#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vpm n ILE 2 N 0.00 0.00 -1.82 3.57 5.41 -1.26 -5.26 119.36 120.00 1vpm n ILE 2 Ca 0.00 0.00 -0.37 0.00 1.00 0.00 0.00 62.75 63.38 1vpm n ILE 2 Cb 0.00 -0.24 0.06 0.00 -0.71 0.00 0.00 39.64 38.74 1vpm n ILE 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1vpm s GLN 3 N -1.50 2.75 0.74 0.38 -2.07 -1.26 -4.93 119.66 113.77 1vpm s GLN 3 Ca 0.00 2.03 -0.12 0.00 -1.82 0.00 0.00 55.36 55.46 1vpm s GLN 3 Cb 0.00 -1.93 0.04 0.00 -1.09 0.00 0.00 33.01 30.02 1vpm s GLN 3 CO 0.00 -1.43 1.12 -1.12 -1.32 0.00 0.00 175.29 172.53 1vpm s SER 4 N -1.37 5.12 -0.08 12.60 0.01 -1.26 -4.51 113.70 124.22 1vpm s SER 4 Ca 0.80 1.06 0.01 0.00 1.31 0.00 0.00 55.95 59.13 1vpm s SER 4 Cb -0.36 -1.78 -0.03 0.00 0.21 0.00 0.00 66.02 64.06 1vpm s SER 4 CO 0.39 -1.54 -0.10 -0.31 0.41 0.00 0.00 173.24 172.09 1vpm s TYR 5 N -3.39 2.85 0.64 2.43 2.02 -0.39 -4.92 117.35 116.59 1vpm s TYR 5 Ca 0.59 -0.14 -0.17 0.00 -0.37 0.00 0.00 57.07 56.99 1vpm s TYR 5 Cb -0.11 -1.72 -0.01 0.00 -0.40 0.00 0.00 41.96 39.72 1vpm s TYR 5 CO 0.51 0.19 1.16 -1.25 -1.57 0.00 0.00 175.55 174.60 1vpm s PRO 6 N -0.56 2.76 0.33 -1.71 0.04 -1.26 -0.66 135.00 133.94 1vpm s PRO 6 Ca 0.08 1.64 0.09 0.00 0.04 0.00 0.00 61.00 62.85 1vpm s PRO 6 Cb -0.12 -1.92 0.83 0.00 0.04 0.00 0.00 34.50 33.33 1vpm s PRO 6 CO 0.02 -1.33 1.78 0.28 0.04 0.00 0.00 177.00 177.79 1vpm h VAL 7 N 0.36 0.67 -0.05 -0.36 2.07 -1.65 -1.72 116.25 115.57 1vpm h VAL 7 Ca -0.48 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 66.82 1vpm h VAL 7 Cb 1.28 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1vpm h VAL 7 CO 0.54 0.12 0.03 -0.08 0.02 0.00 0.00 177.57 178.20 1vpm h GLU 8 N 0.67 0.00 -0.88 1.57 4.57 -1.90 -2.12 114.58 116.49 1vpm h GLU 8 Ca 0.57 0.00 0.18 0.00 -1.18 0.00 0.00 59.36 58.94 1vpm h GLU 8 Cb 1.01 0.00 -0.11 0.00 -0.16 0.00 0.00 28.75 29.50 1vpm h GLU 8 CO -0.36 0.00 0.42 -0.09 -1.18 0.00 0.00 179.01 177.81 1vpm h ARG 9 N 0.00 0.50 -0.01 1.92 2.43 -1.67 -3.21 114.38 114.34 1vpm h ARG 9 Ca 0.02 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1vpm h ARG 9 Cb 0.09 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1vpm h ARG 9 CO -0.00 0.33 -0.01 -1.13 -1.51 0.00 0.00 179.97 177.66 1vpm n SER 10 N -4.95 1.30 -4.69 -3.80 3.41 -0.84 -4.86 113.62 99.20 1vpm n SER 10 Ca 0.20 -1.15 -0.44 0.00 -0.26 0.00 0.00 58.87 57.21 1vpm n SER 10 Cb 0.55 0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.52 1vpm n SER 10 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1vpm n ARG 11 N 0.18 2.18 -4.50 4.33 0.63 -0.97 -4.44 116.66 114.07 1vpm n ARG 11 Ca 0.02 0.78 -0.20 0.00 -0.92 0.00 0.00 57.85 57.53 1vpm n ARG 11 Cb 0.10 -2.47 -0.15 0.00 0.45 0.00 0.00 32.46 30.40 1vpm n ARG 11 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 1vpm s THR 12 N 0.04 0.92 -0.05 5.15 2.01 -0.21 -5.00 115.64 118.51 1vpm s THR 12 Ca 0.68 -0.52 0.05 0.00 0.31 0.00 0.00 61.69 62.21 1vpm s THR 12 Cb -0.62 -0.77 -0.01 0.00 0.01 0.00 0.00 72.50 71.11 1vpm s THR 12 CO 0.48 0.24 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.82 1vpm s ILE 13 N -0.30 1.71 0.05 1.82 -1.09 -1.26 -0.68 121.20 121.45 1vpm s ILE 13 Ca 0.04 -0.88 0.04 0.00 -2.23 0.00 0.00 60.65 57.63 1vpm s ILE 13 Cb -0.05 -1.46 -0.03 0.00 -1.58 0.00 0.00 42.46 39.35 1vpm s ILE 13 CO -0.00 0.48 -0.12 -1.10 -1.23 0.00 0.00 174.94 172.97 1vpm s GLN 14 N -0.06 0.73 -0.02 2.79 -0.21 -0.31 -5.01 119.66 117.57 1vpm s GLN 14 Ca -0.04 -0.83 0.00 0.00 0.02 0.00 0.00 55.36 54.52 1vpm s GLN 14 Cb -0.12 -0.66 0.02 0.00 1.00 0.00 0.00 33.01 33.25 1vpm s GLN 14 CO 0.03 0.15 0.02 0.99 -2.12 0.00 0.00 175.29 174.35 1vpm s THR 15 N -1.19 0.03 -0.11 -0.19 2.01 -1.26 -1.02 115.64 113.90 1vpm s THR 15 Ca -0.04 0.14 -0.10 0.00 0.31 0.00 0.00 61.69 62.00 1vpm s THR 15 Cb -0.09 -0.13 0.03 0.00 0.01 0.00 0.00 72.50 72.31 1vpm s THR 15 CO 0.01 0.09 0.29 0.00 -0.69 0.00 0.00 174.62 174.33 1vpm s ARG 16 N 0.89 0.34 0.26 4.92 1.70 -0.38 -4.98 118.95 121.69 1vpm s ARG 16 Ca -0.08 0.41 -0.30 0.00 -0.47 0.00 0.00 55.73 55.30 1vpm s ARG 16 Cb -0.11 0.16 -0.09 0.00 -0.57 0.00 0.00 34.95 34.34 1vpm s ARG 16 CO -0.02 -0.04 1.14 -1.17 -1.08 0.00 0.00 175.30 174.12 1vpm s LEU 17 N 0.18 4.52 -0.24 -1.89 2.96 -1.26 -0.57 118.68 122.37 1vpm s LEU 17 Ca -0.00 2.28 -0.29 0.00 -0.22 0.00 0.00 54.13 55.91 1vpm s LEU 17 Cb -0.02 -3.62 0.01 0.00 0.50 0.00 0.00 46.19 43.05 1vpm s LEU 17 CO 0.00 -0.23 1.02 -0.69 -1.32 0.00 0.00 176.35 175.13 1vpm s VAL 18 N -0.85 4.68 0.39 1.68 1.01 0.25 -4.89 120.40 122.67 1vpm s VAL 18 Ca 0.47 1.94 0.08 0.00 0.00 0.00 0.00 61.98 64.47 1vpm s VAL 18 Cb -0.33 -4.30 -0.05 0.00 0.00 0.00 0.00 36.38 31.70 1vpm s VAL 18 CO 0.41 -0.21 0.15 -0.76 0.00 0.00 0.00 175.10 174.69 1vpm s LEU 19 N 3.22 3.12 0.43 3.92 1.43 -1.26 0.28 118.68 129.81 1vpm s LEU 19 Ca 0.43 -1.01 0.13 0.00 -1.03 0.00 0.00 54.13 52.65 1vpm s LEU 19 Cb -0.15 -1.48 1.01 0.00 0.03 0.00 0.00 46.19 45.61 1vpm s LEU 19 CO 0.07 -0.46 1.97 -0.65 0.23 0.00 0.00 176.35 177.51 1vpm h PRO 20 N 1.51 0.43 -0.20 1.29 0.11 -1.96 -1.16 132.00 132.01 1vpm h PRO 20 Ca -0.43 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.71 1vpm h PRO 20 Cb 1.25 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 1vpm h PRO 20 CO 0.68 0.28 0.20 -1.35 -0.21 0.00 0.00 178.00 177.60 1vpm h PRO 21 N 0.44 0.00 -0.00 1.05 0.11 -2.01 -2.47 132.00 129.12 1vpm h PRO 21 Ca 0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.41 1vpm h PRO 21 Cb 0.57 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.68 1vpm h PRO 21 CO -0.09 0.00 -0.00 -0.25 -0.21 0.00 0.00 178.00 177.45 1vpm n ASP 22 N -3.97 0.42 -4.22 -2.05 8.00 -0.44 -4.92 116.55 109.37 1vpm n ASP 22 Ca 0.02 -1.10 -0.23 0.00 0.71 0.00 0.00 54.79 54.20 1vpm n ASP 22 Cb 0.33 -0.01 -0.13 0.00 -0.02 0.00 0.00 41.12 41.29 1vpm n ASP 22 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1vpm s THR 23 N -2.03 1.45 0.76 -3.53 2.01 -0.93 -0.36 115.64 113.00 1vpm s THR 23 Ca 0.44 -1.25 -0.12 0.00 0.31 0.00 0.00 61.69 61.07 1vpm s THR 23 Cb 0.22 -1.31 0.05 0.00 0.01 0.00 0.00 72.50 71.47 1vpm s THR 23 CO 0.37 0.02 1.12 0.54 -0.69 0.00 0.00 174.62 175.98 1vpm s ASN 24 N -1.43 4.96 0.27 3.53 2.20 0.65 -4.83 114.94 120.28 1vpm s ASN 24 Ca 0.04 1.04 0.18 0.00 -0.94 0.00 0.00 52.86 53.19 1vpm s ASN 24 Cb -0.09 -1.73 0.98 0.00 -2.00 0.00 0.00 41.25 38.41 1vpm s ASN 24 CO 0.02 -1.64 1.55 0.00 -2.94 0.00 0.00 177.10 174.10 1vpm n HIS 25 N -3.19 0.61 0.52 1.54 1.44 -1.26 0.15 115.22 115.03 1vpm n HIS 25 Ca 0.07 0.32 0.08 0.00 -2.01 0.00 0.00 57.72 56.18 1vpm n HIS 25 Cb 0.58 -1.01 0.22 0.00 0.12 0.00 0.00 29.99 29.90 1vpm n HIS 25 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1vpm n LEU 26 N -2.13 2.53 0.00 2.39 4.77 -1.26 -4.95 117.00 118.34 1vpm n LEU 26 Ca -0.01 -1.25 0.00 0.00 -0.03 0.00 0.00 56.01 54.72 1vpm n LEU 26 Cb 0.03 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 1vpm n LEU 26 CO 0.08 0.63 0.00 0.61 -1.33 0.00 0.00 177.39 177.38 1vpm n GLY 27 N 1.26 0.71 3.78 -0.72 0.00 0.39 -5.02 105.19 105.58 1vpm n GLY 27 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1vpm n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vpm s THR 28 N -2.82 4.76 0.35 2.61 2.01 -1.25 -1.73 115.64 119.57 1vpm s THR 28 Ca 0.00 1.33 -0.28 0.00 0.31 0.00 0.00 61.69 63.05 1vpm s THR 28 Cb 0.00 -3.96 -0.10 0.00 0.01 0.00 0.00 72.50 68.44 1vpm s THR 28 CO 0.00 0.47 1.37 -0.51 -0.69 0.00 0.00 174.62 175.26 1vpm s ILE 29 N -0.62 2.48 0.27 1.82 2.07 -0.70 -0.25 121.20 126.26 1vpm s ILE 29 Ca 0.32 0.48 -0.29 0.00 -1.41 0.00 0.00 60.65 59.74 1vpm s ILE 29 Cb -0.20 -3.30 -0.10 0.00 0.13 0.00 0.00 42.46 39.00 1vpm s ILE 29 CO 0.20 0.11 1.32 -0.36 -1.91 0.00 0.00 174.94 174.30 1vpm s PHE 30 N -1.14 3.14 0.30 3.50 0.08 0.51 -4.78 117.98 119.59 1vpm s PHE 30 Ca 0.51 1.29 0.06 0.00 0.12 0.00 0.00 56.93 58.91 1vpm s PHE 30 Cb -0.42 -3.66 0.73 0.00 -0.57 0.00 0.00 43.02 39.11 1vpm s PHE 30 CO 0.56 -1.94 1.78 0.78 -0.10 0.00 0.00 175.22 176.29 1vpm h GLY 31 N 4.37 1.79 1.61 4.36 0.00 -1.93 -1.59 103.07 111.68 1vpm h GLY 31 Ca -0.47 -0.36 -0.05 0.00 0.00 0.00 0.00 47.33 46.45 1vpm h GLY 31 CO 0.72 -0.06 -0.03 -1.33 0.00 0.00 0.00 176.54 175.84 1vpm h GLY 32 N 0.77 0.53 0.89 4.60 0.00 -1.95 0.10 103.07 108.01 1vpm h GLY 32 Ca 0.58 -0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.54 1vpm h GLY 32 CO -0.38 0.30 -0.02 0.50 0.00 0.00 0.00 176.54 176.93 1vpm h LYS 33 N 0.47 0.55 -0.75 4.80 1.79 -1.61 0.34 116.57 122.15 1vpm h LYS 33 Ca 0.10 -0.19 -0.00 0.00 -2.18 0.00 0.00 60.65 58.38 1vpm h LYS 33 Cb 0.35 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.92 1vpm h LYS 33 CO 0.01 0.71 0.46 0.28 -1.08 0.00 0.00 179.45 179.83 1vpm h VAL 34 N 0.33 1.21 -0.64 0.50 2.07 -1.14 -1.18 116.25 117.41 1vpm h VAL 34 Ca 0.08 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 1vpm h VAL 34 Cb 0.48 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.38 1vpm h VAL 34 CO 0.02 0.22 0.36 -0.07 0.02 0.00 0.00 177.57 178.11 1vpm h LEU 35 N 1.02 0.80 -0.79 2.57 3.38 -0.86 0.23 115.31 121.66 1vpm h LEU 35 Ca 0.27 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1vpm h LEU 35 Cb -0.05 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.46 1vpm h LEU 35 CO -0.05 0.66 0.45 0.00 0.09 0.00 0.00 178.44 179.59 1vpm h ALA 36 N 1.17 1.00 -0.27 1.53 0.00 -0.64 -1.64 119.26 120.42 1vpm h ALA 36 Ca 0.23 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 1vpm h ALA 36 Cb 0.03 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1vpm h ALA 36 CO -0.04 0.49 -0.31 1.88 0.00 0.00 0.00 179.25 181.28 1vpm h TYR 37 N 1.08 0.66 -0.21 0.00 0.05 -0.77 -0.78 116.97 117.00 1vpm h TYR 37 Ca 0.28 -0.16 -0.00 0.00 0.05 0.00 0.00 58.73 58.89 1vpm h TYR 37 Cb -0.00 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 37.58 1vpm h TYR 37 CO -0.00 0.82 0.12 0.82 -1.05 0.00 0.00 178.16 178.86 1vpm h ILE 38 N 0.49 1.11 -0.81 -2.88 2.04 -0.60 -1.32 117.51 115.54 1vpm h ILE 38 Ca 0.06 -0.28 -0.04 0.00 1.00 0.00 0.00 64.86 65.60 1vpm h ILE 38 Cb 0.78 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.74 1vpm h ILE 38 CO 0.06 0.10 0.37 -0.78 0.00 0.00 0.00 178.15 177.90 1vpm h ASP 39 N 0.24 1.07 -0.32 1.72 3.58 -1.14 -1.43 116.42 120.14 1vpm h ASP 39 Ca 0.07 -0.15 0.01 0.00 0.42 0.00 0.00 57.03 57.39 1vpm h ASP 39 Cb 0.06 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.82 1vpm h ASP 39 CO -0.01 0.92 0.19 -0.08 -2.88 0.00 0.00 179.24 177.38 1vpm h GLU 40 N 1.15 0.38 -0.43 0.28 4.81 -0.81 0.19 114.58 120.16 1vpm h GLU 40 Ca 0.27 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.37 1vpm h GLU 40 Cb 0.15 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 1vpm h GLU 40 CO -0.03 0.25 -0.17 0.97 -0.73 0.00 0.00 179.01 179.30 1vpm h ILE 41 N 0.39 1.27 -0.66 2.32 2.10 -1.09 -1.87 117.51 119.96 1vpm h ILE 41 Ca 0.12 -1.26 -0.02 0.00 1.08 0.00 0.00 64.86 64.77 1vpm h ILE 41 Cb -0.01 1.12 -0.03 0.00 -1.09 0.00 0.00 36.82 36.81 1vpm h ILE 41 CO -0.05 0.43 0.32 0.00 -1.08 0.00 0.00 178.15 177.76 1vpm h ALA 42 N 1.10 0.86 -0.14 0.18 0.00 -0.92 -1.06 119.26 119.27 1vpm h ALA 42 Ca 0.11 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1vpm h ALA 42 Cb 0.67 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1vpm h ALA 42 CO 0.05 0.42 0.09 0.00 0.00 0.00 0.00 179.25 179.80 1vpm h ALA 43 N 1.15 0.17 -0.62 0.00 0.00 -0.45 -0.90 119.26 118.60 1vpm h ALA 43 Ca 0.23 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.17 1vpm h ALA 43 Cb 0.12 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1vpm h ALA 43 CO -0.03 -0.32 0.34 -0.07 0.00 0.00 0.00 179.25 179.17 1vpm h LEU 44 N 0.16 0.49 -0.21 0.00 3.38 -1.08 -3.05 115.31 115.00 1vpm h LEU 44 Ca 0.05 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1vpm h LEU 44 Cb 0.01 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1vpm h LEU 44 CO -0.01 0.32 0.07 0.74 0.09 0.00 0.00 178.44 179.65 1vpm h THR 45 N 0.63 1.18 0.00 0.22 2.02 -1.00 -1.66 112.91 114.29 1vpm h THR 45 Ca 0.28 -0.56 0.00 0.00 0.77 0.00 0.00 66.41 66.90 1vpm h THR 45 Cb 0.18 1.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1vpm h THR 45 CO -0.18 0.18 0.00 0.00 0.37 0.00 0.00 175.52 175.89 1vpm n ALA 46 N -2.26 1.84 0.00 6.16 0.00 -0.36 -1.70 120.51 124.19 1vpm n ALA 46 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1vpm n ALA 46 Cb 0.14 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.59 1vpm n ALA 46 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1vpm n LYS 48 N 0.79 0.00 -0.02 0.00 5.02 -0.63 -0.87 118.16 122.44 1vpm n LYS 48 Ca 0.00 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.13 1vpm n LYS 48 Cb 0.17 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.06 1vpm n LYS 48 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1vpm h HIS 49 N 0.00 0.23 0.00 2.13 2.76 -1.60 -3.37 115.15 115.30 1vpm h HIS 49 Ca 0.00 -0.15 0.00 0.00 -2.20 0.00 0.00 60.37 58.02 1vpm h HIS 49 Cb 0.00 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 28.94 1vpm h HIS 49 CO 0.00 1.03 -0.73 0.00 -1.30 0.00 0.00 177.93 176.94 1vpm n ALA 50 N -2.59 3.40 -3.98 5.26 0.00 -0.05 -4.71 120.51 117.84 1vpm n ALA 50 Ca -0.11 -0.35 -0.26 0.00 0.00 0.00 0.00 53.44 52.72 1vpm n ALA 50 Cb 0.56 -1.07 -0.03 0.00 0.00 0.00 0.00 19.45 18.92 1vpm n ALA 50 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1vpm n ASN 51 N -1.81 -0.21 -3.74 0.00 4.13 -1.26 -4.90 115.26 107.47 1vpm n ASN 51 Ca 0.04 -1.03 -0.10 0.00 1.68 0.00 0.00 54.58 55.17 1vpm n ASN 51 Cb 0.39 -2.94 -0.06 0.00 -1.54 0.00 0.00 39.78 35.64 1vpm n ASN 51 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1vpm s SER 52 N -4.37 -0.08 0.73 6.41 0.01 -1.26 -5.09 113.70 110.04 1vpm s SER 52 Ca 0.00 -0.48 -0.16 0.00 1.31 0.00 0.00 55.95 56.63 1vpm s SER 52 Cb -0.00 0.42 0.04 0.00 0.21 0.00 0.00 66.02 66.68 1vpm s SER 52 CO 0.90 -0.81 1.25 0.00 0.41 0.00 0.00 173.24 174.99 1vpm n ALA 53 N -0.16 0.59 -2.16 1.44 0.00 -1.26 -4.88 120.51 114.09 1vpm n ALA 53 Ca -0.15 -0.16 -0.08 0.00 0.00 0.00 0.00 53.44 53.05 1vpm n ALA 53 Cb 0.63 -2.29 -0.10 0.00 0.00 0.00 0.00 19.45 17.69 1vpm n ALA 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1vpm s VAL 54 N -1.74 0.30 0.11 0.00 -7.23 -1.26 -0.85 120.40 109.73 1vpm s VAL 54 Ca 0.78 -1.77 0.06 0.00 -1.81 0.00 0.00 61.98 59.24 1vpm s VAL 54 Cb -0.34 -1.47 -0.04 0.00 0.56 0.00 0.00 36.38 35.10 1vpm s VAL 54 CO 0.45 -0.94 -0.14 0.68 -0.31 0.00 0.00 175.10 174.83 1vpm s VAL 55 N -3.71 1.31 -0.36 1.32 -7.23 -0.10 -4.91 120.40 106.72 1vpm s VAL 55 Ca 0.06 -1.65 -0.26 0.00 -1.81 0.00 0.00 61.98 58.32 1vpm s VAL 55 Cb 0.06 -1.46 0.02 0.00 0.56 0.00 0.00 36.38 35.55 1vpm s VAL 55 CO -0.09 -0.38 0.95 -0.89 -0.31 0.00 0.00 175.10 174.38 1vpm s THR 56 N -1.98 4.57 0.02 5.32 2.01 -1.26 -1.12 115.64 123.20 1vpm s THR 56 Ca 0.07 1.26 -0.15 0.00 0.31 0.00 0.00 61.69 63.18 1vpm s THR 56 Cb -0.06 -4.34 -0.35 0.00 0.01 0.00 0.00 72.50 67.76 1vpm s THR 56 CO 0.03 -0.53 0.95 0.00 -0.69 0.00 0.00 174.62 174.38 1vpm h ALA 57 N 8.43 -0.11 -2.23 7.40 0.00 -1.24 -3.49 119.26 128.03 1vpm h ALA 57 Ca -0.23 -0.90 0.13 0.00 0.00 0.00 0.00 54.91 53.91 1vpm h ALA 57 Cb 1.08 0.22 -0.14 0.00 0.00 0.00 0.00 17.79 18.94 1vpm h ALA 57 CO 0.99 0.75 0.52 -1.54 0.00 0.00 0.00 179.25 179.96 1vpm s SER 58 N -7.54 -0.32 -0.02 0.00 1.04 -1.10 -4.99 113.70 100.77 1vpm s SER 58 Ca -0.10 -0.06 0.06 0.00 0.48 0.00 0.00 55.95 56.33 1vpm s SER 58 Cb 0.04 0.38 -0.01 0.00 0.10 0.00 0.00 66.02 66.53 1vpm s SER 58 CO 0.93 -0.63 -0.20 -0.51 0.98 0.00 0.00 173.24 173.81 1vpm s ILE 59 N -3.09 1.58 1.03 -1.02 2.07 -1.26 -1.25 121.20 119.26 1vpm s ILE 59 Ca 0.06 -0.85 -0.17 0.00 -1.41 0.00 0.00 60.65 58.28 1vpm s ILE 59 Cb -0.01 -1.32 0.22 0.00 0.13 0.00 0.00 42.46 41.48 1vpm s ILE 59 CO -0.07 0.45 1.25 -1.81 -1.91 0.00 0.00 174.94 172.85 1vpm s ASP 60 N -0.41 2.46 0.55 4.50 1.01 0.58 -4.97 116.67 120.39 1vpm s ASP 60 Ca 0.06 0.40 -0.21 0.00 0.71 0.00 0.00 52.55 53.50 1vpm s ASP 60 Cb -0.08 -0.51 -0.05 0.00 1.01 0.00 0.00 42.92 43.29 1vpm s ASP 60 CO -0.00 -3.15 1.36 -0.94 0.21 0.00 0.00 175.17 172.65 1vpm s SER 61 N -4.57 5.20 -0.16 0.27 1.04 -1.26 -4.79 113.70 109.43 1vpm s SER 61 Ca 0.73 2.77 0.01 0.00 0.48 0.00 0.00 55.95 59.94 1vpm s SER 61 Cb -0.06 -2.64 0.02 0.00 0.10 0.00 0.00 66.02 63.45 1vpm s SER 61 CO 0.54 -1.61 -0.15 -0.69 0.98 0.00 0.00 173.24 172.30 1vpm s VAL 62 N -1.30 1.72 -0.24 5.02 1.01 -1.26 -4.74 120.40 120.60 1vpm s VAL 62 Ca 0.72 -0.77 -0.06 0.00 0.00 0.00 0.00 61.98 61.87 1vpm s VAL 62 Cb -0.41 -1.62 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 1vpm s VAL 62 CO 0.48 0.44 0.04 -0.62 0.00 0.00 0.00 175.10 175.44 1vpm s ASP 63 N 1.42 4.93 -0.33 3.32 2.15 -1.26 -5.07 116.67 121.82 1vpm s ASP 63 Ca 0.04 -0.28 -0.27 0.00 0.43 0.00 0.00 52.55 52.48 1vpm s ASP 63 Cb -0.13 -1.88 0.01 0.00 -0.30 0.00 0.00 42.92 40.62 1vpm s ASP 63 CO -0.11 -0.04 0.98 -0.36 -0.17 0.00 0.00 175.17 175.47 1vpm s PHE 64 N 1.58 3.14 -0.21 -5.34 0.08 -1.26 -4.61 117.98 111.37 1vpm s PHE 64 Ca 0.06 1.01 0.21 0.00 0.12 0.00 0.00 56.93 58.33 1vpm s PHE 64 Cb -0.15 -3.58 -0.03 0.00 -0.57 0.00 0.00 43.02 38.69 1vpm s PHE 64 CO 0.02 -0.74 1.00 0.87 -0.10 0.00 0.00 175.22 176.27 1vpm h LYS 65 N 8.19 0.00 -3.12 0.44 1.79 -0.85 -3.48 116.57 119.54 1vpm h LYS 65 Ca -0.22 0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.26 1vpm h LYS 65 Cb 1.07 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.69 1vpm h LYS 65 CO 0.99 0.08 0.19 -1.54 -1.08 0.00 0.00 179.45 178.09 1vpm s SER 66 N -5.49 -0.08 -0.04 0.86 1.04 -1.25 -4.99 113.70 103.76 1vpm s SER 66 Ca -0.01 -0.90 0.02 0.00 0.48 0.00 0.00 55.95 55.54 1vpm s SER 66 Cb 0.09 0.76 0.01 0.00 0.10 0.00 0.00 66.02 66.99 1vpm s SER 66 CO 0.79 -1.46 -0.07 -0.44 0.98 0.00 0.00 173.24 173.03 1vpm s SER 67 N -3.01 1.19 0.62 7.02 0.01 -1.26 -4.81 113.70 113.47 1vpm s SER 67 Ca 0.15 -0.18 -0.14 0.00 1.31 0.00 0.00 55.95 57.08 1vpm s SER 67 Cb -0.05 -0.50 -0.02 0.00 0.21 0.00 0.00 66.02 65.66 1vpm s SER 67 CO 0.10 -0.00 1.06 0.00 0.41 0.00 0.00 173.24 174.81 1vpm s ALA 68 N 0.65 2.71 0.01 1.44 0.00 -1.26 -4.88 121.76 120.42 1vpm s ALA 68 Ca -0.10 0.33 0.05 0.00 0.00 0.00 0.00 51.96 52.23 1vpm s ALA 68 Cb -0.13 -3.22 -0.03 0.00 0.00 0.00 0.00 23.12 19.73 1vpm s ALA 68 CO 0.01 -0.94 -0.12 0.95 0.00 0.00 0.00 175.76 175.66 1vpm s THR 69 N -2.59 3.21 -0.02 0.00 -4.23 -1.26 -1.72 115.64 109.01 1vpm s THR 69 Ca 0.62 -0.94 -0.38 0.00 -1.18 0.00 0.00 61.69 59.81 1vpm s THR 69 Cb -0.16 -2.36 -0.19 0.00 1.34 0.00 0.00 72.50 71.13 1vpm s THR 69 CO 0.42 0.40 1.04 0.55 -0.54 0.00 0.00 174.62 176.49 1vpm n VAL 70 N 1.66 0.00 0.00 2.29 3.14 -0.71 -0.44 118.33 124.28 1vpm n VAL 70 Ca -0.16 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.22 1vpm n VAL 70 Cb 0.52 -0.02 0.00 0.00 -1.06 0.00 0.00 33.84 33.28 1vpm n VAL 70 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1vpm n GLY 71 N 1.54 3.11 3.40 7.55 0.00 0.14 -4.98 105.19 115.95 1vpm n GLY 71 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 1vpm n GLY 71 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vpm n ASP 72 N 0.00 -1.99 -4.67 1.61 8.00 0.42 -4.57 116.55 115.35 1vpm n ASP 72 Ca 0.00 -0.15 -0.35 0.00 0.71 0.00 0.00 54.79 55.00 1vpm n ASP 72 Cb 0.00 -1.15 -0.09 0.00 -0.02 0.00 0.00 41.12 39.86 1vpm n ASP 72 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1vpm s ALA 73 N -2.34 3.41 -0.11 2.24 0.00 0.40 -0.58 121.76 124.79 1vpm s ALA 73 Ca 0.64 -0.75 -0.17 0.00 0.00 0.00 0.00 51.96 51.68 1vpm s ALA 73 Cb -0.21 -1.79 -0.04 0.00 0.00 0.00 0.00 23.12 21.08 1vpm s ALA 73 CO 0.66 0.35 0.46 -1.17 0.00 0.00 0.00 175.76 176.05 1vpm s LEU 74 N -0.14 4.29 -0.15 0.00 2.96 0.27 -0.04 118.68 125.87 1vpm s LEU 74 Ca 0.07 0.81 0.02 0.00 -0.22 0.00 0.00 54.13 54.80 1vpm s LEU 74 Cb -0.12 -2.66 0.01 0.00 0.50 0.00 0.00 46.19 43.92 1vpm s LEU 74 CO 0.01 0.04 -0.21 -1.61 -1.32 0.00 0.00 176.35 173.27 1vpm s GLU 75 N 0.43 2.97 0.01 1.98 2.02 0.55 -1.25 118.70 125.40 1vpm s GLU 75 Ca 0.25 -0.83 0.07 0.00 0.02 0.00 0.00 54.97 54.48 1vpm s GLU 75 Cb -0.15 -2.44 -0.02 0.00 0.10 0.00 0.00 34.13 31.62 1vpm s GLU 75 CO 0.10 -0.07 -0.22 -0.51 0.02 0.00 0.00 175.26 174.58 1vpm s LEU 76 N 0.95 2.10 -0.03 1.80 1.02 -0.19 -1.07 118.68 123.27 1vpm s LEU 76 Ca -0.04 -0.46 0.01 0.00 0.02 0.00 0.00 54.13 53.66 1vpm s LEU 76 Cb -0.15 -1.09 0.02 0.00 0.02 0.00 0.00 46.19 44.99 1vpm s LEU 76 CO -0.05 0.23 -0.03 -0.70 0.02 0.00 0.00 176.35 175.82 1vpm s GLU 77 N -0.83 0.51 0.06 1.70 2.12 -0.55 -1.17 118.70 120.55 1vpm s GLU 77 Ca 0.08 -0.06 0.05 0.00 0.36 0.00 0.00 54.97 55.40 1vpm s GLU 77 Cb -0.09 -0.57 -0.03 0.00 0.26 0.00 0.00 34.13 33.70 1vpm s GLU 77 CO 0.00 -0.04 -0.13 0.20 -0.54 0.00 0.00 175.26 174.75 1vpm s GLY 78 N 0.63 0.81 0.01 -1.50 0.00 0.15 -1.37 107.32 106.05 1vpm s GLY 78 Ca -0.07 -0.95 -0.26 0.00 0.00 0.00 0.00 44.72 43.44 1vpm s GLY 78 CO -0.01 -0.98 0.59 -0.11 0.00 0.00 0.00 173.10 172.59 1vpm s PHE 79 N -1.25 -0.53 -0.02 1.90 -0.12 -0.55 -1.04 117.98 116.37 1vpm s PHE 79 Ca -0.03 0.75 -0.30 0.00 -0.05 0.00 0.00 56.93 57.30 1vpm s PHE 79 Cb -0.10 0.38 -0.04 0.00 -0.63 0.00 0.00 43.02 42.63 1vpm s PHE 79 CO 0.02 -0.63 1.31 0.08 -0.05 0.00 0.00 175.22 175.94 1vpm s VAL 80 N -1.92 3.96 -0.14 -2.49 1.01 -1.26 -1.62 120.40 117.94 1vpm s VAL 80 Ca -0.08 1.32 0.19 0.00 0.00 0.00 0.00 61.98 63.41 1vpm s VAL 80 Cb -0.01 -3.85 -0.27 0.00 0.00 0.00 0.00 36.38 32.26 1vpm s VAL 80 CO 0.03 -0.00 0.25 0.35 0.00 0.00 0.00 175.10 175.73 1vpm n THR 81 N 4.63 0.99 -3.53 3.92 -2.24 0.27 -4.82 114.28 113.50 1vpm n THR 81 Ca 0.12 -0.75 -0.10 0.00 -2.27 0.00 0.00 64.05 61.06 1vpm n THR 81 Cb 0.45 -0.36 -0.04 0.00 -2.10 0.00 0.00 70.33 68.28 1vpm n THR 81 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1vpm s HIS 82 N -2.81 -0.38 0.05 4.78 2.46 -1.24 -3.97 115.29 114.18 1vpm s HIS 82 Ca -0.09 0.45 0.04 0.00 0.47 0.00 0.00 55.06 55.93 1vpm s HIS 82 Cb 0.08 0.49 -0.02 0.00 -0.13 0.00 0.00 32.58 33.00 1vpm s HIS 82 CO 0.85 -0.47 -0.13 0.95 -2.47 0.00 0.00 174.74 173.47 1vpm s THR 83 N -2.18 1.01 0.00 0.89 -4.23 -1.26 -1.11 115.64 108.75 1vpm s THR 83 Ca 0.01 -1.08 0.00 0.00 -1.18 0.00 0.00 61.69 59.44 1vpm s THR 83 Cb -0.01 -0.95 0.00 0.00 1.34 0.00 0.00 72.50 72.89 1vpm s THR 83 CO -0.03 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.54 1vpm n GLY 84 N 1.67 1.64 0.07 3.99 0.00 0.06 -4.95 105.19 107.67 1vpm n GLY 84 Ca -0.19 -1.17 -0.10 0.00 0.00 0.00 0.00 46.02 44.56 1vpm n GLY 84 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1vpm h ARG 85 N 0.00 0.00 -0.00 1.61 2.43 -1.97 -3.42 114.38 113.03 1vpm h ARG 85 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1vpm h ARG 85 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1vpm h ARG 85 CO 0.00 0.48 -0.08 0.25 -1.51 0.00 0.00 179.97 179.12 1vpm n THR 86 N -4.61 0.00 -3.07 0.20 -2.24 -1.26 -1.10 114.28 102.19 1vpm n THR 86 Ca -0.12 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 1vpm n THR 86 Cb 0.35 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.64 1vpm n THR 86 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1vpm n SER 87 N -0.25 1.23 -3.99 3.42 3.41 -1.26 -1.95 113.62 114.23 1vpm n SER 87 Ca 0.02 -0.45 -0.23 0.00 -0.26 0.00 0.00 58.87 57.95 1vpm n SER 87 Cb 0.10 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 63.89 1vpm n SER 87 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1vpm s GLU 89 N 0.06 1.42 -0.13 4.33 2.12 -0.27 -0.76 118.70 125.46 1vpm s GLU 89 Ca 0.00 -0.33 0.03 0.00 0.36 0.00 0.00 54.97 55.03 1vpm s GLU 89 Cb 0.00 -1.22 0.01 0.00 0.26 0.00 0.00 34.13 33.18 1vpm s GLU 89 CO 0.00 0.01 -0.22 0.08 -0.54 0.00 0.00 175.26 174.59 1vpm s VAL 90 N 0.68 2.01 -0.17 3.70 1.01 0.14 -0.56 120.40 127.22 1vpm s VAL 90 Ca -0.13 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 60.78 1vpm s VAL 90 Cb -0.15 -1.77 -0.05 0.00 0.00 0.00 0.00 36.38 34.41 1vpm s VAL 90 CO 0.03 0.54 0.20 -0.47 0.00 0.00 0.00 175.10 175.39 1vpm s TYR 91 N 0.74 3.47 -0.04 5.22 5.04 -0.64 -0.64 117.35 130.50 1vpm s TYR 91 Ca -0.09 0.47 0.03 0.00 -2.44 0.00 0.00 57.07 55.04 1vpm s TYR 91 Cb -0.16 -2.19 0.01 0.00 0.35 0.00 0.00 41.96 39.97 1vpm s TYR 91 CO 0.00 0.36 -0.11 0.08 -1.34 0.00 0.00 175.55 174.54 1vpm s VAL 92 N 0.12 0.98 -0.06 3.14 1.01 -0.51 -1.48 120.40 123.59 1vpm s VAL 92 Ca 0.12 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.72 1vpm s VAL 92 Cb -0.12 -0.88 -0.00 0.00 0.00 0.00 0.00 36.38 35.37 1vpm s VAL 92 CO 0.01 0.31 -0.21 -0.60 0.00 0.00 0.00 175.10 174.61 1vpm s ARG 93 N 0.38 2.32 -0.05 2.72 3.52 -0.47 -1.31 118.95 126.06 1vpm s ARG 93 Ca -0.08 -0.76 0.04 0.00 -0.13 0.00 0.00 55.73 54.80 1vpm s ARG 93 Cb -0.12 -1.92 0.00 0.00 -1.56 0.00 0.00 34.95 31.35 1vpm s ARG 93 CO 0.02 0.27 -0.17 0.08 -0.81 0.00 0.00 175.30 174.69 1vpm s VAL 94 N 0.06 1.45 0.10 7.11 1.01 -0.29 -1.49 120.40 128.36 1vpm s VAL 94 Ca -0.07 -0.71 0.04 0.00 0.00 0.00 0.00 61.98 61.24 1vpm s VAL 94 Cb -0.14 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1vpm s VAL 94 CO 0.04 0.42 -0.11 -1.00 0.00 0.00 0.00 175.10 174.45 1vpm s HIS 95 N 0.19 1.14 -0.01 5.22 3.76 -0.23 -0.27 115.29 125.09 1vpm s HIS 95 Ca -0.08 -0.64 0.03 0.00 -0.15 0.00 0.00 55.06 54.22 1vpm s HIS 95 Cb -0.13 -0.61 -0.03 0.00 1.11 0.00 0.00 32.58 32.92 1vpm s HIS 95 CO 0.03 0.03 -0.09 -1.54 -0.85 0.00 0.00 174.74 172.32 1vpm s SER 96 N -2.50 4.44 -0.18 1.40 1.04 -0.13 -0.33 113.70 117.44 1vpm s SER 96 Ca 0.07 -0.16 -0.00 0.00 0.48 0.00 0.00 55.95 56.33 1vpm s SER 96 Cb -0.03 -1.00 0.05 0.00 0.10 0.00 0.00 66.02 65.13 1vpm s SER 96 CO 0.01 0.30 -0.06 0.21 0.98 0.00 0.00 173.24 174.68 1vpm s ASN 97 N -1.21 3.09 -0.49 7.02 3.84 0.94 -1.13 114.94 127.01 1vpm s ASN 97 Ca 0.15 -0.79 -0.28 0.00 0.21 0.00 0.00 52.86 52.15 1vpm s ASN 97 Cb -0.11 -0.99 0.01 0.00 -0.55 0.00 0.00 41.25 39.61 1vpm s ASN 97 CO 0.05 -0.19 1.41 0.21 -2.79 0.00 0.00 177.10 175.79 1vpm s ASN 98 N 1.57 6.23 0.40 -4.21 3.84 0.69 -0.45 114.94 123.01 1vpm s ASN 98 Ca -0.01 0.53 0.27 0.00 0.21 0.00 0.00 52.86 53.86 1vpm s ASN 98 Cb -0.16 -2.54 0.83 0.00 -0.55 0.00 0.00 41.25 38.83 1vpm s ASN 98 CO -0.08 -1.58 1.77 -0.07 -2.79 0.00 0.00 177.10 174.35 1vpm h LEU 99 N 12.68 0.00 0.12 3.21 3.38 -1.86 0.96 115.31 133.79 1vpm h LEU 99 Ca -0.27 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.42 1vpm h LEU 99 Cb 1.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 1vpm h LEU 99 CO 1.14 0.00 -1.30 -0.07 0.09 0.00 0.00 178.44 178.29 1vpm h LEU 100 N 0.00 0.39 0.00 1.67 4.07 -1.95 -3.38 115.31 116.11 1vpm h LEU 100 Ca 0.00 -0.44 0.00 0.00 0.08 0.00 0.00 57.88 57.52 1vpm h LEU 100 Cb 0.71 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.33 1vpm h LEU 100 CO 0.00 1.35 -1.39 0.35 -1.08 0.00 0.00 178.44 177.68 1vpm n THR 101 N -3.50 0.00 -0.83 0.22 -2.24 -1.17 -5.00 114.28 101.76 1vpm n THR 101 Ca -0.10 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1vpm n THR 101 Cb 1.02 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 69.63 1vpm n THR 101 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vpm n GLY 102 N 1.65 0.72 3.67 3.38 0.00 0.32 -5.03 105.19 109.90 1vpm n GLY 102 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 1vpm n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vpm s GLU 103 N -0.17 4.32 -0.13 1.61 2.02 -1.20 -4.83 118.70 120.32 1vpm s GLU 103 Ca 0.00 1.33 0.01 0.00 0.02 0.00 0.00 54.97 56.32 1vpm s GLU 103 Cb 0.00 -3.60 -0.01 0.00 0.10 0.00 0.00 34.13 30.62 1vpm s GLU 103 CO 0.00 -0.49 -0.15 0.50 0.02 0.00 0.00 175.26 175.14 1vpm s ARG 104 N 2.67 3.32 0.02 1.61 3.52 -1.26 -0.22 118.95 128.62 1vpm s ARG 104 Ca 0.45 -0.72 0.03 0.00 -0.13 0.00 0.00 55.73 55.36 1vpm s ARG 104 Cb -0.16 -2.58 -0.01 0.00 -1.56 0.00 0.00 34.95 30.63 1vpm s ARG 104 CO 0.11 0.19 -0.09 0.95 -0.81 0.00 0.00 175.30 175.66 1vpm s THR 105 N 0.38 0.66 0.11 4.11 -4.23 -0.28 -4.99 115.64 111.40 1vpm s THR 105 Ca -0.12 -0.70 -0.31 0.00 -1.18 0.00 0.00 61.69 59.38 1vpm s THR 105 Cb -0.16 -0.62 -0.08 0.00 1.34 0.00 0.00 72.50 72.97 1vpm s THR 105 CO 0.06 -0.06 1.41 -0.22 -0.54 0.00 0.00 174.62 175.28 1vpm s LEU 106 N -0.84 4.37 -0.17 4.79 2.96 -1.26 -0.95 118.68 127.57 1vpm s LEU 106 Ca -0.02 2.33 -0.14 0.00 -0.22 0.00 0.00 54.13 56.09 1vpm s LEU 106 Cb -0.06 -3.58 -0.07 0.00 0.50 0.00 0.00 46.19 42.97 1vpm s LEU 106 CO 0.00 -0.68 -0.17 0.41 -1.32 0.00 0.00 176.35 174.59 1vpm n THR 107 N 4.05 1.47 -3.69 3.68 -1.04 0.63 -3.86 114.28 115.52 1vpm n THR 107 Ca 0.12 0.11 -0.03 0.00 -2.04 0.00 0.00 64.05 62.20 1vpm n THR 107 Cb 0.42 -2.28 -0.01 0.00 -1.82 0.00 0.00 70.33 66.64 1vpm n THR 107 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1vpm s THR 108 N -2.45 0.00 0.05 12.58 -1.32 -1.04 -0.23 115.64 123.23 1vpm s THR 108 Ca -0.23 -0.46 0.02 0.00 -1.21 0.00 0.00 61.69 59.82 1vpm s THR 108 Cb 0.04 -1.80 -0.03 0.00 -1.51 0.00 0.00 72.50 69.20 1vpm s THR 108 CO 0.35 0.00 -0.08 -1.83 -2.21 0.00 0.00 174.62 170.85 1vpm s GLU 109 N -3.09 0.59 0.01 7.08 -1.05 -1.26 -1.14 118.70 119.85 1vpm s GLU 109 Ca 0.11 -0.85 -0.22 0.00 -0.15 0.00 0.00 54.97 53.86 1vpm s GLU 109 Cb -0.00 -0.33 0.05 0.00 -0.44 0.00 0.00 34.13 33.41 1vpm s GLU 109 CO -0.01 0.05 0.51 0.45 0.95 0.00 0.00 175.26 177.21 1vpm s SER 110 N -1.78 -0.43 -0.04 0.83 0.15 -0.43 -4.66 113.70 107.34 1vpm s SER 110 Ca -0.07 0.26 0.06 0.00 0.70 0.00 0.00 55.95 56.91 1vpm s SER 110 Cb -0.08 0.46 -0.01 0.00 -1.71 0.00 0.00 66.02 64.68 1vpm s SER 110 CO -0.00 -0.64 -0.22 -0.36 1.20 0.00 0.00 173.24 173.22 1vpm s PHE 111 N -1.96 2.14 0.16 3.44 0.08 -1.26 -1.43 117.98 119.15 1vpm s PHE 111 Ca -0.08 -0.56 0.09 0.00 0.12 0.00 0.00 56.93 56.49 1vpm s PHE 111 Cb -0.01 -1.41 -0.04 0.00 -0.57 0.00 0.00 43.02 40.99 1vpm s PHE 111 CO 0.02 -0.15 -0.20 -0.51 -0.10 0.00 0.00 175.22 174.28 1vpm s LEU 112 N -0.23 2.41 0.40 -0.37 1.02 0.19 -0.31 118.68 121.79 1vpm s LEU 112 Ca 0.00 -0.83 0.07 0.00 0.02 0.00 0.00 54.13 53.40 1vpm s LEU 112 Cb -0.12 -0.90 -0.06 0.00 0.02 0.00 0.00 46.19 45.14 1vpm s LEU 112 CO 0.02 0.01 0.14 -0.89 0.02 0.00 0.00 176.35 175.65 1vpm s THR 113 N -1.80 2.32 -0.29 5.49 2.01 -0.38 -0.68 115.64 122.30 1vpm s THR 113 Ca 0.15 -1.77 -0.16 0.00 0.31 0.00 0.00 61.69 60.22 1vpm s THR 113 Cb -0.07 -2.98 0.15 0.00 0.01 0.00 0.00 72.50 69.61 1vpm s THR 113 CO 0.07 -0.03 0.99 -0.69 -0.69 0.00 0.00 174.62 174.27 1vpm s VAL 115 N -2.60 -0.14 0.28 3.82 1.01 -0.27 -0.59 120.40 121.91 1vpm s VAL 115 Ca 0.39 0.00 -0.29 0.00 0.00 0.00 0.00 61.98 62.08 1vpm s VAL 115 Cb 0.04 -1.00 -0.10 0.00 0.00 0.00 0.00 36.38 35.33 1vpm s VAL 115 CO 0.22 0.00 1.19 0.00 0.00 0.00 0.00 175.10 176.50 1vpm s ALA 116 N 1.63 3.45 0.11 5.51 0.00 -0.82 -0.92 121.76 130.71 1vpm s ALA 116 Ca -0.07 1.03 0.07 0.00 0.00 0.00 0.00 51.96 52.99 1vpm s ALA 116 Cb -0.04 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 1vpm s ALA 116 CO -0.15 -0.36 -0.18 0.14 0.00 0.00 0.00 175.76 175.22 1vpm s VAL 117 N -0.98 1.53 0.95 0.00 -7.23 -0.03 -1.24 120.40 113.40 1vpm s VAL 117 Ca 0.47 -1.60 -0.14 0.00 -1.81 0.00 0.00 61.98 58.90 1vpm s VAL 117 Cb -0.35 -1.51 0.22 0.00 0.56 0.00 0.00 36.38 35.30 1vpm s VAL 117 CO 0.44 -0.22 1.30 -0.90 -0.31 0.00 0.00 175.10 175.41 1vpm n ASP 118 N 0.85 0.29 0.28 4.85 5.68 -0.46 -3.98 116.55 124.06 1vpm n ASP 118 Ca -0.18 -1.58 0.16 0.00 -0.50 0.00 0.00 54.79 52.69 1vpm n ASP 118 Cb 0.55 -0.97 0.84 0.00 -1.14 0.00 0.00 41.12 40.40 1vpm n ASP 118 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1vpm h GLU 119 N 0.00 0.00 0.00 0.11 3.07 -1.99 0.16 114.58 115.94 1vpm h GLU 119 Ca -0.42 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.44 1vpm h GLU 119 Cb 1.20 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.11 1vpm h GLU 119 CO 0.31 0.07 0.00 0.45 -1.40 0.00 0.00 179.01 178.44 1vpm n SER 120 N -3.43 0.32 0.00 1.42 2.88 -1.26 -4.93 113.62 108.62 1vpm n SER 120 Ca -0.02 0.54 0.00 0.00 -1.33 0.00 0.00 58.87 58.06 1vpm n SER 120 Cb 0.21 -0.62 0.00 0.00 -0.75 0.00 0.00 64.21 63.05 1vpm n SER 120 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vpm n GLY 121 N 1.25 0.77 3.82 0.46 0.00 0.58 -5.06 105.19 107.02 1vpm n GLY 121 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 1vpm n GLY 121 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vpm s LYS 122 N -0.54 4.03 0.51 1.61 2.20 -1.26 -4.76 119.74 121.53 1vpm s LYS 122 Ca 0.00 0.54 -0.22 0.00 -0.36 0.00 0.00 55.97 55.93 1vpm s LYS 122 Cb 0.00 -3.23 -0.07 0.00 -1.51 0.00 0.00 37.83 33.02 1vpm s LYS 122 CO 0.00 0.67 1.08 -2.30 -0.36 0.00 0.00 175.35 174.44 1vpm n PRO 123 N 1.80 1.32 -4.18 4.03 -0.02 -1.26 -1.36 135.00 135.33 1vpm n PRO 123 Ca -0.12 0.48 -0.16 0.00 -2.02 0.00 0.00 63.50 61.68 1vpm n PRO 123 Cb 0.52 -2.22 -0.14 0.00 -0.02 0.00 0.00 33.50 31.64 1vpm n PRO 123 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1vpm s LYS 124 N -2.45 0.48 0.59 -0.52 2.20 -0.37 -4.76 119.74 114.90 1vpm s LYS 124 Ca 0.69 -0.26 -0.19 0.00 -0.36 0.00 0.00 55.97 55.85 1vpm s LYS 124 Cb -0.47 -0.44 -0.03 0.00 -1.51 0.00 0.00 37.83 35.37 1vpm s LYS 124 CO 0.52 0.12 1.25 -2.14 -0.36 0.00 0.00 175.35 174.74 1vpm s PRO 125 N -0.27 2.93 0.22 4.03 0.02 -1.26 -4.41 135.00 136.26 1vpm s PRO 125 Ca 0.01 1.95 0.10 0.00 0.02 0.00 0.00 61.00 63.08 1vpm s PRO 125 Cb -0.03 -1.98 -0.04 0.00 0.02 0.00 0.00 34.50 32.46 1vpm s PRO 125 CO -0.00 -1.27 -0.14 0.14 -0.33 0.00 0.00 177.00 175.40 1vpm s VAL 126 N -1.49 2.86 0.66 3.83 -7.23 -0.26 -4.94 120.40 113.83 1vpm s VAL 126 Ca 0.77 -1.95 -0.16 0.00 -1.81 0.00 0.00 61.98 58.83 1vpm s VAL 126 Cb -0.34 -2.44 0.00 0.00 0.56 0.00 0.00 36.38 34.16 1vpm s VAL 126 CO 0.37 -0.21 1.17 -2.84 -0.31 0.00 0.00 175.10 173.28 1vpm s PRO 127 N -3.06 2.65 0.48 4.82 0.02 -1.26 -4.89 135.00 133.76 1vpm s PRO 127 Ca 0.26 1.65 -0.20 0.00 0.02 0.00 0.00 61.00 62.73 1vpm s PRO 127 Cb -0.07 -1.91 -0.09 0.00 0.02 0.00 0.00 34.50 32.45 1vpm s PRO 127 CO 0.14 -1.42 1.02 -0.65 -0.33 0.00 0.00 177.00 175.77 1vpm s GLN 128 N -3.77 3.87 0.01 5.54 -1.52 -1.26 -4.89 119.66 117.63 1vpm s GLN 128 Ca 0.73 1.29 -0.01 0.00 -1.95 0.00 0.00 55.36 55.42 1vpm s GLN 128 Cb -0.26 -2.11 -0.04 0.00 -0.22 0.00 0.00 33.01 30.38 1vpm s GLN 128 CO 0.39 -0.36 0.17 0.54 -0.25 0.00 0.00 175.29 175.78 1vpm s VAL 129 N -2.06 5.27 -0.30 1.09 0.11 -1.26 -1.26 120.40 121.99 1vpm s VAL 129 Ca 0.66 -0.28 -0.03 0.00 -2.93 0.00 0.00 61.98 59.40 1vpm s VAL 129 Cb -0.15 -3.48 0.04 0.00 -1.53 0.00 0.00 36.38 31.26 1vpm s VAL 129 CO 0.20 0.28 0.02 -0.70 -3.33 0.00 0.00 175.10 171.57 1vpm s GLU 130 N -2.05 2.61 0.23 1.54 2.56 0.17 -4.87 118.70 118.88 1vpm s GLU 130 Ca 0.28 -1.16 -0.30 0.00 0.00 0.00 0.00 54.97 53.80 1vpm s GLU 130 Cb -0.13 -3.23 -0.09 0.00 2.00 0.00 0.00 34.13 32.69 1vpm s GLU 130 CO 0.20 -0.57 1.16 -1.25 -0.56 0.00 0.00 175.26 174.24 1vpm s PRO 131 N 1.32 4.54 0.00 4.30 0.04 -1.26 -1.73 135.00 142.22 1vpm s PRO 131 Ca -0.03 1.86 0.00 0.00 0.04 0.00 0.00 61.00 62.87 1vpm s PRO 131 Cb -0.19 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 31.14 1vpm s PRO 131 CO -0.00 0.03 0.00 1.04 0.04 0.00 0.00 177.00 178.10 1vpm n GLN 132 N 1.91 0.00 -2.09 4.56 6.02 -1.26 -4.80 117.38 121.72 1vpm n GLN 132 Ca 0.02 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.72 1vpm n GLN 132 Cb 0.45 -0.85 0.03 0.00 1.02 0.00 0.00 30.24 30.89 1vpm n GLN 132 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1vpm s THR 133 N -1.91 3.87 0.29 5.09 -4.23 -1.26 -4.86 115.64 112.63 1vpm s THR 133 Ca 0.00 0.39 -0.03 0.00 -1.18 0.00 0.00 61.69 60.87 1vpm s THR 133 Cb 0.00 -3.57 0.24 0.00 1.34 0.00 0.00 72.50 70.51 1vpm s THR 133 CO 0.00 -0.69 1.93 -0.33 -0.54 0.00 0.00 174.62 174.99 1vpm h GLU 134 N -0.38 1.08 -0.29 3.99 4.39 -1.99 -0.48 114.58 120.89 1vpm h GLU 134 Ca -0.45 -0.09 0.01 0.00 0.34 0.00 0.00 59.36 59.17 1vpm h GLU 134 Cb 1.24 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 29.64 1vpm h GLU 134 CO 0.62 0.76 0.18 1.49 -1.16 0.00 0.00 179.01 180.90 1vpm h GLU 135 N 1.10 0.35 -0.40 2.33 4.81 -1.99 -0.75 114.58 120.03 1vpm h GLU 135 Ca 0.29 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1vpm h GLU 135 Cb -0.05 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.23 1vpm h GLU 135 CO -0.05 0.23 0.24 0.93 -0.73 0.00 0.00 179.01 179.63 1vpm h GLU 136 N 0.36 0.55 -0.92 1.92 5.08 -1.84 -2.00 114.58 117.72 1vpm h GLU 136 Ca 0.11 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1vpm h GLU 136 Cb -0.01 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.08 1vpm h GLU 136 CO -0.05 0.41 0.56 0.87 -1.00 0.00 0.00 179.01 179.80 1vpm h LYS 137 N 0.53 1.25 -0.54 2.33 1.57 -0.83 -0.45 116.57 120.43 1vpm h LYS 137 Ca 0.14 -0.11 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 1vpm h LYS 137 Cb 0.01 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.04 1vpm h LYS 137 CO -0.03 0.87 0.14 0.00 -0.57 0.00 0.00 179.45 179.87 1vpm h ARG 138 N 1.27 0.85 -0.48 3.15 3.08 -0.92 -0.46 114.38 120.87 1vpm h ARG 138 Ca 0.33 -0.20 -0.08 0.00 0.07 0.00 0.00 59.98 60.10 1vpm h ARG 138 Cb -0.06 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 1vpm h ARG 138 CO -0.06 0.80 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.56 1vpm h LEU 139 N 0.75 0.77 -0.52 3.04 3.38 -1.08 -2.28 115.31 119.38 1vpm h LEU 139 Ca 0.17 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1vpm h LEU 139 Cb 0.32 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1vpm h LEU 139 CO 0.00 0.85 0.16 0.22 0.09 0.00 0.00 178.44 179.75 1vpm h TYR 140 N 0.74 0.83 -0.70 1.13 5.03 -0.80 -1.98 116.97 121.22 1vpm h TYR 140 Ca 0.14 -0.09 -0.01 0.00 2.58 0.00 0.00 58.73 61.35 1vpm h TYR 140 Cb 0.47 -0.24 -0.03 0.00 1.55 0.00 0.00 36.73 38.48 1vpm h TYR 140 CO 0.02 0.72 0.38 0.93 -1.32 0.00 0.00 178.16 178.90 1vpm h GLU 141 N 0.71 0.97 -0.01 1.82 5.08 -0.77 -2.85 114.58 119.53 1vpm h GLU 141 Ca 0.17 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1vpm h GLU 141 Cb 0.28 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1vpm h GLU 141 CO -0.00 0.72 -0.39 0.25 -1.00 0.00 0.00 179.01 178.58 1vpm n THR 142 N -4.36 0.00 -0.20 1.13 -2.24 -0.89 -4.38 114.28 103.34 1vpm n THR 142 Ca 0.07 -0.11 -0.07 0.00 -2.27 0.00 0.00 64.05 61.67 1vpm n THR 142 Cb 0.10 0.52 0.03 0.00 -2.10 0.00 0.00 70.33 68.88 1vpm n THR 142 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vpm h ALA 143 N 3.51 0.74 -1.00 6.98 0.00 -1.11 -3.08 119.26 125.29 1vpm h ALA 143 Ca 0.00 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 54.91 1vpm h ALA 143 Cb 0.54 -0.23 -0.07 0.00 0.00 0.00 0.00 17.79 18.02 1vpm h ALA 143 CO 0.00 0.23 0.64 -1.35 0.00 0.00 0.00 179.25 178.77 1vpm h PRO 144 N 0.78 1.10 -0.41 0.00 0.11 -1.76 -0.70 132.00 131.11 1vpm h PRO 144 Ca 0.21 -0.07 0.01 0.00 0.11 0.00 0.00 66.00 66.26 1vpm h PRO 144 Cb 0.00 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 30.84 1vpm h PRO 144 CO -0.04 0.73 0.26 0.00 -0.21 0.00 0.00 178.00 178.74 1vpm h ALA 145 N 1.47 0.52 -0.91 -0.75 0.00 -1.85 -1.37 119.26 116.36 1vpm h ALA 145 Ca 0.45 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.39 1vpm h ALA 145 Cb 0.25 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 1vpm h ALA 145 CO -0.20 -0.05 0.60 0.00 0.00 0.00 0.00 179.25 179.60 1vpm h ARG 146 N 0.53 1.05 0.00 0.00 3.08 -1.27 -2.53 114.38 115.24 1vpm h ARG 146 Ca 0.16 -0.06 -0.12 0.00 0.07 0.00 0.00 59.98 60.03 1vpm h ARG 146 Cb -0.04 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 29.76 1vpm h ARG 146 CO -0.05 0.70 -0.55 -0.22 -1.07 0.00 0.00 179.97 178.78 1vpm h LYS 147 N 1.08 0.00 -0.50 0.04 1.63 -0.69 -2.76 116.57 115.38 1vpm h LYS 147 Ca 0.38 0.00 -0.06 0.00 -0.85 0.00 0.00 60.65 60.12 1vpm h LYS 147 Cb 0.13 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.74 1vpm h LYS 147 CO -0.13 0.55 0.09 0.93 -3.45 0.00 0.00 179.45 177.43 1vpm h GLU 148 N 0.00 0.83 -0.85 1.90 3.07 -0.84 -0.91 114.58 117.79 1vpm h GLU 148 Ca -0.01 -0.22 -0.01 0.00 -0.50 0.00 0.00 59.36 58.63 1vpm h GLU 148 Cb 1.02 -0.10 -0.04 0.00 -0.84 0.00 0.00 28.75 28.79 1vpm h GLU 148 CO 0.07 0.82 0.50 -0.91 -1.40 0.00 0.00 179.01 178.09 1vpm h ASN 149 N 0.71 1.03 -0.38 1.42 4.21 -1.28 0.54 115.58 121.83 1vpm h ASN 149 Ca 0.15 -0.08 -0.02 0.00 1.21 0.00 0.00 56.30 57.56 1vpm h ASN 149 Cb 0.39 -0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 37.31 1vpm h ASN 149 CO 0.01 0.80 0.14 0.03 -1.29 0.00 0.00 177.43 177.13 1vpm h ARG 150 N 1.17 0.57 -0.78 0.81 3.08 -1.32 -0.99 114.38 116.92 1vpm h ARG 150 Ca 0.30 -0.11 0.12 0.00 0.07 0.00 0.00 59.98 60.37 1vpm h ARG 150 Cb -0.02 -0.09 -0.08 0.00 0.08 0.00 0.00 29.97 29.85 1vpm h ARG 150 CO -0.05 0.55 0.38 0.87 -1.07 0.00 0.00 179.97 180.65 1vpm h LYS 151 N 0.46 0.58 0.38 0.04 6.56 -0.85 -2.86 116.57 120.88 1vpm h LYS 151 Ca 0.12 -0.03 -0.01 0.00 -1.06 0.00 0.00 60.65 59.67 1vpm h LYS 151 Cb 0.20 -0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 31.73 1vpm h LYS 151 CO -0.01 0.38 -0.24 -0.22 -2.06 0.00 0.00 179.45 177.30 1vpm h LYS 152 N 0.60 -0.58 0.00 3.15 3.11 -0.06 -3.51 116.57 119.27 1vpm h LYS 152 Ca 0.41 0.04 0.00 0.00 -2.81 0.00 0.00 60.65 58.28 1vpm h LYS 152 Cb 0.51 0.13 0.00 0.00 -1.00 0.00 0.00 32.23 31.88 1vpm h LYS 152 CO -0.32 -0.39 0.00 2.89 -2.81 0.00 0.00 179.45 178.82