#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xyv s LYS 3 N 0.00 3.29 0.19 0.00 1.02 -1.26 -1.14 119.74 121.84 1xyv s LYS 3 Ca 0.00 -0.70 0.09 0.00 0.02 0.00 0.00 55.97 55.39 1xyv s LYS 3 Cb 0.00 -2.77 -0.04 0.00 -0.52 0.00 0.00 37.83 34.50 1xyv s LYS 3 CO 0.00 -0.05 -0.12 0.00 -0.92 0.00 0.00 175.35 174.26 1xyv s ALA 4 N 1.02 2.88 -0.08 5.17 0.00 0.51 0.57 121.76 131.83 1xyv s ALA 4 Ca -0.01 -1.53 0.03 0.00 0.00 0.00 0.00 51.96 50.45 1xyv s ALA 4 Cb -0.15 -0.65 0.01 0.00 0.00 0.00 0.00 23.12 22.33 1xyv s ALA 4 CO -0.02 0.44 -0.17 -1.17 0.00 0.00 0.00 175.76 174.84 1xyv s LEU 5 N -2.88 1.81 -0.15 0.00 2.96 -0.46 -0.39 118.68 119.57 1xyv s LEU 5 Ca 0.25 -0.40 0.02 0.00 -0.22 0.00 0.00 54.13 53.78 1xyv s LEU 5 Cb -0.08 -1.05 0.01 0.00 0.50 0.00 0.00 46.19 45.57 1xyv s LEU 5 CO 0.15 0.08 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.42 1xyv s ILE 6 N 0.56 2.00 -0.11 6.68 1.01 -0.08 0.28 121.20 131.55 1xyv s ILE 6 Ca -0.16 -0.93 0.03 0.00 0.00 0.00 0.00 60.65 59.59 1xyv s ILE 6 Cb -0.17 -1.78 -0.00 0.00 0.01 0.00 0.00 42.46 40.52 1xyv s ILE 6 CO 0.05 0.54 -0.21 -0.69 0.00 0.00 0.00 174.94 174.63 1xyv s VAL 7 N 0.97 2.35 0.04 2.92 1.01 -0.10 0.52 120.40 128.12 1xyv s VAL 7 Ca -0.04 -0.91 0.06 0.00 0.00 0.00 0.00 61.98 61.09 1xyv s VAL 7 Cb -0.15 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.28 1xyv s VAL 7 CO -0.05 0.55 -0.16 -0.72 0.00 0.00 0.00 175.10 174.72 1xyv s TYR 8 N 0.34 1.43 -0.16 5.22 -0.85 -0.80 -0.12 117.35 122.41 1xyv s TYR 8 Ca -0.16 -0.36 -0.01 0.00 -0.52 0.00 0.00 57.07 56.02 1xyv s TYR 8 Cb -0.17 -0.84 -0.01 0.00 0.38 0.00 0.00 41.96 41.32 1xyv s TYR 8 CO 0.08 0.06 -0.13 0.20 -1.52 0.00 0.00 175.55 174.24 1xyv s GLY 9 N -1.20 1.52 -0.13 5.49 0.00 0.41 -0.32 107.32 113.10 1xyv s GLY 9 Ca 0.03 -1.01 -0.06 0.00 0.00 0.00 0.00 44.72 43.69 1xyv s GLY 9 CO 0.02 0.01 0.28 -0.45 0.00 0.00 0.00 173.10 172.96 1xyv s SER 10 N 0.75 -0.10 -0.15 1.64 0.15 -1.26 -2.66 113.70 112.07 1xyv s SER 10 Ca -0.05 0.63 -0.04 0.00 0.70 0.00 0.00 55.95 57.18 1xyv s SER 10 Cb -0.15 0.61 -0.24 0.00 -1.71 0.00 0.00 66.02 64.52 1xyv s SER 10 CO 0.01 -0.20 0.26 0.41 1.20 0.00 0.00 173.24 174.92 1xyv n THR 11 N 4.66 1.72 -0.10 6.45 -1.04 -1.26 -4.40 114.28 120.31 1xyv n THR 11 Ca -0.18 -0.65 0.03 0.00 -2.04 0.00 0.00 64.05 61.22 1xyv n THR 11 Cb 0.52 -1.64 0.09 0.00 -1.82 0.00 0.00 70.33 67.48 1xyv n THR 11 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1xyv n THR 12 N -3.42 0.97 -0.72 12.58 -2.24 -1.26 -4.98 114.28 115.22 1xyv n THR 12 Ca -0.34 -0.98 0.00 0.00 -2.27 0.00 0.00 64.05 60.45 1xyv n THR 12 Cb 1.04 0.52 0.00 0.00 -2.10 0.00 0.00 70.33 69.79 1xyv n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xyv n GLY 13 N 0.14 0.66 0.11 3.38 0.00 -1.26 -4.98 105.19 103.23 1xyv n GLY 13 Ca 0.07 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.94 1xyv n GLY 13 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1xyv h ASN 14 N 0.00 0.28 0.67 1.61 2.35 -1.93 0.23 115.58 118.79 1xyv h ASN 14 Ca 0.00 -0.67 -0.15 0.00 -0.55 0.00 0.00 56.30 54.93 1xyv h ASN 14 Cb 0.00 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 1xyv h ASN 14 CO 0.00 0.91 -0.70 0.74 -1.65 0.00 0.00 177.43 176.72 1xyv h THR 15 N -0.33 1.50 -0.59 2.81 2.02 -1.94 0.12 112.91 116.50 1xyv h THR 15 Ca -0.02 -2.39 -0.01 0.00 0.77 0.00 0.00 66.41 64.76 1xyv h THR 15 Cb 0.91 2.29 -0.03 0.00 -1.74 0.00 0.00 68.15 69.57 1xyv h THR 15 CO 0.05 0.68 0.31 -0.08 0.37 0.00 0.00 175.52 176.85 1xyv h GLU 16 N 0.02 0.83 -0.91 6.66 4.81 -1.82 0.08 114.58 124.25 1xyv h GLU 16 Ca -0.01 -0.11 0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1xyv h GLU 16 Cb 1.24 -0.16 -0.06 0.00 0.63 0.00 0.00 28.75 30.41 1xyv h GLU 16 CO 0.09 0.65 0.59 -0.92 -0.73 0.00 0.00 179.01 178.69 1xyv h TYR 17 N 0.80 1.06 -0.30 0.92 5.03 -0.07 -0.46 116.97 123.95 1xyv h TYR 17 Ca 0.21 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.52 1xyv h TYR 17 Cb 0.07 -0.35 -0.01 0.00 1.55 0.00 0.00 36.73 37.98 1xyv h TYR 17 CO -0.01 0.57 0.11 1.15 -1.32 0.00 0.00 178.16 178.66 1xyv h THR 18 N 1.06 1.19 -0.98 1.81 2.02 -0.19 -1.39 112.91 116.43 1xyv h THR 18 Ca 0.38 -0.58 0.09 0.00 0.77 0.00 0.00 66.41 67.07 1xyv h THR 18 Cb 0.16 1.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.50 1xyv h THR 18 CO -0.14 0.20 0.62 0.00 0.37 0.00 0.00 175.52 176.57 1xyv h ALA 19 N 0.95 1.41 -0.38 6.16 0.00 -0.43 -0.17 119.26 126.80 1xyv h ALA 19 Ca 0.10 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1xyv h ALA 19 Cb 0.20 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1xyv h ALA 19 CO -0.01 0.34 -0.19 0.93 0.00 0.00 0.00 179.25 180.32 1xyv h GLU 20 N 1.08 0.80 -0.05 0.00 5.08 -0.59 0.31 114.58 121.21 1xyv h GLU 20 Ca 0.45 -0.36 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1xyv h GLU 20 Cb 0.29 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1xyv h GLU 20 CO -0.21 0.98 0.01 1.15 -1.00 0.00 0.00 179.01 179.94 1xyv h THR 21 N 0.60 1.22 -0.24 1.13 2.02 -0.89 0.10 112.91 116.85 1xyv h THR 21 Ca 0.08 -0.68 0.04 0.00 0.77 0.00 0.00 66.41 66.63 1xyv h THR 21 Cb 0.75 1.58 -0.04 0.00 -1.74 0.00 0.00 68.15 68.69 1xyv h THR 21 CO 0.06 0.19 0.00 0.40 0.37 0.00 0.00 175.52 176.54 1xyv h ILE 22 N -0.17 0.83 -0.44 3.11 2.04 -0.92 -1.06 117.51 120.91 1xyv h ILE 22 Ca 0.02 -0.03 0.06 0.00 1.00 0.00 0.00 64.86 65.91 1xyv h ILE 22 Cb 0.29 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 37.06 1xyv h ILE 22 CO 0.00 0.01 0.12 0.00 0.00 0.00 0.00 178.15 178.29 1xyv h ALA 23 N 1.20 0.50 -0.81 1.87 0.00 -0.01 0.95 119.26 122.96 1xyv h ALA 23 Ca 0.11 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1xyv h ALA 23 Cb 0.14 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1xyv h ALA 23 CO -0.19 -0.28 0.46 -0.09 0.00 0.00 0.00 179.25 179.15 1xyv h ARG 24 N 0.27 1.12 -0.23 0.00 9.65 -0.80 0.81 114.38 125.20 1xyv h ARG 24 Ca 0.21 -0.12 0.00 0.00 -1.10 0.00 0.00 59.98 58.97 1xyv h ARG 24 Cb 0.23 -0.22 -0.01 0.00 -1.39 0.00 0.00 29.97 28.58 1xyv h ARG 24 CO -0.24 0.81 0.15 0.93 2.80 0.00 0.00 179.97 184.42 1xyv h GLU 25 N 1.12 0.29 0.09 0.20 4.39 0.33 0.14 114.58 121.14 1xyv h GLU 25 Ca 0.29 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.96 1xyv h GLU 25 Cb 0.01 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.60 1xyv h GLU 25 CO -0.05 0.19 -0.04 -0.07 -1.16 0.00 0.00 179.01 177.88 1xyv h LEU 26 N 0.30 -0.10 -1.46 1.33 3.38 -0.52 -2.01 115.31 116.23 1xyv h LEU 26 Ca 0.08 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1xyv h LEU 26 Cb -0.03 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1xyv h LEU 26 CO -0.02 -0.04 0.33 0.00 0.09 0.00 0.00 178.44 178.80 1xyv h ALA 27 N 0.76 1.60 0.00 1.53 0.00 0.10 -1.37 119.26 121.88 1xyv h ALA 27 Ca -0.01 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1xyv h ALA 27 Cb 0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1xyv h ALA 27 CO 0.02 0.36 -0.18 -0.44 0.00 0.00 0.00 179.25 179.00 1xyv h ASP 28 N 0.71 0.00 0.66 0.00 3.32 -0.59 -0.63 116.42 119.89 1xyv h ASP 28 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1xyv h ASP 28 Cb -0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 1xyv h ASP 28 CO -0.04 0.18 -0.05 0.00 -1.72 0.00 0.00 179.24 177.61 1xyv n ALA 29 N -2.23 2.56 0.00 3.45 0.00 -0.57 -4.94 120.51 118.78 1xyv n ALA 29 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1xyv n ALA 29 Cb 0.37 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1xyv n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xyv n GLY 30 N 1.36 0.30 3.76 0.00 0.00 -0.24 -5.08 105.19 105.29 1xyv n GLY 30 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1xyv n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xyv s TYR 31 N -2.00 2.50 -0.02 1.61 1.51 -0.89 -4.67 117.35 115.39 1xyv s TYR 31 Ca 0.00 1.55 -0.21 0.00 -1.01 0.00 0.00 57.07 57.39 1xyv s TYR 31 Cb 0.00 -3.33 -0.05 0.00 -0.11 0.00 0.00 41.96 38.47 1xyv s TYR 31 CO 0.00 -1.91 0.62 -1.21 -1.11 0.00 0.00 175.55 171.94 1xyv s GLU 32 N -3.61 4.36 -0.09 -0.62 2.02 -0.29 -4.26 118.70 116.21 1xyv s GLU 32 Ca 0.72 0.76 0.02 0.00 0.02 0.00 0.00 54.97 56.50 1xyv s GLU 32 Cb -0.25 -3.37 0.01 0.00 0.10 0.00 0.00 34.13 30.62 1xyv s GLU 32 CO 0.35 0.29 -0.15 0.08 0.02 0.00 0.00 175.26 175.85 1xyv s VAL 33 N 0.08 1.42 -0.30 2.63 1.01 -1.26 -0.36 120.40 123.61 1xyv s VAL 33 Ca 0.32 -0.62 -0.01 0.00 0.00 0.00 0.00 61.98 61.68 1xyv s VAL 33 Cb -0.18 -1.28 0.06 0.00 0.00 0.00 0.00 36.38 34.97 1xyv s VAL 33 CO 0.17 0.42 -0.01 -0.62 0.00 0.00 0.00 175.10 175.07 1xyv s ASP 34 N 0.79 4.82 -0.09 3.32 -1.08 0.48 -4.98 116.67 119.93 1xyv s ASP 34 Ca -0.11 -1.39 -0.03 0.00 -0.52 0.00 0.00 52.55 50.49 1xyv s ASP 34 Cb -0.16 -1.68 -0.04 0.00 -1.46 0.00 0.00 42.92 39.58 1xyv s ASP 34 CO 0.02 -0.27 0.05 -0.44 0.52 0.00 0.00 175.17 175.05 1xyv s SER 35 N 1.25 5.64 0.01 -0.34 0.01 -1.26 -0.90 113.70 118.11 1xyv s SER 35 Ca -0.04 0.25 0.01 0.00 1.31 0.00 0.00 55.95 57.48 1xyv s SER 35 Cb -0.20 -1.68 -0.01 0.00 0.21 0.00 0.00 66.02 64.34 1xyv s SER 35 CO -0.02 0.38 -0.04 -0.13 0.41 0.00 0.00 173.24 173.84 1xyv s ARG 36 N -0.99 0.30 0.18 12.44 0.52 0.18 -4.94 118.95 126.65 1xyv s ARG 36 Ca 0.14 -0.35 -0.30 0.00 -0.52 0.00 0.00 55.73 54.71 1xyv s ARG 36 Cb -0.12 -0.16 -0.08 0.00 0.52 0.00 0.00 34.95 35.12 1xyv s ARG 36 CO 0.04 0.03 1.07 0.34 0.02 0.00 0.00 175.30 176.80 1xyv s ASP 37 N -0.69 7.32 0.41 0.23 -1.08 -1.26 -1.90 116.67 119.70 1xyv s ASP 37 Ca -0.05 2.05 0.09 0.00 -0.52 0.00 0.00 52.55 54.13 1xyv s ASP 37 Cb -0.05 -2.60 0.91 0.00 -1.46 0.00 0.00 42.92 39.71 1xyv s ASP 37 CO -0.00 -0.17 2.03 0.00 0.52 0.00 0.00 175.17 177.54 1xyv h ALA 38 N 5.02 1.81 -0.73 3.66 0.00 -0.98 -0.97 119.26 127.07 1xyv h ALA 38 Ca -0.44 -0.02 0.16 0.00 0.00 0.00 0.00 54.91 54.61 1xyv h ALA 38 Cb 1.21 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.82 1xyv h ALA 38 CO 0.72 0.12 0.50 0.00 0.00 0.00 0.00 179.25 180.59 1xyv h ALA 39 N 1.72 2.26 -0.01 0.00 0.00 -1.80 -2.30 119.26 119.13 1xyv h ALA 39 Ca 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1xyv h ALA 39 Cb 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1xyv h ALA 39 CO -0.05 -0.46 -0.29 -1.13 0.00 0.00 0.00 179.25 177.31 1xyv n SER 40 N -4.44 1.39 -4.96 0.00 3.41 -0.38 -5.01 113.62 103.62 1xyv n SER 40 Ca 0.14 -1.14 -0.22 0.00 -0.26 0.00 0.00 58.87 57.40 1xyv n SER 40 Cb 0.59 0.21 0.01 0.00 -0.26 0.00 0.00 64.21 64.77 1xyv n SER 40 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1xyv s VAL 41 N -2.44 3.95 -0.10 -3.33 -7.23 -0.87 -5.02 120.40 105.36 1xyv s VAL 41 Ca 0.24 -0.64 0.03 0.00 -1.81 0.00 0.00 61.98 59.80 1xyv s VAL 41 Cb 0.19 -3.44 -0.01 0.00 0.56 0.00 0.00 36.38 33.69 1xyv s VAL 41 CO 0.51 -0.27 -0.21 -1.61 -0.31 0.00 0.00 175.10 173.22 1xyv s GLU 42 N -4.46 3.05 0.22 4.82 2.02 -1.26 -4.96 118.70 118.14 1xyv s GLU 42 Ca 0.48 -0.82 -0.02 0.00 0.02 0.00 0.00 54.97 54.62 1xyv s GLU 42 Cb -0.10 -2.37 0.22 0.00 0.10 0.00 0.00 34.13 31.98 1xyv s GLU 42 CO 0.36 0.23 1.61 0.00 0.02 0.00 0.00 175.26 177.48 1xyv h ALA 43 N 6.57 0.87 -2.01 5.21 0.00 -1.91 -3.38 119.26 124.62 1xyv h ALA 43 Ca -0.23 -0.41 -0.59 0.00 0.00 0.00 0.00 54.91 53.67 1xyv h ALA 43 Cb 1.22 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.90 1xyv h ALA 43 CO 0.49 0.63 1.26 0.41 0.00 0.00 0.00 179.25 182.05 1xyv n GLY 44 N -0.10 1.38 2.81 0.00 0.00 -1.23 -1.52 105.19 106.54 1xyv n GLY 44 Ca -0.01 0.84 -0.01 0.00 0.00 0.00 0.00 46.02 46.84 1xyv n GLY 44 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyv n GLY 45 N 4.98 0.20 0.38 -0.02 0.00 0.19 -4.88 105.19 106.03 1xyv n GLY 45 Ca 0.26 -0.01 0.22 0.00 0.00 0.00 0.00 46.02 46.48 1xyv n GLY 45 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1xyv h LEU 46 N 0.00 0.53 -0.47 0.99 5.85 -1.27 -0.23 115.31 120.71 1xyv h LEU 46 Ca -0.03 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1xyv h LEU 46 Cb 0.86 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.94 1xyv h LEU 46 CO 0.04 0.03 -0.10 0.49 -0.34 0.00 0.00 178.44 178.56 1xyv n PHE 47 N -4.81 0.00 -1.97 1.25 3.72 0.12 -4.89 117.46 110.89 1xyv n PHE 47 Ca 0.28 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.26 1xyv n PHE 47 Cb 0.90 -0.09 -0.03 0.00 -0.94 0.00 0.00 39.48 39.31 1xyv n PHE 47 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1xyv s GLU 48 N -2.28 4.23 0.00 -1.08 2.02 -0.10 -1.63 118.70 119.85 1xyv s GLU 48 Ca 0.33 2.32 0.00 0.00 0.02 0.00 0.00 54.97 57.64 1xyv s GLU 48 Cb 0.20 -3.21 0.00 0.00 0.10 0.00 0.00 34.13 31.22 1xyv s GLU 48 CO 0.43 -0.60 0.00 0.41 0.02 0.00 0.00 175.26 175.53 1xyv n GLY 49 N 3.74 0.68 3.73 -1.39 0.00 -1.26 -5.06 105.19 105.63 1xyv n GLY 49 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1xyv n GLY 49 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xyv s PHE 50 N -2.32 3.23 -0.22 1.61 0.08 -0.65 -4.84 117.98 114.87 1xyv s PHE 50 Ca 0.00 0.22 0.19 0.00 0.12 0.00 0.00 56.93 57.46 1xyv s PHE 50 Cb 0.00 -1.78 0.24 0.00 -0.57 0.00 0.00 43.02 40.91 1xyv s PHE 50 CO 0.00 0.52 1.54 -0.44 -0.10 0.00 0.00 175.22 176.74 1xyv h ASP 51 N 4.80 0.00 -3.67 1.36 3.32 -0.20 -3.46 116.42 118.58 1xyv h ASP 51 Ca -0.51 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.40 1xyv h ASP 51 Cb 1.19 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.49 1xyv h ASP 51 CO 0.57 0.31 -0.33 -0.22 -1.72 0.00 0.00 179.24 177.85 1xyv s LEU 52 N -6.40 0.48 -0.09 1.55 2.96 -1.08 -4.03 118.68 112.06 1xyv s LEU 52 Ca 0.05 0.72 0.03 0.00 -0.22 0.00 0.00 54.13 54.70 1xyv s LEU 52 Cb 0.07 1.17 0.01 0.00 0.50 0.00 0.00 46.19 47.94 1xyv s LEU 52 CO 0.71 -0.14 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.73 1xyv s VAL 53 N 0.57 1.62 -0.17 1.68 1.01 0.30 -1.35 120.40 124.05 1xyv s VAL 53 Ca -0.03 -0.75 -0.00 0.00 0.00 0.00 0.00 61.98 61.19 1xyv s VAL 53 Cb -0.05 -1.44 0.00 0.00 0.00 0.00 0.00 36.38 34.90 1xyv s VAL 53 CO -0.03 0.46 -0.15 -0.76 0.00 0.00 0.00 175.10 174.62 1xyv s LEU 54 N 0.59 2.46 -0.20 3.92 1.43 0.14 -2.00 118.68 125.02 1xyv s LEU 54 Ca -0.15 -0.50 -0.03 0.00 -1.03 0.00 0.00 54.13 52.42 1xyv s LEU 54 Cb -0.17 -1.57 -0.01 0.00 0.03 0.00 0.00 46.19 44.48 1xyv s LEU 54 CO 0.05 0.05 -0.06 -0.76 0.23 0.00 0.00 176.35 175.85 1xyv s LEU 55 N 1.04 2.85 -0.10 1.79 1.43 -0.49 -0.92 118.68 124.27 1xyv s LEU 55 Ca -0.01 -0.38 -0.02 0.00 -1.03 0.00 0.00 54.13 52.69 1xyv s LEU 55 Cb -0.15 -1.71 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 1xyv s LEU 55 CO -0.04 0.02 -0.00 -0.83 0.23 0.00 0.00 176.35 175.73 1xyv s GLY 56 N 1.22 1.84 -0.26 -3.19 0.00 0.84 -0.18 107.32 107.58 1xyv s GLY 56 Ca 0.03 -0.81 -0.16 0.00 0.00 0.00 0.00 44.72 43.78 1xyv s GLY 56 CO -0.02 -0.49 0.65 0.00 0.00 0.00 0.00 173.10 173.24 1xyv s SER 58 N 1.42 4.62 -0.11 0.00 1.04 -1.09 -4.06 113.70 115.53 1xyv s SER 58 Ca -0.08 0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.74 1xyv s SER 58 Cb -0.05 -0.96 -0.02 0.00 0.10 0.00 0.00 66.02 65.08 1xyv s SER 58 CO -0.16 -1.73 -0.11 -0.89 0.98 0.00 0.00 173.24 171.33 1xyv s THR 59 N -3.31 3.25 0.43 2.02 2.01 -1.10 -1.63 115.64 117.30 1xyv s THR 59 Ca 0.62 -0.61 0.03 0.00 0.31 0.00 0.00 61.69 62.04 1xyv s THR 59 Cb -0.10 -2.35 -0.03 0.00 0.01 0.00 0.00 72.50 70.04 1xyv s THR 59 CO 0.46 0.54 0.08 0.26 -0.69 0.00 0.00 174.62 175.27 1xyv s TRP 60 N -0.03 1.85 0.00 4.92 0.52 0.62 -4.90 118.94 121.92 1xyv s TRP 60 Ca -0.02 -1.14 0.00 0.00 0.02 0.00 0.00 56.10 54.96 1xyv s TRP 60 Cb -0.14 -1.32 0.00 0.00 -1.15 0.00 0.00 33.47 30.86 1xyv s TRP 60 CO 0.04 -0.10 0.00 0.41 0.02 0.00 0.00 176.95 177.32 1xyv n GLY 61 N -0.99 2.37 1.01 0.98 0.00 -1.26 -1.05 105.19 106.25 1xyv n GLY 61 Ca -0.09 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 43.94 1xyv n GLY 61 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xyv n ASP 62 N 0.00 0.06 -0.61 1.61 -0.08 -1.26 -4.86 116.55 111.41 1xyv n ASP 62 Ca 0.00 0.01 0.08 0.00 -1.51 0.00 0.00 54.79 53.37 1xyv n ASP 62 Cb 0.00 -0.02 0.06 0.00 2.34 0.00 0.00 41.12 43.50 1xyv n ASP 62 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 1xyv n ASP 63 N -2.56 2.24 -4.11 1.67 5.75 -1.26 -4.53 116.55 113.76 1xyv n ASP 63 Ca 0.00 -1.62 -0.32 0.00 -0.01 0.00 0.00 54.79 52.84 1xyv n ASP 63 Cb 0.00 0.09 -0.16 0.00 -1.03 0.00 0.00 41.12 40.02 1xyv n ASP 63 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xyv s ILE 65 N 1.20 3.06 0.00 0.00 1.01 -1.26 -4.22 121.20 121.00 1xyv s ILE 65 Ca 0.02 0.08 0.08 0.00 0.00 0.00 0.00 60.65 60.82 1xyv s ILE 65 Cb -0.14 -3.06 -0.02 0.00 0.01 0.00 0.00 42.46 39.26 1xyv s ILE 65 CO -0.10 -0.01 -0.25 -1.61 0.00 0.00 0.00 174.94 172.97 1xyv s GLU 66 N 4.82 1.91 0.33 2.79 2.02 -0.22 -4.98 118.70 125.36 1xyv s GLU 66 Ca 0.90 -0.96 -0.14 0.00 0.02 0.00 0.00 54.97 54.79 1xyv s GLU 66 Cb -0.40 -1.93 -0.08 0.00 0.10 0.00 0.00 34.13 31.82 1xyv s GLU 66 CO 0.39 0.52 0.72 -0.51 0.02 0.00 0.00 175.26 176.40 1xyv s LEU 67 N -0.81 4.03 0.27 1.80 1.02 -1.26 -0.28 118.68 123.45 1xyv s LEU 67 Ca 0.10 1.22 -0.27 0.00 0.02 0.00 0.00 54.13 55.19 1xyv s LEU 67 Cb -0.10 -4.03 -0.15 0.00 0.02 0.00 0.00 46.19 41.93 1xyv s LEU 67 CO 0.00 -0.23 0.78 1.67 0.02 0.00 0.00 176.35 178.60 1xyv n GLN 68 N -0.52 0.79 -0.32 1.70 0.00 -0.65 -4.75 117.38 113.64 1xyv n GLN 68 Ca 0.03 0.28 0.06 0.00 -0.00 0.00 0.00 57.00 57.37 1xyv n GLN 68 Cb 0.53 -1.51 0.22 0.00 0.00 0.00 0.00 30.24 29.48 1xyv n GLN 68 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.06 177.28 1xyv h ASP 69 N 1.50 0.72 1.34 1.69 3.58 -1.94 -0.97 116.42 122.33 1xyv h ASP 69 Ca -0.36 0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.16 1xyv h ASP 69 Cb 1.38 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 42.36 1xyv h ASP 69 CO 0.58 0.36 0.00 0.44 -2.88 0.00 0.00 179.24 177.74 1xyv h ASP 70 N 0.80 0.00 0.70 2.28 3.32 -1.93 -3.20 116.42 118.39 1xyv h ASP 70 Ca 0.46 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 57.27 1xyv h ASP 70 Cb 0.53 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.04 1xyv h ASP 70 CO -0.30 0.00 -1.42 0.15 -1.72 0.00 0.00 179.24 175.95 1xyv h PHE 71 N 0.00 0.00 -0.72 4.55 3.04 -1.49 -3.35 116.94 118.96 1xyv h PHE 71 Ca 0.00 0.00 0.16 0.00 3.98 0.00 0.00 57.97 62.11 1xyv h PHE 71 Cb 0.67 0.00 -0.13 0.00 2.56 0.00 0.00 35.95 39.05 1xyv h PHE 71 CO 0.00 0.92 -0.07 0.82 -2.02 0.00 0.00 178.31 177.96 1xyv h ILE 72 N 0.00 0.33 -0.75 1.41 2.04 -1.53 0.16 117.51 119.18 1xyv h ILE 72 Ca -0.18 -0.02 0.04 0.00 1.00 0.00 0.00 64.86 65.69 1xyv h ILE 72 Cb 1.86 0.27 -0.05 0.00 -0.74 0.00 0.00 36.82 38.16 1xyv h ILE 72 CO 0.09 0.01 0.47 -0.65 0.00 0.00 0.00 178.15 178.07 1xyv h PRO 73 N 0.06 0.87 -0.43 2.37 0.11 -1.80 0.15 132.00 133.33 1xyv h PRO 73 Ca 0.38 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.31 1xyv h PRO 73 Cb 0.63 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 1xyv h PRO 73 CO -0.68 0.58 -0.21 1.25 -0.21 0.00 0.00 178.00 178.73 1xyv h LEU 74 N 0.90 0.89 -0.53 2.35 5.85 -1.41 -1.90 115.31 121.45 1xyv h LEU 74 Ca 0.31 -0.32 0.06 0.00 0.84 0.00 0.00 57.88 58.76 1xyv h LEU 74 Cb 0.06 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 40.79 1xyv h LEU 74 CO -0.13 1.07 0.24 0.15 -0.34 0.00 0.00 178.44 179.44 1xyv h PHE 75 N 0.76 0.44 0.00 1.25 3.57 0.27 0.70 116.94 123.92 1xyv h PHE 75 Ca 0.10 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 1xyv h PHE 75 Cb 0.75 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.37 1xyv h PHE 75 CO 0.04 0.19 -0.06 -0.44 -2.23 0.00 0.00 178.31 175.81 1xyv h ASP 76 N 0.47 0.00 -0.40 0.41 3.32 -0.82 -2.74 116.42 116.67 1xyv h ASP 76 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1xyv h ASP 76 Cb 0.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1xyv h ASP 76 CO -0.20 0.06 0.00 -1.20 -1.72 0.00 0.00 179.24 176.18 1xyv n SER 77 N -3.26 3.85 0.02 6.45 7.64 -0.21 -4.70 113.62 123.42 1xyv n SER 77 Ca -0.01 -2.54 0.21 0.00 1.01 0.00 0.00 58.87 57.55 1xyv n SER 77 Cb 0.27 -0.45 0.73 0.00 -1.01 0.00 0.00 64.21 63.75 1xyv n SER 77 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1xyv h LEU 78 N 2.51 0.00 -0.71 -3.43 3.38 -0.62 -0.57 115.31 115.88 1xyv h LEU 78 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xyv h LEU 78 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1xyv h LEU 78 CO 0.16 0.00 0.00 1.21 0.09 0.00 0.00 178.44 179.90 1xyv n GLU 79 N -4.04 0.17 -0.37 1.13 2.13 -1.26 -2.54 120.64 115.86 1xyv n GLU 79 Ca 0.10 0.43 0.12 0.00 0.66 0.00 0.00 57.16 58.46 1xyv n GLU 79 Cb 0.65 -1.85 0.32 0.00 0.27 0.00 0.00 31.44 30.84 1xyv n GLU 79 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1xyv n GLU 80 N -2.17 2.68 -0.01 5.31 1.02 -0.22 -4.52 120.64 122.74 1xyv n GLU 80 Ca 0.02 -2.59 0.10 0.00 -0.02 0.00 0.00 57.16 54.66 1xyv n GLU 80 Cb 0.20 -1.56 -0.14 0.00 -0.02 0.00 0.00 31.44 29.92 1xyv n GLU 80 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1xyv n THR 81 N 1.60 0.00 -0.97 2.62 -2.24 -1.05 0.55 114.28 114.79 1xyv n THR 81 Ca 0.24 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1xyv n THR 81 Cb 0.61 0.34 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 1xyv n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xyv n GLY 82 N 1.40 0.48 0.01 3.38 0.00 -1.26 -0.70 105.19 108.49 1xyv n GLY 82 Ca -0.01 -0.24 0.11 0.00 0.00 0.00 0.00 46.02 45.87 1xyv n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xyv n ALA 83 N -0.49 4.20 -1.69 4.61 0.00 -1.26 -4.63 120.51 121.24 1xyv n ALA 83 Ca 0.00 -0.53 -0.43 0.00 0.00 0.00 0.00 53.44 52.47 1xyv n ALA 83 Cb 0.24 -0.84 -0.03 0.00 0.00 0.00 0.00 19.45 18.82 1xyv n ALA 83 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1xyv n GLN 84 N -1.66 2.66 -0.04 0.00 -0.06 -1.25 -1.35 117.38 115.69 1xyv n GLN 84 Ca 0.03 0.97 0.00 0.00 -2.00 0.00 0.00 57.00 56.00 1xyv n GLN 84 Cb 0.38 -2.83 0.00 0.00 -4.06 0.00 0.00 30.24 23.72 1xyv n GLN 84 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1xyv n GLY 85 N 4.07 2.82 3.75 1.69 0.00 -0.22 -4.89 105.19 112.42 1xyv n GLY 85 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1xyv n GLY 85 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1xyv s ARG 86 N -0.00 4.63 -0.11 1.61 6.06 -0.46 -4.54 118.95 126.14 1xyv s ARG 86 Ca 0.00 1.77 -0.25 0.00 -2.50 0.00 0.00 55.73 54.75 1xyv s ARG 86 Cb 0.00 -3.22 -0.03 0.00 0.06 0.00 0.00 34.95 31.76 1xyv s ARG 86 CO 0.00 0.18 0.78 0.15 -2.50 0.00 0.00 175.30 173.90 1xyv s LYS 87 N -1.08 4.38 0.10 5.12 1.02 -1.26 0.18 119.74 128.21 1xyv s LYS 87 Ca 0.46 0.98 -0.05 0.00 0.02 0.00 0.00 55.97 57.37 1xyv s LYS 87 Cb -0.31 -3.51 -0.02 0.00 -0.52 0.00 0.00 37.83 33.47 1xyv s LYS 87 CO 0.39 -0.13 0.13 0.14 -0.92 0.00 0.00 175.35 174.96 1xyv s VAL 88 N 1.44 0.14 -0.04 3.17 -7.23 -0.38 -0.54 120.40 116.96 1xyv s VAL 88 Ca 0.39 -1.52 -0.26 0.00 -1.81 0.00 0.00 61.98 58.77 1xyv s VAL 88 Cb -0.17 -1.62 0.06 0.00 0.56 0.00 0.00 36.38 35.20 1xyv s VAL 88 CO 0.16 -0.63 0.57 0.00 -0.31 0.00 0.00 175.10 174.89 1xyv s ALA 89 N -3.93 -1.47 0.21 1.32 0.00 -0.85 -0.72 121.76 116.32 1xyv s ALA 89 Ca 0.12 1.03 0.11 0.00 0.00 0.00 0.00 51.96 53.22 1xyv s ALA 89 Cb 0.06 0.00 -0.05 0.00 0.00 0.00 0.00 23.12 23.13 1xyv s ALA 89 CO -0.06 -0.33 -0.23 0.00 0.00 0.00 0.00 175.76 175.14 1xyv s PHE 91 N -1.89 -0.02 -0.24 0.00 -0.71 0.74 -0.85 117.98 115.00 1xyv s PHE 91 Ca 0.22 -0.35 -0.37 0.00 -1.04 0.00 0.00 56.93 55.40 1xyv s PHE 91 Cb -0.07 0.11 0.15 0.00 -1.21 0.00 0.00 43.02 42.00 1xyv s PHE 91 CO 0.10 -0.64 1.31 0.20 -1.34 0.00 0.00 175.22 174.85 1xyv s GLY 92 N -2.84 -0.24 -0.07 1.99 0.00 -0.58 -1.46 107.32 104.13 1xyv s GLY 92 Ca 0.04 1.77 -0.03 0.00 0.00 0.00 0.00 44.72 46.51 1xyv s GLY 92 CO -0.11 0.59 0.07 0.00 0.00 0.00 0.00 173.10 173.65 1xyv n GLY 94 N 1.75 3.42 3.12 0.00 0.00 0.63 -2.72 105.19 111.39 1xyv n GLY 94 Ca -0.17 -0.98 -0.12 0.00 0.00 0.00 0.00 46.02 44.76 1xyv n GLY 94 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xyv s ASP 95 N 1.28 -0.16 0.00 1.61 -1.08 -1.26 -1.78 116.67 115.28 1xyv s ASP 95 Ca 0.00 0.68 0.10 0.00 -0.52 0.00 0.00 52.55 52.81 1xyv s ASP 95 Cb 0.00 0.67 0.54 0.00 -1.46 0.00 0.00 42.92 42.67 1xyv s ASP 95 CO 0.00 -0.20 1.09 -1.54 0.52 0.00 0.00 175.17 175.04 1xyv n SER 96 N 4.66 0.00 0.03 -0.34 3.41 -1.26 -2.24 113.62 117.88 1xyv n SER 96 Ca -0.18 -0.12 0.12 0.00 -0.26 0.00 0.00 58.87 58.43 1xyv n SER 96 Cb 0.52 -0.11 0.31 0.00 -0.26 0.00 0.00 64.21 64.67 1xyv n SER 96 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1xyv n SER 97 N -1.11 0.49 -4.89 4.04 3.41 -1.26 -4.81 113.62 109.50 1xyv n SER 97 Ca 0.06 0.09 -0.30 0.00 -0.26 0.00 0.00 58.87 58.47 1xyv n SER 97 Cb 0.05 -0.02 0.03 0.00 -0.26 0.00 0.00 64.21 64.00 1xyv n SER 97 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1xyv s TYR 98 N -3.06 3.44 0.18 7.33 2.02 -0.95 -4.98 117.35 121.33 1xyv s TYR 98 Ca 0.10 1.04 -0.12 0.00 -0.37 0.00 0.00 57.07 57.72 1xyv s TYR 98 Cb 0.16 -2.82 0.09 0.00 -0.40 0.00 0.00 41.96 38.99 1xyv s TYR 98 CO 0.66 -0.87 1.79 1.49 -1.57 0.00 0.00 175.55 177.06 1xyv h GLU 99 N -0.38 0.85 -3.47 -0.62 4.81 -1.87 -3.35 114.58 110.55 1xyv h GLU 99 Ca -0.45 -0.10 -0.68 0.00 -0.13 0.00 0.00 59.36 58.00 1xyv h GLU 99 Cb 1.23 -0.17 -0.37 0.00 0.63 0.00 0.00 28.75 30.07 1xyv h GLU 99 CO 0.62 0.65 -0.39 0.71 -0.73 0.00 0.00 179.01 179.88 1xyv s TYR 100 N -5.84 3.43 -0.00 0.92 2.02 -1.26 -5.05 117.35 111.56 1xyv s TYR 100 Ca -0.13 -2.88 -0.30 0.00 -0.37 0.00 0.00 57.07 53.39 1xyv s TYR 100 Cb 0.13 -3.11 -0.06 0.00 -0.40 0.00 0.00 41.96 38.52 1xyv s TYR 100 CO 0.78 -0.79 1.55 0.12 -1.57 0.00 0.00 175.55 175.64 1xyv s PHE 101 N -0.37 2.45 -1.40 2.71 5.36 -1.26 -1.57 117.98 123.89 1xyv s PHE 101 Ca 0.19 0.48 -0.11 0.00 -0.96 0.00 0.00 56.93 56.52 1xyv s PHE 101 Cb -0.19 -3.83 0.09 0.00 -0.34 0.00 0.00 43.02 38.75 1xyv s PHE 101 CO -0.05 -3.29 0.62 0.00 -1.46 0.00 0.00 175.22 171.04 1xyv h GLY 103 N -1.25 0.00 1.41 0.00 0.00 -1.68 -1.73 103.07 99.82 1xyv h GLY 103 Ca -0.48 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 46.73 1xyv h GLY 103 CO 0.60 0.00 -0.27 0.00 0.00 0.00 0.00 176.54 176.87 1xyv h ALA 104 N 1.86 0.92 -0.72 3.60 0.00 -1.86 -0.46 119.26 122.60 1xyv h ALA 104 Ca 0.03 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.60 1xyv h ALA 104 Cb 0.22 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 1xyv h ALA 104 CO -0.00 0.62 0.44 0.28 0.00 0.00 0.00 179.25 180.59 1xyv h VAL 105 N 0.58 1.07 -0.46 0.00 2.07 -1.55 -0.72 116.25 117.24 1xyv h VAL 105 Ca 0.08 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.26 1xyv h VAL 105 Cb 0.75 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 1xyv h VAL 105 CO 0.06 0.16 0.10 0.44 0.02 0.00 0.00 177.57 178.35 1xyv h ASP 106 N 0.85 0.70 -0.34 0.57 3.32 -1.28 -1.38 116.42 118.87 1xyv h ASP 106 Ca 0.30 -0.24 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1xyv h ASP 106 Cb 0.06 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 1xyv h ASP 106 CO -0.13 0.76 0.21 0.00 -1.72 0.00 0.00 179.24 178.37 1xyv h ALA 107 N 0.97 0.43 -0.58 3.45 0.00 -0.78 0.29 119.26 123.04 1xyv h ALA 107 Ca 0.14 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1xyv h ALA 107 Cb 0.34 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1xyv h ALA 107 CO 0.00 -0.09 0.05 0.82 0.00 0.00 0.00 179.25 180.03 1xyv h ILE 108 N 0.45 1.26 -0.22 0.00 2.04 -1.07 -0.95 117.51 119.02 1xyv h ILE 108 Ca 0.12 -1.07 -0.02 0.00 1.00 0.00 0.00 64.86 64.90 1xyv h ILE 108 Cb -0.02 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 1xyv h ILE 108 CO -0.02 0.39 0.07 -0.33 0.00 0.00 0.00 178.15 178.25 1xyv h GLU 109 N 0.89 0.34 -0.85 2.37 5.08 -1.09 0.58 114.58 121.89 1xyv h GLU 109 Ca 0.17 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1xyv h GLU 109 Cb 0.49 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.65 1xyv h GLU 109 CO 0.02 0.43 0.48 1.49 -1.00 0.00 0.00 179.01 180.43 1xyv h GLU 110 N 0.18 1.18 -0.47 2.33 4.57 -0.77 0.93 114.58 122.54 1xyv h GLU 110 Ca 0.07 -0.13 -0.02 0.00 -1.18 0.00 0.00 59.36 58.11 1xyv h GLU 110 Cb 0.23 -0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 28.57 1xyv h GLU 110 CO -0.00 0.85 0.23 -0.22 -1.18 0.00 0.00 179.01 178.69 1xyv h LYS 111 N 1.19 0.67 -0.84 1.92 1.63 -0.77 0.63 116.57 120.99 1xyv h LYS 111 Ca 0.30 -0.10 0.00 0.00 -0.85 0.00 0.00 60.65 60.01 1xyv h LYS 111 Cb 0.00 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 31.47 1xyv h LYS 111 CO -0.05 0.56 0.53 -0.07 -3.45 0.00 0.00 179.45 176.97 1xyv h LEU 112 N 0.61 1.00 -0.60 5.20 3.38 -0.36 0.12 115.31 124.66 1xyv h LEU 112 Ca 0.16 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1xyv h LEU 112 Cb 0.11 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1xyv h LEU 112 CO -0.02 0.75 0.34 0.50 0.09 0.00 0.00 178.44 180.10 1xyv h LYS 113 N 1.15 0.83 0.00 1.13 3.64 -0.29 -0.37 116.57 122.67 1xyv h LYS 113 Ca 0.31 -0.09 -0.08 0.00 -1.27 0.00 0.00 60.65 59.52 1xyv h LYS 113 Cb -0.08 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.57 1xyv h LYS 113 CO -0.06 0.62 -0.36 -0.91 -2.27 0.00 0.00 179.45 176.47 1xyv h ASN 114 N 0.81 0.00 0.00 4.20 2.35 -0.37 -0.22 115.58 122.35 1xyv h ASN 114 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 1xyv h ASN 114 Cb 0.02 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.39 1xyv h ASN 114 CO -0.04 0.36 0.00 0.18 -1.65 0.00 0.00 177.43 176.29 1xyv n LEU 115 N -3.57 0.00 0.00 1.61 4.77 -0.02 -4.90 117.00 114.89 1xyv n LEU 115 Ca -0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1xyv n LEU 115 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 1xyv n LEU 115 CO 0.37 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1xyv n GLY 116 N 0.76 0.52 3.79 -0.72 0.00 -0.09 -3.76 105.19 105.68 1xyv n GLY 116 Ca 0.19 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 45.26 1xyv n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xyv s ALA 117 N -2.00 2.32 -0.48 4.61 0.00 -0.51 -1.05 121.76 124.64 1xyv s ALA 117 Ca 0.00 0.03 -0.13 0.00 0.00 0.00 0.00 51.96 51.86 1xyv s ALA 117 Cb 0.00 -3.18 0.10 0.00 0.00 0.00 0.00 23.12 20.04 1xyv s ALA 117 CO 0.00 -1.63 0.38 -2.00 0.00 0.00 0.00 175.76 172.51 1xyv s GLU 118 N -5.03 2.76 -0.53 0.00 2.12 0.48 -4.71 118.70 113.79 1xyv s GLU 118 Ca 0.60 -1.59 -0.27 0.00 0.36 0.00 0.00 54.97 54.07 1xyv s GLU 118 Cb -0.15 -4.05 -0.01 0.00 0.26 0.00 0.00 34.13 30.18 1xyv s GLU 118 CO 0.55 -1.14 1.67 0.42 -0.54 0.00 0.00 175.26 176.22 1xyv s ILE 119 N 1.51 3.55 -0.12 -3.70 1.09 -1.26 -1.25 121.20 121.02 1xyv s ILE 119 Ca 0.04 0.45 0.24 0.00 -1.10 0.00 0.00 60.65 60.28 1xyv s ILE 119 Cb -0.26 -4.08 0.28 0.00 -1.06 0.00 0.00 42.46 37.34 1xyv s ILE 119 CO 0.03 -0.91 1.72 -0.37 -0.10 0.00 0.00 174.94 175.31 1xyv h VAL 120 N 6.66 0.29 -2.92 2.92 -1.51 -1.28 -3.45 116.25 116.96 1xyv h VAL 120 Ca -0.28 -1.14 -0.11 0.00 -1.23 0.00 0.00 66.70 63.94 1xyv h VAL 120 Cb 1.14 1.91 -0.20 0.00 -2.13 0.00 0.00 31.29 32.00 1xyv h VAL 120 CO 1.16 0.14 -0.23 -1.58 -1.23 0.00 0.00 177.57 175.83 1xyv s GLN 121 N -3.38 0.68 0.62 5.19 2.00 -1.26 -4.81 119.66 118.70 1xyv s GLN 121 Ca 0.04 -0.08 -0.19 0.00 -2.00 0.00 0.00 55.36 53.13 1xyv s GLN 121 Cb 0.08 0.31 -0.02 0.00 0.80 0.00 0.00 33.01 34.17 1xyv s GLN 121 CO 0.65 -0.18 1.23 -0.25 -0.50 0.00 0.00 175.29 176.23 1xyv n ASP 122 N 1.40 1.86 -4.76 6.67 10.43 -1.26 -4.57 116.55 126.32 1xyv n ASP 122 Ca -0.21 0.84 -0.39 0.00 2.57 0.00 0.00 54.79 57.61 1xyv n ASP 122 Cb 0.56 -1.52 0.01 0.00 1.84 0.00 0.00 41.12 42.01 1xyv n ASP 122 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 1xyv s GLY 123 N -1.29 2.91 -0.28 0.44 0.00 -1.26 -4.79 107.32 103.05 1xyv s GLY 123 Ca 0.80 1.35 -0.24 0.00 0.00 0.00 0.00 44.72 46.63 1xyv s GLY 123 CO 0.43 1.93 0.80 -2.27 0.00 0.00 0.00 173.10 173.99 1xyv s LEU 124 N -2.72 4.08 -0.24 0.66 2.96 -0.03 -4.98 118.68 118.41 1xyv s LEU 124 Ca 0.61 0.80 -0.00 0.00 -0.22 0.00 0.00 54.13 55.32 1xyv s LEU 124 Cb -0.41 -3.11 0.03 0.00 0.50 0.00 0.00 46.19 43.21 1xyv s LEU 124 CO 0.52 -0.57 -0.09 -0.13 -1.32 0.00 0.00 176.35 174.75 1xyv s ARG 125 N 2.91 2.71 -0.23 1.98 0.52 -1.26 -1.52 118.95 124.06 1xyv s ARG 125 Ca 0.33 -1.05 -0.08 0.00 -0.52 0.00 0.00 55.73 54.41 1xyv s ARG 125 Cb -0.15 -2.90 -0.04 0.00 0.52 0.00 0.00 34.95 32.39 1xyv s ARG 125 CO 0.11 -0.41 0.10 0.42 0.02 0.00 0.00 175.30 175.53 1xyv s ILE 126 N 1.27 4.84 -0.25 1.52 1.01 -0.26 -4.96 121.20 124.37 1xyv s ILE 126 Ca -0.01 -0.00 -0.14 0.00 0.00 0.00 0.00 60.65 60.50 1xyv s ILE 126 Cb -0.17 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 39.02 1xyv s ILE 126 CO -0.06 0.37 0.30 -0.62 0.00 0.00 0.00 174.94 174.94 1xyv s ASP 127 N 1.04 6.22 0.00 3.58 2.15 -1.26 -0.27 116.67 128.13 1xyv s ASP 127 Ca 0.05 0.25 0.00 0.00 0.43 0.00 0.00 52.55 53.28 1xyv s ASP 127 Cb -0.14 -2.18 0.00 0.00 -0.30 0.00 0.00 42.92 40.30 1xyv s ASP 127 CO 0.04 -0.09 0.00 0.61 -0.17 0.00 0.00 175.17 175.56 1xyv n GLY 128 N 4.51 -1.86 3.71 2.66 0.00 -0.73 -4.85 105.19 108.62 1xyv n GLY 128 Ca -0.11 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 43.81 1xyv n GLY 128 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xyv s ASP 129 N -4.00 6.71 0.52 1.61 -1.08 -1.26 -4.71 116.67 114.47 1xyv s ASP 129 Ca 0.00 2.41 0.26 0.00 -0.52 0.00 0.00 52.55 54.70 1xyv s ASP 129 Cb 0.00 -2.58 1.44 0.00 -1.46 0.00 0.00 42.92 40.32 1xyv s ASP 129 CO 0.00 -0.76 2.09 1.55 0.52 0.00 0.00 175.17 178.57 1xyv h PRO 130 N 7.24 0.00 0.00 4.34 0.13 -1.89 -0.12 132.00 141.71 1xyv h PRO 130 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1xyv h PRO 130 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1xyv h PRO 130 CO 0.90 0.11 0.00 0.00 -0.23 0.00 0.00 178.00 178.78 1xyv h ARG 131 N 0.00 0.00 -0.52 0.86 3.08 -1.93 0.56 114.38 116.43 1xyv h ARG 131 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1xyv h ARG 131 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1xyv h ARG 131 CO 0.01 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.91 1xyv n ALA 132 N -2.07 2.42 -1.90 0.04 0.00 -0.06 -3.95 120.51 114.98 1xyv n ALA 132 Ca -0.02 -1.02 0.04 0.00 0.00 0.00 0.00 53.44 52.44 1xyv n ALA 132 Cb 0.12 -0.94 0.07 0.00 0.00 0.00 0.00 19.45 18.70 1xyv n ALA 132 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xyv n ALA 133 N 1.30 2.49 -0.34 0.00 0.00 0.19 -4.82 120.51 119.32 1xyv n ALA 133 Ca 0.20 -2.18 0.15 0.00 0.00 0.00 0.00 53.44 51.61 1xyv n ALA 133 Cb 0.54 -0.52 0.36 0.00 0.00 0.00 0.00 19.45 19.82 1xyv n ALA 133 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1xyv h ARG 134 N 0.51 0.67 -0.64 0.00 2.43 -1.47 0.17 114.38 116.04 1xyv h ARG 134 Ca -0.07 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.01 1xyv h ARG 134 Cb 1.40 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.77 1xyv h ARG 134 CO 0.03 0.44 0.22 -0.44 -1.51 0.00 0.00 179.97 178.71 1xyv h ASP 135 N 0.69 0.88 -0.27 -3.80 3.32 -1.89 -1.65 116.42 113.70 1xyv h ASP 135 Ca 0.59 -0.14 -0.09 0.00 0.02 0.00 0.00 57.03 57.40 1xyv h ASP 135 Cb 1.02 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 1xyv h ASP 135 CO -0.38 0.81 -0.14 0.44 -1.72 0.00 0.00 179.24 178.25 1xyv h ASP 136 N 0.93 0.69 0.31 6.45 3.32 -1.09 -1.55 116.42 125.49 1xyv h ASP 136 Ca 0.21 -0.21 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1xyv h ASP 136 Cb 0.23 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.60 1xyv h ASP 136 CO -0.01 0.86 -0.15 0.40 -1.72 0.00 0.00 179.24 178.61 1xyv h ILE 137 N 0.63 0.72 -0.94 0.35 2.04 -0.56 -1.00 117.51 118.75 1xyv h ILE 137 Ca 0.10 -0.43 0.03 0.00 1.00 0.00 0.00 64.86 65.57 1xyv h ILE 137 Cb 0.60 0.95 -0.05 0.00 -0.74 0.00 0.00 36.82 37.58 1xyv h ILE 137 CO 0.04 0.09 0.62 0.58 0.00 0.00 0.00 178.15 179.48 1xyv h VAL 138 N -0.65 1.17 0.00 1.67 2.07 -1.35 0.25 116.25 119.41 1xyv h VAL 138 Ca -0.04 -0.41 -0.07 0.00 0.82 0.00 0.00 66.70 67.00 1xyv h VAL 138 Cb 0.46 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 1xyv h VAL 138 CO 0.07 0.22 -0.33 1.23 0.02 0.00 0.00 177.57 178.78 1xyv h GLY 139 N 1.20 0.00 0.85 2.17 0.00 -1.21 -1.19 103.07 104.89 1xyv h GLY 139 Ca 0.37 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.54 1xyv h GLY 139 CO -0.11 0.00 -0.60 -0.25 0.00 0.00 0.00 176.54 175.58 1xyv h TRP 140 N 0.00 0.68 -0.88 5.60 7.01 -0.63 0.10 115.95 127.82 1xyv h TRP 140 Ca -0.00 -0.34 0.02 0.00 2.11 0.00 0.00 58.89 60.67 1xyv h TRP 140 Cb 0.84 -0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 27.76 1xyv h TRP 140 CO 0.00 1.15 0.59 0.00 -2.79 0.00 0.00 178.44 177.38 1xyv h ALA 141 N 0.38 1.39 -0.26 2.65 0.00 -0.81 0.23 119.26 122.84 1xyv h ALA 141 Ca -0.06 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1xyv h ALA 141 Cb 1.29 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1xyv h ALA 141 CO 0.12 0.56 0.08 1.25 0.00 0.00 0.00 179.25 181.26 1xyv h HIS 142 N 1.18 0.42 -0.06 0.00 -0.00 -1.04 -2.32 115.15 113.33 1xyv h HIS 142 Ca 0.33 -0.04 -0.08 0.00 -0.00 0.00 0.00 60.37 60.58 1xyv h HIS 142 Cb -0.10 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 27.18 1xyv h HIS 142 CO -0.00 0.46 -0.34 -0.44 -0.00 0.00 0.00 177.93 177.60 1xyv h ASP 143 N 0.26 0.12 -0.28 3.26 3.32 0.10 -2.27 116.42 120.93 1xyv h ASP 143 Ca 0.08 -0.04 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 1xyv h ASP 143 Cb 0.23 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.75 1xyv h ASP 143 CO -0.00 0.46 -0.27 -0.37 -1.72 0.00 0.00 179.24 177.34 1xyv h VAL 144 N 0.11 1.30 -0.97 -1.35 -1.51 -0.25 -1.94 116.25 111.64 1xyv h VAL 144 Ca 0.01 -1.43 0.18 0.00 -1.23 0.00 0.00 66.70 64.24 1xyv h VAL 144 Cb 0.66 1.58 -0.09 0.00 -2.13 0.00 0.00 31.29 31.32 1xyv h VAL 144 CO 0.05 0.46 0.61 0.03 -1.23 0.00 0.00 177.57 177.49 1xyv h ARG 145 N 0.42 0.66 0.00 5.19 3.08 -1.12 0.23 114.38 122.84 1xyv h ARG 145 Ca 0.05 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1xyv h ARG 145 Cb 0.83 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.73 1xyv h ARG 145 CO 0.07 0.44 0.00 0.78 -1.07 0.00 0.00 179.97 180.18 1xyv h GLY 146 N 0.68 0.00 -1.10 0.04 0.00 -1.24 -2.98 103.07 98.47 1xyv h GLY 146 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.86 1xyv h GLY 146 CO -0.29 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.25 1xyv n ALA 147 N -1.84 2.52 1.03 3.60 0.00 0.79 -5.09 120.51 121.51 1xyv n ALA 147 Ca 0.04 -0.58 0.12 0.00 0.00 0.00 0.00 53.44 53.02 1xyv n ALA 147 Cb 0.38 -1.03 0.12 0.00 0.00 0.00 0.00 19.45 18.92 1xyv n ALA 147 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61