#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vju h ALA -1 N 0.00 1.15 -0.35 -0.43 0.00 -2.04 -2.66 119.26 114.93 2vju h ALA -1 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2vju h ALA -1 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2vju h ALA -1 CO 0.00 0.16 0.00 0.00 0.00 0.00 0.00 179.25 179.41 2vju n MET 0 N -3.46 2.91 -2.01 0.00 0.00 -1.26 -4.98 117.12 108.33 2vju n MET 0 Ca -0.01 -2.25 -0.42 0.00 0.00 0.00 0.00 57.70 55.02 2vju n MET 0 Cb 0.29 -1.41 -0.03 0.00 0.00 0.00 0.00 33.22 32.07 2vju n MET 0 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2vju s ALA 1 N -1.38 3.68 0.52 3.17 0.00 -1.01 -4.95 121.76 121.79 2vju s ALA 1 Ca 0.29 1.20 -0.22 0.00 0.00 0.00 0.00 51.96 53.22 2vju s ALA 1 Cb 0.17 -3.63 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 2vju s ALA 1 CO 0.15 -0.90 1.32 0.45 0.00 0.00 0.00 175.76 176.78 2vju s SER 2 N 1.74 5.53 0.00 0.00 0.15 -1.26 -4.90 113.70 114.96 2vju s SER 2 Ca 0.70 2.67 0.21 0.00 0.70 0.00 0.00 55.95 60.23 2vju s SER 2 Cb -0.39 -2.63 0.16 0.00 -1.71 0.00 0.00 66.02 61.45 2vju s SER 2 CO 0.31 -1.39 1.17 0.59 1.20 0.00 0.00 173.24 175.12 2vju n ASN 3 N -0.84 2.74 -4.77 5.45 3.02 -1.26 -4.95 115.26 114.65 2vju n ASN 3 Ca 0.09 -1.87 -0.40 0.00 -0.03 0.00 0.00 54.58 52.37 2vju n ASN 3 Cb 0.45 0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.63 2vju n ASN 3 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vju s ALA 4 N -1.78 3.42 0.43 5.41 0.00 -1.26 -4.39 121.76 123.58 2vju s ALA 4 Ca 0.25 1.31 -0.24 0.00 0.00 0.00 0.00 51.96 53.27 2vju s ALA 4 Cb 0.18 -3.50 -0.08 0.00 0.00 0.00 0.00 23.12 19.71 2vju s ALA 4 CO 0.27 -0.79 1.21 0.54 0.00 0.00 0.00 175.76 176.99 2vju s VAL 5 N -1.18 2.96 -0.22 0.00 0.11 -1.26 -5.02 120.40 115.79 2vju s VAL 5 Ca 0.53 0.78 -0.04 0.00 -2.93 0.00 0.00 61.98 60.31 2vju s VAL 5 Cb -0.40 -3.42 0.08 0.00 -1.53 0.00 0.00 36.38 31.10 2vju s VAL 5 CO 0.53 0.05 0.10 -0.76 -3.33 0.00 0.00 175.10 171.69 2vju s LEU 6 N -2.73 0.51 0.61 2.54 1.43 -1.26 -5.14 118.68 114.63 2vju s LEU 6 Ca 0.60 -0.90 -0.15 0.00 -1.03 0.00 0.00 54.13 52.65 2vju s LEU 6 Cb -0.32 -0.32 -0.03 0.00 0.03 0.00 0.00 46.19 45.55 2vju s LEU 6 CO 0.40 -0.38 1.05 -0.31 0.23 0.00 0.00 176.35 177.34 2vju s TYR 7 N 2.10 3.06 0.28 0.29 2.02 -1.26 -4.88 117.35 118.96 2vju s TYR 7 Ca 0.05 1.49 0.06 0.00 -0.37 0.00 0.00 57.07 58.30 2vju s TYR 7 Cb -0.16 -2.96 -0.02 0.00 -0.40 0.00 0.00 41.96 38.42 2vju s TYR 7 CO -0.20 -1.06 0.23 0.36 -1.57 0.00 0.00 175.55 173.31 2vju n LYS 8 N -2.22 0.36 -3.46 -0.62 2.85 -0.81 -4.96 118.16 109.29 2vju n LYS 8 Ca 0.08 -2.80 -0.13 0.00 -1.05 0.00 0.00 58.31 54.42 2vju n LYS 8 Cb 0.53 2.26 -0.03 0.00 -0.65 0.00 0.00 35.03 37.14 2vju n LYS 8 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2vju s SER 9 N -2.96 -0.54 0.00 -5.58 1.04 -1.26 -0.97 113.70 103.43 2vju s SER 9 Ca 0.33 0.07 0.00 0.00 0.48 0.00 0.00 55.95 56.83 2vju s SER 9 Cb 0.02 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.71 2vju s SER 9 CO 0.23 -0.90 0.00 -0.46 0.98 0.00 0.00 173.24 173.09 2vju n ASN 10 N -0.15 0.84 0.25 7.02 0.23 -0.76 -5.00 115.26 117.69 2vju n ASN 10 Ca -0.17 -0.33 0.08 0.00 -0.53 0.00 0.00 54.58 53.63 2vju n ASN 10 Cb 0.64 0.00 0.63 0.00 -2.08 0.00 0.00 39.78 38.97 2vju n ASN 10 CO 0.00 0.00 0.00 0.45 -0.93 0.00 0.00 177.26 176.78 2vju h HIS 11 N 0.14 0.00 0.00 -2.53 3.86 -2.06 -3.34 115.15 111.22 2vju h HIS 11 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2vju h HIS 11 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2vju h HIS 11 CO 0.00 0.08 -0.02 0.09 0.86 0.00 0.00 177.93 178.94 2vju n ASN 12 N -4.29 0.11 -4.07 2.45 3.02 -1.26 -5.07 115.26 106.15 2vju n ASN 12 Ca -0.03 -0.34 -0.23 0.00 -0.03 0.00 0.00 54.58 53.96 2vju n ASN 12 Cb 0.16 0.69 -0.16 0.00 -0.61 0.00 0.00 39.78 39.87 2vju n ASN 12 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2vju s VAL 13 N -0.72 1.08 -0.17 2.41 1.01 -1.25 -5.11 120.40 117.65 2vju s VAL 13 Ca 0.00 -0.54 -0.08 0.00 0.00 0.00 0.00 61.98 61.37 2vju s VAL 13 Cb 0.00 -0.94 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 2vju s VAL 13 CO 0.00 0.32 0.08 -0.69 0.00 0.00 0.00 175.10 174.81 2vju s VAL 14 N 0.05 4.92 0.29 2.92 1.01 -1.26 -1.83 120.40 126.50 2vju s VAL 14 Ca -0.02 0.01 -0.13 0.00 0.00 0.00 0.00 61.98 61.84 2vju s VAL 14 Cb -0.09 -3.21 0.01 0.00 0.00 0.00 0.00 36.38 33.09 2vju s VAL 14 CO 0.01 0.48 0.57 -0.72 0.00 0.00 0.00 175.10 175.44 2vju s TYR 15 N 0.19 0.33 -0.29 5.22 -0.85 -0.14 -4.97 117.35 116.83 2vju s TYR 15 Ca 0.05 -0.74 0.04 0.00 -0.52 0.00 0.00 57.07 55.90 2vju s TYR 15 Cb -0.12 0.35 0.20 0.00 0.38 0.00 0.00 41.96 42.77 2vju s TYR 15 CO 0.00 -1.16 0.64 0.45 -1.52 0.00 0.00 175.55 173.96 2vju s SER 16 N -3.04 -1.50 -0.20 -0.18 0.15 -1.26 -1.91 113.70 105.75 2vju s SER 16 Ca 0.20 0.21 -0.00 0.00 0.70 0.00 0.00 55.95 57.06 2vju s SER 16 Cb -0.02 1.97 0.05 0.00 -1.71 0.00 0.00 66.02 66.31 2vju s SER 16 CO 0.11 -0.28 -0.04 0.00 1.20 0.00 0.00 173.24 174.23 2vju s LYS 18 N 1.57 2.86 -0.00 0.00 1.02 -1.25 -0.87 119.74 123.07 2vju s LYS 18 Ca -0.02 -0.71 0.06 0.00 0.02 0.00 0.00 55.97 55.32 2vju s LYS 18 Cb -0.17 -2.46 -0.02 0.00 -0.52 0.00 0.00 37.83 34.66 2vju s LYS 18 CO -0.07 0.44 -0.20 0.71 -0.92 0.00 0.00 175.35 175.30 2vju s TYR 19 N -0.24 1.79 -0.36 3.18 1.51 0.13 -1.20 117.35 122.15 2vju s TYR 19 Ca 0.01 -0.35 -0.12 0.00 -1.01 0.00 0.00 57.07 55.61 2vju s TYR 19 Cb -0.13 -1.13 0.01 0.00 -0.11 0.00 0.00 41.96 40.60 2vju s TYR 19 CO 0.03 -0.00 0.22 -1.58 -1.11 0.00 0.00 175.55 173.10 2vju s HIS 20 N -0.54 3.22 -0.08 2.71 5.65 0.14 -0.80 115.29 125.60 2vju s HIS 20 Ca 0.08 -0.68 0.02 0.00 0.25 0.00 0.00 55.06 54.72 2vju s HIS 20 Cb -0.08 -2.45 -0.02 0.00 -1.18 0.00 0.00 32.58 28.84 2vju s HIS 20 CO -0.00 -0.55 -0.12 0.42 -0.65 0.00 0.00 174.74 173.85 2vju s ILE 21 N 1.62 3.25 -0.01 0.89 1.01 0.15 -0.79 121.20 127.32 2vju s ILE 21 Ca 0.04 -0.63 -0.01 0.00 0.00 0.00 0.00 60.65 60.05 2vju s ILE 21 Cb -0.18 -2.31 0.00 0.00 0.01 0.00 0.00 42.46 39.97 2vju s ILE 21 CO 0.08 0.57 0.02 -0.69 0.00 0.00 0.00 174.94 174.92 2vju s VAL 22 N -0.46 -0.00 0.14 2.92 1.01 0.22 -1.56 120.40 122.66 2vju s VAL 22 Ca 0.06 0.00 -0.16 0.00 0.00 0.00 0.00 61.98 61.88 2vju s VAL 22 Cb -0.12 -0.04 0.03 0.00 0.00 0.00 0.00 36.38 36.25 2vju s VAL 22 CO 0.02 0.00 0.41 -1.66 0.00 0.00 0.00 175.10 173.88 2vju s TRP 23 N 0.03 -0.17 0.18 5.22 -2.14 -1.19 -0.16 118.94 120.72 2vju s TRP 23 Ca -0.00 -0.15 0.04 0.00 2.66 0.00 0.00 56.10 58.65 2vju s TRP 23 Cb -0.00 0.27 -0.05 0.00 -3.10 0.00 0.00 33.47 30.59 2vju s TRP 23 CO -0.00 -0.73 -0.06 0.00 -2.66 0.00 0.00 176.95 173.49 2vju s PRO 25 N -3.79 1.32 0.38 0.00 0.02 -1.26 -3.57 135.00 128.10 2vju s PRO 25 Ca 0.22 0.85 -0.28 0.00 0.02 0.00 0.00 61.00 61.81 2vju s PRO 25 Cb 0.04 -1.81 -0.11 0.00 0.02 0.00 0.00 34.50 32.63 2vju s PRO 25 CO 0.04 -2.20 1.44 1.17 -0.33 0.00 0.00 177.00 177.12 2vju n LYS 26 N -3.86 2.52 -1.32 5.54 3.00 0.53 -1.31 118.16 123.27 2vju n LYS 26 Ca 0.07 0.89 -0.12 0.00 -0.00 0.00 0.00 58.31 59.15 2vju n LYS 26 Cb 0.55 -2.59 -0.05 0.00 0.00 0.00 0.00 35.03 32.94 2vju n LYS 26 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2vju n TYR 27 N 0.35 -0.02 -3.21 5.64 0.53 -1.26 -2.08 117.16 117.11 2vju n TYR 27 Ca 0.02 0.00 -0.23 0.00 -1.02 0.00 0.00 57.90 56.67 2vju n TYR 27 Cb 0.38 -2.78 0.02 0.00 -1.03 0.00 0.00 39.34 35.93 2vju n TYR 27 CO 0.00 0.00 0.00 -2.13 -1.02 0.00 0.00 176.86 173.71 2vju n ARG 28 N -0.92 -4.51 -2.38 -0.72 0.63 -0.42 -4.94 116.66 103.40 2vju n ARG 28 Ca -0.12 0.73 -0.39 0.00 -0.92 0.00 0.00 57.85 57.16 2vju n ARG 28 Cb 0.59 -5.55 -0.03 0.00 0.45 0.00 0.00 32.46 27.92 2vju n ARG 28 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2vju s ARG 29 N -5.89 4.26 -1.59 -0.14 0.52 -0.88 -4.83 118.95 110.40 2vju s ARG 29 Ca 0.37 1.80 -0.10 0.00 -0.52 0.00 0.00 55.73 57.27 2vju s ARG 29 Cb -0.18 -2.82 -0.06 0.00 0.52 0.00 0.00 34.95 32.41 2vju s ARG 29 CO 0.45 -0.13 2.82 1.63 0.02 0.00 0.00 175.30 180.10 2vju n LYS 30 N 0.41 3.62 0.03 3.54 5.02 -1.26 -4.41 118.16 125.11 2vju n LYS 30 Ca 0.03 -2.33 0.11 0.00 -2.02 0.00 0.00 58.31 54.10 2vju n LYS 30 Cb 0.46 -2.87 0.05 0.00 -0.02 0.00 0.00 35.03 32.65 2vju n LYS 30 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 2vju n VAL 31 N 3.73 0.18 -2.04 -0.18 0.24 -0.98 -4.58 118.33 114.71 2vju n VAL 31 Ca 0.74 -0.23 -0.42 0.00 -2.04 0.00 0.00 64.34 62.39 2vju n VAL 31 Cb 0.26 0.18 0.00 0.00 -1.47 0.00 0.00 33.84 32.81 2vju n VAL 31 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2vju n LEU 32 N -1.95 6.85 -4.35 1.34 4.77 -0.15 -4.70 117.00 118.81 2vju n LEU 32 Ca 0.02 -4.43 -0.20 0.00 -0.03 0.00 0.00 56.01 51.37 2vju n LEU 32 Cb 0.43 -1.55 -0.08 0.00 -2.33 0.00 0.00 43.42 39.88 2vju n LEU 32 CO 0.39 1.31 -0.16 0.68 -1.33 0.00 0.00 177.39 178.28 2vju s VAL 33 N 1.59 0.23 0.00 4.08 -7.23 -1.26 -3.03 120.40 114.77 2vju s VAL 33 Ca 0.44 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.61 2vju s VAL 33 Cb 0.12 -2.46 0.00 0.00 0.56 0.00 0.00 36.38 34.60 2vju s VAL 33 CO -0.04 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.36 2vju n GLY 34 N -0.67 2.52 0.30 2.32 0.00 -1.26 -1.85 105.19 106.55 2vju n GLY 34 Ca 0.02 -0.08 -0.08 0.00 0.00 0.00 0.00 46.02 45.88 2vju n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vju h ALA 35 N -0.24 0.85 -0.95 4.61 0.00 -1.98 -2.81 119.26 118.74 2vju h ALA 35 Ca 0.00 -0.23 0.16 0.00 0.00 0.00 0.00 54.91 54.85 2vju h ALA 35 Cb 0.00 -0.25 -0.10 0.00 0.00 0.00 0.00 17.79 17.44 2vju h ALA 35 CO 0.00 0.55 0.56 0.28 0.00 0.00 0.00 179.25 180.64 2vju h VAL 36 N 0.95 0.75 -0.12 0.00 2.07 -1.73 -0.86 116.25 117.31 2vju h VAL 36 Ca 0.21 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 2vju h VAL 36 Cb 0.33 -0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.02 2vju h VAL 36 CO -0.00 0.14 -0.02 -0.08 0.02 0.00 0.00 177.57 177.63 2vju h GLU 37 N 0.76 0.22 -0.99 1.57 4.81 -1.11 -0.70 114.58 119.13 2vju h GLU 37 Ca 0.53 -0.08 0.01 0.00 -0.13 0.00 0.00 59.36 59.69 2vju h GLU 37 Cb 0.75 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.07 2vju h GLU 37 CO -0.36 0.50 0.65 1.98 -0.73 0.00 0.00 179.01 181.05 2vju h MET 38 N -0.09 1.31 -0.28 1.92 4.05 -1.22 -2.32 114.93 118.31 2vju h MET 38 Ca 0.03 -0.09 -0.19 0.00 -0.28 0.00 0.00 59.70 59.18 2vju h MET 38 Cb 0.42 -0.29 0.00 0.00 -0.80 0.00 0.00 31.60 30.93 2vju h MET 38 CO 0.01 0.88 -0.55 0.00 0.23 0.00 0.00 176.91 177.47 2vju h ARG 39 N 1.35 0.87 -0.09 0.39 2.47 -1.14 -2.32 114.38 115.92 2vju h ARG 39 Ca 0.36 -0.56 0.03 0.00 -1.26 0.00 0.00 59.98 58.55 2vju h ARG 39 Cb -0.14 0.07 -0.04 0.00 -1.65 0.00 0.00 29.97 28.22 2vju h ARG 39 CO -0.08 1.19 -0.13 1.25 0.56 0.00 0.00 179.97 182.77 2vju h LEU 40 N 0.65 -0.39 -0.91 3.04 5.85 -0.75 0.15 115.31 122.95 2vju h LEU 40 Ca 0.01 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 2vju h LEU 40 Cb 1.17 0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.34 2vju h LEU 40 CO 0.12 -0.17 0.49 0.11 -0.34 0.00 0.00 178.44 178.65 2vju h LYS 41 N -0.17 1.26 -0.19 1.25 1.57 -1.45 -0.12 116.57 118.73 2vju h LYS 41 Ca 0.07 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2vju h LYS 41 Cb 0.28 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 2vju h LYS 41 CO -0.19 0.93 0.10 0.93 -0.57 0.00 0.00 179.45 180.65 2vju h GLU 42 N 1.27 0.26 -0.04 3.15 5.08 -0.73 -0.91 114.58 122.66 2vju h GLU 42 Ca 0.32 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.66 2vju h GLU 42 Cb 0.03 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2vju h GLU 42 CO -0.05 0.27 -0.06 0.82 -1.00 0.00 0.00 179.01 178.99 2vju h ILE 43 N 0.19 0.84 -0.64 3.13 2.04 -0.30 -0.83 117.51 121.93 2vju h ILE 43 Ca 0.07 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.94 2vju h ILE 43 Cb 0.09 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 2vju h ILE 43 CO -0.01 0.00 0.43 0.40 0.00 0.00 0.00 178.15 178.97 2vju h ILE 44 N -0.08 1.15 -0.68 -0.67 2.04 -0.93 -0.19 117.51 118.15 2vju h ILE 44 Ca 0.04 -0.29 -0.05 0.00 1.00 0.00 0.00 64.86 65.56 2vju h ILE 44 Cb 0.14 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 36.41 2vju h ILE 44 CO -0.09 0.15 0.22 1.56 0.00 0.00 0.00 178.15 180.00 2vju h GLN 45 N 0.85 1.03 -0.32 2.37 1.08 -0.24 0.16 115.11 120.04 2vju h GLN 45 Ca 0.24 -0.20 -0.03 0.00 -1.45 0.00 0.00 58.65 57.20 2vju h GLN 45 Cb -0.06 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.20 2vju h GLN 45 CO -0.06 0.87 0.07 0.93 -0.95 0.00 0.00 178.83 179.70 2vju h GLU 46 N 1.00 0.52 -0.45 1.46 5.08 0.27 -1.52 114.58 120.95 2vju h GLU 46 Ca 0.22 -0.13 0.01 0.00 -1.00 0.00 0.00 59.36 58.46 2vju h GLU 46 Cb 0.26 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 2vju h GLU 46 CO -0.01 0.60 0.28 0.28 -1.00 0.00 0.00 179.01 179.16 2vju h VAL 47 N 0.36 1.08 -0.02 3.13 2.07 -0.52 -1.08 116.25 121.27 2vju h VAL 47 Ca 0.10 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.45 2vju h VAL 47 Cb 0.32 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 2vju h VAL 47 CO 0.00 0.10 -0.11 0.00 0.02 0.00 0.00 177.57 177.58 2vju h ALA 48 N 1.18 -0.11 -0.54 1.67 0.00 -0.48 0.55 119.26 121.52 2vju h ALA 48 Ca 0.17 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.15 2vju h ALA 48 Cb -0.03 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 2vju h ALA 48 CO -0.06 -0.60 0.26 -0.22 0.00 0.00 0.00 179.25 178.63 2vju h LYS 49 N -0.18 0.47 -0.45 0.00 3.64 -1.00 0.11 116.57 119.16 2vju h LYS 49 Ca 0.05 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.33 2vju h LYS 49 Cb 0.25 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 2vju h LYS 49 CO -0.13 0.31 0.01 0.93 -2.27 0.00 0.00 179.45 178.30 2vju h GLU 50 N 0.49 0.73 -0.61 1.90 5.08 -0.65 -3.01 114.58 118.49 2vju h GLU 50 Ca 0.25 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2vju h GLU 50 Cb 0.20 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2vju h GLU 50 CO -0.20 0.73 0.00 1.28 -1.00 0.00 0.00 179.01 179.82 2vju n LEU 51 N -4.23 3.57 -2.91 1.33 4.32 0.13 -4.92 117.00 114.29 2vju n LEU 51 Ca 0.02 -1.79 -0.21 0.00 -0.02 0.00 0.00 56.01 54.02 2vju n LEU 51 Cb 0.28 -0.46 0.01 0.00 -1.62 0.00 0.00 43.42 41.63 2vju n LEU 51 CO 0.41 0.73 -0.08 0.54 -1.22 0.00 0.00 177.39 177.77 2vju n ARG 52 N 1.06 -3.53 -4.05 3.23 1.74 -0.31 -4.95 116.66 109.85 2vju n ARG 52 Ca 0.20 0.76 -0.36 0.00 -0.77 0.00 0.00 57.85 57.69 2vju n ARG 52 Cb 0.62 -5.50 -0.08 0.00 -1.02 0.00 0.00 32.46 26.48 2vju n ARG 52 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2vju s VAL 53 N -2.99 4.94 -0.33 1.55 1.01 0.23 -4.75 120.40 120.06 2vju s VAL 53 Ca 0.23 0.00 -0.12 0.00 0.00 0.00 0.00 61.98 62.09 2vju s VAL 53 Cb -0.11 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.09 2vju s VAL 53 CO 0.28 0.56 0.22 -0.70 0.00 0.00 0.00 175.10 175.46 2vju s GLU 54 N -0.49 3.47 -0.50 2.72 2.12 -0.84 -4.15 118.70 121.04 2vju s GLU 54 Ca 0.10 -0.65 -0.29 0.00 0.36 0.00 0.00 54.97 54.50 2vju s GLU 54 Cb -0.12 -3.76 0.03 0.00 0.26 0.00 0.00 34.13 30.55 2vju s GLU 54 CO 0.02 -0.43 1.13 0.42 -0.54 0.00 0.00 175.26 175.86 2vju s ILE 55 N 1.70 4.18 0.06 -3.70 -1.09 -1.26 -1.00 121.20 120.10 2vju s ILE 55 Ca 0.06 1.12 -0.07 0.00 -2.23 0.00 0.00 60.65 59.53 2vju s ILE 55 Cb -0.17 -4.62 -0.30 0.00 -1.58 0.00 0.00 42.46 35.79 2vju s ILE 55 CO 0.10 -1.07 1.10 0.40 -1.23 0.00 0.00 174.94 174.23 2vju h ILE 56 N 6.21 1.44 -2.32 2.92 2.04 -0.58 -3.47 117.51 123.75 2vju h ILE 56 Ca -0.23 -2.98 -0.07 0.00 1.00 0.00 0.00 64.86 62.57 2vju h ILE 56 Cb 1.06 2.96 -0.22 0.00 -0.74 0.00 0.00 36.82 39.89 2vju h ILE 56 CO 1.13 0.87 -0.01 -0.70 0.00 0.00 0.00 178.15 179.45 2vju s GLU 57 N -2.64 0.73 -0.20 2.37 2.56 -0.91 -4.96 118.70 115.64 2vju s GLU 57 Ca -0.05 0.70 -0.07 0.00 0.00 0.00 0.00 54.97 55.54 2vju s GLU 57 Cb 0.06 0.35 0.09 0.00 2.00 0.00 0.00 34.13 36.64 2vju s GLU 57 CO 0.90 -0.12 0.44 1.41 -0.56 0.00 0.00 175.26 177.33 2vju s MET 58 N 0.05 0.35 -0.02 4.30 -2.45 -1.26 0.29 119.30 120.57 2vju s MET 58 Ca -0.02 1.05 0.01 0.00 -1.25 0.00 0.00 55.69 55.47 2vju s MET 58 Cb -0.04 0.33 0.02 0.00 1.25 0.00 0.00 34.83 36.39 2vju s MET 58 CO 0.02 -0.24 -0.02 -0.65 1.05 0.00 0.00 175.02 175.18 2vju s GLN 59 N 2.50 0.42 0.11 4.11 -1.52 0.03 -5.01 119.66 120.31 2vju s GLN 59 Ca -0.03 -0.04 0.03 0.00 -1.95 0.00 0.00 55.36 53.38 2vju s GLN 59 Cb -0.12 -0.50 -0.04 0.00 -0.22 0.00 0.00 33.01 32.13 2vju s GLN 59 CO -0.13 -0.05 0.13 0.95 -0.25 0.00 0.00 175.29 175.94 2vju s THR 60 N 0.63 4.71 -0.40 -0.19 -4.23 -1.26 -0.29 115.64 114.61 2vju s THR 60 Ca -0.07 -0.81 0.10 0.00 -1.18 0.00 0.00 61.69 59.73 2vju s THR 60 Cb -0.10 -3.33 0.33 0.00 1.34 0.00 0.00 72.50 70.74 2vju s THR 60 CO -0.01 0.03 0.84 -0.67 -0.54 0.00 0.00 174.62 174.27 2vju n ASP 61 N 0.08 -0.22 0.00 3.99 4.64 0.34 -4.98 116.55 120.41 2vju n ASP 61 Ca -0.08 -3.20 0.00 0.00 -1.38 0.00 0.00 54.79 50.13 2vju n ASP 61 Cb 0.53 0.18 0.00 0.00 -1.04 0.00 0.00 41.12 40.79 2vju n ASP 61 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 2vju n LYS 62 N 0.39 0.00 -0.31 -0.67 5.02 -1.17 -3.68 118.16 117.74 2vju n LYS 62 Ca 0.19 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.56 2vju n LYS 62 Cb 0.66 0.00 0.21 0.00 -0.02 0.00 0.00 35.03 35.88 2vju n LYS 62 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2vju n ASP 63 N 1.76 3.14 -3.61 4.39 3.85 -1.26 -0.98 116.55 123.84 2vju n ASP 63 Ca 0.00 -3.11 0.00 0.00 -0.71 0.00 0.00 54.79 50.98 2vju n ASP 63 Cb 0.00 -0.50 -0.01 0.00 -1.35 0.00 0.00 41.12 39.26 2vju n ASP 63 CO 0.00 0.00 0.00 -1.38 -1.01 0.00 0.00 177.20 174.81 2vju s HIS 64 N -2.88 -0.05 0.00 2.11 -3.43 -1.24 -4.14 115.29 105.66 2vju s HIS 64 Ca 0.38 -0.01 0.01 0.00 -0.80 0.00 0.00 55.06 54.63 2vju s HIS 64 Cb 0.32 0.53 -0.00 0.00 -1.43 0.00 0.00 32.58 32.00 2vju s HIS 64 CO 0.06 -0.20 -0.02 -1.50 -2.00 0.00 0.00 174.74 171.08 2vju s ILE 65 N -2.33 0.17 -0.13 -5.38 2.07 -0.85 -0.50 121.20 114.24 2vju s ILE 65 Ca 0.13 -0.20 -0.01 0.00 -1.41 0.00 0.00 60.65 59.16 2vju s ILE 65 Cb 0.03 -0.17 -0.02 0.00 0.13 0.00 0.00 42.46 42.44 2vju s ILE 65 CO -0.04 -0.02 -0.11 -1.00 -1.91 0.00 0.00 174.94 171.85 2vju s HIS 66 N -0.23 2.85 0.03 3.50 3.76 0.60 -3.15 115.29 122.65 2vju s HIS 66 Ca -0.01 -0.57 0.04 0.00 -0.15 0.00 0.00 55.06 54.37 2vju s HIS 66 Cb -0.02 -1.86 -0.02 0.00 1.11 0.00 0.00 32.58 31.79 2vju s HIS 66 CO -0.00 -0.17 -0.13 0.42 -0.85 0.00 0.00 174.74 174.00 2vju s ILE 67 N 0.33 1.05 -0.29 0.60 1.01 -0.60 -0.79 121.20 122.51 2vju s ILE 67 Ca -0.09 -0.87 0.01 0.00 0.00 0.00 0.00 60.65 59.70 2vju s ILE 67 Cb -0.16 -0.94 0.08 0.00 0.01 0.00 0.00 42.46 41.46 2vju s ILE 67 CO 0.05 0.07 0.02 -0.22 0.00 0.00 0.00 174.94 174.86 2vju s LEU 68 N -0.92 3.15 0.04 2.97 2.96 0.15 -0.68 118.68 126.35 2vju s LEU 68 Ca 0.02 -1.60 0.08 0.00 -0.22 0.00 0.00 54.13 52.41 2vju s LEU 68 Cb -0.07 -1.23 -0.03 0.00 0.50 0.00 0.00 46.19 45.36 2vju s LEU 68 CO 0.01 -0.33 -0.22 0.00 -1.32 0.00 0.00 176.35 174.49 2vju s ALA 69 N 1.30 2.43 -0.39 5.97 0.00 0.02 0.23 121.76 131.33 2vju s ALA 69 Ca 0.03 -1.23 -0.11 0.00 0.00 0.00 0.00 51.96 50.65 2vju s ALA 69 Cb -0.18 -0.61 0.04 0.00 0.00 0.00 0.00 23.12 22.36 2vju s ALA 69 CO -0.12 0.55 0.23 0.34 0.00 0.00 0.00 175.76 176.77 2vju s ASP 70 N -1.34 5.77 0.09 0.00 3.68 -0.17 0.19 116.67 124.88 2vju s ASP 70 Ca 0.13 -1.10 0.07 0.00 2.13 0.00 0.00 52.55 53.78 2vju s ASP 70 Cb -0.10 -2.03 -0.03 0.00 -1.45 0.00 0.00 42.92 39.30 2vju s ASP 70 CO 0.04 -0.43 -0.18 -0.63 0.13 0.00 0.00 175.17 174.10 2vju s ILE 71 N 1.54 1.43 -0.03 4.11 1.01 -0.05 -1.98 121.20 127.23 2vju s ILE 71 Ca 0.02 -1.44 -0.30 0.00 0.00 0.00 0.00 60.65 58.93 2vju s ILE 71 Cb -0.20 -1.33 -0.05 0.00 0.01 0.00 0.00 42.46 40.89 2vju s ILE 71 CO 0.06 -0.15 1.44 -0.62 0.00 0.00 0.00 174.94 175.68 2vju s ASP 72 N -1.84 6.82 0.49 3.58 -1.08 -1.26 -4.14 116.67 119.23 2vju s ASP 72 Ca 0.03 2.10 0.18 0.00 -0.52 0.00 0.00 52.55 54.33 2vju s ASP 72 Cb -0.10 -2.55 1.20 0.00 -1.46 0.00 0.00 42.92 40.01 2vju s ASP 72 CO 0.03 -0.77 2.06 1.55 0.52 0.00 0.00 175.17 178.56 2vju h PRO 73 N 8.25 0.00 -0.13 4.34 0.13 -1.97 -1.42 132.00 141.20 2vju h PRO 73 Ca -0.37 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.64 2vju h PRO 73 Cb 1.17 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2vju h PRO 73 CO 0.92 0.11 -0.45 0.77 -0.23 0.00 0.00 178.00 179.13 2vju h SER 74 N 0.00 0.35 -0.28 1.44 0.02 -2.01 -3.02 113.55 110.05 2vju h SER 74 Ca -0.00 -0.16 -0.03 0.00 -0.84 0.00 0.00 61.79 60.76 2vju h SER 74 Cb 0.22 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 2vju h SER 74 CO 0.01 0.75 0.04 0.15 -1.14 0.00 0.00 176.83 176.65 2vju h PHE 75 N 0.27 0.49 0.00 3.45 3.57 -1.67 -3.49 116.94 119.55 2vju h PHE 75 Ca 0.02 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.45 2vju h PHE 75 Cb 0.90 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.51 2vju h PHE 75 CO 0.02 0.57 0.00 0.41 -2.23 0.00 0.00 178.31 177.08 2vju n GLY 76 N -0.45 1.41 0.31 2.40 0.00 -0.83 -4.58 105.19 103.45 2vju n GLY 76 Ca -0.03 -1.21 0.09 0.00 0.00 0.00 0.00 46.02 44.87 2vju n GLY 76 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2vju h VAL 77 N 0.00 0.98 -0.31 1.61 3.04 -1.85 -1.13 116.25 118.59 2vju h VAL 77 Ca 0.00 -0.09 -0.07 0.00 -1.01 0.00 0.00 66.70 65.53 2vju h VAL 77 Cb 0.00 0.69 -0.02 0.00 -2.01 0.00 0.00 31.29 29.96 2vju h VAL 77 CO 0.00 0.05 -0.11 0.24 -1.01 0.00 0.00 177.57 176.74 2vju h MET 78 N 0.26 0.52 -0.78 4.17 2.86 -1.99 -1.44 114.93 118.54 2vju h MET 78 Ca 0.14 -0.15 -0.05 0.00 -2.06 0.00 0.00 59.70 57.58 2vju h MET 78 Cb 0.22 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.79 2vju h MET 78 CO -0.03 0.63 0.30 0.87 1.06 0.00 0.00 176.91 179.74 2vju h LYS 79 N 0.49 1.17 0.40 1.72 1.57 -1.45 0.16 116.57 120.62 2vju h LYS 79 Ca 0.09 -0.22 -0.02 0.00 -1.87 0.00 0.00 60.65 58.63 2vju h LYS 79 Cb 0.48 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.61 2vju h LYS 79 CO 0.03 0.96 -0.19 0.35 -0.57 0.00 0.00 179.45 180.02 2vju h PHE 80 N 1.13 -0.50 -0.52 -1.35 3.57 -1.42 -1.89 116.94 115.96 2vju h PHE 80 Ca 0.26 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.82 2vju h PHE 80 Cb 0.23 0.16 -0.06 0.00 2.79 0.00 0.00 35.95 39.08 2vju h PHE 80 CO 0.02 -0.19 0.19 0.82 -2.23 0.00 0.00 178.31 176.92 2vju h ILE 81 N -0.78 0.82 -0.86 1.41 2.04 -1.14 0.21 117.51 119.22 2vju h ILE 81 Ca -0.05 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.68 2vju h ILE 81 Cb 0.53 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 2vju h ILE 81 CO 0.09 0.07 0.55 0.50 0.00 0.00 0.00 178.15 179.35 2vju h LYS 82 N 0.37 1.14 -0.00 2.37 3.64 -0.69 0.84 116.57 124.24 2vju h LYS 82 Ca 0.25 -0.08 -0.16 0.00 -1.27 0.00 0.00 60.65 59.39 2vju h LYS 82 Cb 0.27 -0.25 0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2vju h LYS 82 CO -0.25 0.78 -0.63 1.15 -2.27 0.00 0.00 179.45 178.23 2vju h THR 83 N 1.17 1.42 -0.05 1.00 2.02 -0.67 -0.23 112.91 117.56 2vju h THR 83 Ca 0.31 -2.09 -0.00 0.00 0.77 0.00 0.00 66.41 65.40 2vju h THR 83 Cb -0.10 2.59 -0.00 0.00 -1.74 0.00 0.00 68.15 68.90 2vju h THR 83 CO -0.06 0.61 0.03 0.00 0.37 0.00 0.00 175.52 176.47 2vju h ALA 84 N 0.32 0.06 0.37 6.16 0.00 -0.41 0.72 119.26 126.48 2vju h ALA 84 Ca -0.08 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2vju h ALA 84 Cb 1.34 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2vju h ALA 84 CO 0.12 -0.41 -0.18 0.87 0.00 0.00 0.00 179.25 179.66 2vju h LYS 85 N 0.02 -0.47 -0.57 0.00 1.57 -0.89 -1.71 116.57 114.51 2vju h LYS 85 Ca 0.02 0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.90 2vju h LYS 85 Cb 0.05 0.11 -0.06 0.00 0.08 0.00 0.00 32.23 32.41 2vju h LYS 85 CO -0.00 -0.16 0.26 0.78 -0.57 0.00 0.00 179.45 179.75 2vju h GLY 86 N -0.82 0.81 0.88 3.86 0.00 -1.03 0.12 103.07 106.88 2vju h GLY 86 Ca -0.05 -0.16 -0.12 0.00 0.00 0.00 0.00 47.33 47.00 2vju h GLY 86 CO 0.08 0.06 -0.39 -0.09 0.00 0.00 0.00 176.54 176.20 2vju h ARG 87 N 0.48 0.54 -0.49 4.80 2.43 -0.91 -2.58 114.38 118.65 2vju h ARG 87 Ca 0.27 -0.37 0.04 0.00 -0.81 0.00 0.00 59.98 59.11 2vju h ARG 87 Cb 0.25 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 2vju h ARG 87 CO -0.23 0.99 0.33 0.66 -1.51 0.00 0.00 179.97 180.21 2vju h SER 88 N 0.18 0.46 0.67 -3.80 4.64 -1.09 -1.23 113.55 113.37 2vju h SER 88 Ca -0.00 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 2vju h SER 88 Cb 1.00 -0.11 0.01 0.00 -0.31 0.00 0.00 62.40 62.99 2vju h SER 88 CO 0.08 0.31 -0.32 -1.28 -0.87 0.00 0.00 176.83 174.76 2vju h SER 89 N 0.53 -0.76 -0.26 4.97 0.87 -0.83 0.28 113.55 118.35 2vju h SER 89 Ca 0.20 -0.00 0.06 0.00 -1.23 0.00 0.00 61.79 60.82 2vju h SER 89 Cb 0.14 0.20 -0.08 0.00 -0.44 0.00 0.00 62.40 62.22 2vju h SER 89 CO -0.05 -0.39 -0.31 -0.09 -0.53 0.00 0.00 176.83 175.45 2vju h ARG 90 N -1.16 -0.30 0.12 2.24 9.65 -1.21 -0.42 114.38 123.30 2vju h ARG 90 Ca -0.09 0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.80 2vju h ARG 90 Cb 0.72 0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.37 2vju h ARG 90 CO 0.15 -0.20 -0.06 0.82 2.80 0.00 0.00 179.97 183.48 2vju h ILE 91 N -0.31 1.01 -0.32 1.20 2.04 -1.25 -1.95 117.51 117.93 2vju h ILE 91 Ca 0.13 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 2vju h ILE 91 Cb 0.53 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.93 2vju h ILE 91 CO -0.43 0.13 0.15 -0.07 0.00 0.00 0.00 178.15 177.93 2vju h LEU 92 N -0.41 0.38 -0.46 1.44 3.38 -0.86 0.11 115.31 118.90 2vju h LEU 92 Ca -0.02 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2vju h LEU 92 Cb 0.34 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2vju h LEU 92 CO 0.03 0.33 0.00 0.03 0.09 0.00 0.00 178.44 178.92 2vju h ARG 93 N 0.44 0.00 0.14 1.13 3.08 -0.99 0.15 114.38 118.33 2vju h ARG 93 Ca 0.11 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.83 2vju h ARG 93 Cb 0.05 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 2vju h ARG 93 CO -0.02 0.00 -1.69 1.96 -1.07 0.00 0.00 179.97 179.15 2vju h GLN 94 N 0.00 0.29 0.00 0.04 4.20 -0.24 -3.37 115.11 116.03 2vju h GLN 94 Ca 0.00 -0.50 -0.09 0.00 0.06 0.00 0.00 58.65 58.12 2vju h GLN 94 Cb 0.78 0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.73 2vju h GLN 94 CO 0.00 1.16 -0.63 0.93 -0.67 0.00 0.00 178.83 179.63 2vju h GLU 95 N 0.08 0.00 -3.59 1.46 5.08 -0.75 -3.41 114.58 113.45 2vju h GLU 95 Ca -0.31 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.44 2vju h GLU 95 Cb 2.05 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 30.90 2vju h GLU 95 CO 0.15 0.34 -0.73 -0.06 -1.00 0.00 0.00 179.01 177.71 2vju s PHE 96 N -3.03 2.38 0.46 4.33 0.40 0.53 -5.00 117.98 118.05 2vju s PHE 96 Ca 0.03 -2.38 0.22 0.00 -0.60 0.00 0.00 56.93 54.20 2vju s PHE 96 Cb 0.07 -2.14 1.22 0.00 0.51 0.00 0.00 43.02 42.68 2vju s PHE 96 CO 0.75 -0.85 1.88 -0.97 0.70 0.00 0.00 175.22 176.73 2vju h ASN 97 N 7.38 0.26 0.27 1.36 -0.73 -1.81 -0.66 115.58 121.65 2vju h ASN 97 Ca -0.07 0.03 -0.04 0.00 1.87 0.00 0.00 56.30 58.09 2vju h ASN 97 Cb 0.97 -0.02 -0.01 0.00 0.27 0.00 0.00 38.32 39.54 2vju h ASN 97 CO 0.51 0.11 -0.18 1.12 -0.37 0.00 0.00 177.43 178.61 2vju h HIS 98 N 0.26 0.00 0.00 0.67 2.07 -1.94 -1.48 115.15 114.72 2vju h HIS 98 Ca 0.43 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.91 2vju h HIS 98 Cb 1.27 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.24 2vju h HIS 98 CO -0.00 0.18 -0.17 -0.07 -3.07 0.00 0.00 177.93 174.80 2vju h LEU 99 N 0.00 0.00 0.15 6.12 3.38 -1.44 -2.64 115.31 120.88 2vju h LEU 99 Ca -0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 2vju h LEU 99 Cb 0.36 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2vju h LEU 99 CO 0.02 0.17 -1.75 0.50 0.09 0.00 0.00 178.44 177.48 2vju h LYS 100 N 0.00 0.32 0.11 1.13 1.63 -1.33 -3.33 116.57 115.10 2vju h LYS 100 Ca -0.00 -0.55 -0.26 0.00 -0.85 0.00 0.00 60.65 58.99 2vju h LYS 100 Cb 0.93 0.20 0.00 0.00 -0.60 0.00 0.00 32.23 32.76 2vju h LYS 100 CO 0.02 1.26 -1.19 1.79 -3.45 0.00 0.00 179.45 177.89 2vju h THR 101 N -0.01 1.50 -0.02 1.00 1.35 -1.40 -3.35 112.91 111.97 2vju h THR 101 Ca -0.36 -2.99 0.00 0.00 -0.55 0.00 0.00 66.41 62.51 2vju h THR 101 Cb 1.99 2.87 0.00 0.00 -1.73 0.00 0.00 68.15 71.28 2vju h THR 101 CO 0.12 0.87 -0.16 0.29 -0.25 0.00 0.00 175.52 176.39 2vju n LYS 102 N -3.56 1.50 -3.91 4.72 5.02 -1.00 -4.89 118.16 116.05 2vju n LYS 102 Ca -0.08 -1.06 -0.14 0.00 -2.02 0.00 0.00 58.31 55.01 2vju n LYS 102 Cb 0.99 -1.48 -0.15 0.00 -0.02 0.00 0.00 35.03 34.38 2vju n LYS 102 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2vju s LEU 103 N -2.23 1.71 0.39 -0.35 1.43 -1.25 -5.03 118.68 113.36 2vju s LEU 103 Ca 0.28 -0.01 0.11 0.00 -1.03 0.00 0.00 54.13 53.48 2vju s LEU 103 Cb 0.20 -0.09 0.81 0.00 0.03 0.00 0.00 46.19 47.13 2vju s LEU 103 CO 0.42 -0.03 1.92 1.55 0.23 0.00 0.00 176.35 180.44 2vju h PRO 104 N 6.50 0.17 -3.61 1.29 0.13 -1.87 -3.43 132.00 131.18 2vju h PRO 104 Ca -0.32 -0.04 -0.07 0.00 -0.87 0.00 0.00 66.00 64.70 2vju h PRO 104 Cb 1.18 -0.02 -0.13 0.00 0.13 0.00 0.00 31.00 32.16 2vju h PRO 104 CO 0.50 0.35 -0.20 0.95 -0.23 0.00 0.00 178.00 179.37 2vju s THR 105 N -4.65 0.08 -0.01 1.56 -4.23 -1.26 -5.07 115.64 102.06 2vju s THR 105 Ca -0.05 -0.96 -0.17 0.00 -1.18 0.00 0.00 61.69 59.33 2vju s THR 105 Cb 0.15 -1.42 -0.33 0.00 1.34 0.00 0.00 72.50 72.24 2vju s THR 105 CO 0.73 -0.38 0.88 0.25 -0.54 0.00 0.00 174.62 175.55 2vju h LEU 106 N 2.49 0.68-10.24 4.79 5.85 -1.86 -3.40 115.31 113.62 2vju h LEU 106 Ca -0.33 -0.93 -0.56 0.00 0.84 0.00 0.00 57.88 56.91 2vju h LEU 106 Cb 1.23 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 42.00 2vju h LEU 106 CO 0.49 1.64 -0.35 0.26 -0.34 0.00 0.00 178.44 180.14 2vju s TRP 107 N -2.54 2.05 0.54 1.25 0.52 -1.26 -0.34 118.94 119.15 2vju s TRP 107 Ca -0.12 -0.71 0.09 0.00 0.02 0.00 0.00 56.10 55.38 2vju s TRP 107 Cb 0.03 -1.99 0.09 0.00 -1.15 0.00 0.00 33.47 30.45 2vju s TRP 107 CO 0.89 -0.30 0.74 0.25 0.02 0.00 0.00 176.95 178.55 2vju n THR 108 N -1.64 0.00 1.25 2.01 -2.24 -1.23 -4.27 114.28 108.15 2vju n THR 108 Ca 0.00 -1.79 0.09 0.00 -2.27 0.00 0.00 64.05 60.09 2vju n THR 108 Cb 0.64 -0.55 0.34 0.00 -2.10 0.00 0.00 70.33 68.66 2vju n THR 108 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2vju n ASN 109 N -2.38 1.51 -4.63 3.42 6.94 -1.26 -4.91 115.26 113.94 2vju n ASN 109 Ca 0.15 -1.74 -0.29 0.00 -0.02 0.00 0.00 54.58 52.68 2vju n ASN 109 Cb 0.55 -0.12 -0.11 0.00 -2.36 0.00 0.00 39.78 37.75 2vju n ASN 109 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2vju s SER 110 N -1.45 3.89 0.04 0.53 1.04 -1.26 -5.15 113.70 111.35 2vju s SER 110 Ca 0.29 -1.40 -0.28 0.00 0.48 0.00 0.00 55.95 55.05 2vju s SER 110 Cb 0.16 -0.29 0.09 0.00 0.10 0.00 0.00 66.02 66.08 2vju s SER 110 CO 0.23 -0.50 0.89 0.00 0.98 0.00 0.00 173.24 174.84 2vju s PHE 112 N -3.20 2.94 -0.07 0.00 5.36 0.78 -4.97 117.98 118.82 2vju s PHE 112 Ca 0.06 -0.47 0.01 0.00 -0.96 0.00 0.00 56.93 55.58 2vju s PHE 112 Cb -0.01 -1.93 0.02 0.00 -0.34 0.00 0.00 43.02 40.76 2vju s PHE 112 CO -0.07 -0.14 -0.07 0.42 -1.46 0.00 0.00 175.22 173.91 2vju s ILE 113 N 0.44 0.82 -0.05 3.12 1.01 -1.26 -0.61 121.20 124.67 2vju s ILE 113 Ca -0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 60.65 60.33 2vju s ILE 113 Cb -0.15 -0.82 0.03 0.00 0.01 0.00 0.00 42.46 41.53 2vju s ILE 113 CO 0.04 0.30 0.02 -0.55 0.00 0.00 0.00 174.94 174.75 2vju s SER 114 N 1.11 1.23 0.54 3.58 0.15 0.03 -4.97 113.70 115.38 2vju s SER 114 Ca -0.07 -0.02 -0.18 0.00 0.70 0.00 0.00 55.95 56.39 2vju s SER 114 Cb -0.14 -0.30 -0.06 0.00 -1.71 0.00 0.00 66.02 63.81 2vju s SER 114 CO -0.01 -0.20 1.04 0.42 1.20 0.00 0.00 173.24 175.69 2vju s THR 115 N 1.88 3.90 0.01 6.45 -4.23 -1.26 0.29 115.64 122.66 2vju s THR 115 Ca 0.02 1.02 -0.08 0.00 -1.18 0.00 0.00 61.69 61.47 2vju s THR 115 Cb -0.12 -3.45 0.00 0.00 1.34 0.00 0.00 72.50 70.27 2vju s THR 115 CO -0.04 -0.41 0.16 0.54 -0.54 0.00 0.00 174.62 174.33 2vju s VAL 116 N -2.27 0.08 0.36 2.29 0.11 -0.34 -4.86 120.40 115.77 2vju s VAL 116 Ca 0.65 -0.70 0.06 0.00 -2.93 0.00 0.00 61.98 59.06 2vju s VAL 116 Cb -0.15 -0.51 -0.02 0.00 -1.53 0.00 0.00 36.38 34.17 2vju s VAL 116 CO 0.29 -0.39 0.23 0.61 -3.33 0.00 0.00 175.10 172.51 2vju n GLY 117 N 1.34 3.04 0.23 6.54 0.00 -1.26 -3.83 105.19 111.24 2vju n GLY 117 Ca -0.22 -1.98 -0.10 0.00 0.00 0.00 0.00 46.02 43.72 2vju n GLY 117 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2vju h GLY 118 N 1.88 0.70 -3.32 -0.02 0.00 -1.98 -3.44 103.07 96.89 2vju h GLY 118 Ca -0.27 -0.77 -0.49 0.00 0.00 0.00 0.00 47.33 45.80 2vju h GLY 118 CO 0.40 0.70 -0.36 0.00 0.00 0.00 0.00 176.54 177.28 2vju s ALA 119 N -4.11 3.86 0.51 3.60 0.00 -1.26 -5.03 121.76 119.33 2vju s ALA 119 Ca -0.08 -1.05 -0.15 0.00 0.00 0.00 0.00 51.96 50.68 2vju s ALA 119 Cb 0.11 -1.88 -0.07 0.00 0.00 0.00 0.00 23.12 21.29 2vju s ALA 119 CO 0.85 0.27 0.95 -1.25 0.00 0.00 0.00 175.76 176.58 2vju s PRO 120 N -3.81 3.86 0.26 0.00 0.04 -1.26 -4.93 135.00 129.16 2vju s PRO 120 Ca 0.36 0.83 -0.02 0.00 0.04 0.00 0.00 61.00 62.22 2vju s PRO 120 Cb -0.10 -2.17 0.57 0.00 0.04 0.00 0.00 34.50 32.84 2vju s PRO 120 CO 0.30 -0.27 1.68 1.25 0.04 0.00 0.00 177.00 180.00 2vju h LEU 121 N 0.78 0.06 -1.45 -3.56 5.85 -1.98 -1.33 115.31 113.68 2vju h LEU 121 Ca -0.46 0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.38 2vju h LEU 121 Cb 1.19 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.41 2vju h LEU 121 CO 0.62 -0.06 0.01 -1.13 -0.34 0.00 0.00 178.44 177.54 2vju h ASN 122 N 0.28 0.34 -0.19 1.25 -0.73 -1.99 0.65 115.58 115.18 2vju h ASN 122 Ca 0.48 -0.05 -0.05 0.00 1.87 0.00 0.00 56.30 58.54 2vju h ASN 122 Cb 0.87 -0.09 -0.00 0.00 0.27 0.00 0.00 38.32 39.37 2vju h ASN 122 CO -0.55 0.39 -0.09 0.58 -0.37 0.00 0.00 177.43 177.38 2vju h VAL 123 N 0.36 1.31 -0.69 2.57 2.07 -1.63 -1.93 116.25 118.31 2vju h VAL 123 Ca 0.08 -1.15 -0.03 0.00 0.82 0.00 0.00 66.70 66.42 2vju h VAL 123 Cb 0.23 1.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 2vju h VAL 123 CO 0.00 0.35 0.31 0.58 0.02 0.00 0.00 177.57 178.83 2vju h VAL 124 N 0.09 1.24 -0.53 2.57 2.07 -1.21 -1.16 116.25 119.31 2vju h VAL 124 Ca 0.04 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.87 2vju h VAL 124 Cb 0.58 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 2vju h VAL 124 CO 0.03 0.28 0.34 0.50 0.02 0.00 0.00 177.57 178.74 2vju h LYS 125 N 0.96 0.71 -0.18 1.57 3.64 -0.77 -1.06 116.57 121.44 2vju h LYS 125 Ca 0.23 -0.05 -0.16 0.00 -1.27 0.00 0.00 60.65 59.40 2vju h LYS 125 Cb 0.15 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 2vju h LYS 125 CO -0.03 0.49 -0.54 1.96 -2.27 0.00 0.00 179.45 179.07 2vju h GLN 126 N 0.72 0.52 -0.65 1.90 4.20 -1.13 -0.77 115.11 119.90 2vju h GLN 126 Ca 0.19 -0.33 0.03 0.00 0.06 0.00 0.00 58.65 58.60 2vju h GLN 126 Cb -0.05 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.73 2vju h GLN 126 CO -0.04 0.93 0.41 -0.92 -0.67 0.00 0.00 178.83 178.54 2vju h TYR 127 N 0.40 0.77 -0.31 2.96 5.03 -0.75 0.30 116.97 125.37 2vju h TYR 127 Ca 0.01 0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.25 2vju h TYR 127 Cb 1.07 -0.25 -0.01 0.00 1.55 0.00 0.00 36.73 39.09 2vju h TYR 127 CO 0.04 0.44 -0.17 0.82 -1.32 0.00 0.00 178.16 177.98 2vju h ILE 128 N 0.81 1.29 -0.24 1.81 1.08 -1.05 -2.92 117.51 118.29 2vju h ILE 128 Ca 0.26 -1.28 0.04 0.00 -0.39 0.00 0.00 64.86 63.49 2vju h ILE 128 Cb 0.00 1.45 -0.01 0.00 -3.07 0.00 0.00 36.82 35.19 2vju h ILE 128 CO -0.10 0.41 0.17 -0.08 -0.69 0.00 0.00 178.15 177.86 2vju h GLU 129 N 0.42 0.17 -0.91 2.37 4.81 0.12 -2.50 114.58 119.06 2vju h GLU 129 Ca 0.07 -0.01 -0.35 0.00 -0.13 0.00 0.00 59.36 58.94 2vju h GLU 129 Cb 0.70 -0.04 -0.21 0.00 0.63 0.00 0.00 28.75 29.83 2vju h GLU 129 CO 0.05 0.11 0.45 0.09 -0.73 0.00 0.00 179.01 178.98 2vju n ASN 130 N -4.49 4.03 -0.10 1.04 4.13 0.94 -4.62 115.26 116.19 2vju n ASN 130 Ca 0.02 -3.29 0.09 0.00 1.68 0.00 0.00 54.58 53.08 2vju n ASN 130 Cb 0.19 -0.77 0.44 0.00 -1.54 0.00 0.00 39.78 38.10 2vju n ASN 130 CO 0.00 0.00 0.00 1.56 0.28 0.00 0.00 177.26 179.10 2vju h GLN 131 N 1.51 0.54 -0.02 3.52 1.08 -1.49 -3.50 115.11 116.75 2vju h GLN 131 Ca 0.43 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.60 2vju h GLN 131 Cb 2.47 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 29.78 2vju h GLN 131 CO 0.86 0.35 0.00 1.04 -0.95 0.00 0.00 178.83 180.13