#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 1.56 0.28 -0.02 0.00 -1.26 -5.05 107.32 102.84 2jvu s GLY 2 Ca 0.00 -0.59 -0.28 0.00 0.00 0.00 0.00 44.72 43.84 2jvu s GLY 2 CO 0.00 -0.36 0.98 -0.45 0.00 0.00 0.00 173.10 173.26 2jvu s SER 3 N -4.21 7.44 -0.43 1.64 0.15 -1.26 -5.00 113.70 112.04 2jvu s SER 3 Ca 0.51 1.98 0.09 0.00 0.70 0.00 0.00 55.95 59.23 2jvu s SER 3 Cb -0.10 -2.60 0.31 0.00 -1.71 0.00 0.00 66.02 61.91 2jvu s SER 3 CO 0.45 0.00 0.69 0.61 1.20 0.00 0.00 173.24 176.20 2jvu n GLY 4 N 1.12 3.73 3.70 9.45 0.00 -1.26 -5.09 105.19 116.84 2jvu n GLY 4 Ca -0.00 -1.89 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 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 -2.16 3.36 -0.03 1.61 -0.00 -1.26 -4.88 118.94 115.57 2jvu s TRP 5 Ca 0.40 1.32 0.05 0.00 -0.00 0.00 0.00 56.10 57.86 2jvu s TRP 5 Cb 0.26 -3.38 0.07 0.00 -0.00 0.00 0.00 33.47 30.42 2jvu s TRP 5 CO -0.09 -1.12 0.98 0.27 -0.00 0.00 0.00 176.95 176.98 2jvu n ASN 6 N 4.48 0.68 -0.60 5.86 6.94 -1.26 -4.96 115.26 126.40 2jvu n ASN 6 Ca 0.09 -2.15 -0.07 0.00 -0.02 0.00 0.00 54.58 52.43 2jvu n ASN 6 Cb 0.47 -0.22 -0.03 0.00 -2.36 0.00 0.00 39.78 37.64 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 -0.38 -0.11 -0.01 -2.53 0.00 -1.26 -4.75 120.51 111.47 2jvu n ALA 7 Ca 0.04 0.12 -0.04 0.00 0.00 0.00 0.00 53.44 53.56 2jvu n ALA 7 Cb 0.64 -1.55 -0.12 0.00 0.00 0.00 0.00 19.45 18.42 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 -0.80 0.69 -0.86 0.00 -0.08 -1.26 -3.99 116.55 110.25 2jvu n ASP 8 Ca -0.07 0.32 0.11 0.00 -1.51 0.00 0.00 54.79 53.64 2jvu n ASP 8 Cb 0.51 0.30 0.28 0.00 2.34 0.00 0.00 41.12 44.56 2jvu n ASP 8 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 2jvu n ASN 9 N -2.89 2.58 -4.51 1.67 5.03 -1.26 -4.87 115.26 111.01 2jvu n ASN 9 Ca -0.15 -1.86 -0.34 0.00 0.87 0.00 0.00 54.58 53.11 2jvu n ASN 9 Cb 0.94 -0.15 -0.12 0.00 -1.02 0.00 0.00 39.78 39.43 2jvu n ASN 9 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2jvu s VAL 10 N -1.69 3.65 -0.08 2.41 1.01 -1.26 -5.10 120.40 119.34 2jvu s VAL 10 Ca 0.35 -0.47 -0.19 0.00 0.00 0.00 0.00 61.98 61.67 2jvu s VAL 10 Cb 0.20 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.99 2jvu s VAL 10 CO 0.29 0.54 0.52 -1.81 0.00 0.00 0.00 175.10 174.64 2jvu s ASP 11 N -0.12 6.78 0.21 3.32 1.11 -1.26 -4.95 116.67 121.76 2jvu s ASP 11 Ca 0.01 0.93 0.24 0.00 0.18 0.00 0.00 52.55 53.92 2jvu s ASP 11 Cb -0.13 -2.31 0.91 0.00 1.07 0.00 0.00 42.92 42.45 2jvu s ASP 11 CO 0.03 0.03 1.74 -0.81 1.18 0.00 0.00 175.17 177.33 2jvu n PRO 12 N 3.38 0.20 -0.03 8.23 -0.04 -1.26 -3.17 135.00 142.30 2jvu n PRO 12 Ca -0.07 0.31 -0.05 0.00 -0.04 0.00 0.00 63.50 63.65 2jvu n PRO 12 Cb 0.52 -1.80 0.16 0.00 -0.04 0.00 0.00 33.50 32.33 2jvu n PRO 12 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2jvu h SER 13 N 0.00 0.61 0.58 3.54 4.64 -1.90 -2.83 113.55 118.19 2jvu h SER 13 Ca 0.00 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 2jvu h SER 13 Cb 0.51 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2jvu h SER 13 CO 0.00 0.83 -0.58 0.00 -0.87 0.00 0.00 176.83 176.20 2jvu n GLN 14 N -4.13 0.10 0.17 4.77 6.02 -1.19 -3.79 117.38 119.33 2jvu n GLN 14 Ca 0.00 0.02 0.02 0.00 -0.01 0.00 0.00 57.00 57.03 2jvu n GLN 14 Cb 0.40 -1.55 0.30 0.00 1.02 0.00 0.00 30.24 30.41 2jvu n GLN 14 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2jvu s ILE 16 N -3.92 2.10 0.14 0.00 -5.25 -1.23 -1.62 121.20 111.42 2jvu s ILE 16 Ca -0.02 -1.44 0.07 0.00 -0.99 0.00 0.00 60.65 58.28 2jvu s ILE 16 Cb 0.13 -1.81 -0.04 0.00 2.95 0.00 0.00 42.46 43.69 2jvu s ILE 16 CO 0.73 0.29 -0.17 -0.54 -1.79 0.00 0.00 174.94 173.47 2jvu s LYS 17 N -1.38 1.13 -0.27 0.37 1.02 -1.15 -4.88 119.74 114.58 2jvu s LYS 17 Ca 0.12 -1.29 -0.15 0.00 0.02 0.00 0.00 55.97 54.67 2jvu s LYS 17 Cb -0.10 -1.14 -0.04 0.00 -0.52 0.00 0.00 37.83 36.03 2jvu s LYS 17 CO 0.03 0.23 0.36 -0.65 -0.92 0.00 0.00 175.35 174.40 2jvu s GLN 18 N -2.60 4.01 -0.28 1.68 -0.21 -1.26 -3.00 119.66 118.01 2jvu s GLN 18 Ca 0.11 0.01 -0.05 0.00 0.02 0.00 0.00 55.36 55.45 2jvu s GLN 18 Cb -0.06 -3.66 0.01 0.00 1.00 0.00 0.00 33.01 30.31 2jvu s GLN 18 CO 0.05 -0.27 0.04 0.45 -2.12 0.00 0.00 175.29 173.43 2jvu s SER 19 N 1.65 4.88 1.59 5.90 0.15 -0.26 -4.96 113.70 122.64 2jvu s SER 19 Ca 0.14 -0.74 0.00 0.00 0.70 0.00 0.00 55.95 56.05 2jvu s SER 19 Cb -0.16 -1.82 0.00 0.00 -1.71 0.00 0.00 66.02 62.34 2jvu s SER 19 CO 0.10 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.98 2jvu n GLY 20 N 4.81 1.69 0.35 9.45 0.00 -1.26 -0.54 105.19 119.69 2jvu n GLY 20 Ca -0.15 0.42 0.09 0.00 0.00 0.00 0.00 46.02 46.38 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 0.00 2.03 -4.34 1.61 0.24 -1.26 -5.03 118.33 111.58 2jvu n VAL 21 Ca 0.00 -2.22 -0.18 0.00 -2.04 0.00 0.00 64.34 59.90 2jvu n VAL 21 Cb 0.00 -0.25 -0.10 0.00 -1.47 0.00 0.00 33.84 32.02 2jvu n VAL 21 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2jvu s GLN 22 N -2.89 1.31 -0.11 7.34 0.74 0.30 -3.18 119.66 123.17 2jvu s GLN 22 Ca 0.35 -1.59 -0.01 0.00 0.05 0.00 0.00 55.36 54.17 2jvu s GLN 22 Cb 0.30 -1.05 -0.02 0.00 1.10 0.00 0.00 33.01 33.34 2jvu s GLN 22 CO 0.04 0.15 -0.08 0.71 -0.55 0.00 0.00 175.29 175.56 2jvu s TYR 23 N -3.03 2.91 0.03 1.67 1.51 -0.84 -1.10 117.35 118.49 2jvu s TYR 23 Ca 0.22 -0.27 0.04 0.00 -1.01 0.00 0.00 57.07 56.05 2jvu s TYR 23 Cb 0.00 -1.82 -0.02 0.00 -0.11 0.00 0.00 41.96 40.02 2jvu s TYR 23 CO 0.06 0.06 -0.11 0.95 -1.11 0.00 0.00 175.55 175.41 2jvu s THR 24 N -0.13 0.82 -0.09 -0.71 -4.23 -1.16 -3.58 115.64 106.57 2jvu s THR 24 Ca 0.01 -0.85 -0.27 0.00 -1.18 0.00 0.00 61.69 59.40 2jvu s THR 24 Cb -0.13 -0.77 -0.02 0.00 1.34 0.00 0.00 72.50 72.91 2jvu s THR 24 CO 0.03 -0.06 0.87 -0.47 -0.54 0.00 0.00 174.62 174.45 2jvu s TYR 25 N -0.82 3.54 -1.24 3.99 6.14 -1.26 -2.96 117.35 124.74 2jvu s TYR 25 Ca -0.01 1.44 -0.16 0.00 0.64 0.00 0.00 57.07 58.98 2jvu s TYR 25 Cb -0.07 -3.03 0.12 0.00 0.42 0.00 0.00 41.96 39.40 2jvu s TYR 25 CO 0.01 -0.09 1.58 1.21 0.64 0.00 0.00 175.55 178.89 2jvu s ASN 26 N 1.02 6.93 0.00 4.32 3.84 -0.64 -4.70 114.94 125.71 2jvu s ASN 26 Ca 0.44 -2.67 0.28 0.00 0.21 0.00 0.00 52.86 51.12 2jvu s ASN 26 Cb -0.18 -2.50 1.07 0.00 -0.55 0.00 0.00 41.25 39.09 2jvu s ASN 26 CO 0.19 -0.98 1.79 -1.54 -2.79 0.00 0.00 177.10 173.77 2jvu n SER 27 N 7.13 0.25 0.00 -4.21 3.41 -1.26 -3.84 113.62 115.09 2jvu n SER 27 Ca 0.43 -0.01 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 2jvu n SER 27 Cb 0.45 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 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 1.43 -0.10 3.53 5.00 0.00 -1.26 -4.34 105.19 109.46 2jvu n GLY 28 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.01 4.02 0.44 1.61 -7.23 -1.25 -5.00 120.40 110.99 2jvu s VAL 29 Ca 0.00 -0.32 0.14 0.00 -1.81 0.00 0.00 61.98 59.99 2jvu s VAL 29 Cb 0.00 -2.76 0.18 0.00 0.56 0.00 0.00 36.38 34.36 2jvu s VAL 29 CO 0.00 0.51 1.98 0.77 -0.31 0.00 0.00 175.10 178.05 2jvu h SER 30 N 6.48 0.03 -1.00 4.85 4.64 -1.95 -2.82 113.55 123.78 2jvu h SER 30 Ca -0.34 -0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.98 2jvu h SER 30 Cb 1.19 -0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 63.22 2jvu h SER 30 CO 0.63 0.20 0.66 1.62 -0.87 0.00 0.00 176.83 179.07 2jvu h VAL 31 N 0.03 1.25 -0.99 0.95 3.04 -1.94 -1.11 116.25 117.47 2jvu h VAL 31 Ca 0.00 -0.46 0.01 0.00 -1.01 0.00 0.00 66.70 65.24 2jvu h VAL 31 Cb 0.32 -0.22 -0.05 0.00 -2.01 0.00 0.00 31.29 29.34 2jvu h VAL 31 CO 0.02 0.25 0.66 0.00 -1.01 0.00 0.00 177.57 177.49 2jvu n MET 33 N -4.39 0.24 -0.34 0.00 2.81 -0.90 -3.02 117.12 111.52 2jvu n MET 33 Ca 0.12 0.20 -0.03 0.00 -1.81 0.00 0.00 57.70 56.17 2jvu n MET 33 Cb 0.01 -1.78 0.09 0.00 -0.71 0.00 0.00 33.22 30.84 2jvu n MET 33 CO 0.00 0.00 0.00 0.37 1.51 0.00 0.00 175.97 177.85 2jvu h GLN 34 N 0.00 1.23 0.00 0.03 4.15 0.12 0.25 115.11 120.89 2jvu h GLN 34 Ca 0.00 -0.11 -0.06 0.00 0.77 0.00 0.00 58.65 59.25 2jvu h GLN 34 Cb 0.71 -0.26 -0.01 0.00 0.21 0.00 0.00 27.48 28.13 2jvu h GLN 34 CO 0.00 0.85 -0.35 0.78 -1.93 0.00 0.00 178.83 178.18 2jvu h GLY 35 N 1.25 0.00 0.84 2.39 0.00 -1.56 -3.15 103.07 102.83 2jvu h GLY 35 Ca 0.33 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.70 2jvu h GLY 35 CO -0.06 0.00 0.65 1.41 0.00 0.00 0.00 176.54 178.54 2jvu h LEU 36 N -1.00 1.08 -1.01 3.11 3.38 -1.53 -1.02 115.31 118.32 2jvu h LEU 36 Ca -0.09 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.88 2jvu h LEU 36 Cb 0.98 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.44 2jvu h LEU 36 CO -0.06 0.72 0.67 -1.13 0.09 0.00 0.00 178.44 178.74 2jvu h ASN 37 N 1.24 1.15 0.57 -0.43 -1.24 -0.64 0.15 115.58 116.38 2jvu h ASN 37 Ca 0.41 -0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.39 2jvu h ASN 37 Cb 0.05 -0.29 0.00 0.00 0.73 0.00 0.00 38.32 38.81 2jvu h ASN 37 CO -0.14 0.83 0.00 -0.62 -1.29 0.00 0.00 177.43 176.21 2jvu n GLU 38 N -4.39 0.27 -2.41 6.67 -0.58 -0.46 -4.88 120.64 114.87 2jvu n GLU 38 Ca 0.12 0.05 -0.11 0.00 -0.42 0.00 0.00 57.16 56.81 2jvu n GLU 38 Cb 0.01 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.39 2jvu n GLU 38 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jvu n GLY 39 N 0.91 0.02 0.03 0.62 0.00 0.04 -4.88 105.19 101.93 2jvu n GLY 39 Ca 0.11 -0.40 0.09 0.00 0.00 0.00 0.00 46.02 45.81 2jvu n GLY 39 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2jvu n LYS 40 N -2.16 1.02 -4.18 1.61 4.81 -1.09 -4.95 118.16 113.22 2jvu n LYS 40 Ca -0.09 -0.06 -0.12 0.00 -0.87 0.00 0.00 58.31 57.17 2jvu n LYS 40 Cb 0.58 -1.36 -0.10 0.00 0.02 0.00 0.00 35.03 34.16 2jvu n LYS 40 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2jvu s VAL 41 N -2.68 0.85 -0.12 3.15 1.01 -1.25 -4.38 120.40 116.98 2jvu s VAL 41 Ca 0.07 -1.83 0.03 0.00 0.00 0.00 0.00 61.98 60.25 2jvu s VAL 41 Cb 0.14 -1.57 -0.03 0.00 0.00 0.00 0.00 36.38 34.92 2jvu s VAL 41 CO 0.73 -0.73 0.11 0.54 0.00 0.00 0.00 175.10 175.75 2jvu n ARG 42 N 0.17 5.42 -0.89 2.72 1.74 0.61 -4.61 116.66 121.83 2jvu n ARG 42 Ca -0.13 -0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 2jvu n ARG 42 Cb 0.60 -0.68 0.00 0.00 -1.02 0.00 0.00 32.46 31.36 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 1.20 0.49 3.20 -0.13 0.00 -1.22 -4.88 105.19 103.85 2jvu n GLY 43 Ca 0.00 -1.57 -0.32 0.00 0.00 0.00 0.00 46.02 44.14 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 -3.27 2.06 -0.01 1.61 1.01 -1.19 -1.91 120.40 118.70 2jvu s VAL 44 Ca 0.00 -1.01 -0.24 0.00 0.00 0.00 0.00 61.98 60.74 2jvu s VAL 44 Cb 0.00 -1.79 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 2jvu s VAL 44 CO 0.00 0.56 0.71 -0.44 0.00 0.00 0.00 175.10 175.93 2jvu s SER 45 N 0.49 7.08 -0.04 3.32 0.01 -0.95 -2.36 113.70 121.26 2jvu s SER 45 Ca -0.15 1.30 0.02 0.00 1.31 0.00 0.00 55.95 58.42 2jvu s SER 45 Cb -0.17 -2.43 0.01 0.00 0.21 0.00 0.00 66.02 63.64 2jvu s SER 45 CO 0.06 -0.02 -0.08 0.54 0.41 0.00 0.00 173.24 174.14 2jvu s VAL 46 N 0.27 0.74 -0.00 3.43 0.11 -0.99 -2.71 120.40 121.25 2jvu s VAL 46 Ca 0.37 -0.29 0.05 0.00 -2.93 0.00 0.00 61.98 59.18 2jvu s VAL 46 Cb -0.19 -0.70 -0.01 0.00 -1.53 0.00 0.00 36.38 33.95 2jvu s VAL 46 CO 0.20 0.25 -0.15 -0.44 -3.33 0.00 0.00 175.10 171.63 2jvu s SER 47 N 0.55 1.79 0.07 3.54 0.01 -1.14 -2.78 113.70 115.73 2jvu s SER 47 Ca -0.09 -0.31 0.05 0.00 1.31 0.00 0.00 55.95 56.91 2jvu s SER 47 Cb -0.12 -0.18 -0.03 0.00 0.21 0.00 0.00 66.02 65.90 2jvu s SER 47 CO 0.01 0.16 -0.14 -0.83 0.41 0.00 0.00 173.24 172.85 2jvu s GLY 48 N -0.51 0.84 -0.08 3.44 0.00 -1.02 -2.54 107.32 107.46 2jvu s GLY 48 Ca 0.05 -0.97 0.03 0.00 0.00 0.00 0.00 44.72 43.83 2jvu s GLY 48 CO -0.00 -1.00 -0.17 0.14 0.00 0.00 0.00 173.10 172.07 2jvu s VAL 49 N -1.24 1.53 -0.24 1.40 1.01 -1.10 -2.30 120.40 119.47 2jvu s VAL 49 Ca -0.02 -0.71 -0.07 0.00 0.00 0.00 0.00 61.98 61.18 2jvu s VAL 49 Cb -0.10 -1.35 -0.03 0.00 0.00 0.00 0.00 36.38 34.90 2jvu s VAL 49 CO 0.02 0.44 0.07 -0.36 0.00 0.00 0.00 175.10 175.28 2jvu s PHE 50 N 0.53 3.11 -0.25 5.22 0.08 -0.81 -3.65 117.98 122.21 2jvu s PHE 50 Ca -0.16 -0.30 -0.15 0.00 0.12 0.00 0.00 56.93 56.44 2jvu s PHE 50 Cb -0.17 -2.21 -0.04 0.00 -0.57 0.00 0.00 43.02 40.03 2jvu s PHE 50 CO 0.06 -0.26 0.36 0.71 -0.10 0.00 0.00 175.22 175.99 2jvu s TYR 51 N 1.39 3.28 -0.18 0.36 1.51 -1.18 -2.99 117.35 119.54 2jvu s TYR 51 Ca 0.05 0.44 -0.06 0.00 -1.01 0.00 0.00 57.07 56.50 2jvu s TYR 51 Cb -0.15 -2.54 -0.03 0.00 -0.11 0.00 0.00 41.96 39.13 2jvu s TYR 51 CO 0.04 -0.16 0.02 0.71 -1.11 0.00 0.00 175.55 175.05 2jvu s TYR 52 N 1.82 3.13 0.35 2.71 2.02 -0.81 -1.18 117.35 125.39 2jvu s TYR 52 Ca 0.15 -0.15 0.14 0.00 -0.37 0.00 0.00 57.07 56.84 2jvu s TYR 52 Cb -0.15 -2.05 0.77 0.00 -0.40 0.00 0.00 41.96 40.12 2jvu s TYR 52 CO 0.09 0.01 1.35 -0.97 -1.57 0.00 0.00 175.55 174.46 2jvu h ASN 53 N 6.90 0.00 0.00 2.29 -1.24 -1.84 0.54 115.58 122.23 2jvu h ASN 53 Ca -0.35 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.66 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 0.47 -1.29 0.00 0.00 177.43 177.27 2jvu n ASP 54 N -2.31 0.00 -0.18 1.15 8.00 -1.26 -4.77 116.55 117.18 2jvu n ASP 54 Ca -0.01 -0.53 -0.02 0.00 0.71 0.00 0.00 54.79 54.94 2jvu n ASP 54 Cb 0.50 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.59 2jvu n ASP 54 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2jvu n GLY 55 N -0.17 0.57 3.43 0.44 0.00 0.19 -5.04 105.19 104.61 2jvu n GLY 55 Ca 0.06 -0.95 -0.30 0.00 0.00 0.00 0.00 46.02 44.84 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 -2.09 2.57 -0.07 2.61 -4.23 -1.17 -5.00 115.64 108.26 2jvu s THR 56 Ca 0.00 -1.46 0.01 0.00 -1.18 0.00 0.00 61.69 59.07 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 0.21 -0.09 0.42 -0.54 0.00 0.00 174.62 174.62 2jvu s THR 57 N -1.00 0.93 0.19 3.99 -4.23 -1.26 -1.93 115.64 112.33 2jvu s THR 57 Ca 0.15 -0.33 0.11 0.00 -1.18 0.00 0.00 61.69 60.43 2jvu s THR 57 Cb -0.10 -0.90 -0.04 0.00 1.34 0.00 0.00 72.50 72.80 2jvu s THR 57 CO 0.06 0.32 -0.20 -0.55 -0.54 0.00 0.00 174.62 173.72 2jvu s SER 58 N 0.94 3.68 -0.03 3.99 0.15 -1.16 -4.99 113.70 116.28 2jvu s SER 58 Ca -0.10 -0.79 -0.01 0.00 0.70 0.00 0.00 55.95 55.75 2jvu s SER 58 Cb -0.15 -0.39 0.02 0.00 -1.71 0.00 0.00 66.02 63.80 2jvu s SER 58 CO 0.01 0.11 0.07 0.21 1.20 0.00 0.00 173.24 174.84 2jvu s ASN 59 N -2.75 -0.02 -0.16 5.45 3.84 -1.26 -1.93 114.94 118.10 2jvu s ASN 59 Ca 0.22 0.14 0.00 0.00 0.21 0.00 0.00 52.86 53.43 2jvu s ASN 59 Cb -0.08 0.06 0.00 0.00 -0.55 0.00 0.00 41.25 40.68 2jvu s ASN 59 CO 0.12 -0.10 -0.15 -0.36 -2.79 0.00 0.00 177.10 173.81 2jvu s PHE 60 N 0.78 2.79 0.01 0.43 0.08 -0.97 -5.00 117.98 116.10 2jvu s PHE 60 Ca -0.06 -1.10 0.05 0.00 0.12 0.00 0.00 56.93 55.94 2jvu s PHE 60 Cb -0.09 -1.91 -0.03 0.00 -0.57 0.00 0.00 43.02 40.43 2jvu s PHE 60 CO -0.03 -0.52 -0.14 0.21 -0.10 0.00 0.00 175.22 174.64 2jvu s LYS 61 N 0.92 2.31 0.12 0.44 2.20 -1.26 -2.42 119.74 122.05 2jvu s LYS 61 Ca -0.03 -0.84 -0.25 0.00 -0.36 0.00 0.00 55.97 54.49 2jvu s LYS 61 Cb -0.15 -2.32 0.08 0.00 -1.51 0.00 0.00 37.83 33.93 2jvu s LYS 61 CO -0.02 0.58 1.06 0.20 -0.36 0.00 0.00 175.35 176.81 2jvu s GLY 62 N -1.22 -0.18 -0.14 5.54 0.00 -1.12 -5.04 107.32 105.16 2jvu s GLY 62 Ca 0.14 0.12 -0.00 0.00 0.00 0.00 0.00 44.72 44.98 2jvu s GLY 62 CO 0.04 0.79 -0.14 0.14 0.00 0.00 0.00 173.10 173.93 2jvu s VAL 63 N -2.80 2.94 -0.25 1.40 1.01 -1.26 -2.34 120.40 119.10 2jvu s VAL 63 Ca 0.16 -0.69 -0.12 0.00 0.00 0.00 0.00 61.98 61.32 2jvu s VAL 63 Cb -0.00 -2.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.10 2jvu s VAL 63 CO 0.02 0.52 0.25 -0.69 0.00 0.00 0.00 175.10 175.20 2jvu s VAL 64 N 0.49 5.28 0.14 2.92 1.01 -0.99 -4.90 120.40 124.34 2jvu s VAL 64 Ca -0.10 0.36 0.10 0.00 0.00 0.00 0.00 61.98 62.34 2jvu s VAL 64 Cb -0.16 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 2jvu s VAL 64 CO 0.04 0.27 -0.24 0.42 0.00 0.00 0.00 175.10 175.59 2jvu s THR 65 N 1.45 2.11 0.35 3.92 -4.23 -0.92 -3.19 115.64 115.15 2jvu s THR 65 Ca 0.11 -1.76 0.28 0.00 -1.18 0.00 0.00 61.69 59.14 2jvu s THR 65 Cb -0.15 -1.90 0.43 0.00 1.34 0.00 0.00 72.50 72.22 2jvu s THR 65 CO 0.08 -0.01 1.14 -2.65 -0.54 0.00 0.00 174.62 172.64 2jvu n PRO 66 N 0.81 -0.02 0.00 3.99 -0.02 -1.26 0.19 135.00 138.69 2jvu n PRO 66 Ca -0.17 0.87 0.08 0.00 -2.02 0.00 0.00 63.50 62.26 2jvu n PRO 66 Cb 0.54 -1.81 0.06 0.00 -0.02 0.00 0.00 33.50 32.26 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 -3.89 2.23 -3.95 2.55 7.64 -1.26 -4.84 113.62 112.09 2jvu n SER 67 Ca 0.31 -1.62 -0.31 0.00 1.01 0.00 0.00 58.87 58.26 2jvu n SER 67 Cb 1.26 0.06 -0.15 0.00 -1.01 0.00 0.00 64.21 64.36 2jvu n SER 67 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2jvu s THR 68 N -1.38 1.70 0.40 0.44 2.01 0.50 -5.12 115.64 114.19 2jvu s THR 68 Ca 0.18 -1.53 -0.01 0.00 0.31 0.00 0.00 61.69 60.64 2jvu s THR 68 Cb 0.13 -2.03 -0.03 0.00 0.01 0.00 0.00 72.50 70.58 2jvu s THR 68 CO 0.22 -0.26 0.63 -2.16 -0.69 0.00 0.00 174.62 172.36 2jvu s PRO 69 N 1.28 3.38 -0.01 4.92 0.04 -1.26 -2.15 135.00 141.20 2jvu s PRO 69 Ca -0.01 -0.27 0.02 0.00 0.04 0.00 0.00 61.00 60.78 2jvu s PRO 69 Cb -0.19 -2.57 -0.01 0.00 0.04 0.00 0.00 34.50 31.77 2jvu s PRO 69 CO -0.09 -0.04 -0.07 0.08 0.04 0.00 0.00 177.00 176.93 2jvu s VAL 70 N -2.47 0.55 -0.05 -0.36 1.01 -1.23 -4.97 120.40 112.87 2jvu s VAL 70 Ca 0.44 -0.30 -0.13 0.00 0.00 0.00 0.00 61.98 62.00 2jvu s VAL 70 Cb -0.10 -0.46 -0.05 0.00 0.00 0.00 0.00 36.38 35.77 2jvu s VAL 70 CO 0.38 0.16 0.32 0.20 0.00 0.00 0.00 175.10 176.16 2jvu s ASN 71 N -0.15 6.65 -0.10 3.32 0.01 -1.26 -1.98 114.94 121.42 2jvu s ASN 71 Ca 0.03 0.78 0.05 0.00 -0.71 0.00 0.00 52.86 53.01 2jvu s ASN 71 Cb -0.03 -2.19 -0.10 0.00 0.41 0.00 0.00 41.25 39.34 2jvu s ASN 71 CO -0.00 0.32 -0.02 1.07 -1.51 0.00 0.00 177.10 176.96 2jvu n THR 72 N 2.09 0.65 -0.50 1.60 5.66 -1.19 -4.45 114.28 118.13 2jvu n THR 72 Ca -0.15 -0.34 -0.16 0.00 -3.05 0.00 0.00 64.05 60.35 2jvu n THR 72 Cb 0.53 -0.82 0.09 0.00 -1.55 0.00 0.00 70.33 68.59 2jvu n THR 72 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2jvu n ASN 73 N -2.53 4.23 0.24 1.09 5.15 -1.26 -4.55 115.26 117.63 2jvu n ASN 73 Ca -0.17 -3.04 0.18 0.00 -0.60 0.00 0.00 54.58 50.95 2jvu n ASN 73 Cb 0.77 -0.78 0.82 0.00 -0.53 0.00 0.00 39.78 40.06 2jvu n ASN 73 CO 0.00 0.00 0.00 0.06 1.40 0.00 0.00 177.26 178.72 2jvu h GLN 74 N 0.84 0.00 -2.79 1.20 3.07 -1.87 -3.13 115.11 112.43 2jvu h GLN 74 Ca 0.38 0.00 -0.73 0.00 0.09 0.00 0.00 58.65 58.39 2jvu h GLN 74 Cb 1.85 0.00 -0.33 0.00 0.08 0.00 0.00 27.48 29.07 2jvu h GLN 74 CO 0.74 0.00 0.24 -0.25 0.09 0.00 0.00 178.83 179.65 2jvu n ASP 75 N -3.28 5.30 -0.11 0.06 8.00 -1.26 -4.85 116.55 120.42 2jvu n ASP 75 Ca 0.01 -3.37 -0.14 0.00 0.71 0.00 0.00 54.79 52.01 2jvu n ASP 75 Cb 0.42 -1.07 -0.03 0.00 -0.02 0.00 0.00 41.12 40.43 2jvu n ASP 75 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2jvu h ILE 76 N 3.44 1.27 -0.31 0.53 1.08 -1.95 -1.99 117.51 119.58 2jvu h ILE 76 Ca 0.19 -1.58 0.00 0.00 -0.39 0.00 0.00 64.86 63.08 2jvu h ILE 76 Cb 0.67 1.45 -0.02 0.00 -3.07 0.00 0.00 36.82 35.85 2jvu h ILE 76 CO 1.11 0.52 0.20 0.78 -0.69 0.00 0.00 178.15 180.08 2jvu h ASN 77 N 0.71 0.36 0.00 1.72 2.35 -1.92 0.71 115.58 119.51 2jvu h ASN 77 Ca 0.05 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2jvu h ASN 77 Cb 1.00 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.28 2jvu h ASN 77 CO 0.10 0.27 -0.00 0.50 -1.65 0.00 0.00 177.43 176.64 2jvu h LYS 78 N 0.42 -0.00 -0.62 0.81 3.64 -1.96 -1.99 116.57 116.86 2jvu h LYS 78 Ca 0.11 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.47 2jvu h LYS 78 Cb -0.04 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 2jvu h LYS 78 CO -0.02 0.00 0.30 1.15 -2.27 0.00 0.00 179.45 178.61 2jvu h THR 79 N -0.01 1.22 -0.52 1.00 2.02 -0.92 -2.37 112.91 113.34 2jvu h THR 79 Ca -0.00 -0.61 -0.00 0.00 0.77 0.00 0.00 66.41 66.57 2jvu h THR 79 Cb 0.01 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 66.86 2jvu h THR 79 CO 0.00 0.25 0.32 0.78 0.37 0.00 0.00 175.52 177.23 2jvu h ASN 80 N 0.85 0.61 -0.08 4.18 -0.26 0.63 2.74 115.58 124.25 2jvu h ASN 80 Ca 0.21 -0.03 -0.02 0.00 -0.56 0.00 0.00 56.30 55.91 2jvu h ASN 80 Cb 0.12 -0.15 -0.00 0.00 -1.06 0.00 0.00 38.32 37.22 2jvu h ASN 80 CO -0.03 0.47 -0.01 0.50 -1.06 0.00 0.00 177.43 177.29 2jvu h LYS 81 N 0.71 0.15 0.00 0.81 3.11 -0.84 -3.38 116.57 117.13 2jvu h LYS 81 Ca 0.19 -0.06 -0.08 0.00 -2.81 0.00 0.00 60.65 57.89 2jvu h LYS 81 Cb -0.04 -0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.17 2jvu h LYS 81 CO -0.04 0.46 -1.42 1.55 -2.81 0.00 0.00 179.45 177.20 2jvu n VAL 82 N -4.81 0.31 0.00 2.00 3.14 -1.07 -5.13 118.33 112.78 2jvu n VAL 82 Ca -0.07 -0.24 0.00 0.00 -2.96 0.00 0.00 64.34 61.07 2jvu n VAL 82 Cb 0.22 -0.46 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 -0.27 3.41 7.55 0.00 0.92 -4.69 105.19 114.54 2jvu n GLY 83 Ca -0.08 -1.74 -0.35 0.00 0.00 0.00 0.00 46.02 43.86 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 -2.19 3.70 -0.04 1.61 1.01 -1.26 -4.14 120.40 119.08 2jvu s VAL 84 Ca 0.00 -0.40 -0.00 0.00 0.00 0.00 0.00 61.98 61.58 2jvu s VAL 84 Cb 0.00 -2.66 -0.00 0.00 0.00 0.00 0.00 36.38 33.72 2jvu s VAL 84 CO 0.00 0.44 0.01 -0.61 0.00 0.00 0.00 175.10 174.94 2jvu h GLN 85 N 7.48 -0.00 -6.45 2.72 4.15 -1.51 -3.47 115.11 118.03 2jvu h GLN 85 Ca -0.36 0.00 -0.69 0.00 0.77 0.00 0.00 58.65 58.37 2jvu h GLN 85 Cb 1.18 0.00 -0.23 0.00 0.21 0.00 0.00 27.48 28.64 2jvu h GLN 85 CO 0.60 -0.00 -0.79 0.21 -1.93 0.00 0.00 178.83 176.92 2jvu s LYS 86 N -1.25 2.29 -0.08 1.69 2.47 -1.26 -5.02 119.74 118.58 2jvu s LYS 86 Ca -0.00 -0.84 0.05 0.00 -1.56 0.00 0.00 55.97 53.62 2jvu s LYS 86 Cb 0.00 -2.27 -0.00 0.00 -1.46 0.00 0.00 37.83 34.09 2jvu s LYS 86 CO 0.00 0.58 -0.23 -0.47 0.16 0.00 0.00 175.35 175.39 2jvu s TYR 87 N -0.81 2.37 -0.05 4.03 5.04 -1.26 -3.13 117.35 123.54 2jvu s TYR 87 Ca 0.13 -0.86 0.00 0.00 -2.44 0.00 0.00 57.07 53.90 2jvu s TYR 87 Cb -0.11 -1.58 0.02 0.00 0.35 0.00 0.00 41.96 40.65 2jvu s TYR 87 CO 0.03 -0.32 -0.03 1.03 -1.34 0.00 0.00 175.55 174.91 2jvu s ARG 88 N 0.18 0.72 -0.05 4.97 0.52 -1.24 -5.03 118.95 119.02 2jvu s ARG 88 Ca -0.13 -0.03 0.04 0.00 -0.52 0.00 0.00 55.73 55.10 2jvu s ARG 88 Cb -0.16 -0.84 -0.00 0.00 0.52 0.00 0.00 34.95 34.47 2jvu s ARG 88 CO 0.06 -0.14 -0.18 0.00 0.02 0.00 0.00 175.30 175.06 2jvu s ALA 89 N 1.19 1.65 -0.08 2.13 0.00 -1.26 -2.71 121.76 122.68 2jvu s ALA 89 Ca -0.07 -0.75 0.04 0.00 0.00 0.00 0.00 51.96 51.19 2jvu s ALA 89 Cb -0.14 -0.55 -0.01 0.00 0.00 0.00 0.00 23.12 22.42 2jvu s ALA 89 CO -0.02 0.29 -0.22 -1.17 0.00 0.00 0.00 175.76 174.64 2jvu s LEU 90 N 0.07 2.24 -0.08 0.00 2.96 -1.05 -5.00 118.68 117.82 2jvu s LEU 90 Ca -0.05 -0.47 0.01 0.00 -0.22 0.00 0.00 54.13 53.40 2jvu s LEU 90 Cb -0.13 -1.44 0.02 0.00 0.50 0.00 0.00 46.19 45.14 2jvu s LEU 90 CO 0.03 0.22 -0.10 0.42 -1.32 0.00 0.00 176.35 175.59 2jvu s THR 91 N 0.00 1.08 0.10 3.68 -4.23 -1.26 -2.90 115.64 112.11 2jvu s THR 91 Ca -0.08 -0.40 0.03 0.00 -1.18 0.00 0.00 61.69 60.06 2jvu s THR 91 Cb -0.15 -1.03 -0.04 0.00 1.34 0.00 0.00 72.50 72.62 2jvu s THR 91 CO 0.05 0.36 -0.08 -1.61 -0.54 0.00 0.00 174.62 172.80 2jvu s GLU 92 N 1.05 0.86 0.29 3.99 0.41 -1.10 -4.62 118.70 119.58 2jvu s GLU 92 Ca -0.07 -1.29 -0.29 0.00 -0.41 0.00 0.00 54.97 52.91 2jvu s GLU 92 Cb -0.15 -0.36 -0.10 0.00 -1.78 0.00 0.00 34.13 31.75 2jvu s GLU 92 CO -0.01 0.03 1.20 -1.58 -0.49 0.00 0.00 175.26 174.40 2jvu s TRP 93 N -3.19 3.35 -0.23 1.61 0.52 -1.26 -2.23 118.94 117.51 2jvu s TRP 93 Ca 0.10 1.54 -0.04 0.00 0.02 0.00 0.00 56.10 57.73 2jvu s TRP 93 Cb 0.02 -3.46 -0.00 0.00 -1.15 0.00 0.00 33.47 28.88 2jvu s TRP 93 CO -0.02 -1.17 -0.04 0.08 0.02 0.00 0.00 176.95 175.81 2jvu s VAL 94 N -0.98 3.30 0.00 4.03 1.01 -0.80 -4.82 120.40 122.14 2jvu s VAL 94 Ca 0.48 -0.61 0.00 0.00 0.00 0.00 0.00 61.98 61.85 2jvu s VAL 94 Cb -0.35 -2.54 0.00 0.00 0.00 0.00 0.00 36.38 33.48 2jvu s VAL 94 CO 0.45 0.36 0.00 0.61 0.00 0.00 0.00 175.10 176.52 2jvu n GLY 95 N 4.78 3.82 3.63 4.51 0.00 -1.26 0.23 105.19 120.89 2jvu n GLY 95 Ca -0.18 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 2jvu n GLY 95 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2jvu s SER 96 N 1.11 6.75 0.00 1.61 1.04 -1.26 -4.77 113.70 118.18 2jvu s SER 96 Ca 0.00 0.87 0.25 0.00 0.48 0.00 0.00 55.95 57.55 2jvu s SER 96 Cb 0.00 -2.42 0.58 0.00 0.10 0.00 0.00 66.02 64.28 2jvu s SER 96 CO 0.00 -0.55 1.47 -2.11 0.98 0.00 0.00 173.24 173.02 2jvu n ARG 97 N 6.08 0.08 0.00 4.02 1.85 -1.26 -5.21 116.66 122.23 2jvu n ARG 97 Ca 0.05 -0.04 0.04 0.00 -1.00 0.00 0.00 57.85 56.89 2jvu n ARG 97 Cb 0.48 -1.50 0.03 0.00 -1.05 0.00 0.00 32.46 30.42 2jvu n ARG 97 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07