#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vdr s LEU 3 N 0.00 4.53 -0.14 -1.84 1.43 -1.26 -2.06 118.68 119.34 1vdr s LEU 3 Ca 0.00 1.85 -0.07 0.00 -1.03 0.00 0.00 54.13 54.88 1vdr s LEU 3 Cb 0.00 -3.59 0.05 0.00 0.03 0.00 0.00 46.19 42.68 1vdr s LEU 3 CO 0.00 -0.04 0.32 0.54 0.23 0.00 0.00 176.35 177.40 1vdr s VAL 4 N -0.25 -0.08 0.25 -1.59 0.11 0.08 -0.49 120.40 118.41 1vdr s VAL 4 Ca 0.46 0.14 0.00 0.00 -2.93 0.00 0.00 61.98 59.65 1vdr s VAL 4 Cb -0.24 -0.49 -0.04 0.00 -1.53 0.00 0.00 36.38 34.08 1vdr s VAL 4 CO 0.31 0.06 0.43 -0.94 -3.33 0.00 0.00 175.10 171.63 1vdr s SER 5 N 1.45 6.36 -0.05 3.54 1.04 -0.60 -1.68 113.70 123.76 1vdr s SER 5 Ca -0.08 0.38 -0.01 0.00 0.48 0.00 0.00 55.95 56.71 1vdr s SER 5 Cb -0.10 -2.00 0.03 0.00 0.10 0.00 0.00 66.02 64.05 1vdr s SER 5 CO -0.10 -0.12 0.03 0.54 0.98 0.00 0.00 173.24 174.57 1vdr s VAL 6 N -2.01 0.10 0.03 5.02 0.11 -0.71 0.12 120.40 123.07 1vdr s VAL 6 Ca 0.38 0.25 -0.20 0.00 -2.93 0.00 0.00 61.98 59.49 1vdr s VAL 6 Cb -0.10 -0.29 0.04 0.00 -1.53 0.00 0.00 36.38 34.50 1vdr s VAL 6 CO 0.31 0.19 0.45 0.00 -3.33 0.00 0.00 175.10 172.72 1vdr s ALA 7 N 1.80 -1.13 -0.06 1.54 0.00 -0.89 -4.41 121.76 118.61 1vdr s ALA 7 Ca 0.01 0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.43 1vdr s ALA 7 Cb -0.12 0.31 0.02 0.00 0.00 0.00 0.00 23.12 23.33 1vdr s ALA 7 CO -0.03 -0.45 -0.04 0.00 0.00 0.00 0.00 175.76 175.24 1vdr s ALA 8 N -2.28 0.78 0.01 0.00 0.00 -1.26 -1.29 121.76 117.73 1vdr s ALA 8 Ca -0.06 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 51.76 1vdr s ALA 8 Cb -0.01 -0.56 -0.01 0.00 0.00 0.00 0.00 23.12 22.54 1vdr s ALA 8 CO -0.01 -0.15 -0.03 -0.48 0.00 0.00 0.00 175.76 175.09 1vdr s LEU 9 N 1.23 2.14 0.00 0.00 2.34 -0.93 -4.63 118.68 118.83 1vdr s LEU 9 Ca -0.06 -0.29 0.00 0.00 0.06 0.00 0.00 54.13 53.84 1vdr s LEU 9 Cb -0.14 -0.01 0.00 0.00 -0.56 0.00 0.00 46.19 45.48 1vdr s LEU 9 CO -0.02 -0.14 0.00 0.00 -1.06 0.00 0.00 176.35 175.13 1vdr n ALA 10 N 2.23 0.00 -1.83 1.48 0.00 -0.57 -1.64 120.51 120.19 1vdr n ALA 10 Ca -0.19 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.93 1vdr n ALA 10 Cb 0.57 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.98 1vdr n ALA 10 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1vdr s GLU 11 N -2.20 3.94 0.00 0.00 2.56 -0.94 -3.22 118.70 118.84 1vdr s GLU 11 Ca 0.00 0.99 0.00 0.00 0.00 0.00 0.00 54.97 55.96 1vdr s GLU 11 Cb 0.00 -2.13 0.00 0.00 2.00 0.00 0.00 34.13 34.00 1vdr s GLU 11 CO 0.00 -0.28 0.00 0.09 -0.56 0.00 0.00 175.26 174.51 1vdr n ASN 12 N -1.50 0.00 -0.67 -1.70 3.02 -1.26 -4.17 115.26 108.98 1vdr n ASN 12 Ca 0.07 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.53 1vdr n ASN 12 Cb 0.54 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.67 1vdr n ASN 12 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1vdr n ARG 13 N -2.00 -1.05 -2.16 3.52 1.74 -1.20 -4.92 116.66 110.59 1vdr n ARG 13 Ca 0.00 0.74 -0.42 0.00 -0.77 0.00 0.00 57.85 57.40 1vdr n ARG 13 Cb 0.00 -4.77 -0.03 0.00 -1.02 0.00 0.00 32.46 26.64 1vdr n ARG 13 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1vdr s VAL 14 N -2.10 3.28 -0.71 1.55 1.01 -1.26 -1.21 120.40 120.95 1vdr s VAL 14 Ca 0.00 0.92 0.10 0.00 0.00 0.00 0.00 61.98 63.00 1vdr s VAL 14 Cb 0.00 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 1vdr s VAL 14 CO 0.00 0.07 0.53 2.30 0.00 0.00 0.00 175.10 178.01 1vdr n ILE 15 N 3.90 0.00 -3.82 2.22 -5.35 -0.43 -1.51 119.36 114.38 1vdr n ILE 15 Ca 0.11 -0.35 0.00 0.00 -0.27 0.00 0.00 62.75 62.25 1vdr n ILE 15 Cb 0.42 1.07 0.01 0.00 -1.74 0.00 0.00 39.64 39.39 1vdr n ILE 15 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1vdr s GLY 16 N -1.57 -0.17 -0.08 3.28 0.00 -1.17 -4.65 107.32 102.95 1vdr s GLY 16 Ca 0.06 0.16 -0.03 0.00 0.00 0.00 0.00 44.72 44.91 1vdr s GLY 16 CO 0.31 2.35 0.17 -1.60 0.00 0.00 0.00 173.10 174.33 1vdr s ARG 17 N -2.35 0.06 0.00 2.90 3.52 -0.90 -1.93 118.95 120.25 1vdr s ARG 17 Ca 0.20 0.53 0.00 0.00 -0.13 0.00 0.00 55.73 56.33 1vdr s ARG 17 Cb 0.01 -0.23 0.00 0.00 -1.56 0.00 0.00 34.95 33.16 1vdr s ARG 17 CO 0.00 -0.27 0.00 -3.47 -0.81 0.00 0.00 175.30 170.75 1vdr n ASP 18 N 5.03 0.00 0.00 -2.12 2.03 -1.26 -1.70 116.55 118.53 1vdr n ASP 18 Ca -0.11 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.20 1vdr n ASP 18 Cb 0.50 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.90 1vdr n ASP 18 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1vdr n GLY 19 N 0.00 0.33 0.21 0.27 0.00 -1.26 -5.17 105.19 99.56 1vdr n GLY 19 Ca 0.00 0.09 -0.01 0.00 0.00 0.00 0.00 46.02 46.09 1vdr n GLY 19 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vdr n GLU 20 N 0.00 0.60 -1.75 1.61 1.02 -0.69 -5.12 120.64 116.31 1vdr n GLU 20 Ca 0.00 -0.22 -0.41 0.00 -0.02 0.00 0.00 57.16 56.52 1vdr n GLU 20 Cb 0.00 0.14 0.01 0.00 -0.02 0.00 0.00 31.44 31.57 1vdr n GLU 20 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1vdr n LEU 21 N 0.00 4.63 0.05 -4.62 4.77 -1.26 -2.11 117.00 118.45 1vdr n LEU 21 Ca -0.00 1.16 -0.04 0.00 -0.03 0.00 0.00 56.01 57.10 1vdr n LEU 21 Cb 0.04 -1.58 -0.09 0.00 -2.33 0.00 0.00 43.42 39.46 1vdr n LEU 21 CO 0.02 -0.19 -0.01 1.55 -1.33 0.00 0.00 177.39 177.43 1vdr h PRO 22 N 2.49 0.00 -6.62 3.23 0.13 -1.88 -3.45 132.00 125.90 1vdr h PRO 22 Ca -0.50 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.12 1vdr h PRO 22 Cb 1.27 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.37 1vdr h PRO 22 CO 0.62 0.68 0.05 1.67 -0.23 0.00 0.00 178.00 180.79 1vdr s TRP 23 N -2.76 3.45 0.00 1.56 -2.14 -1.26 -4.99 118.94 112.79 1vdr s TRP 23 Ca -0.00 1.18 0.00 0.00 2.66 0.00 0.00 56.10 59.93 1vdr s TRP 23 Cb 0.09 -2.49 0.00 0.00 -3.10 0.00 0.00 33.47 27.97 1vdr s TRP 23 CO 0.80 0.19 0.00 -0.35 -2.66 0.00 0.00 176.95 174.93 1vdr n PRO 24 N -0.05 0.00 0.00 3.25 -0.04 -1.26 -5.00 135.00 131.90 1vdr n PRO 24 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1vdr n PRO 24 Cb 0.53 -0.06 0.00 0.00 -0.04 0.00 0.00 33.50 33.92 1vdr n PRO 24 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1vdr n SER 25 N 0.00 0.00 -0.53 3.54 3.41 -1.26 -4.98 113.62 113.80 1vdr n SER 25 Ca 0.00 0.16 0.00 0.00 -0.26 0.00 0.00 58.87 58.77 1vdr n SER 25 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1vdr n SER 25 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vdr n ILE 26 N -0.19 0.00 1.81 -1.33 0.13 -1.26 -4.94 119.36 113.59 1vdr n ILE 26 Ca 0.00 0.00 0.13 0.00 -1.10 0.00 0.00 62.75 61.78 1vdr n ILE 26 Cb 0.00 0.00 0.76 0.00 -0.84 0.00 0.00 39.64 39.56 1vdr n ILE 26 CO 0.00 0.00 0.00 -0.81 2.80 0.00 0.00 176.55 178.54 1vdr n PRO 27 N 0.00 0.91 0.08 9.51 -0.04 -1.26 -2.34 135.00 141.85 1vdr n PRO 27 Ca 0.00 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.49 1vdr n PRO 27 Cb 0.00 -1.44 -0.03 0.00 -0.04 0.00 0.00 33.50 31.99 1vdr n PRO 27 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1vdr h ALA 28 N 3.69 0.65 0.59 0.55 0.00 -1.92 -3.09 119.26 119.73 1vdr h ALA 28 Ca 0.00 -0.56 -0.03 0.00 0.00 0.00 0.00 54.91 54.32 1vdr h ALA 28 Cb 0.00 0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.92 1vdr h ALA 28 CO 0.00 0.65 -0.28 0.22 0.00 0.00 0.00 179.25 179.83 1vdr h ASP 29 N 0.00 -0.67 -0.99 0.00 3.58 -1.82 -2.93 116.42 113.59 1vdr h ASP 29 Ca -0.09 -0.02 0.04 0.00 0.42 0.00 0.00 57.03 57.38 1vdr h ASP 29 Cb 1.41 0.17 -0.06 0.00 1.72 0.00 0.00 39.33 42.57 1vdr h ASP 29 CO 0.04 -0.30 0.65 0.50 -2.88 0.00 0.00 179.24 177.26 1vdr h LYS 30 N -1.12 1.21 0.45 0.28 3.64 -1.70 -0.25 116.57 119.09 1vdr h LYS 30 Ca -0.08 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.20 1vdr h LYS 30 Cb 0.65 -0.27 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1vdr h LYS 30 CO 0.13 0.80 -0.22 -0.22 -2.27 0.00 0.00 179.45 177.68 1vdr h LYS 31 N 1.25 -0.58 -0.47 1.90 1.63 -1.64 -1.47 116.57 117.19 1vdr h LYS 31 Ca 0.40 0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 60.21 1vdr h LYS 31 Cb 0.02 0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.76 1vdr h LYS 31 CO -0.13 -0.36 0.16 0.37 -3.45 0.00 0.00 179.45 176.04 1vdr h GLN 32 N -0.65 0.68 -0.01 1.90 4.15 -1.28 -1.67 115.11 118.22 1vdr h GLN 32 Ca -0.06 -0.11 -0.07 0.00 0.77 0.00 0.00 58.65 59.18 1vdr h GLN 32 Cb 0.49 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.07 1vdr h GLN 32 CO 0.10 0.59 -0.26 -0.92 -1.93 0.00 0.00 178.83 176.41 1vdr h TYR 33 N 0.67 0.28 -0.65 3.99 3.20 -1.05 -1.91 116.97 121.51 1vdr h TYR 33 Ca 0.16 -0.14 -0.04 0.00 3.14 0.00 0.00 58.73 61.85 1vdr h TYR 33 Cb 0.18 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.38 1vdr h TYR 33 CO 0.01 0.92 0.26 0.00 -1.64 0.00 0.00 178.16 177.71 1vdr h ARG 34 N -0.44 0.95 0.00 1.82 2.47 -1.24 -2.93 114.38 115.01 1vdr h ARG 34 Ca -0.03 -0.15 -0.14 0.00 -1.26 0.00 0.00 59.98 58.39 1vdr h ARG 34 Cb 0.98 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 29.12 1vdr h ARG 34 CO 0.05 0.77 -0.68 0.77 0.56 0.00 0.00 179.97 181.44 1vdr h SER 35 N 0.93 0.00 -0.43 7.04 0.02 -1.39 -3.11 113.55 116.61 1vdr h SER 35 Ca 0.22 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.17 1vdr h SER 35 Cb 0.18 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 1vdr h SER 35 CO -0.02 0.68 0.26 -0.09 -1.14 0.00 0.00 176.83 176.53 1vdr h ARG 36 N 0.00 0.58 -0.34 3.45 9.65 -1.15 -3.10 114.38 123.48 1vdr h ARG 36 Ca -0.01 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 1vdr h ARG 36 Cb 1.32 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 29.78 1vdr h ARG 36 CO 0.09 0.43 0.00 0.44 2.80 0.00 0.00 179.97 183.72 1vdr n ILE 37 N -4.75 0.44 -0.30 1.20 -5.35 -1.18 -4.77 119.36 104.65 1vdr n ILE 37 Ca 0.01 -0.61 0.12 0.00 -0.27 0.00 0.00 62.75 61.99 1vdr n ILE 37 Cb 0.05 0.71 0.28 0.00 -1.74 0.00 0.00 39.64 38.94 1vdr n ILE 37 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1vdr h ALA 38 N 4.30 1.35 0.00 -1.28 0.00 -1.46 -3.24 119.26 118.93 1vdr h ALA 38 Ca 0.00 0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 1vdr h ALA 38 Cb 0.79 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1vdr h ALA 38 CO 0.00 -0.32 -1.35 -0.25 0.00 0.00 0.00 179.25 177.34 1vdr n ASP 39 N -5.04 3.66 -4.75 0.00 8.00 -1.26 -2.72 116.55 114.42 1vdr n ASP 39 Ca 0.20 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.41 1vdr n ASP 39 Cb 0.60 0.80 0.13 0.00 -0.02 0.00 0.00 41.12 42.63 1vdr n ASP 39 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1vdr s ASP 40 N -3.41 3.71 0.48 -2.24 1.01 -1.22 -2.81 116.67 112.19 1vdr s ASP 40 Ca -0.03 1.29 -0.22 0.00 0.71 0.00 0.00 52.55 54.30 1vdr s ASP 40 Cb 0.02 -1.96 -0.07 0.00 1.01 0.00 0.00 42.92 41.91 1vdr s ASP 40 CO 0.23 -2.46 1.13 -2.84 0.21 0.00 0.00 175.17 171.44 1vdr s PRO 41 N -5.08 3.70 -0.20 8.23 0.02 -1.26 -2.63 135.00 137.79 1vdr s PRO 41 Ca 0.63 1.67 0.01 0.00 0.02 0.00 0.00 61.00 63.33 1vdr s PRO 41 Cb -0.16 -2.29 0.04 0.00 0.02 0.00 0.00 34.50 32.10 1vdr s PRO 41 CO 0.55 -0.58 -0.14 0.08 -0.33 0.00 0.00 177.00 176.59 1vdr s VAL 42 N -1.65 1.89 -0.06 3.83 1.01 -0.77 -2.28 120.40 122.36 1vdr s VAL 42 Ca 0.66 -1.10 -0.30 0.00 0.00 0.00 0.00 61.98 61.24 1vdr s VAL 42 Cb -0.26 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 1vdr s VAL 42 CO 0.31 0.27 1.12 -0.69 0.00 0.00 0.00 175.10 176.11 1vdr s VAL 43 N 1.30 4.45 0.24 2.92 1.01 0.13 -1.19 120.40 129.26 1vdr s VAL 43 Ca -0.01 1.75 -0.22 0.00 0.00 0.00 0.00 61.98 63.51 1vdr s VAL 43 Cb -0.16 -4.13 0.04 0.00 0.00 0.00 0.00 36.38 32.13 1vdr s VAL 43 CO -0.09 0.02 0.68 -1.48 0.00 0.00 0.00 175.10 174.23 1vdr s LEU 44 N 2.00 -0.36 0.68 3.92 2.34 -1.02 -1.33 118.68 124.90 1vdr s LEU 44 Ca 0.53 -0.41 -0.11 0.00 0.06 0.00 0.00 54.13 54.21 1vdr s LEU 44 Cb -0.23 2.68 0.00 0.00 -0.56 0.00 0.00 46.19 48.09 1vdr s LEU 44 CO 0.21 -1.22 1.06 -0.83 -1.06 0.00 0.00 176.35 174.52 1vdr s GLY 45 N -2.86 1.63 0.08 -3.48 0.00 0.55 -0.66 107.32 102.58 1vdr s GLY 45 Ca 0.08 -0.34 -0.19 0.00 0.00 0.00 0.00 44.72 44.27 1vdr s GLY 45 CO 0.00 0.00 1.56 -0.09 0.00 0.00 0.00 173.10 174.58 1vdr h ARG 46 N -0.53 0.37 0.00 2.90 1.12 -1.87 -0.42 114.38 115.95 1vdr h ARG 46 Ca -0.45 -0.10 -0.06 0.00 -1.11 0.00 0.00 59.98 58.27 1vdr h ARG 46 Cb 1.24 -0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 31.15 1vdr h ARG 46 CO 0.63 0.50 -0.26 1.15 -3.11 0.00 0.00 179.97 178.88 1vdr h THR 47 N 0.17 0.94 0.05 0.20 2.02 -1.94 0.54 112.91 114.89 1vdr h THR 47 Ca 0.07 -0.99 -0.27 0.00 0.77 0.00 0.00 66.41 65.99 1vdr h THR 47 Cb 0.31 1.57 0.02 0.00 -1.74 0.00 0.00 68.15 68.31 1vdr h THR 47 CO 0.00 0.26 -1.10 0.74 0.37 0.00 0.00 175.52 175.79 1vdr h THR 48 N 0.00 1.34 0.53 3.16 2.02 -1.86 -2.26 112.91 115.84 1vdr h THR 48 Ca -0.00 -2.45 -0.03 0.00 0.77 0.00 0.00 66.41 64.70 1vdr h THR 48 Cb 0.55 2.54 0.01 0.00 -1.74 0.00 0.00 68.15 69.51 1vdr h THR 48 CO 0.03 0.74 -0.26 0.15 0.37 0.00 0.00 175.52 176.56 1vdr h PHE 49 N 0.28 -0.66 -0.67 3.16 3.57 -0.56 -1.86 116.94 120.20 1vdr h PHE 49 Ca -0.13 -0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.48 1vdr h PHE 49 Cb 1.76 0.22 -0.12 0.00 2.79 0.00 0.00 35.95 40.59 1vdr h PHE 49 CO 0.09 -0.41 -0.18 0.39 -2.23 0.00 0.00 178.31 175.97 1vdr n GLU 50 N -4.25 -0.07 0.10 1.11 -0.58 0.13 0.08 120.64 117.16 1vdr n GLU 50 Ca -0.09 1.04 -0.03 0.00 -0.42 0.00 0.00 57.16 57.66 1vdr n GLU 50 Cb 0.28 -1.55 0.17 0.00 -0.57 0.00 0.00 31.44 29.76 1vdr n GLU 50 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1vdr h SER 51 N 0.00 0.20 -0.24 1.62 4.64 -1.35 -2.88 113.55 115.55 1vdr h SER 51 Ca 0.31 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1vdr h SER 51 Cb 0.48 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1vdr h SER 51 CO -0.69 0.71 0.00 0.23 -0.87 0.00 0.00 176.83 176.22 1vdr n MET 52 N -3.91 1.57 -0.26 4.77 2.81 0.11 -4.61 117.12 117.61 1vdr n MET 52 Ca -0.02 -0.89 0.33 0.00 -1.81 0.00 0.00 57.70 55.31 1vdr n MET 52 Cb 0.57 -1.20 0.72 0.00 -0.71 0.00 0.00 33.22 32.60 1vdr n MET 52 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1vdr h ARG 53 N 1.46 0.00 0.06 0.03 -0.00 -1.20 -2.12 114.38 112.62 1vdr h ARG 53 Ca 0.00 0.00 -0.25 0.00 -0.50 0.00 0.00 59.98 59.23 1vdr h ARG 53 Cb 0.33 0.00 -0.02 0.00 0.00 0.00 0.00 29.97 30.29 1vdr h ARG 53 CO 0.00 0.00 -1.22 -0.44 0.00 0.00 0.00 179.97 178.31 1vdr h ASP 54 N 0.00 0.19 -1.44 7.04 3.32 -1.88 -3.45 116.42 120.20 1vdr h ASP 54 Ca 0.51 -0.22 0.00 0.00 0.02 0.00 0.00 57.03 57.34 1vdr h ASP 54 Cb 2.19 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 41.68 1vdr h ASP 54 CO -0.01 1.17 0.00 -0.67 -1.72 0.00 0.00 179.24 178.02 1vdr n ASP 55 N -3.39 0.81 0.00 6.45 -0.08 -0.80 -5.17 116.55 114.37 1vdr n ASP 55 Ca -0.07 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.21 1vdr n ASP 55 Cb 0.99 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.45 1vdr n ASP 55 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1vdr n LEU 56 N 0.00 0.00 0.06 -2.67 7.94 -1.24 -4.92 117.00 116.17 1vdr n LEU 56 Ca 0.00 0.00 -0.01 0.00 -1.11 0.00 0.00 56.01 54.89 1vdr n LEU 56 Cb 0.00 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 43.88 1vdr n LEU 56 CO 0.00 0.00 -0.05 -0.65 -1.11 0.00 0.00 177.39 175.58 1vdr h PRO 57 N 0.00 0.00 -4.79 1.96 0.11 -1.95 -3.48 132.00 123.86 1vdr h PRO 57 Ca 0.00 0.00 -0.43 0.00 0.11 0.00 0.00 66.00 65.68 1vdr h PRO 57 Cb 0.00 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 30.98 1vdr h PRO 57 CO 0.00 0.48 -0.46 0.20 -0.21 0.00 0.00 178.00 178.00 1vdr s GLY 58 N -4.73 2.17 -1.14 -0.55 0.00 -1.26 -4.03 107.32 97.78 1vdr s GLY 58 Ca -0.01 -1.98 -0.17 0.00 0.00 0.00 0.00 44.72 42.56 1vdr s GLY 58 CO 0.80 -1.41 1.44 -0.45 0.00 0.00 0.00 173.10 173.48 1vdr s SER 59 N -3.34 6.84 0.00 1.64 0.15 -1.08 -4.58 113.70 113.33 1vdr s SER 59 Ca 0.39 -2.44 0.00 0.00 0.70 0.00 0.00 55.95 54.60 1vdr s SER 59 Cb 0.02 -2.47 0.00 0.00 -1.71 0.00 0.00 66.02 61.87 1vdr s SER 59 CO 0.26 -1.02 0.00 0.00 1.20 0.00 0.00 173.24 173.67 1vdr n ALA 60 N 6.96 0.00 -3.93 5.45 0.00 -1.26 -4.17 120.51 123.55 1vdr n ALA 60 Ca 0.36 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.47 1vdr n ALA 60 Cb 0.46 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.77 1vdr n ALA 60 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1vdr s GLN 61 N -5.06 2.20 -0.89 0.00 1.11 -1.25 -1.85 119.66 113.92 1vdr s GLN 61 Ca 0.00 -1.40 -0.22 0.00 0.01 0.00 0.00 55.36 53.75 1vdr s GLN 61 Cb 0.00 -3.04 0.08 0.00 -1.01 0.00 0.00 33.01 29.04 1vdr s GLN 61 CO 0.00 -0.65 1.24 0.42 0.01 0.00 0.00 175.29 176.31 1vdr s ILE 62 N 1.12 4.23 -0.53 1.08 1.01 -0.33 -1.19 121.20 126.59 1vdr s ILE 62 Ca -0.05 -0.81 -0.28 0.00 0.00 0.00 0.00 60.65 59.51 1vdr s ILE 62 Cb -0.20 -4.89 0.02 0.00 0.01 0.00 0.00 42.46 37.40 1vdr s ILE 62 CO -0.04 -1.71 1.36 -0.69 0.00 0.00 0.00 174.94 173.86 1vdr s VAL 63 N 4.17 3.88 -0.37 2.92 1.01 -0.34 -2.44 120.40 129.22 1vdr s VAL 63 Ca 0.36 0.80 -0.29 0.00 0.00 0.00 0.00 61.98 62.85 1vdr s VAL 63 Cb -0.05 -4.45 0.00 0.00 0.00 0.00 0.00 36.38 31.88 1vdr s VAL 63 CO -0.03 -1.11 1.41 -0.04 0.00 0.00 0.00 175.10 175.33 1vdr s MET 64 N 5.23 3.68 -0.02 2.72 -1.94 0.17 -1.01 119.30 128.13 1vdr s MET 64 Ca 0.52 1.09 -0.22 0.00 -1.71 0.00 0.00 55.69 55.37 1vdr s MET 64 Cb -0.10 -3.99 0.04 0.00 2.01 0.00 0.00 34.83 32.79 1vdr s MET 64 CO 0.27 -1.43 0.48 -1.54 -0.01 0.00 0.00 175.02 172.78 1vdr s SER 65 N 3.70 -0.40 0.02 3.03 1.04 -0.76 -2.85 113.70 117.48 1vdr s SER 65 Ca 0.61 0.33 -0.18 0.00 0.48 0.00 0.00 55.95 57.19 1vdr s SER 65 Cb -0.15 0.42 -0.10 0.00 0.10 0.00 0.00 66.02 66.29 1vdr s SER 65 CO 0.30 -0.55 1.08 0.03 0.98 0.00 0.00 173.24 175.07 1vdr h ARG 66 N 3.37 -0.61 -6.28 4.02 3.08 -1.95 -3.39 114.38 112.62 1vdr h ARG 66 Ca -0.29 0.04 -0.63 0.00 0.07 0.00 0.00 59.98 59.17 1vdr h ARG 66 Cb 1.17 0.14 0.12 0.00 0.08 0.00 0.00 29.97 31.47 1vdr h ARG 66 CO 0.40 -0.41 -0.20 0.43 -1.07 0.00 0.00 179.97 179.12 1vdr n SER 67 N -4.01 0.02 -4.64 7.04 7.64 -1.26 -4.98 113.62 113.42 1vdr n SER 67 Ca -0.08 1.12 -0.42 0.00 1.01 0.00 0.00 58.87 60.50 1vdr n SER 67 Cb 0.25 -1.14 -0.04 0.00 -1.01 0.00 0.00 64.21 62.27 1vdr n SER 67 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1vdr s GLU 68 N -1.35 4.19 0.09 1.43 2.56 -1.26 -4.97 118.70 119.38 1vdr s GLU 68 Ca 0.61 0.93 0.07 0.00 0.00 0.00 0.00 54.97 56.59 1vdr s GLU 68 Cb -0.77 -3.64 -0.03 0.00 2.00 0.00 0.00 34.13 31.69 1vdr s GLU 68 CO 0.58 -0.51 -0.19 1.03 -0.56 0.00 0.00 175.26 175.61 1vdr s ARG 69 N 2.81 1.05 -0.14 4.30 0.52 -1.26 -5.10 118.95 121.13 1vdr s ARG 69 Ca 0.35 -1.11 -0.25 0.00 -0.52 0.00 0.00 55.73 54.20 1vdr s ARG 69 Cb -0.15 -1.25 -0.02 0.00 0.52 0.00 0.00 34.95 34.05 1vdr s ARG 69 CO 0.07 0.29 0.82 -1.12 0.02 0.00 0.00 175.30 175.39 1vdr s SER 70 N -1.85 6.99 -0.21 0.23 0.01 -1.26 -4.92 113.70 112.69 1vdr s SER 70 Ca 0.04 1.21 0.01 0.00 1.31 0.00 0.00 55.95 58.53 1vdr s SER 70 Cb -0.10 -2.46 0.05 0.00 0.21 0.00 0.00 66.02 63.72 1vdr s SER 70 CO 0.04 -0.35 -0.10 -0.36 0.41 0.00 0.00 173.24 172.88 1vdr s PHE 71 N 1.86 2.55 -1.18 2.43 0.08 -1.26 -5.03 117.98 117.43 1vdr s PHE 71 Ca 0.39 -1.73 -0.13 0.00 0.12 0.00 0.00 56.93 55.59 1vdr s PHE 71 Cb -0.17 -1.68 0.20 0.00 -0.57 0.00 0.00 43.02 40.80 1vdr s PHE 71 CO 0.14 -0.77 1.35 -1.12 -0.10 0.00 0.00 175.22 174.72 1vdr s SER 72 N 1.35 7.12 -0.24 1.36 0.01 -1.26 -4.71 113.70 117.33 1vdr s SER 72 Ca -0.03 -3.11 -0.09 0.00 1.31 0.00 0.00 55.95 54.03 1vdr s SER 72 Cb -0.17 -2.35 0.11 0.00 0.21 0.00 0.00 66.02 63.81 1vdr s SER 72 CO -0.08 -0.64 0.53 -0.69 0.41 0.00 0.00 173.24 172.77 1vdr s VAL 73 N 0.93 -0.74 0.60 3.43 1.01 -1.26 -5.08 120.40 119.28 1vdr s VAL 73 Ca 0.39 0.09 0.29 0.00 0.00 0.00 0.00 61.98 62.75 1vdr s VAL 73 Cb -0.05 -0.82 0.36 0.00 0.00 0.00 0.00 36.38 35.88 1vdr s VAL 73 CO -0.02 0.04 2.01 -2.24 0.00 0.00 0.00 175.10 174.89 1vdr h ASP 74 N 8.01 0.00 -1.94 3.32 2.03 -2.06 -3.32 116.42 122.46 1vdr h ASP 74 Ca -0.18 0.00 -0.27 0.00 -0.73 0.00 0.00 57.03 55.84 1vdr h ASP 74 Cb 1.11 0.00 -0.31 0.00 -0.83 0.00 0.00 39.33 39.30 1vdr h ASP 74 CO 0.12 0.00 -0.60 0.28 -1.03 0.00 0.00 179.24 178.01 1vdr s THR 75 N -4.57 -0.49 -0.34 1.15 -1.32 -1.26 -5.01 115.64 103.79 1vdr s THR 75 Ca -0.04 -0.45 -0.06 0.00 -1.21 0.00 0.00 61.69 59.92 1vdr s THR 75 Cb 0.15 -0.95 0.19 0.00 -1.51 0.00 0.00 72.50 70.37 1vdr s THR 75 CO 0.52 -0.40 0.97 0.00 -2.21 0.00 0.00 174.62 173.50 1vdr s ALA 76 N 2.34 -4.05 0.80 11.08 0.00 -1.25 -3.93 121.76 126.75 1vdr s ALA 76 Ca 0.10 1.03 -0.11 0.00 0.00 0.00 0.00 51.96 52.98 1vdr s ALA 76 Cb -0.13 -2.96 0.08 0.00 0.00 0.00 0.00 23.12 20.10 1vdr s ALA 76 CO -0.29 -2.45 1.16 -1.01 0.00 0.00 0.00 175.76 173.17 1vdr s HIS 77 N 1.87 2.95 0.09 0.00 3.76 -0.33 -4.81 115.29 118.81 1vdr s HIS 77 Ca 0.15 0.71 0.09 0.00 -0.15 0.00 0.00 55.06 55.87 1vdr s HIS 77 Cb 0.02 -3.46 -0.04 0.00 1.11 0.00 0.00 32.58 30.22 1vdr s HIS 77 CO -0.13 -1.73 -0.21 0.50 -0.85 0.00 0.00 174.74 172.31 1vdr s ARG 78 N -5.54 1.76 -0.01 1.40 3.00 -1.26 -1.20 118.95 117.10 1vdr s ARG 78 Ca 0.62 -1.16 -0.02 0.00 -1.00 0.00 0.00 55.73 54.16 1vdr s ARG 78 Cb -0.11 -2.06 0.00 0.00 0.00 0.00 0.00 34.95 32.78 1vdr s ARG 78 CO 0.48 0.49 0.05 0.00 0.00 0.00 0.00 175.30 176.33 1vdr s ALA 79 N -1.02 -0.12 -0.19 6.12 0.00 -0.18 -4.85 121.76 121.52 1vdr s ALA 79 Ca 0.15 -0.01 0.15 0.00 0.00 0.00 0.00 51.96 52.26 1vdr s ALA 79 Cb -0.10 -0.03 0.43 0.00 0.00 0.00 0.00 23.12 23.42 1vdr s ALA 79 CO 0.07 -0.08 1.31 0.00 0.00 0.00 0.00 175.76 177.06 1vdr n ALA 80 N 2.58 3.08 0.00 0.00 0.00 -1.26 -1.83 120.51 123.07 1vdr n ALA 80 Ca -0.16 -2.71 0.00 0.00 0.00 0.00 0.00 53.44 50.57 1vdr n ALA 80 Cb 0.58 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.48 1vdr n ALA 80 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1vdr n SER 81 N -1.04 0.00 -0.36 0.00 3.41 -1.26 -4.98 113.62 109.39 1vdr n SER 81 Ca 0.21 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.80 1vdr n SER 81 Cb 0.81 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.86 1vdr n SER 81 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1vdr h VAL 82 N 0.24 1.26 0.08 -3.33 2.07 -1.97 -2.27 116.25 112.32 1vdr h VAL 82 Ca 0.00 -0.56 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 1vdr h VAL 82 Cb 0.00 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 29.67 1vdr h VAL 82 CO 0.00 0.27 -0.04 -0.33 0.02 0.00 0.00 177.57 177.49 1vdr h GLU 83 N 1.32 -0.10 -0.71 1.57 3.07 -1.99 -0.74 114.58 117.00 1vdr h GLU 83 Ca 0.34 0.01 0.03 0.00 -0.50 0.00 0.00 59.36 59.24 1vdr h GLU 83 Cb -0.07 0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 27.82 1vdr h GLU 83 CO -0.07 0.20 0.44 1.49 -1.40 0.00 0.00 179.01 179.68 1vdr h GLU 84 N -0.40 0.84 0.00 2.33 4.81 -1.94 -0.85 114.58 119.37 1vdr h GLU 84 Ca -0.01 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 1vdr h GLU 84 Cb 0.35 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.53 1vdr h GLU 84 CO 0.02 0.56 -0.16 0.00 -0.73 0.00 0.00 179.01 178.70 1vdr h ALA 85 N 1.30 1.65 0.18 2.92 0.00 -1.16 -2.02 119.26 122.13 1vdr h ALA 85 Ca 0.28 -0.15 -0.27 0.00 0.00 0.00 0.00 54.91 54.77 1vdr h ALA 85 Cb 0.01 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 17.81 1vdr h ALA 85 CO -0.11 0.20 -1.18 0.28 0.00 0.00 0.00 179.25 178.45 1vdr h VAL 86 N 0.00 1.36 -0.26 0.00 2.07 -0.43 -3.25 116.25 115.73 1vdr h VAL 86 Ca -0.00 -2.55 0.06 0.00 0.82 0.00 0.00 66.70 65.03 1vdr h VAL 86 Cb 0.30 2.98 -0.06 0.00 -1.52 0.00 0.00 31.29 32.98 1vdr h VAL 86 CO 0.02 0.76 -0.16 0.44 0.02 0.00 0.00 177.57 178.65 1vdr h ASP 87 N 0.02 -0.51 -0.41 0.57 3.32 -0.72 0.79 116.42 119.48 1vdr h ASP 87 Ca -0.20 0.11 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 1vdr h ASP 87 Cb 1.91 0.27 -0.02 0.00 0.22 0.00 0.00 39.33 41.71 1vdr h ASP 87 CO 0.22 -0.19 0.25 0.40 -1.72 0.00 0.00 179.24 178.20 1vdr h ILE 88 N -0.13 1.12 0.00 0.35 2.04 -1.52 0.85 117.51 120.21 1vdr h ILE 88 Ca 0.14 -0.27 -0.19 0.00 1.00 0.00 0.00 64.86 65.54 1vdr h ILE 88 Cb 0.35 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 1vdr h ILE 88 CO -0.34 0.13 -0.98 0.00 0.00 0.00 0.00 178.15 176.95 1vdr h ALA 89 N 1.71 0.48 -0.52 1.87 0.00 -1.43 -2.14 119.26 119.23 1vdr h ALA 89 Ca 0.15 -0.86 -0.04 0.00 0.00 0.00 0.00 54.91 54.16 1vdr h ALA 89 Cb -0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1vdr h ALA 89 CO -0.03 1.13 0.15 0.00 0.00 0.00 0.00 179.25 180.50 1vdr h ALA 90 N 1.13 1.30 -0.30 0.00 0.00 0.01 -2.35 119.26 119.05 1vdr h ALA 90 Ca -0.05 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.55 1vdr h ALA 90 Cb 1.70 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.27 1vdr h ALA 90 CO 0.11 0.50 -0.37 0.77 0.00 0.00 0.00 179.25 180.26 1vdr h SER 91 N 0.75 0.73 -0.14 0.00 0.02 -0.72 -2.85 113.55 111.34 1vdr h SER 91 Ca 0.17 -0.31 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 1vdr h SER 91 Cb 0.24 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.58 1vdr h SER 91 CO -0.01 1.02 0.00 0.18 -1.14 0.00 0.00 176.83 176.88 1vdr n LEU 92 N -4.05 1.24 0.00 5.07 4.32 -0.82 -4.89 117.00 117.88 1vdr n LEU 92 Ca -0.01 -0.62 0.00 0.00 -0.02 0.00 0.00 56.01 55.35 1vdr n LEU 92 Cb 0.51 -0.26 0.00 0.00 -1.62 0.00 0.00 43.42 42.04 1vdr n LEU 92 CO 0.46 0.25 0.00 0.47 -1.22 0.00 0.00 177.39 177.35 1vdr n ASP 93 N 0.01 -2.80 -4.63 -1.43 9.92 -1.08 -4.94 116.55 111.61 1vdr n ASP 93 Ca 0.05 0.00 -0.39 0.00 -0.53 0.00 0.00 54.79 53.92 1vdr n ASP 93 Cb 0.25 -2.48 0.03 0.00 -0.64 0.00 0.00 41.12 38.28 1vdr n ASP 93 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1vdr n ALA 94 N 1.00 0.39 -0.03 2.24 0.00 -1.12 -4.97 120.51 118.01 1vdr n ALA 94 Ca 0.00 0.12 -0.21 0.00 0.00 0.00 0.00 53.44 53.35 1vdr n ALA 94 Cb 0.21 -2.13 -0.13 0.00 0.00 0.00 0.00 19.45 17.40 1vdr n ALA 94 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1vdr h GLU 95 N 1.10 0.16 -4.93 0.00 4.39 -1.92 -3.46 114.58 109.93 1vdr h GLU 95 Ca -0.47 -0.27 -0.46 0.00 0.34 0.00 0.00 59.36 58.50 1vdr h GLU 95 Cb 1.34 0.10 -0.30 0.00 -0.10 0.00 0.00 28.75 29.79 1vdr h GLU 95 CO 0.54 1.13 -0.80 0.95 -1.16 0.00 0.00 179.01 179.67 1vdr s THR 96 N -2.44 0.97 -0.13 1.13 -4.23 -1.26 -1.93 115.64 107.75 1vdr s THR 96 Ca -0.23 -0.49 0.03 0.00 -1.18 0.00 0.00 61.69 59.82 1vdr s THR 96 Cb 0.05 -0.84 0.01 0.00 1.34 0.00 0.00 72.50 73.06 1vdr s THR 96 CO 0.71 0.29 -0.22 0.00 -0.54 0.00 0.00 174.62 174.85 1vdr s ALA 97 N -0.04 2.18 -0.12 3.99 0.00 -0.87 -4.02 121.76 122.88 1vdr s ALA 97 Ca 0.00 -1.03 -0.08 0.00 0.00 0.00 0.00 51.96 50.85 1vdr s ALA 97 Cb -0.07 -0.93 -0.04 0.00 0.00 0.00 0.00 23.12 22.07 1vdr s ALA 97 CO 0.00 0.05 0.15 0.71 0.00 0.00 0.00 175.76 176.68 1vdr s TYR 98 N 0.70 3.58 -0.33 0.00 2.02 -0.97 -0.74 117.35 121.62 1vdr s TYR 98 Ca -0.10 0.53 -0.12 0.00 -0.37 0.00 0.00 57.07 57.01 1vdr s TYR 98 Cb -0.16 -1.99 -0.02 0.00 -0.40 0.00 0.00 41.96 39.39 1vdr s TYR 98 CO 0.01 0.67 0.21 0.08 -1.57 0.00 0.00 175.55 174.96 1vdr s VAL 99 N -0.85 5.12 -0.43 0.71 1.01 -0.67 0.17 120.40 125.46 1vdr s VAL 99 Ca 0.15 -0.23 0.23 0.00 0.00 0.00 0.00 61.98 62.13 1vdr s VAL 99 Cb -0.12 -3.60 -0.14 0.00 0.00 0.00 0.00 36.38 32.52 1vdr s VAL 99 CO 0.04 0.04 0.92 -0.38 0.00 0.00 0.00 175.10 175.72 1vdr n ILE 100 N 5.07 0.23 0.00 2.22 2.08 -0.44 -1.73 119.36 126.78 1vdr n ILE 100 Ca -0.13 -0.35 0.00 0.00 0.56 0.00 0.00 62.75 62.83 1vdr n ILE 100 Cb 0.50 0.07 0.00 0.00 -0.75 0.00 0.00 39.64 39.46 1vdr n ILE 100 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1vdr n GLY 101 N 1.31 -1.22 0.00 7.39 0.00 -1.25 -4.97 105.19 106.45 1vdr n GLY 101 Ca 0.00 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.08 1vdr n GLY 101 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vdr n GLY 102 N 0.00 -2.41 0.35 -0.02 0.00 -1.26 -0.33 105.19 101.51 1vdr n GLY 102 Ca 0.00 -1.15 0.08 0.00 0.00 0.00 0.00 46.02 44.95 1vdr n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vdr h ALA 103 N -2.00 1.48 -0.20 4.61 0.00 -1.94 -0.60 119.26 120.61 1vdr h ALA 103 Ca 0.00 0.05 -0.19 0.00 0.00 0.00 0.00 54.91 54.77 1vdr h ALA 103 Cb 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1vdr h ALA 103 CO 0.00 0.10 -0.64 0.00 0.00 0.00 0.00 179.25 178.71 1vdr h ALA 104 N 1.56 0.50 -0.25 0.00 0.00 -1.96 -2.74 119.26 116.36 1vdr h ALA 104 Ca 0.50 -0.55 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1vdr h ALA 104 Cb 0.60 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1vdr h ALA 104 CO -0.31 0.69 -0.11 0.82 0.00 0.00 0.00 179.25 180.35 1vdr h ILE 105 N 0.53 1.30 -0.78 0.00 1.08 -1.85 -1.49 117.51 116.30 1vdr h ILE 105 Ca -0.01 -1.18 0.04 0.00 -0.39 0.00 0.00 64.86 63.32 1vdr h ILE 105 Cb 1.23 1.53 -0.05 0.00 -3.07 0.00 0.00 36.82 36.47 1vdr h ILE 105 CO 0.13 0.37 0.51 1.88 -0.69 0.00 0.00 178.15 180.35 1vdr h TYR 106 N 0.25 0.91 0.81 1.37 0.05 -1.05 -2.12 116.97 117.19 1vdr h TYR 106 Ca 0.06 0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.82 1vdr h TYR 106 Cb 0.61 -0.30 0.01 0.00 1.01 0.00 0.00 36.73 38.05 1vdr h TYR 106 CO 0.06 0.52 -0.39 0.00 -1.05 0.00 0.00 178.16 177.30 1vdr h ALA 107 N 1.55 -1.08 -0.17 3.88 0.00 -1.50 -0.87 119.26 121.07 1vdr h ALA 107 Ca 0.31 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1vdr h ALA 107 Cb 0.08 0.42 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1vdr h ALA 107 CO -0.09 -1.09 0.25 1.25 0.00 0.00 0.00 179.25 179.56 1vdr h LEU 108 N -1.11 0.00 -0.16 0.00 5.85 -1.09 -2.42 115.31 116.39 1vdr h LEU 108 Ca -0.11 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1vdr h LEU 108 Cb 0.83 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.86 1vdr h LEU 108 CO 0.18 0.00 -0.75 0.49 -0.34 0.00 0.00 178.44 178.03 1vdr n PHE 109 N -3.53 0.00 0.00 1.25 3.01 -0.81 -4.68 117.46 112.70 1vdr n PHE 109 Ca 0.01 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.36 1vdr n PHE 109 Cb 0.36 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.77 1vdr n PHE 109 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 1vdr h GLN 110 N 0.34 0.10 0.00 -1.08 5.75 -0.62 -1.90 115.11 117.69 1vdr h GLN 110 Ca 0.00 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 1vdr h GLN 110 Cb 0.45 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.98 1vdr h GLN 110 CO 0.00 0.13 0.00 -0.35 -2.65 0.00 0.00 178.83 175.96 1vdr n PRO 111 N -5.00 0.09 -0.00 -2.39 -0.04 -1.26 -2.50 135.00 123.89 1vdr n PRO 111 Ca -0.06 0.49 0.10 0.00 -0.04 0.00 0.00 63.50 63.99 1vdr n PRO 111 Cb 0.06 -1.74 -0.13 0.00 -0.04 0.00 0.00 33.50 31.65 1vdr n PRO 111 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1vdr n HIS 112 N -1.92 0.01 -1.82 0.54 8.25 -1.01 -5.01 115.22 114.26 1vdr n HIS 112 Ca 0.01 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.09 1vdr n HIS 112 Cb 0.09 -0.21 0.05 0.00 1.12 0.00 0.00 29.99 31.05 1vdr n HIS 112 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1vdr s LEU 113 N -3.61 3.70 -0.12 2.41 1.43 -0.75 -4.68 118.68 117.07 1vdr s LEU 113 Ca 0.02 2.63 0.07 0.00 -1.03 0.00 0.00 54.13 55.81 1vdr s LEU 113 Cb 0.15 -4.48 -0.12 0.00 0.03 0.00 0.00 46.19 41.78 1vdr s LEU 113 CO 0.88 -1.74 -0.02 0.47 0.23 0.00 0.00 176.35 176.17 1vdr n ASP 114 N -1.49 2.55 -4.02 2.29 9.92 0.35 -4.92 116.55 121.24 1vdr n ASP 114 Ca 0.13 -0.03 -0.08 0.00 -0.53 0.00 0.00 54.79 54.29 1vdr n ASP 114 Cb 0.47 0.43 -0.09 0.00 -0.64 0.00 0.00 41.12 41.29 1vdr n ASP 114 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1vdr s ARG 115 N -2.26 0.72 -0.03 -1.24 0.52 -1.14 -2.82 118.95 112.70 1vdr s ARG 115 Ca -0.10 -1.16 0.02 0.00 -0.52 0.00 0.00 55.73 53.97 1vdr s ARG 115 Cb 0.04 0.26 0.01 0.00 0.52 0.00 0.00 34.95 35.78 1vdr s ARG 115 CO 0.40 -0.18 -0.07 -1.64 0.02 0.00 0.00 175.30 173.83 1vdr s MET 116 N -3.91 0.87 -0.35 3.54 -1.94 0.07 -1.56 119.30 116.01 1vdr s MET 116 Ca 0.08 -0.20 0.03 0.00 -1.71 0.00 0.00 55.69 53.89 1vdr s MET 116 Cb 0.07 -0.83 0.10 0.00 2.01 0.00 0.00 34.83 36.18 1vdr s MET 116 CO -0.09 0.02 0.08 0.08 -0.01 0.00 0.00 175.02 175.10 1vdr s VAL 117 N 0.51 2.04 -0.19 -6.03 1.01 0.12 -0.81 120.40 117.05 1vdr s VAL 117 Ca -0.07 -2.27 -0.00 0.00 0.00 0.00 0.00 61.98 59.63 1vdr s VAL 117 Cb -0.11 -2.51 0.01 0.00 0.00 0.00 0.00 36.38 33.77 1vdr s VAL 117 CO 0.00 -0.64 -0.15 -0.76 0.00 0.00 0.00 175.10 173.55 1vdr s LEU 118 N 0.91 2.37 -0.38 3.92 1.43 0.07 -2.10 118.68 124.90 1vdr s LEU 118 Ca 0.11 -0.56 -0.22 0.00 -1.03 0.00 0.00 54.13 52.43 1vdr s LEU 118 Cb -0.19 -1.56 0.01 0.00 0.03 0.00 0.00 46.19 44.48 1vdr s LEU 118 CO -0.10 0.01 0.73 -0.44 0.23 0.00 0.00 176.35 176.77 1vdr s SER 119 N 1.27 6.47 -0.73 2.29 0.01 -0.41 -0.51 113.70 122.10 1vdr s SER 119 Ca 0.04 0.17 -0.20 0.00 1.31 0.00 0.00 55.95 57.27 1vdr s SER 119 Cb -0.14 -2.37 0.11 0.00 0.21 0.00 0.00 66.02 63.84 1vdr s SER 119 CO -0.09 -0.72 0.92 -0.13 0.41 0.00 0.00 173.24 173.64 1vdr s ARG 120 N 2.98 3.27 0.02 12.44 1.81 -0.06 -2.19 118.95 137.23 1vdr s ARG 120 Ca 0.28 -1.37 -0.30 0.00 -1.72 0.00 0.00 55.73 52.62 1vdr s ARG 120 Cb -0.13 -4.46 -0.04 0.00 -0.45 0.00 0.00 34.95 29.87 1vdr s ARG 120 CO 0.17 -1.69 1.03 0.08 -0.68 0.00 0.00 175.30 174.22 1vdr s VAL 121 N 2.97 4.63 -0.17 3.52 1.01 -0.65 -2.81 120.40 128.91 1vdr s VAL 121 Ca 0.22 1.91 0.17 0.00 0.00 0.00 0.00 61.98 64.27 1vdr s VAL 121 Cb -0.15 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 32.01 1vdr s VAL 121 CO 0.02 0.16 1.22 -0.65 0.00 0.00 0.00 175.10 175.85 1vdr h PRO 122 N 6.70 0.00 -6.93 2.72 0.11 -1.88 -3.30 132.00 129.42 1vdr h PRO 122 Ca -0.41 0.00 -0.47 0.00 0.11 0.00 0.00 66.00 65.23 1vdr h PRO 122 Cb 1.22 0.00 0.06 0.00 0.11 0.00 0.00 31.00 32.39 1vdr h PRO 122 CO 0.76 0.37 0.02 0.20 -0.21 0.00 0.00 178.00 179.14 1vdr s GLY 123 N -4.55 1.77 0.02 -0.55 0.00 -1.26 -4.68 107.32 98.06 1vdr s GLY 123 Ca 0.02 -1.81 -0.17 0.00 0.00 0.00 0.00 44.72 42.75 1vdr s GLY 123 CO 0.77 -1.31 0.49 -0.54 0.00 0.00 0.00 173.10 172.50 1vdr s GLU 124 N -4.94 4.10 0.20 2.90 8.01 -1.26 -2.22 118.70 125.48 1vdr s GLU 124 Ca 0.64 0.56 0.02 0.00 0.01 0.00 0.00 54.97 56.20 1vdr s GLU 124 Cb -0.06 -3.26 -0.05 0.00 -4.31 0.00 0.00 34.13 26.45 1vdr s GLU 124 CO 0.42 0.59 0.01 0.71 0.01 0.00 0.00 175.26 177.00 1vdr s TYR 125 N -0.85 1.37 -0.13 1.61 2.02 -1.26 -4.99 117.35 115.12 1vdr s TYR 125 Ca 0.26 -0.99 -0.05 0.00 -0.37 0.00 0.00 57.07 55.93 1vdr s TYR 125 Cb -0.18 -0.78 -0.04 0.00 -0.40 0.00 0.00 41.96 40.56 1vdr s TYR 125 CO 0.15 -0.15 0.04 -1.21 -1.57 0.00 0.00 175.55 172.82 1vdr s GLU 126 N -3.90 3.45 0.00 -0.62 2.02 -1.26 -4.95 118.70 113.44 1vdr s GLU 126 Ca 0.27 -0.34 0.00 0.00 0.02 0.00 0.00 54.97 54.91 1vdr s GLU 126 Cb 0.06 -3.02 0.00 0.00 0.10 0.00 0.00 34.13 31.27 1vdr s GLU 126 CO 0.06 0.54 0.00 0.41 0.02 0.00 0.00 175.26 176.30 1vdr n GLY 127 N 2.68 3.20 0.00 -1.39 0.00 -1.26 -4.62 105.19 103.80 1vdr n GLY 127 Ca -0.18 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1vdr n GLY 127 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1vdr n ASP 128 N 0.00 0.00 -4.28 1.61 5.68 -0.81 -4.96 116.55 113.79 1vdr n ASP 128 Ca 0.00 -0.09 -0.33 0.00 -0.50 0.00 0.00 54.79 53.88 1vdr n ASP 128 Cb 0.00 0.00 -0.16 0.00 -1.14 0.00 0.00 41.12 39.82 1vdr n ASP 128 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1vdr s THR 129 N 0.00 2.56 0.17 2.12 -4.23 -1.21 -5.04 115.64 110.00 1vdr s THR 129 Ca 0.00 -0.83 0.09 0.00 -1.18 0.00 0.00 61.69 59.77 1vdr s THR 129 Cb 0.00 -2.04 -0.04 0.00 1.34 0.00 0.00 72.50 71.76 1vdr s THR 129 CO 0.00 0.54 -0.19 -0.31 -0.54 0.00 0.00 174.62 174.12 1vdr s TYR 130 N 0.47 1.88 0.07 3.99 1.51 -1.26 -1.31 117.35 122.69 1vdr s TYR 130 Ca -0.12 -0.45 -0.22 0.00 -1.01 0.00 0.00 57.07 55.26 1vdr s TYR 130 Cb -0.17 -0.94 -0.06 0.00 -0.11 0.00 0.00 41.96 40.68 1vdr s TYR 130 CO 0.05 0.35 0.67 -0.47 -1.11 0.00 0.00 175.55 175.05 1vdr s TYR 131 N -1.99 3.78 0.82 2.71 5.04 -0.35 -4.73 117.35 122.64 1vdr s TYR 131 Ca 0.16 1.39 -0.14 0.00 -2.44 0.00 0.00 57.07 56.04 1vdr s TYR 131 Cb -0.06 -2.67 0.03 0.00 0.35 0.00 0.00 41.96 39.60 1vdr s TYR 131 CO 0.07 0.43 0.74 -0.35 -1.34 0.00 0.00 175.55 175.09 1vdr n PRO 132 N 2.24 0.08 -2.95 4.97 -0.04 -1.26 -4.89 135.00 133.15 1vdr n PRO 132 Ca -0.06 0.09 -0.30 0.00 -0.04 0.00 0.00 63.50 63.18 1vdr n PRO 132 Cb 0.50 -2.06 -0.03 0.00 -0.04 0.00 0.00 33.50 31.88 1vdr n PRO 132 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1vdr s GLU 133 N -3.50 3.74 -0.02 0.54 -1.05 -1.26 -5.08 118.70 112.07 1vdr s GLU 133 Ca 0.66 0.36 -0.03 0.00 -0.15 0.00 0.00 54.97 55.81 1vdr s GLU 133 Cb -0.29 -2.44 0.01 0.00 -0.44 0.00 0.00 34.13 30.96 1vdr s GLU 133 CO 0.58 0.01 0.09 1.67 0.95 0.00 0.00 175.26 178.56 1vdr s TRP 134 N -2.32 -0.05 0.26 4.83 -2.14 -1.26 -5.11 118.94 113.15 1vdr s TRP 134 Ca 0.50 0.13 -0.30 0.00 2.66 0.00 0.00 56.10 59.09 1vdr s TRP 134 Cb -0.10 0.00 -0.09 0.00 -3.10 0.00 0.00 33.47 30.18 1vdr s TRP 134 CO 0.31 -0.09 1.26 0.34 -2.66 0.00 0.00 176.95 176.12 1vdr s ASP 135 N -0.27 6.94 0.30 -2.66 2.15 -1.26 -4.96 116.67 116.91 1vdr s ASP 135 Ca -0.03 2.46 0.14 0.00 0.43 0.00 0.00 52.55 55.55 1vdr s ASP 135 Cb -0.02 -2.63 0.43 0.00 -0.30 0.00 0.00 42.92 40.40 1vdr s ASP 135 CO 0.00 -0.45 1.63 0.00 -0.17 0.00 0.00 175.17 176.18 1vdr h ALA 136 N 4.39 0.93 0.00 3.66 0.00 -2.01 -3.19 119.26 123.04 1vdr h ALA 136 Ca -0.46 -0.49 -0.15 0.00 0.00 0.00 0.00 54.91 53.81 1vdr h ALA 136 Cb 1.22 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1vdr h ALA 136 CO 0.71 0.67 -0.70 0.00 0.00 0.00 0.00 179.25 179.93 1vdr h ALA 137 N 1.46 0.83 0.00 0.00 0.00 -2.06 -3.28 119.26 116.21 1vdr h ALA 137 Ca -0.01 -0.64 -0.07 0.00 0.00 0.00 0.00 54.91 54.20 1vdr h ALA 137 Cb 1.08 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1vdr h ALA 137 CO 0.07 0.88 -0.62 1.05 0.00 0.00 0.00 179.25 180.63 1vdr h GLU 138 N 0.00 0.00 -6.52 0.00 4.11 -1.97 -3.46 114.58 106.74 1vdr h GLU 138 Ca -0.01 0.00 -0.69 0.00 0.07 0.00 0.00 59.36 58.73 1vdr h GLU 138 Cb 1.25 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 30.26 1vdr h GLU 138 CO 0.09 0.22 -0.81 -1.58 0.07 0.00 0.00 179.01 177.00 1vdr s TRP 139 N -3.11 2.56 -0.02 2.06 0.52 -1.21 -0.39 118.94 119.35 1vdr s TRP 139 Ca 0.03 -0.26 0.05 0.00 0.02 0.00 0.00 56.10 55.94 1vdr s TRP 139 Cb 0.07 -1.51 -0.03 0.00 -1.15 0.00 0.00 33.47 30.86 1vdr s TRP 139 CO 0.74 0.19 -0.17 -2.00 0.02 0.00 0.00 176.95 175.73 1vdr s GLU 140 N -1.13 2.33 -0.41 4.98 2.12 0.10 -4.72 118.70 121.98 1vdr s GLU 140 Ca 0.13 -0.80 -0.21 0.00 0.36 0.00 0.00 54.97 54.45 1vdr s GLU 140 Cb -0.10 -2.28 0.02 0.00 0.26 0.00 0.00 34.13 32.02 1vdr s GLU 140 CO 0.03 0.59 0.65 -1.17 -0.54 0.00 0.00 175.26 174.82 1vdr s LEU 141 N -0.89 4.39 -0.02 2.70 1.98 -1.26 -0.70 118.68 124.88 1vdr s LEU 141 Ca 0.12 -0.15 -0.26 0.00 -2.89 0.00 0.00 54.13 50.95 1vdr s LEU 141 Cb -0.10 -2.77 -0.20 0.00 0.66 0.00 0.00 46.19 43.78 1vdr s LEU 141 CO 0.01 -0.73 1.28 -0.78 -1.89 0.00 0.00 176.35 174.24 1vdr h ASP 142 N 8.74 -0.01 -5.14 3.68 3.58 -0.12 -3.47 116.42 123.69 1vdr h ASP 142 Ca -0.26 -0.47 -0.03 0.00 0.42 0.00 0.00 57.03 56.70 1vdr h ASP 142 Cb 1.10 0.00 -0.10 0.00 1.72 0.00 0.00 39.33 42.06 1vdr h ASP 142 CO 0.88 0.47 -0.03 0.00 -2.88 0.00 0.00 179.24 177.68 1vdr s ALA 143 N -4.31 -0.69 -0.25 -0.78 0.00 -0.74 -4.98 121.76 110.01 1vdr s ALA 143 Ca -0.16 -0.47 -0.08 0.00 0.00 0.00 0.00 51.96 51.25 1vdr s ALA 143 Cb 0.02 0.91 0.12 0.00 0.00 0.00 0.00 23.12 24.16 1vdr s ALA 143 CO 0.67 -0.82 0.54 -2.00 0.00 0.00 0.00 175.76 174.14 1vdr s GLU 144 N -3.93 0.46 0.01 0.00 2.12 -1.26 -1.40 118.70 114.70 1vdr s GLU 144 Ca 0.14 1.22 0.05 0.00 0.36 0.00 0.00 54.97 56.73 1vdr s GLU 144 Cb -0.01 0.58 -0.02 0.00 0.26 0.00 0.00 34.13 34.94 1vdr s GLU 144 CO 0.02 -0.26 -0.16 0.95 -0.54 0.00 0.00 175.26 175.27 1vdr s THR 145 N 2.76 1.24 0.07 -1.70 -4.23 -0.16 -5.00 115.64 108.62 1vdr s THR 145 Ca -0.02 -0.80 -0.23 0.00 -1.18 0.00 0.00 61.69 59.46 1vdr s THR 145 Cb -0.12 -1.06 -0.06 0.00 1.34 0.00 0.00 72.50 72.60 1vdr s THR 145 CO -0.16 0.24 0.68 -0.62 -0.54 0.00 0.00 174.62 174.22 1vdr s ASP 146 N -0.64 7.17 0.14 3.99 -1.08 -1.26 -1.03 116.67 123.95 1vdr s ASP 146 Ca 0.05 1.39 0.03 0.00 -0.52 0.00 0.00 52.55 53.50 1vdr s ASP 146 Cb -0.07 -2.43 -0.01 0.00 -1.46 0.00 0.00 42.92 38.95 1vdr s ASP 146 CO 0.00 0.15 0.11 1.41 0.52 0.00 0.00 175.17 177.36 1vdr n HIS 147 N 2.23 -0.29 -2.89 -5.34 8.25 -0.90 -4.96 115.22 111.32 1vdr n HIS 147 Ca -0.06 -1.14 -0.42 0.00 -0.26 0.00 0.00 57.72 55.84 1vdr n HIS 147 Cb 0.50 0.11 -0.04 0.00 1.12 0.00 0.00 29.99 31.68 1vdr n HIS 147 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 1vdr s GLU 148 N -2.56 4.11 0.00 -0.41 2.56 -1.26 -3.91 118.70 117.23 1vdr s GLU 148 Ca 0.16 0.85 0.00 0.00 0.00 0.00 0.00 54.97 55.98 1vdr s GLU 148 Cb 0.01 -3.68 0.00 0.00 2.00 0.00 0.00 34.13 32.46 1vdr s GLU 148 CO 0.11 -0.59 0.00 0.41 -0.56 0.00 0.00 175.26 174.63 1vdr n GLY 149 N 3.89 1.41 3.82 -1.50 0.00 -1.26 -4.89 105.19 106.66 1vdr n GLY 149 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 1vdr n GLY 149 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1vdr s PHE 150 N -2.59 -0.06 -0.05 1.61 -0.71 -1.25 -4.28 117.98 110.66 1vdr s PHE 150 Ca 0.00 -0.40 -0.00 0.00 -1.04 0.00 0.00 56.93 55.48 1vdr s PHE 150 Cb 0.00 0.72 0.03 0.00 -1.21 0.00 0.00 43.02 42.56 1vdr s PHE 150 CO 0.00 -1.15 -0.00 -0.08 -1.34 0.00 0.00 175.22 172.65 1vdr s THR 151 N -3.06 0.31 -0.05 -4.49 -1.32 -1.12 -2.12 115.64 103.78 1vdr s THR 151 Ca 0.14 0.09 -0.21 0.00 -1.21 0.00 0.00 61.69 60.51 1vdr s THR 151 Cb -0.04 -0.43 -0.05 0.00 -1.51 0.00 0.00 72.50 70.47 1vdr s THR 151 CO 0.06 0.21 0.59 -0.22 -2.21 0.00 0.00 174.62 173.05 1vdr s LEU 152 N 1.52 4.35 -0.08 9.08 1.98 -0.20 -0.88 118.68 134.46 1vdr s LEU 152 Ca -0.02 1.07 0.05 0.00 -2.89 0.00 0.00 54.13 52.33 1vdr s LEU 152 Cb -0.13 -2.89 -0.01 0.00 0.66 0.00 0.00 46.19 43.82 1vdr s LEU 152 CO -0.03 0.02 -0.24 -1.10 -1.89 0.00 0.00 176.35 173.12 1vdr s GLN 153 N 0.27 2.79 -0.30 1.98 -0.21 0.34 -0.99 119.66 123.53 1vdr s GLN 153 Ca 0.31 -0.87 -0.04 0.00 0.02 0.00 0.00 55.36 54.78 1vdr s GLN 153 Cb -0.17 -2.25 0.04 0.00 1.00 0.00 0.00 33.01 31.62 1vdr s GLN 153 CO 0.15 0.31 0.03 -1.21 -2.12 0.00 0.00 175.29 172.45 1vdr s GLU 154 N 0.03 2.66 -0.26 2.91 2.02 -0.49 -0.76 118.70 124.82 1vdr s GLU 154 Ca -0.09 -1.12 -0.08 0.00 0.02 0.00 0.00 54.97 53.70 1vdr s GLU 154 Cb -0.15 -3.26 -0.03 0.00 0.10 0.00 0.00 34.13 30.79 1vdr s GLU 154 CO 0.06 -0.57 0.09 -1.58 0.02 0.00 0.00 175.26 173.28 1vdr s TRP 155 N 1.35 3.11 0.22 1.61 0.52 0.01 0.63 118.94 126.39 1vdr s TRP 155 Ca -0.02 -0.44 -0.04 0.00 0.02 0.00 0.00 56.10 55.63 1vdr s TRP 155 Cb -0.19 -2.26 -0.05 0.00 -1.15 0.00 0.00 33.47 29.82 1vdr s TRP 155 CO 0.00 -0.37 0.46 0.54 0.02 0.00 0.00 176.95 177.60 1vdr s VAL 156 N 1.62 5.11 0.66 4.03 0.11 0.12 -0.75 120.40 131.30 1vdr s VAL 156 Ca 0.06 -0.07 -0.14 0.00 -2.93 0.00 0.00 61.98 58.91 1vdr s VAL 156 Cb -0.15 -3.70 0.00 0.00 -1.53 0.00 0.00 36.38 30.99 1vdr s VAL 156 CO 0.04 -0.18 1.09 -0.60 -3.33 0.00 0.00 175.10 172.12 1vdr s ARG 157 N -3.24 2.87 0.00 1.54 3.52 -1.13 -0.72 118.95 121.80 1vdr s ARG 157 Ca 0.42 1.25 0.00 0.00 -0.13 0.00 0.00 55.73 57.26 1vdr s ARG 157 Cb -0.11 -1.97 0.00 0.00 -1.56 0.00 0.00 34.95 31.31 1vdr s ARG 157 CO 0.28 -1.18 0.00 0.45 -0.81 0.00 0.00 175.30 174.04