.00 -0.55 0.00 0.00 66.41 65.74 1n80 h THR 221 Cb 0.25 1.16 -0.00 0.00 -1.73 0.00 0.00 68.15 67.83 1n80 h THR 221 CO -0.29 0.07 -0.11 -0.09 -0.25 0.00 0.00 175.52 174.86 1n80 h ARG 222 N 0.00 0.00 -0.52 4.72 2.43 -1.82 -2.26 114.38 116.93 1n80 h ARG 222 Ca -0.00 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 58.84 1n80 h ARG 222 Cb 0.16 0.00 -0.21 0.00 -0.42 0.00 0.00 29.97 29.50 1n80 h ARG 222 CO 0.01 0.11 -0.21 0.91 -1.51 0.00 0.00 179.97 179.28 1n80 n TRP 223 N -3.63 1.73 -3.05 2.20 7.02 -0.35 -4.40 117.44 116.95 1n80 n TRP 223 Ca -0.02 -1.95 -0.17 0.00 -1.02 0.00 0.00 57.50 54.33 1n80 n TRP 223 Cb 0.23 -0.55 -0.01 0.00 -2.42 0.00 0.00 31.31 28.56 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 -0.99 -0.48 0.50 6.99 0.00 -0.85 -1.51 105.19 108.84 1n80 n GLY 224 Ca 0.39 0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.54 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 -3.53 0.00 -0.16 1.61 4.19 0.10 -4.54 117.16 114.84 1n80 n TYR 225 Ca -0.03 0.00 0.11 0.00 3.31 0.00 0.00 57.90 61.29 1n80 n TYR 225 Cb 0.54 0.00 0.44 0.00 0.49 0.00 0.00 39.34 40.81 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 2.43 0.54 -0.09 2.98 9.09 -1.85 -0.60 114.58 127.08 1n80 h GLU 226 Ca 0.00 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 59.38 1n80 h GLU 226 Cb 0.62 -0.12 0.00 0.00 -1.65 0.00 0.00 28.75 27.60 1n80 h GLU 226 CO 0.00 0.36 0.00 -0.25 0.05 0.00 0.00 179.01 179.17 1n80 n ASP 227 N -4.49 0.63 -4.76 3.06 10.43 -1.26 -4.92 116.55 115.25 1n80 n ASP 227 Ca 0.12 -1.70 -0.36 0.00 2.57 0.00 0.00 54.79 55.42 1n80 n ASP 227 Cb 0.37 -0.06 0.03 0.00 1.84 0.00 0.00 41.12 43.31 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 -1.36 5.32 0.00 -2.24 3.84 -0.23 -4.96 114.94 115.31 1n80 s ASN 228 Ca 0.22 2.39 0.00 0.00 0.21 0.00 0.00 52.86 55.68 1n80 s ASN 228 Cb 0.11 -2.60 0.00 0.00 -0.55 0.00 0.00 41.25 38.21 1n80 s ASN 228 CO 0.17 -1.50 0.00 0.18 -2.79 0.00 0.00 177.10 173.15 1n80 n LEU 229 N -1.43 0.00 0.00 3.21 4.77 -1.26 -4.79 117.00 117.50 1n80 n LEU 229 Ca 0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 1n80 n LEU 229 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1n80 n LEU 229 CO 0.45 0.00 0.50 0.35 -1.33 0.00 0.00 177.39 177.36 1n80 n THR 230 N -1.52 1.85 0.29 -5.08 -2.24 -1.26 -1.26 114.28 105.06 1n80 n THR 230 Ca 0.00 0.49 0.18 0.00 -2.27 0.00 0.00 64.05 62.45 1n80 n THR 230 Cb 0.33 -1.49 0.86 0.00 -2.10 0.00 0.00 70.33 67.93 1n80 n THR 230 CO 0.00 0.00 0.00 4.11 -0.57 0.00 0.00 175.07 178.61 1n80 h TRP 231 N 0.00 0.00 0.00 4.78 5.08 -1.92 0.27 115.95 124.17 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 0.06 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.22 1n80 h TRP 231 CO 0.00 0.03 0.00 1.04 -1.28 0.00 0.00 178.44 178.23 1n80 n GLN 232 N -3.22 0.04 0.00 0.12 6.02 -0.39 -0.69 117.38 119.25 1n80 n GLN 232 Ca -0.01 0.22 0.00 0.00 -0.01 0.00 0.00 57.00 57.20 1n80 n GLN 232 Cb 0.22 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.98 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 -1.23 0.00 0.00 -1.09 10.64 -0.65 -4.87 117.38 120.17 1n80 n GLN 233 Ca 0.01 0.00 0.12 0.00 -1.83 0.00 0.00 57.00 55.30 1n80 n GLN 233 Cb 0.01 -0.49 0.23 0.00 -0.86 0.00 0.00 30.24 29.14 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 -1.45 1.30 -3.89 2.61 3.85 -0.01 -4.99 116.55 113.97 1n80 n ASP 234 Ca 0.00 -1.05 -0.37 0.00 -0.71 0.00 0.00 54.79 52.66 1n80 n ASP 234 Cb 0.00 0.28 0.02 0.00 -1.35 0.00 0.00 41.12 40.08 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 -4.26 -1.64 -1.12 2.03 0.13 -1.11 116.55 110.04 1n80 n ASP 235 Ca 0.11 -1.14 -0.20 0.00 0.52 0.00 0.00 54.79 54.07 1n80 n ASP 235 Cb 0.38 -2.60 -0.08 0.00 -0.72 0.00 0.00 41.12 38.11 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 -4.58 -0.11 -1.15 -0.67 3.72 -1.26 -4.88 117.46 108.53 1n80 n PHE 236 Ca -0.12 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.06 1n80 n PHE 236 Cb 0.59 -3.45 -0.12 0.00 -0.94 0.00 0.00 39.48 35.56 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 -0.54 3.52 0.31 1.37 0.00 -0.27 -4.24 105.19 105.34 1n80 n GLY 237 Ca -0.21 -1.36 -0.00 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 5.58 0.78 -1.49 0.99 5.85 -1.88 -2.05 115.31 123.10 1n80 h LEU 238 Ca 0.43 0.02 0.17 0.00 0.84 0.00 0.00 57.88 59.33 1n80 h LEU 238 Cb 1.06 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.88 1n80 h LEU 238 CO 0.78 0.51 0.55 0.16 -0.34 0.00 0.00 178.44 180.10 1n80 h ILE 239 N 0.92 0.76 -0.39 4.05 3.07 -1.83 0.90 117.51 125.00 1n80 h ILE 239 Ca 0.35 -0.16 -0.11 0.00 1.55 0.00 0.00 64.86 66.49 1n80 h ILE 239 Cb 0.15 0.25 -0.01 0.00 -0.27 0.00 0.00 36.82 36.94 1n80 h ILE 239 CO -0.17 0.09 -0.19 1.88 -1.05 0.00 0.00 178.15 178.71 1n80 h TYR 240 N 0.48 0.93 -0.92 0.16 -1.99 -1.70 -0.15 116.97 113.78 1n80 h TYR 240 Ca 0.42 -0.23 0.08 0.00 2.00 0.00 0.00 58.73 61.00 1n80 h TYR 240 Cb 0.92 -0.22 -0.06 0.00 2.00 0.00 0.00 36.73 39.38 1n80 h TYR 240 CO -0.00 0.98 0.59 0.00 -0.00 0.00 0.00 178.16 179.73 1n80 h ARG 241 N 0.61 0.95 -0.68 4.88 3.08 -0.66 -2.09 114.38 120.46 1n80 h ARG 241 Ca 0.09 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1n80 h ARG 241 Cb 0.74 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1n80 h ARG 241 CO 0.06 0.63 0.00 1.33 -1.07 0.00 0.00 179.97 180.91 1n80 n VAL 242 N -4.52 1.02 -3.61 2.04 0.24 -0.91 -4.96 118.33 107.63 1n80 n VAL 242 Ca 0.15 -0.94 -0.22 0.00 -2.04 0.00 0.00 64.34 61.29 1n80 n VAL 242 Cb 0.26 0.41 0.07 0.00 -1.47 0.00 0.00 33.84 33.11 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 1.45 -6.83 -2.43 7.34 5.02 -0.79 -4.93 118.16 116.99 1n80 n LYS 243 Ca 0.23 0.78 -0.42 0.00 -2.02 0.00 0.00 58.31 56.88 1n80 n LYS 243 Cb 0.61 -5.74 -0.03 0.00 -0.02 0.00 0.00 35.03 29.85 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 -3.37 3.40 0.00 7.82 0.00 -0.11 -4.88 121.76 124.61 1n80 s ALA 244 Ca 0.34 0.87 0.08 0.00 0.00 0.00 0.00 51.96 53.26 1n80 s ALA 244 Cb -0.16 -3.42 0.14 0.00 0.00 0.00 0.00 23.12 19.68 1n80 s ALA 244 CO 0.76 -0.38 0.98 0.27 0.00 0.00 0.00 175.76 177.38 1n80 n ASN 245 N 3.28 -0.05 -3.88 0.00 0.23 -1.26 -3.76 115.26 109.82 1n80 n ASN 245 Ca 0.07 -1.84 -0.15 0.00 -0.53 0.00 0.00 54.58 52.13 1n80 n ASN 245 Cb 0.46 -0.01 -0.15 0.00 -2.08 0.00 0.00 39.78 38.00 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 0.18 -0.11 5.53 2.01 -1.25 -0.68 115.64 121.31 1n80 s THR 246 Ca 0.11 -0.03 -0.00 0.00 0.31 0.00 0.00 61.69 62.07 1n80 s THR 246 Cb 0.13 -0.20 -0.02 0.00 0.01 0.00 0.00 72.50 72.41 1n80 s THR 246 CO -0.06 0.09 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.23 1n80 s ILE 247 N 0.33 3.37 -0.20 1.82 1.01 0.21 -0.31 121.20 127.43 1n80 s ILE 247 Ca -0.03 -0.57 -0.02 0.00 0.00 0.00 0.00 60.65 60.03 1n80 s ILE 247 Cb -0.06 -2.41 -0.00 0.00 0.01 0.00 0.00 42.46 40.00 1n80 s ILE 247 CO -0.01 0.54 -0.09 -0.60 0.00 0.00 0.00 174.94 174.78 1n80 s ARG 248 N 0.01 3.29 0.23 2.79 3.52 0.79 -0.86 118.95 128.71 1n80 s ARG 248 Ca -0.02 -0.68 -0.30 0.00 -0.13 0.00 0.00 55.73 54.60 1n80 s ARG 248 Cb -0.14 -2.88 -0.09 0.00 -1.56 0.00 0.00 34.95 30.29 1n80 s ARG 248 CO 0.04 -0.17 1.06 -0.06 -0.81 0.00 0.00 175.30 175.35 1n80 s PHE 249 N 1.35 3.68 -0.55 5.12 0.40 0.74 -1.91 117.98 126.81 1n80 s PHE 249 Ca 0.04 1.72 0.04 0.00 -0.60 0.00 0.00 56.93 58.13 1n80 s PHE 249 Cb -0.14 -3.20 0.16 0.00 0.51 0.00 0.00 43.02 40.34 1n80 s PHE 249 CO -0.05 -0.31 0.37 0.21 0.70 0.00 0.00 175.22 176.14 1n80 s LYS 250 N -0.98 1.74 -0.01 0.44 2.47 0.58 -3.75 119.74 120.23 1n80 s LYS 250 Ca 0.45 -2.64 0.05 0.00 -1.56 0.00 0.00 55.97 52.27 1n80 s LYS 250 Cb -0.29 -2.64 -0.01 0.00 -1.46 0.00 0.00 37.83 33.42 1n80 s LYS 250 CO 0.37 -1.26 -0.15 0.00 0.16 0.00 0.00 175.35 174.46 1n80 s ALA 251 N -0.52 1.25 0.01 3.13 0.00 -1.00 -4.63 121.76 120.00 1n80 s ALA 251 Ca 0.24 -0.64 0.04 0.00 0.00 0.00 0.00 51.96 51.60 1n80 s ALA 251 Cb -0.09 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.67 1n80 s ALA 251 CO -0.12 0.30 -0.08 0.71 0.00 0.00 0.00 175.76 176.57 1n80 s TYR 252 N -0.33 2.84 -0.37 0.00 2.02 -1.26 0.57 117.35 120.82 1n80 s TYR 252 Ca 0.05 -0.07 -0.14 0.00 -0.37 0.00 0.00 57.07 56.54 1n80 s TYR 252 Cb -0.06 -1.59 0.00 0.00 -0.40 0.00 0.00 41.96 39.91 1n80 s TYR 252 CO -0.00 0.35 0.30 -0.51 -1.57 0.00 0.00 175.55 174.12 1n80 s LEU 253 N -1.40 4.75 -0.51 -1.29 1.43 -0.22 -4.90 118.68 116.54 1n80 s LEU 253 Ca 0.17 -0.58 -0.18 0.00 -1.03 0.00 0.00 54.13 52.50 1n80 s LEU 253 Cb -0.11 -2.21 0.07 0.00 0.03 0.00 0.00 46.19 43.97 1n80 s LEU 253 CO 0.07 -0.36 0.59 -0.62 0.23 0.00 0.00 176.35 176.25 1n80 s ASP 254 N 1.72 6.20 0.44 2.29 3.68 -1.26 -1.80 116.67 127.94 1n80 s ASP 254 Ca 0.07 -1.08 0.30 0.00 2.13 0.00 0.00 52.55 53.98 1n80 s ASP 254 Cb -0.18 -2.27 1.55 0.00 -1.45 0.00 0.00 42.92 40.57 1n80 s ASP 254 CO 0.11 -0.87 1.92 0.28 0.13 0.00 0.00 175.17 176.74 1n80 h SER 255 N 8.97 0.00 0.21 -0.34 0.02 -1.14 -0.22 113.55 121.05 1n80 h SER 255 Ca -0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 1n80 h SER 255 Cb 1.10 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.64 1n80 h SER 255 CO 0.97 0.00 0.00 0.55 -1.14 0.00 0.00 176.83 177.21 1n80 n VAL 256 N -2.60 0.07 -0.30 2.27 3.14 -1.21 -1.96 118.33 117.74 1n80 n VAL 256 Ca -0.01 0.02 0.08 0.00 -2.96 0.00 0.00 64.34 61.46 1n80 n VAL 256 Cb 0.11 -0.59 0.31 0.00 -1.06 0.00 0.00 33.84 32.60 1n80 n VAL 256 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 1n80 n TYR 257 N -1.12 1.33 0.00 1.45 4.01 -0.09 -4.74 117.16 117.99 1n80 n TYR 257 Ca 0.17 -0.52 0.00 0.00 -0.16 0.00 0.00 57.90 57.39 1n80 n TYR 257 Cb 0.14 -0.25 0.00 0.00 -0.31 0.00 0.00 39.34 38.92 1n80 n TYR 257 CO 0.00 0.00 0.00 1.97 -0.46 0.00 0.00 176.86 178.37 1n80 n PHE 258 N 0.86 0.00 0.00 -0.72 1.16 -0.83 -5.04 117.46 112.90 1n80 n PHE 258 Ca 0.22 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.70 1n80 n PHE 258 Cb 0.81 0.00 0.09 0.00 -1.61 0.00 0.00 39.48 38.77 1n80 n PHE 258 CO 0.00 0.00 0.00 -0.35 -1.87 0.00 0.00 176.76 174.54 1n80 n PRO 259 N 0.00 1.67 -0.01 3.97 -0.04 -1.26 -4.35 135.00 134.97 1n80 n PRO 259 Ca 0.00 -1.37 -0.02 0.00 -0.04 0.00 0.00 63.50 62.08 1n80 n PRO 259 Cb 0.00 -1.56 -0.01 0.00 -0.04 0.00 0.00 33.50 31.89 1n80 n PRO 259 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1n80 n GLU 260 N -0.20 0.10 0.00 0.54 1.02 -1.26 -4.66 120.64 116.18 1n80 n GLU 260 Ca 0.26 0.04 0.06 0.00 -0.02 0.00 0.00 57.16 57.50 1n80 n GLU 260 Cb 1.00 -0.59 0.31 0.00 -0.02 0.00 0.00 31.44 32.15 1n80 n GLU 260 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1n80 n ALA 261 N -2.91 1.68 -3.42 0.62 0.00 -1.26 -4.30 120.51 110.92 1n80 n ALA 261 Ca -0.03 -0.05 -0.44 0.00 0.00 0.00 0.00 53.44 52.92 1n80 n ALA 261 Cb 0.09 -1.22 -0.04 0.00 0.00 0.00 0.00 19.45 18.29 1n80 n ALA 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n80 s ALA 262 N -2.80 4.06 -0.09 0.00 0.00 -1.26 -4.84 121.76 116.82 1n80 s ALA 262 Ca 0.09 -3.39 -0.10 0.00 0.00 0.00 0.00 51.96 48.56 1n80 s ALA 262 Cb 0.09 -3.32 0.03 0.00 0.00 0.00 0.00 23.12 19.91 1n80 s ALA 262 CO 0.22 -2.23 0.28 -0.51 0.00 0.00 0.00 175.76 173.52 1n80 s LEU 263 N -0.11 0.94 0.00 0.00 1.43 -1.26 -4.65 118.68 115.04 1n80 s LEU 263 Ca 0.19 0.48 0.00 0.00 -1.03 0.00 0.00 54.13 53.77 1n80 s LEU 263 Cb -0.12 0.99 0.00 0.00 0.03 0.00 0.00 46.19 47.09 1n80 s LEU 263 CO -0.08 -0.15 0.00 -2.65 0.23 0.00 0.00 176.35 173.70 1n80 n PRO 264 N 2.66 0.00 0.17 1.29 -0.02 -1.26 0.22 135.00 138.06 1n80 n PRO 264 Ca -0.14 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.18 1n80 n PRO 264 Cb 0.58 0.00 -0.09 0.00 -0.02 0.00 0.00 33.50 33.97 1n80 n PRO 264 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1n80 h GLY 265 N 0.00 -1.19 0.00 -1.23 0.00 -1.98 -3.46 103.07 95.20 1n80 h GLY 265 Ca 0.00 0.61 0.00 0.00 0.00 0.00 0.00 47.33 47.94 1n80 h GLY 265 CO 0.00 -0.32 0.00 -2.01 0.00 0.00 0.00 176.54 174.21 1n80 n ASN 266 N -5.20 0.00 0.08 0.19 5.15 0.13 -4.87 115.26 110.74 1n80 n ASN 266 Ca -0.09 0.00 -0.11 0.00 -0.60 0.00 0.00 54.58 53.78 1n80 n ASN 266 Cb 0.39 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.59 1n80 n ASN 266 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1n80 h LYS 267 N 1.10 0.24 0.00 1.20 6.56 -1.88 -3.47 116.57 120.32 1n80 h LYS 267 Ca 0.00 -0.30 0.00 0.00 -1.06 0.00 0.00 60.65 59.29 1n80 h LYS 267 Cb 0.00 0.10 0.00 0.00 -0.57 0.00 0.00 32.23 31.76 1n80 h LYS 267 CO 0.00 1.05 0.00 0.41 -2.06 0.00 0.00 179.45 178.85 1n80 n GLY 268 N 1.07 -1.14 3.57 3.86 0.00 -1.26 -4.58 105.19 106.70 1n80 n GLY 268 Ca -0.05 -2.23 -0.25 0.00 0.00 0.00 0.00 46.02 43.49 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 -0.72 2.45 0.00 1.61 -0.12 -1.20 -3.52 117.98 116.47 1n80 s PHE 269 Ca 0.00 -0.45 0.00 0.00 -0.05 0.00 0.00 56.93 56.43 1n80 s PHE 269 Cb 0.00 -1.37 0.00 0.00 -0.63 0.00 0.00 43.02 41.02 1n80 s PHE 269 CO 0.00 0.57 0.07 0.54 -0.05 0.00 0.00 175.22 176.35 1n80 n ARG 270 N -0.83 0.00 -4.69 1.99 1.74 0.11 -2.79 116.66 112.19 1n80 n ARG 270 Ca -0.05 -0.07 -0.23 0.00 -0.77 0.00 0.00 57.85 56.72 1n80 n ARG 270 Cb 0.63 -0.44 -0.15 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 0.00 1.31 -0.00 5.56 -0.21 -0.69 -1.33 119.66 124.31 1n80 s GLN 271 Ca 0.00 -0.52 0.06 0.00 0.02 0.00 0.00 55.36 54.91 1n80 s GLN 271 Cb 0.00 -1.23 -0.03 0.00 1.00 0.00 0.00 33.01 32.75 1n80 s GLN 271 CO 0.00 0.28 -0.18 0.42 -2.12 0.00 0.00 175.29 173.69 1n80 s ILE 272 N -0.19 2.80 -0.09 1.08 -1.09 0.95 -1.97 121.20 122.69 1n80 s ILE 272 Ca 0.02 -1.00 -0.09 0.00 -2.23 0.00 0.00 60.65 57.36 1n80 s ILE 272 Cb -0.07 -2.12 0.02 0.00 -1.58 0.00 0.00 42.46 38.71 1n80 s ILE 272 CO 0.00 0.46 0.24 -0.55 -1.23 0.00 0.00 174.94 173.87 1n80 s SER 273 N -1.07 -0.24 -0.16 3.58 0.15 -0.32 -0.33 113.70 115.32 1n80 s SER 273 Ca 0.13 0.46 0.01 0.00 0.70 0.00 0.00 55.95 57.25 1n80 s SER 273 Cb -0.10 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.69 1n80 s SER 273 CO 0.03 -0.10 -0.17 -0.63 1.20 0.00 0.00 173.24 173.56 1n80 s ILE 274 N 0.06 2.44 0.01 6.45 -1.09 -0.70 0.10 121.20 128.48 1n80 s ILE 274 Ca -0.01 -0.84 0.07 0.00 -2.23 0.00 0.00 60.65 57.64 1n80 s ILE 274 Cb -0.02 -2.02 -0.02 0.00 -1.58 0.00 0.00 42.46 38.82 1n80 s ILE 274 CO 0.00 0.52 -0.21 -0.63 -1.23 0.00 0.00 174.94 173.39 1n80 s ILE 275 N 0.90 1.71 -0.06 2.92 1.01 -0.46 -1.44 121.20 125.78 1n80 s ILE 275 Ca -0.04 -1.07 0.03 0.00 0.00 0.00 0.00 60.65 59.57 1n80 s ILE 275 Cb -0.15 -1.45 -0.03 0.00 0.01 0.00 0.00 42.46 40.84 1n80 s ILE 275 CO -0.02 0.35 -0.13 0.42 0.00 0.00 0.00 174.94 175.55 1n80 s THR 276 N -0.65 3.14 -1.44 2.92 -4.23 0.14 -1.21 115.64 114.31 1n80 s THR 276 Ca 0.08 -0.69 -0.07 0.00 -1.18 0.00 0.00 61.69 59.83 1n80 s THR 276 Cb -0.09 -2.24 0.05 0.00 1.34 0.00 0.00 72.50 71.56 1n80 s THR 276 CO 0.01 0.59 0.81 0.59 -0.54 0.00 0.00 174.62 176.07 1n80 n ASN 277 N 2.40 -2.86 -4.74 3.99 3.02 -0.72 -0.48 115.26 115.87 1n80 n ASN 277 Ca -0.17 -0.82 -0.35 0.00 -0.03 0.00 0.00 54.58 53.20 1n80 n ASN 277 Cb 0.52 -3.84 0.06 0.00 -0.61 0.00 0.00 39.78 35.92 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 -6.37 2.56 -0.07 3.52 0.04 -1.26 -3.67 135.00 129.75 1n80 s PRO 278 Ca 0.34 1.83 -0.05 0.00 0.04 0.00 0.00 61.00 63.16 1n80 s PRO 278 Cb -0.17 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 1n80 s PRO 278 CO 0.83 -1.53 0.13 -0.51 0.04 0.00 0.00 177.00 175.97 1n80 s LEU 279 N -4.58 4.25 -0.43 -3.56 1.43 -1.26 -2.03 118.68 112.50 1n80 s LEU 279 Ca 0.77 0.37 -0.29 0.00 -1.03 0.00 0.00 54.13 53.95 1n80 s LEU 279 Cb -0.31 -2.23 0.02 0.00 0.03 0.00 0.00 46.19 43.71 1n80 s LEU 279 CO 0.39 0.35 1.19 -1.61 0.23 0.00 0.00 176.35 176.90 1n80 s GLU 280 N -1.36 3.76 0.05 1.70 2.02 0.65 -0.60 118.70 124.93 1n80 s GLU 280 Ca 0.19 0.75 -0.16 0.00 0.02 0.00 0.00 54.97 55.77 1n80 s GLU 280 Cb -0.12 -3.90 -0.09 0.00 0.10 0.00 0.00 34.13 30.12 1n80 s GLU 280 CO 0.09 -1.32 0.37 0.00 0.02 0.00 0.00 175.26 174.42 1n80 n ALA 281 N 7.85 -1.96 -2.21 5.21 0.00 -1.20 -4.57 120.51 123.63 1n80 n ALA 281 Ca 0.13 0.25 -0.21 0.00 0.00 0.00 0.00 53.44 53.60 1n80 n ALA 281 Cb 0.48 -0.81 -0.01 0.00 0.00 0.00 0.00 19.45 19.11 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 -0.26 2.48 -0.13 0.00 1.02 -1.26 -4.79 119.74 116.80 1n80 s LYS 282 Ca 0.37 -1.61 0.13 0.00 0.02 0.00 0.00 55.97 54.88 1n80 s LYS 282 Cb -0.52 -2.39 -0.18 0.00 -0.52 0.00 0.00 37.83 34.21 1n80 s LYS 282 CO 0.27 -0.36 0.07 0.00 -0.92 0.00 0.00 175.35 174.42 1n80 n ALA 283 N -1.70 1.72 -3.78 5.17 0.00 -1.26 -4.83 120.51 115.83 1n80 n ALA 283 Ca 0.04 -0.90 -0.30 0.00 0.00 0.00 0.00 53.44 52.28 1n80 n ALA 283 Cb 0.62 -0.09 -0.14 0.00 0.00 0.00 0.00 19.45 19.84 1n80 n ALA 283 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1n80 s HIS 284 N -2.40 2.20 0.07 0.00 3.76 -1.26 -5.04 115.29 112.62 1n80 s HIS 284 Ca -0.07 -2.23 -0.12 0.00 -0.15 0.00 0.00 55.06 52.49 1n80 s HIS 284 Cb 0.05 -2.02 -0.01 0.00 1.11 0.00 0.00 32.58 31.71 1n80 s HIS 284 CO 0.59 -0.85 0.65 -2.30 -0.85 0.00 0.00 174.74 171.98 1n80 n PRO 285 N 4.26 -0.17 0.12 8.40 -0.02 -1.26 0.11 135.00 146.43 1n80 n PRO 285 Ca 0.03 0.64 0.18 0.00 -2.02 0.00 0.00 63.50 62.33 1n80 n PRO 285 Cb 0.39 -0.95 0.59 0.00 -0.02 0.00 0.00 33.50 33.52 1n80 n PRO 285 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 1n80 h ASN 286 N 0.00 0.00 -3.53 2.55 -1.24 -2.02 -3.43 115.58 107.91 1n80 h ASN 286 Ca 0.08 0.00 -0.57 0.00 0.71 0.00 0.00 56.30 56.52 1n80 h ASN 286 Cb 0.19 0.00 0.17 0.00 0.73 0.00 0.00 38.32 39.40 1n80 h ASN 286 CO -0.40 0.00 0.05 0.47 -1.29 0.00 0.00 177.43 176.26 1n80 n ASP 287 N -3.23 0.46 -4.70 1.15 8.00 0.30 -4.88 116.55 113.66 1n80 n ASP 287 Ca 0.08 0.77 -0.42 0.00 0.71 0.00 0.00 54.79 55.93 1n80 n ASP 287 Cb 0.82 -1.36 -0.03 0.00 -0.02 0.00 0.00 41.12 40.53 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 -2.75 4.17 0.68 -0.24 0.04 -1.26 -4.93 135.00 130.70 1n80 s PRO 288 Ca 0.75 2.46 -0.17 0.00 0.04 0.00 0.00 61.00 64.09 1n80 s PRO 288 Cb -0.41 -3.51 -0.01 0.00 0.04 0.00 0.00 34.50 30.61 1n80 s PRO 288 CO 0.48 -0.77 1.08 0.09 0.04 0.00 0.00 177.00 177.92 1n80 n ASN 289 N 5.34 1.06 -4.05 6.66 4.13 -1.26 -5.03 115.26 122.11 1n80 n ASN 289 Ca 0.16 0.74 -0.25 0.00 1.68 0.00 0.00 54.58 56.91 1n80 n ASN 289 Cb 0.39 -1.45 -0.16 0.00 -1.54 0.00 0.00 39.78 37.01 1n80 n ASN 289 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1n80 s VAL 290 N -1.63 1.22 -0.15 2.41 1.01 -1.26 -5.05 120.40 116.94 1n80 s VAL 290 Ca 0.77 -0.54 -0.22 0.00 0.00 0.00 0.00 61.98 61.99 1n80 s VAL 290 Cb -0.37 -1.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 1n80 s VAL 290 CO 0.46 0.37 0.69 -1.59 0.00 0.00 0.00 175.10 175.03 1n80 s LYS 291 N 0.55 4.30 -0.01 2.72 0.00 -1.26 -0.25 119.74 125.80 1n80 s LYS 291 Ca -0.13 0.78 -0.30 0.00 0.00 0.00 0.00 55.97 56.32 1n80 s LYS 291 Cb -0.15 -3.53 -0.08 0.00 0.00 0.00 0.00 37.83 34.06 1n80 s LYS 291 CO 0.04 -0.16 1.97 0.00 0.00 0.00 0.00 175.35 177.20 1n80 s ALA 292 N 1.60 3.48 -0.07 0.59 0.00 -0.86 -4.85 121.76 121.64 1n80 s ALA 292 Ca 0.33 1.21 0.11 0.00 0.00 0.00 0.00 51.96 53.61 1n80 s ALA 292 Cb -0.16 -3.87 0.17 0.00 0.00 0.00 0.00 23.12 19.26 1n80 s ALA 292 CO 0.13 -1.71 1.06 0.39 0.00 0.00 0.00 175.76 175.62 1n80 n GLU 293 N 7.66 1.51 -2.42 0.00 1.02 -1.26 -4.88 120.64 122.27 1n80 n GLU 293 Ca 0.21 -2.01 -0.25 0.00 -0.02 0.00 0.00 57.16 55.09 1n80 n GLU 293 Cb 0.42 -1.20 0.12 0.00 -0.02 0.00 0.00 31.44 30.76 1n80 n GLU 293 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1n80 s LYS 294 N -1.91 1.48 0.00 3.49 2.47 -1.26 -5.00 119.74 119.01 1n80 s LYS 294 Ca 0.18 -0.91 0.23 0.00 -1.56 0.00 0.00 55.97 53.92 1n80 s LYS 294 Cb 0.16 -2.22 0.48 0.00 -1.46 0.00 0.00 37.83 34.80 1n80 s LYS 294 CO 0.02 -1.65 1.44 -0.25 0.16 0.00 0.00 175.35 175.07 1n80 n ASP 295 N -3.04 3.49 -3.58 1.43 8.00 -1.26 -4.75 116.55 116.84 1n80 n ASP 295 Ca 0.15 -1.99 -0.10 0.00 0.71 0.00 0.00 54.79 53.56 1n80 n ASP 295 Cb 0.60 -0.29 -0.05 0.00 -0.02 0.00 0.00 41.12 41.36 1n80 n ASP 295 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1n80 s TYR 296 N -1.41 -0.37 -0.06 1.24 6.14 -1.26 -2.60 117.35 119.02 1n80 s TYR 296 Ca 0.41 0.66 -0.18 0.00 0.64 0.00 0.00 57.07 58.59 1n80 s TYR 296 Cb 0.23 0.44 0.04 0.00 0.42 0.00 0.00 41.96 43.09 1n80 s TYR 296 CO 0.32 -0.33 0.42 0.71 0.64 0.00 0.00 175.55 177.31 1n80 s TYR 297 N -1.01 -0.35 0.08 4.97 2.02 -1.12 -5.03 117.35 116.91 1n80 s TYR 297 Ca -0.01 0.66 -0.21 0.00 -0.37 0.00 0.00 57.07 57.14 1n80 s TYR 297 Cb -0.01 0.18 -0.07 0.00 -0.40 0.00 0.00 41.96 41.66 1n80 s TYR 297 CO 0.01 -0.40 0.63 0.34 -1.57 0.00 0.00 175.55 174.56 1n80 s ASP 298 N -0.93 7.13 0.65 2.29 -1.08 -1.26 -3.40 116.67 120.07 1n80 s ASP 298 Ca -0.10 1.34 0.01 0.00 -0.52 0.00 0.00 52.55 53.28 1n80 s ASP 298 Cb -0.04 -2.40 0.05 0.00 -1.46 0.00 0.00 42.92 39.07 1n80 s ASP 298 CO 0.05 0.22 1.02 -0.65 0.52 0.00 0.00 175.17 176.32 1n80 h PRO 299 N 4.75 0.00 0.00 4.34 0.11 -1.94 1.69 132.00 140.95 1n80 h PRO 299 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1n80 h PRO 299 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1n80 h PRO 299 CO 0.65 0.00 -1.47 -1.91 -0.21 0.00 0.00 178.00 175.07 1n80 n GLU 300 N -2.48 0.66 0.11 1.05 2.13 -1.26 -4.24 120.64 116.61 1n80 n GLU 300 Ca -0.00 -0.10 0.12 0.00 0.66 0.00 0.00 57.16 57.83 1n80 n GLU 300 Cb 0.97 -1.43 0.46 0.00 0.27 0.00 0.00 31.44 31.71 1n80 n GLU 300 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1n80 n ASP 301 N -1.87 0.62 -4.69 4.31 10.43 0.58 -4.78 116.55 121.14 1n80 n ASP 301 Ca -0.01 0.63 -0.31 0.00 2.57 0.00 0.00 54.79 57.68 1n80 n ASP 301 Cb 0.42 -0.77 -0.08 0.00 1.84 0.00 0.00 41.12 42.53 1n80 n ASP 301 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1n80 s LEU 302 N -4.31 3.50 -0.29 0.64 1.43 -1.22 -3.24 118.68 115.19 1n80 s LEU 302 Ca 0.06 -0.13 -0.28 0.00 -1.03 0.00 0.00 54.13 52.75 1n80 s LEU 302 Cb 0.10 -2.18 -0.05 0.00 0.03 0.00 0.00 46.19 44.09 1n80 s LEU 302 CO 0.42 0.19 2.17 -0.32 0.23 0.00 0.00 176.35 179.05 1n80 s MET 303 N -2.17 2.98 0.56 1.70 -2.45 0.23 -4.37 119.30 115.78 1n80 s MET 303 Ca 0.25 1.78 -0.20 0.00 -1.25 0.00 0.00 55.69 56.27 1n80 s MET 303 Cb -0.12 -4.38 -0.06 0.00 1.25 0.00 0.00 34.83 31.52 1n80 s MET 303 CO 0.17 -2.28 0.95 -2.13 1.05 0.00 0.00 175.02 172.78 1n80 n ARG 304 N 8.76 0.98 -1.39 4.11 0.63 -1.26 -1.73 116.66 126.77 1n80 n ARG 304 Ca 0.29 0.37 -0.13 0.00 -0.92 0.00 0.00 57.85 57.46 1n80 n ARG 304 Cb 0.47 -2.12 -0.06 0.00 0.45 0.00 0.00 32.46 31.20 1n80 n ARG 304 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1n80 n HIS 305 N -1.48 0.00 -2.35 -0.14 8.25 -1.26 -4.98 115.22 113.26 1n80 n HIS 305 Ca 0.13 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.34 1n80 n HIS 305 Cb 0.46 -2.85 0.08 0.00 1.12 0.00 0.00 29.99 28.79 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 -2.54 4.73 0.99 0.41 1.04 -0.70 -4.93 113.70 112.70 1n80 s SER 306 Ca 0.00 0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.63 1n80 s SER 306 Cb 0.00 -0.82 0.00 0.00 0.10 0.00 0.00 66.02 65.30 1n80 s SER 306 CO 0.00 -1.61 0.00 0.61 0.98 0.00 0.00 173.24 173.22 1n80 n GLY 307 N -2.83 0.56 2.93 7.32 0.00 -1.24 -4.69 105.19 107.25 1n80 n GLY 307 Ca 0.10 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 45.04 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 1.11 -0.35 1.61 0.41 0.37 -4.92 118.70 116.93 1n80 s GLU 308 Ca 0.00 -0.20 -0.21 0.00 -0.41 0.00 0.00 54.97 54.15 1n80 s GLU 308 Cb 0.00 -1.03 0.00 0.00 -1.78 0.00 0.00 34.13 31.32 1n80 s GLU 308 CO 0.00 -0.05 0.65 1.41 -0.49 0.00 0.00 175.26 176.78 1n80 s MET 309 N 0.86 3.71 0.00 1.61 -2.45 -1.26 0.26 119.30 122.03 1n80 s MET 309 Ca -0.12 0.12 0.11 0.00 -1.25 0.00 0.00 55.69 54.55 1n80 s MET 309 Cb -0.15 -3.80 -0.08 0.00 1.25 0.00 0.00 34.83 32.06 1n80 s MET 309 CO 0.01 -0.73 0.55 0.44 1.05 0.00 0.00 175.02 176.34 1n80 n ILE 310 N 5.59 0.00 -3.73 10.11 -5.35 -0.52 -5.00 119.36 120.46 1n80 n ILE 310 Ca -0.01 -0.29 -0.12 0.00 -0.27 0.00 0.00 62.75 62.06 1n80 n ILE 310 Cb 0.49 1.05 -0.13 0.00 -1.74 0.00 0.00 39.64 39.31 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 -1.83 -0.33 -0.05 4.28 6.14 -1.20 -4.99 117.35 119.36 1n80 s TYR 311 Ca 0.06 0.79 0.02 0.00 0.64 0.00 0.00 57.07 58.58 1n80 s TYR 311 Cb 0.09 0.05 0.01 0.00 0.42 0.00 0.00 41.96 42.53 1n80 s TYR 311 CO 0.39 -0.23 -0.10 -1.64 0.64 0.00 0.00 175.55 174.60 1n80 s MET 312 N 1.23 1.41 -0.02 4.97 -1.94 -1.26 -1.72 119.30 121.98 1n80 s MET 312 Ca -0.09 -0.34 0.01 0.00 -1.71 0.00 0.00 55.69 53.57 1n80 s MET 312 Cb -0.10 -1.22 0.01 0.00 2.01 0.00 0.00 34.83 35.53 1n80 s MET 312 CO -0.08 0.02 -0.04 -2.00 -0.01 0.00 0.00 175.02 172.91 1n80 s GLU 313 N 0.63 0.48 -0.02 2.03 2.12 0.55 -4.91 118.70 119.59 1n80 s GLU 313 Ca -0.12 -0.13 0.07 0.00 0.36 0.00 0.00 54.97 55.15 1n80 s GLU 313 Cb -0.14 -0.50 -0.02 0.00 0.26 0.00 0.00 34.13 33.73 1n80 s GLU 313 CO 0.02 0.03 -0.22 -0.80 -0.54 0.00 0.00 175.26 173.76 1n80 s ASN 314 N 0.26 2.53 0.22 -1.70 0.01 -1.26 -0.03 114.94 114.97 1n80 s ASN 314 Ca -0.03 -0.39 -0.22 0.00 -0.71 0.00 0.00 52.86 51.51 1n80 s ASN 314 Cb -0.06 -0.31 0.06 0.00 0.41 0.00 0.00 41.25 41.36 1n80 s ASN 314 CO -0.00 0.26 0.95 0.00 -1.51 0.00 0.00 177.10 176.79 1n80 s ARG 315 N -0.48 1.49 1.13 -0.60 1.70 -0.44 -4.87 118.95 116.89 1n80 s ARG 315 Ca 0.08 -0.92 -0.18 0.00 -0.47 0.00 0.00 55.73 54.24 1n80 s ARG 315 Cb -0.09 0.45 0.15 0.00 -0.57 0.00 0.00 34.95 34.89 1n80 s ARG 315 CO -0.01 -0.70 0.16 -2.30 -1.08 0.00 0.00 175.30 171.38 1n80 n PRO 316 N -0.58 -2.00 -1.56 3.89 -0.02 -1.26 -4.57 135.00 128.89 1n80 n PRO 316 Ca -0.05 -0.57 -0.31 0.00 -2.02 0.00 0.00 63.50 60.55 1n80 n PRO 316 Cb 0.60 -1.70 0.06 0.00 -0.02 0.00 0.00 33.50 32.44 1n80 n PRO 316 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1n80 s PRO 317 N -3.60 2.69 -0.09 0.52 0.04 -1.26 -4.54 135.00 128.77 1n80 s PRO 317 Ca 0.54 0.87 -0.05 0.00 0.04 0.00 0.00 61.00 62.40 1n80 s PRO 317 Cb -0.12 -1.97 0.04 0.00 0.04 0.00 0.00 34.50 32.49 1n80 s PRO 317 CO 0.60 -1.25 0.21 0.42 0.04 0.00 0.00 177.00 177.02 1n80 s ILE 318 N -3.07 -0.03 0.11 0.56 -1.09 -1.12 -4.94 121.20 111.62 1n80 s ILE 318 Ca 0.59 0.11 -0.24 0.00 -2.23 0.00 0.00 60.65 58.88 1n80 s ILE 318 Cb -0.14 -0.32 -0.07 0.00 -1.58 0.00 0.00 42.46 40.34 1n80 s ILE 318 CO 0.55 0.04 0.73 0.27 -1.23 0.00 0.00 174.94 175.30 1n80 s ILE 319 N 0.89 4.54 -0.20 2.92 -0.00 -1.26 -3.27 121.20 124.82 1n80 s ILE 319 Ca -0.06 1.58 -0.03 0.00 -0.00 0.00 0.00 60.65 62.14 1n80 s ILE 319 Cb -0.08 -4.08 -0.01 0.00 -0.00 0.00 0.00 42.46 38.29 1n80 s ILE 319 CO -0.05 0.49 -0.08 0.00 -0.00 0.00 0.00 174.94 175.30 1n80 s MET 320 N -0.85 3.34 0.00 0.37 0.23 -1.26 -5.02 119.30 116.10 1n80 s MET 320 Ca 0.35 -0.66 0.00 0.00 -1.03 0.00 0.00 55.69 54.35 1n80 s MET 320 Cb -0.22 -2.88 0.00 0.00 -1.53 0.00 0.00 34.83 30.20 1n80 s MET 320 CO 0.24 -0.11 0.00 0.00 -2.03 0.00 0.00 175.02 173.12 1n80 n ALA 321 N 4.50 0.00 -1.00 3.16 0.00 -1.26 -4.19 120.51 121.73 1n80 n ALA 321 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1n80 n ALA 321 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 1n80 n ALA 321 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1n80 n MET 322 N -0.87 0.00 -1.45 0.00 2.81 -1.26 -4.24 117.12 112.11 1n80 n MET 322 Ca 0.00 0.00 -0.36 0.00 -1.81 0.00 0.00 57.70 55.53 1n80 n MET 322 Cb 0.00 -0.37 0.07 0.00 -0.71 0.00 0.00 33.22 32.21 1n80 n MET 322 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1n80 n ASP 323 N 0.00 7.66 -4.90 7.83 10.43 -1.26 -3.34 116.55 132.98 1n80 n ASP 323 Ca 0.00 -3.79 -0.30 0.00 2.57 0.00 0.00 54.79 53.28 1n80 n ASP 323 Cb 0.00 -1.00 -0.04 0.00 1.84 0.00 0.00 41.12 41.92 1n80 n ASP 323 CO 0.00 0.00 0.00 -1.58 -1.07 0.00 0.00 177.20 174.55 1n80 s GLN 324 N -3.85 3.68 -0.19 -1.24 2.00 -1.26 -4.73 119.66 114.07 1n80 s GLN 324 Ca 0.62 0.09 -0.01 0.00 -2.00 0.00 0.00 55.36 54.06 1n80 s GLN 324 Cb 0.49 -2.64 0.05 0.00 0.80 0.00 0.00 33.01 31.72 1n80 s GLN 324 CO -0.10 0.23 -0.01 0.95 -0.50 0.00 0.00 175.29 175.87 1n80 s THR 325 N -2.03 0.88 -0.24 -0.34 -4.23 -1.26 -0.71 115.64 107.72 1n80 s THR 325 Ca 0.45 -0.70 -0.20 0.00 -1.18 0.00 0.00 61.69 60.06 1n80 s THR 325 Cb -0.11 -1.25 -0.02 0.00 1.34 0.00 0.00 72.50 72.46 1n80 s THR 325 CO 0.28 -0.09 0.62 -1.61 -0.54 0.00 0.00 174.62 173.27 1n80 s GLU 326 N 1.70 4.14 0.01 3.99 0.41 -0.75 -4.83 118.70 123.38 1n80 s GLU 326 Ca -0.02 0.55 -0.30 0.00 -0.41 0.00 0.00 54.97 54.79 1n80 s GLU 326 Cb -0.17 -3.62 -0.06 0.00 -1.78 0.00 0.00 34.13 28.50 1n80 s GLU 326 CO -0.07 -0.34 1.46 -2.00 -0.49 0.00 0.00 175.26 173.81 1n80 s GLU 327 N 2.27 4.26 -0.19 1.61 2.12 -1.26 -1.05 118.70 126.46 1n80 s GLU 327 Ca 0.26 2.04 -0.06 0.00 0.36 0.00 0.00 54.97 57.58 1n80 s GLU 327 Cb -0.16 -3.58 -0.03 0.00 0.26 0.00 0.00 34.13 30.62 1n80 s GLU 327 CO 0.09 -0.61 0.02 0.42 -0.54 0.00 0.00 175.26 174.64 1n80 s ILE 328 N 2.47 4.31 0.15 -3.70 -1.09 0.19 -4.93 121.20 118.61 1n80 s ILE 328 Ca 0.66 -0.20 0.09 0.00 -2.23 0.00 0.00 60.65 58.98 1n80 s ILE 328 Cb -0.33 -2.94 -0.04 0.00 -1.58 0.00 0.00 42.46 37.57 1n80 s ILE 328 CO 0.28 0.44 -0.21 0.20 -1.23 0.00 0.00 174.94 174.42 1n80 s ASN 329 N 0.67 2.84 -0.18 3.58 0.02 -1.26 -2.38 114.94 118.24 1n80 s ASN 329 Ca 0.01 -0.81 -0.19 0.00 -1.02 0.00 0.00 52.86 50.85 1n80 s ASN 329 Cb -0.14 -0.18 0.05 0.00 0.02 0.00 0.00 41.25 41.01 1n80 s ASN 329 CO 0.02 0.04 0.53 -0.63 0.02 0.00 0.00 177.10 177.08 1n80 s ILE 330 N -1.66 0.00 -0.18 0.60 1.01 -1.25 -4.96 121.20 114.78 1n80 s ILE 330 Ca 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 60.65 60.74 1n80 s ILE 330 Cb -0.08 -0.76 -0.00 0.00 0.01 0.00 0.00 42.46 41.63 1n80 s ILE 330 CO 0.07 -0.02 -0.12 -0.76 0.00 0.00 0.00 174.94 174.11 1n80 s LEU 331 N 0.05 2.62 -0.18 2.97 1.43 -1.26 -0.19 118.68 124.12 1n80 s LEU 331 Ca -0.02 -0.44 -0.04 0.00 -1.03 0.00 0.00 54.13 52.60 1n80 s LEU 331 Cb -0.04 -1.62 -0.02 0.00 0.03 0.00 0.00 46.19 44.54 1n80 s LEU 331 CO 0.02 0.05 -0.03 -0.36 0.23 0.00 0.00 176.35 176.25 1n80 s PHE 332 N 1.04 2.99 -0.19 0.29 2.99 -0.04 -4.97 117.98 120.09 1n80 s PHE 332 Ca -0.01 -0.52 -0.02 0.00 0.00 0.00 0.00 56.93 56.38 1n80 s PHE 332 Cb -0.15 -2.02 -0.01 0.00 0.00 0.00 0.00 43.02 40.84 1n80 s PHE 332 CO -0.02 -0.23 -0.08 0.99 -0.00 0.00 0.00 175.22 175.87 1n80 s THR 333 N 0.83 3.12 -2.99 0.64 2.01 -1.26 -0.61 115.64 117.37 1n80 s THR 333 Ca -0.01 -0.59 0.24 0.00 0.31 0.00 0.00 61.69 61.64 1n80 s THR 333 Cb -0.14 -2.38 0.20 0.00 0.01 0.00 0.00 72.50 70.18 1n80 s THR 333 CO 0.02 0.46 1.27 0.49 -0.69 0.00 0.00 174.62 176.17