#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1npd s VAL 3 N 0.00 3.58 0.44 2.53 1.01 -1.26 -5.02 120.40 121.67 1npd s VAL 3 Ca 0.00 1.20 0.03 0.00 0.00 0.00 0.00 61.98 63.21 1npd s VAL 3 Cb 0.00 -3.77 -0.02 0.00 0.00 0.00 0.00 36.38 32.59 1npd s VAL 3 CO 0.00 0.13 0.10 0.42 0.00 0.00 0.00 175.10 175.75 1npd s THR 4 N 0.67 0.76 -1.56 3.92 -4.23 -1.26 -5.01 115.64 108.93 1npd s THR 4 Ca 0.59 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 59.17 1npd s THR 4 Cb -0.34 -2.31 0.15 0.00 1.34 0.00 0.00 72.50 71.34 1npd s THR 4 CO 0.33 0.00 1.05 0.00 -0.54 0.00 0.00 174.62 175.45 1npd n ALA 5 N -1.00 1.58 0.25 3.99 0.00 -1.26 -2.30 120.51 121.77 1npd n ALA 5 Ca -0.09 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.42 1npd n ALA 5 Cb 0.65 -1.12 -0.02 0.00 0.00 0.00 0.00 19.45 18.96 1npd n ALA 5 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1npd n LYS 6 N -1.22 0.50 -2.26 0.00 5.02 -1.26 -4.94 118.16 114.00 1npd n LYS 6 Ca 0.04 0.01 -0.39 0.00 -2.02 0.00 0.00 58.31 55.95 1npd n LYS 6 Cb 0.05 -1.68 -0.02 0.00 -0.02 0.00 0.00 35.03 33.36 1npd n LYS 6 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1npd s TYR 7 N -3.33 3.11 0.17 2.13 1.51 -0.97 -4.93 117.35 115.04 1npd s TYR 7 Ca -0.00 1.53 0.04 0.00 -1.01 0.00 0.00 57.07 57.63 1npd s TYR 7 Cb 0.12 -3.46 -0.04 0.00 -0.11 0.00 0.00 41.96 38.47 1npd s TYR 7 CO 0.82 -1.39 0.20 -1.21 -1.11 0.00 0.00 175.55 172.85 1npd s GLU 8 N -2.06 3.09 0.03 -0.62 2.02 -0.42 -4.95 118.70 115.78 1npd s GLU 8 Ca 0.54 -0.80 -0.12 0.00 0.02 0.00 0.00 54.97 54.61 1npd s GLU 8 Cb -0.33 -2.75 -0.06 0.00 0.10 0.00 0.00 34.13 31.09 1npd s GLU 8 CO 0.43 0.49 0.38 -1.17 0.02 0.00 0.00 175.26 175.41 1npd s LEU 9 N -3.24 4.41 -0.11 1.80 2.96 -1.26 -1.70 118.68 121.55 1npd s LEU 9 Ca 0.32 0.85 -0.01 0.00 -0.22 0.00 0.00 54.13 55.07 1npd s LEU 9 Cb -0.10 -2.72 0.03 0.00 0.50 0.00 0.00 46.19 43.90 1npd s LEU 9 CO 0.25 0.27 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.90 1npd s ILE 10 N -1.22 0.60 0.34 6.68 1.01 -0.46 -0.16 121.20 127.99 1npd s ILE 10 Ca 0.27 -0.12 0.05 0.00 0.00 0.00 0.00 60.65 60.85 1npd s ILE 10 Cb -0.15 -0.78 0.05 0.00 0.01 0.00 0.00 42.46 41.59 1npd s ILE 10 CO 0.15 0.21 0.40 0.61 0.00 0.00 0.00 174.94 176.31 1npd n GLY 11 N 5.07 2.22 2.47 6.18 0.00 -0.91 -3.90 105.19 116.32 1npd n GLY 11 Ca -0.09 -2.20 -0.13 0.00 0.00 0.00 0.00 46.02 43.60 1npd n GLY 11 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1npd n LEU 12 N 0.00 0.00 0.00 0.99 7.94 -1.25 0.51 117.00 125.18 1npd n LEU 12 Ca 0.06 -2.24 0.00 0.00 -1.11 0.00 0.00 56.01 52.72 1npd n LEU 12 Cb 0.36 1.62 0.00 0.00 0.53 0.00 0.00 43.42 45.93 1npd n LEU 12 CO 0.22 -0.45 0.00 0.00 -1.11 0.00 0.00 177.39 176.06 1npd n ALA 14 N -1.28 0.00 -3.51 1.96 0.00 -1.11 -0.05 120.51 116.53 1npd n ALA 14 Ca -0.10 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.34 1npd n ALA 14 Cb 0.45 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.84 1npd n ALA 14 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1npd s TYR 15 N -1.30 -0.61 0.91 0.00 5.04 -1.21 -0.84 117.35 119.33 1npd s TYR 15 Ca 0.00 1.13 -0.11 0.00 -2.44 0.00 0.00 57.07 55.65 1npd s TYR 15 Cb 0.00 0.37 0.14 0.00 0.35 0.00 0.00 41.96 42.81 1npd s TYR 15 CO 0.00 -0.30 1.11 -2.14 -1.34 0.00 0.00 175.55 172.87 1npd s PRO 16 N 1.93 1.13 0.00 4.97 0.02 -1.26 -4.26 135.00 137.53 1npd s PRO 16 Ca -0.06 1.22 0.00 0.00 0.02 0.00 0.00 61.00 62.19 1npd s PRO 16 Cb -0.05 -1.76 0.00 0.00 0.02 0.00 0.00 34.50 32.71 1npd s PRO 16 CO -0.16 -2.45 0.00 1.51 -0.33 0.00 0.00 177.00 175.57 1npd n ILE 17 N -4.08 0.00 0.00 2.83 3.06 -1.26 -4.92 119.36 114.99 1npd n ILE 17 Ca 0.09 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.34 1npd n ILE 17 Cb 0.53 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.71 1npd n ILE 17 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 1npd n ARG 18 N -0.21 0.00 -0.12 9.51 3.00 -1.26 -0.55 116.66 127.04 1npd n ARG 18 Ca 0.00 0.31 0.06 0.00 -0.01 0.00 0.00 57.85 58.21 1npd n ARG 18 Cb 0.00 -1.62 0.12 0.00 0.00 0.00 0.00 32.46 30.96 1npd n ARG 18 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1npd n HIS 19 N -1.29 0.30 -1.61 -1.55 8.25 -1.26 -5.03 115.22 113.03 1npd n HIS 19 Ca 0.00 -0.33 -0.33 0.00 -0.26 0.00 0.00 57.72 56.80 1npd n HIS 19 Cb 0.12 -0.02 0.07 0.00 1.12 0.00 0.00 29.99 31.28 1npd n HIS 19 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1npd s SER 20 N -0.98 4.72 0.00 0.41 0.15 0.29 -4.97 113.70 113.33 1npd s SER 20 Ca 0.20 2.13 0.18 0.00 0.70 0.00 0.00 55.95 59.16 1npd s SER 20 Cb 0.11 -2.56 -0.18 0.00 -1.71 0.00 0.00 66.02 61.67 1npd s SER 20 CO 0.15 -1.90 0.77 0.18 1.20 0.00 0.00 173.24 173.65 1npd n LEU 21 N -2.58 0.90 -0.19 3.45 4.32 -1.26 -4.50 117.00 117.15 1npd n LEU 21 Ca 0.11 -0.52 -0.02 0.00 -0.02 0.00 0.00 56.01 55.57 1npd n LEU 21 Cb 0.51 0.00 0.09 0.00 -1.62 0.00 0.00 43.42 42.40 1npd n LEU 21 CO 0.48 0.22 1.01 0.28 -1.22 0.00 0.00 177.39 178.15 1npd h SER 22 N 0.12 0.30 0.03 -1.43 0.02 -1.96 -2.96 113.55 107.67 1npd h SER 22 Ca 0.00 0.06 0.03 0.00 -0.84 0.00 0.00 61.79 61.03 1npd h SER 22 Cb 0.44 0.01 -0.05 0.00 0.14 0.00 0.00 62.40 62.94 1npd h SER 22 CO 0.00 0.19 -0.44 -0.65 -1.14 0.00 0.00 176.83 174.79 1npd h PRO 23 N 0.46 -0.60 -0.76 3.45 0.11 -1.89 0.18 132.00 132.95 1npd h PRO 23 Ca 0.28 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.43 1npd h PRO 23 Cb 0.28 0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.52 1npd h PRO 23 CO -0.24 -0.40 0.00 -1.91 -0.21 0.00 0.00 178.00 175.24 1npd n GLU 24 N -5.46 0.00 0.00 1.05 2.13 -1.12 0.33 120.64 117.57 1npd n GLU 24 Ca -0.06 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.76 1npd n GLU 24 Cb 0.38 -1.18 0.00 0.00 0.27 0.00 0.00 31.44 30.91 1npd n GLU 24 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1npd n GLN 26 N 0.68 0.00 0.17 5.31 1.13 0.63 0.26 117.38 125.57 1npd n GLN 26 Ca 0.00 0.00 0.03 0.00 -1.94 0.00 0.00 57.00 55.09 1npd n GLN 26 Cb 0.00 0.00 0.30 0.00 0.11 0.00 0.00 30.24 30.65 1npd n GLN 26 CO 0.00 0.00 0.00 -0.91 -1.44 0.00 0.00 177.06 174.71 1npd h ASN 27 N 0.00 0.00 -0.28 1.08 2.35 -0.33 -0.09 115.58 118.32 1npd h ASN 27 Ca 0.00 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.65 1npd h ASN 27 Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1npd h ASN 27 CO 0.00 0.45 -0.22 0.11 -1.65 0.00 0.00 177.43 176.12 1npd h LYS 28 N 0.00 0.65 -0.54 0.81 1.79 -0.41 -1.68 116.57 117.19 1npd h LYS 28 Ca -0.00 -0.32 -0.05 0.00 -2.18 0.00 0.00 60.65 58.09 1npd h LYS 28 Cb 0.90 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.53 1npd h LYS 28 CO 0.06 0.92 0.13 0.00 -1.08 0.00 0.00 179.45 179.48 1npd h ALA 29 N 0.71 0.71 -0.05 3.86 0.00 -1.73 -0.98 119.26 121.78 1npd h ALA 29 Ca 0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1npd h ALA 29 Cb 0.77 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1npd h ALA 29 CO 0.06 0.41 0.01 -0.07 0.00 0.00 0.00 179.25 179.66 1npd h LEU 30 N 0.76 0.08 -1.20 0.00 3.38 -0.97 -2.58 115.31 114.78 1npd h LEU 30 Ca 0.17 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1npd h LEU 30 Cb 0.34 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 1npd h LEU 30 CO 0.00 0.32 0.32 -0.08 0.09 0.00 0.00 178.44 179.09 1npd h GLU 31 N -0.16 0.87 -0.52 1.13 4.81 -1.29 -0.70 114.58 118.72 1npd h GLU 31 Ca 0.02 -0.10 0.09 0.00 -0.13 0.00 0.00 59.36 59.23 1npd h GLU 31 Cb 0.27 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 1npd h GLU 31 CO 0.00 0.66 0.36 -0.22 -0.73 0.00 0.00 179.01 179.08 1npd h LYS 32 N 0.88 0.33 -0.63 1.92 1.63 -0.93 0.72 116.57 120.48 1npd h LYS 32 Ca 0.22 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.00 1npd h LYS 32 Cb 0.06 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.62 1npd h LYS 32 CO -0.03 0.22 0.00 0.00 -3.45 0.00 0.00 179.45 176.18 1npd n ALA 33 N -2.53 2.48 -3.07 5.00 0.00 -0.41 -4.95 120.51 117.03 1npd n ALA 33 Ca 0.08 -1.35 -0.22 0.00 0.00 0.00 0.00 53.44 51.95 1npd n ALA 33 Cb 0.35 -0.84 0.02 0.00 0.00 0.00 0.00 19.45 18.98 1npd n ALA 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1npd n GLY 34 N 1.28 -0.51 3.74 0.00 0.00 0.24 -4.95 105.19 105.01 1npd n GLY 34 Ca 0.22 0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.95 1npd n GLY 34 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1npd s LEU 35 N -6.52 4.38 -0.70 0.99 1.02 -0.51 -4.97 118.68 112.37 1npd s LEU 35 Ca 0.30 1.21 -0.05 0.00 0.02 0.00 0.00 54.13 55.61 1npd s LEU 35 Cb -0.15 -3.02 -0.07 0.00 0.02 0.00 0.00 46.19 42.98 1npd s LEU 35 CO 0.37 0.01 2.07 -0.81 0.02 0.00 0.00 176.35 178.02 1npd n PRO 36 N 3.12 1.80 -4.00 1.29 -0.04 -1.26 -4.69 135.00 131.22 1npd n PRO 36 Ca -0.04 -1.24 -0.10 0.00 -0.04 0.00 0.00 63.50 62.08 1npd n PRO 36 Cb 0.51 -2.30 -0.11 0.00 -0.04 0.00 0.00 33.50 31.56 1npd n PRO 36 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1npd s PHE 37 N 3.20 0.35 -0.06 0.54 0.40 -1.26 -1.30 117.98 119.85 1npd s PHE 37 Ca 0.37 -0.57 0.01 0.00 -0.60 0.00 0.00 56.93 56.14 1npd s PHE 37 Cb 0.11 -0.24 0.02 0.00 0.51 0.00 0.00 43.02 43.42 1npd s PHE 37 CO -0.03 -0.19 -0.06 0.99 0.70 0.00 0.00 175.22 176.64 1npd s THR 38 N -1.66 0.70 0.44 0.64 2.01 -0.69 -4.88 115.64 112.20 1npd s THR 38 Ca -0.13 -0.18 0.01 0.00 0.31 0.00 0.00 61.69 61.70 1npd s THR 38 Cb -0.08 -0.72 -0.01 0.00 0.01 0.00 0.00 72.50 71.70 1npd s THR 38 CO -0.01 0.27 0.65 -0.47 -0.69 0.00 0.00 174.62 174.37 1npd s TYR 39 N 1.11 3.23 -0.00 4.92 5.04 -1.25 -1.35 117.35 129.04 1npd s TYR 39 Ca -0.08 0.20 0.02 0.00 -2.44 0.00 0.00 57.07 54.77 1npd s TYR 39 Cb -0.14 -2.27 -0.00 0.00 0.35 0.00 0.00 41.96 39.89 1npd s TYR 39 CO -0.01 -0.31 -0.05 0.00 -1.34 0.00 0.00 175.55 173.84 1npd s ALA 41 N -2.52 0.41 -0.06 3.97 0.00 -1.26 -4.86 121.76 117.45 1npd s ALA 41 Ca 0.48 -0.22 0.03 0.00 0.00 0.00 0.00 51.96 52.25 1npd s ALA 41 Cb -0.10 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 22.92 1npd s ALA 41 CO 0.37 0.10 -0.15 -0.06 0.00 0.00 0.00 175.76 176.02 1npd s PHE 42 N -0.13 1.66 -0.62 0.00 0.08 0.93 -4.88 117.98 115.02 1npd s PHE 42 Ca 0.02 -0.57 -0.27 0.00 0.12 0.00 0.00 56.93 56.23 1npd s PHE 42 Cb -0.02 -1.16 0.01 0.00 -0.57 0.00 0.00 43.02 41.28 1npd s PHE 42 CO -0.00 -0.24 1.52 -1.21 -0.10 0.00 0.00 175.22 175.18 1npd s GLU 43 N 0.37 3.07 -0.03 0.44 2.02 -1.26 -2.73 118.70 120.57 1npd s GLU 43 Ca -0.11 0.32 0.01 0.00 0.02 0.00 0.00 54.97 55.21 1npd s GLU 43 Cb -0.14 -4.22 0.02 0.00 0.10 0.00 0.00 34.13 29.88 1npd s GLU 43 CO 0.04 -2.24 -0.04 0.08 0.02 0.00 0.00 175.26 173.12 1npd s VAL 44 N 6.89 0.46 0.14 2.63 1.01 -0.02 -4.93 120.40 126.57 1npd s VAL 44 Ca 0.52 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.38 1npd s VAL 44 Cb -0.11 -0.47 0.00 0.00 0.00 0.00 0.00 36.38 35.81 1npd s VAL 44 CO 0.21 0.19 0.02 -0.90 0.00 0.00 0.00 175.10 174.62 1npd n ASP 45 N 3.76 2.20 -0.35 3.32 5.68 -1.26 -3.35 116.55 126.55 1npd n ASP 45 Ca -0.23 -1.58 0.13 0.00 -0.50 0.00 0.00 54.79 52.62 1npd n ASP 45 Cb 0.52 0.07 0.33 0.00 -1.14 0.00 0.00 41.12 40.91 1npd n ASP 45 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 1npd h ASN 46 N 0.30 0.78 -0.14 -1.12 4.21 -2.00 -0.11 115.58 117.50 1npd h ASN 46 Ca -0.11 0.09 -0.13 0.00 1.21 0.00 0.00 56.30 57.36 1npd h ASN 46 Cb 0.34 -0.05 -0.01 0.00 -1.12 0.00 0.00 38.32 37.47 1npd h ASN 46 CO 0.18 0.29 -0.34 0.44 -1.29 0.00 0.00 177.43 176.71 1npd h ASP 47 N 0.77 0.67 0.56 5.81 3.32 -2.00 -3.15 116.42 122.39 1npd h ASP 47 Ca 0.56 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 57.33 1npd h ASP 47 Cb 0.88 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.24 1npd h ASP 47 CO -0.36 0.96 -0.63 -1.54 -1.72 0.00 0.00 179.24 175.96 1npd n SER 48 N -4.06 0.58 -0.19 6.45 3.41 -0.86 -4.38 113.62 114.57 1npd n SER 48 Ca -0.01 -0.18 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 1npd n SER 48 Cb 0.49 0.34 0.10 0.00 -0.26 0.00 0.00 64.21 64.88 1npd n SER 48 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1npd h PHE 49 N 0.00 0.21 -0.52 7.33 3.57 -0.99 0.95 116.94 127.48 1npd h PHE 49 Ca 0.00 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.58 1npd h PHE 49 Cb 0.59 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.29 1npd h PHE 49 CO 0.00 -0.02 0.28 -1.35 -2.23 0.00 0.00 178.31 174.98 1npd h PRO 50 N 0.26 0.52 -0.39 6.41 0.11 -1.76 -0.25 132.00 136.91 1npd h PRO 50 Ca 0.31 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.30 1npd h PRO 50 Cb 0.44 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.42 1npd h PRO 50 CO -0.39 0.34 -0.09 0.78 -0.21 0.00 0.00 178.00 178.44 1npd h GLY 51 N 0.54 0.72 1.02 -0.55 0.00 -1.58 -2.61 103.07 100.61 1npd h GLY 51 Ca 0.22 -0.51 -0.04 0.00 0.00 0.00 0.00 47.33 47.01 1npd h GLY 51 CO -0.14 0.47 0.29 0.00 0.00 0.00 0.00 176.54 177.16 1npd h ALA 52 N 1.29 0.89 -0.35 3.60 0.00 0.02 -1.02 119.26 123.68 1npd h ALA 52 Ca 0.11 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1npd h ALA 52 Cb 0.52 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1npd h ALA 52 CO 0.03 0.50 -0.06 0.82 0.00 0.00 0.00 179.25 180.54 1npd h ILE 53 N 0.97 1.22 -0.68 0.00 1.08 -0.83 0.28 117.51 119.54 1npd h ILE 53 Ca 0.23 -0.94 -0.04 0.00 -0.39 0.00 0.00 64.86 63.72 1npd h ILE 53 Cb 0.19 1.02 -0.03 0.00 -3.07 0.00 0.00 36.82 34.92 1npd h ILE 53 CO -0.02 0.32 0.26 -0.33 -0.69 0.00 0.00 178.15 177.69 1npd h GLU 54 N 0.54 1.01 -0.32 2.37 4.39 -0.99 -2.10 114.58 119.49 1npd h GLU 54 Ca 0.11 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.57 1npd h GLU 54 Cb 0.43 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 1npd h GLU 54 CO 0.02 0.83 -0.05 0.78 -1.16 0.00 0.00 179.01 179.43 1npd h GLY 55 N 1.06 0.64 0.02 -3.84 0.00 -0.18 -0.28 103.07 100.50 1npd h GLY 55 Ca 0.23 -0.50 0.14 0.00 0.00 0.00 0.00 47.33 47.20 1npd h GLY 55 CO -0.02 0.46 0.18 -2.00 0.00 0.00 0.00 176.54 175.16 1npd h LEU 56 N 0.37 0.05 -0.02 3.11 6.46 -0.36 0.38 115.31 125.30 1npd h LEU 56 Ca 0.08 0.13 -0.04 0.00 -0.12 0.00 0.00 57.88 57.94 1npd h LEU 56 Cb 0.52 0.17 0.00 0.00 -0.73 0.00 0.00 40.66 40.62 1npd h LEU 56 CO 0.03 -0.01 -0.14 0.11 -0.62 0.00 0.00 178.44 177.81 1npd h LYS 57 N 0.29 0.13 -0.53 1.25 1.57 -1.33 -2.63 116.57 115.32 1npd h LYS 57 Ca 0.39 -0.11 -0.05 0.00 -1.87 0.00 0.00 60.65 59.00 1npd h LYS 57 Cb 0.63 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.94 1npd h LYS 57 CO -0.47 0.79 0.11 0.00 -0.57 0.00 0.00 179.45 179.31 1npd h ALA 58 N 0.34 1.19 -0.00 3.86 0.00 -0.43 -2.06 119.26 122.17 1npd h ALA 58 Ca -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1npd h ALA 58 Cb 0.82 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1npd h ALA 58 CO 0.03 0.55 -0.18 1.28 0.00 0.00 0.00 179.25 180.93 1npd n LEU 59 N -4.26 0.43 -1.77 0.00 4.77 0.13 -5.07 117.00 111.22 1npd n LEU 59 Ca 0.04 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 1npd n LEU 59 Cb 0.24 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1npd n LEU 59 CO 0.40 0.09 -0.45 0.29 -1.33 0.00 0.00 177.39 176.38 1npd n LYS 60 N -1.14 -4.96 -0.03 3.23 5.02 -0.78 -4.98 118.16 114.53 1npd n LYS 60 Ca 0.11 3.58 0.01 0.00 -2.02 0.00 0.00 58.31 59.98 1npd n LYS 60 Cb 0.31 -3.94 -0.08 0.00 -0.02 0.00 0.00 35.03 31.30 1npd n LYS 60 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1npd n ARG 62 N 0.48 1.29 -3.88 1.97 3.00 0.77 -4.73 116.66 115.57 1npd n ARG 62 Ca 0.00 -0.05 0.00 0.00 -0.00 0.00 0.00 57.85 57.80 1npd n ARG 62 Cb 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 32.46 31.21 1npd n ARG 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1npd n GLY 63 N 2.13 -1.05 3.54 5.14 0.00 -1.24 -1.40 105.19 112.31 1npd n GLY 63 Ca -0.08 -1.13 -0.11 0.00 0.00 0.00 0.00 46.02 44.69 1npd n GLY 63 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1npd s THR 64 N -3.00 0.00 0.31 2.61 -1.32 -0.49 -2.14 115.64 111.61 1npd s THR 64 Ca 0.00 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.47 1npd s THR 64 Cb 0.00 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.95 1npd s THR 64 CO 0.00 0.00 0.52 -0.83 -2.21 0.00 0.00 174.62 172.10 1npd s GLY 65 N -1.56 1.52 -0.03 6.08 0.00 0.18 -0.80 107.32 112.71 1npd s GLY 65 Ca -0.01 -0.83 0.02 0.00 0.00 0.00 0.00 44.72 43.89 1npd s GLY 65 CO -0.00 -0.76 -0.06 0.14 0.00 0.00 0.00 173.10 172.41 1npd s VAL 66 N -2.18 0.63 0.14 1.40 1.01 0.23 -3.88 120.40 117.75 1npd s VAL 66 Ca 0.40 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.15 1npd s VAL 66 Cb -0.10 -0.61 0.00 0.00 0.00 0.00 0.00 36.38 35.67 1npd s VAL 66 CO 0.33 0.23 0.00 -0.24 0.00 0.00 0.00 175.10 175.42 1npd n SER 67 N 3.66 0.04 -1.18 3.32 2.88 -1.26 -4.30 113.62 116.77 1npd n SER 67 Ca -0.22 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 1npd n SER 67 Cb 0.53 0.15 0.00 0.00 -0.75 0.00 0.00 64.21 64.14 1npd n SER 67 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1npd n PRO 69 N -3.03 0.55 -0.06 -1.46 -0.04 -1.26 -3.77 135.00 125.93 1npd n PRO 69 Ca 0.00 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.58 1npd n PRO 69 Cb 0.00 -1.22 0.13 0.00 -0.04 0.00 0.00 33.50 32.37 1npd n PRO 69 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1npd n ASN 70 N 0.98 3.11 -0.22 3.54 5.03 -1.26 -4.62 115.26 121.82 1npd n ASN 70 Ca 0.00 -1.98 -0.01 0.00 0.87 0.00 0.00 54.58 53.46 1npd n ASN 70 Cb 0.28 -0.08 0.10 0.00 -1.02 0.00 0.00 39.78 39.06 1npd n ASN 70 CO 0.00 0.00 0.00 0.11 -1.83 0.00 0.00 177.26 175.54 1npd h LYS 71 N 4.55 0.56 0.00 3.52 1.57 -1.78 0.72 116.57 125.71 1npd h LYS 71 Ca 0.00 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1npd h LYS 71 Cb 0.98 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.16 1npd h LYS 71 CO 0.00 0.37 -0.01 1.96 -0.57 0.00 0.00 179.45 181.20 1npd h GLN 72 N 0.58 0.00 -0.85 3.15 4.20 -1.82 -1.04 115.11 119.33 1npd h GLN 72 Ca 0.30 -0.01 0.10 0.00 0.06 0.00 0.00 58.65 59.10 1npd h GLN 72 Cb 0.25 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.97 1npd h GLN 72 CO -0.22 0.82 0.55 1.25 -0.67 0.00 0.00 178.83 180.57 1npd h LEU 73 N -0.81 0.73 -1.65 1.46 5.85 -1.81 -2.06 115.31 117.01 1npd h LEU 73 Ca -0.00 0.02 0.21 0.00 0.84 0.00 0.00 57.88 58.95 1npd h LEU 73 Cb 0.83 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.67 1npd h LEU 73 CO 0.00 0.43 0.59 0.00 -0.34 0.00 0.00 178.44 179.11 1npd h ALA 74 N 1.58 2.36 -0.22 1.25 0.00 -0.94 -0.13 119.26 123.16 1npd h ALA 74 Ca 0.39 0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.37 1npd h ALA 74 Cb 0.44 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1npd h ALA 74 CO -0.16 -0.62 0.16 0.00 0.00 0.00 0.00 179.25 178.62 1npd n GLU 76 N -4.48 0.13 -0.30 0.00 -0.58 -0.06 -3.58 120.64 111.77 1npd n GLU 76 Ca 0.02 -0.01 0.07 0.00 -0.42 0.00 0.00 57.16 56.82 1npd n GLU 76 Cb 0.29 -1.50 0.20 0.00 -0.57 0.00 0.00 31.44 29.87 1npd n GLU 76 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1npd n TYR 77 N -1.43 0.70 -4.17 -0.32 4.02 -0.68 -5.00 117.16 110.28 1npd n TYR 77 Ca 0.09 -0.64 -0.23 0.00 -0.01 0.00 0.00 57.90 57.11 1npd n TYR 77 Cb 0.31 -0.14 -0.07 0.00 -0.02 0.00 0.00 39.34 39.42 1npd n TYR 77 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1npd s VAL 78 N -1.68 2.95 -0.02 -0.72 -7.23 -1.23 -4.92 120.40 107.55 1npd s VAL 78 Ca 0.32 -1.77 0.12 0.00 -1.81 0.00 0.00 61.98 58.83 1npd s VAL 78 Cb 0.21 -2.93 -0.19 0.00 0.56 0.00 0.00 36.38 34.03 1npd s VAL 78 CO 0.14 -0.19 0.92 0.44 -0.31 0.00 0.00 175.10 176.10 1npd h ASP 79 N 1.62 0.00 -3.86 4.85 3.32 -0.84 -3.48 116.42 118.04 1npd h ASP 79 Ca -0.43 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.47 1npd h ASP 79 Cb 1.25 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.55 1npd h ASP 79 CO 0.64 0.89 -0.35 -1.61 -1.72 0.00 0.00 179.24 177.09 1npd s GLU 80 N -2.71 0.36 0.19 3.56 2.02 -1.02 -5.01 118.70 116.09 1npd s GLU 80 Ca -0.02 0.42 0.11 0.00 0.02 0.00 0.00 54.97 55.50 1npd s GLU 80 Cb 0.09 0.18 -0.04 0.00 0.10 0.00 0.00 34.13 34.45 1npd s GLU 80 CO 0.82 -0.04 -0.22 -0.51 0.02 0.00 0.00 175.26 175.32 1npd s LEU 81 N 0.15 2.43 0.34 1.80 1.43 -1.26 -0.44 118.68 123.12 1npd s LEU 81 Ca -0.00 -0.86 -0.13 0.00 -1.03 0.00 0.00 54.13 52.10 1npd s LEU 81 Cb -0.02 -1.08 -0.08 0.00 0.03 0.00 0.00 46.19 45.04 1npd s LEU 81 CO 0.00 0.08 0.73 0.42 0.23 0.00 0.00 176.35 177.81 1npd s THR 82 N -1.76 4.73 0.27 5.49 -4.23 -1.16 -4.89 115.64 114.10 1npd s THR 82 Ca 0.19 0.80 -0.05 0.00 -1.18 0.00 0.00 61.69 61.46 1npd s THR 82 Cb -0.07 -3.65 0.35 0.00 1.34 0.00 0.00 72.50 70.47 1npd s THR 82 CO 0.09 -0.27 1.60 -0.65 -0.54 0.00 0.00 174.62 174.85 1npd h PRO 83 N 1.98 0.05 0.13 3.99 0.11 -1.99 0.21 132.00 136.49 1npd h PRO 83 Ca -0.48 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1npd h PRO 83 Cb 1.18 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1npd h PRO 83 CO 0.65 0.04 -0.06 0.00 -0.21 0.00 0.00 178.00 178.42 1npd h ALA 84 N 1.84 -0.17 -0.92 -0.75 0.00 -1.93 -1.66 119.26 115.67 1npd h ALA 84 Ca 0.48 -0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.52 1npd h ALA 84 Cb 0.88 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.63 1npd h ALA 84 CO -0.80 -0.59 0.50 0.00 0.00 0.00 0.00 179.25 178.36 1npd h ALA 85 N 0.70 1.46 -0.50 0.00 0.00 -0.95 0.40 119.26 120.37 1npd h ALA 85 Ca -0.02 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1npd h ALA 85 Cb 0.13 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1npd h ALA 85 CO 0.03 -0.10 -0.01 0.87 0.00 0.00 0.00 179.25 180.04 1npd h LYS 86 N 0.66 0.85 -0.09 0.00 1.57 -0.62 0.50 116.57 119.44 1npd h LYS 86 Ca 0.52 -0.24 -0.04 0.00 -1.87 0.00 0.00 60.65 59.02 1npd h LYS 86 Cb 0.80 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.02 1npd h LYS 86 CO -0.39 0.86 -0.08 -0.07 -0.57 0.00 0.00 179.45 179.20 1npd h LEU 87 N 0.79 0.22 -0.71 2.94 3.38 0.22 -3.18 115.31 118.97 1npd h LEU 87 Ca 0.15 -0.48 -0.06 0.00 0.09 0.00 0.00 57.88 57.58 1npd h LEU 87 Cb 0.49 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1npd h LEU 87 CO 0.02 0.66 0.23 0.58 0.09 0.00 0.00 178.44 180.02 1npd h VAL 88 N -0.21 1.26 0.00 1.22 2.07 -0.24 -3.47 116.25 116.88 1npd h VAL 88 Ca 0.01 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.65 1npd h VAL 88 Cb 0.59 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1npd h VAL 88 CO 0.02 0.35 0.00 0.61 0.02 0.00 0.00 177.57 178.57 1npd n GLY 89 N -0.75 0.52 3.41 2.17 0.00 0.17 -4.93 105.19 105.78 1npd n GLY 89 Ca 0.05 -0.56 -0.14 0.00 0.00 0.00 0.00 46.02 45.38 1npd n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npd s ALA 90 N -2.00 -1.42 0.08 4.61 0.00 -1.22 -4.51 121.76 117.31 1npd s ALA 90 Ca 0.00 0.62 0.03 0.00 0.00 0.00 0.00 51.96 52.62 1npd s ALA 90 Cb 0.00 0.47 -0.03 0.00 0.00 0.00 0.00 23.12 23.55 1npd s ALA 90 CO 0.00 -0.56 -0.09 0.96 0.00 0.00 0.00 175.76 176.07 1npd s ILE 91 N -2.66 0.82 0.00 0.00 -4.36 -0.40 -4.69 121.20 109.91 1npd s ILE 91 Ca -0.04 -1.55 0.00 0.00 -0.26 0.00 0.00 60.65 58.80 1npd s ILE 91 Cb -0.00 -1.23 0.00 0.00 1.25 0.00 0.00 42.46 42.47 1npd s ILE 91 CO -0.03 -0.55 0.53 -0.46 0.24 0.00 0.00 174.94 174.66 1npd n ASN 92 N 0.70 1.01 -3.87 4.36 6.94 -0.85 -4.45 115.26 119.10 1npd n ASN 92 Ca -0.17 -1.20 -0.13 0.00 -0.02 0.00 0.00 54.58 53.05 1npd n ASN 92 Cb 0.57 0.00 -0.14 0.00 -2.36 0.00 0.00 39.78 37.85 1npd n ASN 92 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1npd s THR 93 N -0.20 0.07 -0.03 5.53 2.01 -0.94 -0.60 115.64 121.49 1npd s THR 93 Ca 0.00 -0.00 0.02 0.00 0.31 0.00 0.00 61.69 62.02 1npd s THR 93 Cb 0.00 -0.10 0.01 0.00 0.01 0.00 0.00 72.50 72.42 1npd s THR 93 CO 0.00 0.04 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.27 1npd s ILE 94 N 0.20 0.64 -0.09 1.82 1.01 0.02 -1.66 121.20 123.15 1npd s ILE 94 Ca -0.02 -0.26 0.05 0.00 0.00 0.00 0.00 60.65 60.41 1npd s ILE 94 Cb -0.03 -0.60 -0.00 0.00 0.01 0.00 0.00 42.46 41.84 1npd s ILE 94 CO -0.01 0.22 -0.24 -0.69 0.00 0.00 0.00 174.94 174.22 1npd s VAL 95 N 0.36 2.11 -0.31 2.92 1.01 -0.41 -1.39 120.40 124.68 1npd s VAL 95 Ca -0.05 -1.02 -0.08 0.00 0.00 0.00 0.00 61.98 60.83 1npd s VAL 95 Cb -0.09 -1.79 0.01 0.00 0.00 0.00 0.00 36.38 34.51 1npd s VAL 95 CO 0.00 0.56 0.12 0.21 0.00 0.00 0.00 175.10 175.99 1npd s ASN 96 N 0.16 5.32 -0.57 3.32 3.04 -0.49 -0.47 114.94 125.25 1npd s ASN 96 Ca -0.13 -0.76 -0.06 0.00 0.04 0.00 0.00 52.86 51.94 1npd s ASN 96 Cb -0.16 -1.92 0.15 0.00 -1.54 0.00 0.00 41.25 37.77 1npd s ASN 96 CO 0.07 -0.24 0.42 -1.81 -3.04 0.00 0.00 177.10 172.50 1npd s ASP 97 N 1.52 5.61 -1.68 -4.21 1.01 0.39 -4.73 116.67 114.58 1npd s ASP 97 Ca 0.02 -2.40 -0.18 0.00 0.71 0.00 0.00 52.55 50.70 1npd s ASP 97 Cb -0.18 -1.95 0.15 0.00 1.01 0.00 0.00 42.92 41.96 1npd s ASP 97 CO 0.04 -0.53 0.80 0.47 0.21 0.00 0.00 175.17 176.16 1npd n ASP 98 N 4.18 -3.47 0.00 0.27 10.43 -1.26 -1.49 116.55 125.20 1npd n ASP 98 Ca 0.02 -0.97 0.00 0.00 2.57 0.00 0.00 54.79 56.41 1npd n ASP 98 Cb 0.41 -2.84 0.00 0.00 1.84 0.00 0.00 41.12 40.53 1npd n ASP 98 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1npd n GLY 99 N -1.39 1.99 3.70 0.44 0.00 -1.26 -5.07 105.19 103.59 1npd n GLY 99 Ca 0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 1npd n GLY 99 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1npd s TYR 100 N -2.37 3.35 -0.18 1.61 1.51 -0.56 -5.05 117.35 115.66 1npd s TYR 100 Ca 0.00 0.23 -0.07 0.00 -1.01 0.00 0.00 57.07 56.22 1npd s TYR 100 Cb 0.00 -2.11 -0.04 0.00 -0.11 0.00 0.00 41.96 39.70 1npd s TYR 100 CO 0.00 0.25 0.04 -0.51 -1.11 0.00 0.00 175.55 174.23 1npd s LEU 101 N 0.29 3.66 -0.13 -1.29 1.43 -1.26 -0.46 118.68 120.91 1npd s LEU 101 Ca 0.06 0.00 -0.01 0.00 -1.03 0.00 0.00 54.13 53.15 1npd s LEU 101 Cb -0.12 -1.92 -0.02 0.00 0.03 0.00 0.00 46.19 44.16 1npd s LEU 101 CO -0.01 0.15 -0.09 -0.13 0.23 0.00 0.00 176.35 176.50 1npd s ARG 102 N 0.51 3.42 -0.12 1.70 0.52 0.38 -0.08 118.95 125.28 1npd s ARG 102 Ca 0.02 -0.61 -0.08 0.00 -0.52 0.00 0.00 55.73 54.53 1npd s ARG 102 Cb -0.13 -2.72 -0.04 0.00 0.52 0.00 0.00 34.95 32.57 1npd s ARG 102 CO 0.01 0.27 0.17 0.20 0.02 0.00 0.00 175.30 175.97 1npd s GLY 103 N 0.23 2.18 0.06 -3.53 0.00 0.41 -1.29 107.32 105.38 1npd s GLY 103 Ca -0.06 -0.60 0.00 0.00 0.00 0.00 0.00 44.72 44.06 1npd s GLY 103 CO 0.04 -0.26 -0.04 -0.19 0.00 0.00 0.00 173.10 172.65 1npd s TYR 104 N -0.86 0.63 -0.39 1.90 2.02 -0.67 -3.01 117.35 116.98 1npd s TYR 104 Ca 0.15 -0.97 0.01 0.00 -0.37 0.00 0.00 57.07 55.90 1npd s TYR 104 Cb -0.12 -0.42 0.12 0.00 -0.40 0.00 0.00 41.96 41.14 1npd s TYR 104 CO 0.04 -0.28 0.18 1.21 -1.57 0.00 0.00 175.55 175.12 1npd s ASN 105 N -2.83 3.92 0.00 2.29 3.84 -1.26 -2.01 114.94 118.89 1npd s ASN 105 Ca 0.07 -2.29 0.25 0.00 0.21 0.00 0.00 52.86 51.10 1npd s ASN 105 Cb 0.05 -1.07 1.13 0.00 -0.55 0.00 0.00 41.25 40.81 1npd s ASN 105 CO -0.07 -0.32 1.80 0.35 -2.79 0.00 0.00 177.10 176.07 1npd n THR 106 N 4.00 0.28 -0.01 -5.21 -2.24 -1.26 -3.45 114.28 106.39 1npd n THR 106 Ca 0.05 0.07 -0.11 0.00 -2.27 0.00 0.00 64.05 61.79 1npd n THR 106 Cb 0.37 -0.65 -0.05 0.00 -2.10 0.00 0.00 70.33 67.90 1npd n THR 106 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1npd h ASP 107 N 0.00 0.14 0.79 3.42 3.32 -1.93 0.59 116.42 122.76 1npd h ASP 107 Ca 0.00 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 1npd h ASP 107 Cb 0.35 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.87 1npd h ASP 107 CO 0.00 0.12 -0.38 1.23 -1.72 0.00 0.00 179.24 178.49 1npd h GLY 108 N 0.15 -1.11 0.43 2.75 0.00 -1.72 -0.96 103.07 102.61 1npd h GLY 108 Ca 0.04 0.41 0.14 0.00 0.00 0.00 0.00 47.33 47.92 1npd h GLY 108 CO -0.01 -0.40 0.62 -0.91 0.00 0.00 0.00 176.54 175.83 1npd h THR 109 N -1.28 0.86 -0.18 4.70 1.35 -1.65 -1.00 112.91 115.70 1npd h THR 109 Ca -0.11 -0.30 -0.01 0.00 -0.55 0.00 0.00 66.41 65.44 1npd h THR 109 Cb 0.81 -0.09 -0.01 0.00 -1.73 0.00 0.00 68.15 67.13 1npd h THR 109 CO 0.18 0.16 0.08 1.23 -0.25 0.00 0.00 175.52 176.92 1npd h GLY 110 N 0.88 0.28 1.08 5.82 0.00 0.33 -0.17 103.07 111.29 1npd h GLY 110 Ca 0.50 -0.14 -0.09 0.00 0.00 0.00 0.00 47.33 47.59 1npd h GLY 110 CO -0.27 0.14 0.01 0.84 0.00 0.00 0.00 176.54 177.26 1npd h HIS 111 N 0.15 1.16 -0.69 5.60 6.17 -0.45 -1.83 115.15 125.25 1npd h HIS 111 Ca 0.06 -0.20 -0.07 0.00 0.71 0.00 0.00 60.37 60.87 1npd h HIS 111 Cb 0.14 -0.30 -0.03 0.00 2.52 0.00 0.00 27.41 29.74 1npd h HIS 111 CO -0.02 1.02 0.16 0.82 0.71 0.00 0.00 177.93 180.62 1npd h ILE 112 N 0.96 1.26 -0.39 6.26 1.08 -1.12 -2.17 117.51 123.39 1npd h ILE 112 Ca 0.17 -0.98 0.00 0.00 -0.39 0.00 0.00 64.86 63.67 1npd h ILE 112 Cb 0.55 0.56 -0.02 0.00 -3.07 0.00 0.00 36.82 34.85 1npd h ILE 112 CO 0.03 0.37 0.26 -0.09 -0.69 0.00 0.00 178.15 178.03 1npd h ARG 113 N 1.05 0.52 -0.87 2.37 9.65 -0.73 -0.30 114.38 126.07 1npd h ARG 113 Ca 0.22 -0.03 0.07 0.00 -1.10 0.00 0.00 59.98 59.13 1npd h ARG 113 Cb 0.38 -0.12 -0.06 0.00 -1.39 0.00 0.00 29.97 28.78 1npd h ARG 113 CO 0.00 0.34 0.54 0.00 2.80 0.00 0.00 179.97 183.66 1npd h ALA 114 N 1.14 1.21 0.91 2.80 0.00 -1.11 0.19 119.26 124.39 1npd h ALA 114 Ca 0.14 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1npd h ALA 114 Cb -0.06 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1npd h ALA 114 CO -0.03 0.27 -0.48 0.82 0.00 0.00 0.00 179.25 179.83 1npd h ILE 115 N 0.96 0.03 -0.76 0.00 1.08 -0.66 -2.79 117.51 115.38 1npd h ILE 115 Ca 0.39 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.97 1npd h ILE 115 Cb 0.21 0.03 -0.05 0.00 -3.07 0.00 0.00 36.82 33.94 1npd h ILE 115 CO -0.19 0.00 0.50 0.11 -0.69 0.00 0.00 178.15 177.88 1npd h LYS 116 N -1.27 0.57 0.00 2.37 1.57 -0.76 -0.99 116.57 118.06 1npd h LYS 116 Ca -0.12 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1npd h LYS 116 Cb 0.99 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.17 1npd h LYS 116 CO 0.18 0.38 -0.03 0.93 -0.57 0.00 0.00 179.45 180.34 1npd h GLU 117 N 0.59 0.00 -0.07 3.15 4.39 -0.37 -1.15 114.58 121.12 1npd h GLU 117 Ca 0.36 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.06 1npd h GLU 117 Cb 0.59 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1npd h GLU 117 CO -0.13 0.03 0.00 -1.13 -1.16 0.00 0.00 179.01 176.62 1npd n SER 118 N -3.20 1.37 -0.25 1.42 3.41 -0.38 -4.90 113.62 111.09 1npd n SER 118 Ca -0.01 -1.54 0.00 0.00 -0.26 0.00 0.00 58.87 57.06 1npd n SER 118 Cb 0.20 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.11 1npd n SER 118 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1npd n GLY 119 N 1.12 0.99 3.21 5.00 0.00 -0.44 -5.09 105.19 109.98 1npd n GLY 119 Ca 0.18 -0.41 -0.27 0.00 0.00 0.00 0.00 46.02 45.52 1npd n GLY 119 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1npd s PHE 120 N -2.51 1.88 -0.44 1.61 5.36 -1.21 -5.05 117.98 117.63 1npd s PHE 120 Ca 0.00 -0.41 -0.04 0.00 -0.96 0.00 0.00 56.93 55.52 1npd s PHE 120 Cb 0.00 -1.22 0.12 0.00 -0.34 0.00 0.00 43.02 41.58 1npd s PHE 120 CO 0.00 -0.07 0.25 0.34 -1.46 0.00 0.00 175.22 174.27 1npd s ASP 121 N -0.36 5.31 0.37 6.13 2.15 -1.26 -3.80 116.67 125.21 1npd s ASP 121 Ca 0.05 -2.10 0.24 0.00 0.43 0.00 0.00 52.55 51.17 1npd s ASP 121 Cb -0.09 -1.85 1.31 0.00 -0.30 0.00 0.00 42.92 41.99 1npd s ASP 121 CO 0.00 -0.55 1.73 0.16 -0.17 0.00 0.00 175.17 176.35 1npd h ILE 122 N 6.23 0.00 -2.88 4.11 3.07 -1.96 -3.44 117.51 122.64 1npd h ILE 122 Ca -0.13 0.00 -0.53 0.00 1.55 0.00 0.00 64.86 65.75 1npd h ILE 122 Cb 1.04 0.53 0.07 0.00 -0.27 0.00 0.00 36.82 38.20 1npd h ILE 122 CO 0.72 0.00 0.93 1.17 -1.05 0.00 0.00 178.15 179.92 1npd n LYS 123 N -2.35 2.67 -1.09 0.16 4.81 -1.26 -2.05 118.16 119.05 1npd n LYS 123 Ca -0.02 0.96 -0.03 0.00 -0.87 0.00 0.00 58.31 58.35 1npd n LYS 123 Cb 0.06 -2.77 -0.01 0.00 0.02 0.00 0.00 35.03 32.33 1npd n LYS 123 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1npd n GLY 124 N 3.11 0.41 3.95 3.14 0.00 0.31 -4.83 105.19 111.29 1npd n GLY 124 Ca 0.13 -0.05 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 1npd n GLY 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1npd s LYS 125 N -1.87 3.19 0.56 1.61 1.02 -0.87 -4.31 119.74 119.07 1npd s LYS 125 Ca 0.00 -0.94 0.09 0.00 0.02 0.00 0.00 55.97 55.14 1npd s LYS 125 Cb 0.00 -2.79 0.07 0.00 -0.52 0.00 0.00 37.83 34.60 1npd s LYS 125 CO 0.00 0.26 0.73 0.99 -0.92 0.00 0.00 175.35 176.40 1npd s THR 126 N -2.10 2.16 -0.29 2.17 2.01 -1.26 -1.19 115.64 117.14 1npd s THR 126 Ca 0.39 -1.06 0.02 0.00 0.31 0.00 0.00 61.69 61.35 1npd s THR 126 Cb -0.09 -2.22 0.18 0.00 0.01 0.00 0.00 72.50 70.38 1npd s THR 126 CO 0.29 0.00 0.54 -0.69 -0.69 0.00 0.00 174.62 174.07 1npd s VAL 128 N -2.65 -0.89 -0.33 3.82 1.01 -0.10 -2.07 120.40 119.19 1npd s VAL 128 Ca 0.58 -0.06 -0.16 0.00 0.00 0.00 0.00 61.98 62.34 1npd s VAL 128 Cb -0.06 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 1npd s VAL 128 CO 0.36 -0.06 0.40 -0.22 0.00 0.00 0.00 175.10 175.59 1npd s LEU 129 N 2.76 4.32 -0.21 3.92 2.96 -0.71 -0.62 118.68 131.09 1npd s LEU 129 Ca 0.14 -0.05 -0.19 0.00 -0.22 0.00 0.00 54.13 53.80 1npd s LEU 129 Cb -0.13 -2.43 -0.03 0.00 0.50 0.00 0.00 46.19 44.11 1npd s LEU 129 CO -0.24 -0.34 0.55 -0.76 -1.32 0.00 0.00 176.35 174.24 1npd s LEU 130 N 2.13 4.12 0.00 -0.68 1.43 0.14 -0.05 118.68 125.77 1npd s LEU 130 Ca 0.14 0.68 0.00 0.00 -1.03 0.00 0.00 54.13 53.93 1npd s LEU 130 Cb -0.16 -2.75 0.00 0.00 0.03 0.00 0.00 46.19 43.31 1npd s LEU 130 CO 0.12 -0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.08 1npd n GLY 131 N 3.97 1.74 0.39 -3.19 0.00 0.64 -0.52 105.19 108.22 1npd n GLY 131 Ca -0.04 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.00 1npd n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npd n ALA 132 N 1.62 1.78 -1.00 4.61 0.00 -1.26 -4.66 120.51 121.60 1npd n ALA 132 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.79 1npd n ALA 132 Cb 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 19.45 19.16 1npd n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1npd n GLY 133 N 0.00 -0.04 0.23 0.00 0.00 -1.26 -4.51 105.19 99.60 1npd n GLY 133 Ca 0.00 -1.47 -0.09 0.00 0.00 0.00 0.00 46.02 44.46 1npd n GLY 133 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1npd h GLY 134 N 0.00 0.80 0.71 -0.02 0.00 -1.99 -2.06 103.07 100.50 1npd h GLY 134 Ca 0.00 -0.50 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 1npd h GLY 134 CO 0.00 0.46 -0.34 0.00 0.00 0.00 0.00 176.54 176.66 1npd h ALA 135 N 0.98 -0.96 -0.64 3.60 0.00 -1.92 -2.01 119.26 118.31 1npd h ALA 135 Ca 0.15 -0.21 0.10 0.00 0.00 0.00 0.00 54.91 54.95 1npd h ALA 135 Cb 0.32 0.37 -0.08 0.00 0.00 0.00 0.00 17.79 18.40 1npd h ALA 135 CO 0.00 -0.89 0.24 0.77 0.00 0.00 0.00 179.25 179.37 1npd h SER 136 N -1.25 0.23 -0.76 0.00 0.02 -1.77 0.95 113.55 110.97 1npd h SER 136 Ca -0.10 0.08 -0.06 0.00 -0.84 0.00 0.00 61.79 60.88 1npd h SER 136 Cb 0.73 0.07 -0.03 0.00 0.14 0.00 0.00 62.40 63.31 1npd h SER 136 CO 0.16 0.13 0.25 0.74 -1.14 0.00 0.00 176.83 176.97 1npd h THR 137 N 0.42 1.26 0.03 -2.27 2.02 -1.43 -0.07 112.91 112.87 1npd h THR 137 Ca 0.33 -0.90 -0.00 0.00 0.77 0.00 0.00 66.41 66.61 1npd h THR 137 Cb 0.43 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.25 1npd h THR 137 CO -0.33 0.36 -0.01 0.00 0.37 0.00 0.00 175.52 175.91 1npd h ALA 138 N 1.14 -0.04 -0.36 6.16 0.00 -0.37 -1.54 119.26 124.25 1npd h ALA 138 Ca 0.25 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1npd h ALA 138 Cb 0.29 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1npd h ALA 138 CO -0.01 -0.35 0.11 0.82 0.00 0.00 0.00 179.25 179.82 1npd h ILE 139 N -0.38 0.87 0.41 0.00 5.03 -0.80 -1.74 117.51 120.89 1npd h ILE 139 Ca -0.00 -0.08 -0.01 0.00 -0.12 0.00 0.00 64.86 64.64 1npd h ILE 139 Cb 0.36 0.60 -0.00 0.00 -3.03 0.00 0.00 36.82 34.75 1npd h ILE 139 CO 0.01 0.04 -0.25 1.23 -0.68 0.00 0.00 178.15 178.50 1npd h GLY 140 N 0.24 -0.66 0.55 5.37 0.00 -0.98 0.38 103.07 107.97 1npd h GLY 140 Ca 0.17 0.28 0.03 0.00 0.00 0.00 0.00 47.33 47.80 1npd h GLY 140 CO -0.19 -0.25 -0.19 0.00 0.00 0.00 0.00 176.54 175.91 1npd h ALA 141 N -0.08 -0.24 -0.10 3.60 0.00 -1.14 0.12 119.26 121.42 1npd h ALA 141 Ca -0.05 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1npd h ALA 141 Cb 0.52 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1npd h ALA 141 CO 0.05 -0.69 0.01 0.37 0.00 0.00 0.00 179.25 178.99 1npd h GLN 142 N -0.31 0.05 -0.95 0.00 5.75 -1.27 -1.39 115.11 116.98 1npd h GLN 142 Ca 0.06 -0.00 0.12 0.00 -0.15 0.00 0.00 58.65 58.67 1npd h GLN 142 Cb 0.38 -0.01 -0.08 0.00 1.07 0.00 0.00 27.48 28.84 1npd h GLN 142 CO -0.17 0.03 0.61 0.78 -2.65 0.00 0.00 178.83 177.43 1npd h GLY 143 N 0.05 1.46 0.73 2.39 0.00 0.17 -0.57 103.07 107.31 1npd h GLY 143 Ca 0.05 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 46.99 1npd h GLY 143 CO -0.07 0.16 0.00 0.00 0.00 0.00 0.00 176.54 176.64 1npd h ALA 144 N 1.55 0.02 -0.86 3.60 0.00 -0.19 -1.70 119.26 121.68 1npd h ALA 144 Ca 0.46 -0.14 0.10 0.00 0.00 0.00 0.00 54.91 55.33 1npd h ALA 144 Cb 0.51 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1npd h ALA 144 CO -0.23 -0.34 0.56 0.82 0.00 0.00 0.00 179.25 180.06 1npd h ILE 145 N -0.24 0.96 -0.09 0.00 2.04 -0.51 -2.03 117.51 117.64 1npd h ILE 145 Ca 0.00 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.58 1npd h ILE 145 Cb 0.28 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 1npd h ILE 145 CO 0.00 0.15 0.00 -0.62 0.00 0.00 0.00 178.15 177.68 1npd n GLU 146 N -4.52 1.55 0.00 2.37 1.02 -0.29 -4.85 120.64 115.91 1npd n GLU 146 Ca 0.15 -0.46 0.00 0.00 -0.02 0.00 0.00 57.16 56.83 1npd n GLU 146 Cb 0.31 -1.57 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 1npd n GLU 146 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1npd n GLY 147 N 0.14 0.66 3.66 0.62 0.00 -0.76 -4.31 105.19 105.20 1npd n GLY 147 Ca 0.04 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.61 1npd n GLY 147 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1npd n LEU 148 N 0.00 2.96 0.29 0.99 4.77 -0.66 0.12 117.00 125.47 1npd n LEU 148 Ca 0.00 1.13 -0.15 0.00 -0.03 0.00 0.00 56.01 56.96 1npd n LEU 148 Cb 0.00 -1.41 -0.08 0.00 -2.33 0.00 0.00 43.42 39.60 1npd n LEU 148 CO 0.00 -0.52 0.56 0.50 -1.33 0.00 0.00 177.39 176.60 1npd h LYS 149 N 4.50 -0.70 -2.56 3.23 3.64 -1.34 -3.37 116.57 119.96 1npd h LYS 149 Ca -0.45 0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 58.91 1npd h LYS 149 Cb 1.28 0.16 -0.18 0.00 -0.41 0.00 0.00 32.23 33.08 1npd h LYS 149 CO 0.78 -0.41 0.03 -1.83 -2.27 0.00 0.00 179.45 175.76 1npd s GLU 150 N -5.27 0.98 -0.20 1.90 -1.05 -1.19 -2.90 118.70 110.97 1npd s GLU 150 Ca -0.16 -0.06 0.01 0.00 -0.15 0.00 0.00 54.97 54.62 1npd s GLU 150 Cb 0.03 0.45 0.03 0.00 -0.44 0.00 0.00 34.13 34.20 1npd s GLU 150 CO 0.55 -0.32 -0.17 0.42 0.95 0.00 0.00 175.26 176.69 1npd s ILE 151 N -1.81 2.05 -0.56 1.83 -1.09 0.17 -4.44 121.20 117.34 1npd s ILE 151 Ca -0.09 -1.11 -0.13 0.00 -2.23 0.00 0.00 60.65 57.09 1npd s ILE 151 Cb -0.01 -1.95 0.14 0.00 -1.58 0.00 0.00 42.46 39.06 1npd s ILE 151 CO 0.03 0.38 0.49 -0.54 -1.23 0.00 0.00 174.94 174.07 1npd s LYS 152 N 1.25 2.91 -0.01 2.79 1.02 -1.26 -0.34 119.74 126.10 1npd s LYS 152 Ca 0.01 -1.86 -0.22 0.00 0.02 0.00 0.00 55.97 53.92 1npd s LYS 152 Cb -0.15 -4.19 -0.05 0.00 -0.52 0.00 0.00 37.83 32.92 1npd s LYS 152 CO -0.11 -1.28 0.66 -1.17 -0.92 0.00 0.00 175.35 172.53 1npd s LEU 153 N 1.27 4.40 -0.13 3.17 0.20 0.40 -1.74 118.68 126.25 1npd s LEU 153 Ca 0.06 1.24 0.01 0.00 0.69 0.00 0.00 54.13 56.13 1npd s LEU 153 Cb -0.26 -3.03 0.02 0.00 -0.43 0.00 0.00 46.19 42.48 1npd s LEU 153 CO 0.00 0.03 -0.17 -0.36 -0.29 0.00 0.00 176.35 175.57 1npd s PHE 154 N 0.06 2.24 -0.02 5.38 0.40 0.92 -0.46 117.98 126.50 1npd s PHE 154 Ca 0.34 -1.16 -0.05 0.00 -0.60 0.00 0.00 56.93 55.46 1npd s PHE 154 Cb -0.19 -1.60 0.01 0.00 0.51 0.00 0.00 43.02 41.75 1npd s PHE 154 CO 0.19 -0.59 0.11 1.21 0.70 0.00 0.00 175.22 176.84 1npd s ASN 155 N 1.14 -0.04 1.19 1.36 3.84 -1.07 -0.26 114.94 121.09 1npd s ASN 155 Ca -0.02 0.02 -0.14 0.00 0.21 0.00 0.00 52.86 52.93 1npd s ASN 155 Cb -0.14 0.22 0.21 0.00 -0.55 0.00 0.00 41.25 40.99 1npd s ASN 155 CO -0.05 -0.18 0.67 -2.11 -2.79 0.00 0.00 177.10 172.64 1npd n ARG 156 N 2.36 -2.72 -2.34 0.43 1.85 -1.26 -1.91 116.66 113.07 1npd n ARG 156 Ca -0.17 -1.08 -0.43 0.00 -1.00 0.00 0.00 57.85 55.17 1npd n ARG 156 Cb 0.58 -1.09 0.00 0.00 -1.05 0.00 0.00 32.46 30.90 1npd n ARG 156 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1npd n ARG 157 N -3.83 3.52 -1.36 2.89 5.12 -1.26 -4.36 116.66 117.39 1npd n ARG 157 Ca 0.10 -3.46 0.00 0.00 -1.93 0.00 0.00 57.85 52.55 1npd n ARG 157 Cb 0.38 -2.98 0.00 0.00 -1.16 0.00 0.00 32.46 28.70 1npd n ARG 157 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 1npd n ASP 158 N 4.31 1.16 0.28 0.55 5.68 -1.26 -5.00 116.55 122.26 1npd n ASP 158 Ca 0.41 -0.68 0.15 0.00 -0.50 0.00 0.00 54.79 54.17 1npd n ASP 158 Cb 0.37 0.00 0.81 0.00 -1.14 0.00 0.00 41.12 41.16 1npd n ASP 158 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1npd h GLU 159 N 0.00 0.00 0.00 0.11 9.09 -2.04 -2.00 114.58 119.74 1npd h GLU 159 Ca 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.40 1npd h GLU 159 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1npd h GLU 159 CO 0.00 0.08 -0.04 0.74 0.05 0.00 0.00 179.01 179.84 1npd h PHE 160 N 0.00 0.00 0.09 2.06 -1.00 -1.95 -3.23 116.94 112.91 1npd h PHE 160 Ca -0.00 0.00 0.02 0.00 2.81 0.00 0.00 57.97 60.80 1npd h PHE 160 Cb 0.29 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.82 1npd h PHE 160 CO 0.00 0.04 -0.26 0.35 -1.61 0.00 0.00 178.31 176.82 1npd h PHE 161 N 0.00 -0.70 -0.88 -0.55 3.57 -1.56 0.55 116.94 117.37 1npd h PHE 161 Ca -0.00 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.58 1npd h PHE 161 Cb 0.67 0.30 -0.06 0.00 2.79 0.00 0.00 35.95 39.66 1npd h PHE 161 CO 0.00 -0.36 0.57 -0.44 -2.23 0.00 0.00 178.31 175.85 1npd h ASP 162 N -0.46 0.88 -0.46 0.41 5.19 -1.74 0.94 116.42 121.19 1npd h ASP 162 Ca 0.04 0.00 0.02 0.00 -0.62 0.00 0.00 57.03 56.48 1npd h ASP 162 Cb 0.49 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 39.79 1npd h ASP 162 CO -0.17 0.57 0.26 0.11 -3.12 0.00 0.00 179.24 176.89 1npd h LYS 163 N 1.00 0.51 -0.54 3.56 1.79 -1.13 -0.77 116.57 120.98 1npd h LYS 163 Ca 0.37 -0.03 0.04 0.00 -2.18 0.00 0.00 60.65 58.86 1npd h LYS 163 Cb 0.18 -0.11 -0.04 0.00 -1.58 0.00 0.00 32.23 30.67 1npd h LYS 163 CO -0.13 0.33 0.29 0.00 -1.08 0.00 0.00 179.45 178.86 1npd h ALA 164 N 1.21 0.70 0.07 3.86 0.00 0.24 0.44 119.26 125.78 1npd h ALA 164 Ca 0.19 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1npd h ALA 164 Cb 0.04 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1npd h ALA 164 CO -0.10 -0.03 -0.13 -0.07 0.00 0.00 0.00 179.25 178.92 1npd h LEU 165 N 0.57 -0.36 -1.09 0.00 3.38 -0.35 0.82 115.31 118.27 1npd h LEU 165 Ca 0.24 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 1npd h LEU 165 Cb 0.12 0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 1npd h LEU 165 CO -0.15 -0.19 0.42 0.00 0.09 0.00 0.00 178.44 178.61 1npd h ALA 166 N 0.64 1.31 -0.52 1.53 0.00 -0.83 -2.35 119.26 119.04 1npd h ALA 166 Ca 0.02 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1npd h ALA 166 Cb 0.28 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1npd h ALA 166 CO -0.08 0.57 0.01 0.35 0.00 0.00 0.00 179.25 180.10 1npd h PHE 167 N 1.06 0.98 -0.51 0.00 3.57 -0.42 -2.39 116.94 119.23 1npd h PHE 167 Ca 0.27 -0.16 0.03 0.00 3.53 0.00 0.00 57.97 61.64 1npd h PHE 167 Cb 0.01 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 38.46 1npd h PHE 167 CO 0.01 0.90 0.29 0.00 -2.23 0.00 0.00 178.31 177.28 1npd h ALA 168 N 0.95 0.65 -0.04 2.41 0.00 -0.44 -2.43 119.26 120.36 1npd h ALA 168 Ca 0.15 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1npd h ALA 168 Cb 0.50 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1npd h ALA 168 CO 0.02 -0.03 0.02 0.37 0.00 0.00 0.00 179.25 179.64 1npd h GLN 169 N 0.57 0.06 -0.56 0.00 4.15 -1.28 -0.82 115.11 117.22 1npd h GLN 169 Ca 0.21 -0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.71 1npd h GLN 169 Cb 0.06 -0.01 -0.07 0.00 0.21 0.00 0.00 27.48 27.67 1npd h GLN 169 CO -0.11 0.09 0.18 0.00 -1.93 0.00 0.00 178.83 177.06 1npd h ARG 170 N 0.01 0.34 -0.11 1.69 3.08 -1.19 -1.85 114.38 116.35 1npd h ARG 170 Ca 0.01 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 1npd h ARG 170 Cb 0.05 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 1npd h ARG 170 CO -0.00 0.22 -0.02 0.28 -1.07 0.00 0.00 179.97 179.38 1npd h VAL 171 N 0.35 1.28 0.00 2.04 2.07 -1.27 -2.53 116.25 118.19 1npd h VAL 171 Ca 0.28 -0.90 0.00 0.00 0.82 0.00 0.00 66.70 66.90 1npd h VAL 171 Cb 0.35 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 1npd h VAL 171 CO -0.31 0.26 0.00 0.59 0.02 0.00 0.00 177.57 178.13 1npd n ASN 172 N -4.77 0.00 -0.17 0.57 3.02 -0.33 -0.25 115.26 113.33 1npd n ASN 172 Ca -0.06 0.40 0.05 0.00 -0.03 0.00 0.00 54.58 54.93 1npd n ASN 172 Cb 0.23 -0.42 -0.01 0.00 -0.61 0.00 0.00 39.78 38.96 1npd n ASN 172 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1npd n GLU 173 N -1.42 2.52 0.00 3.52 1.02 -0.73 -4.60 120.64 120.95 1npd n GLU 173 Ca 0.02 -0.46 0.00 0.00 -0.02 0.00 0.00 57.16 56.69 1npd n GLU 173 Cb 0.05 -1.04 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 1npd n GLU 173 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1npd n ASN 174 N -0.47 0.66 -4.15 1.62 4.13 -0.55 -5.08 115.26 111.42 1npd n ASN 174 Ca 0.03 -1.22 -0.11 0.00 1.68 0.00 0.00 54.58 54.97 1npd n ASN 174 Cb 0.19 0.00 -0.09 0.00 -1.54 0.00 0.00 39.78 38.34 1npd n ASN 174 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1npd s THR 175 N -0.22 0.01 -2.01 3.41 -4.23 0.66 -5.03 115.64 108.24 1npd s THR 175 Ca 0.00 -1.86 0.26 0.00 -1.18 0.00 0.00 61.69 58.91 1npd s THR 175 Cb 0.00 -2.37 0.30 0.00 1.34 0.00 0.00 72.50 71.77 1npd s THR 175 CO 0.00 -0.06 1.54 0.47 -0.54 0.00 0.00 174.62 176.03 1npd n ASP 176 N -0.27 1.34 -4.77 3.99 8.00 -1.26 -4.69 116.55 118.89 1npd n ASP 176 Ca 0.00 -1.15 -0.38 0.00 0.71 0.00 0.00 54.79 53.97 1npd n ASP 176 Cb 0.65 0.14 -0.06 0.00 -0.02 0.00 0.00 41.12 41.83 1npd n ASP 176 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1npd s VAL 178 N -1.43 3.40 0.09 0.00 -7.23 -1.14 -4.31 120.40 109.78 1npd s VAL 178 Ca 0.48 -0.49 0.03 0.00 -1.81 0.00 0.00 61.98 60.19 1npd s VAL 178 Cb -0.23 -2.54 -0.04 0.00 0.56 0.00 0.00 36.38 34.13 1npd s VAL 178 CO 0.29 0.43 0.07 -0.69 -0.31 0.00 0.00 175.10 174.89 1npd s VAL 179 N 1.37 4.43 -0.05 1.32 1.01 -1.25 0.42 120.40 127.66 1npd s VAL 179 Ca 0.05 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 1npd s VAL 179 Cb -0.14 -3.14 0.04 0.00 0.00 0.00 0.00 36.38 33.14 1npd s VAL 179 CO -0.02 0.11 0.10 0.42 0.00 0.00 0.00 175.10 175.71 1npd s THR 180 N -1.39 -0.09 -0.38 3.92 -4.23 0.54 -4.93 115.64 109.08 1npd s THR 180 Ca 0.29 0.24 -0.19 0.00 -1.18 0.00 0.00 61.69 60.85 1npd s THR 180 Cb -0.12 -0.19 0.01 0.00 1.34 0.00 0.00 72.50 73.54 1npd s THR 180 CO 0.21 0.10 0.58 -0.69 -0.54 0.00 0.00 174.62 174.28 1npd s VAL 181 N 1.40 4.93 -0.01 2.29 1.01 -1.26 -0.45 120.40 128.31 1npd s VAL 181 Ca -0.06 0.31 0.05 0.00 0.00 0.00 0.00 61.98 62.28 1npd s VAL 181 Cb -0.12 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 1npd s VAL 181 CO -0.05 -0.36 -0.16 -0.89 0.00 0.00 0.00 175.10 173.64 1npd s THR 182 N 2.59 2.90 0.02 3.92 2.01 0.39 -5.00 115.64 122.46 1npd s THR 182 Ca 0.21 -0.95 -0.30 0.00 0.31 0.00 0.00 61.69 60.96 1npd s THR 182 Cb -0.15 -2.17 -0.07 0.00 0.01 0.00 0.00 72.50 70.12 1npd s THR 182 CO 0.15 0.47 1.55 -0.62 -0.69 0.00 0.00 174.62 175.48 1npd s ASP 183 N -1.06 6.72 0.00 3.53 -1.08 -1.26 -2.61 116.67 120.91 1npd s ASP 183 Ca 0.13 2.28 0.00 0.00 -0.52 0.00 0.00 52.55 54.44 1npd s ASP 183 Cb -0.11 -2.56 0.00 0.00 -1.46 0.00 0.00 42.92 38.80 1npd s ASP 183 CO 0.03 -0.82 0.87 -0.11 0.52 0.00 0.00 175.17 175.66 1npd n LEU 184 N 5.78 0.00 0.09 -1.34 7.94 -0.80 -0.85 117.00 127.83 1npd n LEU 184 Ca 0.15 0.38 -0.02 0.00 -1.11 0.00 0.00 56.01 55.41 1npd n LEU 184 Cb 0.42 -0.38 -0.05 0.00 0.53 0.00 0.00 43.42 43.95 1npd n LEU 184 CO 0.61 -0.38 0.24 0.00 -1.11 0.00 0.00 177.39 176.75 1npd h ALA 185 N 1.94 0.55 -0.06 1.96 0.00 -1.88 -3.39 119.26 118.39 1npd h ALA 185 Ca 0.00 -0.71 -0.64 0.00 0.00 0.00 0.00 54.91 53.56 1npd h ALA 185 Cb 0.02 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 17.78 1npd h ALA 185 CO 0.00 0.94 2.36 -3.47 0.00 0.00 0.00 179.25 179.07 1npd n ASP 186 N -3.24 2.88 0.31 0.00 -0.08 -0.03 -4.70 116.55 111.69 1npd n ASP 186 Ca -0.01 -2.72 0.15 0.00 -1.51 0.00 0.00 54.79 50.71 1npd n ASP 186 Cb 0.84 -1.28 0.82 0.00 2.34 0.00 0.00 41.12 43.84 1npd n ASP 186 CO 0.00 0.00 0.00 -0.61 0.12 0.00 0.00 177.20 176.71 1npd h GLN 187 N 7.68 0.00 0.05 -0.67 5.75 -1.84 -1.73 115.11 124.35 1npd h GLN 187 Ca 0.43 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.93 1npd h GLN 187 Cb 0.69 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.24 1npd h GLN 187 CO 1.88 0.00 -0.02 1.96 -2.65 0.00 0.00 178.83 180.00 1npd h GLN 188 N 0.00 -0.06 0.00 1.69 7.50 -1.96 -3.24 115.11 119.03 1npd h GLN 188 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1npd h GLN 188 Cb 0.55 0.01 0.00 0.00 0.05 0.00 0.00 27.48 28.09 1npd h GLN 188 CO 0.00 0.53 0.00 0.00 -1.50 0.00 0.00 178.83 177.86 1npd h ALA 189 N -0.24 1.00 0.00 3.87 0.00 -1.73 -0.92 119.26 121.24 1npd h ALA 189 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 1npd h ALA 189 Cb 0.62 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1npd h ALA 189 CO 0.01 0.00 -0.57 0.35 0.00 0.00 0.00 179.25 179.04 1npd h PHE 190 N 0.00 0.00 0.07 0.00 3.57 -1.47 -3.14 116.94 115.96 1npd h PHE 190 Ca 0.00 0.00 -0.23 0.00 3.53 0.00 0.00 57.97 61.27 1npd h PHE 190 Cb 0.16 0.00 0.02 0.00 2.79 0.00 0.00 35.95 38.92 1npd h PHE 190 CO 0.00 0.57 -0.92 0.00 -2.23 0.00 0.00 178.31 175.73 1npd h ALA 191 N 1.43 0.02 0.00 2.41 0.00 -1.21 -1.20 119.26 120.70 1npd h ALA 191 Ca -0.01 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.22 1npd h ALA 191 Cb 1.27 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1npd h ALA 191 CO 0.07 0.51 0.12 0.93 0.00 0.00 0.00 179.25 180.89 1npd h GLU 192 N 0.04 0.00 0.00 0.00 5.08 -1.49 -0.47 114.58 117.74 1npd h GLU 192 Ca -0.14 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.18 1npd h GLU 192 Cb 1.64 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.88 1npd h GLU 192 CO 0.18 0.00 -0.88 0.00 -1.00 0.00 0.00 179.01 177.31 1npd n ALA 193 N -1.79 1.58 0.25 3.43 0.00 -1.19 -4.20 120.51 118.59 1npd n ALA 193 Ca -0.02 -0.59 0.10 0.00 0.00 0.00 0.00 53.44 52.94 1npd n ALA 193 Cb 0.16 0.12 0.56 0.00 0.00 0.00 0.00 19.45 20.28 1npd n ALA 193 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1npd h LEU 194 N -0.69 0.00 0.00 0.00 6.46 -1.09 -0.17 115.31 119.83 1npd h LEU 194 Ca -0.07 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.65 1npd h LEU 194 Cb 0.79 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.71 1npd h LEU 194 CO -0.04 0.00 -0.26 0.00 -0.62 0.00 0.00 178.44 177.52 1npd h ALA 195 N 1.20 0.05 -0.78 1.25 0.00 -1.31 -3.36 119.26 116.31 1npd h ALA 195 Ca 0.00 -0.57 -0.49 0.00 0.00 0.00 0.00 54.91 53.85 1npd h ALA 195 Cb 0.70 0.16 -0.23 0.00 0.00 0.00 0.00 17.79 18.42 1npd h ALA 195 CO 0.00 0.16 0.63 -1.13 0.00 0.00 0.00 179.25 178.90 1npd n SER 196 N -4.60 5.91 -4.72 0.00 3.41 -0.15 -4.95 113.62 108.52 1npd n SER 196 Ca -0.13 -3.41 -0.25 0.00 -0.26 0.00 0.00 58.87 54.82 1npd n SER 196 Cb 0.45 -0.92 -0.07 0.00 -0.26 0.00 0.00 64.21 63.41 1npd n SER 196 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1npd s ALA 197 N -2.85 3.35 -0.24 7.33 0.00 -0.72 -4.92 121.76 123.71 1npd s ALA 197 Ca 0.49 -1.36 -0.02 0.00 0.00 0.00 0.00 51.96 51.07 1npd s ALA 197 Cb 0.39 -1.11 -0.18 0.00 0.00 0.00 0.00 23.12 22.22 1npd s ALA 197 CO 0.03 0.44 -0.16 -0.25 0.00 0.00 0.00 175.76 175.81 1npd n ASP 198 N -0.40 1.99 -3.98 0.00 8.00 -0.92 -4.96 116.55 116.28 1npd n ASP 198 Ca -0.09 -0.02 -0.18 0.00 0.71 0.00 0.00 54.79 55.22 1npd n ASP 198 Cb 0.56 -0.54 -0.15 0.00 -0.02 0.00 0.00 41.12 40.97 1npd n ASP 198 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1npd s ILE 199 N -2.52 0.58 -0.25 0.53 2.07 -0.88 -2.12 121.20 118.61 1npd s ILE 199 Ca -0.34 -0.29 -0.01 0.00 -1.41 0.00 0.00 60.65 58.60 1npd s ILE 199 Cb 0.09 -0.50 0.03 0.00 0.13 0.00 0.00 42.46 42.21 1npd s ILE 199 CO 0.61 0.17 -0.07 -0.22 -1.91 0.00 0.00 174.94 173.52 1npd s LEU 200 N -0.02 3.17 -0.15 8.50 2.96 0.14 -0.93 118.68 132.36 1npd s LEU 200 Ca 0.01 -0.89 0.01 0.00 -0.22 0.00 0.00 54.13 53.04 1npd s LEU 200 Cb -0.05 -1.65 -0.00 0.00 0.50 0.00 0.00 46.19 44.99 1npd s LEU 200 CO -0.00 -0.13 -0.16 -0.89 -1.32 0.00 0.00 176.35 173.85 1npd s THR 201 N 1.32 2.58 -0.23 3.68 2.01 0.21 0.04 115.64 125.24 1npd s THR 201 Ca -0.00 -0.81 -0.08 0.00 0.31 0.00 0.00 61.69 61.12 1npd s THR 201 Cb -0.17 -2.07 -0.03 0.00 0.01 0.00 0.00 72.50 70.23 1npd s THR 201 CO -0.05 0.52 0.08 0.21 -0.69 0.00 0.00 174.62 174.70 1npd s ASN 202 N 0.76 5.36 -0.10 3.53 2.47 -0.17 0.26 114.94 127.04 1npd s ASN 202 Ca -0.07 -0.11 0.14 0.00 0.42 0.00 0.00 52.86 53.24 1npd s ASN 202 Cb -0.16 -1.95 0.25 0.00 -1.45 0.00 0.00 41.25 37.94 1npd s ASN 202 CO 0.01 0.02 1.13 0.61 -3.72 0.00 0.00 177.10 175.14 1npd n GLY 203 N 4.56 3.55 3.99 1.21 0.00 0.32 -1.63 105.19 117.19 1npd n GLY 203 Ca -0.16 -0.87 -0.20 0.00 0.00 0.00 0.00 46.02 44.79 1npd n GLY 203 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1npd s THR 204 N -2.00 2.65 -0.90 2.61 -4.23 -1.22 -4.42 115.64 108.11 1npd s THR 204 Ca 0.25 -0.80 0.27 0.00 -1.18 0.00 0.00 61.69 60.23 1npd s THR 204 Cb 0.24 -2.84 0.24 0.00 1.34 0.00 0.00 72.50 71.48 1npd s THR 204 CO -0.01 0.00 1.84 0.29 -0.54 0.00 0.00 174.62 176.20 1npd n LYS 205 N -2.23 0.08 -1.86 3.99 5.02 -1.26 -4.74 118.16 117.17 1npd n LYS 205 Ca 0.10 0.10 -0.42 0.00 -2.02 0.00 0.00 58.31 56.07 1npd n LYS 205 Cb 0.60 -1.60 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 1npd n LYS 205 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1npd s VAL 206 N -3.04 2.34 0.00 -0.18 1.01 -1.26 -4.72 120.40 114.55 1npd s VAL 206 Ca 0.12 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.36 1npd s VAL 206 Cb 0.16 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.37 1npd s VAL 206 CO 0.52 0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.26 1npd n GLY 207 N 3.18 1.99 3.88 4.51 0.00 -0.51 -4.93 105.19 113.32 1npd n GLY 207 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1npd n GLY 207 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1npd s LYS 209 N -0.44 3.63 -0.05 1.61 -2.85 -1.26 -4.17 119.74 116.22 1npd s LYS 209 Ca 0.00 -0.00 0.03 0.00 -1.00 0.00 0.00 55.97 55.00 1npd s LYS 209 Cb 0.00 -3.05 0.17 0.00 -2.06 0.00 0.00 37.83 32.89 1npd s LYS 209 CO 0.00 0.62 0.81 -0.35 0.10 0.00 0.00 175.35 176.53 1npd n PRO 210 N 1.04 1.80 -1.62 1.78 -0.04 -1.26 -4.87 135.00 131.82 1npd n PRO 210 Ca -0.10 -0.67 -0.31 0.00 -0.04 0.00 0.00 63.50 62.38 1npd n PRO 210 Cb 0.53 -1.61 0.06 0.00 -0.04 0.00 0.00 33.50 32.43 1npd n PRO 210 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1npd n LEU 211 N 0.12 6.69 0.00 1.53 4.77 -1.26 -4.86 117.00 123.98 1npd n LEU 211 Ca 0.06 -4.50 0.00 0.00 -0.03 0.00 0.00 56.01 51.54 1npd n LEU 211 Cb 0.42 -0.75 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 1npd n LEU 211 CO 0.07 1.72 0.37 -0.62 -1.33 0.00 0.00 177.39 177.60 1npd n GLU 212 N -0.82 0.00 -0.02 3.23 4.71 -1.26 -1.42 120.64 125.05 1npd n GLU 212 Ca 0.55 0.37 0.00 0.00 -0.01 0.00 0.00 57.16 58.07 1npd n GLU 212 Cb 0.74 -1.25 0.00 0.00 -1.01 0.00 0.00 31.44 29.92 1npd n GLU 212 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 1npd n ASN 213 N -1.42 0.98 -4.39 1.62 0.23 -1.26 -4.22 115.26 106.79 1npd n ASN 213 Ca 0.00 -0.72 -0.26 0.00 -0.53 0.00 0.00 54.58 53.07 1npd n ASN 213 Cb 0.00 -0.18 -0.12 0.00 -2.08 0.00 0.00 39.78 37.41 1npd n ASN 213 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1npd s GLU 214 N 0.83 1.43 -0.17 -3.83 2.12 -1.19 -5.03 118.70 112.87 1npd s GLU 214 Ca 0.00 -1.47 -0.19 0.00 0.36 0.00 0.00 54.97 53.67 1npd s GLU 214 Cb 0.00 -1.71 0.05 0.00 0.26 0.00 0.00 34.13 32.73 1npd s GLU 214 CO 0.00 0.37 0.53 0.45 -0.54 0.00 0.00 175.26 176.07 1npd s SER 215 N -2.59 -0.53 0.00 -1.70 0.15 -1.26 -3.84 113.70 103.93 1npd s SER 215 Ca 0.18 0.94 0.14 0.00 0.70 0.00 0.00 55.95 57.92 1npd s SER 215 Cb -0.08 0.96 0.85 0.00 -1.71 0.00 0.00 66.02 66.04 1npd s SER 215 CO 0.09 -0.26 1.45 0.18 1.20 0.00 0.00 173.24 175.89 1npd n LEU 216 N 2.44 0.00 -4.22 3.45 4.77 -1.26 -4.52 117.00 117.67 1npd n LEU 216 Ca -0.15 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.46 1npd n LEU 216 Cb 0.56 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.53 1npd n LEU 216 CO 0.12 0.00 -0.26 -0.69 -1.33 0.00 0.00 177.39 175.22 1npd s VAL 217 N -2.00 3.50 0.11 4.08 1.01 -1.26 -5.01 120.40 120.83 1npd s VAL 217 Ca 0.21 -1.36 -0.21 0.00 0.00 0.00 0.00 61.98 60.62 1npd s VAL 217 Cb 0.10 -3.06 -0.10 0.00 0.00 0.00 0.00 36.38 33.32 1npd s VAL 217 CO 0.16 -0.25 1.75 0.78 0.00 0.00 0.00 175.10 177.54 1npd h ASN 218 N 8.14 0.06 -4.08 3.32 4.21 -2.03 -3.45 115.58 121.75 1npd h ASN 218 Ca -0.21 0.01 -0.31 0.00 1.21 0.00 0.00 56.30 57.00 1npd h ASN 218 Cb 1.07 -0.00 -0.27 0.00 -1.12 0.00 0.00 38.32 38.00 1npd h ASN 218 CO 0.61 0.06 -0.75 1.51 -1.29 0.00 0.00 177.43 177.56 1npd s ASP 219 N -5.26 0.63 0.53 5.81 1.47 -1.26 -5.01 116.67 113.58 1npd s ASP 219 Ca -0.13 -0.19 0.34 0.00 1.18 0.00 0.00 52.55 53.75 1npd s ASP 219 Cb 0.08 -0.04 1.50 0.00 -0.34 0.00 0.00 42.92 44.12 1npd s ASP 219 CO 0.68 0.00 1.83 0.40 0.68 0.00 0.00 175.17 178.76 1npd h ILE 220 N 4.91 0.46 -0.34 2.11 2.04 -1.91 -2.63 117.51 122.15 1npd h ILE 220 Ca -0.29 -0.01 0.03 0.00 1.00 0.00 0.00 64.86 65.59 1npd h ILE 220 Cb 1.19 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 37.67 1npd h ILE 220 CO 0.48 0.00 -0.20 -1.20 0.00 0.00 0.00 178.15 177.24 1npd n SER 221 N -4.24 -0.36 0.28 1.72 7.64 -1.26 0.30 113.62 117.71 1npd n SER 221 Ca 0.23 1.17 0.06 0.00 1.01 0.00 0.00 58.87 61.34 1npd n SER 221 Cb 1.13 -0.36 0.32 0.00 -1.01 0.00 0.00 64.21 64.29 1npd n SER 221 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1npd h LEU 222 N 0.00 0.00 -8.76 -3.43 3.38 -1.86 -3.39 115.31 101.25 1npd h LEU 222 Ca 0.05 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 57.33 1npd h LEU 222 Cb 0.14 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 40.62 1npd h LEU 222 CO -0.32 0.00 -0.84 -0.76 0.09 0.00 0.00 178.44 176.61 1npd s LEU 223 N -4.88 2.36 0.25 1.67 1.02 0.15 -4.60 118.68 114.65 1npd s LEU 223 Ca -0.01 -0.38 0.01 0.00 0.02 0.00 0.00 54.13 53.76 1npd s LEU 223 Cb 0.03 -1.43 -0.05 0.00 0.02 0.00 0.00 46.19 44.77 1npd s LEU 223 CO 0.11 0.32 0.12 -1.38 0.02 0.00 0.00 176.35 175.53 1npd s HIS 224 N -0.71 1.46 0.96 0.29 -3.43 -1.26 -4.91 115.29 107.69 1npd s HIS 224 Ca 0.11 -1.26 -0.12 0.00 -0.80 0.00 0.00 55.06 52.99 1npd s HIS 224 Cb -0.10 -0.81 0.12 0.00 -1.43 0.00 0.00 32.58 30.36 1npd s HIS 224 CO 0.00 -0.44 0.83 -2.30 -2.00 0.00 0.00 174.74 170.83 1npd n PRO 225 N -0.44 -0.65 0.00 -0.38 -0.02 -1.07 -2.83 135.00 129.61 1npd n PRO 225 Ca 0.01 -0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 1npd n PRO 225 Cb 0.66 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 1npd n PRO 225 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1npd n GLY 226 N 0.83 1.78 3.74 -1.23 0.00 -1.15 -4.86 105.19 104.31 1npd n GLY 226 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1npd n GLY 226 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1npd n LEU 227 N 0.00 4.21 -4.64 0.99 7.94 -1.13 -4.63 117.00 119.74 1npd n LEU 227 Ca 0.00 1.15 -0.40 0.00 -1.11 0.00 0.00 56.01 55.66 1npd n LEU 227 Cb 0.00 -1.57 -0.07 0.00 0.53 0.00 0.00 43.42 42.31 1npd n LEU 227 CO 0.00 0.06 0.26 -0.22 -1.11 0.00 0.00 177.39 176.38 1npd s LEU 228 N -0.50 4.10 -0.27 -1.96 2.96 -0.90 -2.92 118.68 119.19 1npd s LEU 228 Ca 0.64 0.62 0.02 0.00 -0.22 0.00 0.00 54.13 55.18 1npd s LEU 228 Cb -0.52 -2.71 0.05 0.00 0.50 0.00 0.00 46.19 43.52 1npd s LEU 228 CO 0.50 -0.25 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.50 1npd s VAL 229 N 2.02 2.37 -0.19 1.68 1.01 -0.94 0.29 120.40 126.64 1npd s VAL 229 Ca 0.23 -1.53 -0.07 0.00 0.00 0.00 0.00 61.98 60.61 1npd s VAL 229 Cb -0.16 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 1npd s VAL 229 CO 0.09 -0.02 0.06 0.42 0.00 0.00 0.00 175.10 175.65 1npd s THR 230 N 1.15 4.68 -0.15 3.92 -4.23 0.11 -2.42 115.64 118.69 1npd s THR 230 Ca -0.07 -0.07 -0.01 0.00 -1.18 0.00 0.00 61.69 60.36 1npd s THR 230 Cb -0.20 -3.11 -0.01 0.00 1.34 0.00 0.00 72.50 70.52 1npd s THR 230 CO -0.04 0.45 -0.12 -0.70 -0.54 0.00 0.00 174.62 173.66 1npd s GLU 231 N 0.49 3.34 0.01 3.99 2.56 -1.07 -1.00 118.70 127.02 1npd s GLU 231 Ca 0.03 -0.69 -0.03 0.00 0.00 0.00 0.00 54.97 54.28 1npd s GLU 231 Cb -0.13 -2.69 -0.28 0.00 2.00 0.00 0.00 34.13 33.04 1npd s GLU 231 CO 0.01 0.11 0.90 0.00 -0.56 0.00 0.00 175.26 175.71 1npd s VAL 233 N -2.62 2.22 0.00 0.00 1.01 -1.26 -4.41 120.40 115.33 1npd s VAL 233 Ca -0.08 0.11 0.00 0.00 0.00 0.00 0.00 61.98 62.01 1npd s VAL 233 Cb 0.07 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.38 1npd s VAL 233 CO 0.86 0.01 0.00 0.00 0.00 0.00 0.00 175.10 175.96 1npd n TYR 234 N 4.22 0.00 0.00 5.22 0.18 -1.26 -3.78 117.16 121.73 1npd n TYR 234 Ca 0.16 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.94 1npd n TYR 234 Cb 0.36 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.32 1npd n TYR 234 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 1npd n ASN 235 N -0.98 0.00 -4.56 9.48 3.02 -1.26 -2.20 115.26 118.75 1npd n ASN 235 Ca 0.00 0.67 -0.38 0.00 -0.03 0.00 0.00 54.58 54.84 1npd n ASN 235 Cb 0.00 -0.17 -0.03 0.00 -0.61 0.00 0.00 39.78 38.96 1npd n ASN 235 CO 0.00 0.00 0.00 -2.84 -2.62 0.00 0.00 177.26 171.80 1npd s PRO 236 N -1.69 3.35 0.00 3.52 0.02 -1.26 -5.06 135.00 133.88 1npd s PRO 236 Ca 0.00 -0.87 0.00 0.00 0.02 0.00 0.00 61.00 60.15 1npd s PRO 236 Cb 0.00 -5.20 0.00 0.00 0.02 0.00 0.00 34.50 29.32 1npd s PRO 236 CO 0.00 -2.44 0.00 1.58 -0.33 0.00 0.00 177.00 175.81 1npd n HIS 237 N 9.96 0.00 -3.63 6.54 -0.00 -0.93 -4.91 115.22 122.24 1npd n HIS 237 Ca 0.32 0.00 -0.04 0.00 0.46 0.00 0.00 57.72 58.46 1npd n HIS 237 Cb 0.50 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 30.36 1npd n HIS 237 CO 0.00 0.00 0.00 0.95 0.46 0.00 0.00 176.34 177.75 1npd s THR 239 N 0.00 0.00 0.50 3.57 -4.23 -1.26 -4.85 115.64 109.38 1npd s THR 239 Ca 0.00 -0.31 0.32 0.00 -1.18 0.00 0.00 61.69 60.53 1npd s THR 239 Cb 0.00 -1.57 0.35 0.00 1.34 0.00 0.00 72.50 72.63 1npd s THR 239 CO 0.00 0.00 2.19 0.50 -0.54 0.00 0.00 174.62 176.77 1npd h LYS 240 N 2.00 0.00 -0.29 3.99 3.64 -1.78 0.34 116.57 124.47 1npd h LYS 240 Ca -0.23 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.02 1npd h LYS 240 Cb 1.22 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 1npd h LYS 240 CO 0.27 0.05 -0.36 -0.07 -2.27 0.00 0.00 179.45 177.07 1npd h LEU 241 N 0.00 0.67 -0.20 5.20 3.38 -1.92 -2.42 115.31 120.02 1npd h LEU 241 Ca -0.00 -0.28 -0.11 0.00 0.09 0.00 0.00 57.88 57.57 1npd h LEU 241 Cb 0.17 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1npd h LEU 241 CO 0.01 0.97 -0.31 0.25 0.09 0.00 0.00 178.44 179.44 1npd h LEU 242 N 0.54 0.63 -0.13 1.67 7.12 -1.36 0.34 115.31 124.12 1npd h LEU 242 Ca 0.05 -0.52 0.03 0.00 0.13 0.00 0.00 57.88 57.57 1npd h LEU 242 Cb 0.86 -0.18 -0.06 0.00 -0.53 0.00 0.00 40.66 40.75 1npd h LEU 242 CO 0.07 1.03 -0.54 1.56 -0.13 0.00 0.00 178.44 180.44 1npd h GLN 243 N 0.24 -0.56 -0.84 1.25 4.20 -1.21 1.54 115.11 119.74 1npd h GLN 243 Ca 0.02 0.04 0.07 0.00 0.06 0.00 0.00 58.65 58.83 1npd h GLN 243 Cb 0.89 0.13 -0.05 0.00 0.30 0.00 0.00 27.48 28.75 1npd h GLN 243 CO 0.07 -0.37 0.55 0.37 -0.67 0.00 0.00 178.83 178.78 1npd h GLN 244 N -0.58 0.89 0.00 1.46 -0.00 -1.44 -1.90 115.11 113.54 1npd h GLN 244 Ca 0.03 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 58.63 1npd h GLN 244 Cb 0.67 -0.20 0.00 0.00 0.00 0.00 0.00 27.48 27.95 1npd h GLN 244 CO -0.43 0.59 0.00 0.00 0.00 0.00 0.00 178.83 178.99 1npd n ALA 245 N -2.42 -0.36 0.45 3.38 0.00 0.85 -0.32 120.51 122.09 1npd n ALA 245 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1npd n ALA 245 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.67 1npd n ALA 245 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1npd n GLN 246 N -1.68 0.28 -0.00 0.00 6.02 0.49 -0.69 117.38 121.79 1npd n GLN 246 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1npd n GLN 246 Cb 0.00 -1.05 -0.01 0.00 1.02 0.00 0.00 30.24 30.20 1npd n GLN 246 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 177.06 176.99 1npd n GLN 247 N -0.16 2.72 0.00 -1.09 7.27 -0.72 -4.54 117.38 120.85 1npd n GLN 247 Ca 0.00 -0.00 0.13 0.00 0.07 0.00 0.00 57.00 57.20 1npd n GLN 247 Cb 0.03 -1.03 0.31 0.00 2.41 0.00 0.00 30.24 31.96 1npd n GLN 247 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1npd n ALA 248 N -1.89 2.56 -2.10 1.69 0.00 0.56 -4.96 120.51 116.37 1npd n ALA 248 Ca -0.01 -0.56 -0.08 0.00 0.00 0.00 0.00 53.44 52.79 1npd n ALA 248 Cb 0.39 -0.99 -0.00 0.00 0.00 0.00 0.00 19.45 18.84 1npd n ALA 248 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1npd n GLY 249 N 1.27 0.10 3.66 0.00 0.00 -0.54 -2.61 105.19 107.06 1npd n GLY 249 Ca 0.16 -0.57 -0.36 0.00 0.00 0.00 0.00 46.02 45.25 1npd n GLY 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npd s LYS 251 N 1.00 3.65 0.21 0.00 2.36 -1.15 -4.35 119.74 121.47 1npd s LYS 251 Ca 0.07 2.08 0.01 0.00 -2.55 0.00 0.00 55.97 55.58 1npd s LYS 251 Cb -0.13 -2.50 -0.05 0.00 -1.05 0.00 0.00 37.83 34.10 1npd s LYS 251 CO 0.04 -0.73 0.07 0.95 1.55 0.00 0.00 175.35 177.23 1npd s THR 252 N -1.36 0.46 -0.37 3.43 -4.23 -1.26 -2.22 115.64 110.10 1npd s THR 252 Ca 0.63 -1.99 0.01 0.00 -1.18 0.00 0.00 61.69 59.16 1npd s THR 252 Cb -0.36 -2.41 0.12 0.00 1.34 0.00 0.00 72.50 71.19 1npd s THR 252 CO 0.45 -0.18 0.17 -0.63 -0.54 0.00 0.00 174.62 173.88 1npd s ILE 253 N -3.82 1.03 1.27 2.99 1.01 -1.02 -4.97 121.20 117.70 1npd s ILE 253 Ca 0.33 -1.93 -0.18 0.00 0.00 0.00 0.00 60.65 58.87 1npd s ILE 253 Cb 0.07 -1.75 0.29 0.00 0.01 0.00 0.00 42.46 41.07 1npd s ILE 253 CO 0.09 -0.80 0.71 -0.90 0.00 0.00 0.00 174.94 174.04 1npd n ASP 254 N 4.21 -2.94 0.26 3.58 3.85 -1.26 -2.61 116.55 121.65 1npd n ASP 254 Ca 0.04 -0.46 0.15 0.00 -0.71 0.00 0.00 54.79 53.81 1npd n ASP 254 Cb 0.38 -1.05 0.64 0.00 -1.35 0.00 0.00 41.12 39.74 1npd n ASP 254 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 1npd h GLY 255 N -2.97 0.00 1.02 6.12 0.00 -1.53 -3.07 103.07 102.64 1npd h GLY 255 Ca -0.49 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.79 1npd h GLY 255 CO 0.35 0.00 0.19 -0.97 0.00 0.00 0.00 176.54 176.11 1npd h TYR 256 N 0.00 1.01 0.00 5.60 0.99 -1.88 0.13 116.97 122.82 1npd h TYR 256 Ca -0.00 -0.10 0.00 0.00 2.00 0.00 0.00 58.73 60.63 1npd h TYR 256 Cb 0.55 -0.29 0.00 0.00 1.00 0.00 0.00 36.73 37.99 1npd h TYR 256 CO 0.00 0.83 0.00 0.41 -0.00 0.00 0.00 178.16 179.40 1npd n GLY 257 N -0.71 0.45 2.14 3.88 0.00 -1.16 -1.29 105.19 108.50 1npd n GLY 257 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1npd n GLY 257 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1npd n LEU 259 N 0.43 0.00 -0.11 0.99 7.94 0.03 -1.67 117.00 124.61 1npd n LEU 259 Ca 0.00 0.00 -0.09 0.00 -1.11 0.00 0.00 56.01 54.81 1npd n LEU 259 Cb 0.08 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.02 1npd n LEU 259 CO 0.00 0.00 0.95 -0.07 -1.11 0.00 0.00 177.39 177.16 1npd h LEU 260 N 0.00 0.45 -0.31 -1.96 3.38 -1.44 -0.85 115.31 114.57 1npd h LEU 260 Ca 0.00 -0.11 -0.19 0.00 0.09 0.00 0.00 57.88 57.67 1npd h LEU 260 Cb 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.64 1npd h LEU 260 CO 0.00 0.43 -0.64 -0.50 0.09 0.00 0.00 178.44 177.82 1npd h TRP 261 N 0.43 0.96 -0.37 1.13 4.06 -1.58 0.14 115.95 120.72 1npd h TRP 261 Ca 0.12 -0.37 -0.05 0.00 2.06 0.00 0.00 58.89 60.65 1npd h TRP 261 Cb 0.09 -0.17 -0.02 0.00 -1.00 0.00 0.00 29.16 28.07 1npd h TRP 261 CO -0.02 1.18 0.02 -0.56 -3.56 0.00 0.00 178.44 175.50 1npd h GLN 262 N 0.54 0.57 -0.09 0.49 -0.00 -1.75 -1.71 115.11 113.16 1npd h GLN 262 Ca -0.01 -0.12 -0.22 0.00 -0.00 0.00 0.00 58.65 58.30 1npd h GLN 262 Cb 1.24 -0.08 0.01 0.00 -0.00 0.00 0.00 27.48 28.64 1npd h GLN 262 CO 0.13 0.58 -0.83 0.78 -0.00 0.00 0.00 178.83 179.48 1npd h GLY 263 N 0.85 0.69 0.51 0.06 0.00 -0.95 -3.01 103.07 101.21 1npd h GLY 263 Ca 0.12 -1.04 0.06 0.00 0.00 0.00 0.00 47.33 46.47 1npd h GLY 263 CO 0.01 0.92 0.02 0.00 0.00 0.00 0.00 176.54 177.49 1npd h ALA 264 N 0.66 0.32 -0.11 3.60 0.00 -0.17 -0.67 119.26 122.90 1npd h ALA 264 Ca -0.06 0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1npd h ALA 264 Cb 1.45 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.35 1npd h ALA 264 CO 0.16 -0.38 -0.06 1.49 0.00 0.00 0.00 179.25 180.46 1npd h GLU 265 N 0.12 -0.04 -0.48 0.00 4.57 -1.37 -0.54 114.58 116.84 1npd h GLU 265 Ca 0.16 0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.37 1npd h GLU 265 Cb 0.21 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.77 1npd h GLU 265 CO -0.25 -0.03 0.27 1.96 -1.18 0.00 0.00 179.01 179.78 1npd h GLN 266 N -0.05 0.53 -0.18 1.92 4.20 -1.32 -0.06 115.11 120.14 1npd h GLN 266 Ca 0.06 -0.03 0.05 0.00 0.06 0.00 0.00 58.65 58.80 1npd h GLN 266 Cb 0.14 -0.12 -0.06 0.00 0.30 0.00 0.00 27.48 27.74 1npd h GLN 266 CO -0.15 0.35 -0.24 0.35 -0.67 0.00 0.00 178.83 178.47 1npd h PHE 267 N 0.55 -0.65 -0.70 2.96 3.57 -0.69 -0.75 116.94 121.22 1npd h PHE 267 Ca 0.20 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.66 1npd h PHE 267 Cb 0.05 0.32 -0.03 0.00 2.79 0.00 0.00 35.95 39.07 1npd h PHE 267 CO -0.08 -0.32 0.17 1.15 -2.23 0.00 0.00 178.31 177.00 1npd h THR 268 N -0.28 1.26 -0.84 4.41 2.02 -0.84 0.35 112.91 118.99 1npd h THR 268 Ca 0.12 -0.97 0.04 0.00 0.77 0.00 0.00 66.41 66.36 1npd h THR 268 Cb 0.46 0.56 -0.05 0.00 -1.74 0.00 0.00 68.15 67.38 1npd h THR 268 CO -0.35 0.37 0.55 -0.07 0.37 0.00 0.00 175.52 176.40 1npd h LEU 269 N 1.05 0.89 0.12 2.58 3.38 -0.28 0.56 115.31 123.61 1npd h LEU 269 Ca 0.22 -0.01 -0.19 0.00 0.09 0.00 0.00 57.88 57.99 1npd h LEU 269 Cb 0.38 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.94 1npd h LEU 269 CO 0.00 0.61 -0.88 -0.50 0.09 0.00 0.00 178.44 177.76 1npd h TRP 270 N 1.03 0.46 0.00 1.13 6.55 -0.74 -3.39 115.95 120.99 1npd h TRP 270 Ca 0.33 -0.34 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1npd h TRP 270 Cb 0.04 -0.02 0.00 0.00 -0.86 0.00 0.00 29.16 28.32 1npd h TRP 270 CO -0.00 1.34 -1.85 0.25 -1.05 0.00 0.00 178.44 177.13 1npd n THR 271 N -4.14 0.00 -0.99 1.49 -2.24 0.08 -4.96 114.28 103.53 1npd n THR 271 Ca -0.16 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.19 1npd n THR 271 Cb 0.80 0.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 1npd n THR 271 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1npd n GLY 272 N 1.31 0.95 4.00 3.38 0.00 0.19 -5.01 105.19 110.03 1npd n GLY 272 Ca -0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.82 1npd n GLY 272 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1npd s LYS 273 N -0.03 2.91 0.31 1.61 3.01 -1.26 -4.99 119.74 121.30 1npd s LYS 273 Ca 0.00 -1.18 -0.27 0.00 -1.01 0.00 0.00 55.97 53.51 1npd s LYS 273 Cb 0.00 -2.77 -0.10 0.00 -1.01 0.00 0.00 37.83 33.95 1npd s LYS 273 CO 0.00 -0.18 0.97 -0.51 0.51 0.00 0.00 175.35 176.14 1npd s ASP 274 N -4.30 7.33 -0.17 2.83 1.01 -1.26 -3.91 116.67 118.20 1npd s ASP 274 Ca 0.52 1.92 -0.25 0.00 0.71 0.00 0.00 52.55 55.45 1npd s ASP 274 Cb -0.10 -2.59 -0.02 0.00 1.01 0.00 0.00 42.92 41.22 1npd s ASP 274 CO 0.32 -0.07 0.80 0.12 0.21 0.00 0.00 175.17 176.55 1npd s PHE 275 N -1.49 3.42 -0.99 4.23 5.36 -1.26 -4.93 117.98 122.31 1npd s PHE 275 Ca 0.49 1.22 -0.08 0.00 -0.96 0.00 0.00 56.93 57.60 1npd s PHE 275 Cb -0.22 -2.98 -0.06 0.00 -0.34 0.00 0.00 43.02 39.42 1npd s PHE 275 CO 0.27 -0.22 2.19 -0.35 -1.46 0.00 0.00 175.22 175.65 1npd n PRO 276 N 5.15 2.23 -0.33 10.12 -0.04 -1.26 -4.70 135.00 146.17 1npd n PRO 276 Ca 0.04 -1.60 0.11 0.00 -0.04 0.00 0.00 63.50 62.00 1npd n PRO 276 Cb 0.49 -2.55 0.29 0.00 -0.04 0.00 0.00 33.50 31.68 1npd n PRO 276 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1npd h LEU 277 N 8.75 0.63 -0.22 1.53 6.46 -1.96 -0.30 115.31 130.21 1npd h LEU 277 Ca 0.53 0.10 -0.06 0.00 -0.12 0.00 0.00 57.88 58.34 1npd h LEU 277 Cb 0.23 -0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.16 1npd h LEU 277 CO 1.54 0.22 -0.09 -0.08 -0.62 0.00 0.00 178.44 179.41 1npd h GLU 278 N 0.67 0.45 0.28 1.25 4.57 -2.00 -0.52 114.58 119.28 1npd h GLU 278 Ca 0.54 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 58.53 1npd h GLU 278 Cb 0.84 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.39 1npd h GLU 278 CO -0.40 0.72 -0.27 -0.92 -1.18 0.00 0.00 179.01 176.96 1npd h TYR 279 N 0.16 -0.73 -0.32 0.92 3.20 -1.76 -2.39 116.97 116.06 1npd h TYR 279 Ca 0.05 0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.98 1npd h TYR 279 Cb 0.58 0.28 -0.05 0.00 1.54 0.00 0.00 36.73 39.08 1npd h TYR 279 CO 0.06 -0.40 0.01 0.28 -1.64 0.00 0.00 178.16 176.48 1npd h VAL 280 N -0.58 0.78 -0.56 1.81 2.07 -1.03 -1.31 116.25 117.43 1npd h VAL 280 Ca -0.01 -0.04 0.11 0.00 0.82 0.00 0.00 66.70 67.59 1npd h VAL 280 Cb 0.53 0.67 -0.11 0.00 -1.52 0.00 0.00 31.29 30.86 1npd h VAL 280 CO -0.05 0.02 -0.14 0.50 0.02 0.00 0.00 177.57 177.92 1npd h LYS 281 N 0.11 0.00 -0.17 1.57 3.64 -0.89 -2.42 116.57 118.41 1npd h LYS 281 Ca 0.15 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.50 1npd h LYS 281 Cb 0.20 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 1npd h LYS 281 CO -0.24 0.00 -0.01 1.96 -2.27 0.00 0.00 179.45 178.89 1npd h GLN 282 N 0.00 0.30 -1.85 1.90 4.20 -0.95 0.10 115.11 118.81 1npd h GLN 282 Ca 0.27 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.88 1npd h GLN 282 Cb 0.41 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.17 1npd h GLN 282 CO -0.58 0.52 0.00 0.28 -0.67 0.00 0.00 178.83 178.39 1npd n VAL 283 N -4.73 0.19 -1.87 -0.54 0.31 -0.54 -4.54 118.33 106.61 1npd n VAL 283 Ca -0.05 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 1npd n VAL 283 Cb 0.23 -0.63 0.00 0.00 -0.91 0.00 0.00 33.84 32.52 1npd n VAL 283 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1npd n GLY 285 N 1.01 0.50 0.11 2.92 0.00 -0.86 -5.10 105.19 103.78 1npd n GLY 285 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 1npd n GLY 285 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1npd n PHE 286 N 0.00 0.48 1.10 1.61 0.99 0.30 -5.13 117.46 116.81 1npd n PHE 286 Ca 0.00 0.25 0.09 0.00 -0.00 0.00 0.00 57.45 57.79 1npd n PHE 286 Cb 0.50 -0.87 0.52 0.00 -1.00 0.00 0.00 39.48 38.63 1npd n PHE 286 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17