#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nv4 s LEU 3 N 0.00 4.47 -0.24 1.39 1.43 -1.26 -5.06 118.68 119.42 2nv4 s LEU 3 Ca 0.00 1.14 -0.06 0.00 -1.03 0.00 0.00 54.13 54.18 2nv4 s LEU 3 Cb 0.00 -2.81 -0.02 0.00 0.03 0.00 0.00 46.19 43.39 2nv4 s LEU 3 CO 0.00 0.23 0.02 -1.59 0.23 0.00 0.00 176.35 175.24 2nv4 s LYS 4 N -0.76 3.52 0.24 1.70 -2.85 -1.26 -5.07 119.74 115.26 2nv4 s LYS 4 Ca 0.28 -0.55 -0.31 0.00 -1.00 0.00 0.00 55.97 54.39 2nv4 s LYS 4 Cb -0.18 -3.19 -0.12 0.00 -2.06 0.00 0.00 37.83 32.28 2nv4 s LYS 4 CO 0.17 -0.20 1.68 -1.25 0.10 0.00 0.00 175.35 175.85 2nv4 s PRO 5 N 1.55 4.12 0.00 1.78 0.04 -1.26 -4.87 135.00 136.36 2nv4 s PRO 5 Ca 0.06 2.61 0.21 0.00 0.04 0.00 0.00 61.00 63.91 2nv4 s PRO 5 Cb -0.15 -3.05 0.19 0.00 0.04 0.00 0.00 34.50 31.53 2nv4 s PRO 5 CO 0.01 -0.72 1.18 0.44 0.04 0.00 0.00 177.00 177.95 2nv4 n ILE 6 N 3.35 0.07 -0.89 0.56 -5.35 -0.60 -4.95 119.36 111.54 2nv4 n ILE 6 Ca 0.13 -0.53 0.00 0.00 -0.27 0.00 0.00 62.75 62.08 2nv4 n ILE 6 Cb 0.36 1.37 0.00 0.00 -1.74 0.00 0.00 39.64 39.63 2nv4 n ILE 6 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2nv4 n GLY 7 N 1.19 -1.29 3.04 3.28 0.00 -1.24 -0.85 105.19 109.32 2nv4 n GLY 7 Ca 0.13 -0.99 -0.11 0.00 0.00 0.00 0.00 46.02 45.05 2nv4 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nv4 s VAL 8 N -2.28 0.34 -0.07 1.61 0.11 -0.57 -0.44 120.40 119.09 2nv4 s VAL 8 Ca 0.00 -1.15 -0.06 0.00 -2.93 0.00 0.00 61.98 57.84 2nv4 s VAL 8 Cb 0.00 -0.64 -0.04 0.00 -1.53 0.00 0.00 36.38 34.17 2nv4 s VAL 8 CO 0.00 -0.53 0.17 -0.69 -3.33 0.00 0.00 175.10 170.72 2nv4 s VAL 9 N -1.85 5.46 -0.13 2.04 1.01 0.17 -1.86 120.40 125.23 2nv4 s VAL 9 Ca -0.09 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.01 2nv4 s VAL 9 Cb -0.07 -3.46 0.02 0.00 0.00 0.00 0.00 36.38 32.87 2nv4 s VAL 9 CO -0.02 0.51 -0.15 -0.75 0.00 0.00 0.00 175.10 174.70 2nv4 s LYS 10 N -1.35 2.28 0.32 2.72 2.20 -0.01 0.83 119.74 126.71 2nv4 s LYS 10 Ca 0.20 -0.56 -0.06 0.00 -0.36 0.00 0.00 55.97 55.18 2nv4 s LYS 10 Cb -0.12 -2.02 0.00 0.00 -1.51 0.00 0.00 37.83 34.18 2nv4 s LYS 10 CO 0.10 -0.16 0.49 -1.54 -0.36 0.00 0.00 175.35 173.88 2nv4 s SER 11 N 1.27 0.53 0.00 1.43 1.04 -1.26 0.35 113.70 117.06 2nv4 s SER 11 Ca 0.00 -1.30 0.14 0.00 0.48 0.00 0.00 55.95 55.27 2nv4 s SER 11 Cb -0.14 0.65 0.50 0.00 0.10 0.00 0.00 66.02 67.13 2nv4 s SER 11 CO -0.07 -1.28 1.38 -0.81 0.98 0.00 0.00 173.24 173.44 2nv4 n PRO 12 N -0.50 1.70 -3.39 4.02 -0.04 -1.26 -4.54 135.00 130.98 2nv4 n PRO 12 Ca -0.01 -1.07 -0.44 0.00 -0.04 0.00 0.00 63.50 61.94 2nv4 n PRO 12 Cb 0.62 -1.30 -0.07 0.00 -0.04 0.00 0.00 33.50 32.70 2nv4 n PRO 12 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2nv4 s PHE 13 N -1.68 3.25 -0.05 0.54 0.08 -1.26 -4.92 117.98 113.94 2nv4 s PHE 13 Ca 0.26 -1.02 -0.15 0.00 0.12 0.00 0.00 56.93 56.13 2nv4 s PHE 13 Cb 0.14 -3.24 -0.31 0.00 -0.57 0.00 0.00 43.02 39.03 2nv4 s PHE 13 CO 0.19 -0.83 0.74 0.87 -0.10 0.00 0.00 175.22 176.09 2nv4 h LYS 14 N 8.75 0.37 -5.84 0.44 1.79 -1.92 0.44 116.57 120.59 2nv4 h LYS 14 Ca -0.28 -0.63 -0.51 0.00 -2.18 0.00 0.00 60.65 57.05 2nv4 h LYS 14 Cb 1.11 0.23 -0.15 0.00 -1.58 0.00 0.00 32.23 31.84 2nv4 h LYS 14 CO 0.89 1.30 -0.75 0.95 -1.08 0.00 0.00 179.45 180.76 2nv4 s THR 15 N -2.53 1.98 0.57 -0.16 -4.23 -1.26 -4.64 115.64 105.38 2nv4 s THR 15 Ca -0.15 -2.22 0.31 0.00 -1.18 0.00 0.00 61.69 58.45 2nv4 s THR 15 Cb 0.04 -2.09 0.44 0.00 1.34 0.00 0.00 72.50 72.23 2nv4 s THR 15 CO 0.84 -0.48 1.80 1.56 -0.54 0.00 0.00 174.62 177.80 2nv4 h GLN 16 N 2.60 0.00 0.00 3.99 7.50 -1.95 0.57 115.11 127.82 2nv4 h GLN 16 Ca -0.39 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.76 2nv4 h GLN 16 Cb 1.23 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.76 2nv4 h GLN 16 CO 0.59 0.00 0.00 -1.71 -1.50 0.00 0.00 178.83 176.21 2nv4 n ASN 17 N -3.85 0.18 -0.09 1.46 5.15 -1.26 -3.80 115.26 113.05 2nv4 n ASN 17 Ca 0.16 0.52 -0.09 0.00 -0.60 0.00 0.00 54.58 54.57 2nv4 n ASN 17 Cb 0.95 -0.57 -0.14 0.00 -0.53 0.00 0.00 39.78 39.49 2nv4 n ASN 17 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2nv4 n ASP 18 N -1.67 0.57 -4.80 1.20 10.43 0.20 -4.99 116.55 117.48 2nv4 n ASP 18 Ca 0.06 -0.00 -0.34 0.00 2.57 0.00 0.00 54.79 57.08 2nv4 n ASP 18 Cb 0.33 0.94 -0.04 0.00 1.84 0.00 0.00 41.12 44.20 2nv4 n ASP 18 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2nv4 s ALA 19 N -2.43 2.90 0.54 2.24 0.00 -1.14 -4.89 121.76 118.98 2nv4 s ALA 19 Ca -0.09 0.62 -0.18 0.00 0.00 0.00 0.00 51.96 52.31 2nv4 s ALA 19 Cb 0.05 -3.26 -0.06 0.00 0.00 0.00 0.00 23.12 19.86 2nv4 s ALA 19 CO 0.74 -0.30 1.06 -1.25 0.00 0.00 0.00 175.76 176.01 2nv4 s PRO 20 N -3.12 3.55 0.16 0.00 0.04 -1.26 -4.94 135.00 129.43 2nv4 s PRO 20 Ca 0.66 1.32 -0.20 0.00 0.04 0.00 0.00 61.00 62.83 2nv4 s PRO 20 Cb -0.17 -2.06 0.08 0.00 0.04 0.00 0.00 34.50 32.39 2nv4 s PRO 20 CO 0.21 -0.64 1.64 -0.09 0.04 0.00 0.00 177.00 178.16 2nv4 h ARG 21 N 1.05 -0.14 -3.89 4.56 2.43 -1.95 -3.39 114.38 113.05 2nv4 h ARG 21 Ca -0.48 0.01 -0.44 0.00 -0.81 0.00 0.00 59.98 58.25 2nv4 h ARG 21 Cb 1.22 0.03 -0.37 0.00 -0.42 0.00 0.00 29.97 30.44 2nv4 h ARG 21 CO 0.58 -0.09 -0.77 -0.65 -1.51 0.00 0.00 179.97 177.53 2nv4 s GLN 22 N -6.14 0.84 0.62 0.20 -1.52 -1.26 -5.03 119.66 107.36 2nv4 s GLN 22 Ca -0.14 -0.02 0.30 0.00 -1.95 0.00 0.00 55.36 53.55 2nv4 s GLN 22 Cb 0.14 -1.03 1.64 0.00 -0.22 0.00 0.00 33.01 33.54 2nv4 s GLN 22 CO 0.69 -0.23 1.99 0.78 -0.25 0.00 0.00 175.29 178.28 2nv4 h GLY 23 N 7.94 0.00 2.00 3.09 0.00 -1.77 -1.80 103.07 112.52 2nv4 h GLY 23 Ca -0.27 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 2nv4 h GLY 23 CO 0.35 0.00 -0.10 -0.09 0.00 0.00 0.00 176.54 176.70 2nv4 h ARG 24 N 0.00 0.00 -0.62 4.80 9.65 -1.91 -2.31 114.38 123.99 2nv4 h ARG 24 Ca 0.09 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.97 2nv4 h ARG 24 Cb 0.73 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.31 2nv4 h ARG 24 CO -0.00 0.10 0.00 1.19 2.80 0.00 0.00 179.97 184.06 2nv4 n PHE 25 N -3.57 1.89 -4.36 2.20 3.72 -0.68 -4.91 117.46 111.75 2nv4 n PHE 25 Ca -0.02 -0.66 -0.22 0.00 -0.05 0.00 0.00 57.45 56.51 2nv4 n PHE 25 Cb 0.23 -0.47 -0.13 0.00 -0.94 0.00 0.00 39.48 38.18 2nv4 n PHE 25 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2nv4 s SER 26 N -0.72 2.03 0.00 4.37 0.15 -0.87 -5.02 113.70 113.64 2nv4 s SER 26 Ca 0.50 -0.56 0.24 0.00 0.70 0.00 0.00 55.95 56.83 2nv4 s SER 26 Cb 0.38 -0.12 0.27 0.00 -1.71 0.00 0.00 66.02 64.84 2nv4 s SER 26 CO 0.15 0.04 1.30 0.47 1.20 0.00 0.00 173.24 176.41 2nv4 n ASP 27 N 1.57 3.15 -4.75 5.45 8.00 -1.26 -4.31 116.55 124.40 2nv4 n ASP 27 Ca -0.19 -1.99 -0.40 0.00 0.71 0.00 0.00 54.79 52.92 2nv4 n ASP 27 Cb 0.54 -0.09 0.02 0.00 -0.02 0.00 0.00 41.12 41.58 2nv4 n ASP 27 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2nv4 n ALA 28 N 1.40 1.88 -2.74 2.24 0.00 -1.26 -4.95 120.51 117.07 2nv4 n ALA 28 Ca 0.16 0.23 -0.35 0.00 0.00 0.00 0.00 53.44 53.48 2nv4 n ALA 28 Cb 0.60 -2.37 -0.08 0.00 0.00 0.00 0.00 19.45 17.60 2nv4 n ALA 28 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2nv4 s VAL 29 N -1.21 5.41 0.25 0.00 1.01 -1.26 -4.22 120.40 120.38 2nv4 s VAL 29 Ca 0.63 0.21 0.12 0.00 0.00 0.00 0.00 61.98 62.93 2nv4 s VAL 29 Cb -0.45 -3.47 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 2nv4 s VAL 29 CO 0.56 0.45 -0.19 -0.44 0.00 0.00 0.00 175.10 175.48 2nv4 s SER 30 N 0.29 3.65 -0.06 3.32 0.01 0.52 -4.49 113.70 116.93 2nv4 s SER 30 Ca 0.09 -0.94 0.06 0.00 1.31 0.00 0.00 55.95 56.47 2nv4 s SER 30 Cb -0.11 -0.35 -0.01 0.00 0.21 0.00 0.00 66.02 65.76 2nv4 s SER 30 CO -0.01 0.06 -0.25 -0.70 0.41 0.00 0.00 173.24 172.75 2nv4 s GLU 31 N -3.26 2.60 -0.35 12.44 2.12 0.15 -0.51 118.70 131.90 2nv4 s GLU 31 Ca 0.27 -0.90 -0.04 0.00 0.36 0.00 0.00 54.97 54.67 2nv4 s GLU 31 Cb -0.06 -2.17 0.06 0.00 0.26 0.00 0.00 34.13 32.22 2nv4 s GLU 31 CO 0.14 0.35 0.10 0.42 -0.54 0.00 0.00 175.26 175.73 2nv4 s ILE 32 N -0.09 3.38 -0.47 -3.70 1.01 0.45 -0.83 121.20 120.95 2nv4 s ILE 32 Ca -0.06 -1.49 -0.15 0.00 0.00 0.00 0.00 60.65 58.96 2nv4 s ILE 32 Cb -0.14 -3.04 0.08 0.00 0.01 0.00 0.00 42.46 39.37 2nv4 s ILE 32 CO 0.04 -0.31 0.39 0.00 0.00 0.00 0.00 174.94 175.06 2nv4 s ALA 33 N 1.28 3.53 0.15 9.38 0.00 -0.78 -0.52 121.76 134.80 2nv4 s ALA 33 Ca -0.00 -2.17 -0.27 0.00 0.00 0.00 0.00 51.96 49.52 2nv4 s ALA 33 Cb -0.21 -3.03 -0.07 0.00 0.00 0.00 0.00 23.12 19.81 2nv4 s ALA 33 CO -0.01 -1.75 0.85 0.42 0.00 0.00 0.00 175.76 175.27 2nv4 s ILE 34 N 1.60 4.40 0.43 0.00 -1.09 0.43 -1.52 121.20 125.45 2nv4 s ILE 34 Ca 0.04 1.85 -0.25 0.00 -2.23 0.00 0.00 60.65 60.05 2nv4 s ILE 34 Cb -0.25 -4.21 -0.08 0.00 -1.58 0.00 0.00 42.46 36.34 2nv4 s ILE 34 CO 0.05 0.44 1.31 -0.36 -1.23 0.00 0.00 174.94 175.16 2nv4 s PHE 35 N -0.70 2.74 0.31 3.97 0.08 -0.02 -4.69 117.98 119.67 2nv4 s PHE 35 Ca 0.40 1.40 0.08 0.00 0.12 0.00 0.00 56.93 58.93 2nv4 s PHE 35 Cb -0.23 -3.69 0.86 0.00 -0.57 0.00 0.00 43.02 39.39 2nv4 s PHE 35 CO 0.28 -2.21 1.70 -0.44 -0.10 0.00 0.00 175.22 174.45 2nv4 h ASP 36 N 2.49 0.49 0.31 1.36 3.45 -1.95 0.28 116.42 122.85 2nv4 h ASP 36 Ca -0.50 0.16 0.00 0.00 0.43 0.00 0.00 57.03 57.12 2nv4 h ASP 36 Cb 1.25 0.10 0.00 0.00 -0.56 0.00 0.00 39.33 40.12 2nv4 h ASP 36 CO 0.62 0.01 0.00 -1.84 -1.57 0.00 0.00 179.24 176.46 2nv4 n GLU 37 N -4.99 0.06 0.00 3.56 0.00 -1.26 -2.15 120.64 115.85 2nv4 n GLU 37 Ca 0.26 0.27 0.00 0.00 0.00 0.00 0.00 57.16 57.69 2nv4 n GLU 37 Cb 0.75 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.69 2nv4 n GLU 37 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2nv4 n TYR 38 N -1.42 0.00 -0.43 -1.84 4.01 0.69 -4.77 117.16 113.40 2nv4 n TYR 38 Ca 0.04 0.00 0.35 0.00 -0.16 0.00 0.00 57.90 58.13 2nv4 n TYR 38 Cb 0.11 0.00 0.65 0.00 -0.31 0.00 0.00 39.34 39.79 2nv4 n TYR 38 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2nv4 h ALA 39 N 0.00 2.78 0.00 -0.72 0.00 -0.24 0.41 119.26 121.50 2nv4 h ALA 39 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2nv4 h ALA 39 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2nv4 h ALA 39 CO 0.00 -1.33 0.00 -3.47 0.00 0.00 0.00 179.25 174.45 2nv4 n ASP 40 N -4.55 0.00 -0.07 0.00 2.03 -1.26 -1.81 116.55 110.90 2nv4 n ASP 40 Ca 0.34 0.31 0.14 0.00 0.52 0.00 0.00 54.79 56.10 2nv4 n ASP 40 Cb 1.35 -0.39 0.64 0.00 -0.72 0.00 0.00 41.12 42.01 2nv4 n ASP 40 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2nv4 n GLY 41 N -0.38 -1.08 0.30 0.27 0.00 0.14 -3.36 105.19 101.09 2nv4 n GLY 41 Ca 0.04 -0.23 0.13 0.00 0.00 0.00 0.00 46.02 45.96 2nv4 n GLY 41 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2nv4 n LEU 42 N -1.10 1.21 -4.52 0.99 4.32 -0.75 -4.96 117.00 112.19 2nv4 n LEU 42 Ca 0.14 -0.35 -0.56 0.00 -0.02 0.00 0.00 56.01 55.22 2nv4 n LEU 42 Cb 0.27 -0.10 -0.08 0.00 -1.62 0.00 0.00 43.42 41.89 2nv4 n LEU 42 CO 0.24 0.22 1.59 1.57 -1.22 0.00 0.00 177.39 179.79 2nv4 n HIS 43 N -0.49 1.70 -1.04 -1.77 -0.00 -1.21 -0.56 115.22 111.85 2nv4 n HIS 43 Ca 0.12 0.49 -0.01 0.00 0.46 0.00 0.00 57.72 58.78 2nv4 n HIS 43 Cb 0.37 -2.45 -0.01 0.00 -0.12 0.00 0.00 29.99 27.78 2nv4 n HIS 43 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 2nv4 n LYS 44 N 6.87 -0.11 0.25 1.57 4.76 -1.26 -4.93 118.16 125.31 2nv4 n LYS 44 Ca 0.38 0.48 0.14 0.00 -2.87 0.00 0.00 58.31 56.44 2nv4 n LYS 44 Cb 0.13 -3.97 0.53 0.00 -1.84 0.00 0.00 35.03 29.88 2nv4 n LYS 44 CO 0.00 0.00 0.00 0.97 -1.37 0.00 0.00 177.40 177.00 2nv4 h ILE 45 N 0.00 0.14 0.00 -0.18 2.10 -1.20 -2.54 117.51 115.82 2nv4 h ILE 45 Ca -0.03 -0.77 0.00 0.00 1.08 0.00 0.00 64.86 65.14 2nv4 h ILE 45 Cb 0.10 1.68 0.00 0.00 -1.09 0.00 0.00 36.82 37.50 2nv4 h ILE 45 CO 0.04 0.06 0.00 -1.84 -1.08 0.00 0.00 178.15 175.33 2nv4 n GLU 46 N -3.16 0.05 0.00 2.19 0.00 -1.26 -0.17 120.64 118.29 2nv4 n GLU 46 Ca 0.01 0.30 0.13 0.00 0.00 0.00 0.00 57.16 57.60 2nv4 n GLU 46 Cb 0.38 -1.50 0.42 0.00 0.00 0.00 0.00 31.44 30.74 2nv4 n GLU 46 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2nv4 n ASN 47 N -1.39 0.50 -4.76 -1.84 4.13 -0.96 -4.86 115.26 106.09 2nv4 n ASN 47 Ca 0.02 -0.31 -0.33 0.00 1.68 0.00 0.00 54.58 55.65 2nv4 n ASN 47 Cb 0.07 0.02 -0.07 0.00 -1.54 0.00 0.00 39.78 38.26 2nv4 n ASN 47 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2nv4 s LEU 48 N -2.79 3.79 -0.23 3.41 2.01 0.76 -5.01 118.68 120.63 2nv4 s LEU 48 Ca 0.18 0.09 0.01 0.00 0.01 0.00 0.00 54.13 54.43 2nv4 s LEU 48 Cb 0.19 -2.23 -0.15 0.00 0.01 0.00 0.00 46.19 44.01 2nv4 s LEU 48 CO 0.58 0.26 -0.20 -1.14 1.01 0.00 0.00 176.35 176.86 2nv4 n ARG 49 N 1.16 0.57 -5.17 1.70 3.00 -1.26 -4.79 116.66 111.87 2nv4 n ARG 49 Ca -0.13 0.13 -0.30 0.00 -0.00 0.00 0.00 57.85 57.56 2nv4 n ARG 49 Cb 0.53 -1.45 -0.16 0.00 0.00 0.00 0.00 32.46 31.37 2nv4 n ARG 49 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 2nv4 s HIS 50 N -2.46 2.17 0.14 -0.14 3.76 -1.26 0.12 115.29 117.63 2nv4 s HIS 50 Ca -0.31 -0.52 0.01 0.00 -0.15 0.00 0.00 55.06 54.10 2nv4 s HIS 50 Cb 0.08 -1.41 -0.04 0.00 1.11 0.00 0.00 32.58 32.31 2nv4 s HIS 50 CO 0.52 -0.11 -0.00 0.96 -0.85 0.00 0.00 174.74 175.26 2nv4 s ILE 51 N -0.36 0.52 -0.18 0.60 -4.36 -0.71 -2.94 121.20 113.78 2nv4 s ILE 51 Ca 0.03 -1.95 -0.05 0.00 -0.26 0.00 0.00 60.65 58.43 2nv4 s ILE 51 Cb -0.11 -1.98 -0.03 0.00 1.25 0.00 0.00 42.46 41.59 2nv4 s ILE 51 CO 0.01 -0.58 0.01 -0.63 0.24 0.00 0.00 174.94 173.99 2nv4 s ILE 52 N -3.75 4.23 -0.16 8.37 1.01 0.51 -0.77 121.20 130.64 2nv4 s ILE 52 Ca 0.21 -0.23 -0.03 0.00 0.00 0.00 0.00 60.65 60.60 2nv4 s ILE 52 Cb 0.06 -2.89 -0.02 0.00 0.01 0.00 0.00 42.46 39.62 2nv4 s ILE 52 CO 0.01 0.46 -0.07 -0.69 0.00 0.00 0.00 174.94 174.66 2nv4 s VAL 53 N 0.52 3.57 -0.20 2.92 1.01 0.12 -1.23 120.40 127.11 2nv4 s VAL 53 Ca -0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 61.98 61.47 2nv4 s VAL 53 Cb -0.14 -2.55 -0.01 0.00 0.00 0.00 0.00 36.38 33.68 2nv4 s VAL 53 CO 0.02 0.49 -0.06 -0.76 0.00 0.00 0.00 175.10 174.80 2nv4 s LEU 54 N 0.50 2.89 0.32 3.92 1.02 -0.30 -1.56 118.68 125.48 2nv4 s LEU 54 Ca -0.05 -0.36 0.03 0.00 0.02 0.00 0.00 54.13 53.77 2nv4 s LEU 54 Cb -0.15 -1.72 -0.06 0.00 0.02 0.00 0.00 46.19 44.28 2nv4 s LEU 54 CO 0.03 0.02 0.07 -0.72 0.02 0.00 0.00 176.35 175.77 2nv4 s TYR 55 N 1.24 1.90 0.00 0.29 1.13 0.14 -0.10 117.35 121.95 2nv4 s TYR 55 Ca 0.03 -1.00 0.00 0.00 -1.41 0.00 0.00 57.07 54.69 2nv4 s TYR 55 Cb -0.14 -1.22 0.00 0.00 -1.10 0.00 0.00 41.96 39.49 2nv4 s TYR 55 CO -0.02 -0.05 0.00 1.87 -2.51 0.00 0.00 175.55 174.84 2nv4 n TRP 56 N -0.66 0.00 0.00 -3.49 -0.00 -0.33 0.81 117.44 113.77 2nv4 n TRP 56 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.48 2nv4 n TRP 56 Cb 0.66 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.97 2nv4 n TRP 56 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 177.69 177.29 2nv4 n ASP 58 N 0.00 0.00 -0.89 5.87 5.68 -1.26 -4.01 116.55 121.94 2nv4 n ASP 58 Ca 0.00 0.00 0.10 0.00 -0.50 0.00 0.00 54.79 54.39 2nv4 n ASP 58 Cb 0.00 0.00 0.27 0.00 -1.14 0.00 0.00 41.12 40.25 2nv4 n ASP 58 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2nv4 n LYS 59 N -0.42 2.15 -2.96 0.11 4.76 -1.26 -4.93 118.16 115.61 2nv4 n LYS 59 Ca 0.00 -1.75 -0.34 0.00 -2.87 0.00 0.00 58.31 53.36 2nv4 n LYS 59 Cb 0.00 -1.44 -0.07 0.00 -1.84 0.00 0.00 35.03 31.69 2nv4 n LYS 59 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2nv4 s ALA 60 N -1.54 3.20 0.11 7.82 0.00 -1.26 -5.03 121.76 125.06 2nv4 s ALA 60 Ca 0.35 0.26 -0.30 0.00 0.00 0.00 0.00 51.96 52.27 2nv4 s ALA 60 Cb 0.19 -2.98 -0.06 0.00 0.00 0.00 0.00 23.12 20.27 2nv4 s ALA 60 CO 0.27 0.23 1.09 0.45 0.00 0.00 0.00 175.76 177.80 2nv4 s SER 61 N -2.10 7.26 0.00 0.00 0.15 -1.26 -4.96 113.70 112.78 2nv4 s SER 61 Ca 0.56 1.96 0.23 0.00 0.70 0.00 0.00 55.95 59.41 2nv4 s SER 61 Cb -0.11 -2.59 0.40 0.00 -1.71 0.00 0.00 66.02 62.01 2nv4 s SER 61 CO 0.16 -0.28 1.39 0.54 1.20 0.00 0.00 173.24 176.25 2nv4 n ARG 62 N 3.13 2.40 -0.05 5.44 1.74 -1.26 -2.20 116.66 125.86 2nv4 n ARG 62 Ca 0.05 -2.09 0.06 0.00 -0.77 0.00 0.00 57.85 55.09 2nv4 n ARG 62 Cb 0.47 -1.49 0.08 0.00 -1.02 0.00 0.00 32.46 30.50 2nv4 n ARG 62 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2nv4 n ASP 63 N 1.36 2.11 -4.70 0.55 5.68 -1.26 -3.82 116.55 116.47 2nv4 n ASP 63 Ca 0.18 -2.60 -0.36 0.00 -0.50 0.00 0.00 54.79 51.52 2nv4 n ASP 63 Cb 0.58 -0.25 -0.08 0.00 -1.14 0.00 0.00 41.12 40.23 2nv4 n ASP 63 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 2nv4 s LYS 64 N -2.01 4.16 -0.00 0.11 2.20 -1.26 -4.95 119.74 117.98 2nv4 s LYS 64 Ca 0.18 -0.18 0.03 0.00 -0.36 0.00 0.00 55.97 55.64 2nv4 s LYS 64 Cb 0.16 -3.46 -0.05 0.00 -1.51 0.00 0.00 37.83 32.97 2nv4 s LYS 64 CO 0.02 0.20 0.08 1.28 -0.36 0.00 0.00 175.35 176.56 2nv4 n LEU 65 N 3.82 0.02 -4.24 5.43 4.32 -1.26 -3.99 117.00 121.10 2nv4 n LEU 65 Ca -0.15 -0.07 -0.30 0.00 -0.02 0.00 0.00 56.01 55.48 2nv4 n LEU 65 Cb 0.52 0.00 -0.16 0.00 -1.62 0.00 0.00 43.42 42.16 2nv4 n LEU 65 CO 0.37 0.00 -0.55 -0.13 -1.22 0.00 0.00 177.39 175.86 2nv4 s ARG 66 N -2.10 2.28 0.07 3.23 0.52 -1.26 -0.90 118.95 120.79 2nv4 s ARG 66 Ca -0.01 -0.83 -0.09 0.00 -0.52 0.00 0.00 55.73 54.28 2nv4 s ARG 66 Cb 0.02 -1.98 0.00 0.00 0.52 0.00 0.00 34.95 33.52 2nv4 s ARG 66 CO 0.13 0.37 0.20 0.54 0.02 0.00 0.00 175.30 176.56 2nv4 s VAL 67 N -0.17 0.13 -0.37 3.52 0.11 -0.36 -4.90 120.40 118.35 2nv4 s VAL 67 Ca -0.02 -1.04 -0.04 0.00 -2.93 0.00 0.00 61.98 57.96 2nv4 s VAL 67 Cb -0.13 -1.17 0.08 0.00 -1.53 0.00 0.00 36.38 33.63 2nv4 s VAL 67 CO 0.03 -0.57 0.13 -0.69 -3.33 0.00 0.00 175.10 170.67 2nv4 s VAL 68 N -3.35 3.39 0.72 2.04 1.01 -1.26 -1.18 120.40 121.78 2nv4 s VAL 68 Ca 0.01 -1.63 -0.16 0.00 0.00 0.00 0.00 61.98 60.20 2nv4 s VAL 68 Cb 0.02 -3.12 0.02 0.00 0.00 0.00 0.00 36.38 33.31 2nv4 s VAL 68 CO -0.08 -0.42 1.12 -2.65 0.00 0.00 0.00 175.10 173.07 2nv4 n PRO 69 N 4.68 0.58 -1.66 2.72 -0.02 -1.26 -4.83 135.00 135.21 2nv4 n PRO 69 Ca -0.08 0.26 -0.43 0.00 -2.02 0.00 0.00 63.50 61.23 2nv4 n PRO 69 Cb 0.43 -2.36 -0.01 0.00 -0.02 0.00 0.00 33.50 31.53 2nv4 n PRO 69 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2nv4 n PRO 70 N -2.25 1.83 0.00 0.52 -0.04 -1.26 -1.03 135.00 132.77 2nv4 n PRO 70 Ca 0.14 0.64 0.00 0.00 -0.04 0.00 0.00 63.50 64.24 2nv4 n PRO 70 Cb 0.49 -2.14 0.00 0.00 -0.04 0.00 0.00 33.50 31.81 2nv4 n PRO 70 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2nv4 n GLY 71 N 0.98 2.74 3.94 0.55 0.00 -1.26 -5.01 105.19 107.13 2nv4 n GLY 71 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 2nv4 n GLY 71 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nv4 s GLU 72 N -0.17 2.96 -0.06 1.61 0.41 -0.20 -5.04 118.70 118.21 2nv4 s GLU 72 Ca 0.00 -0.33 0.03 0.00 -0.41 0.00 0.00 54.97 54.26 2nv4 s GLU 72 Cb 0.00 -2.44 -0.06 0.00 -1.78 0.00 0.00 34.13 29.85 2nv4 s GLU 72 CO 0.00 -0.47 -0.02 2.41 -0.49 0.00 0.00 175.26 176.69 2nv4 n THR 73 N -2.29 0.41 -4.14 3.63 -1.04 -1.26 -4.83 114.28 104.75 2nv4 n THR 73 Ca 0.03 -0.21 -0.25 0.00 -2.04 0.00 0.00 64.05 61.58 2nv4 n THR 73 Cb 0.58 -0.81 -0.06 0.00 -1.82 0.00 0.00 70.33 68.22 2nv4 n THR 73 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2nv4 s GLU 74 N -2.14 2.72 0.60 -2.82 0.41 -1.26 -5.03 118.70 111.18 2nv4 s GLU 74 Ca -0.06 -1.02 -0.10 0.00 -0.41 0.00 0.00 54.97 53.39 2nv4 s GLU 74 Cb 0.02 -2.51 -0.03 0.00 -1.78 0.00 0.00 34.13 29.83 2nv4 s GLU 74 CO 0.21 0.45 0.99 -1.83 -0.49 0.00 0.00 175.26 174.58 2nv4 s GLU 75 N -3.25 3.48 0.14 1.61 4.04 -1.26 -4.57 118.70 118.88 2nv4 s GLU 75 Ca 0.30 0.58 -0.15 0.00 0.04 0.00 0.00 54.97 55.75 2nv4 s GLU 75 Cb -0.09 -2.14 0.03 0.00 0.02 0.00 0.00 34.13 31.95 2nv4 s GLU 75 CO 0.22 -0.56 0.38 -0.98 -1.84 0.00 0.00 175.26 172.49 2nv4 s ARG 76 N -5.11 1.10 0.58 -4.83 1.70 -0.32 -4.92 118.95 107.15 2nv4 s ARG 76 Ca 0.54 -0.81 -0.20 0.00 -0.47 0.00 0.00 55.73 54.79 2nv4 s ARG 76 Cb -0.11 0.45 -0.04 0.00 -0.57 0.00 0.00 34.95 34.69 2nv4 s ARG 76 CO 0.52 -0.43 1.27 0.41 -1.08 0.00 0.00 175.30 175.99 2nv4 n GLY 77 N -0.22 0.51 0.23 3.88 0.00 -1.26 -1.23 105.19 107.10 2nv4 n GLY 77 Ca -0.14 -0.05 0.09 0.00 0.00 0.00 0.00 46.02 45.93 2nv4 n GLY 77 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2nv4 h VAL 78 N 1.03 0.68 0.00 1.61 -1.51 -1.36 -2.37 116.25 114.32 2nv4 h VAL 78 Ca -0.50 -1.03 0.00 0.00 -1.23 0.00 0.00 66.70 63.94 2nv4 h VAL 78 Cb 1.32 1.66 0.00 0.00 -2.13 0.00 0.00 31.29 32.14 2nv4 h VAL 78 CO 0.55 0.23 0.00 0.49 -1.23 0.00 0.00 177.57 177.61 2nv4 n PHE 79 N -3.55 0.04 -0.32 5.19 3.72 -1.26 -1.58 117.46 119.70 2nv4 n PHE 79 Ca -0.01 0.02 0.11 0.00 -0.05 0.00 0.00 57.45 57.52 2nv4 n PHE 79 Cb 0.38 -0.53 0.30 0.00 -0.94 0.00 0.00 39.48 38.70 2nv4 n PHE 79 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2nv4 n THR 80 N -1.54 0.98 -3.86 4.37 -2.24 -0.89 -4.97 114.28 106.13 2nv4 n THR 80 Ca 0.04 -0.99 0.00 0.00 -2.27 0.00 0.00 64.05 60.83 2nv4 n THR 80 Cb 0.19 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 2nv4 n THR 80 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2nv4 n THR 81 N 1.51 0.00 -0.86 4.28 -2.24 -0.61 -5.02 114.28 111.33 2nv4 n THR 81 Ca 0.23 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 62.08 2nv4 n THR 81 Cb 0.60 0.00 0.10 0.00 -2.10 0.00 0.00 70.33 68.93 2nv4 n THR 81 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2nv4 n ARG 82 N 0.00 1.61 -1.73 -0.78 5.12 -1.26 -5.01 116.66 114.60 2nv4 n ARG 82 Ca 0.00 -2.27 -0.40 0.00 -1.93 0.00 0.00 57.85 53.25 2nv4 n ARG 82 Cb 0.00 -1.35 0.02 0.00 -1.16 0.00 0.00 32.46 29.97 2nv4 n ARG 82 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2nv4 n SER 83 N -1.17 2.89 -0.09 0.55 3.41 -1.26 -4.91 113.62 113.04 2nv4 n SER 83 Ca 0.12 1.10 0.01 0.00 -0.26 0.00 0.00 58.87 59.84 2nv4 n SER 83 Cb 0.55 -1.55 0.31 0.00 -0.26 0.00 0.00 64.21 63.26 2nv4 n SER 83 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2nv4 h PRO 84 N 2.09 0.73 -6.35 4.33 0.13 -1.98 -3.42 132.00 127.53 2nv4 h PRO 84 Ca -0.49 -0.07 -0.55 0.00 -0.87 0.00 0.00 66.00 64.01 2nv4 h PRO 84 Cb 1.28 -0.15 -0.03 0.00 0.13 0.00 0.00 31.00 32.24 2nv4 h PRO 84 CO 0.60 0.54 0.47 -1.54 -0.23 0.00 0.00 178.00 177.85 2nv4 s SER 85 N -6.57 7.29 -0.22 1.44 1.04 -1.26 -4.59 113.70 110.82 2nv4 s SER 85 Ca -0.09 1.65 -0.36 0.00 0.48 0.00 0.00 55.95 57.63 2nv4 s SER 85 Cb 0.17 -2.56 0.15 0.00 0.10 0.00 0.00 66.02 63.87 2nv4 s SER 85 CO 0.76 -0.36 1.26 0.00 0.98 0.00 0.00 173.24 175.88 2nv4 s ARG 86 N 1.45 0.22 0.33 4.02 1.70 -0.93 -4.88 118.95 120.86 2nv4 s ARG 86 Ca 0.51 -0.07 0.12 0.00 -0.47 0.00 0.00 55.73 55.82 2nv4 s ARG 86 Cb -0.21 0.10 0.99 0.00 -0.57 0.00 0.00 34.95 35.26 2nv4 s ARG 86 CO 0.24 -0.09 1.70 -1.35 -1.08 0.00 0.00 175.30 174.72 2nv4 h PRO 87 N 2.01 0.45 -3.00 3.89 0.11 -1.79 -3.22 132.00 130.46 2nv4 h PRO 87 Ca -0.07 -0.03 -0.61 0.00 0.11 0.00 0.00 66.00 65.40 2nv4 h PRO 87 Cb 1.15 -0.10 -0.40 0.00 0.11 0.00 0.00 31.00 31.76 2nv4 h PRO 87 CO 0.22 0.30 -0.72 -0.80 -0.21 0.00 0.00 178.00 176.79 2nv4 s ASN 88 N -5.08 3.72 0.00 -2.05 -0.87 -1.26 -4.82 114.94 104.58 2nv4 s ASN 88 Ca -0.10 -2.95 -0.21 0.00 -1.57 0.00 0.00 52.86 48.02 2nv4 s ASN 88 Cb 0.28 -1.17 -0.26 0.00 -0.02 0.00 0.00 41.25 40.08 2nv4 s ASN 88 CO 0.79 -0.22 1.41 -2.65 -2.57 0.00 0.00 177.10 173.86 2nv4 n PRO 89 N 3.12 0.00 -3.30 -0.60 -0.02 -1.21 -4.88 135.00 128.11 2nv4 n PRO 89 Ca 0.12 -0.84 -0.40 0.00 -2.02 0.00 0.00 63.50 60.36 2nv4 n PRO 89 Cb 0.36 -2.34 -0.08 0.00 -0.02 0.00 0.00 33.50 31.41 2nv4 n PRO 89 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2nv4 s ILE 90 N 6.38 5.10 0.01 4.25 1.01 -1.26 -4.45 121.20 132.24 2nv4 s ILE 90 Ca 0.48 0.66 -0.26 0.00 0.00 0.00 0.00 60.65 61.53 2nv4 s ILE 90 Cb 0.10 -3.80 -0.04 0.00 0.01 0.00 0.00 42.46 38.73 2nv4 s ILE 90 CO 0.24 0.06 0.82 -0.83 0.00 0.00 0.00 174.94 175.23 2nv4 s GLY 91 N 1.62 2.80 -0.19 6.18 0.00 0.24 -4.88 107.32 113.10 2nv4 s GLY 91 Ca 0.18 0.34 0.01 0.00 0.00 0.00 0.00 44.72 45.25 2nv4 s GLY 91 CO 0.10 1.30 -0.18 -2.27 0.00 0.00 0.00 173.10 172.05 2nv4 s LEU 92 N 0.43 2.22 0.02 0.66 2.96 -1.26 -0.68 118.68 123.03 2nv4 s LEU 92 Ca 0.42 -0.72 0.01 0.00 -0.22 0.00 0.00 54.13 53.63 2nv4 s LEU 92 Cb -0.20 -1.44 -0.01 0.00 0.50 0.00 0.00 46.19 45.03 2nv4 s LEU 92 CO 0.24 -0.03 -0.05 0.00 -1.32 0.00 0.00 176.35 175.19 2nv4 s VAL 94 N -0.72 5.08 0.30 0.00 1.01 -1.26 0.12 120.40 124.92 2nv4 s VAL 94 Ca -0.05 -0.09 0.10 0.00 0.00 0.00 0.00 61.98 61.94 2nv4 s VAL 94 Cb -0.06 -3.50 -0.05 0.00 0.00 0.00 0.00 36.38 32.77 2nv4 s VAL 94 CO -0.00 0.14 -0.10 0.68 0.00 0.00 0.00 175.10 175.83 2nv4 s VAL 95 N 1.71 2.65 -0.23 2.92 -7.23 0.05 -4.76 120.40 115.51 2nv4 s VAL 95 Ca 0.06 -2.18 -0.05 0.00 -1.81 0.00 0.00 61.98 58.00 2nv4 s VAL 95 Cb -0.17 -2.58 -0.02 0.00 0.56 0.00 0.00 36.38 34.18 2nv4 s VAL 95 CO 0.09 -0.31 -0.01 -0.70 -0.31 0.00 0.00 175.10 173.86 2nv4 s GLU 96 N -3.61 3.48 0.07 4.82 2.12 -0.87 -1.73 118.70 122.98 2nv4 s GLU 96 Ca 0.32 -0.57 -0.31 0.00 0.36 0.00 0.00 54.97 54.77 2nv4 s GLU 96 Cb -0.03 -3.11 -0.07 0.00 0.26 0.00 0.00 34.13 31.19 2nv4 s GLU 96 CO 0.17 -0.18 1.38 0.42 -0.54 0.00 0.00 175.26 176.51 2nv4 s ILE 97 N 1.48 3.51 -0.06 -3.70 1.01 0.12 -2.50 121.20 121.07 2nv4 s ILE 97 Ca 0.06 1.03 0.12 0.00 0.00 0.00 0.00 60.65 61.86 2nv4 s ILE 97 Cb -0.15 -3.66 -0.18 0.00 0.01 0.00 0.00 42.46 38.49 2nv4 s ILE 97 CO -0.01 0.05 0.18 0.18 0.00 0.00 0.00 174.94 175.34 2nv4 n LEU 98 N 4.48 0.00 -3.53 2.97 4.77 0.98 -4.91 117.00 121.76 2nv4 n LEU 98 Ca 0.12 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.96 2nv4 n LEU 98 Cb 0.43 0.13 -0.05 0.00 -2.33 0.00 0.00 43.42 41.60 2nv4 n LEU 98 CO 0.58 0.13 0.56 -0.70 -1.33 0.00 0.00 177.39 176.63 2nv4 s GLU 99 N -2.63 0.92 -0.25 3.23 2.12 -0.99 -4.96 118.70 116.14 2nv4 s GLU 99 Ca -0.05 0.10 0.01 0.00 0.36 0.00 0.00 54.97 55.39 2nv4 s GLU 99 Cb 0.06 0.43 0.07 0.00 0.26 0.00 0.00 34.13 34.95 2nv4 s GLU 99 CO 0.51 -0.31 -0.03 0.14 -0.54 0.00 0.00 175.26 175.03 2nv4 s VAL 100 N -1.59 1.53 -0.76 3.70 -7.23 -1.26 -0.79 120.40 113.99 2nv4 s VAL 100 Ca -0.06 -1.32 -0.02 0.00 -1.81 0.00 0.00 61.98 58.78 2nv4 s VAL 100 Cb -0.00 -1.85 0.19 0.00 0.56 0.00 0.00 36.38 35.28 2nv4 s VAL 100 CO 0.03 -0.19 0.61 -0.70 -0.31 0.00 0.00 175.10 174.55 2nv4 s GLU 101 N 1.38 2.91 4.05 4.82 2.56 0.17 -4.98 118.70 129.61 2nv4 s GLU 101 Ca -0.03 -2.94 0.00 0.00 0.00 0.00 0.00 54.97 52.00 2nv4 s GLU 101 Cb -0.19 -3.83 0.00 0.00 2.00 0.00 0.00 34.13 32.11 2nv4 s GLU 101 CO -0.08 -1.23 0.00 0.54 -0.56 0.00 0.00 175.26 173.94 2nv4 n ARG 102 N 2.84 0.00 -0.52 4.30 5.12 -1.26 -1.02 116.66 126.13 2nv4 n ARG 102 Ca 0.15 0.00 0.05 0.00 -1.93 0.00 0.00 57.85 56.13 2nv4 n ARG 102 Cb 0.37 0.00 0.24 0.00 -1.16 0.00 0.00 32.46 31.91 2nv4 n ARG 102 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 2nv4 n ASN 103 N 7.88 3.53 -4.14 0.55 6.94 -1.26 -4.96 115.26 123.79 2nv4 n ASN 103 Ca 0.00 -3.19 -0.24 0.00 -0.02 0.00 0.00 54.58 51.13 2nv4 n ASN 103 Cb 0.00 -0.56 -0.15 0.00 -2.36 0.00 0.00 39.78 36.70 2nv4 n ASN 103 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2nv4 s ARG 104 N -2.93 1.29 -0.06 -3.83 0.52 -0.19 -0.43 118.95 113.33 2nv4 s ARG 104 Ca 0.43 -0.58 0.06 0.00 -0.52 0.00 0.00 55.73 55.11 2nv4 s ARG 104 Cb 0.36 -1.25 -0.01 0.00 0.52 0.00 0.00 34.95 34.57 2nv4 s ARG 104 CO 0.07 0.34 -0.24 -0.51 0.02 0.00 0.00 175.30 174.98 2nv4 s LEU 105 N -0.40 2.05 -0.23 2.53 1.43 0.32 0.41 118.68 124.79 2nv4 s LEU 105 Ca 0.06 -0.50 -0.11 0.00 -1.03 0.00 0.00 54.13 52.56 2nv4 s LEU 105 Cb -0.06 -1.32 -0.05 0.00 0.03 0.00 0.00 46.19 44.79 2nv4 s LEU 105 CO -0.01 0.22 0.16 -0.54 0.23 0.00 0.00 176.35 176.42 2nv4 s LYS 106 N -0.07 4.11 0.24 1.70 -0.14 0.03 -0.41 119.74 125.20 2nv4 s LYS 106 Ca -0.05 -0.24 -0.01 0.00 -1.36 0.00 0.00 55.97 54.31 2nv4 s LYS 106 Cb -0.14 -3.51 -0.03 0.00 -1.68 0.00 0.00 37.83 32.47 2nv4 s LYS 106 CO 0.04 0.12 0.23 0.14 -0.76 0.00 0.00 175.35 175.12 2nv4 s VAL 107 N 0.87 0.00 0.07 3.17 -7.23 0.33 -0.01 120.40 117.60 2nv4 s VAL 107 Ca 0.08 -1.90 0.01 0.00 -1.81 0.00 0.00 61.98 58.37 2nv4 s VAL 107 Cb -0.13 -2.48 -0.03 0.00 0.56 0.00 0.00 36.38 34.30 2nv4 s VAL 107 CO 0.03 0.00 -0.06 0.00 -0.31 0.00 0.00 175.10 174.76 2nv4 s ARG 108 N -3.91 0.66 0.00 4.82 1.70 -1.04 -0.36 118.95 120.82 2nv4 s ARG 108 Ca 0.37 -1.06 0.00 0.00 -0.47 0.00 0.00 55.73 54.57 2nv4 s ARG 108 Cb 0.05 -0.16 0.00 0.00 -0.57 0.00 0.00 34.95 34.27 2nv4 s ARG 108 CO 0.16 -0.01 0.00 0.91 -1.08 0.00 0.00 175.30 175.28 2nv4 n TRP 109 N 0.64 0.00 -3.11 5.89 8.01 -1.24 -2.05 117.44 125.57 2nv4 n TRP 109 Ca -0.17 0.00 -0.39 0.00 -1.31 0.00 0.00 57.50 55.63 2nv4 n TRP 109 Cb 0.58 0.00 -0.06 0.00 -2.01 0.00 0.00 31.31 29.83 2nv4 n TRP 109 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.69 175.51 2nv4 s LEU 110 N 0.00 4.49 -0.25 -0.99 2.96 -1.26 -3.80 118.68 119.83 2nv4 s LEU 110 Ca 0.00 1.37 0.10 0.00 -0.22 0.00 0.00 54.13 55.38 2nv4 s LEU 110 Cb 0.00 -3.08 0.45 0.00 0.50 0.00 0.00 46.19 44.06 2nv4 s LEU 110 CO 0.00 0.14 1.19 -0.90 -1.32 0.00 0.00 176.35 175.46 2nv4 n ASP 111 N 2.27 3.56 -4.81 3.68 5.68 -1.26 -4.72 116.55 120.95 2nv4 n ASP 111 Ca -0.06 -3.56 -0.37 0.00 -0.50 0.00 0.00 54.79 50.29 2nv4 n ASP 111 Cb 0.50 -0.40 -0.06 0.00 -1.14 0.00 0.00 41.12 40.02 2nv4 n ASP 111 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2nv4 s ALA 112 N -3.36 3.50 0.43 2.12 0.00 -1.26 -4.82 121.76 118.37 2nv4 s ALA 112 Ca 0.44 0.11 -0.24 0.00 0.00 0.00 0.00 51.96 52.28 2nv4 s ALA 112 Cb 0.39 -2.74 -0.08 0.00 0.00 0.00 0.00 23.12 20.69 2nv4 s ALA 112 CO -0.01 0.36 1.22 -0.51 0.00 0.00 0.00 175.76 176.83 2nv4 s LEU 113 N -1.54 4.11 0.12 0.00 1.02 -1.26 -4.71 118.68 116.41 2nv4 s LEU 113 Ca 0.36 2.45 -0.35 0.00 0.02 0.00 0.00 54.13 56.61 2nv4 s LEU 113 Cb -0.19 -4.08 -0.15 0.00 0.02 0.00 0.00 46.19 41.79 2nv4 s LEU 113 CO 0.21 -0.88 1.49 -0.67 0.02 0.00 0.00 176.35 176.52 2nv4 n ASP 114 N -0.18 2.49 0.00 2.29 4.64 0.15 -1.23 116.55 124.71 2nv4 n ASP 114 Ca 0.06 1.10 0.00 0.00 -1.38 0.00 0.00 54.79 54.56 2nv4 n ASP 114 Cb 0.46 -1.32 0.00 0.00 -1.04 0.00 0.00 41.12 39.22 2nv4 n ASP 114 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2nv4 n GLY 115 N 3.07 1.30 3.72 0.27 0.00 0.24 -4.94 105.19 108.85 2nv4 n GLY 115 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 2nv4 n GLY 115 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2nv4 n SER 116 N 0.00 3.28 -4.77 1.61 7.64 -0.37 -4.48 113.62 116.53 2nv4 n SER 116 Ca 0.00 1.17 -0.37 0.00 1.01 0.00 0.00 58.87 60.67 2nv4 n SER 116 Cb 0.00 -1.52 -0.03 0.00 -1.01 0.00 0.00 64.21 61.64 2nv4 n SER 116 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2nv4 s PRO 117 N -0.94 4.19 -0.07 1.43 0.02 -1.26 0.44 135.00 138.80 2nv4 s PRO 117 Ca 0.62 1.64 -0.12 0.00 0.02 0.00 0.00 61.00 63.16 2nv4 s PRO 117 Cb -0.56 -2.66 -0.05 0.00 0.02 0.00 0.00 34.50 31.25 2nv4 s PRO 117 CO 0.53 -0.15 0.30 0.08 -0.33 0.00 0.00 177.00 177.44 2nv4 s VAL 118 N -1.52 5.24 -0.20 3.83 1.01 0.41 -1.19 120.40 127.98 2nv4 s VAL 118 Ca 0.56 0.59 -0.05 0.00 0.00 0.00 0.00 61.98 63.08 2nv4 s VAL 118 Cb -0.26 -3.60 -0.11 0.00 0.00 0.00 0.00 36.38 32.41 2nv4 s VAL 118 CO 0.32 0.54 -0.22 -0.38 0.00 0.00 0.00 175.10 175.36 2nv4 n ILE 119 N 2.31 1.12 -3.53 2.22 2.08 0.86 -1.56 119.36 122.87 2nv4 n ILE 119 Ca -0.15 -0.35 -0.10 0.00 0.56 0.00 0.00 62.75 62.70 2nv4 n ILE 119 Cb 0.53 -1.51 -0.02 0.00 -0.75 0.00 0.00 39.64 37.89 2nv4 n ILE 119 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2nv4 s ASP 120 N -6.40 -0.48 -0.03 4.38 2.15 -0.85 -4.59 116.67 110.85 2nv4 s ASP 120 Ca -0.28 -0.14 -0.01 0.00 0.43 0.00 0.00 52.55 52.55 2nv4 s ASP 120 Cb 0.09 0.61 0.02 0.00 -0.30 0.00 0.00 42.92 43.33 2nv4 s ASP 120 CO 0.40 -1.02 0.06 -0.63 -0.17 0.00 0.00 175.17 173.81 2nv4 s ILE 121 N -3.72 -0.02 0.18 4.11 1.01 -1.26 -1.15 121.20 120.35 2nv4 s ILE 121 Ca 0.04 0.09 0.02 0.00 0.00 0.00 0.00 60.65 60.80 2nv4 s ILE 121 Cb -0.02 -0.11 -0.05 0.00 0.01 0.00 0.00 42.46 42.30 2nv4 s ILE 121 CO -0.08 0.04 -0.01 -0.54 0.00 0.00 0.00 174.94 174.34 2nv4 s LYS 122 N 0.49 1.13 0.16 2.79 1.02 -0.36 -4.96 119.74 120.01 2nv4 s LYS 122 Ca -0.04 -1.54 -0.30 0.00 0.02 0.00 0.00 55.97 54.11 2nv4 s LYS 122 Cb -0.06 -0.37 -0.08 0.00 -0.52 0.00 0.00 37.83 36.81 2nv4 s LYS 122 CO -0.02 -0.10 1.20 0.21 -0.92 0.00 0.00 175.35 175.73 2nv4 s LYS 123 N -3.88 4.48 0.03 1.68 2.20 -1.26 -0.36 119.74 122.63 2nv4 s LYS 123 Ca 0.23 1.86 -0.29 0.00 -0.36 0.00 0.00 55.97 57.40 2nv4 s LYS 123 Cb 0.06 -3.26 -0.04 0.00 -1.51 0.00 0.00 37.83 33.07 2nv4 s LYS 123 CO 0.04 -0.12 0.95 -0.47 -0.36 0.00 0.00 175.35 175.38 2nv4 s TYR 124 N 0.19 3.71 -0.20 4.03 5.04 -1.15 -4.67 117.35 124.30 2nv4 s TYR 124 Ca 0.54 1.69 -0.04 0.00 -2.44 0.00 0.00 57.07 56.82 2nv4 s TYR 124 Cb -0.32 -3.07 0.07 0.00 0.35 0.00 0.00 41.96 38.99 2nv4 s TYR 124 CO 0.35 0.08 0.09 0.45 -1.34 0.00 0.00 175.55 175.17 2nv4 s SER 125 N 0.63 2.65 0.25 4.32 0.15 -1.26 -4.91 113.70 115.53 2nv4 s SER 125 Ca 0.49 -0.77 -0.11 0.00 0.70 0.00 0.00 55.95 56.26 2nv4 s SER 125 Cb -0.21 -0.32 0.35 0.00 -1.71 0.00 0.00 66.02 64.12 2nv4 s SER 125 CO 0.28 -0.36 1.58 -0.65 1.20 0.00 0.00 173.24 175.29 2nv4 h PRO 126 N 8.39 -0.01 0.00 5.44 0.11 -1.96 0.86 132.00 144.83 2nv4 h PRO 126 Ca -0.16 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.95 2nv4 h PRO 126 Cb 1.12 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 2nv4 h PRO 126 CO 0.32 -0.01 -0.03 1.05 -0.21 0.00 0.00 178.00 179.13 2nv4 h GLU 127 N -0.01 0.00 0.00 1.05 4.11 -1.97 -1.05 114.58 116.71 2nv4 h GLU 127 Ca 0.40 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.77 2nv4 h GLU 127 Cb 0.62 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 2nv4 h GLU 127 CO -0.87 0.03 -1.44 0.44 0.07 0.00 0.00 179.01 177.23 2nv4 n ILE 128 N -3.65 0.22 0.05 -1.06 -5.35 -0.53 -4.65 119.36 104.39 2nv4 n ILE 128 Ca -0.03 -0.25 0.01 0.00 -0.27 0.00 0.00 62.75 62.21 2nv4 n ILE 128 Cb 0.12 -0.16 -0.07 0.00 -1.74 0.00 0.00 39.64 37.80 2nv4 n ILE 128 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 2nv4 h ASP 129 N 0.00 0.00 -2.99 7.28 3.32 -0.86 -3.47 116.42 119.71 2nv4 h ASP 129 Ca -0.09 0.00 -0.65 0.00 0.02 0.00 0.00 57.03 56.31 2nv4 h ASP 129 Cb 0.84 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.31 2nv4 h ASP 129 CO 0.00 0.56 -0.54 0.00 -1.72 0.00 0.00 179.24 177.54 2nv4 s VAL 131 N -1.25 2.87 -0.51 0.00 1.01 -1.26 -4.76 120.40 116.49 2nv4 s VAL 131 Ca 0.25 -0.96 -0.27 0.00 0.00 0.00 0.00 61.98 61.00 2nv4 s VAL 131 Cb -0.12 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.80 2nv4 s VAL 131 CO 0.16 0.25 2.01 0.20 0.00 0.00 0.00 175.10 177.72 2nv4 s ASN 132 N 1.34 5.18 0.00 3.32 0.02 -1.26 -5.23 114.94 118.30 2nv4 s ASN 132 Ca 0.01 0.78 0.00 0.00 -1.02 0.00 0.00 52.86 52.63 2nv4 s ASN 132 Cb -0.16 -2.52 0.00 0.00 0.02 0.00 0.00 41.25 38.59 2nv4 s ASN 132 CO -0.05 -2.37 0.00 0.00 0.02 0.00 0.00 177.10 174.70