#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vjv s TYR 7 N 0.00 3.60 0.46 -1.77 1.51 -1.26 -4.78 117.35 115.11 2vjv s TYR 7 Ca 0.00 0.69 0.07 0.00 -1.01 0.00 0.00 57.07 56.82 2vjv s TYR 7 Cb 0.00 -2.17 -0.01 0.00 -0.11 0.00 0.00 41.96 39.67 2vjv s TYR 7 CO 0.00 0.56 0.32 0.15 -1.11 0.00 0.00 175.55 175.47 2vjv s LYS 8 N -0.59 2.33 -0.05 -0.62 1.02 -0.34 -4.92 119.74 116.58 2vjv s LYS 8 Ca 0.18 -1.82 -0.16 0.00 0.02 0.00 0.00 55.97 54.19 2vjv s LYS 8 Cb -0.14 -2.14 0.03 0.00 -0.52 0.00 0.00 37.83 35.06 2vjv s LYS 8 CO 0.07 -0.32 0.36 -1.54 -0.92 0.00 0.00 175.35 172.99 2vjv s SER 9 N -4.11 -0.28 0.00 2.83 1.04 -1.26 -1.00 113.70 110.93 2vjv s SER 9 Ca 0.40 0.29 0.00 0.00 0.48 0.00 0.00 55.95 57.12 2vjv s SER 9 Cb -0.01 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.55 2vjv s SER 9 CO 0.23 -0.39 0.00 -0.46 0.98 0.00 0.00 173.24 173.60 2vjv n ASN 10 N 1.59 0.17 0.17 7.02 0.23 -0.40 -4.97 115.26 119.07 2vjv n ASN 10 Ca -0.19 0.00 0.02 0.00 -0.53 0.00 0.00 54.58 53.87 2vjv n ASN 10 Cb 0.56 0.00 0.34 0.00 -2.08 0.00 0.00 39.78 38.60 2vjv n ASN 10 CO 0.00 0.00 0.00 0.45 -0.93 0.00 0.00 177.26 176.78 2vjv h HIS 11 N 0.00 0.03 0.00 -2.53 3.86 -2.06 -3.36 115.15 111.10 2vjv h HIS 11 Ca 0.00 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2vjv h HIS 11 Cb 0.00 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.46 2vjv h HIS 11 CO 0.00 0.41 0.00 0.09 0.86 0.00 0.00 177.93 179.29 2vjv n ASN 12 N -4.08 0.21 -4.06 2.45 3.02 -1.26 -5.07 115.26 106.46 2vjv n ASN 12 Ca -0.02 -0.55 -0.19 0.00 -0.03 0.00 0.00 54.58 53.80 2vjv n ASN 12 Cb 0.42 0.53 -0.14 0.00 -0.61 0.00 0.00 39.78 39.97 2vjv n ASN 12 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2vjv s VAL 13 N -0.53 0.83 -0.16 2.41 1.01 -1.26 -5.12 120.40 117.58 2vjv s VAL 13 Ca 0.00 -0.62 -0.05 0.00 0.00 0.00 0.00 61.98 61.31 2vjv s VAL 13 Cb 0.00 -0.73 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 2vjv s VAL 13 CO 0.00 0.11 -0.00 -0.69 0.00 0.00 0.00 175.10 174.52 2vjv s VAL 14 N -0.49 4.22 0.28 2.92 1.01 -1.26 -1.27 120.40 125.81 2vjv s VAL 14 Ca 0.02 -0.24 -0.19 0.00 0.00 0.00 0.00 61.98 61.56 2vjv s VAL 14 Cb -0.05 -2.87 0.02 0.00 0.00 0.00 0.00 36.38 33.48 2vjv s VAL 14 CO 0.00 0.49 0.69 -0.72 0.00 0.00 0.00 175.10 175.56 2vjv s TYR 15 N 0.31 -0.08 -0.29 5.22 -0.85 -0.17 -4.98 117.35 116.51 2vjv s TYR 15 Ca -0.01 -0.38 0.04 0.00 -0.52 0.00 0.00 57.07 56.20 2vjv s TYR 15 Cb -0.13 0.64 0.20 0.00 0.38 0.00 0.00 41.96 43.04 2vjv s TYR 15 CO 0.02 -1.23 0.63 0.45 -1.52 0.00 0.00 175.55 173.90 2vjv s SER 16 N -2.95 -1.53 -0.23 -0.18 0.15 -1.26 -1.20 113.70 106.50 2vjv s SER 16 Ca 0.13 0.22 0.01 0.00 0.70 0.00 0.00 55.95 57.01 2vjv s SER 16 Cb -0.05 1.99 0.05 0.00 -1.71 0.00 0.00 66.02 66.30 2vjv s SER 16 CO 0.08 -0.28 -0.08 0.00 1.20 0.00 0.00 173.24 174.16 2vjv s LYS 18 N 1.32 2.48 0.00 0.00 1.02 -1.26 -0.77 119.74 122.54 2vjv s LYS 18 Ca -0.05 -0.74 0.00 0.00 0.02 0.00 0.00 55.97 55.20 2vjv s LYS 18 Cb -0.18 -2.43 -0.00 0.00 -0.52 0.00 0.00 37.83 34.70 2vjv s LYS 18 CO -0.06 0.60 -0.01 0.71 -0.92 0.00 0.00 175.35 175.67 2vjv s TYR 19 N -0.90 0.09 -0.08 3.18 1.51 0.11 -1.28 117.35 119.99 2vjv s TYR 19 Ca 0.15 -0.08 -0.19 0.00 -1.01 0.00 0.00 57.07 55.93 2vjv s TYR 19 Cb -0.11 -0.06 -0.05 0.00 -0.11 0.00 0.00 41.96 41.63 2vjv s TYR 19 CO 0.05 -0.03 0.52 -1.01 -1.11 0.00 0.00 175.55 173.97 2vjv s HIS 20 N -0.22 3.58 -0.05 2.71 3.76 0.49 -1.32 115.29 124.24 2vjv s HIS 20 Ca -0.02 1.00 0.02 0.00 -0.15 0.00 0.00 55.06 55.91 2vjv s HIS 20 Cb -0.02 -2.56 0.02 0.00 1.11 0.00 0.00 32.58 31.13 2vjv s HIS 20 CO -0.00 0.25 -0.09 0.42 -0.85 0.00 0.00 174.74 174.47 2vjv s ILE 21 N 0.29 0.85 -0.02 0.60 1.01 0.64 -1.38 121.20 123.19 2vjv s ILE 21 Ca 0.28 -0.32 0.01 0.00 0.00 0.00 0.00 60.65 60.61 2vjv s ILE 21 Cb -0.16 -0.81 0.02 0.00 0.01 0.00 0.00 42.46 41.52 2vjv s ILE 21 CO 0.13 0.29 -0.01 -0.69 0.00 0.00 0.00 174.94 174.66 2vjv s VAL 22 N 0.71 0.20 0.11 2.92 1.01 -0.45 -0.78 120.40 124.12 2vjv s VAL 22 Ca -0.12 -0.00 -0.08 0.00 0.00 0.00 0.00 61.98 61.77 2vjv s VAL 22 Cb -0.15 -0.25 -0.01 0.00 0.00 0.00 0.00 36.38 35.98 2vjv s VAL 22 CO 0.02 0.11 0.21 -1.66 0.00 0.00 0.00 175.10 173.78 2vjv s TRP 23 N 0.58 0.24 0.22 5.22 -2.14 -1.03 -0.42 118.94 121.60 2vjv s TRP 23 Ca -0.06 -0.65 0.05 0.00 2.66 0.00 0.00 56.10 58.10 2vjv s TRP 23 Cb -0.09 -0.08 -0.05 0.00 -3.10 0.00 0.00 33.47 30.16 2vjv s TRP 23 CO -0.01 -0.58 -0.06 0.00 -2.66 0.00 0.00 176.95 173.64 2vjv s PRO 25 N -3.78 2.47 0.28 0.00 0.02 -1.26 -3.74 135.00 129.00 2vjv s PRO 25 Ca 0.25 1.36 -0.29 0.00 0.02 0.00 0.00 61.00 62.34 2vjv s PRO 25 Cb 0.04 -1.91 -0.13 0.00 0.02 0.00 0.00 34.50 32.51 2vjv s PRO 25 CO 0.07 -1.50 1.23 1.17 -0.33 0.00 0.00 177.00 177.64 2vjv n LYS 26 N -2.89 1.80 -1.01 5.54 3.00 0.41 -1.01 118.16 124.00 2vjv n LYS 26 Ca 0.10 0.63 -0.00 0.00 -0.00 0.00 0.00 58.31 59.04 2vjv n LYS 26 Cb 0.52 -2.17 -0.00 0.00 0.00 0.00 0.00 35.03 33.38 2vjv n LYS 26 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2vjv n TYR 27 N 0.84 0.00 -2.48 5.64 0.53 -1.26 -2.03 117.16 118.39 2vjv n TYR 27 Ca 0.09 0.00 -0.20 0.00 -1.02 0.00 0.00 57.90 56.77 2vjv n TYR 27 Cb 0.33 -1.80 -0.00 0.00 -1.03 0.00 0.00 39.34 36.83 2vjv n TYR 27 CO 0.00 0.00 0.00 -2.13 -1.02 0.00 0.00 176.86 173.71 2vjv n ARG 28 N 0.49 -2.10 -1.77 -0.72 0.63 -0.18 -4.94 116.66 108.07 2vjv n ARG 28 Ca -0.00 0.93 -0.40 0.00 -0.92 0.00 0.00 57.85 57.46 2vjv n ARG 28 Cb 0.45 -5.61 0.02 0.00 0.45 0.00 0.00 32.46 27.77 2vjv n ARG 28 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2vjv s ARG 29 N -5.12 3.58 -1.36 -0.14 1.81 -0.86 -4.88 118.95 111.98 2vjv s ARG 29 Ca 0.03 2.42 -0.09 0.00 -1.72 0.00 0.00 55.73 56.38 2vjv s ARG 29 Cb -0.02 -2.59 0.10 0.00 -0.45 0.00 0.00 34.95 32.00 2vjv s ARG 29 CO 0.04 -0.90 2.21 1.63 -0.68 0.00 0.00 175.30 177.61 2vjv n LYS 30 N -0.34 3.82 -0.00 3.54 5.02 -1.26 -4.53 118.16 124.40 2vjv n LYS 30 Ca 0.06 -3.21 0.10 0.00 -2.02 0.00 0.00 58.31 53.24 2vjv n LYS 30 Cb 0.42 -2.87 -0.11 0.00 -0.02 0.00 0.00 35.03 32.44 2vjv n LYS 30 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2vjv n VAL 31 N 3.12 0.00 -1.81 -0.18 0.24 -1.05 -4.69 118.33 113.96 2vjv n VAL 31 Ca 0.53 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.34 62.40 2vjv n VAL 31 Cb 0.31 0.96 -0.00 0.00 -1.47 0.00 0.00 33.84 33.64 2vjv n VAL 31 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2vjv n LEU 32 N -1.52 7.15 -4.16 1.34 4.77 -0.30 -4.67 117.00 119.62 2vjv n LEU 32 Ca 0.04 -4.31 -0.12 0.00 -0.03 0.00 0.00 56.01 51.59 2vjv n LEU 32 Cb 0.34 -1.59 -0.10 0.00 -2.33 0.00 0.00 43.42 39.73 2vjv n LEU 32 CO 0.43 1.35 -0.40 0.68 -1.33 0.00 0.00 177.39 178.12 2vjv s VAL 33 N 2.27 0.76 0.00 4.08 -7.23 -1.26 -3.98 120.40 115.04 2vjv s VAL 33 Ca 0.49 -1.73 0.00 0.00 -1.81 0.00 0.00 61.98 58.93 2vjv s VAL 33 Cb 0.14 -1.43 0.00 0.00 0.56 0.00 0.00 36.38 35.65 2vjv s VAL 33 CO -0.07 -0.71 0.00 0.61 -0.31 0.00 0.00 175.10 174.63 2vjv n GLY 34 N 0.35 3.21 0.36 2.32 0.00 -1.26 -2.20 105.19 107.97 2vjv n GLY 34 Ca -0.15 -0.04 0.04 0.00 0.00 0.00 0.00 46.02 45.87 2vjv n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vjv h ALA 35 N -0.60 1.54 -0.10 4.61 0.00 -1.98 -1.54 119.26 121.20 2vjv h ALA 35 Ca 0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2vjv h ALA 35 Cb 0.00 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2vjv h ALA 35 CO 0.00 0.35 0.06 0.28 0.00 0.00 0.00 179.25 179.94 2vjv h VAL 36 N 0.97 1.06 -0.65 0.00 2.07 -1.75 -0.33 116.25 117.61 2vjv h VAL 36 Ca 0.34 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.71 2vjv h VAL 36 Cb 0.13 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 2vjv h VAL 36 CO -0.11 0.05 0.42 -0.08 0.02 0.00 0.00 177.57 177.87 2vjv h GLU 37 N 0.09 0.86 0.03 1.57 4.81 -1.30 0.12 114.58 120.76 2vjv h GLU 37 Ca 0.03 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2vjv h GLU 37 Cb 0.04 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.23 2vjv h GLU 37 CO -0.01 0.58 -0.01 1.98 -0.73 0.00 0.00 179.01 180.82 2vjv h MET 38 N 0.88 -0.04 -0.53 1.92 4.05 -1.10 -2.61 114.93 117.50 2vjv h MET 38 Ca 0.24 0.00 -0.09 0.00 -0.28 0.00 0.00 59.70 59.57 2vjv h MET 38 Cb -0.08 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.71 2vjv h MET 38 CO -0.05 0.09 -0.01 -0.09 0.23 0.00 0.00 176.91 177.07 2vjv h ARG 39 N -0.15 0.90 -0.54 0.39 9.65 -0.86 -2.66 114.38 121.12 2vjv h ARG 39 Ca -0.00 -0.27 0.05 0.00 -1.10 0.00 0.00 59.98 58.66 2vjv h ARG 39 Cb 0.14 -0.09 -0.05 0.00 -1.39 0.00 0.00 29.97 28.58 2vjv h ARG 39 CO 0.01 0.91 0.28 1.25 2.80 0.00 0.00 179.97 185.21 2vjv h LEU 40 N 0.83 0.40 -0.72 3.80 5.85 -0.62 -1.04 115.31 123.81 2vjv h LEU 40 Ca 0.15 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.85 2vjv h LEU 40 Cb 0.51 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 2vjv h LEU 40 CO 0.03 0.27 0.23 0.11 -0.34 0.00 0.00 178.44 178.74 2vjv h LYS 41 N 0.53 1.12 -0.41 1.25 1.57 -1.26 -1.50 116.57 117.87 2vjv h LYS 41 Ca 0.24 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2vjv h LYS 41 Cb 0.14 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 2vjv h LYS 41 CO -0.16 0.96 0.23 0.93 -0.57 0.00 0.00 179.45 180.84 2vjv h GLU 42 N 1.07 0.57 -0.25 3.15 5.08 -1.07 -0.16 114.58 122.96 2vjv h GLU 42 Ca 0.23 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2vjv h GLU 42 Cb 0.30 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2vjv h GLU 42 CO -0.01 0.44 0.16 0.82 -1.00 0.00 0.00 179.01 179.42 2vjv h ILE 43 N 0.54 1.08 -0.13 3.13 2.04 -0.91 -1.61 117.51 121.65 2vjv h ILE 43 Ca 0.15 -0.18 -0.07 0.00 1.00 0.00 0.00 64.86 65.75 2vjv h ILE 43 Cb 0.03 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 2vjv h ILE 43 CO -0.03 0.08 -0.25 0.40 0.00 0.00 0.00 178.15 178.36 2vjv h ILE 44 N 0.32 1.24 -0.52 -0.67 2.04 -0.97 -0.27 117.51 118.68 2vjv h ILE 44 Ca 0.09 -1.10 -0.08 0.00 1.00 0.00 0.00 64.86 64.77 2vjv h ILE 44 Cb -0.01 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 2vjv h ILE 44 CO -0.02 0.33 -0.00 1.56 0.00 0.00 0.00 178.15 180.03 2vjv h GLN 45 N 0.22 0.91 -0.62 2.37 1.08 -0.68 -0.48 115.11 117.91 2vjv h GLN 45 Ca 0.04 -0.29 -0.06 0.00 -1.45 0.00 0.00 58.65 56.88 2vjv h GLN 45 Cb 0.56 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.88 2vjv h GLN 45 CO 0.04 0.94 0.16 1.49 -0.95 0.00 0.00 178.83 180.51 2vjv h GLU 46 N 0.78 0.99 -0.29 1.46 4.57 -0.56 -1.05 114.58 120.48 2vjv h GLU 46 Ca 0.15 -0.24 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 2vjv h GLU 46 Cb 0.53 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.97 2vjv h GLU 46 CO 0.03 0.90 0.19 0.28 -1.18 0.00 0.00 179.01 179.22 2vjv h VAL 47 N 0.91 1.09 -0.32 0.32 2.07 -0.79 -1.54 116.25 118.00 2vjv h VAL 47 Ca 0.20 -0.17 0.01 0.00 0.82 0.00 0.00 66.70 67.55 2vjv h VAL 47 Cb 0.35 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 2vjv h VAL 47 CO 0.00 0.08 0.19 0.00 0.02 0.00 0.00 177.57 177.86 2vjv h ALA 48 N 1.09 0.40 -0.13 1.67 0.00 -0.79 0.02 119.26 121.52 2vjv h ALA 48 Ca 0.11 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.05 2vjv h ALA 48 Cb -0.02 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 2vjv h ALA 48 CO -0.02 -0.17 -0.14 -0.22 0.00 0.00 0.00 179.25 178.70 2vjv h LYS 49 N 0.39 -0.16 -0.33 0.00 3.64 -0.97 0.16 116.57 119.30 2vjv h LYS 49 Ca 0.12 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 2vjv h LYS 49 Cb -0.01 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 2vjv h LYS 49 CO -0.05 -0.11 0.03 0.93 -2.27 0.00 0.00 179.45 177.98 2vjv h GLU 50 N -0.17 0.50 -0.58 1.90 5.08 -0.90 -2.80 114.58 117.62 2vjv h GLU 50 Ca 0.09 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2vjv h GLU 50 Cb 0.31 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2vjv h GLU 50 CO -0.23 0.51 0.00 1.28 -1.00 0.00 0.00 179.01 179.56 2vjv n LEU 51 N -4.31 3.25 -3.72 1.33 4.32 -0.04 -4.94 117.00 112.89 2vjv n LEU 51 Ca 0.02 -1.63 -0.26 0.00 -0.02 0.00 0.00 56.01 54.12 2vjv n LEU 51 Cb 0.22 -0.42 0.06 0.00 -1.62 0.00 0.00 43.42 41.66 2vjv n LEU 51 CO 0.38 0.72 0.17 0.54 -1.22 0.00 0.00 177.39 177.98 2vjv n ARG 52 N 1.04 -6.84 -4.52 3.23 1.74 -0.35 -4.99 116.66 105.98 2vjv n ARG 52 Ca 0.19 0.73 -0.34 0.00 -0.77 0.00 0.00 57.85 57.66 2vjv n ARG 52 Cb 0.55 -5.70 -0.12 0.00 -1.02 0.00 0.00 32.46 26.17 2vjv n ARG 52 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2vjv s VAL 53 N -3.33 3.80 -0.28 1.55 1.01 -0.10 -4.73 120.40 118.32 2vjv s VAL 53 Ca 0.56 -0.42 -0.14 0.00 0.00 0.00 0.00 61.98 61.98 2vjv s VAL 53 Cb -0.26 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 2vjv s VAL 53 CO 0.77 0.55 0.33 -0.70 0.00 0.00 0.00 175.10 176.06 2vjv s GLU 54 N -0.27 3.98 -0.44 2.72 2.12 -0.85 -4.33 118.70 121.62 2vjv s GLU 54 Ca 0.04 -0.06 -0.22 0.00 0.36 0.00 0.00 54.97 55.09 2vjv s GLU 54 Cb -0.13 -3.66 0.02 0.00 0.26 0.00 0.00 34.13 30.62 2vjv s GLU 54 CO 0.02 -0.27 0.74 0.42 -0.54 0.00 0.00 175.26 175.63 2vjv s ILE 55 N 2.00 4.71 -0.02 -3.70 1.01 -1.26 -0.89 121.20 123.06 2vjv s ILE 55 Ca 0.13 0.33 -0.21 0.00 0.00 0.00 0.00 60.65 60.90 2vjv s ILE 55 Cb -0.16 -4.28 -0.26 0.00 0.01 0.00 0.00 42.46 37.77 2vjv s ILE 55 CO 0.10 -0.67 1.02 0.40 0.00 0.00 0.00 174.94 175.79 2vjv h ILE 56 N 5.94 1.47 -2.75 2.92 2.04 -1.07 -3.48 117.51 122.60 2vjv h ILE 56 Ca -0.25 -2.22 -0.10 0.00 1.00 0.00 0.00 64.86 63.29 2vjv h ILE 56 Cb 1.09 2.82 -0.20 0.00 -0.74 0.00 0.00 36.82 39.79 2vjv h ILE 56 CO 0.94 0.63 -0.15 -1.61 0.00 0.00 0.00 178.15 177.96 2vjv s GLU 57 N -2.94 0.76 -0.14 2.37 2.02 -1.04 -4.98 118.70 114.74 2vjv s GLU 57 Ca -0.14 -0.03 -0.06 0.00 0.02 0.00 0.00 54.97 54.76 2vjv s GLU 57 Cb 0.02 0.35 0.06 0.00 0.10 0.00 0.00 34.13 34.66 2vjv s GLU 57 CO 0.81 -0.21 0.32 1.41 0.02 0.00 0.00 175.26 177.61 2vjv s MET 58 N -1.21 0.26 0.02 1.61 -2.45 -1.26 -0.51 119.30 115.77 2vjv s MET 58 Ca -0.12 0.74 0.00 0.00 -1.25 0.00 0.00 55.69 55.06 2vjv s MET 58 Cb -0.04 0.00 -0.02 0.00 1.25 0.00 0.00 34.83 36.02 2vjv s MET 58 CO 0.06 -0.21 -0.03 -0.65 1.05 0.00 0.00 175.02 175.23 2vjv s GLN 59 N 1.81 0.35 0.03 4.11 -0.21 0.22 -4.99 119.66 120.98 2vjv s GLN 59 Ca -0.05 -0.67 0.04 0.00 0.02 0.00 0.00 55.36 54.70 2vjv s GLN 59 Cb -0.10 0.09 -0.02 0.00 1.00 0.00 0.00 33.01 33.97 2vjv s GLN 59 CO -0.10 -0.05 -0.13 0.95 -2.12 0.00 0.00 175.29 173.84 2vjv s THR 60 N -1.65 0.99 0.44 -0.19 -4.23 -1.26 -0.45 115.64 109.30 2vjv s THR 60 Ca -0.14 -0.86 0.06 0.00 -1.18 0.00 0.00 61.69 59.57 2vjv s THR 60 Cb -0.09 -0.89 -0.04 0.00 1.34 0.00 0.00 72.50 72.82 2vjv s THR 60 CO -0.02 0.03 0.14 -0.62 -0.54 0.00 0.00 174.62 173.62 2vjv s ASP 61 N -0.94 4.29 0.50 3.99 -1.08 0.07 -5.00 116.67 118.50 2vjv s ASP 61 Ca 0.01 -1.25 0.25 0.00 -0.52 0.00 0.00 52.55 51.05 2vjv s ASP 61 Cb -0.07 -0.20 1.33 0.00 -1.46 0.00 0.00 42.92 42.52 2vjv s ASP 61 CO 0.01 -0.64 1.92 0.11 0.52 0.00 0.00 175.17 177.09 2vjv h LYS 62 N 1.40 0.12 0.00 4.34 1.57 -1.94 -3.00 116.57 119.06 2vjv h LYS 62 Ca -0.43 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.34 2vjv h LYS 62 Cb 1.27 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.54 2vjv h LYS 62 CO 0.71 0.08 -0.16 -0.40 -0.57 0.00 0.00 179.45 179.12 2vjv n ASP 63 N -4.37 2.03 -3.57 0.86 3.85 -1.26 -1.14 116.55 112.94 2vjv n ASP 63 Ca 0.15 -3.16 -0.06 0.00 -0.71 0.00 0.00 54.79 51.02 2vjv n ASP 63 Cb 0.75 -0.43 -0.02 0.00 -1.35 0.00 0.00 41.12 40.07 2vjv n ASP 63 CO 0.00 0.00 0.00 -1.38 -1.01 0.00 0.00 177.20 174.81 2vjv s HIS 64 N -2.70 -0.19 0.01 2.11 -3.43 -1.13 -4.15 115.29 105.80 2vjv s HIS 64 Ca 0.31 0.13 0.04 0.00 -0.80 0.00 0.00 55.06 54.74 2vjv s HIS 64 Cb 0.28 0.52 -0.01 0.00 -1.43 0.00 0.00 32.58 31.94 2vjv s HIS 64 CO 0.00 -0.30 -0.14 -1.50 -2.00 0.00 0.00 174.74 170.81 2vjv s ILE 65 N -2.57 1.07 -0.09 -5.38 2.07 -0.81 -0.75 121.20 114.74 2vjv s ILE 65 Ca 0.08 -0.71 0.02 0.00 -1.41 0.00 0.00 60.65 58.63 2vjv s ILE 65 Cb -0.01 -0.92 0.01 0.00 0.13 0.00 0.00 42.46 41.67 2vjv s ILE 65 CO -0.06 0.20 -0.14 -2.28 -1.91 0.00 0.00 174.94 170.75 2vjv s HIS 66 N -0.49 1.73 -0.03 3.50 5.65 0.41 -2.45 115.29 123.60 2vjv s HIS 66 Ca 0.04 -0.72 0.05 0.00 0.25 0.00 0.00 55.06 54.67 2vjv s HIS 66 Cb -0.06 -1.26 -0.01 0.00 -1.18 0.00 0.00 32.58 30.08 2vjv s HIS 66 CO 0.00 -0.37 -0.18 0.42 -0.65 0.00 0.00 174.74 173.96 2vjv s ILE 67 N 0.82 1.45 -0.23 0.89 1.01 0.04 -0.61 121.20 124.57 2vjv s ILE 67 Ca -0.11 -0.75 -0.03 0.00 0.00 0.00 0.00 60.65 59.76 2vjv s ILE 67 Cb -0.15 -1.23 0.00 0.00 0.01 0.00 0.00 42.46 41.09 2vjv s ILE 67 CO 0.02 0.41 -0.05 -0.22 0.00 0.00 0.00 174.94 175.10 2vjv s LEU 68 N -0.18 2.93 0.03 2.97 0.20 0.33 -0.26 118.68 124.70 2vjv s LEU 68 Ca 0.01 -0.52 0.01 0.00 0.69 0.00 0.00 54.13 54.32 2vjv s LEU 68 Cb -0.10 -1.71 -0.02 0.00 -0.43 0.00 0.00 46.19 43.94 2vjv s LEU 68 CO 0.01 -0.05 -0.05 0.00 -0.29 0.00 0.00 176.35 175.97 2vjv s ALA 69 N 1.44 0.32 -0.25 5.97 0.00 -0.43 -0.36 121.76 128.44 2vjv s ALA 69 Ca 0.05 -0.66 -0.08 0.00 0.00 0.00 0.00 51.96 51.26 2vjv s ALA 69 Cb -0.15 0.10 -0.04 0.00 0.00 0.00 0.00 23.12 23.04 2vjv s ALA 69 CO -0.04 -0.10 0.10 0.34 0.00 0.00 0.00 175.76 176.06 2vjv s ASP 70 N -1.50 5.42 -0.03 0.00 2.15 -0.06 -0.71 116.67 121.94 2vjv s ASP 70 Ca -0.13 -0.12 0.03 0.00 0.43 0.00 0.00 52.55 52.75 2vjv s ASP 70 Cb -0.10 -1.98 0.00 0.00 -0.30 0.00 0.00 42.92 40.54 2vjv s ASP 70 CO -0.00 -0.02 -0.11 -0.63 -0.17 0.00 0.00 175.17 174.24 2vjv s ILE 71 N 1.53 0.92 0.09 4.11 1.01 0.05 -2.02 121.20 126.89 2vjv s ILE 71 Ca 0.06 -0.44 -0.31 0.00 0.00 0.00 0.00 60.65 59.96 2vjv s ILE 71 Cb -0.15 -0.81 -0.10 0.00 0.01 0.00 0.00 42.46 41.41 2vjv s ILE 71 CO 0.05 0.28 1.87 -0.62 0.00 0.00 0.00 174.94 176.52 2vjv s ASP 72 N 0.13 6.44 0.52 3.58 -1.08 -1.26 -4.27 116.67 120.73 2vjv s ASP 72 Ca -0.03 2.71 0.24 0.00 -0.52 0.00 0.00 52.55 54.96 2vjv s ASP 72 Cb -0.09 -2.55 1.41 0.00 -1.46 0.00 0.00 42.92 40.23 2vjv s ASP 72 CO 0.01 -1.02 2.09 1.55 0.52 0.00 0.00 175.17 178.32 2vjv h PRO 73 N 9.25 0.00 -0.07 4.34 0.13 -1.96 -1.27 132.00 142.43 2vjv h PRO 73 Ca -0.47 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.53 2vjv h PRO 73 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2vjv h PRO 73 CO 0.95 0.11 -0.54 0.77 -0.23 0.00 0.00 178.00 179.06 2vjv h SER 74 N 0.00 0.22 -0.00 1.44 0.02 -2.02 -3.14 113.55 110.08 2vjv h SER 74 Ca -0.00 -0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 60.83 2vjv h SER 74 Cb 0.26 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.73 2vjv h SER 74 CO 0.01 0.72 -0.00 0.15 -1.14 0.00 0.00 176.83 176.57 2vjv h PHE 75 N 0.16 0.00 0.00 3.45 3.57 -1.66 -3.50 116.94 118.96 2vjv h PHE 75 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2vjv h PHE 75 Cb 1.00 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.74 2vjv h PHE 75 CO 0.02 0.71 0.00 0.41 -2.23 0.00 0.00 178.31 177.22 2vjv n GLY 76 N 0.82 1.99 0.28 2.40 0.00 -0.60 -4.61 105.19 105.48 2vjv n GLY 76 Ca -0.09 -1.35 0.01 0.00 0.00 0.00 0.00 46.02 44.59 2vjv n GLY 76 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2vjv h VAL 77 N 0.00 1.17 -0.20 1.61 3.04 -1.87 -2.26 116.25 117.73 2vjv h VAL 77 Ca 0.00 -0.60 -0.09 0.00 -1.01 0.00 0.00 66.70 65.00 2vjv h VAL 77 Cb 0.00 0.80 -0.01 0.00 -2.01 0.00 0.00 31.29 30.07 2vjv h VAL 77 CO 0.00 0.22 -0.26 0.24 -1.01 0.00 0.00 177.57 176.75 2vjv h MET 78 N 0.52 0.38 -0.34 4.17 2.86 -1.99 -0.38 114.93 120.17 2vjv h MET 78 Ca 0.12 -0.14 -0.11 0.00 -2.06 0.00 0.00 59.70 57.51 2vjv h MET 78 Cb 0.21 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 2vjv h MET 78 CO -0.00 0.62 -0.24 -0.22 1.06 0.00 0.00 176.91 178.13 2vjv h LYS 79 N 0.34 0.67 -0.26 1.72 3.64 -1.66 0.81 116.57 121.82 2vjv h LYS 79 Ca 0.05 -0.27 -0.08 0.00 -1.27 0.00 0.00 60.65 59.09 2vjv h LYS 79 Cb 0.65 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 2vjv h LYS 79 CO 0.05 0.85 -0.14 0.35 -2.27 0.00 0.00 179.45 178.28 2vjv h PHE 80 N 0.58 0.65 -0.53 1.91 3.57 -1.28 -2.65 116.94 119.20 2vjv h PHE 80 Ca 0.08 -0.17 -0.02 0.00 3.53 0.00 0.00 57.97 61.39 2vjv h PHE 80 Cb 0.72 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.29 2vjv h PHE 80 CO 0.03 0.82 0.23 0.82 -2.23 0.00 0.00 178.31 177.99 2vjv h ILE 81 N 0.29 1.21 -0.42 1.41 2.04 -0.79 -0.51 117.51 120.74 2vjv h ILE 81 Ca 0.06 -0.61 0.04 0.00 1.00 0.00 0.00 64.86 65.34 2vjv h ILE 81 Cb 0.66 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 2vjv h ILE 81 CO 0.04 0.24 0.20 0.50 0.00 0.00 0.00 178.15 179.12 2vjv h LYS 82 N 0.71 0.38 -0.20 2.37 3.11 -0.85 0.22 116.57 122.32 2vjv h LYS 82 Ca 0.18 -0.02 -0.07 0.00 -2.81 0.00 0.00 60.65 57.92 2vjv h LYS 82 Cb 0.15 -0.09 -0.00 0.00 -1.00 0.00 0.00 32.23 31.29 2vjv h LYS 82 CO -0.02 0.25 -0.17 1.15 -2.81 0.00 0.00 179.45 177.86 2vjv h THR 83 N 0.40 1.33 -0.36 1.00 2.02 -1.27 0.10 112.91 116.12 2vjv h THR 83 Ca 0.19 -1.31 -0.00 0.00 0.77 0.00 0.00 66.41 66.06 2vjv h THR 83 Cb 0.11 1.74 -0.02 0.00 -1.74 0.00 0.00 68.15 68.25 2vjv h THR 83 CO -0.15 0.40 0.22 0.00 0.37 0.00 0.00 175.52 176.36 2vjv h ALA 84 N 0.66 0.46 -0.01 6.16 0.00 -0.84 -0.22 119.26 125.45 2vjv h ALA 84 Ca 0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2vjv h ALA 84 Cb 0.70 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2vjv h ALA 84 CO 0.04 -0.04 -0.04 0.87 0.00 0.00 0.00 179.25 180.09 2vjv h LYS 85 N 0.47 0.05 -0.39 0.00 1.57 -1.00 -2.77 116.57 114.51 2vjv h LYS 85 Ca 0.13 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2vjv h LYS 85 Cb 0.01 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 2vjv h LYS 85 CO -0.02 0.63 0.23 0.78 -0.57 0.00 0.00 179.45 180.50 2vjv h GLY 86 N -0.52 0.57 1.05 3.86 0.00 -0.95 -1.08 103.07 106.00 2vjv h GLY 86 Ca -0.00 -0.24 -0.15 0.00 0.00 0.00 0.00 47.33 46.93 2vjv h GLY 86 CO 0.01 0.24 -0.41 -0.09 0.00 0.00 0.00 176.54 176.29 2vjv h ARG 87 N 0.51 0.80 -0.43 4.80 2.43 -1.16 -2.25 114.38 119.08 2vjv h ARG 87 Ca 0.14 -0.46 -0.06 0.00 -0.81 0.00 0.00 59.98 58.78 2vjv h ARG 87 Cb 0.02 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 2vjv h ARG 87 CO -0.03 1.09 -0.00 0.66 -1.51 0.00 0.00 179.97 180.19 2vjv h SER 88 N 0.56 0.66 0.00 -3.80 4.64 -1.41 -0.84 113.55 113.37 2vjv h SER 88 Ca 0.03 -0.15 -0.00 0.00 -0.47 0.00 0.00 61.79 61.21 2vjv h SER 88 Cb 1.00 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 2vjv h SER 88 CO 0.10 0.73 -0.00 -1.28 -0.87 0.00 0.00 176.83 175.51 2vjv h SER 89 N 0.65 -0.00 0.53 4.97 0.87 -1.14 1.00 113.55 120.43 2vjv h SER 89 Ca 0.13 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.51 2vjv h SER 89 Cb 0.41 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.35 2vjv h SER 89 CO 0.02 0.16 -0.49 -0.09 -0.53 0.00 0.00 176.83 175.90 2vjv h ARG 90 N -0.16 -0.97 -0.11 2.24 9.65 -1.10 -0.77 114.38 123.16 2vjv h ARG 90 Ca -0.00 0.07 0.01 0.00 -1.10 0.00 0.00 59.98 58.96 2vjv h ARG 90 Cb 0.16 0.22 -0.01 0.00 -1.39 0.00 0.00 29.97 28.95 2vjv h ARG 90 CO 0.00 -0.64 0.02 0.82 2.80 0.00 0.00 179.97 182.97 2vjv h ILE 91 N -1.00 0.95 -0.68 1.20 2.04 -1.15 -2.10 117.51 116.77 2vjv h ILE 91 Ca -0.07 -0.02 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 2vjv h ILE 91 Cb 0.86 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.79 2vjv h ILE 91 CO -0.03 0.01 0.35 -0.07 0.00 0.00 0.00 178.15 178.40 2vjv h LEU 92 N 0.07 0.86 -1.12 1.44 3.38 -0.75 0.24 115.31 119.43 2vjv h LEU 92 Ca 0.05 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 2vjv h LEU 92 Cb 0.04 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2vjv h LEU 92 CO -0.06 0.71 -0.26 0.03 0.09 0.00 0.00 178.44 178.95 2vjv h ARG 93 N 0.96 0.00 0.16 1.13 3.08 -0.96 0.23 114.38 118.98 2vjv h ARG 93 Ca 0.24 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.98 2vjv h ARG 93 Cb 0.07 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.15 2vjv h ARG 93 CO -0.03 0.26 -1.32 1.96 -1.07 0.00 0.00 179.97 179.77 2vjv h GLN 94 N 0.00 0.58 0.03 0.04 4.20 -0.63 -3.37 115.11 115.97 2vjv h GLN 94 Ca -0.00 -0.84 -0.23 0.00 0.06 0.00 0.00 58.65 57.63 2vjv h GLN 94 Cb 0.76 0.29 -0.02 0.00 0.30 0.00 0.00 27.48 28.81 2vjv h GLN 94 CO 0.03 1.39 -1.11 0.93 -0.67 0.00 0.00 178.83 179.40 2vjv h GLU 95 N 0.23 0.07 -3.59 1.46 5.08 -0.61 -3.40 114.58 113.81 2vjv h GLU 95 Ca -0.21 -0.13 -0.64 0.00 -1.00 0.00 0.00 59.36 57.39 2vjv h GLU 95 Cb 2.00 0.05 -0.41 0.00 0.50 0.00 0.00 28.75 30.89 2vjv h GLU 95 CO 0.25 1.03 -0.67 -0.06 -1.00 0.00 0.00 179.01 178.56 2vjv s PHE 96 N -2.69 3.03 0.42 4.33 0.40 0.76 -4.99 117.98 119.24 2vjv s PHE 96 Ca -0.01 -2.95 0.22 0.00 -0.60 0.00 0.00 56.93 53.60 2vjv s PHE 96 Cb 0.09 -2.63 1.21 0.00 0.51 0.00 0.00 43.02 42.19 2vjv s PHE 96 CO 0.84 -0.80 1.76 -2.95 0.70 0.00 0.00 175.22 174.77 2vjv h ASN 97 N 6.84 0.36 0.24 1.36 7.08 -1.79 -0.48 115.58 129.19 2vjv h ASN 97 Ca -0.06 0.08 -0.04 0.00 -3.08 0.00 0.00 56.30 53.20 2vjv h ASN 97 Cb 0.93 0.02 -0.01 0.00 -2.08 0.00 0.00 38.32 37.19 2vjv h ASN 97 CO 0.61 0.04 -0.18 0.45 -2.08 0.00 0.00 177.43 176.27 2vjv h HIS 98 N 0.30 0.00 0.00 4.14 3.86 -1.94 -0.31 115.15 121.20 2vjv h HIS 98 Ca 0.62 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.78 2vjv h HIS 98 Cb 1.74 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 30.20 2vjv h HIS 98 CO -0.00 0.18 -0.21 -0.07 0.86 0.00 0.00 177.93 178.68 2vjv h LEU 99 N 0.00 0.00 0.07 2.43 3.38 -1.41 -1.95 115.31 117.83 2vjv h LEU 99 Ca -0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 2vjv h LEU 99 Cb 0.35 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 2vjv h LEU 99 CO 0.02 0.21 -1.92 1.17 0.09 0.00 0.00 178.44 178.02 2vjv n LYS 100 N -3.37 0.71 0.07 1.13 4.81 -0.35 -3.92 118.16 117.24 2vjv n LYS 100 Ca 0.00 0.27 -0.12 0.00 -0.87 0.00 0.00 58.31 57.59 2vjv n LYS 100 Cb 0.43 -1.73 -0.13 0.00 0.02 0.00 0.00 35.03 33.62 2vjv n LYS 100 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 2vjv h THR 101 N 0.04 1.54 -0.01 3.15 1.35 -1.11 -3.33 112.91 114.54 2vjv h THR 101 Ca -0.38 -3.19 0.00 0.00 -0.55 0.00 0.00 66.41 62.29 2vjv h THR 101 Cb 2.03 2.86 0.00 0.00 -1.73 0.00 0.00 68.15 71.31 2vjv h THR 101 CO 0.08 0.91 -0.17 0.29 -0.25 0.00 0.00 175.52 176.38 2vjv n LYS 102 N -3.42 1.27 -3.92 4.72 5.02 -0.74 -4.93 118.16 116.16 2vjv n LYS 102 Ca -0.06 -0.80 -0.10 0.00 -2.02 0.00 0.00 58.31 55.33 2vjv n LYS 102 Cb 0.99 -1.48 -0.11 0.00 -0.02 0.00 0.00 35.03 34.40 2vjv n LYS 102 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2vjv s LEU 103 N -2.29 1.95 0.18 -0.35 1.43 -1.25 -5.04 118.68 113.31 2vjv s LEU 103 Ca 0.29 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 53.14 2vjv s LEU 103 Cb 0.20 0.26 0.05 0.00 0.03 0.00 0.00 46.19 46.72 2vjv s LEU 103 CO 0.44 -0.24 1.41 1.55 0.23 0.00 0.00 176.35 179.75 2vjv h PRO 104 N 4.96 0.27 -4.01 1.29 0.13 -1.88 -3.44 132.00 129.33 2vjv h PRO 104 Ca -0.30 -0.25 -0.12 0.00 -0.87 0.00 0.00 66.00 64.46 2vjv h PRO 104 Cb 1.21 0.06 -0.14 0.00 0.13 0.00 0.00 31.00 32.26 2vjv h PRO 104 CO 0.43 0.94 -0.43 0.95 -0.23 0.00 0.00 178.00 179.65 2vjv s THR 105 N -3.40 0.11 -0.04 1.56 -4.23 -1.26 -5.07 115.64 103.31 2vjv s THR 105 Ca -0.04 -1.48 -0.14 0.00 -1.18 0.00 0.00 61.69 58.86 2vjv s THR 105 Cb 0.10 -1.71 -0.32 0.00 1.34 0.00 0.00 72.50 71.91 2vjv s THR 105 CO 0.83 -0.50 0.75 0.25 -0.54 0.00 0.00 174.62 175.41 2vjv h LEU 106 N 2.72 0.64-10.33 4.79 5.85 -1.89 -3.42 115.31 113.67 2vjv h LEU 106 Ca -0.33 -0.92 -0.60 0.00 0.84 0.00 0.00 57.88 56.86 2vjv h LEU 106 Cb 1.21 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.97 2vjv h LEU 106 CO 0.54 1.72 -0.32 0.26 -0.34 0.00 0.00 178.44 180.30 2vjv s TRP 107 N -2.56 1.59 0.59 1.25 0.52 -1.26 -0.44 118.94 118.62 2vjv s TRP 107 Ca -0.15 -0.88 0.09 0.00 0.02 0.00 0.00 56.10 55.18 2vjv s TRP 107 Cb 0.05 -1.86 0.09 0.00 -1.15 0.00 0.00 33.47 30.59 2vjv s TRP 107 CO 0.86 -0.41 0.73 0.95 0.02 0.00 0.00 176.95 179.10 2vjv s THR 108 N -2.80 1.92 -2.06 2.01 -4.23 -1.25 -4.28 115.64 104.95 2vjv s THR 108 Ca 0.29 -1.11 0.12 0.00 -1.18 0.00 0.00 61.69 59.81 2vjv s THR 108 Cb -0.02 -2.03 0.30 0.00 1.34 0.00 0.00 72.50 72.09 2vjv s THR 108 CO 0.18 0.00 1.33 -0.46 -0.54 0.00 0.00 174.62 175.13 2vjv n ASN 109 N -2.18 1.20 -4.45 3.99 6.94 -1.26 -4.92 115.26 114.57 2vjv n ASN 109 Ca 0.12 -1.86 -0.22 0.00 -0.02 0.00 0.00 54.58 52.60 2vjv n ASN 109 Cb 0.62 -0.13 -0.10 0.00 -2.36 0.00 0.00 39.78 37.82 2vjv n ASN 109 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2vjv s SER 110 N -1.20 3.00 0.25 0.53 1.04 -1.26 -5.15 113.70 110.92 2vjv s SER 110 Ca 0.21 -1.18 -0.21 0.00 0.48 0.00 0.00 55.95 55.25 2vjv s SER 110 Cb 0.11 -0.21 0.03 0.00 0.10 0.00 0.00 66.02 66.05 2vjv s SER 110 CO 0.16 -0.29 0.68 0.00 0.98 0.00 0.00 173.24 174.77 2vjv s PHE 112 N -3.89 2.65 -0.02 0.00 5.36 0.44 -4.98 117.98 117.52 2vjv s PHE 112 Ca 0.10 -0.41 0.00 0.00 -0.96 0.00 0.00 56.93 55.66 2vjv s PHE 112 Cb -0.05 -1.66 0.02 0.00 -0.34 0.00 0.00 43.02 40.99 2vjv s PHE 112 CO 0.03 -0.01 -0.00 0.42 -1.46 0.00 0.00 175.22 174.20 2vjv s ILE 113 N -0.35 0.15 -0.04 3.12 1.01 -1.26 -1.34 121.20 122.49 2vjv s ILE 113 Ca 0.03 0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.74 2vjv s ILE 113 Cb -0.12 -0.23 0.03 0.00 0.01 0.00 0.00 42.46 42.15 2vjv s ILE 113 CO 0.02 0.12 0.06 -0.55 0.00 0.00 0.00 174.94 174.60 2vjv s SER 114 N 0.85 0.37 0.70 3.58 0.15 -0.48 -4.97 113.70 113.91 2vjv s SER 114 Ca -0.08 0.11 -0.14 0.00 0.70 0.00 0.00 55.95 56.53 2vjv s SER 114 Cb -0.12 -0.03 0.02 0.00 -1.71 0.00 0.00 66.02 64.19 2vjv s SER 114 CO -0.02 -0.17 1.12 0.42 1.20 0.00 0.00 173.24 175.79 2vjv s THR 115 N 1.46 3.08 0.07 6.45 -4.23 -1.26 -0.38 115.64 120.84 2vjv s THR 115 Ca -0.05 0.47 0.06 0.00 -1.18 0.00 0.00 61.69 60.99 2vjv s THR 115 Cb -0.12 -2.96 -0.03 0.00 1.34 0.00 0.00 72.50 70.72 2vjv s THR 115 CO -0.04 -0.35 -0.17 -0.69 -0.54 0.00 0.00 174.62 172.84 2vjv s VAL 116 N -2.43 1.33 0.13 2.29 1.01 -0.41 -4.81 120.40 117.52 2vjv s VAL 116 Ca 0.67 -1.30 -0.35 0.00 0.00 0.00 0.00 61.98 61.00 2vjv s VAL 116 Cb -0.21 -1.23 -0.16 0.00 0.00 0.00 0.00 36.38 34.78 2vjv s VAL 116 CO 0.46 -0.09 1.33 0.61 0.00 0.00 0.00 175.10 177.40 2vjv n GLY 117 N 1.40 0.46 0.19 4.51 0.00 -1.26 -4.15 105.19 106.33 2vjv n GLY 117 Ca -0.20 0.63 0.02 0.00 0.00 0.00 0.00 46.02 46.47 2vjv n GLY 117 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2vjv h GLY 118 N 4.38 0.04 -2.02 -0.02 0.00 -1.93 -3.45 103.07 100.06 2vjv h GLY 118 Ca -0.46 -0.03 0.08 0.00 0.00 0.00 0.00 47.33 46.92 2vjv h GLY 118 CO 0.77 0.03 0.26 0.00 0.00 0.00 0.00 176.54 177.59 2vjv s ALA 119 N -4.18 -1.26 0.46 3.60 0.00 -1.26 -4.86 121.76 114.27 2vjv s ALA 119 Ca -0.03 -0.28 -0.25 0.00 0.00 0.00 0.00 51.96 51.41 2vjv s ALA 119 Cb 0.14 0.83 -0.08 0.00 0.00 0.00 0.00 23.12 24.01 2vjv s ALA 119 CO 0.73 -1.04 1.35 -1.25 0.00 0.00 0.00 175.76 175.56 2vjv s PRO 120 N -3.83 3.66 0.41 0.00 0.04 -1.26 -4.71 135.00 129.31 2vjv s PRO 120 Ca 0.11 2.25 0.25 0.00 0.04 0.00 0.00 61.00 63.65 2vjv s PRO 120 Cb -0.06 -2.58 1.31 0.00 0.04 0.00 0.00 34.50 33.21 2vjv s PRO 120 CO 0.07 -0.78 1.66 -0.07 0.04 0.00 0.00 177.00 177.92 2vjv h LEU 121 N 2.22 0.33 -0.62 -3.56 4.07 -1.99 0.18 115.31 115.93 2vjv h LEU 121 Ca -0.50 0.14 0.06 0.00 0.08 0.00 0.00 57.88 57.65 2vjv h LEU 121 Cb 1.27 0.11 -0.05 0.00 1.08 0.00 0.00 40.66 43.06 2vjv h LEU 121 CO 0.61 -0.13 0.33 0.78 -1.08 0.00 0.00 178.44 178.95 2vjv h ASN 122 N 0.18 0.48 0.06 -0.43 4.21 -2.01 -1.98 115.58 116.08 2vjv h ASN 122 Ca 0.76 0.03 -0.23 0.00 1.21 0.00 0.00 56.30 58.07 2vjv h ASN 122 Cb 2.20 -0.06 0.02 0.00 -1.12 0.00 0.00 38.32 39.36 2vjv h ASN 122 CO -0.43 0.31 -0.93 0.58 -1.29 0.00 0.00 177.43 175.67 2vjv h VAL 123 N 0.61 1.36 -0.54 2.81 2.07 -1.02 -3.35 116.25 118.19 2vjv h VAL 123 Ca 0.28 -2.30 0.01 0.00 0.82 0.00 0.00 66.70 65.51 2vjv h VAL 123 Cb 0.19 2.67 -0.03 0.00 -1.52 0.00 0.00 31.29 32.60 2vjv h VAL 123 CO -0.18 0.68 0.35 -0.37 0.02 0.00 0.00 177.57 178.08 2vjv h VAL 124 N 0.08 1.13 -0.99 2.57 -1.51 -1.11 -2.65 116.25 113.77 2vjv h VAL 124 Ca -0.13 -0.25 0.19 0.00 -1.23 0.00 0.00 66.70 65.27 2vjv h VAL 124 Cb 1.63 0.35 -0.10 0.00 -2.13 0.00 0.00 31.29 31.04 2vjv h VAL 124 CO 0.18 0.13 0.61 0.11 -1.23 0.00 0.00 177.57 177.38 2vjv h LYS 125 N 0.72 0.72 -0.84 5.19 1.57 -1.50 0.23 116.57 122.67 2vjv h LYS 125 Ca 0.20 -0.04 0.14 0.00 -1.87 0.00 0.00 60.65 59.07 2vjv h LYS 125 Cb -0.08 -0.16 -0.06 0.00 0.08 0.00 0.00 32.23 32.01 2vjv h LYS 125 CO -0.05 0.48 0.55 0.37 -0.57 0.00 0.00 179.45 180.23 2vjv h GLN 126 N 0.74 0.59 0.00 3.15 4.15 -1.61 -0.22 115.11 121.92 2vjv h GLN 126 Ca 0.56 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.94 2vjv h GLN 126 Cb 0.90 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.46 2vjv h GLN 126 CO -0.34 0.39 -1.15 0.66 -1.93 0.00 0.00 178.83 176.46 2vjv n TYR 127 N -4.53 0.56 0.37 3.99 4.02 0.02 -4.48 117.16 117.11 2vjv n TYR 127 Ca 0.16 0.16 0.04 0.00 -0.01 0.00 0.00 57.90 58.25 2vjv n TYR 127 Cb 0.47 -0.70 -0.04 0.00 -0.02 0.00 0.00 39.34 39.06 2vjv n TYR 127 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 176.86 176.29 2vjv n ILE 128 N -2.34 0.00 -3.97 -0.72 -5.35 -0.89 -5.04 119.36 101.05 2vjv n ILE 128 Ca 0.00 -0.33 -0.08 0.00 -0.27 0.00 0.00 62.75 62.07 2vjv n ILE 128 Cb 0.51 1.02 -0.09 0.00 -1.74 0.00 0.00 39.64 39.34 2vjv n ILE 128 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2vjv s GLU 129 N -1.65 0.73 0.00 6.28 2.02 -0.13 -5.06 118.70 120.89 2vjv s GLU 129 Ca 0.04 -1.07 0.07 0.00 0.02 0.00 0.00 54.97 54.03 2vjv s GLU 129 Cb 0.06 0.28 0.43 0.00 0.10 0.00 0.00 34.13 35.00 2vjv s GLU 129 CO 0.30 -0.19 0.89 0.09 0.02 0.00 0.00 175.26 176.37