#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jvu s GLY 2 N 0.00 2.87 -0.26 -0.02 0.00 -1.26 -5.01 107.32 103.65 2jvu s GLY 2 Ca 0.00 0.83 -0.11 0.00 0.00 0.00 0.00 44.72 45.44 2jvu s GLY 2 CO 0.00 1.33 0.18 -0.56 0.00 0.00 0.00 173.10 174.06 2jvu s SER 3 N -1.24 6.09 0.00 1.64 0.01 -1.26 -4.83 113.70 114.11 2jvu s SER 3 Ca 0.53 0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.87 2jvu s SER 3 Cb -0.27 -2.12 0.00 0.00 0.21 0.00 0.00 66.02 63.84 2jvu s SER 3 CO 0.35 0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.61 2jvu n GLY 4 N 4.61 0.24 3.69 3.44 0.00 -1.26 -5.09 105.19 110.82 2jvu n GLY 4 Ca -0.14 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 2jvu n GLY 4 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2jvu n TRP 5 N 0.00 2.64 -1.97 1.61 -0.00 -1.26 -4.85 117.44 113.61 2jvu n TRP 5 Ca 0.00 -0.12 0.03 0.00 -0.00 0.00 0.00 57.50 57.42 2jvu n TRP 5 Cb 0.00 -2.72 0.05 0.00 -0.00 0.00 0.00 31.31 28.64 2jvu n TRP 5 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 2jvu n ASN 6 N 5.39 0.84 -3.52 5.87 3.02 -1.26 -4.97 115.26 120.63 2jvu n ASN 6 Ca 0.18 -2.36 -0.26 0.00 -0.03 0.00 0.00 54.58 52.10 2jvu n ASN 6 Cb 0.37 -0.30 0.01 0.00 -0.61 0.00 0.00 39.78 39.25 2jvu n ASN 6 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jvu n ALA 7 N -0.18 -1.12 -0.97 5.41 0.00 -1.26 -4.88 120.51 117.51 2jvu n ALA 7 Ca 0.06 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2jvu n ALA 7 Cb 0.83 -3.47 0.00 0.00 0.00 0.00 0.00 19.45 16.81 2jvu n ALA 7 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2jvu n ASP 8 N -2.49 0.00 -2.47 0.00 5.75 -1.26 -4.53 116.55 111.55 2jvu n ASP 8 Ca -0.01 0.51 0.00 0.00 -0.01 0.00 0.00 54.79 55.29 2jvu n ASP 8 Cb 0.54 -0.01 0.05 0.00 -1.03 0.00 0.00 41.12 40.67 2jvu n ASP 8 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2jvu n ASN 9 N -0.85 0.82 -4.84 -1.12 4.13 -1.26 -5.11 115.26 107.03 2jvu n ASN 9 Ca 0.00 -2.05 -0.32 0.00 1.68 0.00 0.00 54.58 53.89 2jvu n ASN 9 Cb 0.00 -0.21 -0.05 0.00 -1.54 0.00 0.00 39.78 37.98 2jvu n ASN 9 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2jvu s VAL 10 N -2.25 4.54 0.05 2.41 1.01 -1.26 -5.01 120.40 119.88 2jvu s VAL 10 Ca 0.24 1.19 -0.30 0.00 0.00 0.00 0.00 61.98 63.11 2jvu s VAL 10 Cb 0.34 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 2jvu s VAL 10 CO -0.08 -0.49 1.02 -1.81 0.00 0.00 0.00 175.10 173.75 2jvu s ASP 11 N -2.71 7.34 0.22 3.32 1.01 -1.26 -4.93 116.67 119.66 2jvu s ASP 11 Ca 0.58 1.79 0.26 0.00 0.71 0.00 0.00 52.55 55.89 2jvu s ASP 11 Cb -0.10 -2.58 0.75 0.00 1.01 0.00 0.00 42.92 42.01 2jvu s ASP 11 CO 0.24 -0.25 1.73 1.55 0.21 0.00 0.00 175.17 178.65 2jvu h PRO 12 N 6.39 0.00 -0.42 8.23 0.13 -1.95 -3.30 132.00 141.08 2jvu h PRO 12 Ca -0.42 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.65 2jvu h PRO 12 Cb 1.22 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 2jvu h PRO 12 CO 0.75 0.00 0.01 0.66 -0.23 0.00 0.00 178.00 179.19 2jvu h SER 13 N 0.00 0.63 0.81 1.44 4.64 -1.89 -2.24 113.55 116.94 2jvu h SER 13 Ca 0.00 -0.13 -0.04 0.00 -0.47 0.00 0.00 61.79 61.15 2jvu h SER 13 Cb 0.75 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 2jvu h SER 13 CO 0.00 0.69 -0.18 1.56 -0.87 0.00 0.00 176.83 178.03 2jvu h GLN 14 N 0.63 0.00 0.00 4.77 4.20 -1.99 -2.62 115.11 120.10 2jvu h GLN 14 Ca 0.13 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.77 2jvu h GLN 14 Cb 0.38 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 2jvu h GLN 14 CO 0.01 0.18 -0.32 0.00 -0.67 0.00 0.00 178.83 178.04 2jvu s ILE 16 N -4.02 2.31 -0.02 0.00 -5.25 -0.99 -1.70 121.20 111.54 2jvu s ILE 16 Ca -0.02 -0.95 0.03 0.00 -0.99 0.00 0.00 60.65 58.72 2jvu s ILE 16 Cb 0.13 -1.88 -0.03 0.00 2.95 0.00 0.00 42.46 43.63 2jvu s ILE 16 CO 0.68 0.56 -0.10 -0.54 -1.79 0.00 0.00 174.94 173.76 2jvu s LYS 17 N 0.05 2.55 -0.19 0.37 1.02 -1.18 -4.87 119.74 117.48 2jvu s LYS 17 Ca -0.09 -0.69 -0.13 0.00 0.02 0.00 0.00 55.97 55.08 2jvu s LYS 17 Cb -0.15 -2.47 -0.05 0.00 -0.52 0.00 0.00 37.83 34.64 2jvu s LYS 17 CO 0.06 0.62 0.24 1.14 -0.92 0.00 0.00 175.35 176.49 2jvu s GLN 18 N -1.09 4.20 -0.26 1.68 0.00 -1.26 -2.98 119.66 119.95 2jvu s GLN 18 Ca 0.14 -0.03 -0.07 0.00 -0.00 0.00 0.00 55.36 55.40 2jvu s GLN 18 Cb -0.11 -3.46 -0.02 0.00 0.00 0.00 0.00 33.01 29.43 2jvu s GLN 18 CO 0.04 0.18 0.06 0.45 0.00 0.00 0.00 175.29 176.02 2jvu s SER 19 N 0.63 5.03 0.00 12.60 0.15 -0.44 -4.85 113.70 126.81 2jvu s SER 19 Ca 0.13 -0.36 0.00 0.00 0.70 0.00 0.00 55.95 56.42 2jvu s SER 19 Cb -0.13 -1.89 0.00 0.00 -1.71 0.00 0.00 66.02 62.29 2jvu s SER 19 CO 0.03 -0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.00 2jvu n GLY 20 N 4.90 0.22 1.56 9.45 0.00 -1.26 -0.79 105.19 119.26 2jvu n GLY 20 Ca -0.16 0.69 -0.04 0.00 0.00 0.00 0.00 46.02 46.51 2jvu n GLY 20 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2jvu n VAL 21 N 0.00 0.06 -4.32 1.61 3.14 -1.26 -5.12 118.33 112.45 2jvu n VAL 21 Ca 0.00 -0.50 -0.17 0.00 -2.96 0.00 0.00 64.34 60.71 2jvu n VAL 21 Cb 0.00 0.72 -0.10 0.00 -1.06 0.00 0.00 33.84 33.40 2jvu n VAL 21 CO 0.00 0.00 0.00 -1.58 -6.46 0.00 0.00 176.83 168.79 2jvu s GLN 22 N -0.15 1.25 -0.08 1.45 0.74 0.03 -2.48 119.66 120.42 2jvu s GLN 22 Ca 0.07 -1.57 0.03 0.00 0.05 0.00 0.00 55.36 53.94 2jvu s GLN 22 Cb 0.17 -0.84 -0.02 0.00 1.10 0.00 0.00 33.01 33.42 2jvu s GLN 22 CO -0.05 0.07 -0.16 0.71 -0.55 0.00 0.00 175.29 175.31 2jvu s TYR 23 N -3.19 2.70 0.04 1.67 2.02 -0.87 -1.33 117.35 118.39 2jvu s TYR 23 Ca 0.22 -0.46 0.02 0.00 -0.37 0.00 0.00 57.07 56.49 2jvu s TYR 23 Cb 0.02 -1.71 -0.02 0.00 -0.40 0.00 0.00 41.96 39.85 2jvu s TYR 23 CO 0.05 -0.05 -0.08 0.95 -1.57 0.00 0.00 175.55 174.85 2jvu s THR 24 N -0.19 0.56 -0.20 -0.71 -4.23 -1.16 -3.68 115.64 106.03 2jvu s THR 24 Ca -0.01 -1.09 -0.26 0.00 -1.18 0.00 0.00 61.69 59.16 2jvu s THR 24 Cb -0.13 -0.63 -0.01 0.00 1.34 0.00 0.00 72.50 73.07 2jvu s THR 24 CO 0.03 -0.38 0.87 -0.47 -0.54 0.00 0.00 174.62 174.13 2jvu s TYR 25 N -1.38 3.38 -1.16 3.99 6.14 -1.26 -3.10 117.35 123.96 2jvu s TYR 25 Ca -0.10 1.26 -0.18 0.00 0.64 0.00 0.00 57.07 58.70 2jvu s TYR 25 Cb -0.10 -3.07 0.11 0.00 0.42 0.00 0.00 41.96 39.32 2jvu s TYR 25 CO 0.00 -0.32 1.49 1.21 0.64 0.00 0.00 175.55 178.57 2jvu s ASN 26 N 1.22 6.81 0.00 4.32 3.84 -0.69 -4.75 114.94 125.70 2jvu s ASN 26 Ca 0.38 -2.36 0.28 0.00 0.21 0.00 0.00 52.86 51.38 2jvu s ASN 26 Cb -0.16 -2.49 1.46 0.00 -0.55 0.00 0.00 41.25 39.51 2jvu s ASN 26 CO 0.10 -1.09 1.98 -1.54 -2.79 0.00 0.00 177.10 173.77 2jvu n SER 27 N 7.34 0.00 -0.32 -4.21 3.41 -1.26 -3.61 113.62 114.97 2jvu n SER 27 Ca 0.38 -0.22 0.05 0.00 -0.26 0.00 0.00 58.87 58.81 2jvu n SER 27 Cb 0.46 -0.25 0.24 0.00 -0.26 0.00 0.00 64.21 64.41 2jvu n SER 27 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2jvu h GLY 28 N 4.62 1.41 -4.28 5.00 0.00 -1.96 -3.41 103.07 104.45 2jvu h GLY 28 Ca 0.00 -0.42 -0.53 0.00 0.00 0.00 0.00 47.33 46.38 2jvu h GLY 28 CO 0.00 0.27 0.32 -1.34 0.00 0.00 0.00 176.54 175.79 2jvu s VAL 29 N -5.92 4.64 0.35 4.60 -7.23 -1.24 -4.95 120.40 110.65 2jvu s VAL 29 Ca -0.12 1.97 0.05 0.00 -1.81 0.00 0.00 61.98 62.07 2jvu s VAL 29 Cb 0.20 -4.28 0.18 0.00 0.56 0.00 0.00 36.38 33.04 2jvu s VAL 29 CO 0.80 0.29 1.90 0.28 -0.31 0.00 0.00 175.10 178.06 2jvu h SER 30 N 5.89 0.50 -1.01 4.85 0.02 -1.93 -3.01 113.55 118.86 2jvu h SER 30 Ca -0.43 -0.08 0.01 0.00 -0.84 0.00 0.00 61.79 60.46 2jvu h SER 30 Cb 1.21 -0.13 -0.05 0.00 0.14 0.00 0.00 62.40 63.57 2jvu h SER 30 CO 0.72 0.53 0.67 1.62 -1.14 0.00 0.00 176.83 179.24 2jvu h VAL 31 N 0.52 1.26 -0.61 2.27 3.04 -1.94 0.52 116.25 121.31 2jvu h VAL 31 Ca 0.12 -0.47 -0.10 0.00 -1.01 0.00 0.00 66.70 65.24 2jvu h VAL 31 Cb 0.27 -0.23 -0.02 0.00 -2.01 0.00 0.00 31.29 29.30 2jvu h VAL 31 CO 0.00 0.25 -0.00 0.00 -1.01 0.00 0.00 177.57 176.81 2jvu h MET 33 N 0.98 0.00 -0.86 0.00 2.86 -1.44 -3.18 114.93 113.30 2jvu h MET 33 Ca 0.17 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.81 2jvu h MET 33 Cb 0.57 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.19 2jvu h MET 33 CO 0.03 0.00 0.53 0.37 1.06 0.00 0.00 176.91 178.90 2jvu h GLN 34 N 0.00 1.17 -0.09 1.72 4.15 0.55 0.53 115.11 123.13 2jvu h GLN 34 Ca 0.00 -0.10 -0.15 0.00 0.77 0.00 0.00 58.65 59.17 2jvu h GLN 34 Cb 0.89 -0.25 0.01 0.00 0.21 0.00 0.00 27.48 28.34 2jvu h GLN 34 CO 0.00 0.81 -0.51 0.78 -1.93 0.00 0.00 178.83 177.98 2jvu h GLY 35 N 1.18 0.56 1.09 2.39 0.00 -1.53 -2.32 103.07 104.44 2jvu h GLY 35 Ca 0.31 -0.81 -0.09 0.00 0.00 0.00 0.00 47.33 46.74 2jvu h GLY 35 CO -0.06 0.72 0.04 1.41 0.00 0.00 0.00 176.54 178.65 2jvu h LEU 36 N 0.10 1.07 -0.86 3.11 3.38 -1.48 -1.68 115.31 118.95 2jvu h LEU 36 Ca -0.04 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.61 2jvu h LEU 36 Cb 1.16 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 41.58 2jvu h LEU 36 CO 0.11 1.10 0.42 0.78 0.09 0.00 0.00 178.44 180.93 2jvu h ASN 37 N 1.01 1.12 0.90 -0.43 2.35 0.06 -1.64 115.58 118.95 2jvu h ASN 37 Ca 0.19 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2jvu h ASN 37 Cb 0.52 -0.29 0.00 0.00 0.05 0.00 0.00 38.32 38.61 2jvu h ASN 37 CO 0.03 0.94 0.00 -0.62 -1.65 0.00 0.00 177.43 176.13 2jvu n GLU 38 N -4.31 0.04 -2.04 0.81 1.02 -0.88 -4.89 120.64 110.40 2jvu n GLU 38 Ca 0.09 0.12 -0.09 0.00 -0.02 0.00 0.00 57.16 57.25 2jvu n GLU 38 Cb 0.14 -1.55 -0.01 0.00 -0.02 0.00 0.00 31.44 29.99 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 0.97 0.16 0.31 0.62 0.00 -0.62 -4.87 105.19 101.77 2jvu n GLY 39 Ca 0.06 -0.52 0.09 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.01 1.45 -4.21 1.61 5.02 -0.93 -4.95 118.16 114.15 2jvu n LYS 40 Ca -0.11 -0.67 -0.12 0.00 -2.02 0.00 0.00 58.31 55.39 2jvu n LYS 40 Cb 0.54 -1.34 -0.10 0.00 -0.02 0.00 0.00 35.03 34.11 2jvu n LYS 40 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2jvu s VAL 41 N -2.24 0.93 0.00 -0.18 1.01 -1.19 -4.57 120.40 114.16 2jvu s VAL 41 Ca 0.13 -1.99 0.00 0.00 0.00 0.00 0.00 61.98 60.12 2jvu s VAL 41 Cb 0.14 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.77 2jvu s VAL 41 CO 0.53 -0.81 0.11 0.54 0.00 0.00 0.00 175.10 175.47 2jvu n ARG 42 N -0.10 4.94 0.00 2.72 1.74 0.80 -4.57 116.66 122.18 2jvu n ARG 42 Ca -0.11 -0.11 0.00 0.00 -0.77 0.00 0.00 57.85 56.86 2jvu n ARG 42 Cb 0.61 -0.59 0.00 0.00 -1.02 0.00 0.00 32.46 31.45 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 0.74 0.95 3.20 -0.13 0.00 -1.21 -4.92 105.19 103.83 2jvu n GLY 43 Ca 0.00 -1.90 -0.31 0.00 0.00 0.00 0.00 46.02 43.80 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 -2.82 1.99 0.12 1.61 1.01 -1.21 -2.13 120.40 118.97 2jvu s VAL 44 Ca 0.00 -0.98 -0.22 0.00 0.00 0.00 0.00 61.98 60.78 2jvu s VAL 44 Cb 0.00 -1.73 -0.07 0.00 0.00 0.00 0.00 36.38 34.58 2jvu s VAL 44 CO 0.00 0.54 0.67 -0.55 0.00 0.00 0.00 175.10 175.77 2jvu s SER 45 N 0.39 7.23 -0.04 3.32 0.15 -0.98 -2.12 113.70 121.66 2jvu s SER 45 Ca -0.18 1.46 0.02 0.00 0.70 0.00 0.00 55.95 57.95 2jvu s SER 45 Cb -0.18 -2.43 0.01 0.00 -1.71 0.00 0.00 66.02 61.71 2jvu s SER 45 CO 0.08 0.24 -0.09 0.54 1.20 0.00 0.00 173.24 175.22 2jvu s VAL 46 N -1.13 0.81 0.10 4.45 0.11 -0.99 -2.95 120.40 120.80 2jvu s VAL 46 Ca 0.32 -0.32 0.09 0.00 -2.93 0.00 0.00 61.98 59.14 2jvu s VAL 46 Cb -0.21 -0.75 -0.03 0.00 -1.53 0.00 0.00 36.38 33.85 2jvu s VAL 46 CO 0.23 0.27 -0.23 -0.94 -3.33 0.00 0.00 175.10 171.10 2jvu s SER 47 N 0.53 2.78 -0.03 3.54 1.04 -1.01 -2.66 113.70 117.89 2jvu s SER 47 Ca -0.09 -0.67 -0.06 0.00 0.48 0.00 0.00 55.95 55.61 2jvu s SER 47 Cb -0.12 -0.18 0.01 0.00 0.10 0.00 0.00 66.02 65.82 2jvu s SER 47 CO 0.01 0.12 0.15 -0.83 0.98 0.00 0.00 173.24 173.68 2jvu s GLY 48 N -1.79 -0.05 -0.09 7.32 0.00 -1.17 -2.25 107.32 109.29 2jvu s GLY 48 Ca 0.09 0.20 0.04 0.00 0.00 0.00 0.00 44.72 45.05 2jvu s GLY 48 CO 0.04 0.11 -0.22 0.14 0.00 0.00 0.00 173.10 173.17 2jvu s VAL 49 N -0.56 1.89 -0.25 1.40 1.01 -1.15 -2.80 120.40 119.95 2jvu s VAL 49 Ca -0.06 -0.92 -0.07 0.00 0.00 0.00 0.00 61.98 60.92 2jvu s VAL 49 Cb -0.04 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.67 2jvu s VAL 49 CO 0.01 0.52 0.06 -0.36 0.00 0.00 0.00 175.10 175.33 2jvu s PHE 50 N 0.40 3.07 -0.27 5.22 0.40 -0.92 -3.77 117.98 122.11 2jvu s PHE 50 Ca -0.18 -0.49 -0.12 0.00 -0.60 0.00 0.00 56.93 55.54 2jvu s PHE 50 Cb -0.18 -2.23 -0.05 0.00 0.51 0.00 0.00 43.02 41.08 2jvu s PHE 50 CO 0.08 -0.38 0.24 0.71 0.70 0.00 0.00 175.22 176.57 2jvu s TYR 51 N 1.60 3.24 -0.16 0.36 1.51 -1.19 -3.22 117.35 119.49 2jvu s TYR 51 Ca 0.06 0.23 -0.06 0.00 -1.01 0.00 0.00 57.07 56.29 2jvu s TYR 51 Cb -0.15 -2.42 -0.04 0.00 -0.11 0.00 0.00 41.96 39.24 2jvu s TYR 51 CO 0.03 -0.14 0.03 0.71 -1.11 0.00 0.00 175.55 175.06 2jvu s TYR 52 N 1.74 3.18 0.22 2.71 2.02 -0.93 -1.70 117.35 124.59 2jvu s TYR 52 Ca 0.10 -0.01 0.08 0.00 -0.37 0.00 0.00 57.07 56.87 2jvu s TYR 52 Cb -0.16 -2.01 0.45 0.00 -0.40 0.00 0.00 41.96 39.85 2jvu s TYR 52 CO 0.10 0.15 1.10 -0.97 -1.57 0.00 0.00 175.55 174.36 2jvu h ASN 53 N 6.47 0.00 0.04 2.29 -1.24 -1.83 0.82 115.58 122.14 2jvu h ASN 53 Ca -0.37 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.64 2jvu h ASN 53 Cb 1.18 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.23 2jvu h ASN 53 CO 0.66 0.00 0.00 -0.67 -1.29 0.00 0.00 177.43 176.13 2jvu n ASP 54 N -2.01 0.00 -0.15 1.15 -0.08 -1.26 -4.80 116.55 109.39 2jvu n ASP 54 Ca -0.01 -0.41 -0.02 0.00 -1.51 0.00 0.00 54.79 52.85 2jvu n ASP 54 Cb 0.53 -0.04 -0.01 0.00 2.34 0.00 0.00 41.12 43.95 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 -0.03 0.44 3.43 0.27 0.00 0.29 -5.04 105.19 104.54 2jvu n GLY 55 Ca 0.11 -0.95 -0.29 0.00 0.00 0.00 0.00 46.02 44.89 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 -2.07 2.46 -0.04 2.61 -4.23 -1.19 -4.99 115.64 108.18 2jvu s THR 56 Ca 0.00 -1.69 0.01 0.00 -1.18 0.00 0.00 61.69 58.82 2jvu s THR 56 Cb 0.00 -2.11 0.02 0.00 1.34 0.00 0.00 72.50 71.75 2jvu s THR 56 CO 0.00 0.08 -0.03 0.42 -0.54 0.00 0.00 174.62 174.55 2jvu s THR 57 N -1.13 0.44 0.06 3.99 -4.23 -1.26 -2.20 115.64 111.31 2jvu s THR 57 Ca 0.16 -0.05 0.09 0.00 -1.18 0.00 0.00 61.69 60.70 2jvu s THR 57 Cb -0.10 -0.49 -0.03 0.00 1.34 0.00 0.00 72.50 73.22 2jvu s THR 57 CO 0.08 0.21 -0.24 -0.55 -0.54 0.00 0.00 174.62 173.58 2jvu s SER 58 N 1.01 3.41 -0.04 3.99 0.15 -1.20 -4.97 113.70 116.06 2jvu s SER 58 Ca -0.10 -0.57 0.00 0.00 0.70 0.00 0.00 55.95 55.99 2jvu s SER 58 Cb -0.14 -0.38 0.02 0.00 -1.71 0.00 0.00 66.02 63.81 2jvu s SER 58 CO -0.01 0.24 -0.02 0.21 1.20 0.00 0.00 173.24 174.86 2jvu s ASN 59 N -1.49 0.87 -0.18 5.45 3.84 -1.26 -2.16 114.94 120.01 2jvu s ASN 59 Ca 0.13 -0.08 -0.00 0.00 0.21 0.00 0.00 52.86 53.12 2jvu s ASN 59 Cb -0.10 -0.36 0.01 0.00 -0.55 0.00 0.00 41.25 40.24 2jvu s ASN 59 CO 0.04 -0.09 -0.15 -0.36 -2.79 0.00 0.00 177.10 173.74 2jvu s PHE 60 N 1.13 2.81 -0.01 0.43 0.08 -1.12 -4.99 117.98 116.31 2jvu s PHE 60 Ca -0.08 -1.28 0.01 0.00 0.12 0.00 0.00 56.93 55.70 2jvu s PHE 60 Cb -0.14 -1.94 -0.04 0.00 -0.57 0.00 0.00 43.02 40.34 2jvu s PHE 60 CO -0.01 -0.63 0.01 0.21 -0.10 0.00 0.00 175.22 174.69 2jvu s LYS 61 N 1.14 2.82 0.24 0.44 2.20 -1.26 -3.06 119.74 122.25 2jvu s LYS 61 Ca 0.01 -0.59 -0.22 0.00 -0.36 0.00 0.00 55.97 54.81 2jvu s LYS 61 Cb -0.14 -2.69 0.04 0.00 -1.51 0.00 0.00 37.83 33.53 2jvu s LYS 61 CO -0.06 0.63 0.82 0.20 -0.36 0.00 0.00 175.35 176.59 2jvu s GLY 62 N -1.53 -0.10 -0.17 5.54 0.00 -1.09 -5.04 107.32 104.93 2jvu s GLY 62 Ca 0.19 -0.19 -0.01 0.00 0.00 0.00 0.00 44.72 44.71 2jvu s GLY 62 CO 0.10 0.02 -0.11 0.14 0.00 0.00 0.00 173.10 173.25 2jvu s VAL 63 N -3.51 3.05 -0.30 1.40 1.01 -1.26 -2.33 120.40 118.47 2jvu s VAL 63 Ca 0.12 -0.63 -0.20 0.00 0.00 0.00 0.00 61.98 61.27 2jvu s VAL 63 Cb -0.04 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 2jvu s VAL 63 CO 0.06 0.49 0.63 -0.69 0.00 0.00 0.00 175.10 175.58 2jvu s VAL 64 N 0.85 4.95 0.04 2.92 1.01 -0.90 -4.84 120.40 124.43 2jvu s VAL 64 Ca -0.03 0.90 0.07 0.00 0.00 0.00 0.00 61.98 62.92 2jvu s VAL 64 Cb -0.15 -3.98 -0.02 0.00 0.00 0.00 0.00 36.38 32.22 2jvu s VAL 64 CO 0.00 -0.11 -0.19 0.42 0.00 0.00 0.00 175.10 175.23 2jvu s THR 65 N 2.58 1.54 0.60 3.92 -4.23 -0.73 -3.35 115.64 115.96 2jvu s THR 65 Ca 0.25 -1.11 0.06 0.00 -1.18 0.00 0.00 61.69 59.71 2jvu s THR 65 Cb -0.15 -1.34 0.09 0.00 1.34 0.00 0.00 72.50 72.44 2jvu s THR 65 CO 0.11 0.20 0.99 -2.65 -0.54 0.00 0.00 174.62 172.73 2jvu n PRO 66 N 1.96 0.02 -0.00 3.99 -0.02 -1.26 0.14 135.00 139.83 2jvu n PRO 66 Ca -0.17 0.89 0.06 0.00 -2.02 0.00 0.00 63.50 62.26 2jvu n PRO 66 Cb 0.54 -2.36 -0.07 0.00 -0.02 0.00 0.00 33.50 31.59 2jvu n PRO 66 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2jvu n SER 67 N -2.52 0.79 -3.81 2.55 7.64 -1.26 -4.91 113.62 112.09 2jvu n SER 67 Ca 0.05 -0.68 -0.29 0.00 1.01 0.00 0.00 58.87 58.97 2jvu n SER 67 Cb 1.04 1.08 -0.16 0.00 -1.01 0.00 0.00 64.21 65.16 2jvu n SER 67 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2jvu s THR 68 N -2.24 0.97 0.49 0.44 -4.23 0.38 -5.14 115.64 106.32 2jvu s THR 68 Ca 0.03 -0.99 -0.01 0.00 -1.18 0.00 0.00 61.69 59.54 2jvu s THR 68 Cb 0.09 -1.45 -0.00 0.00 1.34 0.00 0.00 72.50 72.48 2jvu s THR 68 CO 0.50 -0.27 0.73 -2.16 -0.54 0.00 0.00 174.62 172.88 2jvu s PRO 69 N 1.63 3.04 -0.08 3.99 0.04 -1.26 -1.78 135.00 140.58 2jvu s PRO 69 Ca -0.00 -0.34 0.03 0.00 0.04 0.00 0.00 61.00 60.73 2jvu s PRO 69 Cb -0.18 -2.48 0.01 0.00 0.04 0.00 0.00 34.50 31.89 2jvu s PRO 69 CO -0.11 -0.38 -0.18 0.08 0.04 0.00 0.00 177.00 176.45 2jvu s VAL 70 N -2.67 1.59 -0.13 -0.36 1.01 -1.24 -4.99 120.40 113.61 2jvu s VAL 70 Ca 0.50 -0.75 -0.07 0.00 0.00 0.00 0.00 61.98 61.66 2jvu s VAL 70 Cb -0.10 -1.40 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 2jvu s VAL 70 CO 0.40 0.46 0.12 0.20 0.00 0.00 0.00 175.10 176.28 2jvu s ASN 71 N 0.49 6.23 0.00 3.32 -0.87 -1.26 -2.05 114.94 120.80 2jvu s ASN 71 Ca -0.16 0.39 0.22 0.00 -1.57 0.00 0.00 52.86 51.74 2jvu s ASN 71 Cb -0.17 -2.01 -0.28 0.00 -0.02 0.00 0.00 41.25 38.77 2jvu s ASN 71 CO 0.06 0.37 0.59 0.35 -2.57 0.00 0.00 177.10 175.90 2jvu n THR 72 N 2.27 0.09 -1.04 1.60 -2.24 -1.03 -4.28 114.28 109.65 2jvu n THR 72 Ca -0.19 -0.48 -0.17 0.00 -2.27 0.00 0.00 64.05 60.94 2jvu n THR 72 Cb 0.54 0.01 -0.02 0.00 -2.10 0.00 0.00 70.33 68.76 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 -2.27 6.17 0.00 3.42 6.94 -1.26 -4.53 115.26 123.73 2jvu n ASN 73 Ca -0.03 -2.95 -0.11 0.00 -0.02 0.00 0.00 54.58 51.47 2jvu n ASN 73 Cb 0.55 -1.17 -0.05 0.00 -2.36 0.00 0.00 39.78 36.75 2jvu n ASN 73 CO 0.00 0.00 0.00 1.56 -1.03 0.00 0.00 177.26 177.79 2jvu h GLN 74 N 2.09 0.11 -2.85 -3.83 4.20 -1.95 -3.24 115.11 109.64 2jvu h GLN 74 Ca 0.27 -0.01 -0.66 0.00 0.06 0.00 0.00 58.65 58.32 2jvu h GLN 74 Cb 0.94 -0.02 -0.39 0.00 0.30 0.00 0.00 27.48 28.31 2jvu h GLN 74 CO 0.63 0.07 -0.29 -3.47 -0.67 0.00 0.00 178.83 175.10 2jvu n ASP 75 N -5.04 3.98 0.14 1.46 -0.08 -1.26 -4.87 116.55 110.88 2jvu n ASP 75 Ca -0.05 -3.29 0.00 0.00 -1.51 0.00 0.00 54.79 49.94 2jvu n ASP 75 Cb 0.04 -0.87 0.19 0.00 2.34 0.00 0.00 41.12 42.81 2jvu n ASP 75 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 2jvu h ILE 76 N 3.79 1.28 -0.03 5.18 2.10 -1.91 -3.23 117.51 124.68 2jvu h ILE 76 Ca 0.18 -2.07 0.00 0.00 1.08 0.00 0.00 64.86 64.05 2jvu h ILE 76 Cb 0.72 2.16 -0.00 0.00 -1.09 0.00 0.00 36.82 38.61 2jvu h ILE 76 CO 0.86 0.56 0.02 -1.13 -1.08 0.00 0.00 178.15 177.39 2jvu h ASN 77 N 0.00 0.04 -0.94 2.19 -0.73 -1.91 0.13 115.58 114.36 2jvu h ASN 77 Ca -0.01 -0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.15 2jvu h ASN 77 Cb 1.11 -0.01 -0.04 0.00 0.27 0.00 0.00 38.32 39.65 2jvu h ASN 77 CO 0.07 0.03 0.55 0.07 -0.37 0.00 0.00 177.43 177.79 2jvu h LYS 78 N 0.04 1.28 -0.61 6.67 2.10 -1.99 -2.19 116.57 121.88 2jvu h LYS 78 Ca 0.01 -0.13 0.01 0.00 -2.00 0.00 0.00 60.65 58.54 2jvu h LYS 78 Cb -0.00 -0.26 -0.03 0.00 -0.90 0.00 0.00 32.23 31.03 2jvu h LYS 78 CO -0.00 0.91 0.40 1.15 -2.00 0.00 0.00 179.45 179.90 2jvu h THR 79 N 1.30 1.16 -0.77 0.07 2.02 -1.42 -0.93 112.91 114.33 2jvu h THR 79 Ca 0.33 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 67.21 2jvu h THR 79 Cb -0.03 0.26 -0.04 0.00 -1.74 0.00 0.00 68.15 66.60 2jvu h THR 79 CO -0.06 0.15 0.41 0.78 0.37 0.00 0.00 175.52 177.17 2jvu h ASN 80 N 0.82 0.96 -0.19 4.18 2.35 -0.18 2.94 115.58 126.47 2jvu h ASN 80 Ca 0.22 -0.09 -0.09 0.00 -0.55 0.00 0.00 56.30 55.80 2jvu h ASN 80 Cb -0.09 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.03 2jvu h ASN 80 CO -0.05 0.79 -0.21 0.50 -1.65 0.00 0.00 177.43 176.81 2jvu h LYS 81 N 1.08 0.48 0.00 0.81 3.64 -0.84 -3.38 116.57 118.35 2jvu h LYS 81 Ca 0.27 -0.26 -0.13 0.00 -1.27 0.00 0.00 60.65 59.26 2jvu h LYS 81 Cb 0.05 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 2jvu h LYS 81 CO -0.04 0.84 -1.53 1.55 -2.27 0.00 0.00 179.45 178.00 2jvu n VAL 82 N -4.44 0.48 0.00 2.00 3.14 -0.41 -5.12 118.33 113.98 2jvu n VAL 82 Ca -0.05 -0.32 0.00 0.00 -2.96 0.00 0.00 64.34 61.00 2jvu n VAL 82 Cb 0.41 -0.65 0.00 0.00 -1.06 0.00 0.00 33.84 32.54 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 2.44 -1.44 3.43 7.55 0.00 0.98 -4.67 105.19 113.48 2jvu n GLY 83 Ca -0.12 -1.56 -0.35 0.00 0.00 0.00 0.00 46.02 43.99 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 -2.86 3.79 -0.11 1.61 1.01 -1.26 -4.01 120.40 118.57 2jvu s VAL 84 Ca 0.00 -0.37 -0.04 0.00 0.00 0.00 0.00 61.98 61.57 2jvu s VAL 84 Cb 0.00 -2.70 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 2jvu s VAL 84 CO 0.00 0.44 0.10 1.56 0.00 0.00 0.00 175.10 177.21 2jvu h GLN 85 N 7.45 0.00 -6.08 2.72 1.08 -1.69 -3.47 115.11 115.13 2jvu h GLN 85 Ca -0.36 0.00 -0.68 0.00 -1.45 0.00 0.00 58.65 56.16 2jvu h GLN 85 Cb 1.18 0.00 -0.24 0.00 -0.05 0.00 0.00 27.48 28.37 2jvu h GLN 85 CO 0.61 0.14 -0.77 0.21 -0.95 0.00 0.00 178.83 178.07 2jvu s LYS 86 N -1.65 2.71 -0.11 1.46 2.20 -1.26 -5.03 119.74 118.06 2jvu s LYS 86 Ca -0.03 -0.69 0.02 0.00 -0.36 0.00 0.00 55.97 54.91 2jvu s LYS 86 Cb -0.00 -2.44 0.01 0.00 -1.51 0.00 0.00 37.83 33.89 2jvu s LYS 86 CO 0.10 0.53 -0.17 -0.47 -0.36 0.00 0.00 175.35 174.97 2jvu s TYR 87 N -0.47 2.16 -0.05 4.03 6.14 -1.26 -3.18 117.35 124.71 2jvu s TYR 87 Ca 0.06 -1.02 0.02 0.00 0.64 0.00 0.00 57.07 56.78 2jvu s TYR 87 Cb -0.12 -1.52 0.01 0.00 0.42 0.00 0.00 41.96 40.75 2jvu s TYR 87 CO 0.02 -0.50 -0.10 1.03 0.64 0.00 0.00 175.55 176.65 2jvu s ARG 88 N 0.88 1.27 -0.03 4.97 1.81 -1.25 -5.04 118.95 121.56 2jvu s ARG 88 Ca -0.08 -0.32 0.07 0.00 -1.72 0.00 0.00 55.73 53.68 2jvu s ARG 88 Cb -0.15 -1.12 -0.01 0.00 -0.45 0.00 0.00 34.95 33.21 2jvu s ARG 88 CO -0.01 0.04 -0.24 0.00 -0.68 0.00 0.00 175.30 174.42 2jvu s ALA 89 N 0.54 2.03 -0.09 2.13 0.00 -1.26 -2.95 121.76 122.16 2jvu s ALA 89 Ca -0.10 -1.02 0.04 0.00 0.00 0.00 0.00 51.96 50.89 2jvu s ALA 89 Cb -0.13 -0.56 -0.00 0.00 0.00 0.00 0.00 23.12 22.42 2jvu s ALA 89 CO 0.02 0.45 -0.24 -1.17 0.00 0.00 0.00 175.76 174.82 2jvu s LEU 90 N -0.39 2.09 -0.10 0.00 0.20 -0.95 -4.97 118.68 114.56 2jvu s LEU 90 Ca 0.04 -0.55 0.02 0.00 0.69 0.00 0.00 54.13 54.33 2jvu s LEU 90 Cb -0.11 -1.40 0.01 0.00 -0.43 0.00 0.00 46.19 44.26 2jvu s LEU 90 CO 0.01 0.18 -0.14 0.42 -0.29 0.00 0.00 176.35 176.53 2jvu s THR 91 N 0.23 1.36 0.09 3.68 -4.23 -1.26 -2.39 115.64 113.11 2jvu s THR 91 Ca -0.16 -0.57 0.03 0.00 -1.18 0.00 0.00 61.69 59.82 2jvu s THR 91 Cb -0.17 -1.25 -0.03 0.00 1.34 0.00 0.00 72.50 72.39 2jvu s THR 91 CO 0.08 0.41 -0.10 -0.70 -0.54 0.00 0.00 174.62 173.77 2jvu s GLU 92 N 0.95 0.80 0.32 3.99 2.12 -1.15 -4.67 118.70 121.05 2jvu s GLU 92 Ca -0.08 -1.10 -0.29 0.00 0.36 0.00 0.00 54.97 53.86 2jvu s GLU 92 Cb -0.15 -0.49 -0.10 0.00 0.26 0.00 0.00 34.13 33.65 2jvu s GLU 92 CO -0.00 0.08 1.30 -1.58 -0.54 0.00 0.00 175.26 174.51 2jvu s TRP 93 N -2.30 3.10 -0.21 5.30 0.52 -1.26 -2.31 118.94 121.78 2jvu s TRP 93 Ca 0.03 1.41 -0.04 0.00 0.02 0.00 0.00 56.10 57.52 2jvu s TRP 93 Cb -0.04 -3.65 -0.01 0.00 -1.15 0.00 0.00 33.47 28.62 2jvu s TRP 93 CO -0.00 -1.80 -0.05 0.08 0.02 0.00 0.00 176.95 175.20 2jvu s VAL 94 N -1.01 3.39 0.00 4.03 1.01 -0.90 -4.66 120.40 122.26 2jvu s VAL 94 Ca 0.50 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.98 2jvu s VAL 94 Cb -0.39 -2.53 0.00 0.00 0.00 0.00 0.00 36.38 33.46 2jvu s VAL 94 CO 0.51 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.65 2jvu n GLY 95 N 4.63 0.40 3.70 4.51 0.00 -1.26 0.28 105.19 117.45 2jvu n GLY 95 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 2jvu n GLY 95 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2jvu s SER 96 N -0.40 7.23 0.37 1.61 0.15 -1.26 -4.60 113.70 116.80 2jvu s SER 96 Ca 0.00 1.49 -0.25 0.00 0.70 0.00 0.00 55.95 57.89 2jvu s SER 96 Cb 0.00 -2.52 -0.09 0.00 -1.71 0.00 0.00 66.02 61.69 2jvu s SER 96 CO 0.00 -0.29 1.02 -0.13 1.20 0.00 0.00 173.24 175.04 2jvu s ARG 97 N 1.31 4.33 0.00 5.44 0.52 -1.26 -5.20 118.95 124.10 2jvu s ARG 97 Ca 0.47 1.47 0.00 0.00 -0.52 0.00 0.00 55.73 57.15 2jvu s ARG 97 Cb -0.19 -2.66 0.00 0.00 0.52 0.00 0.00 34.95 32.62 2jvu s ARG 97 CO 0.22 0.02 0.00 0.45 0.02 0.00 0.00 175.30 176.01