#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nsj s ALA 8 N 0.00 3.47 -2.04 0.55 0.00 -1.26 -4.79 121.76 117.69 2nsj s ALA 8 Ca 0.00 0.49 0.24 0.00 0.00 0.00 0.00 51.96 52.69 2nsj s ALA 8 Cb 0.00 -3.75 0.29 0.00 0.00 0.00 0.00 23.12 19.66 2nsj s ALA 8 CO 0.00 -1.59 1.28 0.54 0.00 0.00 0.00 175.76 175.99 2nsj n ARG 9 N 7.19 1.19 -4.13 0.00 3.00 -1.25 -4.29 116.66 118.37 2nsj n ARG 9 Ca 0.16 -0.91 -0.17 0.00 -0.01 0.00 0.00 57.85 56.92 2nsj n ARG 9 Cb 0.45 -1.48 -0.15 0.00 0.00 0.00 0.00 32.46 31.27 2nsj n ARG 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2nsj s VAL 10 N -2.43 0.42 -0.09 1.55 0.11 -1.26 0.35 120.40 119.05 2nsj s VAL 10 Ca 0.22 -0.14 0.01 0.00 -2.93 0.00 0.00 61.98 59.14 2nsj s VAL 10 Cb 0.19 -0.42 -0.02 0.00 -1.53 0.00 0.00 36.38 34.60 2nsj s VAL 10 CO 0.53 0.16 -0.12 0.00 -3.33 0.00 0.00 175.10 172.34 2nsj s ALA 11 N 0.41 2.72 -0.32 1.54 0.00 -0.82 -2.24 121.76 123.06 2nsj s ALA 11 Ca -0.05 -0.92 -0.03 0.00 0.00 0.00 0.00 51.96 50.96 2nsj s ALA 11 Cb -0.08 -1.15 0.05 0.00 0.00 0.00 0.00 23.12 21.94 2nsj s ALA 11 CO -0.00 0.42 0.04 0.42 0.00 0.00 0.00 175.76 176.63 2nsj s ILE 12 N -0.25 3.22 0.30 0.00 1.01 0.11 -0.01 121.20 125.57 2nsj s ILE 12 Ca 0.02 -1.35 0.10 0.00 0.00 0.00 0.00 60.65 59.42 2nsj s ILE 12 Cb -0.13 -2.86 -0.05 0.00 0.01 0.00 0.00 42.46 39.43 2nsj s ILE 12 CO 0.03 -0.15 -0.07 0.68 0.00 0.00 0.00 174.94 175.42 2nsj s VAL 13 N 1.29 2.76 0.03 2.92 -7.23 0.27 -1.62 120.40 118.81 2nsj s VAL 13 Ca -0.04 -2.13 -0.21 0.00 -1.81 0.00 0.00 61.98 57.80 2nsj s VAL 13 Cb -0.20 -2.63 0.05 0.00 0.56 0.00 0.00 36.38 34.16 2nsj s VAL 13 CO -0.00 -0.31 0.48 0.00 -0.31 0.00 0.00 175.10 174.95 2nsj s MET 14 N -3.63 0.96 0.32 4.82 0.23 -1.03 -1.36 119.30 119.62 2nsj s MET 14 Ca 0.32 -0.22 0.26 0.00 -1.03 0.00 0.00 55.69 55.02 2nsj s MET 14 Cb -0.03 0.44 0.99 0.00 -1.53 0.00 0.00 34.83 34.69 2nsj s MET 14 CO 0.18 -0.33 1.77 0.78 -2.03 0.00 0.00 175.02 175.39 2nsj h GLY 15 N 3.00 0.00 -4.08 3.16 0.00 -1.38 0.20 103.07 103.97 2nsj h GLY 15 Ca -0.30 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.98 2nsj h GLY 15 CO 0.42 0.00 0.22 -0.45 0.00 0.00 0.00 176.54 176.73 2nsj s SER 16 N -4.71 -0.64 0.27 0.19 0.15 -1.26 -4.45 113.70 103.24 2nsj s SER 16 Ca 0.05 0.72 0.21 0.00 0.70 0.00 0.00 55.95 57.62 2nsj s SER 16 Cb 0.10 0.55 1.01 0.00 -1.71 0.00 0.00 66.02 65.97 2nsj s SER 16 CO 0.48 -0.57 1.64 2.29 1.20 0.00 0.00 173.24 178.28 2nsj n LYS 17 N 0.96 0.15 0.09 5.44 2.85 -1.26 -0.10 118.16 126.28 2nsj n LYS 17 Ca -0.18 0.53 0.11 0.00 -1.05 0.00 0.00 58.31 57.72 2nsj n LYS 17 Cb 0.57 -1.89 0.45 0.00 -0.65 0.00 0.00 35.03 33.51 2nsj n LYS 17 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2nsj n SER 18 N -2.19 0.51 0.09 -5.58 3.41 -1.26 -1.94 113.62 106.66 2nsj n SER 18 Ca 0.00 0.61 0.13 0.00 -0.26 0.00 0.00 58.87 59.35 2nsj n SER 18 Cb 0.11 -0.72 0.34 0.00 -0.26 0.00 0.00 64.21 63.68 2nsj n SER 18 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2nsj n ASP 19 N -2.04 0.76 0.13 4.04 8.00 0.86 -3.95 116.55 124.35 2nsj n ASP 19 Ca 0.03 0.43 0.06 0.00 0.71 0.00 0.00 54.79 56.02 2nsj n ASP 19 Cb 0.26 -0.50 0.53 0.00 -0.02 0.00 0.00 41.12 41.38 2nsj n ASP 19 CO 0.00 0.00 0.00 -0.25 -0.39 0.00 0.00 177.20 176.56 2nsj h TRP 20 N 0.00 0.25 -0.05 1.24 2.91 -1.50 0.06 115.95 118.86 2nsj h TRP 20 Ca 0.00 0.00 0.01 0.00 1.13 0.00 0.00 58.89 60.04 2nsj h TRP 20 Cb 0.73 -0.08 -0.00 0.00 -0.51 0.00 0.00 29.16 29.30 2nsj h TRP 20 CO 0.00 0.17 0.06 0.00 -1.03 0.00 0.00 178.44 177.64 2nsj h ALA 21 N 1.86 1.53 0.00 2.65 0.00 -1.78 -0.93 119.26 122.60 2nsj h ALA 21 Ca 0.07 -0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.75 2nsj h ALA 21 Cb -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2nsj h ALA 21 CO -0.01 -0.09 -1.60 2.41 0.00 0.00 0.00 179.25 179.96 2nsj n THR 22 N -3.72 1.51 0.25 0.00 -1.04 -0.46 -4.51 114.28 106.31 2nsj n THR 22 Ca -0.02 -0.09 0.13 0.00 -2.04 0.00 0.00 64.05 62.03 2nsj n THR 22 Cb 0.15 -2.11 0.65 0.00 -1.82 0.00 0.00 70.33 67.21 2nsj n THR 22 CO 0.00 0.00 0.00 0.24 -0.64 0.00 0.00 175.07 174.67 2nsj h MET 23 N -1.00 0.00 0.00 -2.82 2.86 -0.93 -2.51 114.93 110.52 2nsj h MET 23 Ca -0.35 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.28 2nsj h MET 23 Cb 1.24 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.89 2nsj h MET 23 CO -0.21 0.00 -0.06 -0.56 1.06 0.00 0.00 176.91 177.14 2nsj h GLN 24 N 0.00 0.00 0.00 1.72 3.07 -1.40 -1.32 115.11 117.19 2nsj h GLN 24 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.69 2nsj h GLN 24 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.67 2nsj h GLN 24 CO 0.00 0.06 -0.23 0.74 0.09 0.00 0.00 178.83 179.49 2nsj h PHE 25 N 0.00 0.00 -0.07 0.06 -1.00 -1.72 -0.38 116.94 113.83 2nsj h PHE 25 Ca -0.00 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.71 2nsj h PHE 25 Cb 0.16 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.72 2nsj h PHE 25 CO 0.00 0.23 -0.22 0.00 -1.61 0.00 0.00 178.31 176.70 2nsj h ALA 26 N 1.77 0.12 -0.87 2.45 0.00 -1.34 -3.09 119.26 118.29 2nsj h ALA 26 Ca -0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2nsj h ALA 26 Cb 0.80 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 2nsj h ALA 26 CO 0.03 0.10 0.51 0.00 0.00 0.00 0.00 179.25 179.88 2nsj h ALA 27 N 0.44 1.25 -0.65 0.00 0.00 -1.42 -2.01 119.26 116.87 2nsj h ALA 27 Ca -0.01 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 54.86 2nsj h ALA 27 Cb 0.85 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 2nsj h ALA 27 CO 0.05 0.63 0.43 1.49 0.00 0.00 0.00 179.25 181.85 2nsj h GLU 28 N 1.21 0.62 -0.41 0.00 4.81 -1.06 -0.74 114.58 119.00 2nsj h GLU 28 Ca 0.31 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.42 2nsj h GLU 28 Cb -0.02 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 2nsj h GLU 28 CO -0.05 0.41 -0.07 0.82 -0.73 0.00 0.00 179.01 179.38 2nsj h ILE 29 N 0.63 1.27 -0.09 2.32 1.08 -1.28 -1.94 117.51 119.49 2nsj h ILE 29 Ca 0.28 -1.14 -0.06 0.00 -0.39 0.00 0.00 64.86 63.55 2nsj h ILE 29 Cb 0.30 1.18 -0.01 0.00 -3.07 0.00 0.00 36.82 35.22 2nsj h ILE 29 CO -0.09 0.39 -0.21 -0.26 -0.69 0.00 0.00 178.15 177.28 2nsj h PHE 30 N 0.59 0.16 -0.16 1.37 0.05 -1.11 -0.38 116.94 117.46 2nsj h PHE 30 Ca 0.11 -0.02 -0.08 0.00 3.82 0.00 0.00 57.97 61.79 2nsj h PHE 30 Cb 0.58 -0.04 -0.00 0.00 2.00 0.00 0.00 35.95 38.49 2nsj h PHE 30 CO 0.05 0.37 -0.22 0.93 -0.18 0.00 0.00 178.31 179.25 2nsj h GLU 31 N 0.14 0.43 -0.76 1.51 5.08 -0.95 0.15 114.58 120.18 2nsj h GLU 31 Ca 0.03 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.11 2nsj h GLU 31 Cb 0.47 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 2nsj h GLU 31 CO 0.03 0.84 0.36 0.82 -1.00 0.00 0.00 179.01 180.06 2nsj h ILE 32 N 0.06 1.24 -0.04 3.13 2.04 -1.08 -2.50 117.51 120.35 2nsj h ILE 32 Ca 0.02 -0.68 0.00 0.00 1.00 0.00 0.00 64.86 65.20 2nsj h ILE 32 Cb 0.79 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 2nsj h ILE 32 CO 0.05 0.29 0.00 0.18 0.00 0.00 0.00 178.15 178.67 2nsj n LEU 33 N -4.32 1.54 -3.58 1.44 4.77 -0.18 -4.97 117.00 111.70 2nsj n LEU 33 Ca 0.07 -0.54 -0.24 0.00 -0.03 0.00 0.00 56.01 55.27 2nsj n LEU 33 Cb 0.14 -0.02 0.03 0.00 -2.33 0.00 0.00 43.42 41.24 2nsj n LEU 33 CO 0.39 0.27 -0.02 -3.20 -1.33 0.00 0.00 177.39 173.50 2nsj n ASN 34 N 0.21 -5.74 -4.10 -1.43 5.15 0.25 -4.99 115.26 104.61 2nsj n ASN 34 Ca 0.19 -0.83 -0.32 0.00 -0.60 0.00 0.00 54.58 53.01 2nsj n ASN 34 Cb 0.35 -3.45 -0.16 0.00 -0.53 0.00 0.00 39.78 35.99 2nsj n ASN 34 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2nsj s VAL 35 N -3.29 1.98 0.43 3.44 1.01 0.26 -5.03 120.40 119.20 2nsj s VAL 35 Ca 0.30 -0.96 -0.26 0.00 0.00 0.00 0.00 61.98 61.06 2nsj s VAL 35 Cb -0.11 -1.84 -0.09 0.00 0.00 0.00 0.00 36.38 34.35 2nsj s VAL 35 CO 0.85 0.46 1.43 -2.65 0.00 0.00 0.00 175.10 175.18 2nsj n PRO 36 N 4.63 2.31 -3.65 2.72 -0.02 -1.26 -4.67 135.00 135.05 2nsj n PRO 36 Ca -0.20 0.82 -0.15 0.00 -2.02 0.00 0.00 63.50 61.95 2nsj n PRO 36 Cb 0.49 -2.61 -0.07 0.00 -0.02 0.00 0.00 33.50 31.29 2nsj n PRO 36 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2nsj s HIS 37 N -1.18 -0.39 -0.11 6.00 -3.43 -1.26 -3.94 115.29 110.98 2nsj s HIS 37 Ca 0.59 0.60 -0.02 0.00 -0.80 0.00 0.00 55.06 55.43 2nsj s HIS 37 Cb -0.46 0.25 -0.03 0.00 -1.43 0.00 0.00 32.58 30.90 2nsj s HIS 37 CO 0.59 -0.51 -0.02 -1.58 -2.00 0.00 0.00 174.74 171.22 2nsj s HIS 38 N -1.48 3.09 -0.05 0.38 2.46 -0.95 -5.00 115.29 113.73 2nsj s HIS 38 Ca -0.11 -0.00 0.07 0.00 0.47 0.00 0.00 55.06 55.48 2nsj s HIS 38 Cb -0.02 -1.85 -0.01 0.00 -0.13 0.00 0.00 32.58 30.56 2nsj s HIS 38 CO 0.05 0.26 -0.25 0.08 -2.47 0.00 0.00 174.74 172.41 2nsj s VAL 39 N -0.37 2.09 -0.18 0.89 1.01 -1.26 0.05 120.40 122.63 2nsj s VAL 39 Ca 0.07 -1.07 -0.28 0.00 0.00 0.00 0.00 61.98 60.70 2nsj s VAL 39 Cb -0.12 -1.74 0.10 0.00 0.00 0.00 0.00 36.38 34.61 2nsj s VAL 39 CO 0.02 0.57 0.85 -0.70 0.00 0.00 0.00 175.10 175.84 2nsj s GLU 40 N -0.33 0.77 -0.40 2.72 2.12 -0.64 -4.98 118.70 117.96 2nsj s GLU 40 Ca 0.01 0.48 -0.20 0.00 0.36 0.00 0.00 54.97 55.62 2nsj s GLU 40 Cb -0.12 0.37 0.01 0.00 0.26 0.00 0.00 34.13 34.65 2nsj s GLU 40 CO 0.02 -0.18 0.59 0.08 -0.54 0.00 0.00 175.26 175.23 2nsj s VAL 41 N -0.49 4.91 -0.04 3.70 1.01 -1.26 -2.45 120.40 125.77 2nsj s VAL 41 Ca -0.03 0.19 0.03 0.00 0.00 0.00 0.00 61.98 62.18 2nsj s VAL 41 Cb -0.02 -4.11 0.00 0.00 0.00 0.00 0.00 36.38 32.25 2nsj s VAL 41 CO 0.02 -0.44 -0.14 -0.69 0.00 0.00 0.00 175.10 173.86 2nsj s VAL 42 N 2.62 1.18 -0.08 2.92 1.01 0.69 -4.91 120.40 123.82 2nsj s VAL 42 Ca 0.21 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.66 2nsj s VAL 42 Cb -0.15 -1.04 0.01 0.00 0.00 0.00 0.00 36.38 35.21 2nsj s VAL 42 CO 0.16 0.35 -0.16 -0.55 0.00 0.00 0.00 175.10 174.91 2nsj s SER 43 N 0.26 2.25 0.34 3.32 0.15 -1.26 -3.12 113.70 115.64 2nsj s SER 43 Ca -0.07 -0.39 0.15 0.00 0.70 0.00 0.00 55.95 56.34 2nsj s SER 43 Cb -0.12 -1.03 0.58 0.00 -1.71 0.00 0.00 66.02 63.74 2nsj s SER 43 CO 0.02 0.06 1.70 0.00 1.20 0.00 0.00 173.24 176.22 2nsj h ALA 44 N 7.02 1.03 0.19 5.45 0.00 -1.91 -0.47 119.26 130.56 2nsj h ALA 44 Ca -0.28 -0.42 -0.35 0.00 0.00 0.00 0.00 54.91 53.86 2nsj h ALA 44 Cb 1.20 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.92 2nsj h ALA 44 CO 0.48 0.58 -1.73 1.96 0.00 0.00 0.00 179.25 180.53 2nsj h GLN 45 N 0.00 0.39 0.00 0.00 4.20 -1.96 -3.28 115.11 114.46 2nsj h GLN 45 Ca -0.00 -0.67 -0.06 0.00 0.06 0.00 0.00 58.65 57.98 2nsj h GLN 45 Cb 0.94 0.25 -0.01 0.00 0.30 0.00 0.00 27.48 28.96 2nsj h GLN 45 CO 0.06 1.31 -2.03 0.54 -0.67 0.00 0.00 178.83 178.04 2nsj n ARG 46 N -3.59 0.66 -3.15 1.46 1.74 -1.23 -4.61 116.66 107.95 2nsj n ARG 46 Ca -0.24 -0.16 -0.19 0.00 -0.77 0.00 0.00 57.85 56.49 2nsj n ARG 46 Cb 1.08 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.98 2nsj n ARG 46 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2nsj n THR 47 N -2.31 0.20 -0.34 0.55 -2.24 -0.19 -4.98 114.28 104.97 2nsj n THR 47 Ca -0.08 -4.64 0.04 0.00 -2.27 0.00 0.00 64.05 57.09 2nsj n THR 47 Cb 0.65 -0.35 0.19 0.00 -2.10 0.00 0.00 70.33 68.72 2nsj n THR 47 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2nsj h PRO 48 N 3.00 0.94 -0.25 -0.78 0.13 -1.59 -2.03 132.00 131.41 2nsj h PRO 48 Ca 0.10 -0.06 -0.14 0.00 -0.87 0.00 0.00 66.00 65.03 2nsj h PRO 48 Cb 0.93 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 2nsj h PRO 48 CO 0.53 0.62 -0.42 -0.44 -0.23 0.00 0.00 178.00 178.07 2nsj h ASP 49 N 0.97 0.66 0.55 1.44 3.32 -1.90 -2.03 116.42 119.44 2nsj h ASP 49 Ca 0.44 -0.30 -0.11 0.00 0.02 0.00 0.00 57.03 57.08 2nsj h ASP 49 Cb 0.33 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 2nsj h ASP 49 CO -0.23 1.00 -0.51 0.50 -1.72 0.00 0.00 179.24 178.28 2nsj h LYS 50 N 0.50 0.00 -0.11 3.56 3.64 -1.82 -1.28 116.57 121.05 2nsj h LYS 50 Ca 0.04 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.39 2nsj h LYS 50 Cb 0.94 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.76 2nsj h LYS 50 CO 0.08 0.51 -0.05 1.25 -2.27 0.00 0.00 179.45 178.97 2nsj h LEU 51 N 0.00 0.24 0.24 5.20 6.46 -1.13 0.32 115.31 126.65 2nsj h LEU 51 Ca -0.01 -0.40 0.00 0.00 -0.12 0.00 0.00 57.88 57.36 2nsj h LEU 51 Cb 0.92 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.76 2nsj h LEU 51 CO 0.07 0.59 -0.26 -0.26 -0.62 0.00 0.00 178.44 177.96 2nsj h PHE 52 N -0.11 -0.68 -0.53 1.25 -1.00 -1.23 0.27 116.94 114.92 2nsj h PHE 52 Ca 0.03 0.01 0.09 0.00 2.81 0.00 0.00 57.97 60.90 2nsj h PHE 52 Cb 0.49 0.27 -0.07 0.00 3.61 0.00 0.00 35.95 40.25 2nsj h PHE 52 CO 0.06 -0.37 0.11 1.03 -1.61 0.00 0.00 178.31 177.53 2nsj h SER 53 N -0.54 0.02 -0.05 2.17 0.87 -1.19 0.04 113.55 114.87 2nsj h SER 53 Ca -0.00 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 2nsj h SER 53 Cb 0.50 0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 62.58 2nsj h SER 53 CO -0.07 0.03 0.03 0.15 -0.53 0.00 0.00 176.83 176.44 2nsj h PHE 54 N 0.25 0.05 -0.60 2.24 3.57 0.20 -2.65 116.94 120.00 2nsj h PHE 54 Ca 0.27 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.72 2nsj h PHE 54 Cb 0.36 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.06 2nsj h PHE 54 CO -0.23 0.03 0.20 0.00 -2.23 0.00 0.00 178.31 176.08 2nsj h ALA 55 N 1.02 0.79 0.00 2.41 0.00 0.09 -2.24 119.26 121.33 2nsj h ALA 55 Ca 0.02 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 2nsj h ALA 55 Cb 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2nsj h ALA 55 CO -0.01 0.45 -0.17 0.93 0.00 0.00 0.00 179.25 180.45 2nsj h GLU 56 N 0.86 0.00 -0.27 0.00 5.08 -0.94 -2.67 114.58 116.64 2nsj h GLU 56 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 2nsj h GLU 56 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2nsj h GLU 56 CO -0.01 0.17 0.00 -1.13 -1.00 0.00 0.00 179.01 177.04 2nsj n SER 57 N -3.89 3.11 -0.14 1.42 3.41 -1.01 -4.58 113.62 111.95 2nsj n SER 57 Ca -0.02 -1.92 -0.03 0.00 -0.26 0.00 0.00 58.87 56.64 2nsj n SER 57 Cb 0.26 -0.17 0.05 0.00 -0.26 0.00 0.00 64.21 64.09 2nsj n SER 57 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nsj h ALA 58 N 3.94 0.49 0.23 7.33 0.00 -1.04 -0.37 119.26 129.84 2nsj h ALA 58 Ca 0.00 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2nsj h ALA 58 Cb 0.89 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2nsj h ALA 58 CO 0.00 -0.33 -0.11 0.93 0.00 0.00 0.00 179.25 179.74 2nsj h GLU 59 N 0.20 -0.30 0.00 0.00 5.08 -1.80 -2.44 114.58 115.32 2nsj h GLU 59 Ca 0.22 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 2nsj h GLU 59 Cb 0.30 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.62 2nsj h GLU 59 CO -0.31 -0.03 0.00 1.05 -1.00 0.00 0.00 179.01 178.72 2nsj h GLU 60 N -0.55 0.00 -0.00 2.33 4.11 -1.80 0.22 114.58 118.88 2nsj h GLU 60 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.40 2nsj h GLU 60 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2nsj h GLU 60 CO 0.05 0.00 -0.31 0.09 0.07 0.00 0.00 179.01 178.91 2nsj n ASN 61 N -2.71 0.43 0.00 3.06 5.03 -0.17 -4.95 115.26 115.96 2nsj n ASN 61 Ca -0.02 -0.18 0.00 0.00 0.87 0.00 0.00 54.58 55.25 2nsj n ASN 61 Cb 0.06 0.03 0.00 0.00 -1.02 0.00 0.00 39.78 38.85 2nsj n ASN 61 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2nsj n GLY 62 N 1.46 0.63 3.75 7.41 0.00 0.76 -4.92 105.19 114.28 2nsj n GLY 62 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 2nsj n GLY 62 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nsj s TYR 63 N -2.46 3.34 -0.15 1.61 4.12 -0.95 -4.50 117.35 118.35 2nsj s TYR 63 Ca 0.00 1.43 0.07 0.00 0.02 0.00 0.00 57.07 58.59 2nsj s TYR 63 Cb 0.00 -3.50 -0.10 0.00 -1.52 0.00 0.00 41.96 36.84 2nsj s TYR 63 CO 0.00 -1.38 0.22 1.04 0.02 0.00 0.00 175.55 175.46 2nsj n GLN 64 N 1.87 2.16 -3.78 -0.62 6.02 0.15 -4.55 117.38 118.64 2nsj n GLN 64 Ca 0.03 -0.04 -0.13 0.00 -0.01 0.00 0.00 57.00 56.85 2nsj n GLN 64 Cb 0.44 -1.03 -0.10 0.00 1.02 0.00 0.00 30.24 30.56 2nsj n GLN 64 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2nsj s VAL 65 N -2.15 0.03 -0.05 5.09 1.01 -1.12 -3.93 120.40 119.28 2nsj s VAL 65 Ca -0.00 -0.22 0.03 0.00 0.00 0.00 0.00 61.98 61.79 2nsj s VAL 65 Cb 0.05 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.97 2nsj s VAL 65 CO 0.30 -0.12 -0.15 -0.63 0.00 0.00 0.00 175.10 174.51 2nsj s ILE 66 N -0.44 1.28 -0.26 2.22 1.01 0.25 -1.95 121.20 123.31 2nsj s ILE 66 Ca -0.06 -0.60 -0.02 0.00 0.00 0.00 0.00 60.65 59.98 2nsj s ILE 66 Cb -0.04 -1.12 0.03 0.00 0.01 0.00 0.00 42.46 41.34 2nsj s ILE 66 CO 0.02 0.38 -0.05 -0.63 0.00 0.00 0.00 174.94 174.66 2nsj s ILE 67 N 0.31 2.94 -0.14 2.92 1.01 0.98 -0.39 121.20 128.83 2nsj s ILE 67 Ca -0.09 -1.07 0.01 0.00 0.00 0.00 0.00 60.65 59.51 2nsj s ILE 67 Cb -0.13 -2.52 -0.00 0.00 0.01 0.00 0.00 42.46 39.81 2nsj s ILE 67 CO 0.03 0.15 -0.17 0.00 0.00 0.00 0.00 174.94 174.94 2nsj s ALA 68 N 1.32 2.43 0.00 9.38 0.00 -0.18 -0.57 121.76 134.15 2nsj s ALA 68 Ca -0.01 -1.01 0.05 0.00 0.00 0.00 0.00 51.96 51.00 2nsj s ALA 68 Cb -0.17 -1.12 -0.03 0.00 0.00 0.00 0.00 23.12 21.79 2nsj s ALA 68 CO -0.04 0.08 -0.15 0.20 0.00 0.00 0.00 175.76 175.85 2nsj s GLY 69 N 0.65 1.58 -0.02 0.00 0.00 -0.46 -0.91 107.32 108.15 2nsj s GLY 69 Ca -0.09 -1.09 -0.29 0.00 0.00 0.00 0.00 44.72 43.25 2nsj s GLY 69 CO 0.02 -0.94 0.69 0.00 0.00 0.00 0.00 173.10 172.88 2nsj s ALA 70 N -0.87 -1.75 0.20 3.20 0.00 -1.00 -2.20 121.76 119.34 2nsj s ALA 70 Ca 0.14 1.18 0.11 0.00 0.00 0.00 0.00 51.96 53.39 2nsj s ALA 70 Cb -0.11 0.12 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 2nsj s ALA 70 CO 0.04 -0.44 -0.18 0.20 0.00 0.00 0.00 175.76 175.38 2nsj s GLY 71 N -1.49 1.74 0.00 0.00 0.00 -1.26 -1.31 107.32 104.99 2nsj s GLY 71 Ca -0.08 -1.62 0.00 0.00 0.00 0.00 0.00 44.72 43.02 2nsj s GLY 71 CO 0.05 -1.65 0.00 0.61 0.00 0.00 0.00 173.10 172.10 2nsj n GLY 72 N 0.03 0.85 3.57 0.20 0.00 -1.26 -4.16 105.19 104.41 2nsj n GLY 72 Ca -0.11 -0.74 -0.41 0.00 0.00 0.00 0.00 46.02 44.76 2nsj n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nsj s ALA 73 N -2.00 2.86 -0.35 4.61 0.00 -1.26 -2.49 121.76 123.12 2nsj s ALA 73 Ca 0.00 -2.45 -0.29 0.00 0.00 0.00 0.00 51.96 49.22 2nsj s ALA 73 Cb 0.00 -4.57 0.01 0.00 0.00 0.00 0.00 23.12 18.55 2nsj s ALA 73 CO 0.00 -3.58 1.33 0.00 0.00 0.00 0.00 175.76 173.51 2nsj s ALA 74 N 5.01 3.23 -0.06 0.00 0.00 -1.26 -4.85 121.76 123.83 2nsj s ALA 74 Ca 0.50 -0.03 0.12 0.00 0.00 0.00 0.00 51.96 52.54 2nsj s ALA 74 Cb 0.01 -3.84 -0.17 0.00 0.00 0.00 0.00 23.12 19.11 2nsj s ALA 74 CO -0.03 -2.03 0.18 0.72 0.00 0.00 0.00 175.76 174.59 2nsj n HIS 75 N 8.07 0.00 -0.17 0.00 8.25 -1.26 -4.46 115.22 125.64 2nsj n HIS 75 Ca 0.15 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.49 2nsj n HIS 75 Cb 0.47 -0.40 -0.09 0.00 1.12 0.00 0.00 29.99 31.09 2nsj n HIS 75 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2nsj h LEU 76 N 0.00 -1.71 -0.29 2.41 5.85 -1.94 -1.52 115.31 118.11 2nsj h LEU 76 Ca -0.13 0.23 0.07 0.00 0.84 0.00 0.00 57.88 58.89 2nsj h LEU 76 Cb 1.03 0.71 -0.08 0.00 0.37 0.00 0.00 40.66 42.70 2nsj h LEU 76 CO 0.01 -0.33 -0.24 -0.65 -0.34 0.00 0.00 178.44 176.89 2nsj h PRO 77 N -0.28 -0.22 -0.80 5.25 0.11 -1.86 -1.97 132.00 132.24 2nsj h PRO 77 Ca 0.08 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.19 2nsj h PRO 77 Cb 0.50 0.05 -0.04 0.00 0.11 0.00 0.00 31.00 31.62 2nsj h PRO 77 CO -0.59 -0.14 0.43 0.78 -0.21 0.00 0.00 178.00 178.26 2nsj h GLY 78 N -0.22 1.19 1.59 -0.55 0.00 -1.80 -1.92 103.07 101.35 2nsj h GLY 78 Ca 0.15 -0.54 -0.12 0.00 0.00 0.00 0.00 47.33 46.83 2nsj h GLY 78 CO -0.42 0.52 -0.36 -0.33 0.00 0.00 0.00 176.54 175.95 2nsj h MET 79 N 1.11 0.46 -0.24 4.80 2.86 -0.94 -1.19 114.93 121.80 2nsj h MET 79 Ca 0.28 -0.21 -0.08 0.00 -2.06 0.00 0.00 59.70 57.63 2nsj h MET 79 Cb 0.04 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 2nsj h MET 79 CO -0.04 0.76 -0.16 0.82 1.06 0.00 0.00 176.91 179.34 2nsj h ILE 80 N 0.39 1.31 -0.42 -1.22 2.04 -1.16 -3.06 117.51 115.39 2nsj h ILE 80 Ca 0.04 -1.28 -0.01 0.00 1.00 0.00 0.00 64.86 64.61 2nsj h ILE 80 Cb 0.82 1.63 -0.02 0.00 -0.74 0.00 0.00 36.82 38.51 2nsj h ILE 80 CO 0.07 0.40 0.23 0.00 0.00 0.00 0.00 178.15 178.84 2nsj h ALA 81 N 0.69 1.61 0.00 1.87 0.00 -1.17 -1.56 119.26 120.70 2nsj h ALA 81 Ca 0.05 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2nsj h ALA 81 Cb 0.69 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 2nsj h ALA 81 CO 0.04 0.33 -0.08 0.00 0.00 0.00 0.00 179.25 179.55 2nsj h ALA 82 N 1.67 1.04 -0.03 0.00 0.00 -1.12 -3.18 119.26 117.64 2nsj h ALA 82 Ca 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2nsj h ALA 82 Cb 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2nsj h ALA 82 CO -0.02 0.10 0.00 1.63 0.00 0.00 0.00 179.25 180.95 2nsj n LYS 83 N -3.24 1.38 -3.78 0.00 4.76 -0.62 -5.03 118.16 111.63 2nsj n LYS 83 Ca -0.00 -1.52 -0.10 0.00 -2.87 0.00 0.00 58.31 53.82 2nsj n LYS 83 Cb 0.32 -1.33 -0.06 0.00 -1.84 0.00 0.00 35.03 32.12 2nsj n LYS 83 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 2nsj s THR 84 N -1.41 0.09 -2.72 -0.18 -1.32 -1.00 -4.23 115.64 104.85 2nsj s THR 84 Ca 0.20 -0.94 0.24 0.00 -1.21 0.00 0.00 61.69 59.99 2nsj s THR 84 Cb 0.14 -1.40 0.21 0.00 -1.51 0.00 0.00 72.50 69.94 2nsj s THR 84 CO 0.21 -0.39 1.31 0.18 -2.21 0.00 0.00 174.62 173.72 2nsj n LEU 85 N -0.19 2.56 -4.70 9.08 4.77 -1.26 -4.76 117.00 122.50 2nsj n LEU 85 Ca -0.13 -0.86 -0.42 0.00 -0.03 0.00 0.00 56.01 54.56 2nsj n LEU 85 Cb 0.63 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.69 2nsj n LEU 85 CO 0.20 0.43 1.02 -0.69 -1.33 0.00 0.00 177.39 177.03 2nsj s VAL 86 N -2.10 3.71 0.13 4.08 1.01 -1.26 -4.93 120.40 121.03 2nsj s VAL 86 Ca 0.28 1.18 -0.35 0.00 0.00 0.00 0.00 61.98 63.08 2nsj s VAL 86 Cb 0.20 -3.76 -0.15 0.00 0.00 0.00 0.00 36.38 32.67 2nsj s VAL 86 CO 0.36 0.05 1.42 -2.65 0.00 0.00 0.00 175.10 174.28 2nsj n PRO 87 N 4.50 1.55 -4.83 2.72 -0.02 -1.25 -4.76 135.00 132.91 2nsj n PRO 87 Ca 0.11 0.56 -0.33 0.00 -2.02 0.00 0.00 63.50 61.82 2nsj n PRO 87 Cb 0.44 -2.24 -0.15 0.00 -0.02 0.00 0.00 33.50 31.53 2nsj n PRO 87 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2nsj s VAL 88 N 0.58 2.65 -0.16 -1.45 1.01 -1.26 -0.59 120.40 121.18 2nsj s VAL 88 Ca 0.81 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.96 2nsj s VAL 88 Cb -0.83 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.43 2nsj s VAL 88 CO 0.44 0.53 -0.06 -0.76 0.00 0.00 0.00 175.10 175.25 2nsj s LEU 89 N 0.48 3.07 -0.10 3.92 1.43 0.48 -1.79 118.68 126.16 2nsj s LEU 89 Ca -0.12 -0.22 -0.08 0.00 -1.03 0.00 0.00 54.13 52.69 2nsj s LEU 89 Cb -0.16 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 2nsj s LEU 89 CO 0.05 0.14 0.18 -0.83 0.23 0.00 0.00 176.35 176.12 2nsj s GLY 90 N 0.52 2.21 -0.24 -3.19 0.00 0.25 -1.01 107.32 105.86 2nsj s GLY 90 Ca -0.05 -0.58 0.02 0.00 0.00 0.00 0.00 44.72 44.11 2nsj s GLY 90 CO 0.03 -0.29 -0.09 0.14 0.00 0.00 0.00 173.10 172.89 2nsj s VAL 91 N -1.01 1.83 -0.31 1.40 1.01 -0.09 -1.29 120.40 121.93 2nsj s VAL 91 Ca 0.16 -1.37 -0.29 0.00 0.00 0.00 0.00 61.98 60.49 2nsj s VAL 91 Cb -0.13 -2.00 -0.00 0.00 0.00 0.00 0.00 36.38 34.25 2nsj s VAL 91 CO 0.05 -0.02 1.44 -2.84 0.00 0.00 0.00 175.10 173.74 2nsj s PRO 92 N 1.27 3.76 0.20 2.72 0.02 -1.26 -2.38 135.00 139.33 2nsj s PRO 92 Ca -0.06 1.28 -0.26 0.00 0.02 0.00 0.00 61.00 61.98 2nsj s PRO 92 Cb -0.19 -3.98 -0.08 0.00 0.02 0.00 0.00 34.50 30.27 2nsj s PRO 92 CO -0.06 -1.33 0.82 0.08 -0.33 0.00 0.00 177.00 176.18 2nsj s VAL 93 N 5.03 4.31 -0.20 3.83 1.01 -0.43 0.36 120.40 134.32 2nsj s VAL 93 Ca 0.63 1.75 -0.29 0.00 0.00 0.00 0.00 61.98 64.06 2nsj s VAL 93 Cb -0.18 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 2nsj s VAL 93 CO 0.28 0.44 1.59 -1.58 0.00 0.00 0.00 175.10 175.83 2nsj s GLN 94 N -1.35 3.87 0.42 2.72 0.74 -1.26 -4.38 119.66 120.40 2nsj s GLN 94 Ca 0.39 1.70 -0.09 0.00 0.05 0.00 0.00 55.36 57.42 2nsj s GLN 94 Cb -0.22 -4.01 -0.06 0.00 1.10 0.00 0.00 33.01 29.82 2nsj s GLN 94 CO 0.26 -1.21 0.76 -1.54 -0.55 0.00 0.00 175.29 173.02 2nsj s SER 95 N 3.96 6.45 0.05 6.67 1.04 -1.26 -4.72 113.70 125.89 2nsj s SER 95 Ca 0.70 1.07 -0.31 0.00 0.48 0.00 0.00 55.95 57.89 2nsj s SER 95 Cb -0.25 -2.30 -0.17 0.00 0.10 0.00 0.00 66.02 63.40 2nsj s SER 95 CO 0.28 -0.43 1.42 0.00 0.98 0.00 0.00 173.24 175.49 2nsj h ALA 96 N 1.03 -1.26 0.15 5.32 0.00 -1.97 -2.10 119.26 120.44 2nsj h ALA 96 Ca -0.47 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.19 2nsj h ALA 96 Cb 1.19 0.43 0.00 0.00 0.00 0.00 0.00 17.79 19.41 2nsj h ALA 96 CO 0.63 -1.18 -0.07 0.00 0.00 0.00 0.00 179.25 178.63 2nsj h ALA 97 N -1.46 -0.20 -0.64 0.00 0.00 -2.04 -3.31 119.26 111.61 2nsj h ALA 97 Ca -0.11 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2nsj h ALA 97 Cb 0.84 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2nsj h ALA 97 CO 0.18 -0.48 0.00 1.28 0.00 0.00 0.00 179.25 180.23 2nsj n LEU 98 N -5.06 4.78 -4.26 0.00 4.77 -1.26 -4.96 117.00 111.01 2nsj n LEU 98 Ca -0.09 -2.41 -0.36 0.00 -0.03 0.00 0.00 56.01 53.13 2nsj n LEU 98 Cb 0.20 -0.59 -0.04 0.00 -2.33 0.00 0.00 43.42 40.66 2nsj n LEU 98 CO 0.33 0.79 -0.13 -1.20 -1.33 0.00 0.00 177.39 175.84 2nsj n SER 99 N 1.10 -2.13 0.00 -1.43 7.64 -0.79 -0.75 113.62 117.27 2nsj n SER 99 Ca 0.26 -1.09 0.00 0.00 1.01 0.00 0.00 58.87 59.05 2nsj n SER 99 Cb 0.90 -2.45 0.00 0.00 -1.01 0.00 0.00 64.21 61.66 2nsj n SER 99 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2nsj n GLY 100 N -1.54 1.72 0.24 0.23 0.00 -1.23 -4.61 105.19 99.99 2nsj n GLY 100 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 2nsj n GLY 100 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2nsj h VAL 101 N 0.00 1.25 -0.09 1.61 2.07 -1.29 0.93 116.25 120.74 2nsj h VAL 101 Ca 0.00 -1.19 -0.15 0.00 0.82 0.00 0.00 66.70 66.18 2nsj h VAL 101 Cb 0.00 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 2nsj h VAL 101 CO 0.00 0.38 -0.59 -2.24 0.02 0.00 0.00 177.57 175.14 2nsj h ASP 102 N 0.39 0.33 -0.37 0.57 2.03 -1.85 -2.16 116.42 115.36 2nsj h ASP 102 Ca 0.06 -0.19 -0.07 0.00 -0.73 0.00 0.00 57.03 56.10 2nsj h ASP 102 Cb 0.62 -0.10 -0.01 0.00 -0.83 0.00 0.00 39.33 39.01 2nsj h ASP 102 CO 0.04 0.85 -0.06 0.28 -1.03 0.00 0.00 179.24 179.32 2nsj h SER 103 N 0.22 0.70 0.13 4.15 0.02 -1.08 -2.47 113.55 115.22 2nsj h SER 103 Ca -0.00 -0.35 -0.01 0.00 -0.84 0.00 0.00 61.79 60.59 2nsj h SER 103 Cb 1.10 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.45 2nsj h SER 103 CO 0.10 0.88 -0.06 0.25 -1.14 0.00 0.00 176.83 176.85 2nsj h LEU 104 N 0.50 -0.14 -0.75 5.07 5.85 -0.73 -2.58 115.31 122.53 2nsj h LEU 104 Ca 0.10 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 2nsj h LEU 104 Cb 0.56 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 2nsj h LEU 104 CO 0.03 -0.04 0.16 1.88 -0.34 0.00 0.00 178.44 180.13 2nsj h TYR 105 N -0.23 1.17 0.00 1.25 0.05 -1.42 -0.17 116.97 117.61 2nsj h TYR 105 Ca -0.02 -0.14 0.00 0.00 0.05 0.00 0.00 58.73 58.62 2nsj h TYR 105 Cb 0.18 -0.33 0.00 0.00 1.01 0.00 0.00 36.73 37.60 2nsj h TYR 105 CO -0.05 0.95 0.00 0.66 -1.05 0.00 0.00 178.16 178.67 2nsj h SER 106 N 1.05 0.00 0.00 3.88 4.64 -1.41 -2.72 113.55 118.99 2nsj h SER 106 Ca 0.22 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.19 2nsj h SER 106 Cb 0.37 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.41 2nsj h SER 106 CO 0.00 0.00 -2.10 -0.38 -0.87 0.00 0.00 176.83 173.49 2nsj n ILE 107 N -2.42 1.52 0.09 0.95 5.41 -0.97 -4.69 119.36 119.25 2nsj n ILE 107 Ca 0.02 -0.24 -0.06 0.00 1.00 0.00 0.00 62.75 63.47 2nsj n ILE 107 Cb 0.28 -1.99 0.08 0.00 -0.71 0.00 0.00 39.64 37.29 2nsj n ILE 107 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 176.55 178.17 2nsj h VAL 108 N -1.00 1.44 0.00 1.39 3.04 -1.13 -3.36 116.25 116.63 2nsj h VAL 108 Ca -0.53 -2.27 -0.08 0.00 -1.01 0.00 0.00 66.70 62.80 2nsj h VAL 108 Cb 1.45 2.21 -0.03 0.00 -2.01 0.00 0.00 31.29 32.91 2nsj h VAL 108 CO -0.32 0.66 -0.15 0.00 -1.01 0.00 0.00 177.57 176.75 2nsj n GLN 109 N -3.77 1.36 -2.39 4.17 1.13 -1.03 -4.92 117.38 111.93 2nsj n GLN 109 Ca -0.03 -0.43 -0.41 0.00 -1.94 0.00 0.00 57.00 54.20 2nsj n GLN 109 Cb 0.69 -1.46 -0.03 0.00 0.11 0.00 0.00 30.24 29.55 2nsj n GLN 109 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 2nsj s MET 110 N 0.60 4.49 0.94 -1.09 -1.94 -1.26 -5.02 119.30 116.02 2nsj s MET 110 Ca 0.29 1.86 -0.13 0.00 -1.71 0.00 0.00 55.69 55.99 2nsj s MET 110 Cb 0.14 -3.25 0.15 0.00 2.01 0.00 0.00 34.83 33.88 2nsj s MET 110 CO 0.00 -0.09 1.15 -1.25 -0.01 0.00 0.00 175.02 174.82 2nsj s PRO 111 N -0.14 0.92 0.15 2.03 0.04 -1.26 -4.94 135.00 131.79 2nsj s PRO 111 Ca 0.53 0.20 -0.34 0.00 0.04 0.00 0.00 61.00 61.43 2nsj s PRO 111 Cb -0.32 -1.82 -0.14 0.00 0.04 0.00 0.00 34.50 32.26 2nsj s PRO 111 CO 0.36 -2.33 1.55 -2.13 0.04 0.00 0.00 177.00 174.49 2nsj n ARG 112 N -3.84 2.03 0.00 4.56 0.63 -1.26 -3.83 116.66 114.95 2nsj n ARG 112 Ca 0.08 0.73 0.00 0.00 -0.92 0.00 0.00 57.85 57.74 2nsj n ARG 112 Cb 0.59 -2.49 0.00 0.00 0.45 0.00 0.00 32.46 31.02 2nsj n ARG 112 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2nsj n GLY 113 N 3.32 3.49 2.75 5.14 0.00 -1.26 -5.05 105.19 113.58 2nsj n GLY 113 Ca 0.17 -1.05 -0.28 0.00 0.00 0.00 0.00 46.02 44.86 2nsj n GLY 113 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2nsj s ILE 114 N 0.00 0.68 0.45 -0.61 1.09 -1.25 -5.10 121.20 116.46 2nsj s ILE 114 Ca 0.00 -0.83 0.01 0.00 -1.10 0.00 0.00 60.65 58.72 2nsj s ILE 114 Cb 0.00 -1.25 -0.00 0.00 -1.06 0.00 0.00 42.46 40.15 2nsj s ILE 114 CO 0.00 -0.34 0.67 -2.16 -0.10 0.00 0.00 174.94 173.02 2nsj s PRO 115 N 1.77 3.02 -0.24 2.79 0.04 -1.26 -4.69 135.00 136.43 2nsj s PRO 115 Ca 0.02 -0.54 -0.05 0.00 0.04 0.00 0.00 61.00 60.47 2nsj s PRO 115 Cb -0.17 -2.56 0.12 0.00 0.04 0.00 0.00 34.50 31.93 2nsj s PRO 115 CO -0.13 -0.30 0.44 0.08 0.04 0.00 0.00 177.00 177.13 2nsj s VAL 116 N -2.56 -0.70 -0.19 -0.36 1.01 -1.26 -4.72 120.40 111.62 2nsj s VAL 116 Ca 0.49 0.03 -0.29 0.00 0.00 0.00 0.00 61.98 62.21 2nsj s VAL 116 Cb -0.10 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 2nsj s VAL 116 CO 0.38 -0.02 1.37 -0.83 0.00 0.00 0.00 175.10 175.99 2nsj s GLY 117 N 2.64 1.51 -0.11 4.51 0.00 -0.74 -4.74 107.32 110.39 2nsj s GLY 117 Ca 0.07 0.44 -0.06 0.00 0.00 0.00 0.00 44.72 45.18 2nsj s GLY 117 CO -0.16 2.66 0.11 -1.59 0.00 0.00 0.00 173.10 174.12 2nsj s THR 118 N 4.00 5.22 0.52 0.90 2.01 -1.26 0.88 115.64 127.91 2nsj s THR 118 Ca 0.60 0.10 0.06 0.00 0.31 0.00 0.00 61.69 62.76 2nsj s THR 118 Cb -0.23 -3.26 0.03 0.00 0.01 0.00 0.00 72.50 69.05 2nsj s THR 118 CO 0.20 0.62 0.39 -0.76 -0.69 0.00 0.00 174.62 174.38 2nsj s LEU 119 N -0.99 2.81 0.82 4.42 2.01 -0.42 -4.92 118.68 122.41 2nsj s LEU 119 Ca 0.15 -1.18 -0.14 0.00 0.01 0.00 0.00 54.13 52.97 2nsj s LEU 119 Cb -0.12 -1.31 0.05 0.00 0.01 0.00 0.00 46.19 44.82 2nsj s LEU 119 CO 0.04 -1.01 0.90 0.00 1.01 0.00 0.00 176.35 177.28 2nsj n ALA 120 N -1.70 -0.86 -1.78 4.21 0.00 -1.26 -4.41 120.51 114.70 2nsj n ALA 120 Ca -0.01 -0.37 -0.41 0.00 0.00 0.00 0.00 53.44 52.66 2nsj n ALA 120 Cb 0.64 -2.07 -0.02 0.00 0.00 0.00 0.00 19.45 17.99 2nsj n ALA 120 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2nsj s ILE 121 N -2.14 2.71 0.00 0.00 1.01 -1.26 -3.60 121.20 117.91 2nsj s ILE 121 Ca 0.68 0.70 0.00 0.00 0.00 0.00 0.00 60.65 62.03 2nsj s ILE 121 Cb -0.29 -3.45 0.00 0.00 0.01 0.00 0.00 42.46 38.74 2nsj s ILE 121 CO 0.56 0.16 0.00 0.61 0.00 0.00 0.00 174.94 176.27 2nsj n GLY 122 N 0.91 -1.29 0.37 6.18 0.00 0.16 -4.25 105.19 107.27 2nsj n GLY 122 Ca 0.01 -1.27 0.07 0.00 0.00 0.00 0.00 46.02 44.82 2nsj n GLY 122 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nsj h LYS 123 N 0.00 0.94 -0.21 1.61 1.57 -1.88 -1.35 116.57 117.26 2nsj h LYS 123 Ca 0.00 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 2nsj h LYS 123 Cb 0.00 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.08 2nsj h LYS 123 CO 0.00 0.63 -0.08 0.00 -0.57 0.00 0.00 179.45 179.43 2nsj h ALA 124 N 1.53 1.49 -0.02 3.86 0.00 -1.89 -1.53 119.26 122.71 2nsj h ALA 124 Ca 0.45 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 55.01 2nsj h ALA 124 Cb 0.41 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2nsj h ALA 124 CO -0.21 0.36 -0.72 0.78 0.00 0.00 0.00 179.25 179.46 2nsj h GLY 125 N 0.73 0.14 0.85 0.00 0.00 -1.33 -2.10 103.07 101.36 2nsj h GLY 125 Ca 0.07 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 2nsj h GLY 125 CO 0.02 0.19 -0.07 0.00 0.00 0.00 0.00 176.54 176.67 2nsj h ALA 126 N 1.18 -0.19 -0.41 3.60 0.00 -0.65 -0.96 119.26 121.82 2nsj h ALA 126 Ca -0.02 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.81 2nsj h ALA 126 Cb 1.27 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 2nsj h ALA 126 CO 0.10 -0.53 0.23 0.00 0.00 0.00 0.00 179.25 179.05 2nsj h ALA 127 N 0.49 0.51 -0.85 0.00 0.00 -1.39 -2.95 119.26 115.07 2nsj h ALA 127 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2nsj h ALA 127 Cb 0.28 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2nsj h ALA 127 CO 0.03 -0.11 0.43 -0.91 0.00 0.00 0.00 179.25 178.69 2nsj h ASN 128 N 0.46 1.08 -0.37 0.00 -0.26 -1.25 -0.89 115.58 114.35 2nsj h ASN 128 Ca 0.17 -0.11 -0.02 0.00 -0.56 0.00 0.00 56.30 55.77 2nsj h ASN 128 Cb 0.04 -0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 37.00 2nsj h ASN 128 CO -0.09 0.89 0.17 0.00 -1.06 0.00 0.00 177.43 177.34 2nsj h ALA 129 N 1.28 1.51 -0.22 -0.83 0.00 -1.02 0.61 119.26 120.58 2nsj h ALA 129 Ca 0.29 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.95 2nsj h ALA 129 Cb 0.08 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2nsj h ALA 129 CO -0.04 0.38 -0.39 0.00 0.00 0.00 0.00 179.25 179.20 2nsj h ALA 130 N 1.60 0.35 -0.53 0.00 0.00 -1.26 -0.28 119.26 119.13 2nsj h ALA 130 Ca 0.15 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 2nsj h ALA 130 Cb 0.12 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2nsj h ALA 130 CO -0.01 0.44 0.16 -0.07 0.00 0.00 0.00 179.25 179.77 2nsj h LEU 131 N 0.36 0.78 -0.60 0.00 3.38 -0.37 0.29 115.31 119.14 2nsj h LEU 131 Ca 0.01 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 2nsj h LEU 131 Cb 0.99 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 2nsj h LEU 131 CO 0.09 0.79 0.25 0.25 0.09 0.00 0.00 178.44 179.90 2nsj h LEU 132 N 0.74 0.83 -0.94 1.67 5.85 0.29 -0.42 115.31 123.33 2nsj h LEU 132 Ca 0.17 -0.17 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 2nsj h LEU 132 Cb 0.29 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 2nsj h LEU 132 CO -0.00 0.77 0.20 0.00 -0.34 0.00 0.00 178.44 179.06 2nsj h ALA 133 N 1.09 1.14 -0.52 1.25 0.00 -0.75 -1.64 119.26 119.83 2nsj h ALA 133 Ca 0.20 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2nsj h ALA 133 Cb 0.20 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2nsj h ALA 133 CO -0.02 0.59 0.06 0.00 0.00 0.00 0.00 179.25 179.88 2nsj h ALA 134 N 1.27 1.12 0.00 0.00 0.00 -0.39 -1.74 119.26 119.53 2nsj h ALA 134 Ca 0.21 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 2nsj h ALA 134 Cb 0.27 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2nsj h ALA 134 CO -0.01 0.57 -0.46 1.96 0.00 0.00 0.00 179.25 181.32 2nsj h GLN 135 N 0.79 0.00 -0.22 0.00 4.20 -0.51 0.02 115.11 119.40 2nsj h GLN 135 Ca 0.16 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.78 2nsj h GLN 135 Cb 0.39 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.17 2nsj h GLN 135 CO 0.01 0.46 -0.23 0.82 -0.67 0.00 0.00 178.83 179.22 2nsj h ILE 136 N 0.00 1.32 -0.30 2.54 2.04 -0.71 -3.18 117.51 119.22 2nsj h ILE 136 Ca -0.00 -1.40 -0.16 0.00 1.00 0.00 0.00 64.86 64.30 2nsj h ILE 136 Cb 0.91 1.74 -0.00 0.00 -0.74 0.00 0.00 36.82 38.72 2nsj h ILE 136 CO 0.06 0.43 -0.43 -0.07 0.00 0.00 0.00 178.15 178.14 2nsj h LEU 137 N 0.23 0.89 -2.25 1.44 3.38 -1.17 -3.03 115.31 114.81 2nsj h LEU 137 Ca 0.03 -0.51 0.02 0.00 0.09 0.00 0.00 57.88 57.51 2nsj h LEU 137 Cb 0.79 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 2nsj h LEU 137 CO 0.06 1.23 0.25 0.00 0.09 0.00 0.00 178.44 180.06 2nsj h ALA 138 N 0.70 1.38 -0.52 1.53 0.00 -1.02 -0.61 119.26 120.72 2nsj h ALA 138 Ca 0.03 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.05 2nsj h ALA 138 Cb 1.02 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2nsj h ALA 138 CO 0.10 -0.28 0.36 1.15 0.00 0.00 0.00 179.25 180.58 2nsj h THR 139 N 0.00 0.85 -0.54 0.00 2.02 -1.51 -2.26 112.91 111.47 2nsj h THR 139 Ca 0.03 -0.08 -0.38 0.00 0.77 0.00 0.00 66.41 66.74 2nsj h THR 139 Cb 0.53 0.59 -0.37 0.00 -1.74 0.00 0.00 68.15 67.16 2nsj h THR 139 CO -0.00 0.04 -0.88 1.41 0.37 0.00 0.00 175.52 176.46 2nsj n HIS 140 N -4.45 1.88 -3.23 3.16 8.25 -0.24 -4.89 115.22 115.69 2nsj n HIS 140 Ca 0.09 -2.03 -0.02 0.00 -0.26 0.00 0.00 57.72 55.50 2nsj n HIS 140 Cb 0.42 -0.29 -0.02 0.00 1.12 0.00 0.00 29.99 31.22 2nsj n HIS 140 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2nsj s ASP 141 N -3.53 -1.07 0.43 0.41 -1.08 -0.85 -5.03 116.67 105.95 2nsj s ASP 141 Ca 0.42 -0.87 0.12 0.00 -0.52 0.00 0.00 52.55 51.71 2nsj s ASP 141 Cb 0.38 1.72 0.99 0.00 -1.46 0.00 0.00 42.92 44.56 2nsj s ASP 141 CO -0.01 -0.19 2.00 0.11 0.52 0.00 0.00 175.17 177.60 2nsj h LYS 142 N 7.07 0.43 -0.01 4.34 1.79 -1.91 -1.37 116.57 126.91 2nsj h LYS 142 Ca 0.05 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2nsj h LYS 142 Cb 1.16 -0.10 -0.00 0.00 -1.58 0.00 0.00 32.23 31.71 2nsj h LYS 142 CO 0.12 0.28 -0.00 1.49 -1.08 0.00 0.00 179.45 180.26 2nsj h GLU 143 N 0.44 0.03 -0.65 3.15 4.81 -1.96 -1.20 114.58 119.21 2nsj h GLU 143 Ca 0.25 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.41 2nsj h GLU 143 Cb 0.41 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 2nsj h GLU 143 CO -0.07 0.37 0.18 1.25 -0.73 0.00 0.00 179.01 180.02 2nsj h LEU 144 N -0.32 0.93 -1.30 1.64 5.85 -1.86 -1.37 115.31 118.89 2nsj h LEU 144 Ca 0.00 -0.17 0.06 0.00 0.84 0.00 0.00 57.88 58.62 2nsj h LEU 144 Cb 0.36 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 2nsj h LEU 144 CO 0.00 0.88 0.52 -0.74 -0.34 0.00 0.00 178.44 178.76 2nsj h HIS 145 N 0.96 0.86 -0.27 1.25 2.76 -1.11 0.34 115.15 119.94 2nsj h HIS 145 Ca 0.21 0.02 -0.18 0.00 -2.20 0.00 0.00 60.37 58.22 2nsj h HIS 145 Cb 0.30 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 28.98 2nsj h HIS 145 CO 0.02 0.46 -0.54 0.37 -1.30 0.00 0.00 177.93 176.94 2nsj h GLN 146 N 0.85 0.85 -0.48 5.26 5.75 -0.30 -1.92 115.11 125.11 2nsj h GLN 146 Ca 0.34 -0.55 -0.10 0.00 -0.15 0.00 0.00 58.65 58.19 2nsj h GLN 146 Cb 0.23 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.83 2nsj h GLN 146 CO -0.12 1.18 -0.10 0.00 -2.65 0.00 0.00 178.83 177.14 2nsj h ARG 147 N 0.62 0.88 -0.69 1.69 3.08 -0.17 -0.50 114.38 119.29 2nsj h ARG 147 Ca 0.01 -0.30 -0.03 0.00 0.07 0.00 0.00 59.98 59.72 2nsj h ARG 147 Cb 1.15 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 31.10 2nsj h ARG 147 CO 0.12 0.94 0.31 -0.07 -1.07 0.00 0.00 179.97 180.20 2nsj h LEU 148 N 0.79 0.91 -0.60 3.04 3.38 -0.30 0.16 115.31 122.70 2nsj h LEU 148 Ca 0.13 -0.11 -0.14 0.00 0.09 0.00 0.00 57.88 57.85 2nsj h LEU 148 Cb 0.62 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2nsj h LEU 148 CO 0.04 0.80 -0.67 -1.13 0.09 0.00 0.00 178.44 177.57 2nsj h ASN 149 N 0.99 0.00 -0.34 -0.43 -1.24 -0.94 -1.68 115.58 111.94 2nsj h ASN 149 Ca 0.24 0.00 -0.10 0.00 0.71 0.00 0.00 56.30 57.15 2nsj h ASN 149 Cb 0.15 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.19 2nsj h ASN 149 CO -0.03 0.67 -0.17 0.44 -1.29 0.00 0.00 177.43 177.06 2nsj h ASP 150 N 0.00 0.73 -0.21 1.15 3.32 -0.28 -1.46 116.42 119.67 2nsj h ASP 150 Ca -0.01 -0.41 0.00 0.00 0.02 0.00 0.00 57.03 56.64 2nsj h ASP 150 Cb 1.23 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.56 2nsj h ASP 150 CO 0.09 0.98 0.14 -0.25 -1.72 0.00 0.00 179.24 178.48 2nsj h TRP 151 N 0.49 0.27 -0.63 4.55 7.01 -0.84 -0.89 115.95 125.90 2nsj h TRP 151 Ca 0.07 0.01 -0.05 0.00 2.11 0.00 0.00 58.89 61.03 2nsj h TRP 151 Cb 0.71 -0.09 -0.03 0.00 -2.10 0.00 0.00 29.16 27.65 2nsj h TRP 151 CO 0.06 0.17 0.19 0.00 -2.79 0.00 0.00 178.44 176.07 2nsj h ARG 152 N 0.29 0.95 -0.39 2.65 3.08 -1.28 -1.72 114.38 117.96 2nsj h ARG 152 Ca 0.08 -0.19 0.03 0.00 0.07 0.00 0.00 59.98 59.98 2nsj h ARG 152 Cb -0.03 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 29.84 2nsj h ARG 152 CO -0.02 0.82 0.18 0.87 -1.07 0.00 0.00 179.97 180.75 2nsj h LYS 153 N 0.92 0.35 -0.60 0.04 1.57 -0.76 -1.94 116.57 116.15 2nsj h LYS 153 Ca 0.21 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.92 2nsj h LYS 153 Cb 0.27 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 2nsj h LYS 153 CO -0.01 0.23 0.21 0.00 -0.57 0.00 0.00 179.45 179.31 2nsj h ALA 154 N 1.22 0.78 -0.38 3.86 0.00 -0.66 -1.09 119.26 122.98 2nsj h ALA 154 Ca 0.17 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 2nsj h ALA 154 Cb 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2nsj h ALA 154 CO -0.14 0.43 -0.17 1.96 0.00 0.00 0.00 179.25 181.34 2nsj h GLN 155 N 0.84 0.71 0.13 0.00 1.08 -1.14 -1.75 115.11 114.98 2nsj h GLN 155 Ca 0.20 -0.26 -0.01 0.00 -1.45 0.00 0.00 58.65 57.13 2nsj h GLN 155 Cb 0.25 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.63 2nsj h GLN 155 CO -0.01 0.84 -0.06 1.15 -0.95 0.00 0.00 178.83 179.80 2nsj h THR 156 N 0.64 1.04 -0.16 -0.54 2.02 -1.15 -3.14 112.91 111.62 2nsj h THR 156 Ca 0.10 -1.01 -0.02 0.00 0.77 0.00 0.00 66.41 66.25 2nsj h THR 156 Cb 0.64 1.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.68 2nsj h THR 156 CO 0.04 0.23 0.02 0.44 0.37 0.00 0.00 175.52 176.62 2nsj h ASP 157 N -0.68 0.20 -0.94 4.18 3.32 -1.22 -0.59 116.42 120.68 2nsj h ASP 157 Ca -0.02 -0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.05 2nsj h ASP 157 Cb 0.51 -0.05 -0.06 0.00 0.22 0.00 0.00 39.33 39.95 2nsj h ASP 157 CO 0.03 0.23 0.61 -0.08 -1.72 0.00 0.00 179.24 178.31 2nsj h GLU 158 N 0.22 1.15 -0.07 3.56 4.81 -1.32 0.22 114.58 123.16 2nsj h GLU 158 Ca 0.05 -0.07 -0.11 0.00 -0.13 0.00 0.00 59.36 59.10 2nsj h GLU 158 Cb 0.13 -0.26 0.01 0.00 0.63 0.00 0.00 28.75 29.26 2nsj h GLU 158 CO 0.00 0.76 -0.40 0.28 -0.73 0.00 0.00 179.01 178.92 2nsj h VAL 159 N 1.19 1.42 -0.42 0.32 2.07 -1.26 -3.21 116.25 116.35 2nsj h VAL 159 Ca 0.38 -1.81 0.04 0.00 0.82 0.00 0.00 66.70 66.12 2nsj h VAL 159 Cb 0.01 2.35 -0.04 0.00 -1.52 0.00 0.00 31.29 32.09 2nsj h VAL 159 CO -0.12 0.53 0.20 -0.07 0.02 0.00 0.00 177.57 178.12 2nsj h LEU 160 N -0.09 0.28 -0.17 2.57 3.38 -0.69 -1.98 115.31 118.60 2nsj h LEU 160 Ca -0.03 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2nsj h LEU 160 Cb 1.07 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2nsj h LEU 160 CO 0.08 0.20 0.00 -1.84 0.09 0.00 0.00 178.44 176.97 2nsj n GLU 161 N -4.93 1.00 -2.89 1.13 0.28 0.74 -3.78 120.64 112.19 2nsj n GLU 161 Ca 0.02 0.00 -0.12 0.00 -0.16 0.00 0.00 57.16 56.90 2nsj n GLU 161 Cb 0.12 -1.09 0.02 0.00 1.43 0.00 0.00 31.44 31.92 2nsj n GLU 161 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2nsj n ASN 162 N -0.41 0.35 0.16 -1.84 3.02 -0.75 -4.99 115.26 110.80 2nsj n ASN 162 Ca 0.00 -2.93 0.03 0.00 -0.03 0.00 0.00 54.58 51.65 2nsj n ASN 162 Cb 0.04 -0.09 0.42 0.00 -0.61 0.00 0.00 39.78 39.55 2nsj n ASN 162 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2nsj h PRO 163 N 2.89 0.13 -4.85 3.52 0.13 -1.64 -3.42 132.00 128.77 2nsj h PRO 163 Ca -0.04 -0.03 -0.69 0.00 -0.87 0.00 0.00 66.00 64.37 2nsj h PRO 163 Cb 1.10 -0.02 -0.19 0.00 0.13 0.00 0.00 31.00 32.02 2nsj h PRO 163 CO 0.39 0.32 -0.19 0.34 -0.23 0.00 0.00 178.00 178.63 2nsj s ASP 164 N -6.93 6.20 0.58 1.44 3.68 -1.26 -4.93 116.67 115.45 2nsj s ASP 164 Ca -0.05 -0.73 0.37 0.00 2.13 0.00 0.00 52.55 54.27 2nsj s ASP 164 Cb 0.15 -2.23 1.67 0.00 -1.45 0.00 0.00 42.92 41.06 2nsj s ASP 164 CO 0.72 -0.62 2.09 1.55 0.13 0.00 0.00 175.17 179.05 2nsj h PRO 165 N 8.76 0.00 -7.23 4.34 0.13 -2.02 -3.45 132.00 132.53 2nsj h PRO 165 Ca -0.27 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.35 2nsj h PRO 165 Cb 1.11 0.00 0.12 0.00 0.13 0.00 0.00 31.00 32.36 2nsj h PRO 165 CO 0.82 0.00 0.36 1.03 -0.23 0.00 0.00 178.00 179.97 2nsj s ARG 166 N -3.80 2.55 0.37 0.86 0.52 -1.26 -5.00 118.95 113.19 2nsj s ARG 166 Ca -0.01 1.37 -0.25 0.00 -0.52 0.00 0.00 55.73 56.32 2nsj s ARG 166 Cb 0.10 -1.92 -0.09 0.00 0.52 0.00 0.00 34.95 33.56 2nsj s ARG 166 CO 0.50 -1.44 1.08 0.20 0.02 0.00 0.00 175.30 175.66 2nsj s GLY 167 N -2.75 2.84 0.00 -3.53 0.00 -1.26 -5.18 107.32 97.44 2nsj s GLY 167 Ca 0.66 0.80 0.00 0.00 0.00 0.00 0.00 44.72 46.18 2nsj s GLY 167 CO 0.46 1.28 0.42 0.00 0.00 0.00 0.00 173.10 175.26