#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nng n HIS 4 N 0.00 0.45 -1.98 4.41 -0.00 -1.26 -5.10 115.22 111.73 2nng n HIS 4 Ca 0.00 -1.13 -0.31 0.00 -0.00 0.00 0.00 57.72 56.28 2nng n HIS 4 Cb 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 29.99 29.85 2nng n HIS 4 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.34 178.01 2nng s TRP 5 N -1.42 3.45 0.00 4.41 1.48 -1.26 -4.86 118.94 120.74 2nng s TRP 5 Ca 0.30 1.37 0.00 0.00 -1.06 0.00 0.00 56.10 56.72 2nng s TRP 5 Cb 0.36 -2.79 0.00 0.00 -1.16 0.00 0.00 33.47 29.88 2nng s TRP 5 CO -0.12 -0.72 0.00 0.41 -4.06 0.00 0.00 176.95 172.47 2nng n GLY 6 N -2.18 2.79 0.02 3.67 0.00 -0.17 -5.02 105.19 104.30 2nng n GLY 6 Ca 0.07 -0.25 0.01 0.00 0.00 0.00 0.00 46.02 45.85 2nng n GLY 6 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2nng n TYR 7 N 0.00 0.00 -1.97 1.61 4.01 -1.26 -3.76 117.16 115.79 2nng n TYR 7 Ca 0.00 -0.42 -0.29 0.00 -0.16 0.00 0.00 57.90 57.03 2nng n TYR 7 Cb 0.00 -0.05 0.15 0.00 -0.31 0.00 0.00 39.34 39.14 2nng n TYR 7 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 2nng s GLY 8 N -0.94 1.73 0.36 2.72 0.00 -1.26 -4.66 107.32 105.26 2nng s GLY 8 Ca 0.03 -1.09 0.04 0.00 0.00 0.00 0.00 44.72 43.70 2nng s GLY 8 CO 0.00 -0.42 1.95 1.70 0.00 0.00 0.00 173.10 176.33 2nng h LYS 9 N -1.40 0.60 -0.01 2.90 3.64 -1.97 0.13 116.57 120.45 2nng h LYS 9 Ca -0.44 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 2nng h LYS 9 Cb 1.26 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 2nng h LYS 9 CO 0.46 0.51 -0.63 0.72 -2.27 0.00 0.00 179.45 178.24 2nng n HIS 10 N -4.36 0.00 -1.00 1.91 8.25 -1.26 -4.41 115.22 114.34 2nng n HIS 10 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 2nng n HIS 10 Cb 0.16 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.26 2nng n HIS 10 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2nng n ASN 11 N -0.48 0.13 -2.45 0.41 6.94 -1.13 -4.95 115.26 113.72 2nng n ASN 11 Ca 0.08 -1.12 -0.06 0.00 -0.02 0.00 0.00 54.58 53.45 2nng n ASN 11 Cb 0.43 -0.01 0.04 0.00 -2.36 0.00 0.00 39.78 37.88 2nng n ASN 11 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2nng n GLY 12 N -0.04 -0.98 0.49 4.83 0.00 0.42 -1.00 105.19 108.92 2nng n GLY 12 Ca 0.00 -1.71 0.31 0.00 0.00 0.00 0.00 46.02 44.62 2nng n GLY 12 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2nng h PRO 13 N 0.00 0.09 0.00 1.61 0.11 -1.83 0.29 132.00 132.27 2nng h PRO 13 Ca -0.10 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.01 2nng h PRO 13 Cb 0.27 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.36 2nng h PRO 13 CO 0.07 0.06 0.00 0.39 -0.21 0.00 0.00 178.00 178.31 2nng n GLU 14 N -4.31 0.10 -0.00 1.05 -0.58 -1.26 -2.90 120.64 112.74 2nng n GLU 14 Ca 0.25 0.25 0.10 0.00 -0.42 0.00 0.00 57.16 57.34 2nng n GLU 14 Cb 1.12 -1.66 -0.14 0.00 -0.57 0.00 0.00 31.44 30.20 2nng n GLU 14 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 2nng n HIS 15 N -1.84 0.00 0.14 -0.32 8.25 0.10 -4.63 115.22 116.92 2nng n HIS 15 Ca 0.04 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.56 2nng n HIS 15 Cb 0.26 -0.24 0.52 0.00 1.12 0.00 0.00 29.99 31.66 2nng n HIS 15 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 2nng h TRP 16 N 0.00 0.24 0.00 4.41 6.55 -1.41 -2.48 115.95 123.26 2nng h TRP 16 Ca 0.00 0.00 -0.00 0.00 0.95 0.00 0.00 58.89 59.84 2nng h TRP 16 Cb 0.72 -0.08 -0.00 0.00 -0.86 0.00 0.00 29.16 28.94 2nng h TRP 16 CO 0.00 0.18 -0.02 1.12 -1.05 0.00 0.00 178.44 178.67 2nng h HIS 17 N 0.25 0.00 -0.32 0.49 2.07 -1.80 0.40 115.15 116.25 2nng h HIS 17 Ca 0.07 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.45 2nng h HIS 17 Cb 0.02 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.99 2nng h HIS 17 CO 0.00 0.02 -0.36 0.87 -3.07 0.00 0.00 177.93 175.38 2nng h LYS 18 N 0.00 0.74 0.00 5.12 1.57 -1.79 -2.71 116.57 119.49 2nng h LYS 18 Ca -0.00 -0.36 -0.10 0.00 -1.87 0.00 0.00 60.65 58.32 2nng h LYS 18 Cb 0.06 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 2nng h LYS 18 CO 0.00 0.98 -1.45 -0.25 -0.57 0.00 0.00 179.45 178.17 2nng n ASP 19 N -4.05 0.64 -3.55 0.86 8.00 -1.01 -4.64 116.55 112.81 2nng n ASP 19 Ca -0.01 0.27 -0.27 0.00 0.71 0.00 0.00 54.79 55.48 2nng n ASP 19 Cb 0.51 0.64 -0.10 0.00 -0.02 0.00 0.00 41.12 42.15 2nng n ASP 19 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2nng n PHE 20 N -2.70 1.21 0.30 1.24 3.72 0.10 -4.98 117.46 116.35 2nng n PHE 20 Ca -0.07 -3.80 0.20 0.00 -0.05 0.00 0.00 57.45 53.73 2nng n PHE 20 Cb 0.72 -0.24 1.08 0.00 -0.94 0.00 0.00 39.48 40.10 2nng n PHE 20 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2nng h PRO 21 N 5.13 0.00 0.00 -1.08 0.13 -1.72 0.39 132.00 134.85 2nng h PRO 21 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 2nng h PRO 21 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 2nng h PRO 21 CO 0.57 0.00 0.00 1.51 -0.23 0.00 0.00 178.00 179.85 2nng n ILE 22 N -2.90 1.24 -0.12 -3.56 3.06 -1.26 -2.19 119.36 113.63 2nng n ILE 22 Ca -0.03 0.52 0.27 0.00 -2.50 0.00 0.00 62.75 61.01 2nng n ILE 22 Cb 0.07 -1.48 0.72 0.00 0.54 0.00 0.00 39.64 39.49 2nng n ILE 22 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2nng h ALA 23 N 2.11 2.70 -0.61 1.51 0.00 -1.23 0.30 119.26 124.04 2nng h ALA 23 Ca 0.00 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 2nng h ALA 23 Cb 0.10 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 2nng h ALA 23 CO 0.00 -1.04 0.09 1.63 0.00 0.00 0.00 179.25 179.93 2nng n LYS 24 N -4.11 4.44 -0.58 0.00 5.02 -0.93 -4.96 118.16 117.05 2nng n LYS 24 Ca 0.16 -3.03 -0.10 0.00 -2.02 0.00 0.00 58.31 53.32 2nng n LYS 24 Cb 0.91 -2.23 0.07 0.00 -0.02 0.00 0.00 35.03 33.76 2nng n LYS 24 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2nng n GLY 25 N 0.38 -1.49 0.03 0.72 0.00 0.11 -4.99 105.19 99.94 2nng n GLY 25 Ca 0.31 -1.64 0.12 0.00 0.00 0.00 0.00 46.02 44.81 2nng n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2nng n GLU 26 N -2.05 0.13 -2.96 1.61 -0.58 -1.26 -4.32 120.64 111.20 2nng n GLU 26 Ca 0.05 0.05 -0.14 0.00 -0.42 0.00 0.00 57.16 56.70 2nng n GLU 26 Cb 0.19 -1.59 0.01 0.00 -0.57 0.00 0.00 31.44 29.49 2nng n GLU 26 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2nng n ARG 27 N -1.78 1.04 -3.00 3.49 1.85 -1.26 -4.57 116.66 112.43 2nng n ARG 27 Ca 0.05 -3.02 -0.31 0.00 -1.00 0.00 0.00 57.85 53.57 2nng n ARG 27 Cb 0.38 -1.37 -0.04 0.00 -1.05 0.00 0.00 32.46 30.38 2nng n ARG 27 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 2nng s GLN 28 N -2.00 3.82 0.20 2.89 -1.52 -1.26 -2.64 119.66 119.16 2nng s GLN 28 Ca 0.33 0.47 0.09 0.00 -1.95 0.00 0.00 55.36 54.29 2nng s GLN 28 Cb 0.37 -2.44 -0.05 0.00 -0.22 0.00 0.00 33.01 30.68 2nng s GLN 28 CO -0.05 0.05 -0.17 -1.12 -0.25 0.00 0.00 175.29 173.76 2nng s SER 29 N -2.89 2.80 1.00 5.90 0.01 -1.26 -4.67 113.70 114.59 2nng s SER 29 Ca 0.51 -0.96 -0.16 0.00 1.31 0.00 0.00 55.95 56.65 2nng s SER 29 Cb -0.10 -0.17 0.21 0.00 0.21 0.00 0.00 66.02 66.16 2nng s SER 29 CO 0.27 -0.08 1.24 -0.81 0.41 0.00 0.00 173.24 174.27 2nng n PRO 30 N -0.17 -1.23 -4.16 12.44 -0.04 -1.26 -4.51 135.00 136.07 2nng n PRO 30 Ca -0.09 -1.91 -0.10 0.00 -0.04 0.00 0.00 63.50 61.35 2nng n PRO 30 Cb 0.59 -1.28 -0.10 0.00 -0.04 0.00 0.00 33.50 32.67 2nng n PRO 30 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2nng s VAL 31 N -3.70 0.52 0.11 0.52 -7.23 -1.26 -0.32 120.40 109.03 2nng s VAL 31 Ca 0.70 -1.91 -0.30 0.00 -1.81 0.00 0.00 61.98 58.66 2nng s VAL 31 Cb -0.02 -1.76 -0.06 0.00 0.56 0.00 0.00 36.38 35.10 2nng s VAL 31 CO 0.49 -0.79 1.00 -0.62 -0.31 0.00 0.00 175.10 174.87 2nng s ASP 32 N -3.04 7.42 -0.50 4.85 2.15 -1.26 -2.99 116.67 123.30 2nng s ASP 32 Ca 0.14 1.85 -0.17 0.00 0.43 0.00 0.00 52.55 54.80 2nng s ASP 32 Cb 0.06 -2.59 0.08 0.00 -0.30 0.00 0.00 42.92 40.17 2nng s ASP 32 CO -0.04 -0.13 0.50 -0.63 -0.17 0.00 0.00 175.17 174.70 2nng s ILE 33 N 0.09 5.10 -0.48 4.11 1.01 0.59 -4.94 121.20 126.68 2nng s ILE 33 Ca 0.48 -0.96 -0.25 0.00 0.00 0.00 0.00 60.65 59.92 2nng s ILE 33 Cb -0.25 -4.24 0.03 0.00 0.01 0.00 0.00 42.46 38.02 2nng s ILE 33 CO 0.31 -0.73 0.93 -0.62 0.00 0.00 0.00 174.94 174.83 2nng s ASP 34 N 2.85 6.46 0.43 3.58 -1.08 -1.26 -0.59 116.67 127.06 2nng s ASP 34 Ca 0.08 0.00 0.20 0.00 -0.52 0.00 0.00 52.55 52.30 2nng s ASP 34 Cb -0.24 -2.45 1.00 0.00 -1.46 0.00 0.00 42.92 39.78 2nng s ASP 34 CO 0.08 -1.09 1.91 0.71 0.52 0.00 0.00 175.17 177.29 2nng h THR 35 N 6.07 0.91 0.00 1.71 1.35 -1.95 -1.51 112.91 119.49 2nng h THR 35 Ca -0.25 -0.99 0.00 0.00 -0.55 0.00 0.00 66.41 64.62 2nng h THR 35 Cb 1.07 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 2nng h THR 35 CO 1.04 0.26 -0.24 0.45 -0.25 0.00 0.00 175.52 176.78 2nng h HIS 36 N 0.00 0.00 0.00 4.73 3.86 -2.03 -3.29 115.15 118.41 2nng h HIS 36 Ca -0.00 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.16 2nng h HIS 36 Cb 0.56 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.02 2nng h HIS 36 CO 0.00 0.00 -1.85 2.41 0.86 0.00 0.00 177.93 179.35 2nng n THR 37 N -2.70 0.29 -1.87 2.45 -1.04 -0.83 -4.93 114.28 105.65 2nng n THR 37 Ca 0.04 -0.55 -0.41 0.00 -2.04 0.00 0.00 64.05 61.09 2nng n THR 37 Cb 0.50 -0.13 -0.00 0.00 -1.82 0.00 0.00 70.33 68.87 2nng n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2nng s ALA 38 N -3.37 3.53 -0.11 2.41 0.00 -0.63 -4.87 121.76 118.72 2nng s ALA 38 Ca -0.07 1.50 -0.01 0.00 0.00 0.00 0.00 51.96 53.38 2nng s ALA 38 Cb 0.12 -3.58 -0.03 0.00 0.00 0.00 0.00 23.12 19.64 2nng s ALA 38 CO 0.88 -0.98 -0.08 0.21 0.00 0.00 0.00 175.76 175.79 2nng s LYS 39 N -2.07 3.15 0.24 0.00 2.20 -0.86 -4.82 119.74 117.59 2nng s LYS 39 Ca 0.53 -0.58 -0.31 0.00 -0.36 0.00 0.00 55.97 55.25 2nng s LYS 39 Cb -0.45 -2.68 -0.11 0.00 -1.51 0.00 0.00 37.83 33.08 2nng s LYS 39 CO 0.60 0.44 1.62 -0.47 -0.36 0.00 0.00 175.35 177.18 2nng s TYR 40 N -0.20 2.87 -0.30 4.03 5.04 -1.26 -0.52 117.35 127.01 2nng s TYR 40 Ca 0.02 0.62 0.03 0.00 -2.44 0.00 0.00 57.07 55.31 2nng s TYR 40 Cb -0.13 -4.06 0.08 0.00 0.35 0.00 0.00 41.96 38.20 2nng s TYR 40 CO 0.03 -3.76 -0.02 0.34 -1.34 0.00 0.00 175.55 170.80 2nng s ASP 41 N 0.82 4.64 0.05 4.32 -1.08 -0.60 -4.85 116.67 119.97 2nng s ASP 41 Ca 0.68 -1.78 0.12 0.00 -0.52 0.00 0.00 52.55 51.05 2nng s ASP 41 Cb -0.47 -1.60 0.52 0.00 -1.46 0.00 0.00 42.92 39.90 2nng s ASP 41 CO 0.40 -0.29 1.37 -2.65 0.52 0.00 0.00 175.17 174.51 2nng n PRO 42 N 4.35 0.03 0.14 4.34 -0.02 -1.26 -2.26 135.00 140.33 2nng n PRO 42 Ca -0.05 0.37 0.13 0.00 -2.02 0.00 0.00 63.50 61.93 2nng n PRO 42 Cb 0.42 -1.57 0.40 0.00 -0.02 0.00 0.00 33.50 32.73 2nng n PRO 42 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2nng h SER 43 N 0.00 0.00 -3.09 2.55 4.64 -1.97 -3.44 113.55 112.24 2nng h SER 43 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 2nng h SER 43 Cb 0.18 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.30 2nng h SER 43 CO 0.00 0.00 0.75 -0.76 -0.87 0.00 0.00 176.83 175.95 2nng s LEU 44 N -4.88 4.38 0.60 5.97 1.43 -0.96 -5.02 118.68 120.21 2nng s LEU 44 Ca 0.08 2.46 -0.04 0.00 -1.03 0.00 0.00 54.13 55.61 2nng s LEU 44 Cb 0.10 -3.60 0.03 0.00 0.03 0.00 0.00 46.19 42.76 2nng s LEU 44 CO 0.56 -0.68 0.88 -0.54 0.23 0.00 0.00 176.35 176.81 2nng s LYS 45 N 0.65 2.59 0.49 1.70 1.02 -1.19 -4.95 119.74 120.05 2nng s LYS 45 Ca 0.64 -0.35 -0.23 0.00 0.02 0.00 0.00 55.97 56.04 2nng s LYS 45 Cb -0.39 -2.33 -0.07 0.00 -0.52 0.00 0.00 37.83 34.52 2nng s LYS 45 CO 0.34 -0.84 1.32 -2.30 -0.92 0.00 0.00 175.35 172.95 2nng n PRO 46 N -2.58 1.82 -2.48 -1.68 -0.02 -1.26 -2.02 135.00 126.78 2nng n PRO 46 Ca 0.06 0.66 -0.41 0.00 -2.02 0.00 0.00 63.50 61.79 2nng n PRO 46 Cb 0.59 -2.50 -0.04 0.00 -0.02 0.00 0.00 33.50 31.53 2nng n PRO 46 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2nng s LEU 47 N -2.66 4.51 -0.26 2.45 2.96 -1.26 -1.52 118.68 122.90 2nng s LEU 47 Ca 0.67 2.18 0.03 0.00 -0.22 0.00 0.00 54.13 56.78 2nng s LEU 47 Cb -0.45 -3.61 0.06 0.00 0.50 0.00 0.00 46.19 42.69 2nng s LEU 47 CO 0.53 -0.21 -0.09 -0.55 -1.32 0.00 0.00 176.35 174.71 2nng s SER 48 N -0.37 4.33 -0.38 3.68 0.15 -0.05 -4.88 113.70 116.18 2nng s SER 48 Ca 0.48 -1.38 -0.11 0.00 0.70 0.00 0.00 55.95 55.64 2nng s SER 48 Cb -0.31 -1.47 0.03 0.00 -1.71 0.00 0.00 66.02 62.56 2nng s SER 48 CO 0.37 -0.21 0.22 -0.69 1.20 0.00 0.00 173.24 174.13 2nng s VAL 49 N 1.16 4.61 -0.59 4.45 1.01 -1.26 -1.28 120.40 128.50 2nng s VAL 49 Ca -0.08 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.06 2nng s VAL 49 Cb -0.20 -3.59 0.15 0.00 0.00 0.00 0.00 36.38 32.74 2nng s VAL 49 CO -0.05 -0.26 0.35 -0.44 0.00 0.00 0.00 175.10 174.70 2nng s SER 50 N 1.58 4.61 0.00 3.32 0.01 0.18 -4.89 113.70 118.51 2nng s SER 50 Ca 0.02 -3.20 0.13 0.00 1.31 0.00 0.00 55.95 54.21 2nng s SER 50 Cb -0.19 -1.68 0.24 0.00 0.21 0.00 0.00 66.02 64.60 2nng s SER 50 CO 0.07 -0.22 1.12 -1.22 0.41 0.00 0.00 173.24 173.41 2nng n TYR 51 N 2.88 0.29 -0.23 2.43 4.01 -1.26 -1.06 117.16 124.22 2nng n TYR 51 Ca 0.09 -0.27 0.17 0.00 -0.16 0.00 0.00 57.90 57.73 2nng n TYR 51 Cb 0.34 -0.01 0.48 0.00 -0.31 0.00 0.00 39.34 39.84 2nng n TYR 51 CO 0.00 0.00 0.00 0.22 -0.46 0.00 0.00 176.86 176.62 2nng h ASP 52 N 2.49 0.45 -0.52 7.72 3.58 -1.90 -1.32 116.42 126.93 2nng h ASP 52 Ca 0.00 0.04 -0.07 0.00 0.42 0.00 0.00 57.03 57.42 2nng h ASP 52 Cb 0.67 -0.05 -0.04 0.00 1.72 0.00 0.00 39.33 41.63 2nng h ASP 52 CO 0.00 0.20 0.07 0.00 -2.88 0.00 0.00 179.24 176.64 2nng n GLN 53 N -4.52 3.84 -1.80 0.28 1.13 -1.14 -5.01 117.38 110.16 2nng n GLN 53 Ca 0.18 -3.06 -0.41 0.00 -1.94 0.00 0.00 57.00 51.77 2nng n GLN 53 Cb 0.61 -2.11 -0.00 0.00 0.11 0.00 0.00 30.24 28.85 2nng n GLN 53 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2nng s ALA 54 N -2.88 3.60 -0.41 -1.58 0.00 -0.50 -4.57 121.76 115.42 2nng s ALA 54 Ca 0.51 1.57 0.03 0.00 0.00 0.00 0.00 51.96 54.07 2nng s ALA 54 Cb 0.40 -3.62 0.12 0.00 0.00 0.00 0.00 23.12 20.02 2nng s ALA 54 CO 0.12 -1.05 0.17 0.99 0.00 0.00 0.00 175.76 175.99 2nng s THR 55 N -0.97 1.92 0.53 0.00 2.01 -1.26 -4.94 115.64 112.93 2nng s THR 55 Ca 0.54 -2.52 -0.18 0.00 0.31 0.00 0.00 61.69 59.84 2nng s THR 55 Cb -0.47 -2.38 -0.07 0.00 0.01 0.00 0.00 72.50 69.60 2nng s THR 55 CO 0.61 -0.74 1.04 -0.94 -0.69 0.00 0.00 174.62 173.89 2nng s SER 56 N 0.54 6.18 0.00 3.53 1.04 -1.26 -0.80 113.70 122.93 2nng s SER 56 Ca 0.14 1.84 0.00 0.00 0.48 0.00 0.00 55.95 58.41 2nng s SER 56 Cb -0.22 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.35 2nng s SER 56 CO -0.07 -0.89 0.00 0.18 0.98 0.00 0.00 173.24 173.44 2nng n LEU 57 N -1.41 1.24 -3.56 2.42 4.77 0.88 -4.00 117.00 117.33 2nng n LEU 57 Ca 0.09 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.94 2nng n LEU 57 Cb 0.53 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.57 2nng n LEU 57 CO 0.43 0.17 0.28 -0.60 -1.33 0.00 0.00 177.39 176.34 2nng s ARG 58 N -1.92 1.08 -0.05 3.23 3.52 -1.22 -1.40 118.95 122.19 2nng s ARG 58 Ca 0.00 -0.34 0.05 0.00 -0.13 0.00 0.00 55.73 55.32 2nng s ARG 58 Cb 0.00 0.49 -0.01 0.00 -1.56 0.00 0.00 34.95 33.87 2nng s ARG 58 CO 0.00 -0.41 -0.21 -1.50 -0.81 0.00 0.00 175.30 172.37 2nng s ILE 59 N -2.84 1.76 -0.04 4.11 2.07 -0.29 -0.71 121.20 125.27 2nng s ILE 59 Ca -0.03 -0.91 0.01 0.00 -1.41 0.00 0.00 60.65 58.31 2nng s ILE 59 Cb -0.00 -1.50 0.02 0.00 0.13 0.00 0.00 42.46 41.11 2nng s ILE 59 CO -0.05 0.50 -0.06 -0.22 -1.91 0.00 0.00 174.94 173.20 2nng s LEU 60 N -0.11 1.49 -0.43 8.50 2.96 -0.27 -0.80 118.68 130.02 2nng s LEU 60 Ca -0.03 -0.16 -0.23 0.00 -0.22 0.00 0.00 54.13 53.50 2nng s LEU 60 Cb -0.12 -0.50 0.02 0.00 0.50 0.00 0.00 46.19 46.09 2nng s LEU 60 CO 0.03 -0.02 0.77 0.21 -1.32 0.00 0.00 176.35 176.02 2nng s ASN 61 N 0.69 6.43 -0.08 3.68 3.84 -0.11 -0.51 114.94 128.89 2nng s ASN 61 Ca -0.10 -0.04 0.19 0.00 0.21 0.00 0.00 52.86 53.12 2nng s ASN 61 Cb -0.13 -2.38 0.68 0.00 -0.55 0.00 0.00 41.25 38.87 2nng s ASN 61 CO 0.01 -0.86 1.57 -0.46 -2.79 0.00 0.00 177.10 174.57 2nng n ASN 62 N 6.60 4.36 0.00 -4.21 0.23 -0.80 -0.46 115.26 120.97 2nng n ASN 62 Ca 0.02 -2.30 0.00 0.00 -0.53 0.00 0.00 54.58 51.77 2nng n ASN 62 Cb 0.48 -0.54 0.00 0.00 -2.08 0.00 0.00 39.78 37.64 2nng n ASN 62 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2nng n GLY 63 N 1.27 1.63 0.00 4.83 0.00 -1.26 -4.77 105.19 106.88 2nng n GLY 63 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2nng n GLY 63 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2nng n HIS 64 N -2.00 0.00 -2.81 1.61 8.25 -1.26 -4.71 115.22 114.30 2nng n HIS 64 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2nng n HIS 64 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2nng n HIS 64 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2nng n ALA 65 N -1.98 0.00 -2.32 -1.41 0.00 -1.26 -4.87 120.51 108.66 2nng n ALA 65 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 2nng n ALA 65 Cb 0.41 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.70 2nng n ALA 65 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2nng s PHE 66 N -6.47 2.32 -0.11 0.00 -0.71 -1.26 -1.91 117.98 109.84 2nng s PHE 66 Ca 0.00 -0.43 0.00 0.00 -1.04 0.00 0.00 56.93 55.46 2nng s PHE 66 Cb 0.00 -1.46 -0.02 0.00 -1.21 0.00 0.00 43.02 40.33 2nng s PHE 66 CO 0.00 0.01 -0.11 -0.80 -1.34 0.00 0.00 175.22 172.98 2nng s ASN 67 N -0.80 4.21 -0.31 1.98 0.02 0.34 -4.27 114.94 116.10 2nng s ASN 67 Ca 0.10 -0.24 -0.17 0.00 -1.02 0.00 0.00 52.86 51.54 2nng s ASN 67 Cb -0.10 -1.44 -0.02 0.00 0.02 0.00 0.00 41.25 39.71 2nng s ASN 67 CO -0.00 0.22 0.46 -0.69 0.02 0.00 0.00 177.10 177.11 2nng s VAL 68 N 0.02 5.09 -0.05 1.60 1.01 0.17 -1.12 120.40 127.13 2nng s VAL 68 Ca -0.03 0.44 -0.04 0.00 0.00 0.00 0.00 61.98 62.35 2nng s VAL 68 Cb -0.14 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 2nng s VAL 68 CO 0.04 -0.06 0.15 -1.61 0.00 0.00 0.00 175.10 173.62 2nng s GLU 69 N 2.24 3.39 0.18 2.72 2.02 0.11 -1.04 118.70 128.32 2nng s GLU 69 Ca 0.17 -0.28 0.10 0.00 0.02 0.00 0.00 54.97 54.98 2nng s GLU 69 Cb -0.16 -3.09 -0.04 0.00 0.10 0.00 0.00 34.13 30.94 2nng s GLU 69 CO 0.12 0.71 -0.18 -0.06 0.02 0.00 0.00 175.26 175.86 2nng s PHE 70 N -1.21 2.44 -0.42 1.61 0.40 -0.42 -0.09 117.98 120.30 2nng s PHE 70 Ca 0.23 -0.30 -0.29 0.00 -0.60 0.00 0.00 56.93 55.97 2nng s PHE 70 Cb -0.12 -1.21 0.01 0.00 0.51 0.00 0.00 43.02 42.21 2nng s PHE 70 CO 0.13 0.50 1.39 0.34 0.70 0.00 0.00 175.22 178.28 2nng s ASP 71 N -2.70 6.36 -0.27 1.36 2.15 0.02 -4.84 116.67 118.75 2nng s ASP 71 Ca 0.22 0.79 0.11 0.00 0.43 0.00 0.00 52.55 54.11 2nng s ASP 71 Cb -0.08 -2.54 0.53 0.00 -0.30 0.00 0.00 42.92 40.53 2nng s ASP 71 CO 0.12 -1.42 1.50 -0.90 -0.17 0.00 0.00 175.17 174.29 2nng n ASP 72 N 8.76 3.12 0.00 -0.34 5.75 -1.26 -4.59 116.55 127.98 2nng n ASP 72 Ca 0.16 -3.49 0.13 0.00 -0.01 0.00 0.00 54.79 51.58 2nng n ASP 72 Cb 0.48 -0.63 0.63 0.00 -1.03 0.00 0.00 41.12 40.57 2nng n ASP 72 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2nng n SER 73 N -0.90 0.00 -3.90 -1.12 3.41 -1.26 -4.85 113.62 105.01 2nng n SER 73 Ca 0.32 0.08 -0.09 0.00 -0.26 0.00 0.00 58.87 58.91 2nng n SER 73 Cb 1.05 -0.35 -0.05 0.00 -0.26 0.00 0.00 64.21 64.61 2nng n SER 73 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2nng s GLN 74 N -2.69 1.47 -0.98 4.33 -0.21 -1.26 -5.06 119.66 115.26 2nng s GLN 74 Ca 0.21 -1.09 -0.18 0.00 0.02 0.00 0.00 55.36 54.32 2nng s GLN 74 Cb 0.17 0.49 -0.10 0.00 1.00 0.00 0.00 33.01 34.58 2nng s GLN 74 CO 0.42 -0.62 2.05 -0.25 -2.12 0.00 0.00 175.29 174.78 2nng n ASP 75 N -0.36 3.32 0.10 5.90 8.00 -1.26 -4.65 116.55 127.61 2nng n ASP 75 Ca -0.05 -2.67 0.04 0.00 0.71 0.00 0.00 54.79 52.81 2nng n ASP 75 Cb 0.62 -1.26 -0.01 0.00 -0.02 0.00 0.00 41.12 40.46 2nng n ASP 75 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2nng h LYS 76 N 7.16 0.00 -1.84 -1.24 1.79 -1.86 -3.44 116.57 117.15 2nng h LYS 76 Ca 0.48 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.83 2nng h LYS 76 Cb 0.59 0.00 -0.29 0.00 -1.58 0.00 0.00 32.23 30.95 2nng h LYS 76 CO 1.88 0.30 -0.45 0.00 -1.08 0.00 0.00 179.45 180.10 2nng s ALA 77 N -3.03 -1.22 0.09 3.86 0.00 -1.26 -2.33 121.76 117.86 2nng s ALA 77 Ca 0.01 1.05 0.02 0.00 0.00 0.00 0.00 51.96 53.04 2nng s ALA 77 Cb 0.08 -1.71 -0.04 0.00 0.00 0.00 0.00 23.12 21.46 2nng s ALA 77 CO 0.77 -1.24 -0.07 0.14 0.00 0.00 0.00 175.76 175.37 2nng s VAL 78 N 2.58 0.65 -0.09 0.00 -7.23 -0.23 -0.93 120.40 115.16 2nng s VAL 78 Ca 0.13 -1.80 0.04 0.00 -1.81 0.00 0.00 61.98 58.54 2nng s VAL 78 Cb -0.15 -1.51 -0.01 0.00 0.56 0.00 0.00 36.38 35.27 2nng s VAL 78 CO -0.16 -0.80 -0.21 -0.22 -0.31 0.00 0.00 175.10 173.39 2nng s LEU 79 N -2.81 2.26 0.29 1.32 2.96 0.04 -0.65 118.68 122.08 2nng s LEU 79 Ca 0.08 -0.47 -0.03 0.00 -0.22 0.00 0.00 54.13 53.50 2nng s LEU 79 Cb 0.03 -1.45 -0.01 0.00 0.50 0.00 0.00 46.19 45.26 2nng s LEU 79 CO -0.04 0.21 0.37 -0.54 -1.32 0.00 0.00 176.35 175.02 2nng s LYS 80 N 0.07 1.64 2.25 1.98 1.02 -0.40 -1.56 119.74 124.73 2nng s LYS 80 Ca -0.09 -1.65 0.00 0.00 0.02 0.00 0.00 55.97 54.25 2nng s LYS 80 Cb -0.15 0.39 0.00 0.00 -0.52 0.00 0.00 37.83 37.55 2nng s LYS 80 CO 0.06 -0.64 0.00 0.41 -0.92 0.00 0.00 175.35 174.25 2nng n GLY 81 N -0.46 -0.88 7.00 -3.33 0.00 -1.26 -0.87 105.19 105.39 2nng n GLY 81 Ca 0.02 -1.19 0.00 0.00 0.00 0.00 0.00 46.02 44.85 2nng n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nng n GLY 82 N 0.00 3.44 0.18 -0.02 0.00 -0.58 -0.76 105.19 107.45 2nng n GLY 82 Ca 0.00 -0.09 0.15 0.00 0.00 0.00 0.00 46.02 46.08 2nng n GLY 82 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2nng n PRO 83 N 14.00 1.18 -3.15 1.61 -0.04 -1.26 -3.19 135.00 144.15 2nng n PRO 83 Ca 0.00 -0.36 -0.39 0.00 -0.04 0.00 0.00 63.50 62.72 2nng n PRO 83 Cb 0.00 -1.49 -0.06 0.00 -0.04 0.00 0.00 33.50 31.91 2nng n PRO 83 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2nng s LEU 84 N -2.07 4.56 -0.27 1.53 1.43 0.06 -5.05 118.68 118.87 2nng s LEU 84 Ca 0.42 1.42 -0.11 0.00 -1.03 0.00 0.00 54.13 54.84 2nng s LEU 84 Cb 0.21 -3.06 -0.05 0.00 0.03 0.00 0.00 46.19 43.32 2nng s LEU 84 CO 0.37 0.25 0.18 -0.62 0.23 0.00 0.00 176.35 176.76 2nng s ASP 85 N -1.11 5.98 0.00 2.29 2.15 -1.26 -4.20 116.67 120.52 2nng s ASP 85 Ca 0.32 -0.00 0.00 0.00 0.43 0.00 0.00 52.55 53.29 2nng s ASP 85 Cb -0.21 -2.11 0.00 0.00 -0.30 0.00 0.00 42.92 40.30 2nng s ASP 85 CO 0.22 -0.03 0.00 0.61 -0.17 0.00 0.00 175.17 175.80 2nng n GLY 86 N 4.94 -1.05 3.21 2.66 0.00 -1.26 -4.94 105.19 108.74 2nng n GLY 86 Ca -0.14 -1.54 -0.31 0.00 0.00 0.00 0.00 46.02 44.03 2nng n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nng s THR 87 N 0.00 1.93 -0.13 2.61 2.01 -1.26 -4.46 115.64 116.33 2nng s THR 87 Ca 0.00 -0.96 0.03 0.00 0.31 0.00 0.00 61.69 61.07 2nng s THR 87 Cb 0.00 -1.66 0.01 0.00 0.01 0.00 0.00 72.50 70.86 2nng s THR 87 CO 0.00 0.53 -0.22 -0.31 -0.69 0.00 0.00 174.62 173.93 2nng s TYR 88 N 0.24 2.65 -0.09 4.92 1.51 -0.60 -1.26 117.35 124.72 2nng s TYR 88 Ca -0.14 -1.31 -0.15 0.00 -1.01 0.00 0.00 57.07 54.46 2nng s TYR 88 Cb -0.16 -1.80 -0.05 0.00 -0.11 0.00 0.00 41.96 39.84 2nng s TYR 88 CO 0.07 -0.59 0.38 0.50 -1.11 0.00 0.00 175.55 174.80 2nng s ARG 89 N 0.76 4.13 0.08 -0.62 3.52 0.58 -0.78 118.95 126.63 2nng s ARG 89 Ca -0.08 0.30 -0.31 0.00 -0.13 0.00 0.00 55.73 55.51 2nng s ARG 89 Cb -0.16 -3.35 -0.08 0.00 -1.56 0.00 0.00 34.95 29.80 2nng s ARG 89 CO -0.01 0.39 1.52 -1.17 -0.81 0.00 0.00 175.30 175.23 2nng s LEU 90 N -0.07 4.36 -0.11 -0.88 2.96 -0.11 -1.19 118.68 123.64 2nng s LEU 90 Ca 0.22 2.40 0.02 0.00 -0.22 0.00 0.00 54.13 56.54 2nng s LEU 90 Cb -0.15 -3.57 -0.08 0.00 0.50 0.00 0.00 46.19 42.89 2nng s LEU 90 CO 0.09 -0.79 -0.08 0.00 -1.32 0.00 0.00 176.35 174.25 2nng n ILE 91 N 4.39 0.64 -3.52 6.68 3.06 -0.31 -4.50 119.36 125.80 2nng n ILE 91 Ca 0.14 -0.27 -0.10 0.00 -2.50 0.00 0.00 62.75 60.03 2nng n ILE 91 Cb 0.41 -0.88 -0.02 0.00 0.54 0.00 0.00 39.64 39.69 2nng n ILE 91 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2nng s GLN 92 N -2.22 1.17 0.18 9.51 1.03 -1.22 -1.30 119.66 126.81 2nng s GLN 92 Ca -0.14 -0.48 0.06 0.00 0.04 0.00 0.00 55.36 54.84 2nng s GLN 92 Cb 0.04 0.50 -0.05 0.00 0.03 0.00 0.00 33.01 33.54 2nng s GLN 92 CO 0.27 -0.52 -0.12 -0.59 -2.54 0.00 0.00 175.29 171.79 2nng s PHE 93 N -3.51 1.53 0.35 9.60 -0.12 -0.20 -0.65 117.98 124.97 2nng s PHE 93 Ca 0.04 -0.66 -0.14 0.00 -0.05 0.00 0.00 56.93 56.13 2nng s PHE 93 Cb -0.02 -0.74 0.03 0.00 -0.63 0.00 0.00 43.02 41.67 2nng s PHE 93 CO -0.08 0.24 0.70 -3.38 -0.05 0.00 0.00 175.22 172.64 2nng s HIS 94 N -3.12 0.26 0.21 3.49 -3.43 -0.64 -0.65 115.29 111.40 2nng s HIS 94 Ca 0.20 -0.80 0.07 0.00 -0.80 0.00 0.00 55.06 53.73 2nng s HIS 94 Cb 0.01 0.60 -0.05 0.00 -1.43 0.00 0.00 32.58 31.70 2nng s HIS 94 CO 0.04 -1.39 -0.11 -0.06 -2.00 0.00 0.00 174.74 171.22 2nng s PHE 95 N -2.85 1.67 -0.01 0.38 0.40 -1.26 -0.57 117.98 115.74 2nng s PHE 95 Ca 0.18 -0.66 0.06 0.00 -0.60 0.00 0.00 56.93 55.92 2nng s PHE 95 Cb -0.04 -0.84 -0.02 0.00 0.51 0.00 0.00 43.02 42.64 2nng s PHE 95 CO 0.12 0.26 -0.20 -1.01 0.70 0.00 0.00 175.22 175.10 2nng s HIS 96 N -3.08 1.79 0.27 0.36 3.76 -0.11 -4.72 115.29 113.55 2nng s HIS 96 Ca 0.23 -0.34 -0.13 0.00 -0.15 0.00 0.00 55.06 54.67 2nng s HIS 96 Cb 0.01 -1.15 0.00 0.00 1.11 0.00 0.00 32.58 32.56 2nng s HIS 96 CO 0.07 -0.02 0.52 1.67 -0.85 0.00 0.00 174.74 176.12 2nng s TRP 97 N -0.49 0.36 0.53 1.40 -2.14 -1.20 -0.85 118.94 116.54 2nng s TRP 97 Ca 0.08 -0.73 0.07 0.00 2.66 0.00 0.00 56.10 58.17 2nng s TRP 97 Cb -0.08 0.25 0.05 0.00 -3.10 0.00 0.00 33.47 30.59 2nng s TRP 97 CO -0.01 -1.06 0.53 0.20 -2.66 0.00 0.00 176.95 173.95 2nng s GLY 98 N -3.03 2.12 0.31 3.67 0.00 -1.15 -0.84 107.32 108.41 2nng s GLY 98 Ca 0.22 -1.64 0.21 0.00 0.00 0.00 0.00 44.72 43.51 2nng s GLY 98 CO 0.10 -1.82 1.34 1.48 0.00 0.00 0.00 173.10 174.20 2nng h SER 99 N 0.60 0.00 -5.31 1.64 4.64 -1.89 -3.38 113.55 109.85 2nng h SER 99 Ca -0.35 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.82 2nng h SER 99 Cb 1.29 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.23 2nng h SER 99 CO 0.52 0.12 -0.65 -0.76 -0.87 0.00 0.00 176.83 175.18 2nng s LEU 100 N -5.93 2.14 0.47 5.97 1.43 -1.26 -5.06 118.68 116.43 2nng s LEU 100 Ca 0.03 -1.07 0.31 0.00 -1.03 0.00 0.00 54.13 52.37 2nng s LEU 100 Cb 0.07 0.28 1.23 0.00 0.03 0.00 0.00 46.19 47.81 2nng s LEU 100 CO 0.73 -0.66 1.90 0.44 0.23 0.00 0.00 176.35 178.99 2nng h ASP 101 N 3.01 0.00 -0.00 2.29 3.32 -1.92 -2.91 116.42 120.20 2nng h ASP 101 Ca -0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.71 2nng h ASP 101 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2nng h ASP 101 CO 0.63 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.76 2nng n GLY 102 N 0.07 -0.98 3.44 2.75 0.00 -1.26 -3.43 105.19 105.78 2nng n GLY 102 Ca 0.01 -0.08 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 2nng n GLY 102 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2nng s GLN 103 N -2.00 1.27 0.00 1.61 -2.07 -1.10 -4.69 119.66 112.69 2nng s GLN 103 Ca 0.19 -0.74 0.00 0.00 -1.82 0.00 0.00 55.36 52.98 2nng s GLN 103 Cb 0.09 0.52 0.00 0.00 -1.09 0.00 0.00 33.01 32.52 2nng s GLN 103 CO 0.14 -0.53 0.00 0.41 -1.32 0.00 0.00 175.29 173.99 2nng n GLY 104 N -0.31 2.08 3.79 2.60 0.00 -1.00 -3.09 105.19 109.26 2nng n GLY 104 Ca -0.13 -0.18 -0.32 0.00 0.00 0.00 0.00 46.02 45.39 2nng n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nng s SER 105 N 0.00 5.33 -0.13 1.61 1.04 -0.39 -3.27 113.70 117.88 2nng s SER 105 Ca 0.00 1.81 -0.09 0.00 0.48 0.00 0.00 55.95 58.15 2nng s SER 105 Cb 0.00 -2.53 -0.03 0.00 0.10 0.00 0.00 66.02 63.56 2nng s SER 105 CO 0.00 -1.48 -0.18 -0.62 0.98 0.00 0.00 173.24 171.94 2nng n GLU 106 N -2.62 0.43 -1.79 4.02 1.02 -1.26 -4.85 120.64 115.59 2nng n GLU 106 Ca 0.09 0.48 -0.35 0.00 -0.02 0.00 0.00 57.16 57.36 2nng n GLU 106 Cb 0.53 -1.61 0.05 0.00 -0.02 0.00 0.00 31.44 30.40 2nng n GLU 106 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 2nng s HIS 107 N -2.21 2.34 0.18 -0.32 3.76 -1.26 -4.25 115.29 113.53 2nng s HIS 107 Ca -0.15 1.55 0.07 0.00 -0.15 0.00 0.00 55.06 56.38 2nng s HIS 107 Cb 0.02 -3.41 -0.04 0.00 1.11 0.00 0.00 32.58 30.26 2nng s HIS 107 CO 0.22 -2.20 -0.14 0.95 -0.85 0.00 0.00 174.74 172.72 2nng s THR 108 N -1.88 1.61 -0.23 1.30 -4.23 -1.16 -4.71 115.64 106.35 2nng s THR 108 Ca 0.74 -2.10 0.01 0.00 -1.18 0.00 0.00 61.69 59.16 2nng s THR 108 Cb -0.28 -1.93 0.06 0.00 1.34 0.00 0.00 72.50 71.69 2nng s THR 108 CO 0.38 -0.57 -0.07 -0.69 -0.54 0.00 0.00 174.62 173.13 2nng s VAL 109 N -2.83 1.60 -1.56 2.29 1.01 -0.63 -0.30 120.40 119.97 2nng s VAL 109 Ca 0.19 -1.19 -0.15 0.00 0.00 0.00 0.00 61.98 60.84 2nng s VAL 109 Cb -0.01 -1.80 0.10 0.00 0.00 0.00 0.00 36.38 34.66 2nng s VAL 109 CO 0.05 -0.02 0.96 0.47 0.00 0.00 0.00 175.10 176.56 2nng n ASP 110 N 4.66 -4.62 0.00 3.32 8.00 0.24 -0.77 116.55 127.38 2nng n ASP 110 Ca -0.13 -0.81 0.00 0.00 0.71 0.00 0.00 54.79 54.56 2nng n ASP 110 Cb 0.45 -3.72 0.00 0.00 -0.02 0.00 0.00 41.12 37.82 2nng n ASP 110 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2nng n LYS 111 N -4.65 0.00 -2.39 -1.24 4.76 -1.26 -4.99 118.16 108.38 2nng n LYS 111 Ca 0.05 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.07 2nng n LYS 111 Cb 0.52 -2.98 -0.03 0.00 -1.84 0.00 0.00 35.03 30.70 2nng n LYS 111 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2nng s LYS 112 N -0.25 4.40 -0.17 1.97 2.20 0.05 -4.99 119.74 122.96 2nng s LYS 112 Ca 0.00 1.79 -0.13 0.00 -0.36 0.00 0.00 55.97 57.27 2nng s LYS 112 Cb 0.00 -3.38 -0.05 0.00 -1.51 0.00 0.00 37.83 32.90 2nng s LYS 112 CO 0.00 -0.31 0.26 0.15 -0.36 0.00 0.00 175.35 175.08 2nng s LYS 113 N 1.28 4.24 0.64 4.03 1.02 -1.26 -1.60 119.74 128.09 2nng s LYS 113 Ca 0.59 0.02 -0.07 0.00 0.02 0.00 0.00 55.97 56.53 2nng s LYS 113 Cb -0.30 -3.43 0.02 0.00 -0.52 0.00 0.00 37.83 33.61 2nng s LYS 113 CO 0.28 0.24 0.97 0.71 -0.92 0.00 0.00 175.35 176.63 2nng s TYR 114 N 0.48 3.19 0.29 3.18 2.02 -1.26 -4.58 117.35 120.68 2nng s TYR 114 Ca 0.15 0.69 0.21 0.00 -0.37 0.00 0.00 57.07 57.74 2nng s TYR 114 Cb -0.13 -2.91 0.96 0.00 -0.40 0.00 0.00 41.96 39.49 2nng s TYR 114 CO 0.03 -1.03 1.88 0.00 -1.57 0.00 0.00 175.55 174.85 2nng h ALA 115 N -0.37 1.19 -2.51 3.71 0.00 -1.41 -0.95 119.26 118.91 2nng h ALA 115 Ca -0.45 -0.25 0.15 0.00 0.00 0.00 0.00 54.91 54.36 2nng h ALA 115 Cb 1.27 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.95 2nng h ALA 115 CO 0.61 0.34 0.44 0.00 0.00 0.00 0.00 179.25 180.64 2nng s ALA 116 N -3.95 -1.52 -0.10 0.00 0.00 -1.12 -2.93 121.76 112.14 2nng s ALA 116 Ca -0.02 -0.05 -0.05 0.00 0.00 0.00 0.00 51.96 51.84 2nng s ALA 116 Cb 0.12 0.69 0.05 0.00 0.00 0.00 0.00 23.12 23.98 2nng s ALA 116 CO 0.66 -1.04 0.23 -2.00 0.00 0.00 0.00 175.76 173.61 2nng s GLU 117 N -3.24 0.19 -0.12 0.00 2.12 -0.03 -1.10 118.70 116.52 2nng s GLU 117 Ca 0.13 0.53 -0.17 0.00 0.36 0.00 0.00 54.97 55.82 2nng s GLU 117 Cb -0.03 -0.13 -0.04 0.00 0.26 0.00 0.00 34.13 34.20 2nng s GLU 117 CO 0.04 -0.17 0.44 -1.17 -0.54 0.00 0.00 175.26 173.86 2nng s LEU 118 N 1.35 4.29 -0.25 2.70 2.96 0.43 -0.93 118.68 129.23 2nng s LEU 118 Ca -0.08 0.77 -0.00 0.00 -0.22 0.00 0.00 54.13 54.60 2nng s LEU 118 Cb -0.11 -2.63 0.04 0.00 0.50 0.00 0.00 46.19 43.99 2nng s LEU 118 CO -0.08 0.04 -0.08 -1.00 -1.32 0.00 0.00 176.35 173.91 2nng s HIS 119 N 0.46 3.10 -0.38 5.38 3.76 0.27 -0.84 115.29 127.04 2nng s HIS 119 Ca 0.24 -1.80 -0.16 0.00 -0.15 0.00 0.00 55.06 53.19 2nng s HIS 119 Cb -0.15 -2.01 0.01 0.00 1.11 0.00 0.00 32.58 31.53 2nng s HIS 119 CO 0.09 -0.79 0.39 -0.51 -0.85 0.00 0.00 174.74 173.08 2nng s LEU 120 N 1.25 4.68 -0.20 0.89 1.43 -0.04 -1.63 118.68 125.06 2nng s LEU 120 Ca -0.02 -0.48 -0.12 0.00 -1.03 0.00 0.00 54.13 52.48 2nng s LEU 120 Cb -0.17 -2.35 -0.05 0.00 0.03 0.00 0.00 46.19 43.65 2nng s LEU 120 CO -0.05 -0.45 0.20 -0.69 0.23 0.00 0.00 176.35 175.58 2nng s VAL 121 N 2.04 5.36 0.04 -1.59 1.01 0.18 -1.11 120.40 126.33 2nng s VAL 121 Ca 0.11 0.32 0.04 0.00 0.00 0.00 0.00 61.98 62.45 2nng s VAL 121 Cb -0.17 -3.54 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 2nng s VAL 121 CO 0.12 0.39 -0.12 -1.00 0.00 0.00 0.00 175.10 174.50 2nng s HIS 122 N 0.61 1.04 0.05 5.22 3.76 -0.21 -1.16 115.29 124.60 2nng s HIS 122 Ca 0.11 -0.37 0.09 0.00 -0.15 0.00 0.00 55.06 54.73 2nng s HIS 122 Cb -0.12 -0.61 -0.03 0.00 1.11 0.00 0.00 32.58 32.92 2nng s HIS 122 CO 0.02 0.01 -0.24 1.67 -0.85 0.00 0.00 174.74 175.35 2nng s TRP 123 N -0.94 2.39 -0.17 1.40 1.48 -0.33 -0.83 118.94 121.94 2nng s TRP 123 Ca -0.01 -0.36 -0.29 0.00 -1.06 0.00 0.00 56.10 54.37 2nng s TRP 123 Cb -0.08 -1.41 -0.03 0.00 -1.16 0.00 0.00 33.47 30.79 2nng s TRP 123 CO 0.01 0.17 1.49 1.21 -4.06 0.00 0.00 176.95 175.78 2nng s ASN 124 N -1.32 6.64 0.25 -2.66 3.84 0.48 -0.31 114.94 121.87 2nng s ASN 124 Ca 0.13 1.76 0.21 0.00 0.21 0.00 0.00 52.86 55.16 2nng s ASN 124 Cb -0.10 -2.53 0.97 0.00 -0.55 0.00 0.00 41.25 39.03 2nng s ASN 124 CO 0.03 -1.01 1.64 0.35 -2.79 0.00 0.00 177.10 175.32 2nng n THR 125 N 5.86 0.97 0.43 -5.21 -2.24 -0.39 -1.75 114.28 111.95 2nng n THR 125 Ca 0.17 0.41 0.10 0.00 -2.27 0.00 0.00 64.05 62.45 2nng n THR 125 Cb 0.45 -1.35 0.42 0.00 -2.10 0.00 0.00 70.33 67.74 2nng n THR 125 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2nng n LYS 127 N -2.16 0.12 -0.06 -0.78 2.85 -1.26 -2.13 118.16 114.73 2nng n LYS 127 Ca 0.01 0.36 0.10 0.00 -1.05 0.00 0.00 58.31 57.73 2nng n LYS 127 Cb 0.15 -1.73 0.12 0.00 -0.65 0.00 0.00 35.03 32.92 2nng n LYS 127 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2nng n TYR 128 N -1.96 0.17 0.00 5.58 4.01 -0.72 -5.00 117.16 119.25 2nng n TYR 128 Ca 0.03 -0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 2nng n TYR 128 Cb 0.20 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.23 2nng n TYR 128 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2nng n GLY 129 N 1.13 1.66 3.33 2.72 0.00 -0.91 -4.50 105.19 108.63 2nng n GLY 129 Ca 0.13 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 2nng n GLY 129 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2nng s ASP 130 N 0.01 -0.08 0.22 1.61 1.47 -1.26 -5.06 116.67 113.59 2nng s ASP 130 Ca 0.00 -0.58 -0.08 0.00 1.18 0.00 0.00 52.55 53.07 2nng s ASP 130 Cb 0.00 0.45 0.25 0.00 -0.34 0.00 0.00 42.92 43.28 2nng s ASP 130 CO 0.00 -0.87 1.85 0.15 0.68 0.00 0.00 175.17 176.98 2nng h PHE 131 N 2.48 0.90 -0.55 2.11 3.57 -1.94 -1.09 116.94 122.41 2nng h PHE 131 Ca -0.32 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.18 2nng h PHE 131 Cb 1.24 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.66 2nng h PHE 131 CO 0.37 0.49 0.25 0.78 -2.23 0.00 0.00 178.31 177.98 2nng h GLY 132 N 0.92 0.83 1.62 2.40 0.00 -1.97 -1.24 103.07 105.64 2nng h GLY 132 Ca 0.32 -0.39 -0.21 0.00 0.00 0.00 0.00 47.33 47.05 2nng h GLY 132 CO -0.13 0.37 -0.90 0.50 0.00 0.00 0.00 176.54 176.38 2nng h LYS 133 N 0.77 0.34 -0.52 4.80 1.79 -1.76 -3.24 116.57 118.75 2nng h LYS 133 Ca 0.19 -0.36 -0.02 0.00 -2.18 0.00 0.00 60.65 58.28 2nng h LYS 133 Cb 0.10 0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 30.82 2nng h LYS 133 CO -0.02 1.04 0.22 0.00 -1.08 0.00 0.00 179.45 179.61 2nng h ALA 134 N 0.83 1.42 -0.03 3.86 0.00 -0.53 -1.63 119.26 123.18 2nng h ALA 134 Ca -0.06 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2nng h ALA 134 Cb 1.52 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2nng h ALA 134 CO 0.15 0.45 0.00 1.33 0.00 0.00 0.00 179.25 181.18 2nng n VAL 135 N -4.35 0.09 0.25 0.00 0.24 -0.53 -1.59 118.33 112.43 2nng n VAL 135 Ca 0.04 -0.05 0.09 0.00 -2.04 0.00 0.00 64.34 62.38 2nng n VAL 135 Cb 0.15 -0.28 0.16 0.00 -1.47 0.00 0.00 33.84 32.40 2nng n VAL 135 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2nng n GLN 136 N -0.15 2.17 -4.96 7.34 6.02 -0.61 -4.92 117.38 122.28 2nng n GLN 136 Ca 0.01 -2.00 -0.29 0.00 -0.01 0.00 0.00 57.00 54.71 2nng n GLN 136 Cb 0.18 -1.40 -0.15 0.00 1.02 0.00 0.00 30.24 29.89 2nng n GLN 136 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2nng s GLN 137 N -1.28 1.78 0.26 -1.09 -1.52 -0.62 -5.03 119.66 112.16 2nng s GLN 137 Ca 0.30 -1.00 0.24 0.00 -1.95 0.00 0.00 55.36 52.95 2nng s GLN 137 Cb 0.18 -1.87 0.96 0.00 -0.22 0.00 0.00 33.01 32.06 2nng s GLN 137 CO 0.25 0.49 1.73 -0.35 -0.25 0.00 0.00 175.29 177.16 2nng n PRO 138 N 2.02 0.22 -1.09 2.91 -0.04 -1.26 -2.11 135.00 135.63 2nng n PRO 138 Ca -0.17 0.39 -0.05 0.00 -0.04 0.00 0.00 63.50 63.63 2nng n PRO 138 Cb 0.52 -1.87 0.14 0.00 -0.04 0.00 0.00 33.50 32.25 2nng n PRO 138 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2nng n ASP 139 N -2.27 2.85 0.10 3.54 5.75 -1.26 -4.23 116.55 121.03 2nng n ASP 139 Ca 0.03 -3.85 -0.05 0.00 -0.01 0.00 0.00 54.79 50.90 2nng n ASP 139 Cb 0.27 -0.47 0.09 0.00 -1.03 0.00 0.00 41.12 39.98 2nng n ASP 139 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 2nng h GLY 140 N 1.41 0.16 -3.52 6.12 0.00 -1.53 -3.43 103.07 102.28 2nng h GLY 140 Ca 0.13 -0.23 -0.42 0.00 0.00 0.00 0.00 47.33 46.81 2nng h GLY 140 CO 0.27 0.21 -0.76 1.08 0.00 0.00 0.00 176.54 177.34 2nng s LEU 141 N -7.63 2.42 -0.05 3.11 1.43 -1.26 -0.39 118.68 116.30 2nng s LEU 141 Ca -0.03 -0.83 0.00 0.00 -1.03 0.00 0.00 54.13 52.25 2nng s LEU 141 Cb 0.12 -0.57 0.02 0.00 0.03 0.00 0.00 46.19 45.79 2nng s LEU 141 CO 0.80 -0.14 -0.03 0.00 0.23 0.00 0.00 176.35 177.20 2nng s ALA 142 N -2.20 0.68 -0.17 4.21 0.00 -0.01 -0.73 121.76 123.54 2nng s ALA 142 Ca 0.10 -0.08 -0.00 0.00 0.00 0.00 0.00 51.96 51.98 2nng s ALA 142 Cb -0.05 -0.53 0.00 0.00 0.00 0.00 0.00 23.12 22.55 2nng s ALA 142 CO 0.03 -0.16 -0.15 0.08 0.00 0.00 0.00 175.76 175.57 2nng s VAL 143 N 1.25 2.62 -0.35 0.00 1.01 -0.88 -1.04 120.40 123.01 2nng s VAL 143 Ca -0.06 -0.77 -0.19 0.00 0.00 0.00 0.00 61.98 60.96 2nng s VAL 143 Cb -0.14 -2.12 -0.00 0.00 0.00 0.00 0.00 36.38 34.12 2nng s VAL 143 CO -0.02 0.51 0.59 -0.22 0.00 0.00 0.00 175.10 175.95 2nng s LEU 144 N 1.05 4.29 -0.14 3.92 2.96 -0.27 -1.28 118.68 129.21 2nng s LEU 144 Ca -0.01 0.08 -0.05 0.00 -0.22 0.00 0.00 54.13 53.93 2nng s LEU 144 Cb -0.15 -2.70 -0.04 0.00 0.50 0.00 0.00 46.19 43.80 2nng s LEU 144 CO -0.04 -0.54 0.04 -0.83 -1.32 0.00 0.00 176.35 173.66 2nng s GLY 145 N 1.77 1.91 -0.07 7.98 0.00 0.53 -0.86 107.32 118.58 2nng s GLY 145 Ca 0.22 -0.75 -0.00 0.00 0.00 0.00 0.00 44.72 44.19 2nng s GLY 145 CO 0.14 -0.21 -0.04 -0.42 0.00 0.00 0.00 173.10 172.57 2nng s ILE 146 N -0.22 0.64 0.40 0.90 1.01 -0.02 -0.83 121.20 123.09 2nng s ILE 146 Ca 0.07 -0.10 -0.23 0.00 0.00 0.00 0.00 60.65 60.38 2nng s ILE 146 Cb -0.12 -0.70 -0.10 0.00 0.01 0.00 0.00 42.46 41.55 2nng s ILE 146 CO 0.02 0.28 1.00 -0.36 0.00 0.00 0.00 174.94 175.88 2nng s PHE 147 N 1.44 3.33 -0.12 3.97 0.08 -1.26 -0.43 117.98 124.99 2nng s PHE 147 Ca -0.02 1.66 0.01 0.00 0.12 0.00 0.00 56.93 58.70 2nng s PHE 147 Cb -0.13 -3.01 -0.01 0.00 -0.57 0.00 0.00 43.02 39.30 2nng s PHE 147 CO -0.03 -0.36 -0.17 -0.51 -0.10 0.00 0.00 175.22 174.05 2nng s LEU 148 N -2.77 2.52 0.19 -0.37 1.02 -0.25 -0.87 118.68 118.14 2nng s LEU 148 Ca 0.59 -0.39 0.09 0.00 0.02 0.00 0.00 54.13 54.43 2nng s LEU 148 Cb -0.17 -1.54 -0.04 0.00 0.02 0.00 0.00 46.19 44.45 2nng s LEU 148 CO 0.22 0.17 -0.10 -1.59 0.02 0.00 0.00 176.35 175.07 2nng s LYS 149 N 0.30 2.04 -0.17 1.70 -2.85 -0.33 -1.93 119.74 118.49 2nng s LYS 149 Ca -0.12 -1.30 -0.19 0.00 -1.00 0.00 0.00 55.97 53.37 2nng s LYS 149 Cb -0.16 -2.14 -0.03 0.00 -2.06 0.00 0.00 37.83 33.43 2nng s LYS 149 CO 0.06 0.43 0.52 0.08 0.10 0.00 0.00 175.35 176.54 2nng s VAL 150 N -1.74 5.12 0.00 1.79 1.01 -1.26 -0.86 120.40 124.46 2nng s VAL 150 Ca 0.25 0.98 0.00 0.00 0.00 0.00 0.00 61.98 63.21 2nng s VAL 150 Cb -0.09 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.45 2nng s VAL 150 CO 0.15 0.22 0.00 0.61 0.00 0.00 0.00 175.10 176.08 2nng n GLY 151 N 3.68 0.84 3.77 4.51 0.00 0.83 -4.90 105.19 113.92 2nng n GLY 151 Ca -0.05 0.44 -0.34 0.00 0.00 0.00 0.00 46.02 46.07 2nng n GLY 151 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nng s SER 152 N 2.00 5.41 0.59 1.61 1.04 -1.26 -3.96 113.70 119.13 2nng s SER 152 Ca 0.00 2.11 -0.19 0.00 0.48 0.00 0.00 55.95 58.35 2nng s SER 152 Cb 0.00 -2.57 -0.04 0.00 0.10 0.00 0.00 66.02 63.52 2nng s SER 152 CO 0.00 -1.43 1.23 0.00 0.98 0.00 0.00 173.24 174.02 2nng s ALA 153 N -2.02 2.56 -0.46 5.32 0.00 -1.26 -2.56 121.76 123.34 2nng s ALA 153 Ca 0.70 1.06 -0.16 0.00 0.00 0.00 0.00 51.96 53.57 2nng s ALA 153 Cb -0.23 -3.47 0.05 0.00 0.00 0.00 0.00 23.12 19.47 2nng s ALA 153 CO 0.34 -1.22 0.40 0.21 0.00 0.00 0.00 175.76 175.49 2nng s LYS 154 N -3.27 3.00 0.29 0.00 2.47 -1.20 -4.79 119.74 116.24 2nng s LYS 154 Ca 0.77 -1.17 -0.01 0.00 -1.56 0.00 0.00 55.97 54.00 2nng s LYS 154 Cb -0.32 -4.08 0.46 0.00 -1.46 0.00 0.00 37.83 32.43 2nng s LYS 154 CO 0.35 -0.97 1.93 -1.35 0.16 0.00 0.00 175.35 175.47 2nng h PRO 155 N 8.75 1.08 0.00 4.03 0.11 -1.90 -1.77 132.00 142.29 2nng h PRO 155 Ca -0.28 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2nng h PRO 155 Cb 1.11 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2nng h PRO 155 CO 0.84 0.71 0.00 0.41 -0.21 0.00 0.00 178.00 179.76 2nng n GLY 156 N -1.40 -1.10 0.11 -0.55 0.00 -1.26 -1.87 105.19 99.12 2nng n GLY 156 Ca 0.12 0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.27 2nng n GLY 156 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2nng h LEU 157 N 0.00 0.00 -1.07 0.99 5.85 -1.53 -3.41 115.31 116.14 2nng h LEU 157 Ca 0.00 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.58 2nng h LEU 157 Cb 0.29 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 2nng h LEU 157 CO 0.00 0.04 0.03 -0.61 -0.34 0.00 0.00 178.44 177.56 2nng h GLN 158 N 0.00 0.69 -0.47 1.25 5.75 -1.40 -1.42 115.11 119.50 2nng h GLN 158 Ca 0.00 -0.16 0.01 0.00 -0.15 0.00 0.00 58.65 58.35 2nng h GLN 158 Cb 0.90 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.33 2nng h GLN 158 CO 0.00 0.68 0.31 0.87 -2.65 0.00 0.00 178.83 178.05 2nng h LYS 159 N 0.65 0.61 0.06 1.69 1.57 -1.79 0.12 116.57 119.49 2nng h LYS 159 Ca 0.14 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2nng h LYS 159 Cb 0.36 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2nng h LYS 159 CO 0.01 0.41 -0.03 0.28 -0.57 0.00 0.00 179.45 179.55 2nng h VAL 160 N 0.63 1.16 -0.86 0.50 2.07 -1.56 -3.11 116.25 115.09 2nng h VAL 160 Ca 0.18 -0.78 0.08 0.00 0.82 0.00 0.00 66.70 67.00 2nng h VAL 160 Cb -0.06 1.67 -0.07 0.00 -1.52 0.00 0.00 31.29 31.31 2nng h VAL 160 CO -0.04 0.19 0.52 0.58 0.02 0.00 0.00 177.57 178.84 2nng h VAL 161 N -0.43 0.96 0.00 2.57 2.07 -0.80 -2.44 116.25 118.18 2nng h VAL 161 Ca -0.01 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.21 2nng h VAL 161 Cb 0.38 -0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 2nng h VAL 161 CO 0.01 0.16 0.00 0.44 0.02 0.00 0.00 177.57 178.21 2nng h ASP 162 N 0.89 0.00 0.19 0.57 3.32 -0.74 -2.74 116.42 117.90 2nng h ASP 162 Ca 0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.45 2nng h ASP 162 Cb 0.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2nng h ASP 162 CO -0.22 0.00 -0.90 0.55 -1.72 0.00 0.00 179.24 176.95 2nng n VAL 163 N -2.59 0.02 0.23 -1.35 3.14 -0.93 -4.43 118.33 112.42 2nng n VAL 163 Ca 0.01 -0.04 0.06 0.00 -2.96 0.00 0.00 64.34 61.41 2nng n VAL 163 Cb 0.25 0.67 0.54 0.00 -1.06 0.00 0.00 33.84 34.24 2nng n VAL 163 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2nng h LEU 164 N 0.00 0.00 -2.38 6.55 3.38 -1.40 -0.82 115.31 120.64 2nng h LEU 164 Ca 0.00 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.00 2nng h LEU 164 Cb 0.54 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 2nng h LEU 164 CO 0.00 0.15 0.12 0.44 0.09 0.00 0.00 178.44 179.24 2nng h ASP 165 N 0.00 0.00 0.16 -0.43 3.32 -1.78 -1.59 116.42 116.11 2nng h ASP 165 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2nng h ASP 165 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 2nng h ASP 165 CO 0.02 0.00 -0.25 -1.54 -1.72 0.00 0.00 179.24 175.75 2nng n SER 166 N -3.68 1.27 -2.55 6.45 3.41 -0.32 -4.09 113.62 114.11 2nng n SER 166 Ca -0.01 -1.08 -0.13 0.00 -0.26 0.00 0.00 58.87 57.40 2nng n SER 166 Cb 0.22 0.16 0.03 0.00 -0.26 0.00 0.00 64.21 64.36 2nng n SER 166 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2nng n ILE 167 N -0.41 1.65 -0.22 -1.33 -5.35 -0.60 -4.69 119.36 108.40 2nng n ILE 167 Ca 0.13 -3.61 -0.01 0.00 -0.27 0.00 0.00 62.75 58.99 2nng n ILE 167 Cb 0.37 0.13 0.21 0.00 -1.74 0.00 0.00 39.64 38.62 2nng n ILE 167 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2nng h LYS 168 N 2.64 1.01 -6.28 6.28 3.64 -1.69 -3.42 116.57 118.75 2nng h LYS 168 Ca 0.06 -0.09 -0.60 0.00 -1.27 0.00 0.00 60.65 58.75 2nng h LYS 168 Cb 1.23 -0.21 -0.13 0.00 -0.41 0.00 0.00 32.23 32.70 2nng h LYS 168 CO 0.52 0.71 -0.73 0.95 -2.27 0.00 0.00 179.45 178.63 2nng s THR 169 N -5.75 2.81 0.10 1.00 -4.23 -1.26 -0.51 115.64 107.79 2nng s THR 169 Ca -0.11 -2.16 -0.35 0.00 -1.18 0.00 0.00 61.69 57.89 2nng s THR 169 Cb 0.17 -2.46 -0.15 0.00 1.34 0.00 0.00 72.50 71.40 2nng s THR 169 CO 0.79 -0.33 1.50 1.17 -0.54 0.00 0.00 174.62 177.21 2nng n LYS 170 N -0.53 1.68 0.00 3.99 4.81 -0.17 -1.97 118.16 125.97 2nng n LYS 170 Ca -0.07 0.61 0.00 0.00 -0.87 0.00 0.00 58.31 57.98 2nng n LYS 170 Cb 0.59 -2.32 0.00 0.00 0.02 0.00 0.00 35.03 33.32 2nng n LYS 170 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2nng n GLY 171 N 3.11 0.86 3.78 3.14 0.00 0.39 -4.53 105.19 111.94 2nng n GLY 171 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 2nng n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nng s LYS 172 N -0.72 4.56 0.12 1.61 1.02 -0.83 -4.88 119.74 120.62 2nng s LYS 172 Ca 0.00 1.40 0.00 0.00 0.02 0.00 0.00 55.97 57.40 2nng s LYS 172 Cb 0.00 -2.84 -0.04 0.00 -0.52 0.00 0.00 37.83 34.43 2nng s LYS 172 CO 0.00 0.24 -0.00 -1.54 -0.92 0.00 0.00 175.35 173.13 2nng s SER 173 N -1.51 0.81 -0.00 2.83 1.04 -1.26 -0.94 113.70 114.66 2nng s SER 173 Ca 0.50 -1.11 -0.09 0.00 0.48 0.00 0.00 55.95 55.72 2nng s SER 173 Cb -0.21 0.18 0.01 0.00 0.10 0.00 0.00 66.02 66.10 2nng s SER 173 CO 0.26 -0.60 0.18 0.00 0.98 0.00 0.00 173.24 174.06 2nng s ALA 174 N -3.81 -0.44 0.35 5.32 0.00 0.02 -4.91 121.76 118.29 2nng s ALA 174 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 51.96 51.87 2nng s ALA 174 Cb 0.07 0.08 -0.12 0.00 0.00 0.00 0.00 23.12 23.15 2nng s ALA 174 CO -0.01 -0.21 1.26 -3.47 0.00 0.00 0.00 175.76 173.32 2nng n ASP 175 N 1.48 2.59 -2.97 0.00 -0.08 -1.26 -1.13 116.55 115.18 2nng n ASP 175 Ca -0.22 1.19 -0.14 0.00 -1.51 0.00 0.00 54.79 54.12 2nng n ASP 175 Cb 0.56 -1.47 0.03 0.00 2.34 0.00 0.00 41.12 42.58 2nng n ASP 175 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 2nng n PHE 176 N 0.26 -1.16 -2.22 -0.67 7.35 -0.49 -4.69 117.46 115.83 2nng n PHE 176 Ca 0.05 -3.02 -0.30 0.00 -0.76 0.00 0.00 57.45 53.43 2nng n PHE 176 Cb 0.36 0.51 0.00 0.00 0.35 0.00 0.00 39.48 40.70 2nng n PHE 176 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2nng s THR 177 N -1.23 4.78 -1.69 -2.13 -4.23 -1.25 -3.44 115.64 106.45 2nng s THR 177 Ca 0.31 0.63 -0.02 0.00 -1.18 0.00 0.00 61.69 61.43 2nng s THR 177 Cb 0.33 -3.86 0.00 0.00 1.34 0.00 0.00 72.50 70.32 2nng s THR 177 CO -0.06 -0.99 0.25 0.59 -0.54 0.00 0.00 174.62 173.86 2nng n ASN 178 N -2.45 -6.00 -4.74 3.99 3.02 -1.26 -4.97 115.26 102.86 2nng n ASN 178 Ca 0.04 -0.13 -0.38 0.00 -0.03 0.00 0.00 54.58 54.08 2nng n ASN 178 Cb 0.54 -4.93 -0.06 0.00 -0.61 0.00 0.00 39.78 34.73 2nng n ASN 178 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2nng s PHE 179 N -3.10 3.56 -0.46 3.10 5.36 -1.26 -5.02 117.98 120.16 2nng s PHE 179 Ca 0.12 0.99 -0.14 0.00 -0.96 0.00 0.00 56.93 56.95 2nng s PHE 179 Cb -0.05 -2.57 0.07 0.00 -0.34 0.00 0.00 43.02 40.13 2nng s PHE 179 CO 0.15 0.22 0.36 0.34 -1.46 0.00 0.00 175.22 174.83 2nng s ASP 180 N 0.39 6.01 0.04 6.13 -1.08 -1.26 -4.44 116.67 122.46 2nng s ASP 180 Ca 0.28 -1.38 0.15 0.00 -0.52 0.00 0.00 52.55 51.08 2nng s ASP 180 Cb -0.16 -2.13 0.66 0.00 -1.46 0.00 0.00 42.92 39.83 2nng s ASP 180 CO 0.13 -0.62 1.49 -0.81 0.52 0.00 0.00 175.17 175.87 2nng n PRO 181 N 5.12 0.03 0.29 4.34 -0.04 -1.26 -2.22 135.00 141.26 2nng n PRO 181 Ca -0.12 0.29 0.14 0.00 -0.04 0.00 0.00 63.50 63.77 2nng n PRO 181 Cb 0.43 -1.56 0.88 0.00 -0.04 0.00 0.00 33.50 33.21 2nng n PRO 181 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2nng h ARG 182 N 0.00 0.00 0.00 0.54 3.08 -1.92 -2.02 114.38 114.06 2nng h ARG 182 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2nng h ARG 182 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2nng h ARG 182 CO 0.00 0.02 0.00 0.41 -1.07 0.00 0.00 179.97 179.33 2nng n GLY 183 N -1.21 -0.69 0.53 0.04 0.00 -0.94 -2.67 105.19 100.24 2nng n GLY 183 Ca -0.03 -0.13 0.08 0.00 0.00 0.00 0.00 46.02 45.95 2nng n GLY 183 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2nng n LEU 184 N -0.97 2.04 -4.85 0.99 4.77 -0.76 -4.04 117.00 114.18 2nng n LEU 184 Ca 0.16 -0.89 -0.34 0.00 -0.03 0.00 0.00 56.01 54.91 2nng n LEU 184 Cb 0.07 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.10 2nng n LEU 184 CO 0.12 0.37 0.28 -0.76 -1.33 0.00 0.00 177.39 176.07 2nng s LEU 185 N -1.73 4.26 0.99 2.23 1.43 -1.09 -4.92 118.68 119.85 2nng s LEU 185 Ca 0.17 1.11 -0.16 0.00 -1.03 0.00 0.00 54.13 54.22 2nng s LEU 185 Cb 0.14 -3.53 0.20 0.00 0.03 0.00 0.00 46.19 43.03 2nng s LEU 185 CO 0.31 0.01 1.23 -2.16 0.23 0.00 0.00 176.35 175.96 2nng s PRO 186 N -2.33 0.42 0.09 1.29 0.04 -1.26 -4.98 135.00 128.26 2nng s PRO 186 Ca 0.43 -0.16 -0.21 0.00 0.04 0.00 0.00 61.00 61.11 2nng s PRO 186 Cb -0.14 -1.80 -0.10 0.00 0.04 0.00 0.00 34.50 32.51 2nng s PRO 186 CO 0.20 -2.60 1.62 0.93 0.04 0.00 0.00 177.00 177.18 2nng h GLU 187 N -1.78 0.25 -6.16 4.56 5.08 -1.92 -3.44 114.58 111.16 2nng h GLU 187 Ca -0.46 -0.05 -0.58 0.00 -1.00 0.00 0.00 59.36 57.27 2nng h GLU 187 Cb 1.27 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.44 2nng h GLU 187 CO 0.44 0.33 -0.10 0.45 -1.00 0.00 0.00 179.01 179.14 2nng s SER 188 N -5.57 6.96 -0.07 1.42 0.15 -1.26 -5.00 113.70 110.33 2nng s SER 188 Ca -0.14 1.15 0.19 0.00 0.70 0.00 0.00 55.95 57.85 2nng s SER 188 Cb 0.07 -2.32 0.66 0.00 -1.71 0.00 0.00 66.02 62.72 2nng s SER 188 CO 0.70 0.28 1.57 0.18 1.20 0.00 0.00 173.24 177.17 2nng n LEU 189 N 1.69 4.37 -4.66 3.45 4.77 -1.26 -4.73 117.00 120.64 2nng n LEU 189 Ca -0.11 -2.31 -0.46 0.00 -0.03 0.00 0.00 56.01 53.10 2nng n LEU 189 Cb 0.51 -0.53 -0.03 0.00 -2.33 0.00 0.00 43.42 41.04 2nng n LEU 189 CO 0.40 0.85 1.02 0.47 -1.33 0.00 0.00 177.39 178.81 2nng n ASP 190 N 1.16 2.64 -3.84 -1.43 8.00 -1.26 -4.91 116.55 116.91 2nng n ASP 190 Ca 0.24 1.13 -0.09 0.00 0.71 0.00 0.00 54.79 56.78 2nng n ASP 190 Cb 0.78 -1.39 -0.07 0.00 -0.02 0.00 0.00 41.12 40.42 2nng n ASP 190 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2nng s TYR 191 N 0.19 0.14 0.11 1.24 -0.85 -1.26 -1.12 117.35 115.81 2nng s TYR 191 Ca 0.72 -0.55 0.06 0.00 -0.52 0.00 0.00 57.07 56.78 2nng s TYR 191 Cb -0.69 -0.01 -0.04 0.00 0.38 0.00 0.00 41.96 41.60 2nng s TYR 191 CO 0.47 -0.61 -0.01 -1.58 -1.52 0.00 0.00 175.55 172.31 2nng s TRP 192 N -3.87 2.94 -0.02 -3.49 0.51 0.12 -0.76 118.94 114.37 2nng s TRP 192 Ca 0.07 -0.06 -0.05 0.00 -2.12 0.00 0.00 56.10 53.94 2nng s TRP 192 Cb 0.04 -1.50 0.00 0.00 -0.81 0.00 0.00 33.47 31.21 2nng s TRP 192 CO -0.09 0.48 0.12 -0.08 -0.51 0.00 0.00 176.95 176.87 2nng s THR 193 N -1.40 0.05 0.16 2.01 -1.32 0.27 -0.46 115.64 114.94 2nng s THR 193 Ca 0.26 -0.39 -0.23 0.00 -1.21 0.00 0.00 61.69 60.12 2nng s THR 193 Cb -0.11 -0.30 0.07 0.00 -1.51 0.00 0.00 72.50 70.65 2nng s THR 193 CO 0.18 -0.21 0.63 -0.72 -2.21 0.00 0.00 174.62 172.28 2nng s TYR 194 N -0.70 -0.51 -0.07 9.09 1.13 -1.01 -1.15 117.35 124.13 2nng s TYR 194 Ca -0.08 0.29 -0.24 0.00 -1.41 0.00 0.00 57.07 55.62 2nng s TYR 194 Cb -0.05 0.57 -0.03 0.00 -1.10 0.00 0.00 41.96 41.35 2nng s TYR 194 CO 0.01 -0.85 0.75 -1.25 -2.51 0.00 0.00 175.55 171.70 2nng s PRO 195 N -3.72 4.44 0.00 -3.49 0.04 -1.26 -1.28 135.00 129.73 2nng s PRO 195 Ca 0.02 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.02 2nng s PRO 195 Cb -0.01 -3.46 0.00 0.00 0.04 0.00 0.00 34.50 31.06 2nng s PRO 195 CO -0.12 0.00 0.00 0.41 0.04 0.00 0.00 177.00 177.34 2nng n GLY 196 N 3.13 4.61 3.23 0.56 0.00 0.72 -4.82 105.19 112.61 2nng n GLY 196 Ca 0.00 -0.71 -0.13 0.00 0.00 0.00 0.00 46.02 45.18 2nng n GLY 196 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nng s SER 197 N 1.47 0.44 0.52 1.61 1.04 -1.08 -2.40 113.70 115.29 2nng s SER 197 Ca 0.00 -1.41 -0.23 0.00 0.48 0.00 0.00 55.95 54.80 2nng s SER 197 Cb 0.00 0.35 -0.06 0.00 0.10 0.00 0.00 66.02 66.41 2nng s SER 197 CO 0.00 -0.83 1.35 -0.76 0.98 0.00 0.00 173.24 173.98 2nng s LEU 198 N -3.20 3.92 0.00 2.42 1.43 -0.21 -4.46 118.68 118.57 2nng s LEU 198 Ca 0.39 2.75 0.24 0.00 -1.03 0.00 0.00 54.13 56.48 2nng s LEU 198 Cb 0.07 -4.20 0.57 0.00 0.03 0.00 0.00 46.19 42.66 2nng s LEU 198 CO 0.13 -1.43 1.47 0.35 0.23 0.00 0.00 176.35 177.10 2nng n THR 199 N -0.81 0.14 -4.37 5.49 -2.24 -1.26 -4.37 114.28 106.85 2nng n THR 199 Ca 0.09 -0.45 -0.20 0.00 -2.27 0.00 0.00 64.05 61.22 2nng n THR 199 Cb 0.45 0.92 -0.10 0.00 -2.10 0.00 0.00 70.33 69.50 2nng n THR 199 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2nng s THR 200 N -1.86 1.89 0.25 4.28 -4.23 -1.26 -4.67 115.64 110.04 2nng s THR 200 Ca 0.34 -2.24 -0.29 0.00 -1.18 0.00 0.00 61.69 58.31 2nng s THR 200 Cb 0.20 -2.09 -0.15 0.00 1.34 0.00 0.00 72.50 71.81 2nng s THR 200 CO 0.31 -0.54 1.02 -2.65 -0.54 0.00 0.00 174.62 172.22 2nng n PRO 201 N -0.39 1.22 -0.07 3.99 -0.02 -1.26 -0.43 135.00 138.03 2nng n PRO 201 Ca -0.08 0.43 0.03 0.00 -2.02 0.00 0.00 63.50 61.86 2nng n PRO 201 Cb 0.60 -1.81 0.08 0.00 -0.02 0.00 0.00 33.50 32.35 2nng n PRO 201 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2nng n PRO 202 N 1.05 1.33 -2.00 0.52 -0.04 -1.26 -5.00 135.00 129.60 2nng n PRO 202 Ca 0.12 -0.52 -0.16 0.00 -0.04 0.00 0.00 63.50 62.90 2nng n PRO 202 Cb 0.29 -1.12 -0.03 0.00 -0.04 0.00 0.00 33.50 32.60 2nng n PRO 202 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2nng n LEU 203 N -0.09 -1.53 -4.76 1.53 4.77 0.43 -4.91 117.00 112.44 2nng n LEU 203 Ca 0.05 0.14 -0.41 0.00 -0.03 0.00 0.00 56.01 55.76 2nng n LEU 203 Cb 0.12 -2.36 -0.02 0.00 -2.33 0.00 0.00 43.42 38.83 2nng n LEU 203 CO 0.04 -0.41 1.01 -0.76 -1.33 0.00 0.00 177.39 175.93 2nng s LEU 204 N -4.28 4.41 -0.49 2.23 1.43 -1.26 -4.40 118.68 116.33 2nng s LEU 204 Ca 0.00 2.68 -0.20 0.00 -1.03 0.00 0.00 54.13 55.58 2nng s LEU 204 Cb 0.00 -3.64 0.05 0.00 0.03 0.00 0.00 46.19 42.62 2nng s LEU 204 CO 0.00 -0.58 0.67 -1.61 0.23 0.00 0.00 176.35 175.06 2nng s GLU 205 N -1.45 3.19 0.00 1.70 2.02 -1.26 -1.05 118.70 121.85 2nng s GLU 205 Ca 0.51 -0.66 0.00 0.00 0.02 0.00 0.00 54.97 54.85 2nng s GLU 205 Cb -0.40 -4.05 0.00 0.00 0.10 0.00 0.00 34.13 29.78 2nng s GLU 205 CO 0.51 -1.19 0.00 0.28 0.02 0.00 0.00 175.26 174.87 2nng n VAL 207 N 5.76 -0.54 -3.01 2.63 0.31 -1.01 -4.48 118.33 117.99 2nng n VAL 207 Ca -0.04 0.00 -0.43 0.00 -0.01 0.00 0.00 64.34 63.86 2nng n VAL 207 Cb 0.46 -0.54 -0.06 0.00 -0.91 0.00 0.00 33.84 32.80 2nng n VAL 207 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2nng s THR 208 N -0.44 4.74 0.08 2.52 2.01 0.09 -0.20 115.64 124.43 2nng s THR 208 Ca 0.00 0.51 -0.26 0.00 0.31 0.00 0.00 61.69 62.24 2nng s THR 208 Cb 0.00 -4.23 -0.06 0.00 0.01 0.00 0.00 72.50 68.22 2nng s THR 208 CO 0.00 -0.56 0.82 0.26 -0.69 0.00 0.00 174.62 174.45 2nng s TRP 209 N 3.07 3.78 -0.24 4.92 0.52 -0.40 -2.07 118.94 128.51 2nng s TRP 209 Ca 0.28 1.58 -0.00 0.00 0.02 0.00 0.00 56.10 57.98 2nng s TRP 209 Cb -0.13 -2.88 0.07 0.00 -1.15 0.00 0.00 33.47 29.38 2nng s TRP 209 CO 0.19 0.28 -0.01 0.42 0.02 0.00 0.00 176.95 177.86 2nng s ILE 210 N -0.16 1.28 -0.24 2.03 1.01 -0.41 -2.40 121.20 122.31 2nng s ILE 210 Ca 0.41 -1.19 -0.04 0.00 0.00 0.00 0.00 60.65 59.83 2nng s ILE 210 Cb -0.22 -1.68 0.00 0.00 0.01 0.00 0.00 42.46 40.58 2nng s ILE 210 CO 0.25 -0.24 -0.03 -0.69 0.00 0.00 0.00 174.94 174.23 2nng s VAL 211 N 1.49 3.33 0.35 2.92 1.01 0.39 -0.35 120.40 129.54 2nng s VAL 211 Ca -0.01 -0.66 -0.27 0.00 0.00 0.00 0.00 61.98 61.03 2nng s VAL 211 Cb -0.18 -2.59 -0.09 0.00 0.00 0.00 0.00 36.38 33.51 2nng s VAL 211 CO -0.09 0.31 1.17 -0.76 0.00 0.00 0.00 175.10 175.72 2nng s LEU 212 N 1.44 4.35 0.13 3.92 1.43 -0.01 -0.71 118.68 129.24 2nng s LEU 212 Ca 0.04 2.37 -0.12 0.00 -1.03 0.00 0.00 54.13 55.38 2nng s LEU 212 Cb -0.15 -3.83 -0.04 0.00 0.03 0.00 0.00 46.19 42.20 2nng s LEU 212 CO -0.03 -0.46 1.50 0.50 0.23 0.00 0.00 176.35 178.09 2nng h LYS 213 N 3.16 0.86 -5.75 1.70 3.64 -1.46 -3.42 116.57 115.30 2nng h LYS 213 Ca -0.48 -0.40 -0.60 0.00 -1.27 0.00 0.00 60.65 57.91 2nng h LYS 213 Cb 1.22 -0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 32.94 2nng h LYS 213 CO 0.64 1.04 0.42 -2.00 -2.27 0.00 0.00 179.45 177.28 2nng s GLU 214 N -4.56 4.15 0.72 1.90 2.12 -1.26 -5.00 118.70 116.76 2nng s GLU 214 Ca -0.12 0.85 -0.11 0.00 0.36 0.00 0.00 54.97 55.95 2nng s GLU 214 Cb 0.11 -3.65 0.02 0.00 0.26 0.00 0.00 34.13 30.86 2nng s GLU 214 CO 0.85 -0.52 1.07 -1.25 -0.54 0.00 0.00 175.26 174.87 2nng s PRO 215 N 2.81 2.74 0.16 4.30 0.04 -1.26 -4.65 135.00 139.13 2nng s PRO 215 Ca 0.33 0.96 -0.04 0.00 0.04 0.00 0.00 61.00 62.29 2nng s PRO 215 Cb -0.15 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 2nng s PRO 215 CO 0.08 -1.24 0.39 0.96 0.04 0.00 0.00 177.00 177.22 2nng s ILE 216 N -3.03 5.17 -0.15 0.56 -4.36 -0.05 -4.86 121.20 114.48 2nng s ILE 216 Ca 0.59 -0.05 -0.11 0.00 -0.26 0.00 0.00 60.65 60.82 2nng s ILE 216 Cb -0.15 -3.65 -0.05 0.00 1.25 0.00 0.00 42.46 39.87 2nng s ILE 216 CO 0.55 -0.02 0.21 -0.55 0.24 0.00 0.00 174.94 175.37 2nng s SER 217 N -2.61 6.38 0.23 4.36 0.15 -1.26 -1.18 113.70 119.77 2nng s SER 217 Ca 0.41 0.44 0.10 0.00 0.70 0.00 0.00 55.95 57.60 2nng s SER 217 Cb -0.12 -2.13 -0.05 0.00 -1.71 0.00 0.00 66.02 62.01 2nng s SER 217 CO 0.26 0.22 -0.19 0.68 1.20 0.00 0.00 173.24 175.41 2nng s VAL 218 N -0.04 2.14 0.49 4.45 -7.23 -0.04 -3.21 120.40 116.96 2nng s VAL 218 Ca 0.14 -2.23 -0.06 0.00 -1.81 0.00 0.00 61.98 58.02 2nng s VAL 218 Cb -0.12 -2.13 -0.04 0.00 0.56 0.00 0.00 36.38 34.65 2nng s VAL 218 CO 0.03 -0.41 0.81 -0.94 -0.31 0.00 0.00 175.10 174.28 2nng s SER 219 N -3.22 6.28 0.27 4.85 1.04 -1.16 -0.12 113.70 121.63 2nng s SER 219 Ca 0.24 1.00 0.01 0.00 0.48 0.00 0.00 55.95 57.68 2nng s SER 219 Cb -0.04 -2.28 0.59 0.00 0.10 0.00 0.00 66.02 64.39 2nng s SER 219 CO 0.11 -0.60 1.76 -1.28 0.98 0.00 0.00 173.24 174.21 2nng h SER 220 N 0.23 0.58 -0.24 7.02 0.87 -1.92 -1.08 113.55 119.01 2nng h SER 220 Ca -0.47 0.10 -0.07 0.00 -1.23 0.00 0.00 61.79 60.12 2nng h SER 220 Cb 1.20 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.14 2nng h SER 220 CO 0.62 0.23 -0.06 -0.33 -0.53 0.00 0.00 176.83 176.76 2nng h GLU 221 N 0.65 0.60 -0.18 2.24 3.07 -1.95 0.13 114.58 119.14 2nng h GLU 221 Ca 0.50 -0.16 -0.03 0.00 -0.50 0.00 0.00 59.36 59.17 2nng h GLU 221 Cb 0.73 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.56 2nng h GLU 221 CO -0.37 0.66 -0.00 1.96 -1.40 0.00 0.00 179.01 179.85 2nng h GLN 222 N 0.56 0.32 -0.07 2.33 4.20 -1.59 -2.81 115.11 118.05 2nng h GLN 222 Ca 0.11 -0.11 -0.14 0.00 0.06 0.00 0.00 58.65 58.58 2nng h GLN 222 Cb 0.45 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 2nng h GLN 222 CO 0.02 0.54 -0.57 -0.24 -0.67 0.00 0.00 178.83 177.91 2nng h VAL 223 N 0.07 1.38 -0.38 -0.54 3.04 -1.17 -2.42 116.25 116.22 2nng h VAL 223 Ca 0.05 -1.91 0.02 0.00 -1.01 0.00 0.00 66.70 63.86 2nng h VAL 223 Cb 0.40 1.96 -0.02 0.00 -2.01 0.00 0.00 31.29 31.62 2nng h VAL 223 CO 0.01 0.56 0.25 -0.07 -1.01 0.00 0.00 177.57 177.32 2nng h LEU 224 N 0.15 0.37 -0.76 3.16 3.38 -0.91 -1.38 115.31 119.33 2nng h LEU 224 Ca -0.00 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 2nng h LEU 224 Cb 1.05 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 2nng h LEU 224 CO 0.09 0.26 -0.52 0.11 0.09 0.00 0.00 178.44 178.46 2nng h LYS 225 N 0.43 0.25 -0.73 1.13 1.57 -1.17 -2.33 116.57 115.72 2nng h LYS 225 Ca 0.15 -0.15 0.07 0.00 -1.87 0.00 0.00 60.65 58.85 2nng h LYS 225 Cb 0.07 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.34 2nng h LYS 225 CO -0.03 0.72 0.41 0.74 -0.57 0.00 0.00 179.45 180.71 2nng h PHE 226 N 0.20 0.74 0.00 -1.35 -1.00 -1.16 -2.67 116.94 111.70 2nng h PHE 226 Ca 0.00 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.81 2nng h PHE 226 Cb 0.99 -0.23 0.00 0.00 3.61 0.00 0.00 35.95 40.33 2nng h PHE 226 CO 0.02 0.34 0.00 0.54 -1.61 0.00 0.00 178.31 177.60 2nng n ARG 227 N -4.77 0.30 0.00 1.51 1.74 -0.89 -2.18 116.66 112.37 2nng n ARG 227 Ca 0.10 0.09 0.12 0.00 -0.77 0.00 0.00 57.85 57.39 2nng n ARG 227 Cb 0.21 -1.50 0.26 0.00 -1.02 0.00 0.00 32.46 30.41 2nng n ARG 227 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2nng n LYS 228 N -1.29 0.10 -0.77 5.56 5.02 -1.01 -4.47 118.16 121.30 2nng n LYS 228 Ca 0.10 -0.06 -0.30 0.00 -2.02 0.00 0.00 58.31 56.03 2nng n LYS 228 Cb 0.17 -1.50 0.19 0.00 -0.02 0.00 0.00 35.03 33.86 2nng n LYS 228 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2nng s LEU 229 N -2.94 2.09 -0.02 -0.35 1.43 -0.93 -4.86 118.68 113.11 2nng s LEU 229 Ca 0.12 1.83 0.08 0.00 -1.03 0.00 0.00 54.13 55.13 2nng s LEU 229 Cb 0.18 -4.08 -0.02 0.00 0.03 0.00 0.00 46.19 42.30 2nng s LEU 229 CO 0.68 -3.33 -0.25 0.20 0.23 0.00 0.00 176.35 173.89 2nng s ASN 230 N -2.80 2.89 0.24 2.29 0.02 0.34 -0.16 114.94 117.75 2nng s ASN 230 Ca 0.66 -0.45 0.05 0.00 -1.02 0.00 0.00 52.86 52.11 2nng s ASN 230 Cb -0.22 -0.33 0.25 0.00 0.02 0.00 0.00 41.25 40.96 2nng s ASN 230 CO 0.60 0.30 1.56 -0.26 0.02 0.00 0.00 177.10 179.31 2nng h PHE 231 N 5.54 0.28 -4.33 2.20 0.04 -1.29 -3.35 116.94 116.02 2nng h PHE 231 Ca -0.42 -0.11 -0.49 0.00 2.80 0.00 0.00 57.97 59.75 2nng h PHE 231 Cb 1.13 -0.05 0.10 0.00 2.20 0.00 0.00 35.95 39.33 2nng h PHE 231 CO 0.39 0.78 0.36 0.54 -0.60 0.00 0.00 178.31 179.78 2nng s ASN 232 N -6.89 4.91 0.74 2.17 4.22 -1.26 -4.38 114.94 114.45 2nng s ASN 232 Ca -0.04 1.35 -0.10 0.00 -2.14 0.00 0.00 52.86 51.93 2nng s ASN 232 Cb 0.12 -2.14 0.05 0.00 1.28 0.00 0.00 41.25 40.55 2nng s ASN 232 CO 0.80 -1.71 1.10 -0.83 -2.04 0.00 0.00 177.10 174.42 2nng s GLY 233 N -3.96 1.62 0.25 0.45 0.00 -1.26 -0.99 107.32 103.42 2nng s GLY 233 Ca 0.59 -0.60 -0.31 0.00 0.00 0.00 0.00 44.72 44.41 2nng s GLY 233 CO 0.54 -0.18 1.44 -2.21 0.00 0.00 0.00 173.10 172.69 2nng n GLU 234 N -3.09 2.14 0.00 2.90 2.13 -1.26 -2.14 120.64 121.32 2nng n GLU 234 Ca 0.07 0.76 0.00 0.00 0.66 0.00 0.00 57.16 58.66 2nng n GLU 234 Cb 0.59 -2.44 0.00 0.00 0.27 0.00 0.00 31.44 29.86 2nng n GLU 234 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2nng n GLY 235 N 2.16 2.50 3.92 8.31 0.00 -1.26 -5.02 105.19 115.80 2nng n GLY 235 Ca 0.11 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.87 2nng n GLY 235 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nng s GLU 236 N -0.17 3.31 0.41 1.61 2.02 -0.91 -5.02 118.70 119.95 2nng s GLU 236 Ca 0.00 0.00 -0.27 0.00 0.02 0.00 0.00 54.97 54.72 2nng s GLU 236 Cb 0.00 -2.40 -0.10 0.00 0.10 0.00 0.00 34.13 31.73 2nng s GLU 236 CO 0.00 -0.31 1.48 -2.30 0.02 0.00 0.00 175.26 174.15 2nng n PRO 237 N -2.27 2.55 -2.48 0.39 -0.02 -1.26 -4.86 135.00 127.03 2nng n PRO 237 Ca 0.01 0.90 -0.42 0.00 -2.02 0.00 0.00 63.50 61.97 2nng n PRO 237 Cb 0.56 -2.67 -0.03 0.00 -0.02 0.00 0.00 33.50 31.34 2nng n PRO 237 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2nng s GLU 238 N -2.24 4.45 -0.29 -0.52 2.12 -1.26 -4.78 118.70 116.19 2nng s GLU 238 Ca 0.56 1.69 0.01 0.00 0.36 0.00 0.00 54.97 57.59 2nng s GLU 238 Cb -0.46 -3.39 0.08 0.00 0.26 0.00 0.00 34.13 30.62 2nng s GLU 238 CO 0.62 -0.23 0.02 -1.21 -0.54 0.00 0.00 175.26 173.91 2nng s GLU 239 N 1.15 1.35 0.37 4.30 2.02 -1.26 -5.06 118.70 121.57 2nng s GLU 239 Ca 0.57 -1.28 -0.28 0.00 0.02 0.00 0.00 54.97 54.00 2nng s GLU 239 Cb -0.27 -2.62 -0.10 0.00 0.10 0.00 0.00 34.13 31.23 2nng s GLU 239 CO 0.28 -0.80 1.40 -0.51 0.02 0.00 0.00 175.26 175.65 2nng s LEU 240 N 1.30 4.33 -0.96 1.80 1.43 -1.26 -0.95 118.68 124.37 2nng s LEU 240 Ca 0.03 2.87 -0.23 0.00 -1.03 0.00 0.00 54.13 55.77 2nng s LEU 240 Cb -0.18 -3.71 0.06 0.00 0.03 0.00 0.00 46.19 42.38 2nng s LEU 240 CO -0.12 -0.77 1.38 -0.32 0.23 0.00 0.00 176.35 176.75 2nng s MET 241 N -2.03 3.52 0.04 1.70 -2.45 0.77 -4.58 119.30 116.27 2nng s MET 241 Ca 0.52 -1.04 -0.03 0.00 -1.25 0.00 0.00 55.69 53.89 2nng s MET 241 Cb -0.43 -5.10 -0.02 0.00 1.25 0.00 0.00 34.83 30.52 2nng s MET 241 CO 0.57 -2.15 0.04 0.14 1.05 0.00 0.00 175.02 174.68 2nng s VAL 242 N 4.85 0.16 -1.33 10.11 -7.23 -1.26 -4.45 120.40 121.25 2nng s VAL 242 Ca 0.42 -1.33 -0.06 0.00 -1.81 0.00 0.00 61.98 59.21 2nng s VAL 242 Cb -0.02 -1.06 0.02 0.00 0.56 0.00 0.00 36.38 35.88 2nng s VAL 242 CO -0.06 -0.73 1.03 0.47 -0.31 0.00 0.00 175.10 175.50 2nng n ASP 243 N 0.58 -4.08 -2.53 4.85 8.00 -0.02 -4.85 116.55 118.51 2nng n ASP 243 Ca -0.18 -0.65 -0.30 0.00 0.71 0.00 0.00 54.79 54.38 2nng n ASP 243 Cb 0.59 -4.73 -0.01 0.00 -0.02 0.00 0.00 41.12 36.96 2nng n ASP 243 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2nng n ASN 244 N -3.03 6.88 -4.29 -2.24 6.94 -1.09 -4.90 115.26 113.53 2nng n ASN 244 Ca -0.12 -3.42 -0.28 0.00 -0.02 0.00 0.00 54.58 50.74 2nng n ASN 244 Cb 0.60 -1.15 -0.15 0.00 -2.36 0.00 0.00 39.78 36.73 2nng n ASN 244 CO 0.00 0.00 0.00 -1.66 -1.03 0.00 0.00 177.26 174.57 2nng s TRP 245 N -2.58 2.08 0.03 -2.53 1.48 -1.26 -4.60 118.94 111.56 2nng s TRP 245 Ca 0.54 -0.39 -0.20 0.00 -1.06 0.00 0.00 56.10 54.99 2nng s TRP 245 Cb 0.39 -1.25 -0.06 0.00 -1.16 0.00 0.00 33.47 31.39 2nng s TRP 245 CO -0.24 0.09 0.58 0.50 -4.06 0.00 0.00 176.95 173.83 2nng s ARG 246 N -1.13 4.27 0.87 3.25 3.52 -1.26 -4.98 118.95 123.48 2nng s ARG 246 Ca 0.10 0.73 -0.12 0.00 -0.13 0.00 0.00 55.73 56.31 2nng s ARG 246 Cb -0.09 -3.30 0.11 0.00 -1.56 0.00 0.00 34.95 30.11 2nng s ARG 246 CO 0.02 0.48 1.12 -1.25 -0.81 0.00 0.00 175.30 174.86 2nng s PRO 247 N -0.58 1.52 0.40 5.12 0.04 -1.26 -4.60 135.00 135.63 2nng s PRO 247 Ca 0.30 0.42 -0.27 0.00 0.04 0.00 0.00 61.00 61.50 2nng s PRO 247 Cb -0.19 -1.87 -0.10 0.00 0.04 0.00 0.00 34.50 32.38 2nng s PRO 247 CO 0.18 -1.97 1.39 0.00 0.04 0.00 0.00 177.00 176.64 2nng n ALA 248 N -3.63 1.85 -2.59 8.56 0.00 -1.26 -4.31 120.51 119.13 2nng n ALA 248 Ca 0.07 0.31 -0.23 0.00 0.00 0.00 0.00 53.44 53.59 2nng n ALA 248 Cb 0.58 -2.35 -0.06 0.00 0.00 0.00 0.00 19.45 17.62 2nng n ALA 248 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2nng s GLN 249 N -2.16 2.43 0.26 0.00 -1.52 0.56 -4.94 119.66 114.29 2nng s GLN 249 Ca 0.57 -1.44 -0.31 0.00 -1.95 0.00 0.00 55.36 52.23 2nng s GLN 249 Cb -0.49 -2.23 -0.12 0.00 -0.22 0.00 0.00 33.01 29.95 2nng s GLN 249 CO 0.61 0.21 1.66 -2.14 -0.25 0.00 0.00 175.29 175.38 2nng s PRO 250 N -3.81 4.11 0.30 2.91 0.02 -1.26 -4.60 135.00 132.67 2nng s PRO 250 Ca 0.36 2.61 0.03 0.00 0.02 0.00 0.00 61.00 64.02 2nng s PRO 250 Cb -0.04 -3.04 0.49 0.00 0.02 0.00 0.00 34.50 31.92 2nng s PRO 250 CO 0.22 -0.70 1.78 1.25 -0.33 0.00 0.00 177.00 179.22 2nng h LEU 251 N 5.75 0.47 0.00 -5.54 5.85 -1.94 -3.43 115.31 116.46 2nng h LEU 251 Ca -0.45 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.13 2nng h LEU 251 Cb 1.21 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.11 2nng h LEU 251 CO 0.87 0.66 0.00 0.29 -0.34 0.00 0.00 178.44 179.92 2nng n LYS 252 N -4.18 0.00 -1.94 1.25 5.02 -1.26 -3.07 118.16 113.98 2nng n LYS 252 Ca 0.00 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.89 2nng n LYS 252 Cb 0.35 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.35 2nng n LYS 252 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2nng n ASN 253 N 0.41 7.87 -4.11 4.39 4.05 -1.26 -4.90 115.26 121.71 2nng n ASN 253 Ca 0.00 -3.07 -0.16 0.00 0.45 0.00 0.00 54.58 51.80 2nng n ASN 253 Cb 0.00 -1.40 -0.12 0.00 1.23 0.00 0.00 39.78 39.50 2nng n ASN 253 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2nng s ARG 254 N -0.62 0.67 -0.10 1.20 0.52 -1.18 -5.11 118.95 114.34 2nng s ARG 254 Ca 0.55 -0.84 0.03 0.00 -0.52 0.00 0.00 55.73 54.94 2nng s ARG 254 Cb 0.18 -0.56 -0.01 0.00 0.52 0.00 0.00 34.95 35.08 2nng s ARG 254 CO -0.08 0.12 -0.19 -0.65 0.02 0.00 0.00 175.30 174.52 2nng s GLN 255 N -1.62 3.08 -0.09 3.54 -0.21 -1.26 -5.05 119.66 118.05 2nng s GLN 255 Ca -0.06 -0.79 -0.20 0.00 0.02 0.00 0.00 55.36 54.33 2nng s GLN 255 Cb -0.10 -2.43 -0.04 0.00 1.00 0.00 0.00 33.01 31.45 2nng s GLN 255 CO 0.01 0.26 0.56 0.42 -2.12 0.00 0.00 175.29 174.42 2nng s ILE 256 N 0.19 5.12 -0.01 1.08 1.01 -1.26 -4.71 121.20 122.61 2nng s ILE 256 Ca -0.11 1.14 0.00 0.00 0.00 0.00 0.00 60.65 61.68 2nng s ILE 256 Cb -0.16 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.37 2nng s ILE 256 CO 0.06 0.31 0.03 -0.54 0.00 0.00 0.00 174.94 174.80 2nng s LYS 257 N 0.62 2.91 -0.04 2.79 1.02 -0.30 -2.02 119.74 124.70 2nng s LYS 257 Ca 0.30 -0.54 0.01 0.00 0.02 0.00 0.00 55.97 55.76 2nng s LYS 257 Cb -0.16 -2.75 -0.03 0.00 -0.52 0.00 0.00 37.83 34.36 2nng s LYS 257 CO 0.13 0.64 -0.04 0.00 -0.92 0.00 0.00 175.35 175.17 2nng s ALA 258 N -1.10 3.13 -2.18 5.17 0.00 0.32 -0.57 121.76 126.53 2nng s ALA 258 Ca 0.20 -0.91 0.28 0.00 0.00 0.00 0.00 51.96 51.53 2nng s ALA 258 Cb -0.12 -1.29 1.07 0.00 0.00 0.00 0.00 23.12 22.78 2nng s ALA 258 CO 0.10 0.60 1.75 -1.13 0.00 0.00 0.00 175.76 177.09 2nng n SER 259 N 1.89 1.14 -4.14 0.00 3.41 0.06 -1.55 113.62 114.43 2nng n SER 259 Ca -0.17 -1.21 -0.12 0.00 -0.26 0.00 0.00 58.87 57.11 2nng n SER 259 Cb 0.53 0.03 -0.11 0.00 -0.26 0.00 0.00 64.21 64.40 2nng n SER 259 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2nng s PHE 260 N -2.18 0.86 -2.81 7.33 -0.71 -1.26 -4.91 117.98 114.30 2nng s PHE 260 Ca 0.34 -0.73 0.26 0.00 -1.04 0.00 0.00 56.93 55.76 2nng s PHE 260 Cb 0.21 -0.49 0.52 0.00 -1.21 0.00 0.00 43.02 42.04 2nng s PHE 260 CO 0.40 -0.10 1.44 1.63 -1.34 0.00 0.00 175.22 177.25