#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jvu n GLY 2 N 0.00 -0.69 3.74 -0.02 0.00 -1.26 -4.84 105.19 102.13 2jvu n GLY 2 Ca 0.00 -0.30 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 2jvu n GLY 2 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jvu s SER 3 N -2.18 7.60 0.00 1.61 0.15 -1.26 -4.76 113.70 114.86 2jvu s SER 3 Ca 0.38 1.89 0.00 0.00 0.70 0.00 0.00 55.95 58.92 2jvu s SER 3 Cb 0.21 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.92 2jvu s SER 3 CO 0.40 0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.53 2jvu n GLY 4 N 1.76 0.31 3.66 9.45 0.00 -1.26 -5.03 105.19 114.09 2jvu n GLY 4 Ca -0.00 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.35 2jvu n GLY 4 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2jvu s TRP 5 N 0.00 1.99 -0.06 1.61 -0.00 -1.26 -4.83 118.94 116.38 2jvu s TRP 5 Ca 0.00 0.17 0.14 0.00 -0.00 0.00 0.00 56.10 56.41 2jvu s TRP 5 Cb 0.00 -3.94 0.26 0.00 -0.00 0.00 0.00 33.47 29.80 2jvu s TRP 5 CO 0.00 -3.94 1.12 0.27 -0.00 0.00 0.00 176.95 174.41 2jvu n ASN 6 N 6.98 1.07 -4.00 5.86 6.94 -1.26 -4.97 115.26 125.89 2jvu n ASN 6 Ca 0.17 -2.56 -0.32 0.00 -0.02 0.00 0.00 54.58 51.85 2jvu n ASN 6 Cb 0.42 -0.34 0.01 0.00 -2.36 0.00 0.00 39.78 37.52 2jvu n ASN 6 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2jvu n ALA 7 N -0.33 -1.27 -0.20 -2.53 0.00 -1.26 -4.89 120.51 110.02 2jvu n ALA 7 Ca 0.08 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2jvu n ALA 7 Cb 0.82 -4.26 0.00 0.00 0.00 0.00 0.00 19.45 16.01 2jvu n ALA 7 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jvu n ASP 8 N -2.79 0.00 -2.75 0.00 -0.08 -1.26 -4.58 116.55 105.09 2jvu n ASP 8 Ca 0.05 0.90 -0.02 0.00 -1.51 0.00 0.00 54.79 54.21 2jvu n ASP 8 Cb 0.52 -0.40 0.08 0.00 2.34 0.00 0.00 41.12 43.65 2jvu n ASP 8 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 2jvu n ASN 9 N -1.80 0.39 -4.75 1.67 6.94 -1.26 -5.11 115.26 111.34 2jvu n ASN 9 Ca 0.00 -2.22 -0.40 0.00 -0.02 0.00 0.00 54.58 51.94 2jvu n ASN 9 Cb 0.00 -0.03 -0.06 0.00 -2.36 0.00 0.00 39.78 37.33 2jvu n ASN 9 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 2jvu s VAL 10 N -2.25 4.11 0.02 3.53 -7.23 -1.26 -4.99 120.40 112.33 2jvu s VAL 10 Ca 0.21 2.04 -0.30 0.00 -1.81 0.00 0.00 61.98 62.12 2jvu s VAL 10 Cb 0.38 -4.31 -0.06 0.00 0.56 0.00 0.00 36.38 32.96 2jvu s VAL 10 CO -0.06 0.50 1.38 -0.62 -0.31 0.00 0.00 175.10 176.00 2jvu s ASP 11 N -1.17 6.86 0.27 4.85 -1.08 -1.26 -4.90 116.67 120.25 2jvu s ASP 11 Ca 0.40 2.14 0.24 0.00 -0.52 0.00 0.00 52.55 54.82 2jvu s ASP 11 Cb -0.26 -2.57 0.45 0.00 -1.46 0.00 0.00 42.92 39.09 2jvu s ASP 11 CO 0.31 -0.69 1.53 1.55 0.52 0.00 0.00 175.17 178.40 2jvu h PRO 12 N 7.58 0.00 -0.97 4.34 0.13 -1.94 -3.33 132.00 137.80 2jvu h PRO 12 Ca -0.39 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.75 2jvu h PRO 12 Cb 1.19 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.27 2jvu h PRO 12 CO 0.89 0.00 0.64 0.77 -0.23 0.00 0.00 178.00 180.07 2jvu h SER 13 N 0.00 1.12 0.48 1.44 0.02 -1.89 -0.96 113.55 113.76 2jvu h SER 13 Ca 0.00 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.89 2jvu h SER 13 Cb 0.87 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 63.12 2jvu h SER 13 CO 0.00 0.81 -0.12 1.56 -1.14 0.00 0.00 176.83 177.95 2jvu h GLN 14 N 1.32 0.00 -0.33 3.45 1.08 -1.99 -2.51 115.11 116.12 2jvu h GLN 14 Ca 0.36 0.00 -0.07 0.00 -1.45 0.00 0.00 58.65 57.49 2jvu h GLN 14 Cb -0.15 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.26 2jvu h GLN 14 CO -0.08 0.12 -0.08 0.00 -0.95 0.00 0.00 178.83 177.84 2jvu s ILE 16 N -4.82 2.20 0.18 0.00 -5.25 -0.95 -1.22 121.20 111.35 2jvu s ILE 16 Ca -0.08 -1.53 0.08 0.00 -0.99 0.00 0.00 60.65 58.13 2jvu s ILE 16 Cb 0.15 -1.90 -0.04 0.00 2.95 0.00 0.00 42.46 43.61 2jvu s ILE 16 CO 0.78 0.26 -0.15 -0.54 -1.79 0.00 0.00 174.94 173.50 2jvu s LYS 17 N -1.56 1.28 -0.36 0.37 1.02 -1.21 -4.86 119.74 114.42 2jvu s LYS 17 Ca 0.13 -1.50 -0.13 0.00 0.02 0.00 0.00 55.97 54.49 2jvu s LYS 17 Cb -0.10 -1.15 -0.00 0.00 -0.52 0.00 0.00 37.83 36.05 2jvu s LYS 17 CO 0.04 0.21 0.26 -1.14 -0.92 0.00 0.00 175.35 173.79 2jvu s GLN 18 N -3.29 3.30 -0.13 1.68 0.74 -1.26 -3.12 119.66 117.58 2jvu s GLN 18 Ca 0.19 -0.79 0.01 0.00 0.05 0.00 0.00 55.36 54.82 2jvu s GLN 18 Cb -0.03 -3.86 0.02 0.00 1.10 0.00 0.00 33.01 30.25 2jvu s GLN 18 CO 0.06 -0.55 -0.14 -1.12 -0.55 0.00 0.00 175.29 172.99 2jvu s SER 19 N 1.70 2.55 -0.93 6.67 0.01 -0.10 -4.82 113.70 118.78 2jvu s SER 19 Ca 0.06 -0.45 -0.05 0.00 1.31 0.00 0.00 55.95 56.81 2jvu s SER 19 Cb -0.18 -1.11 -0.03 0.00 0.21 0.00 0.00 66.02 64.91 2jvu s SER 19 CO 0.10 -0.05 0.80 0.61 0.41 0.00 0.00 173.24 175.12 2jvu n GLY 20 N 4.65 -1.18 2.48 3.44 0.00 -1.26 -1.96 105.19 111.37 2jvu n GLY 20 Ca -0.17 0.53 -0.05 0.00 0.00 0.00 0.00 46.02 46.32 2jvu n GLY 20 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2jvu n VAL 21 N -2.77 0.00 -4.25 1.61 0.24 -1.26 -4.85 118.33 107.05 2jvu n VAL 21 Ca -0.06 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.10 2jvu n VAL 21 Cb 0.57 -0.06 -0.10 0.00 -1.47 0.00 0.00 33.84 32.78 2jvu n VAL 21 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 2jvu s GLN 22 N -4.56 1.06 -0.02 7.34 -0.21 -0.83 -2.06 119.66 120.38 2jvu s GLN 22 Ca 0.10 -1.45 0.08 0.00 0.02 0.00 0.00 55.36 54.11 2jvu s GLN 22 Cb -0.06 -0.61 -0.02 0.00 1.00 0.00 0.00 33.01 33.31 2jvu s GLN 22 CO 0.13 0.07 -0.25 0.71 -2.12 0.00 0.00 175.29 173.84 2jvu s TYR 23 N -3.33 2.37 0.04 0.91 2.02 -0.90 -0.92 117.35 117.53 2jvu s TYR 23 Ca 0.17 -0.41 0.03 0.00 -0.37 0.00 0.00 57.07 56.48 2jvu s TYR 23 Cb 0.03 -1.51 -0.02 0.00 -0.40 0.00 0.00 41.96 40.05 2jvu s TYR 23 CO 0.00 -0.01 -0.08 0.95 -1.57 0.00 0.00 175.55 174.84 2jvu s THR 24 N -0.63 0.61 -0.24 -0.71 -4.23 -1.18 -3.55 115.64 105.71 2jvu s THR 24 Ca 0.10 -0.95 -0.25 0.00 -1.18 0.00 0.00 61.69 59.41 2jvu s THR 24 Cb -0.10 -0.63 -0.00 0.00 1.34 0.00 0.00 72.50 73.10 2jvu s THR 24 CO -0.01 -0.26 0.86 -0.47 -0.54 0.00 0.00 174.62 174.20 2jvu s TYR 25 N -1.13 3.32 -0.55 3.99 6.14 -1.26 -3.29 117.35 124.57 2jvu s TYR 25 Ca -0.07 1.18 -0.24 0.00 0.64 0.00 0.00 57.07 58.59 2jvu s TYR 25 Cb -0.09 -3.08 0.04 0.00 0.42 0.00 0.00 41.96 39.25 2jvu s TYR 25 CO 0.01 -0.41 0.94 -0.80 0.64 0.00 0.00 175.55 175.93 2jvu s ASN 26 N 1.32 6.34 0.00 4.32 0.01 -0.36 -4.83 114.94 121.74 2jvu s ASN 26 Ca 0.36 -0.34 0.28 0.00 -0.71 0.00 0.00 52.86 52.45 2jvu s ASN 26 Cb -0.15 -2.44 0.98 0.00 0.41 0.00 0.00 41.25 40.05 2jvu s ASN 26 CO 0.07 -1.23 1.70 -1.54 -1.51 0.00 0.00 177.10 174.60 2jvu n SER 27 N 7.46 1.61 0.00 -1.22 3.41 -1.26 -3.86 113.62 119.76 2jvu n SER 27 Ca 0.02 -1.53 0.04 0.00 -0.26 0.00 0.00 58.87 57.15 2jvu n SER 27 Cb 0.47 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.62 2jvu n SER 27 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jvu n GLY 28 N 1.19 -0.80 3.56 5.00 0.00 -1.26 -4.45 105.19 108.43 2jvu n GLY 28 Ca 0.18 -0.03 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 2jvu n GLY 28 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jvu s VAL 29 N -2.97 4.73 0.25 1.61 -7.23 -1.25 -4.99 120.40 110.54 2jvu s VAL 29 Ca 0.05 -0.04 -0.06 0.00 -1.81 0.00 0.00 61.98 60.12 2jvu s VAL 29 Cb 0.06 -3.18 0.25 0.00 0.56 0.00 0.00 36.38 34.07 2jvu s VAL 29 CO 0.16 0.38 1.93 -1.28 -0.31 0.00 0.00 175.10 175.98 2jvu h SER 30 N 7.53 1.14 -0.83 4.85 0.87 -1.94 -2.43 113.55 122.75 2jvu h SER 30 Ca -0.37 -0.03 0.17 0.00 -1.23 0.00 0.00 61.79 60.33 2jvu h SER 30 Cb 1.17 -0.28 -0.06 0.00 -0.44 0.00 0.00 62.40 62.79 2jvu h SER 30 CO 0.63 0.83 0.55 1.62 -0.53 0.00 0.00 176.83 179.92 2jvu h VAL 31 N 1.35 0.76 -0.49 2.23 3.04 -1.94 -1.06 116.25 120.14 2jvu h VAL 31 Ca 0.37 -0.16 -0.01 0.00 -1.01 0.00 0.00 66.70 65.89 2jvu h VAL 31 Cb -0.15 0.26 -0.02 0.00 -2.01 0.00 0.00 31.29 29.37 2jvu h VAL 31 CO -0.08 0.08 0.28 0.00 -1.01 0.00 0.00 177.57 176.84 2jvu h MET 33 N 0.65 0.00 -1.00 0.00 2.86 -1.33 -3.15 114.93 112.96 2jvu h MET 33 Ca 0.17 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.82 2jvu h MET 33 Cb 0.03 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.64 2jvu h MET 33 CO -0.03 0.30 0.66 1.96 1.06 0.00 0.00 176.91 180.86 2jvu h GLN 34 N 0.00 1.33 -0.02 1.72 4.20 -0.95 1.18 115.11 122.56 2jvu h GLN 34 Ca -0.00 -0.08 -0.08 0.00 0.06 0.00 0.00 58.65 58.55 2jvu h GLN 34 Cb 1.09 -0.30 0.01 0.00 0.30 0.00 0.00 27.48 28.58 2jvu h GLN 34 CO 0.04 0.88 -0.29 0.78 -0.67 0.00 0.00 178.83 179.57 2jvu h GLY 35 N 1.36 0.26 1.14 3.46 0.00 -1.56 -2.84 103.07 104.90 2jvu h GLY 35 Ca 0.37 -0.42 -0.10 0.00 0.00 0.00 0.00 47.33 47.18 2jvu h GLY 35 CO -0.08 0.37 -0.02 1.41 0.00 0.00 0.00 176.54 178.22 2jvu h LEU 36 N -0.36 1.00 -1.01 3.11 3.38 -1.47 -2.24 115.31 117.73 2jvu h LEU 36 Ca -0.03 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.66 2jvu h LEU 36 Cb 1.00 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.44 2jvu h LEU 36 CO 0.06 1.07 0.65 0.78 0.09 0.00 0.00 178.44 181.09 2jvu h ASN 37 N 0.93 1.15 0.72 -0.43 -0.26 0.14 -1.52 115.58 116.30 2jvu h ASN 37 Ca 0.16 -0.04 0.00 0.00 -0.56 0.00 0.00 56.30 55.87 2jvu h ASN 37 Cb 0.57 -0.29 0.00 0.00 -1.06 0.00 0.00 38.32 37.54 2jvu h ASN 37 CO 0.03 0.84 -0.06 -0.62 -1.06 0.00 0.00 177.43 176.57 2jvu n GLU 38 N -4.38 0.25 -2.00 0.81 1.02 -1.07 -4.90 120.64 110.37 2jvu n GLU 38 Ca 0.12 -0.03 -0.09 0.00 -0.02 0.00 0.00 57.16 57.13 2jvu n GLU 38 Cb 0.02 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 29.93 2jvu n GLU 38 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jvu n GLY 39 N 1.39 0.20 0.23 0.62 0.00 -0.57 -4.86 105.19 102.20 2jvu n GLY 39 Ca 0.10 -0.53 0.10 0.00 0.00 0.00 0.00 46.02 45.69 2jvu n GLY 39 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jvu n LYS 40 N -2.03 0.83 -4.21 1.61 4.76 -0.90 -4.92 118.16 113.29 2jvu n LYS 40 Ca -0.10 -0.48 -0.15 0.00 -2.87 0.00 0.00 58.31 54.71 2jvu n LYS 40 Cb 0.53 -1.44 -0.11 0.00 -1.84 0.00 0.00 35.03 32.17 2jvu n LYS 40 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2jvu s VAL 41 N -2.64 1.08 -0.14 -0.18 1.01 -1.17 -3.72 120.40 114.65 2jvu s VAL 41 Ca 0.12 -1.81 0.02 0.00 0.00 0.00 0.00 61.98 60.31 2jvu s VAL 41 Cb 0.16 -1.57 -0.01 0.00 0.00 0.00 0.00 36.38 34.96 2jvu s VAL 41 CO 0.69 -0.61 0.25 0.54 0.00 0.00 0.00 175.10 175.96 2jvu n ARG 42 N 0.27 3.92 0.00 2.72 1.74 0.46 -4.58 116.66 121.19 2jvu n ARG 42 Ca -0.14 -0.22 0.00 0.00 -0.77 0.00 0.00 57.85 56.73 2jvu n ARG 42 Cb 0.59 -0.74 0.00 0.00 -1.02 0.00 0.00 32.46 31.28 2jvu n ARG 42 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2jvu n GLY 43 N 0.72 0.83 3.11 -0.13 0.00 -1.23 -4.94 105.19 103.55 2jvu n GLY 43 Ca 0.01 -1.84 -0.28 0.00 0.00 0.00 0.00 46.02 43.91 2jvu n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jvu s VAL 44 N -2.89 1.56 0.01 1.61 1.01 -1.21 -2.02 120.40 118.47 2jvu s VAL 44 Ca 0.00 -0.72 -0.25 0.00 0.00 0.00 0.00 61.98 61.00 2jvu s VAL 44 Cb 0.00 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.95 2jvu s VAL 44 CO 0.00 0.45 0.78 -0.44 0.00 0.00 0.00 175.10 175.89 2jvu s SER 45 N 0.57 7.19 -0.05 3.32 0.01 -0.79 -2.20 113.70 121.74 2jvu s SER 45 Ca -0.15 1.42 0.02 0.00 1.31 0.00 0.00 55.95 58.55 2jvu s SER 45 Cb -0.17 -2.47 0.01 0.00 0.21 0.00 0.00 66.02 63.60 2jvu s SER 45 CO 0.05 -0.05 -0.11 0.54 0.41 0.00 0.00 173.24 174.08 2jvu s VAL 46 N 0.29 1.00 0.04 3.43 0.11 -0.99 -2.65 120.40 121.64 2jvu s VAL 46 Ca 0.40 -0.42 0.08 0.00 -2.93 0.00 0.00 61.98 59.11 2jvu s VAL 46 Cb -0.20 -0.91 -0.03 0.00 -1.53 0.00 0.00 36.38 33.71 2jvu s VAL 46 CO 0.23 0.32 -0.23 -0.94 -3.33 0.00 0.00 175.10 171.15 2jvu s SER 47 N 0.55 2.74 -0.01 3.54 1.04 -1.06 -2.89 113.70 117.60 2jvu s SER 47 Ca -0.11 -0.55 0.02 0.00 0.48 0.00 0.00 55.95 55.79 2jvu s SER 47 Cb -0.14 -0.24 0.00 0.00 0.10 0.00 0.00 66.02 65.75 2jvu s SER 47 CO 0.02 0.20 -0.06 -0.83 0.98 0.00 0.00 173.24 173.56 2jvu s GLY 48 N -1.21 0.33 -0.08 7.32 0.00 -1.02 -2.44 107.32 110.23 2jvu s GLY 48 Ca 0.09 -0.20 0.04 0.00 0.00 0.00 0.00 44.72 44.65 2jvu s GLY 48 CO 0.02 -0.04 -0.20 0.14 0.00 0.00 0.00 173.10 173.03 2jvu s VAL 49 N 0.14 1.70 -0.25 1.40 1.01 -1.17 -2.31 120.40 120.92 2jvu s VAL 49 Ca -0.01 -0.81 -0.09 0.00 0.00 0.00 0.00 61.98 61.06 2jvu s VAL 49 Cb -0.06 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 2jvu s VAL 49 CO -0.00 0.48 0.12 -0.36 0.00 0.00 0.00 175.10 175.34 2jvu s PHE 50 N 0.41 3.19 -0.20 5.22 0.08 -0.93 -3.90 117.98 121.85 2jvu s PHE 50 Ca -0.16 -0.06 -0.12 0.00 0.12 0.00 0.00 56.93 56.71 2jvu s PHE 50 Cb -0.17 -2.26 -0.05 0.00 -0.57 0.00 0.00 43.02 39.97 2jvu s PHE 50 CO 0.07 -0.14 0.22 0.71 -0.10 0.00 0.00 175.22 175.97 2jvu s TYR 51 N 1.36 3.39 -0.15 0.36 1.51 -1.23 -2.95 117.35 119.65 2jvu s TYR 51 Ca 0.06 0.41 -0.01 0.00 -1.01 0.00 0.00 57.07 56.52 2jvu s TYR 51 Cb -0.15 -2.29 -0.01 0.00 -0.11 0.00 0.00 41.96 39.40 2jvu s TYR 51 CO 0.06 0.17 -0.10 0.71 -1.11 0.00 0.00 175.55 175.27 2jvu s TYR 52 N 0.73 2.87 0.65 2.71 2.02 -0.87 -2.58 117.35 122.88 2jvu s TYR 52 Ca 0.12 -0.66 0.07 0.00 -0.37 0.00 0.00 57.07 56.22 2jvu s TYR 52 Cb -0.13 -1.91 0.36 0.00 -0.40 0.00 0.00 41.96 39.88 2jvu s TYR 52 CO 0.03 -0.25 1.19 -0.91 -1.57 0.00 0.00 175.55 174.04 2jvu h ASN 53 N 6.96 0.00 0.00 2.29 4.21 -1.85 0.83 115.58 128.02 2jvu h ASN 53 Ca -0.30 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.21 2jvu h ASN 53 Cb 1.20 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.40 2jvu h ASN 53 CO 0.58 0.00 0.00 -0.67 -1.29 0.00 0.00 177.43 176.05 2jvu n ASP 54 N -2.56 0.00 -0.21 5.81 -0.08 -1.26 -4.78 116.55 113.47 2jvu n ASP 54 Ca -0.00 -0.43 -0.02 0.00 -1.51 0.00 0.00 54.79 52.82 2jvu n ASP 54 Cb 0.86 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 44.31 2jvu n ASP 54 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2jvu n GLY 55 N -0.19 0.47 3.36 0.27 0.00 0.29 -5.04 105.19 104.34 2jvu n GLY 55 Ca 0.09 -0.91 -0.30 0.00 0.00 0.00 0.00 46.02 44.90 2jvu n GLY 55 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jvu s THR 56 N -2.10 2.19 -0.01 2.61 -4.23 -1.17 -4.99 115.64 107.93 2jvu s THR 56 Ca 0.00 -1.52 0.04 0.00 -1.18 0.00 0.00 61.69 59.02 2jvu s THR 56 Cb 0.00 -1.89 -0.01 0.00 1.34 0.00 0.00 72.50 71.94 2jvu s THR 56 CO 0.00 0.27 -0.12 0.42 -0.54 0.00 0.00 174.62 174.65 2jvu s THR 57 N -0.90 0.93 -0.02 3.99 -4.23 -1.26 -2.06 115.64 112.09 2jvu s THR 57 Ca 0.13 -0.51 0.07 0.00 -1.18 0.00 0.00 61.69 60.20 2jvu s THR 57 Cb -0.10 -0.78 -0.02 0.00 1.34 0.00 0.00 72.50 72.94 2jvu s THR 57 CO 0.03 0.26 -0.23 -0.55 -0.54 0.00 0.00 174.62 173.60 2jvu s SER 58 N -0.28 3.28 -0.12 3.99 0.15 -1.15 -4.98 113.70 114.58 2jvu s SER 58 Ca 0.05 -0.41 -0.01 0.00 0.70 0.00 0.00 55.95 56.28 2jvu s SER 58 Cb -0.05 -0.46 0.03 0.00 -1.71 0.00 0.00 66.02 63.84 2jvu s SER 58 CO -0.00 0.32 -0.06 0.20 1.20 0.00 0.00 173.24 174.90 2jvu s ASN 59 N -0.66 2.31 -0.16 5.45 0.02 -1.26 -2.20 114.94 118.44 2jvu s ASN 59 Ca 0.10 -0.38 -0.00 0.00 -1.02 0.00 0.00 52.86 51.56 2jvu s ASN 59 Cb -0.10 -0.82 -0.00 0.00 0.02 0.00 0.00 41.25 40.34 2jvu s ASN 59 CO -0.01 -0.14 -0.14 0.12 0.02 0.00 0.00 177.10 176.95 2jvu s PHE 60 N 1.71 2.81 0.09 2.20 2.19 -0.98 -5.00 117.98 121.01 2jvu s PHE 60 Ca 0.04 -0.98 0.07 0.00 0.33 0.00 0.00 56.93 56.39 2jvu s PHE 60 Cb -0.13 -1.91 -0.04 0.00 -1.31 0.00 0.00 43.02 39.63 2jvu s PHE 60 CO -0.08 -0.45 -0.11 0.21 1.83 0.00 0.00 175.22 176.63 2jvu s LYS 61 N 0.82 2.16 0.06 10.12 2.20 -1.26 -2.42 119.74 131.41 2jvu s LYS 61 Ca -0.05 -0.99 -0.27 0.00 -0.36 0.00 0.00 55.97 54.29 2jvu s LYS 61 Cb -0.15 -2.31 0.09 0.00 -1.51 0.00 0.00 37.83 33.95 2jvu s LYS 61 CO 0.00 0.52 1.00 0.20 -0.36 0.00 0.00 175.35 176.71 2jvu s GLY 62 N -2.06 -0.33 -0.19 5.54 0.00 -1.14 -5.04 107.32 104.09 2jvu s GLY 62 Ca 0.20 0.57 -0.05 0.00 0.00 0.00 0.00 44.72 45.44 2jvu s GLY 62 CO 0.12 0.15 -0.01 0.14 0.00 0.00 0.00 173.10 173.50 2jvu s VAL 63 N -3.07 3.86 -0.24 1.40 1.01 -1.26 -2.33 120.40 119.77 2jvu s VAL 63 Ca 0.10 -0.35 -0.16 0.00 0.00 0.00 0.00 61.98 61.57 2jvu s VAL 63 Cb -0.00 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 2jvu s VAL 63 CO -0.02 0.44 0.42 0.54 0.00 0.00 0.00 175.10 176.48 2jvu s VAL 64 N 0.90 5.15 0.09 2.92 0.11 -0.93 -4.84 120.40 123.80 2jvu s VAL 64 Ca 0.01 0.70 0.07 0.00 -2.93 0.00 0.00 61.98 59.82 2jvu s VAL 64 Cb -0.14 -3.74 -0.03 0.00 -1.53 0.00 0.00 36.38 30.93 2jvu s VAL 64 CO 0.02 0.17 -0.18 0.42 -3.33 0.00 0.00 175.10 172.20 2jvu s THR 65 N 1.87 1.43 0.30 5.04 -4.23 0.41 -3.31 115.64 117.15 2jvu s THR 65 Ca 0.18 -1.43 0.19 0.00 -1.18 0.00 0.00 61.69 59.45 2jvu s THR 65 Cb -0.15 -1.32 0.30 0.00 1.34 0.00 0.00 72.50 72.66 2jvu s THR 65 CO 0.09 -0.14 1.17 -2.65 -0.54 0.00 0.00 174.62 172.56 2jvu n PRO 66 N 1.18 -0.04 0.00 3.99 -0.02 -1.26 0.20 135.00 139.05 2jvu n PRO 66 Ca -0.20 0.99 0.11 0.00 -2.02 0.00 0.00 63.50 62.38 2jvu n PRO 66 Cb 0.54 -1.85 -0.01 0.00 -0.02 0.00 0.00 33.50 32.16 2jvu n PRO 66 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2jvu n SER 67 N -4.50 1.61 -3.87 2.55 2.88 -1.26 -4.82 113.62 106.21 2jvu n SER 67 Ca 0.29 -1.28 -0.30 0.00 -1.33 0.00 0.00 58.87 56.25 2jvu n SER 67 Cb 1.04 0.60 -0.16 0.00 -0.75 0.00 0.00 64.21 64.95 2jvu n SER 67 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2jvu s THR 68 N -2.65 1.28 0.47 2.46 2.01 0.52 -5.13 115.64 114.60 2jvu s THR 68 Ca 0.15 -1.25 -0.02 0.00 0.31 0.00 0.00 61.69 60.88 2jvu s THR 68 Cb 0.18 -1.72 -0.01 0.00 0.01 0.00 0.00 72.50 70.96 2jvu s THR 68 CO 0.66 -0.29 0.73 -2.16 -0.69 0.00 0.00 174.62 172.87 2jvu s PRO 69 N 1.48 3.16 -0.10 4.92 0.04 -1.26 -0.44 135.00 142.80 2jvu s PRO 69 Ca 0.00 -0.24 0.04 0.00 0.04 0.00 0.00 61.00 60.84 2jvu s PRO 69 Cb -0.18 -2.47 0.00 0.00 0.04 0.00 0.00 34.50 31.88 2jvu s PRO 69 CO -0.11 -0.31 -0.23 0.08 0.04 0.00 0.00 177.00 176.47 2jvu s VAL 70 N -2.66 2.01 -0.21 -0.36 1.01 -1.23 -4.96 120.40 114.01 2jvu s VAL 70 Ca 0.48 -0.99 -0.09 0.00 0.00 0.00 0.00 61.98 61.38 2jvu s VAL 70 Cb -0.10 -1.74 -0.05 0.00 0.00 0.00 0.00 36.38 34.49 2jvu s VAL 70 CO 0.40 0.55 0.12 0.54 0.00 0.00 0.00 175.10 176.71 2jvu s ASN 71 N 0.34 5.96 -0.02 3.32 4.22 -1.26 -2.12 114.94 125.38 2jvu s ASN 71 Ca -0.18 0.13 0.15 0.00 -2.14 0.00 0.00 52.86 50.82 2jvu s ASN 71 Cb -0.18 -2.05 0.47 0.00 1.28 0.00 0.00 41.25 40.77 2jvu s ASN 71 CO 0.09 0.13 1.38 0.35 -2.04 0.00 0.00 177.10 177.01 2jvu n THR 72 N 3.85 0.84 -1.12 0.54 -2.24 -0.88 -4.60 114.28 110.68 2jvu n THR 72 Ca -0.16 -0.73 -0.30 0.00 -2.27 0.00 0.00 64.05 60.59 2jvu n THR 72 Cb 0.52 0.27 -0.05 0.00 -2.10 0.00 0.00 70.33 68.96 2jvu n THR 72 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2jvu n ASN 73 N 0.96 7.22 -3.95 3.42 6.94 -1.25 -4.91 115.26 123.69 2jvu n ASN 73 Ca 0.18 -2.48 0.00 0.00 -0.02 0.00 0.00 54.58 52.25 2jvu n ASN 73 Cb 0.49 -1.41 0.00 0.00 -2.36 0.00 0.00 39.78 36.50 2jvu n ASN 73 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2jvu n GLN 74 N 3.47 1.12 -1.74 -3.83 6.02 -1.26 -4.62 117.38 116.54 2jvu n GLN 74 Ca 0.64 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 57.25 2jvu n GLN 74 Cb 0.34 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.57 2jvu n GLN 74 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2jvu s ASP 75 N -1.95 4.93 0.36 1.08 1.01 -1.26 -4.77 116.67 116.06 2jvu s ASP 75 Ca 0.00 0.98 0.24 0.00 0.71 0.00 0.00 52.55 54.48 2jvu s ASP 75 Cb 0.00 -2.51 0.52 0.00 1.01 0.00 0.00 42.92 41.93 2jvu s ASP 75 CO 0.00 -2.52 1.67 0.40 0.21 0.00 0.00 175.17 174.93 2jvu h ILE 76 N 7.31 0.00 -0.94 0.77 2.04 -1.96 -3.26 117.51 121.47 2jvu h ILE 76 Ca -0.27 -0.81 0.01 0.00 1.00 0.00 0.00 64.86 64.79 2jvu h ILE 76 Cb 1.22 1.81 -0.05 0.00 -0.74 0.00 0.00 36.82 39.06 2jvu h ILE 76 CO 1.14 0.00 0.62 0.78 0.00 0.00 0.00 178.15 180.70 2jvu h ASN 77 N 0.00 1.08 -0.18 1.72 2.35 -1.99 0.85 115.58 119.41 2jvu h ASN 77 Ca 0.00 -0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 2jvu h ASN 77 Cb 0.90 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.99 2jvu h ASN 77 CO 0.00 0.78 0.08 0.11 -1.65 0.00 0.00 177.43 176.76 2jvu h LYS 78 N 1.28 0.26 -0.71 0.81 1.57 -1.97 -1.99 116.57 115.81 2jvu h LYS 78 Ca 0.35 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 59.09 2jvu h LYS 78 Cb -0.15 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.08 2jvu h LYS 78 CO -0.07 0.29 0.47 1.15 -0.57 0.00 0.00 179.45 180.72 2jvu h THR 79 N 0.16 1.18 -0.59 -0.16 2.02 -1.52 0.12 112.91 114.12 2jvu h THR 79 Ca 0.06 -0.34 -0.03 0.00 0.77 0.00 0.00 66.41 66.87 2jvu h THR 79 Cb 0.12 0.14 -0.03 0.00 -1.74 0.00 0.00 68.15 66.64 2jvu h THR 79 CO -0.01 0.18 0.24 -1.13 0.37 0.00 0.00 175.52 175.17 2jvu h ASN 80 N 0.97 0.78 -0.14 4.18 -1.24 -0.64 2.94 115.58 122.44 2jvu h ASN 80 Ca 0.26 -0.10 -0.11 0.00 0.71 0.00 0.00 56.30 57.06 2jvu h ASN 80 Cb -0.11 -0.20 0.00 0.00 0.73 0.00 0.00 38.32 38.74 2jvu h ASN 80 CO -0.06 0.70 -0.35 0.50 -1.29 0.00 0.00 177.43 176.94 2jvu h LYS 81 N 0.85 0.48 0.00 6.67 3.64 -0.50 -3.39 116.57 124.31 2jvu h LYS 81 Ca 0.20 -0.33 -0.11 0.00 -1.27 0.00 0.00 60.65 59.15 2jvu h LYS 81 Cb 0.16 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 2jvu h LYS 81 CO -0.02 0.94 -1.47 1.55 -2.27 0.00 0.00 179.45 178.18 2jvu n VAL 82 N -4.35 0.40 0.00 2.00 3.14 0.30 -5.11 118.33 114.72 2jvu n VAL 82 Ca -0.07 -0.28 0.00 0.00 -2.96 0.00 0.00 64.34 61.03 2jvu n VAL 82 Cb 0.50 -0.60 0.00 0.00 -1.06 0.00 0.00 33.84 32.68 2jvu n VAL 82 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2jvu n GLY 83 N 2.46 -0.30 3.40 7.55 0.00 0.98 -4.72 105.19 114.57 2jvu n GLY 83 Ca -0.10 -1.71 -0.35 0.00 0.00 0.00 0.00 46.02 43.87 2jvu n GLY 83 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jvu s VAL 84 N -2.48 3.66 -0.05 1.61 1.01 -1.26 -4.15 120.40 118.74 2jvu s VAL 84 Ca 0.00 -0.41 -0.00 0.00 0.00 0.00 0.00 61.98 61.56 2jvu s VAL 84 Cb 0.00 -2.64 -0.00 0.00 0.00 0.00 0.00 36.38 33.74 2jvu s VAL 84 CO 0.00 0.44 -0.01 1.56 0.00 0.00 0.00 175.10 177.09 2jvu h GLN 85 N 7.52 0.00 -6.35 2.72 4.20 -1.86 -3.47 115.11 117.86 2jvu h GLN 85 Ca -0.36 0.00 -0.69 0.00 0.06 0.00 0.00 58.65 57.66 2jvu h GLN 85 Cb 1.18 0.00 -0.24 0.00 0.30 0.00 0.00 27.48 28.72 2jvu h GLN 85 CO 0.60 0.00 -0.78 0.15 -0.67 0.00 0.00 178.83 178.13 2jvu s LYS 86 N -1.30 2.46 -0.11 1.46 1.02 -1.26 -5.05 119.74 116.96 2jvu s LYS 86 Ca -0.01 -0.72 0.03 0.00 0.02 0.00 0.00 55.97 55.29 2jvu s LYS 86 Cb 0.00 -2.34 0.01 0.00 -0.52 0.00 0.00 37.83 34.98 2jvu s LYS 86 CO 0.01 0.61 -0.21 -0.47 -0.92 0.00 0.00 175.35 174.37 2jvu s TYR 87 N -0.71 2.43 -0.05 3.18 6.14 -1.26 -3.50 117.35 123.58 2jvu s TYR 87 Ca 0.11 -1.10 0.02 0.00 0.64 0.00 0.00 57.07 56.74 2jvu s TYR 87 Cb -0.11 -1.66 0.01 0.00 0.42 0.00 0.00 41.96 40.63 2jvu s TYR 87 CO 0.00 -0.48 -0.08 1.03 0.64 0.00 0.00 175.55 176.66 2jvu s ARG 88 N 0.62 1.14 -0.08 4.97 0.52 -1.25 -5.05 118.95 119.82 2jvu s ARG 88 Ca -0.13 -0.25 0.04 0.00 -0.52 0.00 0.00 55.73 54.87 2jvu s ARG 88 Cb -0.17 -1.03 0.00 0.00 0.52 0.00 0.00 34.95 34.27 2jvu s ARG 88 CO 0.03 0.00 -0.21 0.00 0.02 0.00 0.00 175.30 175.14 2jvu s ALA 89 N 0.66 1.95 -0.14 2.13 0.00 -1.26 -3.07 121.76 122.03 2jvu s ALA 89 Ca -0.11 -0.85 -0.02 0.00 0.00 0.00 0.00 51.96 50.98 2jvu s ALA 89 Cb -0.14 -0.73 -0.02 0.00 0.00 0.00 0.00 23.12 22.24 2jvu s ALA 89 CO 0.01 0.27 -0.07 -0.51 0.00 0.00 0.00 175.76 175.46 2jvu s LEU 90 N 0.32 3.05 -0.12 0.00 1.02 -1.02 -4.96 118.68 116.96 2jvu s LEU 90 Ca -0.15 -0.19 0.01 0.00 0.02 0.00 0.00 54.13 53.82 2jvu s LEU 90 Cb -0.17 -1.71 0.02 0.00 0.02 0.00 0.00 46.19 44.35 2jvu s LEU 90 CO 0.07 0.19 -0.16 0.42 0.02 0.00 0.00 176.35 176.89 2jvu s THR 91 N 0.24 1.59 0.03 5.49 -4.23 -1.26 -2.57 115.64 114.93 2jvu s THR 91 Ca -0.05 -0.68 0.03 0.00 -1.18 0.00 0.00 61.69 59.81 2jvu s THR 91 Cb -0.14 -1.45 -0.02 0.00 1.34 0.00 0.00 72.50 72.22 2jvu s THR 91 CO 0.04 0.46 -0.09 -0.70 -0.54 0.00 0.00 174.62 173.78 2jvu s GLU 92 N 1.08 0.64 0.31 3.99 2.12 -1.08 -4.67 118.70 121.08 2jvu s GLU 92 Ca -0.04 -0.65 -0.29 0.00 0.36 0.00 0.00 54.97 54.36 2jvu s GLU 92 Cb -0.14 -0.53 -0.10 0.00 0.26 0.00 0.00 34.13 33.61 2jvu s GLU 92 CO -0.04 0.12 1.25 -1.58 -0.54 0.00 0.00 175.26 174.47 2jvu s TRP 93 N -0.95 3.21 -0.24 5.30 0.52 -1.26 -1.89 118.94 123.63 2jvu s TRP 93 Ca -0.04 1.48 -0.06 0.00 0.02 0.00 0.00 56.10 57.51 2jvu s TRP 93 Cb -0.08 -3.56 -0.02 0.00 -1.15 0.00 0.00 33.47 28.66 2jvu s TRP 93 CO 0.01 -1.49 0.02 0.08 0.02 0.00 0.00 176.95 175.58 2jvu s VAL 94 N -1.06 3.87 -4.23 4.03 1.01 -0.86 -4.83 120.40 118.33 2jvu s VAL 94 Ca 0.48 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.11 2jvu s VAL 94 Cb -0.37 -2.81 0.00 0.00 0.00 0.00 0.00 36.38 33.20 2jvu s VAL 94 CO 0.49 0.36 0.00 0.61 0.00 0.00 0.00 175.10 176.55 2jvu n GLY 95 N 4.86 -1.73 3.77 4.51 0.00 -1.26 0.17 105.19 115.51 2jvu n GLY 95 Ca -0.17 -1.20 -0.37 0.00 0.00 0.00 0.00 46.02 44.29 2jvu n GLY 95 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jvu s SER 96 N -2.87 6.12 0.00 1.61 0.01 -1.24 -4.93 113.70 112.40 2jvu s SER 96 Ca 0.00 2.25 0.24 0.00 1.31 0.00 0.00 55.95 59.75 2jvu s SER 96 Cb 0.00 -2.60 0.33 0.00 0.21 0.00 0.00 66.02 63.96 2jvu s SER 96 CO 0.00 -0.95 1.29 0.54 0.41 0.00 0.00 173.24 174.53 2jvu n ARG 97 N -0.64 0.00 -0.42 12.44 1.74 -1.26 -4.98 116.66 123.55 2jvu n ARG 97 Ca 0.08 -0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 2jvu n ARG 97 Cb 0.49 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.43 2jvu n ARG 97 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56