#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ne2 h ILE 3 N 0.00 1.21 -0.44 -0.61 2.10 -2.04 -0.27 117.51 117.46 1ne2 h ILE 3 Ca 0.00 -0.94 -0.06 0.00 1.08 0.00 0.00 64.86 64.94 1ne2 h ILE 3 Cb 0.00 1.33 -0.02 0.00 -1.09 0.00 0.00 36.82 37.04 1ne2 h ILE 3 CO 0.00 0.29 0.03 0.50 -1.08 0.00 0.00 178.15 177.89 1ne2 h LYS 4 N 0.20 0.75 -0.19 2.19 3.11 -1.99 0.30 116.57 120.94 1ne2 h LYS 4 Ca 0.04 -0.22 -0.18 0.00 -2.81 0.00 0.00 60.65 57.47 1ne2 h LYS 4 Cb 0.47 -0.08 -0.00 0.00 -1.00 0.00 0.00 32.23 31.62 1ne2 h LYS 4 CO 0.03 0.80 -0.62 -0.91 -2.81 0.00 0.00 179.45 175.94 1ne2 h ASN 5 N 0.60 0.77 -0.34 4.20 2.35 -1.90 -0.79 115.58 120.46 1ne2 h ASN 5 Ca 0.13 -0.44 -0.09 0.00 -0.55 0.00 0.00 56.30 55.34 1ne2 h ASN 5 Cb 0.44 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 1ne2 h ASN 5 CO 0.02 1.20 -0.10 0.44 -1.65 0.00 0.00 177.43 177.34 1ne2 h ASP 6 N 0.50 0.76 -0.11 5.81 3.32 -0.90 -2.16 116.42 123.64 1ne2 h ASP 6 Ca -0.01 -0.22 -0.10 0.00 0.02 0.00 0.00 57.03 56.72 1ne2 h ASP 6 Cb 1.20 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.55 1ne2 h ASP 6 CO 0.12 0.88 -0.31 0.25 -1.72 0.00 0.00 179.24 178.46 1ne2 h LEU 7 N 0.70 0.47 -0.74 1.55 5.85 -0.89 -3.20 115.31 119.05 1ne2 h LEU 7 Ca 0.12 -0.60 0.13 0.00 0.84 0.00 0.00 57.88 58.38 1ne2 h LEU 7 Cb 0.57 -0.14 -0.09 0.00 0.37 0.00 0.00 40.66 41.38 1ne2 h LEU 7 CO 0.04 0.98 0.31 -0.08 -0.34 0.00 0.00 178.44 179.34 1ne2 h GLU 8 N -0.02 0.46 0.00 1.25 4.81 -0.95 -0.03 114.58 120.10 1ne2 h GLU 8 Ca -0.01 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.14 1ne2 h GLU 8 Cb 0.93 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 1ne2 h GLU 8 CO 0.07 0.30 -0.27 -0.84 -0.73 0.00 0.00 179.01 177.55 1ne2 h ILE 9 N 0.47 0.91 -0.01 2.32 3.07 -1.44 -0.58 117.51 122.25 1ne2 h ILE 9 Ca 0.40 -1.02 -0.21 0.00 1.55 0.00 0.00 64.86 65.58 1ne2 h ILE 9 Cb 0.57 1.60 -0.00 0.00 -0.27 0.00 0.00 36.82 38.71 1ne2 h ILE 9 CO -0.37 0.26 -0.89 0.03 -1.05 0.00 0.00 178.15 176.13 1ne2 h ARG 10 N 0.00 0.36 -0.05 0.16 2.47 -1.06 -3.13 114.38 113.13 1ne2 h ARG 10 Ca -0.00 -0.37 -0.12 0.00 -1.26 0.00 0.00 59.98 58.23 1ne2 h ARG 10 Cb 0.58 0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.98 1ne2 h ARG 10 CO 0.03 1.05 -0.51 -0.07 0.56 0.00 0.00 179.97 181.03 1ne2 h LEU 11 N 0.21 0.13 -1.68 3.04 3.38 -0.51 -2.87 115.31 117.01 1ne2 h LEU 11 Ca -0.06 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1ne2 h LEU 11 Cb 1.51 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.22 1ne2 h LEU 11 CO 0.15 0.62 0.00 1.56 0.09 0.00 0.00 178.44 180.86 1ne2 h GLN 12 N 0.10 0.00 0.00 1.13 4.20 -1.07 -1.98 115.11 117.49 1ne2 h GLN 12 Ca 0.00 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 1ne2 h GLN 12 Cb 0.94 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.71 1ne2 h GLN 12 CO 0.07 0.00 -0.28 0.87 -0.67 0.00 0.00 178.83 178.83 1ne2 h LYS 13 N 0.00 0.00 -7.18 1.46 1.57 -1.53 -3.45 116.57 107.44 1ne2 h LYS 13 Ca 0.00 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.32 1ne2 h LYS 13 Cb 0.33 0.00 0.21 0.00 0.08 0.00 0.00 32.23 32.85 1ne2 h LYS 13 CO 0.00 0.28 0.07 -0.51 -0.57 0.00 0.00 179.45 178.71 1ne2 s LEU 14 N -6.57 1.42 -0.61 2.94 1.02 -0.75 -5.13 118.68 111.01 1ne2 s LEU 14 Ca 0.03 1.75 -0.00 0.00 0.02 0.00 0.00 54.13 55.92 1ne2 s LEU 14 Cb 0.09 -3.79 0.47 0.00 0.02 0.00 0.00 46.19 42.98 1ne2 s LEU 14 CO 0.67 -3.93 1.95 0.00 0.02 0.00 0.00 176.35 175.06 1ne2 n GLN 15 N -4.75 2.71 0.00 1.70 6.02 -1.26 -5.10 117.38 116.70 1ne2 n GLN 15 Ca 0.06 -3.33 0.00 0.00 -0.01 0.00 0.00 57.00 53.71 1ne2 n GLN 15 Cb 0.53 -2.27 0.00 0.00 1.02 0.00 0.00 30.24 29.52 1ne2 n GLN 15 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1ne2 n THR 29 N -0.93 0.00 -1.17 5.09 -2.24 -1.26 -4.96 114.28 108.80 1ne2 n THR 29 Ca 0.61 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 62.09 1ne2 n THR 29 Cb 0.79 0.00 0.15 0.00 -2.10 0.00 0.00 70.33 69.17 1ne2 n THR 29 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1ne2 s ASP 30 N 0.00 3.30 0.34 3.42 1.47 -1.26 -4.74 116.67 119.21 1ne2 s ASP 30 Ca 0.00 1.47 0.03 0.00 1.18 0.00 0.00 52.55 55.23 1ne2 s ASP 30 Cb 0.00 -2.14 0.64 0.00 -0.34 0.00 0.00 42.92 41.08 1ne2 s ASP 30 CO 0.00 -2.74 1.97 0.00 0.68 0.00 0.00 175.17 175.08 1ne2 h ALA 31 N -1.62 1.59 0.15 2.11 0.00 -1.94 -0.48 119.26 119.07 1ne2 h ALA 31 Ca -0.50 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 1ne2 h ALA 31 Cb 1.29 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1ne2 h ALA 31 CO 0.55 0.33 -0.07 1.03 0.00 0.00 0.00 179.25 181.08 1ne2 h SER 32 N 0.87 -0.18 -0.75 0.00 0.87 -1.92 -0.57 113.55 111.88 1ne2 h SER 32 Ca 0.29 -0.23 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 1ne2 h SER 32 Cb 0.08 0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.05 1ne2 h SER 32 CO -0.09 0.15 0.42 0.74 -0.53 0.00 0.00 176.83 177.52 1ne2 h THR 33 N -0.51 1.22 -0.42 2.23 2.02 -1.89 -0.52 112.91 115.03 1ne2 h THR 33 Ca -0.02 -0.55 -0.01 0.00 0.77 0.00 0.00 66.41 66.60 1ne2 h THR 33 Cb 0.40 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 1ne2 h THR 33 CO 0.03 0.25 0.21 0.00 0.37 0.00 0.00 175.52 176.38 1ne2 h ALA 34 N 1.22 0.55 -0.53 6.16 0.00 -1.05 -1.12 119.26 124.48 1ne2 h ALA 34 Ca 0.27 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1ne2 h ALA 34 Cb 0.02 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1ne2 h ALA 34 CO -0.04 0.10 0.23 0.00 0.00 0.00 0.00 179.25 179.54 1ne2 h ALA 35 N 1.06 0.69 0.01 0.00 0.00 -0.81 -1.08 119.26 119.14 1ne2 h ALA 35 Ca 0.15 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1ne2 h ALA 35 Cb 0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1ne2 h ALA 35 CO -0.02 0.28 -0.06 -0.92 0.00 0.00 0.00 179.25 178.53 1ne2 h TYR 36 N 0.72 -0.16 -0.10 0.00 3.20 -0.82 -0.73 116.97 119.08 1ne2 h TYR 36 Ca 0.18 0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.08 1ne2 h TYR 36 Cb 0.17 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.48 1ne2 h TYR 36 CO 0.00 -0.10 -0.03 0.35 -1.64 0.00 0.00 178.16 176.74 1ne2 h PHE 37 N -0.12 -0.08 -0.64 -3.82 3.57 -1.09 -2.46 116.94 112.31 1ne2 h PHE 37 Ca 0.02 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 1ne2 h PHE 37 Cb 0.14 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.90 1ne2 h PHE 37 CO -0.13 -0.06 0.15 -0.07 -2.23 0.00 0.00 178.31 175.98 1ne2 h LEU 38 N -0.02 0.95 -1.16 0.59 3.38 -1.06 -2.60 115.31 115.39 1ne2 h LEU 38 Ca 0.05 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 1ne2 h LEU 38 Cb 0.10 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1ne2 h LEU 38 CO -0.12 0.92 -0.02 0.40 0.09 0.00 0.00 178.44 179.71 1ne2 h ILE 39 N 0.96 1.21 -0.33 1.22 1.08 -0.96 -0.06 117.51 120.63 1ne2 h ILE 39 Ca 0.20 -0.85 -0.00 0.00 -0.39 0.00 0.00 64.86 63.82 1ne2 h ILE 39 Cb 0.34 0.97 -0.02 0.00 -3.07 0.00 0.00 36.82 35.05 1ne2 h ILE 39 CO 0.00 0.29 0.20 -0.33 -0.69 0.00 0.00 178.15 177.62 1ne2 h GLU 40 N 0.52 0.45 -0.64 2.37 5.08 -1.07 0.24 114.58 121.53 1ne2 h GLU 40 Ca 0.11 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.39 1ne2 h GLU 40 Cb 0.37 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 1ne2 h GLU 40 CO 0.01 0.34 0.25 0.82 -1.00 0.00 0.00 179.01 179.43 1ne2 h ILE 41 N 0.43 1.23 -0.30 3.13 2.04 -1.16 -1.11 117.51 121.76 1ne2 h ILE 41 Ca 0.12 -0.72 -0.03 0.00 1.00 0.00 0.00 64.86 65.23 1ne2 h ILE 41 Cb 0.00 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 1ne2 h ILE 41 CO -0.02 0.28 0.06 0.22 0.00 0.00 0.00 178.15 178.69 1ne2 h TYR 42 N 0.92 0.51 0.00 1.37 3.20 -0.42 -1.59 116.97 120.97 1ne2 h TYR 42 Ca 0.22 -0.07 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 1ne2 h TYR 42 Cb 0.19 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.32 1ne2 h TYR 42 CO 0.01 0.56 -0.07 -0.91 -1.64 0.00 0.00 178.16 176.12 1ne2 h ASN 43 N 0.31 0.00 1.22 -2.11 2.35 -0.22 -1.19 115.58 115.95 1ne2 h ASN 43 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1ne2 h ASN 43 Cb 0.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.69 1ne2 h ASN 43 CO 0.00 0.07 0.00 0.44 -1.65 0.00 0.00 177.43 176.29 1ne2 h ASP 44 N 0.00 0.00 0.00 5.81 3.32 -0.76 -3.46 116.42 121.32 1ne2 h ASP 44 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ne2 h ASP 44 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1ne2 h ASP 44 CO 0.01 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.14 1ne2 n GLY 45 N 0.61 0.82 0.87 2.75 0.00 -0.45 -5.00 105.19 104.79 1ne2 n GLY 45 Ca 0.03 -0.50 0.07 0.00 0.00 0.00 0.00 46.02 45.63 1ne2 n GLY 45 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ne2 n ASN 46 N 0.94 3.59 0.05 1.61 4.13 -0.64 -4.71 115.26 120.23 1ne2 n ASN 46 Ca 0.00 -2.53 0.00 0.00 1.68 0.00 0.00 54.58 53.73 1ne2 n ASN 46 Cb 0.05 -0.42 0.00 0.00 -1.54 0.00 0.00 39.78 37.87 1ne2 n ASN 46 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1ne2 n ILE 47 N 0.10 0.79 -1.69 2.41 2.08 -1.25 -4.72 119.36 117.07 1ne2 n ILE 47 Ca 0.18 0.26 -0.51 0.00 0.56 0.00 0.00 62.75 63.24 1ne2 n ILE 47 Cb 0.70 -1.29 -0.05 0.00 -0.75 0.00 0.00 39.64 38.24 1ne2 n ILE 47 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1ne2 n GLY 48 N 3.25 1.23 2.36 7.39 0.00 -1.26 -1.22 105.19 116.94 1ne2 n GLY 48 Ca 0.00 0.87 -0.08 0.00 0.00 0.00 0.00 46.02 46.81 1ne2 n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ne2 n GLY 49 N 4.22 0.97 3.67 -0.02 0.00 -0.83 -4.87 105.19 108.33 1ne2 n GLY 49 Ca 0.23 -0.41 -0.23 0.00 0.00 0.00 0.00 46.02 45.62 1ne2 n GLY 49 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ne2 s ARG 50 N -2.45 2.35 -0.17 1.61 1.81 -0.35 -4.51 118.95 117.24 1ne2 s ARG 50 Ca 0.00 -1.41 -0.17 0.00 -1.72 0.00 0.00 55.73 52.43 1ne2 s ARG 50 Cb 0.00 -2.19 -0.04 0.00 -0.45 0.00 0.00 34.95 32.27 1ne2 s ARG 50 CO 0.00 0.34 0.45 -1.54 -0.68 0.00 0.00 175.30 173.87 1ne2 s SER 51 N -3.70 6.56 0.02 0.23 1.04 -1.26 -0.61 113.70 115.98 1ne2 s SER 51 Ca 0.32 0.67 0.07 0.00 0.48 0.00 0.00 55.95 57.49 1ne2 s SER 51 Cb -0.06 -2.26 -0.02 0.00 0.10 0.00 0.00 66.02 63.78 1ne2 s SER 51 CO 0.20 -0.06 -0.20 -0.69 0.98 0.00 0.00 173.24 173.48 1ne2 s VAL 52 N 1.05 1.61 -0.09 5.02 1.01 0.29 -1.16 120.40 128.14 1ne2 s VAL 52 Ca 0.23 -1.05 0.02 0.00 0.00 0.00 0.00 61.98 61.18 1ne2 s VAL 52 Cb -0.15 -1.38 0.01 0.00 0.00 0.00 0.00 36.38 34.87 1ne2 s VAL 52 CO 0.09 0.30 -0.13 -0.51 0.00 0.00 0.00 175.10 174.85 1ne2 s ILE 53 N -0.66 1.25 -0.33 2.22 2.07 -0.14 -0.37 121.20 125.25 1ne2 s ILE 53 Ca 0.07 -0.52 -0.09 0.00 -1.41 0.00 0.00 60.65 58.71 1ne2 s ILE 53 Cb -0.08 -1.16 0.01 0.00 0.13 0.00 0.00 42.46 41.36 1ne2 s ILE 53 CO 0.01 0.39 0.14 -0.62 -1.91 0.00 0.00 174.94 172.95 1ne2 s ASP 54 N 0.89 5.45 -0.06 4.50 2.15 0.38 -1.02 116.67 128.96 1ne2 s ASP 54 Ca -0.10 -0.78 -0.19 0.00 0.43 0.00 0.00 52.55 51.91 1ne2 s ASP 54 Cb -0.15 -1.96 -0.05 0.00 -0.30 0.00 0.00 42.92 40.47 1ne2 s ASP 54 CO 0.01 -0.26 0.54 0.00 -0.17 0.00 0.00 175.17 175.28 1ne2 s ALA 55 N 1.54 3.48 -0.92 3.66 0.00 0.71 -2.02 121.76 128.21 1ne2 s ALA 55 Ca 0.03 -0.08 -0.01 0.00 0.00 0.00 0.00 51.96 51.89 1ne2 s ALA 55 Cb -0.18 -2.69 -0.01 0.00 0.00 0.00 0.00 23.12 20.24 1ne2 s ALA 55 CO 0.05 0.09 0.78 0.41 0.00 0.00 0.00 175.76 177.08 1ne2 n GLY 56 N 2.85 -0.29 0.31 0.00 0.00 -0.11 -4.20 105.19 103.75 1ne2 n GLY 56 Ca -0.07 0.06 0.19 0.00 0.00 0.00 0.00 46.02 46.20 1ne2 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ne2 h THR 57 N -1.37 0.14 0.00 2.61 1.03 -1.28 -3.44 112.91 110.59 1ne2 h THR 57 Ca -0.47 -0.20 0.00 0.00 -0.01 0.00 0.00 66.41 65.73 1ne2 h THR 57 Cb 1.26 1.17 0.00 0.00 -1.07 0.00 0.00 68.15 69.51 1ne2 h THR 57 CO 0.38 0.02 0.00 0.61 -0.01 0.00 0.00 175.52 176.52 1ne2 n GLY 58 N -0.79 3.51 0.00 2.99 0.00 -1.26 0.44 105.19 110.08 1ne2 n GLY 58 Ca -0.02 0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.11 1ne2 n GLY 58 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ne2 n ASN 59 N 5.09 0.00 0.00 1.61 6.94 -1.26 -4.34 115.26 123.30 1ne2 n ASN 59 Ca 0.00 -0.14 0.00 0.00 -0.02 0.00 0.00 54.58 54.42 1ne2 n ASN 59 Cb 0.00 -0.19 0.00 0.00 -2.36 0.00 0.00 39.78 37.23 1ne2 n ASN 59 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ne2 n GLY 60 N 0.09 0.66 0.27 4.83 0.00 0.17 -3.97 105.19 107.25 1ne2 n GLY 60 Ca 0.09 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.16 1ne2 n GLY 60 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ne2 h ILE 61 N 0.00 0.62 -0.02 -0.61 2.10 -1.90 0.66 117.51 118.37 1ne2 h ILE 61 Ca 0.00 -0.13 -0.11 0.00 1.08 0.00 0.00 64.86 65.70 1ne2 h ILE 61 Cb 0.00 0.21 -0.01 0.00 -1.09 0.00 0.00 36.82 35.93 1ne2 h ILE 61 CO 0.00 0.07 -0.51 -0.07 -1.08 0.00 0.00 178.15 176.56 1ne2 h LEU 62 N 0.37 0.05 -0.05 2.19 3.38 -1.94 -0.89 115.31 118.43 1ne2 h LEU 62 Ca 0.40 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.26 1ne2 h LEU 62 Cb 0.63 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1ne2 h LEU 62 CO -0.43 0.55 -0.32 0.00 0.09 0.00 0.00 178.44 178.32 1ne2 h ALA 63 N 1.46 0.10 -0.85 1.53 0.00 -1.59 -2.00 119.26 117.91 1ne2 h ALA 63 Ca -0.00 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.46 1ne2 h ALA 63 Cb 0.91 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 1ne2 h ALA 63 CO 0.07 0.17 0.55 0.00 0.00 0.00 0.00 179.25 180.04 1ne2 h GLY 65 N 1.15 1.33 1.06 0.00 0.00 -1.13 0.13 103.07 105.61 1ne2 h GLY 65 Ca 0.31 -0.64 -0.06 0.00 0.00 0.00 0.00 47.33 46.93 1ne2 h GLY 65 CO -0.06 0.61 0.22 1.76 0.00 0.00 0.00 176.54 179.06 1ne2 h SER 66 N 1.23 1.10 -0.39 0.19 0.02 -0.81 -0.74 113.55 114.15 1ne2 h SER 66 Ca 0.30 -0.22 -0.05 0.00 -0.84 0.00 0.00 61.79 60.99 1ne2 h SER 66 Cb 0.09 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.32 1ne2 h SER 66 CO -0.04 1.03 0.06 0.22 -1.14 0.00 0.00 176.83 176.95 1ne2 h TYR 67 N 1.11 0.69 0.00 3.45 3.20 -0.76 -2.49 116.97 122.17 1ne2 h TYR 67 Ca 0.24 -0.10 -0.03 0.00 3.14 0.00 0.00 58.73 61.98 1ne2 h TYR 67 Cb 0.33 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.41 1ne2 h TYR 67 CO 0.03 0.69 -0.13 -0.07 -1.64 0.00 0.00 178.16 177.03 1ne2 h LEU 68 N 0.49 0.00 -0.59 2.82 3.38 -0.42 -1.92 115.31 119.07 1ne2 h LEU 68 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1ne2 h LEU 68 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1ne2 h LEU 68 CO 0.01 0.13 0.00 0.18 0.09 0.00 0.00 178.44 178.85 1ne2 n LEU 69 N -3.88 0.88 0.00 1.67 4.77 -0.31 -4.91 117.00 115.22 1ne2 n LEU 69 Ca -0.02 -0.39 0.00 0.00 -0.03 0.00 0.00 56.01 55.57 1ne2 n LEU 69 Cb 0.22 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1ne2 n LEU 69 CO 0.32 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1ne2 n GLY 70 N 0.93 0.92 3.75 -0.72 0.00 -0.72 -4.40 105.19 104.95 1ne2 n GLY 70 Ca 0.13 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 45.27 1ne2 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ne2 s ALA 71 N -2.00 2.86 0.17 4.61 0.00 -0.98 -1.97 121.76 124.45 1ne2 s ALA 71 Ca 0.00 1.30 -0.09 0.00 0.00 0.00 0.00 51.96 53.18 1ne2 s ALA 71 Cb 0.00 -3.55 0.04 0.00 0.00 0.00 0.00 23.12 19.61 1ne2 s ALA 71 CO 0.00 -1.29 1.54 1.49 0.00 0.00 0.00 175.76 177.50 1ne2 h GLU 72 N 1.57 0.90 -2.83 0.00 4.81 -1.03 -3.44 114.58 114.57 1ne2 h GLU 72 Ca -0.51 -0.42 -0.12 0.00 -0.13 0.00 0.00 59.36 58.18 1ne2 h GLU 72 Cb 1.29 -0.01 -0.23 0.00 0.63 0.00 0.00 28.75 30.43 1ne2 h GLU 72 CO 0.58 1.07 -0.25 -1.54 -0.73 0.00 0.00 179.01 178.15 1ne2 s SER 73 N -6.79 -0.36 -0.06 1.04 1.04 -1.05 -4.99 113.70 102.54 1ne2 s SER 73 Ca -0.10 0.60 0.01 0.00 0.48 0.00 0.00 55.95 56.93 1ne2 s SER 73 Cb 0.12 0.66 0.02 0.00 0.10 0.00 0.00 66.02 66.92 1ne2 s SER 73 CO 0.87 -0.24 -0.08 -0.69 0.98 0.00 0.00 173.24 174.08 1ne2 s VAL 74 N -0.26 0.81 0.02 5.02 1.01 -1.26 -0.54 120.40 125.20 1ne2 s VAL 74 Ca -0.04 -0.27 0.07 0.00 0.00 0.00 0.00 61.98 61.74 1ne2 s VAL 74 Cb -0.03 -0.78 -0.02 0.00 0.00 0.00 0.00 36.38 35.54 1ne2 s VAL 74 CO 0.02 0.29 -0.22 -0.89 0.00 0.00 0.00 175.10 174.30 1ne2 s THR 75 N 0.87 1.76 -0.09 3.92 2.01 0.50 -0.83 115.64 123.78 1ne2 s THR 75 Ca -0.11 -1.14 -0.12 0.00 0.31 0.00 0.00 61.69 60.62 1ne2 s THR 75 Cb -0.15 -1.50 0.03 0.00 0.01 0.00 0.00 72.50 70.89 1ne2 s THR 75 CO 0.01 0.32 0.31 0.00 -0.69 0.00 0.00 174.62 174.58 1ne2 s ALA 76 N -0.71 -0.78 0.05 7.40 0.00 -0.20 -0.47 121.76 127.05 1ne2 s ALA 76 Ca 0.08 0.75 -0.00 0.00 0.00 0.00 0.00 51.96 52.80 1ne2 s ALA 76 Cb -0.09 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.62 1ne2 s ALA 76 CO 0.01 -0.18 -0.04 -0.59 0.00 0.00 0.00 175.76 174.96 1ne2 s PHE 77 N -0.20 0.55 0.01 0.00 -0.12 -0.86 -4.19 117.98 113.16 1ne2 s PHE 77 Ca -0.03 -0.91 -0.21 0.00 -0.05 0.00 0.00 56.93 55.73 1ne2 s PHE 77 Cb -0.03 -0.38 0.04 0.00 -0.63 0.00 0.00 43.02 42.03 1ne2 s PHE 77 CO 0.01 -0.29 0.48 0.34 -0.05 0.00 0.00 175.22 175.71 1ne2 s ASP 78 N -2.58 -0.39 0.38 1.98 2.15 -1.26 -0.94 116.67 116.01 1ne2 s ASP 78 Ca 0.02 0.24 0.20 0.00 0.43 0.00 0.00 52.55 53.45 1ne2 s ASP 78 Cb 0.03 0.44 0.42 0.00 -0.30 0.00 0.00 42.92 43.51 1ne2 s ASP 78 CO -0.07 -0.61 1.61 -0.29 -0.17 0.00 0.00 175.17 175.65 1ne2 h ILE 79 N 3.17 0.50 -3.55 4.11 6.09 -1.94 -0.93 117.51 124.96 1ne2 h ILE 79 Ca -0.30 -1.52 -0.62 0.00 -1.37 0.00 0.00 64.86 61.06 1ne2 h ILE 79 Cb 1.18 2.10 -0.12 0.00 0.47 0.00 0.00 36.82 40.45 1ne2 h ILE 79 CO 0.41 0.26 0.31 -0.62 -3.07 0.00 0.00 178.15 175.44 1ne2 s ASP 80 N -6.28 6.50 0.48 2.19 3.68 -1.26 -4.72 116.67 117.27 1ne2 s ASP 80 Ca 0.04 0.24 0.19 0.00 2.13 0.00 0.00 52.55 55.15 1ne2 s ASP 80 Cb 0.08 -2.38 1.22 0.00 -1.45 0.00 0.00 42.92 40.39 1ne2 s ASP 80 CO 0.69 -0.71 2.05 1.55 0.13 0.00 0.00 175.17 178.87 1ne2 h PRO 81 N 8.53 0.00 -0.38 4.34 0.13 -2.00 -2.15 132.00 140.46 1ne2 h PRO 81 Ca -0.25 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.75 1ne2 h PRO 81 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 1ne2 h PRO 81 CO 0.90 0.14 -0.27 -0.44 -0.23 0.00 0.00 178.00 178.10 1ne2 h ASP 82 N 0.00 0.82 -0.30 1.44 3.32 -1.99 -1.07 116.42 118.65 1ne2 h ASP 82 Ca -0.00 -0.32 -0.03 0.00 0.02 0.00 0.00 57.03 56.70 1ne2 h ASP 82 Cb 0.28 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1ne2 h ASP 82 CO 0.02 1.04 0.07 0.00 -1.72 0.00 0.00 179.24 178.65 1ne2 h ALA 83 N 1.02 0.39 -0.65 3.45 0.00 -1.70 -2.51 119.26 119.25 1ne2 h ALA 83 Ca 0.08 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1ne2 h ALA 83 Cb 0.80 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1ne2 h ALA 83 CO 0.07 0.05 0.26 0.82 0.00 0.00 0.00 179.25 180.45 1ne2 h ILE 84 N 0.31 1.23 -0.77 0.00 1.08 -1.31 0.12 117.51 118.16 1ne2 h ILE 84 Ca 0.09 -0.72 0.01 0.00 -0.39 0.00 0.00 64.86 63.86 1ne2 h ILE 84 Cb 0.29 0.45 -0.04 0.00 -3.07 0.00 0.00 36.82 34.46 1ne2 h ILE 84 CO 0.00 0.29 0.51 -0.08 -0.69 0.00 0.00 178.15 178.18 1ne2 h GLU 85 N 0.94 1.00 -0.21 2.37 4.22 -1.01 -0.20 114.58 121.69 1ne2 h GLU 85 Ca 0.22 -0.06 -0.14 0.00 0.08 0.00 0.00 59.36 59.46 1ne2 h GLU 85 Cb 0.19 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1ne2 h GLU 85 CO -0.02 0.66 -0.40 1.15 -2.18 0.00 0.00 179.01 178.22 1ne2 h THR 86 N 1.03 1.32 -0.58 0.32 2.02 -0.97 -3.21 112.91 112.85 1ne2 h THR 86 Ca 0.29 -1.62 0.04 0.00 0.77 0.00 0.00 66.41 65.88 1ne2 h THR 86 Cb -0.10 1.82 -0.04 0.00 -1.74 0.00 0.00 68.15 68.09 1ne2 h THR 86 CO -0.07 0.51 0.34 0.00 0.37 0.00 0.00 175.52 176.66 1ne2 h ALA 87 N 0.61 0.75 -0.63 6.16 0.00 -0.38 -2.14 119.26 123.65 1ne2 h ALA 87 Ca 0.01 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.96 1ne2 h ALA 87 Cb 1.00 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 1ne2 h ALA 87 CO 0.09 0.04 0.41 0.87 0.00 0.00 0.00 179.25 180.66 1ne2 h LYS 88 N 0.65 0.68 0.00 0.00 1.57 -1.07 -0.77 116.57 117.63 1ne2 h LYS 88 Ca 0.24 -0.04 -0.14 0.00 -1.87 0.00 0.00 60.65 58.85 1ne2 h LYS 88 Cb 0.07 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 1ne2 h LYS 88 CO -0.12 0.45 -0.65 0.00 -0.57 0.00 0.00 179.45 178.56 1ne2 h ARG 89 N 0.70 0.00 -0.41 3.15 3.08 -1.44 -2.96 114.38 116.50 1ne2 h ARG 89 Ca 0.26 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.17 1ne2 h ARG 89 Cb 0.15 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 1ne2 h ARG 89 CO -0.07 0.65 -0.29 -0.91 -1.07 0.00 0.00 179.97 178.27 1ne2 h ASN 90 N 0.00 0.96 -1.50 7.04 2.35 -0.53 -3.42 115.58 120.49 1ne2 h ASN 90 Ca -0.01 -0.43 -0.19 0.00 -0.55 0.00 0.00 56.30 55.12 1ne2 h ASN 90 Cb 1.28 -0.27 -0.26 0.00 0.05 0.00 0.00 38.32 39.12 1ne2 h ASN 90 CO 0.08 1.19 -0.54 0.00 -1.65 0.00 0.00 177.43 176.51 1ne2 h GLY 92 N 7.42 0.00 2.00 0.00 0.00 -1.78 -2.61 103.07 108.10 1ne2 h GLY 92 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1ne2 h GLY 92 CO 0.18 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.33 1ne2 n GLY 93 N -0.80 -1.20 3.84 4.60 0.00 -1.26 -4.74 105.19 105.63 1ne2 n GLY 93 Ca -0.02 0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1ne2 n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ne2 s VAL 94 N -3.17 4.89 -1.09 1.61 1.01 -0.99 -4.80 120.40 117.86 1ne2 s VAL 94 Ca 0.06 0.88 -0.20 0.00 0.00 0.00 0.00 61.98 62.72 1ne2 s VAL 94 Cb 0.10 -3.76 0.09 0.00 0.00 0.00 0.00 36.38 32.81 1ne2 s VAL 94 CO 0.36 0.39 1.44 0.21 0.00 0.00 0.00 175.10 177.49 1ne2 s ASN 95 N -1.45 6.69 0.64 3.32 2.47 -0.01 -4.98 114.94 121.61 1ne2 s ASN 95 Ca 0.32 -2.03 -0.04 0.00 0.42 0.00 0.00 52.86 51.54 1ne2 s ASN 95 Cb -0.16 -2.51 0.05 0.00 -1.45 0.00 0.00 41.25 37.17 1ne2 s ASN 95 CO 0.18 -1.22 0.91 -0.36 -3.72 0.00 0.00 177.10 172.89 1ne2 s PHE 96 N 3.80 2.92 -0.11 0.43 0.08 -1.26 -1.04 117.98 122.80 1ne2 s PHE 96 Ca 0.44 0.28 0.03 0.00 0.12 0.00 0.00 56.93 57.81 1ne2 s PHE 96 Cb -0.01 -2.99 0.00 0.00 -0.57 0.00 0.00 43.02 39.46 1ne2 s PHE 96 CO -0.04 -1.16 -0.22 0.08 -0.10 0.00 0.00 175.22 173.77 1ne2 s VAL 98 N -3.04 1.98 -0.15 -0.44 1.01 -1.26 -4.94 120.40 113.56 1ne2 s VAL 98 Ca 0.58 -0.96 -0.31 0.00 0.00 0.00 0.00 61.98 61.30 1ne2 s VAL 98 Cb -0.11 -1.73 0.13 0.00 0.00 0.00 0.00 36.38 34.67 1ne2 s VAL 98 CO 0.42 0.54 1.05 0.00 0.00 0.00 0.00 175.10 177.11 1ne2 s ALA 99 N 0.56 -1.96 0.33 5.51 0.00 -0.35 -4.91 121.76 120.94 1ne2 s ALA 99 Ca -0.14 1.51 -0.10 0.00 0.00 0.00 0.00 51.96 53.23 1ne2 s ALA 99 Cb -0.17 -0.48 -0.07 0.00 0.00 0.00 0.00 23.12 22.40 1ne2 s ALA 99 CO 0.04 -0.43 0.67 0.34 0.00 0.00 0.00 175.76 176.39 1ne2 s ASP 100 N -1.56 6.59 0.50 0.00 2.15 -1.26 -3.31 116.67 119.78 1ne2 s ASP 100 Ca 0.03 1.04 0.15 0.00 0.43 0.00 0.00 52.55 54.20 1ne2 s ASP 100 Cb -0.01 -2.28 1.21 0.00 -0.30 0.00 0.00 42.92 41.54 1ne2 s ASP 100 CO -0.03 -0.24 2.13 1.62 -0.17 0.00 0.00 175.17 178.48 1ne2 h VAL 101 N 1.54 1.00 0.00 1.11 3.04 -1.97 -1.33 116.25 119.65 1ne2 h VAL 101 Ca -0.47 -0.03 -0.01 0.00 -1.01 0.00 0.00 66.70 65.18 1ne2 h VAL 101 Cb 1.18 0.90 -0.00 0.00 -2.01 0.00 0.00 31.29 31.36 1ne2 h VAL 101 CO 0.66 0.02 -0.04 0.77 -1.01 0.00 0.00 177.57 177.96 1ne2 h SER 102 N 0.09 0.00 1.90 3.17 4.64 -1.93 -2.35 113.55 119.08 1ne2 h SER 102 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1ne2 h SER 102 Cb 0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1ne2 h SER 102 CO -0.01 0.04 0.00 -0.33 -0.87 0.00 0.00 176.83 175.67 1ne2 h GLU 103 N 0.00 0.00 -6.59 4.77 5.08 -1.63 -3.46 114.58 112.76 1ne2 h GLU 103 Ca -0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 1ne2 h GLU 103 Cb 0.18 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.47 1ne2 h GLU 103 CO 0.01 0.00 0.90 0.42 -1.00 0.00 0.00 179.01 179.34 1ne2 s ILE 104 N -3.21 2.65 0.00 3.13 -1.09 -0.89 -4.89 121.20 116.91 1ne2 s ILE 104 Ca 0.07 0.43 0.00 0.00 -2.23 0.00 0.00 60.65 58.92 1ne2 s ILE 104 Cb 0.06 -3.28 0.00 0.00 -1.58 0.00 0.00 42.46 37.66 1ne2 s ILE 104 CO 0.66 0.03 0.25 -1.54 -1.23 0.00 0.00 174.94 173.11 1ne2 n SER 105 N 4.21 0.00 -4.87 3.58 3.41 -1.26 -5.08 113.62 113.61 1ne2 n SER 105 Ca 0.14 -1.00 -0.21 0.00 -0.26 0.00 0.00 58.87 57.54 1ne2 n SER 105 Cb 0.39 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.40 1ne2 n SER 105 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1ne2 s GLY 106 N 0.00 1.80 -0.09 5.00 0.00 -1.26 -5.10 107.32 107.66 1ne2 s GLY 106 Ca 0.00 -1.65 -0.01 0.00 0.00 0.00 0.00 44.72 43.06 1ne2 s GLY 106 CO 0.00 -1.23 -0.02 1.25 0.00 0.00 0.00 173.10 173.10 1ne2 s LYS 107 N -4.86 3.00 0.01 2.90 2.20 -1.26 -4.74 119.74 116.98 1ne2 s LYS 107 Ca 0.61 -0.46 -0.04 0.00 -0.36 0.00 0.00 55.97 55.73 1ne2 s LYS 107 Cb -0.08 -2.76 -0.01 0.00 -1.51 0.00 0.00 37.83 33.48 1ne2 s LYS 107 CO 0.40 0.64 0.07 0.71 -0.36 0.00 0.00 175.35 176.82 1ne2 s TYR 108 N -0.72 0.11 0.08 4.03 2.02 -0.93 -5.04 117.35 116.90 1ne2 s TYR 108 Ca 0.11 -0.25 -0.23 0.00 -0.37 0.00 0.00 57.07 56.33 1ne2 s TYR 108 Cb -0.12 -0.09 -0.14 0.00 -0.40 0.00 0.00 41.96 41.21 1ne2 s TYR 108 CO 0.02 -0.24 1.68 -0.44 -1.57 0.00 0.00 175.55 175.00 1ne2 h ASP 109 N 4.53 0.05 -3.75 2.29 3.32 -1.44 -3.35 116.42 118.07 1ne2 h ASP 109 Ca -0.31 -0.07 -0.58 0.00 0.02 0.00 0.00 57.03 56.09 1ne2 h ASP 109 Cb 1.20 -0.01 -0.32 0.00 0.22 0.00 0.00 39.33 40.42 1ne2 h ASP 109 CO 0.41 0.11 -0.84 -0.89 -1.72 0.00 0.00 179.24 176.30 1ne2 s THR 110 N -5.91 1.49 -0.15 0.35 2.01 -0.81 -1.22 115.64 111.40 1ne2 s THR 110 Ca -0.13 -0.73 -0.02 0.00 0.31 0.00 0.00 61.69 61.12 1ne2 s THR 110 Cb 0.06 -1.29 -0.02 0.00 0.01 0.00 0.00 72.50 71.26 1ne2 s THR 110 CO 0.67 0.43 -0.09 0.86 -0.69 0.00 0.00 174.62 175.80 1ne2 s TRP 111 N 0.18 2.89 0.31 4.92 -0.11 0.69 -0.96 118.94 126.86 1ne2 s TRP 111 Ca -0.08 -0.64 0.08 0.00 1.22 0.00 0.00 56.10 56.68 1ne2 s TRP 111 Cb -0.13 -1.92 -0.06 0.00 -1.50 0.00 0.00 33.47 29.85 1ne2 s TRP 111 CO 0.03 -0.25 -0.09 0.42 -4.62 0.00 0.00 176.95 172.45 1ne2 s ILE 112 N 0.60 2.01 -0.47 5.86 1.01 -0.19 -0.54 121.20 129.48 1ne2 s ILE 112 Ca -0.06 -2.18 0.04 0.00 0.00 0.00 0.00 60.65 58.44 1ne2 s ILE 112 Cb -0.15 -2.54 0.21 0.00 0.01 0.00 0.00 42.46 39.98 1ne2 s ILE 112 CO 0.03 -0.26 0.86 -3.20 0.00 0.00 0.00 174.94 172.37 1ne2 n ASN 114 N -0.70 -2.86 -4.68 3.58 5.15 -1.26 -0.20 115.26 114.29 1ne2 n ASN 114 Ca -0.05 -2.54 -0.47 0.00 -0.60 0.00 0.00 54.58 50.92 1ne2 n ASN 114 Cb 0.63 1.52 -0.04 0.00 -0.53 0.00 0.00 39.78 41.36 1ne2 n ASN 114 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 1ne2 n PRO 115 N 2.57 2.33 0.04 1.20 -0.02 -1.19 -4.95 135.00 134.99 1ne2 n PRO 115 Ca 0.14 0.85 -0.07 0.00 -2.02 0.00 0.00 63.50 62.40 1ne2 n PRO 115 Cb 0.60 -2.72 -0.12 0.00 -0.02 0.00 0.00 33.50 31.23 1ne2 n PRO 115 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1ne2 h PRO 116 N 9.30 0.00 -7.07 0.52 0.11 -2.00 -3.34 132.00 129.52 1ne2 h PRO 116 Ca -0.49 -0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.08 1ne2 h PRO 116 Cb 1.26 0.00 0.18 0.00 0.11 0.00 0.00 31.00 32.56 1ne2 h PRO 116 CO 0.94 0.89 0.18 1.97 -0.21 0.00 0.00 178.00 181.78 1ne2 n PHE 117 N -3.29 0.85 0.00 0.65 1.16 -1.26 -4.78 117.46 110.78 1ne2 n PHE 117 Ca -0.04 0.39 0.00 0.00 -1.87 0.00 0.00 57.45 55.93 1ne2 n PHE 117 Cb 0.96 -2.08 0.00 0.00 -1.61 0.00 0.00 39.48 36.76 1ne2 n PHE 117 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1ne2 n GLY 118 N 0.84 2.03 0.16 4.97 0.00 -1.26 -4.50 105.19 107.42 1ne2 n GLY 118 Ca 0.13 -0.22 -0.13 0.00 0.00 0.00 0.00 46.02 45.80 1ne2 n GLY 118 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ne2 h SER 119 N 0.00 0.47 -3.44 1.61 0.02 -1.96 -3.30 113.55 106.95 1ne2 h SER 119 Ca 0.00 -0.44 -0.61 0.00 -0.84 0.00 0.00 61.79 59.90 1ne2 h SER 119 Cb 0.00 -0.13 -0.11 0.00 0.14 0.00 0.00 62.40 62.30 1ne2 h SER 119 CO 0.00 0.81 0.26 -0.69 -1.14 0.00 0.00 176.83 176.07 1ne2 s VAL 120 N -4.47 4.91 -0.10 2.27 1.01 -1.26 -5.00 120.40 117.77 1ne2 s VAL 120 Ca -0.14 1.19 -0.06 0.00 0.00 0.00 0.00 61.98 62.97 1ne2 s VAL 120 Cb 0.06 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1ne2 s VAL 120 CO 0.77 -0.07 0.15 -0.69 0.00 0.00 0.00 175.10 175.26 1ne2 s VAL 121 N 2.67 5.49 0.49 2.92 1.01 -1.26 -4.95 120.40 126.77 1ne2 s VAL 121 Ca 0.29 0.16 0.02 0.00 0.00 0.00 0.00 61.98 62.44 1ne2 s VAL 121 Cb -0.15 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.79 1ne2 s VAL 121 CO 0.09 0.57 0.03 -0.54 0.00 0.00 0.00 175.10 175.25 1ne2 s LYS 122 N -1.18 2.14 0.26 2.72 1.02 -1.26 -5.00 119.74 118.45 1ne2 s LYS 122 Ca 0.17 -2.36 -0.03 0.00 0.02 0.00 0.00 55.97 53.77 1ne2 s LYS 122 Cb -0.12 -1.35 0.40 0.00 -0.52 0.00 0.00 37.83 36.24 1ne2 s LYS 122 CO 0.06 -0.39 1.86 1.25 -0.92 0.00 0.00 175.35 177.22 1ne2 h HIS 123 N 1.44 1.09 -0.52 3.18 -0.00 -2.00 -2.25 115.15 116.09 1ne2 h HIS 123 Ca -0.42 0.03 -0.06 0.00 -0.00 0.00 0.00 60.37 59.91 1ne2 h HIS 123 Cb 1.31 -0.35 -0.02 0.00 -0.00 0.00 0.00 27.41 28.35 1ne2 h HIS 123 CO 1.53 0.53 0.07 1.03 -0.00 0.00 0.00 177.93 181.09 1ne2 h SER 124 N 1.05 0.83 -0.73 3.26 0.87 -1.98 -1.70 113.55 115.15 1ne2 h SER 124 Ca 0.42 -0.27 0.06 0.00 -1.23 0.00 0.00 61.79 60.77 1ne2 h SER 124 Cb 0.23 -0.22 -0.06 0.00 -0.44 0.00 0.00 62.40 61.91 1ne2 h SER 124 CO -0.19 0.89 0.42 0.44 -0.53 0.00 0.00 176.83 177.86 1ne2 h ASP 125 N 0.75 0.64 1.11 6.23 3.32 -1.80 -0.48 116.42 126.19 1ne2 h ASP 125 Ca 0.16 0.03 -0.09 0.00 0.02 0.00 0.00 57.03 57.15 1ne2 h ASP 125 Cb 0.42 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1ne2 h ASP 125 CO 0.01 0.41 -0.40 0.03 -1.72 0.00 0.00 179.24 177.57 1ne2 h ARG 126 N 0.78 0.00 -0.64 3.56 3.08 -1.44 -3.19 114.38 116.52 1ne2 h ARG 126 Ca 0.32 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.39 1ne2 h ARG 126 Cb 0.18 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.19 1ne2 h ARG 126 CO -0.18 0.40 0.41 0.00 -1.07 0.00 0.00 179.97 179.54 1ne2 h ALA 127 N 1.60 0.83 -0.54 0.04 0.00 -0.13 0.11 119.26 121.17 1ne2 h ALA 127 Ca -0.00 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 1ne2 h ALA 127 Cb 1.07 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1ne2 h ALA 127 CO 0.05 0.19 -0.00 0.74 0.00 0.00 0.00 179.25 180.23 1ne2 h PHE 128 N 0.82 1.04 -0.14 0.00 -1.00 -1.43 -0.35 116.94 115.88 1ne2 h PHE 128 Ca 0.25 -0.18 -0.01 0.00 2.81 0.00 0.00 57.97 60.84 1ne2 h PHE 128 Cb -0.02 -0.27 -0.01 0.00 3.61 0.00 0.00 35.95 39.26 1ne2 h PHE 128 CO -0.04 0.95 0.04 0.82 -1.61 0.00 0.00 178.31 178.46 1ne2 h ILE 129 N 0.83 1.19 -0.37 -0.55 2.04 -1.48 -0.84 117.51 118.33 1ne2 h ILE 129 Ca 0.15 -0.59 0.02 0.00 1.00 0.00 0.00 64.86 65.44 1ne2 h ILE 129 Cb 0.54 1.33 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 1ne2 h ILE 129 CO 0.03 0.18 0.21 0.44 0.00 0.00 0.00 178.15 179.00 1ne2 h ASP 130 N 0.03 0.33 -0.77 1.72 3.45 -0.69 -2.38 116.42 118.10 1ne2 h ASP 130 Ca 0.04 0.01 -0.04 0.00 0.43 0.00 0.00 57.03 57.47 1ne2 h ASP 130 Cb 0.24 -0.06 -0.03 0.00 -0.56 0.00 0.00 39.33 38.92 1ne2 h ASP 130 CO -0.00 0.24 0.31 0.50 -1.57 0.00 0.00 179.24 178.72 1ne2 h LYS 131 N 0.42 1.16 -0.34 3.56 1.63 -0.97 -2.80 116.57 119.23 1ne2 h LYS 131 Ca 0.15 -0.21 0.03 0.00 -0.85 0.00 0.00 60.65 59.77 1ne2 h LYS 131 Cb 0.02 -0.19 -0.03 0.00 -0.60 0.00 0.00 32.23 31.43 1ne2 h LYS 131 CO -0.08 0.94 0.15 0.00 -3.45 0.00 0.00 179.45 177.01 1ne2 h ALA 132 N 1.21 0.41 0.00 5.00 0.00 -0.74 -1.05 119.26 124.09 1ne2 h ALA 132 Ca 0.26 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1ne2 h ALA 132 Cb 0.21 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1ne2 h ALA 132 CO -0.02 -0.23 0.00 1.19 0.00 0.00 0.00 179.25 180.19 1ne2 n PHE 133 N -4.97 0.38 0.71 0.00 3.72 -0.93 -1.27 117.46 115.10 1ne2 n PHE 133 Ca 0.00 0.14 0.11 0.00 -0.05 0.00 0.00 57.45 57.65 1ne2 n PHE 133 Cb 0.09 -0.73 -0.09 0.00 -0.94 0.00 0.00 39.48 37.82 1ne2 n PHE 133 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1ne2 n GLU 134 N -1.84 0.19 -0.09 -1.08 2.13 -0.87 -4.64 120.64 114.45 1ne2 n GLU 134 Ca 0.04 -0.04 -0.15 0.00 0.66 0.00 0.00 57.16 57.66 1ne2 n GLU 134 Cb 0.24 -1.52 -0.08 0.00 0.27 0.00 0.00 31.44 30.35 1ne2 n GLU 134 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1ne2 n THR 135 N -1.75 1.06 -1.34 6.31 -1.04 -0.45 -4.97 114.28 112.09 1ne2 n THR 135 Ca 0.02 -0.37 0.00 0.00 -2.04 0.00 0.00 64.05 61.66 1ne2 n THR 135 Cb 0.40 -1.30 0.00 0.00 -1.82 0.00 0.00 70.33 67.61 1ne2 n THR 135 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1ne2 n SER 136 N -3.24 0.00 -1.70 8.00 7.64 -0.40 -2.19 113.62 121.73 1ne2 n SER 136 Ca -0.34 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.30 1ne2 n SER 136 Cb 0.83 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.99 1ne2 n SER 136 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 1ne2 n TRP 138 N 0.00 0.50 -5.03 1.43 7.02 -0.36 -4.66 117.44 116.35 1ne2 n TRP 138 Ca 0.00 0.41 -0.32 0.00 -1.02 0.00 0.00 57.50 56.57 1ne2 n TRP 138 Cb 0.00 -0.80 -0.16 0.00 -2.42 0.00 0.00 31.31 27.93 1ne2 n TRP 138 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 1ne2 s ILE 139 N 0.72 2.24 0.03 -0.99 1.01 -0.10 -0.22 121.20 123.88 1ne2 s ILE 139 Ca 0.37 -0.95 0.06 0.00 0.00 0.00 0.00 60.65 60.12 1ne2 s ILE 139 Cb -0.52 -1.88 -0.02 0.00 0.01 0.00 0.00 42.46 40.05 1ne2 s ILE 139 CO 0.27 0.55 -0.16 -0.31 0.00 0.00 0.00 174.94 175.28 1ne2 s TYR 140 N 0.45 1.45 -0.06 3.97 2.02 0.30 -0.13 117.35 125.34 1ne2 s TYR 140 Ca -0.15 -0.33 -0.07 0.00 -0.37 0.00 0.00 57.07 56.14 1ne2 s TYR 140 Cb -0.17 -0.88 0.02 0.00 -0.40 0.00 0.00 41.96 40.53 1ne2 s TYR 140 CO 0.06 0.04 0.19 0.45 -1.57 0.00 0.00 175.55 174.72 1ne2 s SER 141 N -0.94 -0.18 -0.05 2.29 0.15 -0.64 -4.26 113.70 110.07 1ne2 s SER 141 Ca 0.05 0.31 0.01 0.00 0.70 0.00 0.00 55.95 57.02 1ne2 s SER 141 Cb -0.08 0.38 0.02 0.00 -1.71 0.00 0.00 66.02 64.63 1ne2 s SER 141 CO 0.01 -0.12 -0.04 -0.51 1.20 0.00 0.00 173.24 173.78 1ne2 s ILE 142 N -0.13 0.58 0.00 6.45 2.07 -1.26 -0.41 121.20 128.51 1ne2 s ILE 142 Ca -0.02 -0.12 0.00 0.00 -1.41 0.00 0.00 60.65 59.10 1ne2 s ILE 142 Cb -0.02 -0.62 0.00 0.00 0.13 0.00 0.00 42.46 41.95 1ne2 s ILE 142 CO 0.01 0.25 0.00 0.61 -1.91 0.00 0.00 174.94 173.89 1ne2 n GLY 143 N 4.26 0.94 3.67 1.50 0.00 -0.81 -3.15 105.19 111.60 1ne2 n GLY 143 Ca -0.21 -0.81 -0.45 0.00 0.00 0.00 0.00 46.02 44.55 1ne2 n GLY 143 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ne2 n ASN 144 N -0.22 2.82 0.00 1.61 4.05 -1.25 -0.33 115.26 121.94 1ne2 n ASN 144 Ca 0.00 1.13 0.09 0.00 0.45 0.00 0.00 54.58 56.25 1ne2 n ASN 144 Cb 0.00 -1.43 0.39 0.00 1.23 0.00 0.00 39.78 39.97 1ne2 n ASN 144 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1ne2 n ALA 145 N 2.17 1.84 0.28 5.20 0.00 -0.81 -2.84 120.51 126.34 1ne2 n ALA 145 Ca 0.12 -0.06 0.17 0.00 0.00 0.00 0.00 53.44 53.67 1ne2 n ALA 145 Cb 0.31 -1.29 0.70 0.00 0.00 0.00 0.00 19.45 19.17 1ne2 n ALA 145 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1ne2 h LYS 146 N 0.00 0.00 -0.28 0.00 1.57 -1.89 -1.98 116.57 113.99 1ne2 h LYS 146 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ne2 h LYS 146 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1ne2 h LYS 146 CO 0.00 0.03 0.00 0.00 -0.57 0.00 0.00 179.45 178.91 1ne2 n ALA 147 N -2.11 2.46 -0.10 3.86 0.00 -1.13 -4.29 120.51 119.20 1ne2 n ALA 147 Ca 0.00 -0.78 -0.08 0.00 0.00 0.00 0.00 53.44 52.57 1ne2 n ALA 147 Cb 0.30 -0.96 -0.02 0.00 0.00 0.00 0.00 19.45 18.77 1ne2 n ALA 147 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1ne2 h ARG 148 N 3.55 -0.27 -0.04 0.00 2.43 -1.52 0.14 114.38 118.65 1ne2 h ARG 148 Ca 0.00 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1ne2 h ARG 148 Cb 0.78 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.39 1ne2 h ARG 148 CO 0.00 -0.18 0.03 -0.44 -1.51 0.00 0.00 179.97 177.87 1ne2 h ASP 149 N -0.29 0.05 -0.21 -3.80 3.32 -1.81 -0.26 116.42 113.42 1ne2 h ASP 149 Ca 0.16 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1ne2 h ASP 149 Cb 0.54 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 1ne2 h ASP 149 CO -0.51 0.04 0.14 0.15 -1.72 0.00 0.00 179.24 177.34 1ne2 h PHE 150 N 0.05 0.26 -0.37 4.55 3.57 -1.81 -1.93 116.94 121.27 1ne2 h PHE 150 Ca 0.02 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 1ne2 h PHE 150 Cb 0.00 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 1ne2 h PHE 150 CO -0.07 0.16 0.16 -0.07 -2.23 0.00 0.00 178.31 176.26 1ne2 h LEU 151 N 0.28 0.50 -0.59 0.59 3.38 -0.59 -1.22 115.31 117.65 1ne2 h LEU 151 Ca 0.08 -0.15 0.02 0.00 0.09 0.00 0.00 57.88 57.92 1ne2 h LEU 151 Cb -0.03 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 1ne2 h LEU 151 CO -0.02 0.51 0.36 -0.09 0.09 0.00 0.00 178.44 179.29 1ne2 h ARG 152 N 0.45 0.70 0.35 1.13 2.43 -0.95 0.28 114.38 118.77 1ne2 h ARG 152 Ca 0.12 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.24 1ne2 h ARG 152 Cb 0.15 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1ne2 h ARG 152 CO -0.01 0.46 -0.20 -0.09 -1.51 0.00 0.00 179.97 178.61 1ne2 h ARG 153 N 0.72 -0.50 -0.42 0.20 2.43 -1.13 -0.59 114.38 115.08 1ne2 h ARG 153 Ca 0.24 0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.43 1ne2 h ARG 153 Cb 0.01 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.66 1ne2 h ARG 153 CO -0.10 -0.34 0.21 0.93 -1.51 0.00 0.00 179.97 179.16 1ne2 h GLU 154 N -0.52 0.60 -0.45 0.20 4.39 -0.92 -2.30 114.58 115.58 1ne2 h GLU 154 Ca -0.04 -0.09 -0.05 0.00 0.34 0.00 0.00 59.36 59.52 1ne2 h GLU 154 Cb 0.43 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 1ne2 h GLU 154 CO 0.05 0.52 0.09 0.74 -1.16 0.00 0.00 179.01 179.24 1ne2 h PHE 155 N 0.54 0.77 0.00 4.33 0.04 -0.39 -2.86 116.94 119.37 1ne2 h PHE 155 Ca 0.14 -0.10 -0.02 0.00 2.80 0.00 0.00 57.97 60.79 1ne2 h PHE 155 Cb 0.11 -0.21 -0.00 0.00 2.20 0.00 0.00 35.95 38.04 1ne2 h PHE 155 CO -0.01 0.73 -0.10 0.66 -0.60 0.00 0.00 178.31 178.99 1ne2 h SER 156 N 0.60 0.00 1.65 2.17 4.64 -1.04 0.94 113.55 122.50 1ne2 h SER 156 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1ne2 h SER 156 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1ne2 h SER 156 CO 0.01 0.10 0.00 0.00 -0.87 0.00 0.00 176.83 176.06 1ne2 h ALA 157 N 1.90 1.00 0.00 5.18 0.00 -1.18 -3.31 119.26 122.85 1ne2 h ALA 157 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ne2 h ALA 157 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1ne2 h ALA 157 CO 0.01 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.80 1ne2 n ARG 158 N -2.93 0.97 -2.01 0.00 5.12 -0.90 -5.08 116.66 111.83 1ne2 n ARG 158 Ca 0.03 -0.35 -0.01 0.00 -1.93 0.00 0.00 57.85 55.60 1ne2 n ARG 158 Cb 0.45 -0.84 0.01 0.00 -1.16 0.00 0.00 32.46 30.92 1ne2 n ARG 158 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ne2 n GLY 159 N 0.24 1.26 3.49 -0.13 0.00 0.28 -1.57 105.19 108.75 1ne2 n GLY 159 Ca 0.00 -1.01 -0.39 0.00 0.00 0.00 0.00 46.02 44.62 1ne2 n GLY 159 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ne2 s ASP 160 N -1.64 5.79 -0.55 1.61 1.01 0.40 -4.20 116.67 119.08 1ne2 s ASP 160 Ca 0.06 -0.43 -0.27 0.00 0.71 0.00 0.00 52.55 52.61 1ne2 s ASP 160 Cb -0.01 -2.07 0.03 0.00 1.01 0.00 0.00 42.92 41.89 1ne2 s ASP 160 CO 0.02 -0.20 1.11 -0.69 0.21 0.00 0.00 175.17 175.62 1ne2 s VAL 161 N 1.67 4.16 -1.15 -1.27 1.01 -1.26 -0.47 120.40 123.09 1ne2 s VAL 161 Ca 0.05 0.79 0.22 0.00 0.00 0.00 0.00 61.98 63.04 1ne2 s VAL 161 Cb -0.17 -4.65 -0.18 0.00 0.00 0.00 0.00 36.38 31.38 1ne2 s VAL 161 CO 0.08 -1.21 0.97 2.22 0.00 0.00 0.00 175.10 177.15 1ne2 n PHE 162 N 8.06 0.00 -3.74 5.22 1.16 -0.33 -4.90 117.46 122.92 1ne2 n PHE 162 Ca 0.07 0.00 -0.14 0.00 -1.87 0.00 0.00 57.45 55.51 1ne2 n PHE 162 Cb 0.49 -0.02 -0.15 0.00 -1.61 0.00 0.00 39.48 38.19 1ne2 n PHE 162 CO 0.00 0.00 0.00 0.50 -1.87 0.00 0.00 176.76 175.39 1ne2 s ARG 163 N -2.92 0.08 -0.38 3.97 3.52 -0.92 -4.94 118.95 117.36 1ne2 s ARG 163 Ca 0.10 0.38 0.03 0.00 -0.13 0.00 0.00 55.73 56.11 1ne2 s ARG 163 Cb 0.16 -0.19 0.16 0.00 -1.56 0.00 0.00 34.95 33.52 1ne2 s ARG 163 CO 0.82 -0.18 0.38 -2.00 -0.81 0.00 0.00 175.30 173.51 1ne2 s GLU 164 N 1.27 0.69 -0.11 5.12 2.12 -1.21 -1.20 118.70 125.39 1ne2 s GLU 164 Ca -0.08 -1.06 -0.01 0.00 0.36 0.00 0.00 54.97 54.18 1ne2 s GLU 164 Cb -0.12 -0.81 -0.03 0.00 0.26 0.00 0.00 34.13 33.44 1ne2 s GLU 164 CO -0.06 -1.23 -0.08 -2.00 -0.54 0.00 0.00 175.26 171.35 1ne2 s GLU 165 N 1.20 3.14 -0.05 4.30 2.12 0.26 -4.92 118.70 124.74 1ne2 s GLU 165 Ca 0.20 -0.58 -0.25 0.00 0.36 0.00 0.00 54.97 54.70 1ne2 s GLU 165 Cb -0.13 -2.68 -0.04 0.00 0.26 0.00 0.00 34.13 31.54 1ne2 s GLU 165 CO -0.04 0.44 0.76 0.21 -0.54 0.00 0.00 175.26 176.10 1ne2 s LYS 166 N -0.22 4.47 0.01 4.30 2.20 -1.26 -0.74 119.74 128.49 1ne2 s LYS 166 Ca 0.03 1.00 0.03 0.00 -0.36 0.00 0.00 55.97 56.67 1ne2 s LYS 166 Cb -0.13 -3.45 -0.01 0.00 -1.51 0.00 0.00 37.83 32.73 1ne2 s LYS 166 CO 0.03 0.04 -0.10 0.14 -0.36 0.00 0.00 175.35 175.09 1ne2 s VAL 167 N 0.84 0.79 -0.11 4.02 -7.23 -0.85 -4.98 120.40 112.88 1ne2 s VAL 167 Ca 0.41 -0.58 -0.09 0.00 -1.81 0.00 0.00 61.98 59.91 1ne2 s VAL 167 Cb -0.18 -0.69 -0.04 0.00 0.56 0.00 0.00 36.38 36.02 1ne2 s VAL 167 CO 0.20 0.11 0.19 -0.31 -0.31 0.00 0.00 175.10 174.99 1ne2 s TYR 168 N -0.45 3.59 -0.04 2.82 2.02 -1.26 -0.29 117.35 123.74 1ne2 s TYR 168 Ca 0.02 0.59 0.07 0.00 -0.37 0.00 0.00 57.07 57.38 1ne2 s TYR 168 Cb -0.05 -2.05 -0.01 0.00 -0.40 0.00 0.00 41.96 39.45 1ne2 s TYR 168 CO 0.00 0.64 -0.25 0.42 -1.57 0.00 0.00 175.55 174.80 1ne2 s ILE 169 N -0.79 1.98 0.32 2.71 -1.09 -0.61 -4.94 121.20 118.77 1ne2 s ILE 169 Ca 0.16 -1.05 -0.28 0.00 -2.23 0.00 0.00 60.65 57.25 1ne2 s ILE 169 Cb -0.13 -1.66 -0.09 0.00 -1.58 0.00 0.00 42.46 38.99 1ne2 s ILE 169 CO 0.05 0.56 1.07 -0.89 -1.23 0.00 0.00 174.94 174.50 1ne2 s THR 170 N -0.33 3.59 -0.31 2.92 2.01 -1.26 -0.46 115.64 121.80 1ne2 s THR 170 Ca 0.02 1.47 -0.06 0.00 0.31 0.00 0.00 61.69 63.43 1ne2 s THR 170 Cb -0.12 -3.89 0.02 0.00 0.01 0.00 0.00 72.50 68.53 1ne2 s THR 170 CO 0.02 0.25 0.07 -0.69 -0.69 0.00 0.00 174.62 173.58 1ne2 s VAL 171 N -1.33 3.76 0.34 3.82 1.01 0.30 -4.82 120.40 123.48 1ne2 s VAL 171 Ca 0.49 -0.93 -0.27 0.00 0.00 0.00 0.00 61.98 61.27 1ne2 s VAL 171 Cb -0.28 -3.02 -0.13 0.00 0.00 0.00 0.00 36.38 32.95 1ne2 s VAL 171 CO 0.36 -0.02 1.00 -2.65 0.00 0.00 0.00 175.10 173.79 1ne2 n PRO 172 N 4.82 1.37 0.26 2.72 -0.02 -1.26 -4.83 135.00 138.05 1ne2 n PRO 172 Ca -0.14 0.48 0.12 0.00 -2.02 0.00 0.00 63.50 61.95 1ne2 n PRO 172 Cb 0.46 -1.92 0.78 0.00 -0.02 0.00 0.00 33.50 32.80 1ne2 n PRO 172 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ne2 h ARG 173 N 1.83 0.00 0.00 -0.52 3.08 -1.95 0.91 114.38 117.72 1ne2 h ARG 173 Ca -0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.64 1ne2 h ARG 173 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.39 1ne2 h ARG 173 CO 0.59 0.00 0.00 -0.84 -1.07 0.00 0.00 179.97 178.65 1ne2 h ILE 174 N 0.00 0.00 -0.26 2.04 3.07 -2.04 -1.19 117.51 119.13 1ne2 h ILE 174 Ca 0.02 -0.13 0.00 0.00 1.55 0.00 0.00 64.86 66.30 1ne2 h ILE 174 Cb 0.09 0.78 0.00 0.00 -0.27 0.00 0.00 36.82 37.43 1ne2 h ILE 174 CO -0.00 0.00 0.00 -1.22 -1.05 0.00 0.00 178.15 175.88 1ne2 n TYR 175 N -2.35 0.34 -3.43 0.16 4.01 0.30 -4.99 117.16 111.21 1ne2 n TYR 175 Ca 0.00 -0.33 -0.27 0.00 -0.16 0.00 0.00 57.90 57.14 1ne2 n TYR 175 Cb 0.14 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.13 1ne2 n TYR 175 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1ne2 s ARG 176 N -1.02 3.56 0.00 -0.72 0.52 -0.45 -4.99 118.95 115.86 1ne2 s ARG 176 Ca 0.22 -0.18 0.16 0.00 -0.52 0.00 0.00 55.73 55.41 1ne2 s ARG 176 Cb 0.13 -2.70 -0.12 0.00 0.52 0.00 0.00 34.95 32.78 1ne2 s ARG 176 CO 0.17 0.24 0.72 0.72 0.02 0.00 0.00 175.30 177.17 1ne2 n HIS 177 N -1.13 0.00 -3.56 -0.53 8.25 -1.26 -5.01 115.22 111.98 1ne2 n HIS 177 Ca -0.03 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.27 1ne2 n HIS 177 Cb 0.55 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.59 1ne2 n HIS 177 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1ne2 s HIS 178 N -2.29 -0.61 0.45 4.41 3.76 -1.26 -5.04 115.29 114.71 1ne2 s HIS 178 Ca 0.08 1.16 0.13 0.00 -0.15 0.00 0.00 55.06 56.28 1ne2 s HIS 178 Cb 0.12 0.39 1.06 0.00 1.11 0.00 0.00 32.58 35.26 1ne2 s HIS 178 CO 0.56 -0.50 2.05 0.66 -0.85 0.00 0.00 174.74 176.67 1ne2 h SER 179 N 3.31 0.29 -0.02 1.40 4.64 -1.99 -1.57 113.55 119.60 1ne2 h SER 179 Ca -0.26 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1ne2 h SER 179 Cb 1.15 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1ne2 h SER 179 CO 0.30 0.19 0.00 0.00 -0.87 0.00 0.00 176.83 176.45 1ne2 n TYR 180 N -4.48 0.02 -1.42 4.77 0.18 -1.26 -4.89 117.16 110.08 1ne2 n TYR 180 Ca 0.04 -0.01 -0.31 0.00 1.88 0.00 0.00 57.90 59.50 1ne2 n TYR 180 Cb 0.21 0.00 0.07 0.00 -0.38 0.00 0.00 39.34 39.24 1ne2 n TYR 180 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1ne2 s ASP 181 N -1.94 4.88 0.37 9.48 1.01 -0.59 -4.97 116.67 124.90 1ne2 s ASP 181 Ca 0.40 1.77 -0.27 0.00 0.71 0.00 0.00 52.55 55.16 1ne2 s ASP 181 Cb 0.21 -2.52 -0.09 0.00 1.01 0.00 0.00 42.92 41.53 1ne2 s ASP 181 CO 0.33 -1.78 1.23 -0.13 0.21 0.00 0.00 175.17 175.03 1ne2 s ARG 182 N -4.86 4.18 0.37 8.23 1.81 -1.26 -4.94 118.95 122.47 1ne2 s ARG 182 Ca 0.61 2.00 0.23 0.00 -1.72 0.00 0.00 55.73 56.85 1ne2 s ARG 182 Cb -0.16 -2.85 0.24 0.00 -0.45 0.00 0.00 34.95 31.72 1ne2 s ARG 182 CO 0.54 -0.26 1.44 0.00 -0.68 0.00 0.00 175.30 176.34 1ne2 h ALA 183 N 2.97 0.85 -3.25 2.13 0.00 -1.93 -3.45 119.26 116.58 1ne2 h ALA 183 Ca -0.49 -0.00 -0.43 0.00 0.00 0.00 0.00 54.91 53.99 1ne2 h ALA 183 Cb 1.23 0.00 -0.39 0.00 0.00 0.00 0.00 17.79 18.63 1ne2 h ALA 183 CO 0.64 0.00 -0.76 1.03 0.00 0.00 0.00 179.25 180.16 1ne2 s ARG 184 N -3.25 0.37 0.94 0.00 0.52 -1.26 -0.54 118.95 115.72 1ne2 s ARG 184 Ca 0.05 0.10 -0.14 0.00 -0.52 0.00 0.00 55.73 55.22 1ne2 s ARG 184 Cb 0.06 -1.06 0.16 0.00 0.52 0.00 0.00 34.95 34.63 1ne2 s ARG 184 CO 0.71 -0.39 1.18 0.96 0.02 0.00 0.00 175.30 177.78 1ne2 s ILE 185 N 2.03 1.95 -0.17 1.52 -4.36 0.39 -4.74 121.20 117.82 1ne2 s ILE 185 Ca 0.04 0.00 -0.08 0.00 -0.26 0.00 0.00 60.65 60.35 1ne2 s ILE 185 Cb -0.13 -2.82 -0.04 0.00 1.25 0.00 0.00 42.46 40.72 1ne2 s ILE 185 CO -0.05 0.00 0.10 -0.70 0.24 0.00 0.00 174.94 174.53 1ne2 s GLU 186 N -5.49 3.88 0.39 0.37 2.12 -1.26 -1.58 118.70 117.13 1ne2 s GLU 186 Ca 0.67 -0.25 0.08 0.00 0.36 0.00 0.00 54.97 55.82 1ne2 s GLU 186 Cb -0.11 -3.26 -0.07 0.00 0.26 0.00 0.00 34.13 30.95 1ne2 s GLU 186 CO 0.53 0.42 0.03 0.00 -0.54 0.00 0.00 175.26 175.69 1ne2 s ALA 187 N -0.02 3.22 -0.01 6.30 0.00 0.60 -1.92 121.76 129.93 1ne2 s ALA 187 Ca 0.08 -2.18 0.01 0.00 0.00 0.00 0.00 51.96 49.87 1ne2 s ALA 187 Cb -0.12 -0.06 0.00 0.00 0.00 0.00 0.00 23.12 22.95 1ne2 s ALA 187 CO 0.00 -0.07 -0.03 0.54 0.00 0.00 0.00 175.76 176.21 1ne2 s VAL 188 N -2.64 0.22 -0.18 0.00 0.11 0.56 -2.01 120.40 116.45 1ne2 s VAL 188 Ca 0.36 -0.10 -0.04 0.00 -2.93 0.00 0.00 61.98 59.27 1ne2 s VAL 188 Cb 0.06 -0.20 -0.02 0.00 -1.53 0.00 0.00 36.38 34.68 1ne2 s VAL 188 CO 0.19 0.07 -0.03 -0.63 -3.33 0.00 0.00 175.10 171.37 1ne2 s ILE 189 N 0.06 3.72 -0.05 7.04 1.01 0.08 -1.92 121.20 131.14 1ne2 s ILE 189 Ca -0.00 -0.40 0.04 0.00 0.00 0.00 0.00 60.65 60.28 1ne2 s ILE 189 Cb -0.03 -2.65 -0.02 0.00 0.01 0.00 0.00 42.46 39.76 1ne2 s ILE 189 CO -0.00 0.46 -0.16 -0.36 0.00 0.00 0.00 174.94 174.88 1ne2 s PHE 190 N 0.83 2.67 -0.09 3.97 0.08 0.45 -0.57 117.98 125.32 1ne2 s PHE 190 Ca -0.01 -0.21 -0.00 0.00 0.12 0.00 0.00 56.93 56.83 1ne2 s PHE 190 Cb -0.14 -1.63 0.02 0.00 -0.57 0.00 0.00 43.02 40.70 1ne2 s PHE 190 CO 0.02 0.14 -0.06 0.20 -0.10 0.00 0.00 175.22 175.42 1ne2 s GLY 191 N -0.67 0.69 -0.01 4.36 0.00 -0.34 -1.62 107.32 109.74 1ne2 s GLY 191 Ca 0.10 -0.37 0.03 0.00 0.00 0.00 0.00 44.72 44.48 1ne2 s GLY 191 CO 0.01 0.75 -0.08 0.14 0.00 0.00 0.00 173.10 173.92 1ne2 s VAL 192 N 1.54 0.65 -0.29 1.40 1.01 0.81 -1.19 120.40 124.33 1ne2 s VAL 192 Ca 0.01 -0.37 -0.11 0.00 0.00 0.00 0.00 61.98 61.51 1ne2 s VAL 192 Cb -0.13 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 1ne2 s VAL 192 CO -0.05 0.17 0.19 -0.60 0.00 0.00 0.00 175.10 174.81 1ne2 s ARG 193 N -0.22 3.83 0.25 2.72 6.06 0.38 -0.92 118.95 131.05 1ne2 s ARG 193 Ca 0.03 -0.40 -0.31 0.00 -2.50 0.00 0.00 55.73 52.55 1ne2 s ARG 193 Cb -0.03 -3.66 -0.11 0.00 0.06 0.00 0.00 34.95 31.21 1ne2 s ARG 193 CO -0.00 -0.23 1.62 1.21 -2.50 0.00 0.00 175.30 175.40 1ne2 s ASN 194 N 1.74 6.41 0.35 -2.12 3.84 -1.26 -0.45 114.94 123.44 1ne2 s ASN 194 Ca 0.07 2.88 0.16 0.00 0.21 0.00 0.00 52.86 56.17 1ne2 s ASN 194 Cb -0.16 -2.62 0.60 0.00 -0.55 0.00 0.00 41.25 38.52 1ne2 s ASN 194 CO 0.10 -0.91 1.72 0.45 -2.79 0.00 0.00 177.10 175.67 1ne2 h HIS 195 N 5.64 0.00 0.00 0.43 3.86 -1.64 -3.39 115.15 120.05 1ne2 h HIS 195 Ca -0.45 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.76 1ne2 h HIS 195 Cb 1.21 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.68 1ne2 h HIS 195 CO 0.61 0.45 0.00 0.43 0.86 0.00 0.00 177.93 180.28 1ne2 n SER 196 N -3.70 0.00 -0.46 2.45 7.64 -1.26 -5.08 113.62 113.21 1ne2 n SER 196 Ca -0.01 0.14 0.06 0.00 1.01 0.00 0.00 58.87 60.07 1ne2 n SER 196 Cb 0.52 0.00 0.05 0.00 -1.01 0.00 0.00 64.21 63.77 1ne2 n SER 196 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25