#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h0g n GLY 61 N 0.00 -2.00 0.00 0.46 0.00 -1.25 -4.65 105.19 97.75 3h0g n GLY 61 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.35 3h0g n GLY 61 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h0g n LYS 62 N -0.35 0.00 -1.62 1.61 5.02 -1.24 -4.69 118.16 116.88 3h0g n LYS 62 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3h0g n LYS 62 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 3h0g n LYS 62 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h0g n ALA 63 N -0.06 -1.97 -2.53 7.82 0.00 -1.26 -4.95 120.51 117.57 3h0g n ALA 63 Ca 0.00 0.48 -0.20 0.00 0.00 0.00 0.00 53.44 53.72 3h0g n ALA 63 Cb 0.00 -1.47 -0.12 0.00 0.00 0.00 0.00 19.45 17.87 3h0g n ALA 63 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3h0g s VAL 64 N -4.57 1.48 -0.08 0.00 1.01 -1.15 -4.72 120.40 112.38 3h0g s VAL 64 Ca 0.00 -1.66 -0.30 0.00 0.00 0.00 0.00 61.98 60.02 3h0g s VAL 64 Cb 0.00 -1.54 -0.05 0.00 0.00 0.00 0.00 36.38 34.80 3h0g s VAL 64 CO 0.00 -0.29 1.57 0.00 0.00 0.00 0.00 175.10 176.38 3h0g s ALA 65 N -1.78 3.63 -1.94 5.51 0.00 -1.26 -4.84 121.76 121.07 3h0g s ALA 65 Ca 0.08 0.83 0.00 0.00 0.00 0.00 0.00 51.96 52.87 3h0g s ALA 65 Cb -0.07 -3.72 0.00 0.00 0.00 0.00 0.00 23.12 19.33 3h0g s ALA 65 CO 0.04 -1.35 0.43 1.17 0.00 0.00 0.00 175.76 176.05 3h0g n LYS 66 N 7.02 0.00 -0.04 0.00 4.81 -1.26 -0.37 118.16 128.31 3h0g n LYS 66 Ca 0.16 0.00 -0.05 0.00 -0.87 0.00 0.00 58.31 57.55 3h0g n LYS 66 Cb 0.43 -1.44 -0.06 0.00 0.02 0.00 0.00 35.03 33.98 3h0g n LYS 66 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 3h0g n GLU 67 N -0.93 1.89 -3.22 1.64 2.13 -1.26 -4.72 120.64 116.17 3h0g n GLU 67 Ca 0.00 0.02 -0.33 0.00 0.66 0.00 0.00 57.16 57.50 3h0g n GLU 67 Cb 0.00 -1.21 -0.04 0.00 0.27 0.00 0.00 31.44 30.46 3h0g n GLU 67 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3h0g n ASP 68 N -2.47 4.90 -4.80 4.31 8.00 0.50 -5.05 116.55 121.94 3h0g n ASP 68 Ca -0.15 -3.46 -0.39 0.00 0.71 0.00 0.00 54.79 51.50 3h0g n ASP 68 Cb 0.75 -0.90 -0.06 0.00 -0.02 0.00 0.00 41.12 40.89 3h0g n ASP 68 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3h0g s ARG 69 N -2.72 4.32 -0.20 -1.24 1.70 -1.22 -4.50 118.95 115.09 3h0g s ARG 69 Ca 0.37 0.88 -0.16 0.00 -0.47 0.00 0.00 55.73 56.36 3h0g s ARG 69 Cb 0.12 -3.23 -0.10 0.00 -0.57 0.00 0.00 34.95 31.18 3h0g s ARG 69 CO 0.02 0.60 -0.18 2.41 -1.08 0.00 0.00 175.30 177.08 3h0g n THR 70 N 1.62 1.50 -0.44 4.99 -1.04 -1.26 -5.04 114.28 114.60 3h0g n THR 70 Ca -0.08 -0.02 -0.27 0.00 -2.04 0.00 0.00 64.05 61.63 3h0g n THR 70 Cb 0.50 -2.16 0.23 0.00 -1.82 0.00 0.00 70.33 67.08 3h0g n THR 70 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 3h0g n THR 71 N -4.43 0.00 -2.26 12.58 5.66 -1.26 -4.88 114.28 119.69 3h0g n THR 71 Ca -0.28 -0.19 -0.42 0.00 -3.05 0.00 0.00 64.05 60.11 3h0g n THR 71 Cb 0.60 -0.79 -0.03 0.00 -1.55 0.00 0.00 70.33 68.56 3h0g n THR 71 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 3h0g s THR 72 N -2.19 3.62 0.25 1.09 -1.32 -1.26 -4.91 115.64 110.92 3h0g s THR 72 Ca 0.58 1.14 0.31 0.00 -1.21 0.00 0.00 61.69 62.50 3h0g s THR 72 Cb -0.14 -3.73 0.31 0.00 -1.51 0.00 0.00 72.50 67.43 3h0g s THR 72 CO 0.55 0.07 1.94 -0.65 -2.21 0.00 0.00 174.62 174.32 3h0g h PRO 73 N 7.04 0.00 -6.58 7.08 0.11 -1.98 -3.43 132.00 134.23 3h0g h PRO 73 Ca -0.41 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.18 3h0g h PRO 73 Cb 1.20 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 3h0g h PRO 73 CO 0.86 0.00 -0.04 0.71 -0.21 0.00 0.00 178.00 179.31 3h0g s TYR 74 N -3.82 3.44 -0.07 0.65 1.51 -1.26 -2.42 117.35 115.37 3h0g s TYR 74 Ca -0.03 0.90 -0.22 0.00 -1.01 0.00 0.00 57.07 56.71 3h0g s TYR 74 Cb 0.09 -2.30 -0.04 0.00 -0.11 0.00 0.00 41.96 39.60 3h0g s TYR 74 CO 0.28 0.14 0.63 1.41 -1.11 0.00 0.00 175.55 176.91 3h0g s MET 75 N -3.24 4.40 0.50 -0.62 -2.45 -1.24 -4.59 119.30 112.06 3h0g s MET 75 Ca 0.48 0.76 -0.18 0.00 -1.25 0.00 0.00 55.69 55.50 3h0g s MET 75 Cb -0.11 -3.43 -0.08 0.00 1.25 0.00 0.00 34.83 32.46 3h0g s MET 75 CO 0.25 0.12 0.99 0.95 1.05 0.00 0.00 175.02 178.38 3h0g s THR 76 N 0.66 4.34 0.34 10.11 -4.23 -1.26 -4.83 115.64 120.76 3h0g s THR 76 Ca 0.34 1.24 0.13 0.00 -1.18 0.00 0.00 61.69 62.22 3h0g s THR 76 Cb -0.17 -3.62 0.36 0.00 1.34 0.00 0.00 72.50 70.41 3h0g s THR 76 CO 0.16 -0.52 1.59 0.50 -0.54 0.00 0.00 174.62 175.81 3h0g h LYS 77 N 1.20 0.06 0.20 3.99 3.64 -2.01 -1.49 116.57 122.16 3h0g h LYS 77 Ca -0.48 -0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 58.58 3h0g h LYS 77 Cb 1.19 -0.01 0.02 0.00 -0.41 0.00 0.00 32.23 33.02 3h0g h LYS 77 CO 0.61 0.04 -1.47 1.88 -2.27 0.00 0.00 179.45 178.23 3h0g h TYR 78 N 0.06 0.79 0.47 1.91 -1.99 -2.00 -3.27 116.97 112.94 3h0g h TYR 78 Ca 0.73 -0.57 -0.02 0.00 2.00 0.00 0.00 58.73 60.87 3h0g h TYR 78 Cb 1.77 -0.03 -0.01 0.00 2.00 0.00 0.00 36.73 40.45 3h0g h TYR 78 CO -0.19 1.57 -0.39 0.93 -0.00 0.00 0.00 178.16 180.08 3h0g h GLU 79 N 0.01 -0.81 -0.71 4.88 5.08 -1.65 -0.82 114.58 120.56 3h0g h GLU 79 Ca -0.28 0.06 0.21 0.00 -1.00 0.00 0.00 59.36 58.35 3h0g h GLU 79 Cb 2.03 0.18 -0.13 0.00 0.50 0.00 0.00 28.75 31.33 3h0g h GLU 79 CO 0.21 -0.54 0.06 -2.13 -1.00 0.00 0.00 179.01 175.60 3h0g n ARG 80 N -4.81 -0.05 0.18 2.33 0.63 -1.03 0.21 116.66 114.12 3h0g n ARG 80 Ca -0.10 1.05 0.04 0.00 -0.92 0.00 0.00 57.85 57.92 3h0g n ARG 80 Cb 0.37 -1.70 0.34 0.00 0.45 0.00 0.00 32.46 31.92 3h0g n ARG 80 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3h0g h ALA 81 N 1.42 1.08 0.12 5.13 0.00 -1.25 -2.26 119.26 123.50 3h0g h ALA 81 Ca 0.45 -0.37 -0.30 0.00 0.00 0.00 0.00 54.91 54.69 3h0g h ALA 81 Cb 0.97 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3h0g h ALA 81 CO -0.65 0.51 -1.58 -0.09 0.00 0.00 0.00 179.25 177.43 3h0g h ARG 82 N 0.00 0.25 0.42 0.00 1.12 0.37 -3.04 114.38 113.51 3h0g h ARG 82 Ca -0.00 -0.42 -0.02 0.00 -1.11 0.00 0.00 59.98 58.43 3h0g h ARG 82 Cb 0.85 0.16 -0.01 0.00 -0.01 0.00 0.00 29.97 30.96 3h0g h ARG 82 CO 0.05 1.20 -0.30 0.82 -3.11 0.00 0.00 179.97 178.63 3h0g h ILE 83 N -0.23 0.00 -1.16 1.20 2.04 -0.35 0.61 117.51 119.62 3h0g h ILE 83 Ca -0.34 0.00 0.33 0.00 1.00 0.00 0.00 64.86 65.85 3h0g h ILE 83 Cb 1.83 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.85 3h0g h ILE 83 CO 0.05 0.00 0.82 -0.07 0.00 0.00 0.00 178.15 178.96 3h0g h LEU 84 N -0.69 0.05 -0.21 1.44 3.38 -1.59 1.52 115.31 119.21 3h0g h LEU 84 Ca -0.06 0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.75 3h0g h LEU 84 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 3h0g h LEU 84 CO 0.03 0.01 -0.56 1.23 0.09 0.00 0.00 178.44 179.24 3h0g h GLY 85 N 0.04 0.83 0.47 0.83 0.00 -1.07 -2.65 103.07 101.52 3h0g h GLY 85 Ca 0.56 -1.04 -0.00 0.00 0.00 0.00 0.00 47.33 46.85 3h0g h GLY 85 CO -0.04 0.93 -0.01 -0.84 0.00 0.00 0.00 176.54 176.58 3h0g h THR 86 N 0.48 1.34 -0.63 4.70 2.02 0.77 -2.96 112.91 118.63 3h0g h THR 86 Ca -0.01 -1.21 -0.02 0.00 0.77 0.00 0.00 66.41 65.93 3h0g h THR 86 Cb 1.18 2.15 -0.03 0.00 -1.74 0.00 0.00 68.15 69.71 3h0g h THR 86 CO 0.12 0.31 0.30 -0.09 0.37 0.00 0.00 175.52 176.53 3h0g h ARG 87 N -0.57 0.89 -0.51 6.66 2.43 -0.98 -2.28 114.38 120.02 3h0g h ARG 87 Ca -0.00 -0.11 0.07 0.00 -0.81 0.00 0.00 59.98 59.12 3h0g h ARG 87 Cb 0.53 -0.17 -0.10 0.00 -0.42 0.00 0.00 29.97 29.82 3h0g h ARG 87 CO 0.01 0.69 -0.49 0.00 -1.51 0.00 0.00 179.97 178.66 3h0g h ALA 88 N 1.45 -0.54 -0.95 2.80 0.00 -1.39 0.34 119.26 120.98 3h0g h ALA 88 Ca 0.22 0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.24 3h0g h ALA 88 Cb 0.09 1.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.86 3h0g h ALA 88 CO -0.03 -0.93 0.62 1.25 0.00 0.00 0.00 179.25 180.16 3h0g h LEU 89 N -0.30 1.00 0.42 0.00 5.85 -1.27 0.28 115.31 121.29 3h0g h LEU 89 Ca 0.13 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 3h0g h LEU 89 Cb 0.57 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.39 3h0g h LEU 89 CO -0.65 0.66 -0.20 1.56 -0.34 0.00 0.00 178.44 179.47 3h0g h GLN 90 N 1.15 -0.54 -0.89 1.25 4.20 0.11 -0.62 115.11 119.77 3h0g h GLN 90 Ca 0.39 0.04 0.17 0.00 0.06 0.00 0.00 58.65 59.31 3h0g h GLN 90 Cb 0.09 0.12 -0.10 0.00 0.30 0.00 0.00 27.48 27.89 3h0g h GLN 90 CO -0.14 -0.36 0.46 0.82 -0.67 0.00 0.00 178.83 178.94 3h0g h ILE 91 N -0.57 0.66 -0.09 2.54 2.04 -0.92 0.46 117.51 121.63 3h0g h ILE 91 Ca -0.06 -0.20 0.03 0.00 1.00 0.00 0.00 64.86 65.63 3h0g h ILE 91 Cb 0.43 0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.52 3h0g h ILE 91 CO 0.09 0.11 0.14 0.77 0.00 0.00 0.00 178.15 179.26 3h0g h SER 92 N 0.59 0.00 -1.04 1.72 4.64 0.08 -0.68 113.55 118.86 3h0g h SER 92 Ca 0.51 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 61.24 3h0g h SER 92 Cb 0.80 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 62.65 3h0g h SER 92 CO -0.41 0.00 0.75 0.23 -0.87 0.00 0.00 176.83 176.54 3h0g n MET 93 N -3.57 2.46 -2.92 4.77 2.81 0.16 -4.91 117.12 115.91 3h0g n MET 93 Ca -0.01 -2.82 0.00 0.00 -1.81 0.00 0.00 57.70 53.07 3h0g n MET 93 Cb 0.24 -2.11 0.00 0.00 -0.71 0.00 0.00 33.22 30.64 3h0g n MET 93 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3h0g n ASN 94 N -0.39 -6.13 -4.25 7.83 4.05 -0.26 -5.00 115.26 111.10 3h0g n ASN 94 Ca 0.52 0.45 -0.14 0.00 0.45 0.00 0.00 54.58 55.86 3h0g n ASN 94 Cb 0.56 -1.42 -0.10 0.00 1.23 0.00 0.00 39.78 40.05 3h0g n ASN 94 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3h0g s ALA 95 N -0.76 1.46 -0.57 5.20 0.00 -1.23 -4.92 121.76 120.93 3h0g s ALA 95 Ca 0.00 -1.50 -0.26 0.00 0.00 0.00 0.00 51.96 50.19 3h0g s ALA 95 Cb 0.00 0.08 -0.09 0.00 0.00 0.00 0.00 23.12 23.11 3h0g s ALA 95 CO 0.00 -0.11 2.43 -0.35 0.00 0.00 0.00 175.76 177.73 3h0g n PRO 96 N -0.21 0.91 -2.61 0.00 -0.04 -1.26 -4.81 135.00 126.97 3h0g n PRO 96 Ca -0.10 -0.15 -0.42 0.00 -0.04 0.00 0.00 63.50 62.79 3h0g n PRO 96 Cb 0.61 -3.40 -0.03 0.00 -0.04 0.00 0.00 33.50 30.64 3h0g n PRO 96 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3h0g s VAL 97 N 12.49 4.60 -1.55 0.52 1.01 -1.26 -4.96 120.40 131.27 3h0g s VAL 97 Ca 0.99 1.88 0.14 0.00 0.00 0.00 0.00 61.98 64.99 3h0g s VAL 97 Cb -0.22 -4.20 0.50 0.00 0.00 0.00 0.00 36.38 32.46 3h0g s VAL 97 CO 0.24 0.09 1.38 0.18 0.00 0.00 0.00 175.10 176.99 3h0g n LEU 98 N 4.38 3.26 -3.85 3.92 4.77 -1.26 -4.86 117.00 123.36 3h0g n LEU 98 Ca 0.08 -1.64 -0.12 0.00 -0.03 0.00 0.00 56.01 54.30 3h0g n LEU 98 Cb 0.49 -0.43 -0.12 0.00 -2.33 0.00 0.00 43.42 41.02 3h0g n LEU 98 CO 0.53 0.64 -0.23 -0.69 -1.33 0.00 0.00 177.39 176.31 3h0g s VAL 99 N -1.58 0.02 -0.42 4.08 1.01 -1.26 -4.95 120.40 117.30 3h0g s VAL 99 Ca 0.36 -0.17 -0.38 0.00 0.00 0.00 0.00 61.98 61.79 3h0g s VAL 99 Cb 0.21 -0.22 -0.16 0.00 0.00 0.00 0.00 36.38 36.21 3h0g s VAL 99 CO 0.20 -0.09 1.57 0.47 0.00 0.00 0.00 175.10 177.25 3h0g n ASP 100 N 2.68 0.80 -4.61 3.32 8.00 -1.26 -4.70 116.55 120.79 3h0g n ASP 100 Ca -0.15 0.77 -0.44 0.00 0.71 0.00 0.00 54.79 55.68 3h0g n ASP 100 Cb 0.58 -0.74 -0.03 0.00 -0.02 0.00 0.00 41.12 40.91 3h0g n ASP 100 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3h0g n LEU 101 N 4.86 3.41 0.28 0.64 4.77 -1.26 -4.82 117.00 124.88 3h0g n LEU 101 Ca 0.36 0.43 0.17 0.00 -0.03 0.00 0.00 56.01 56.95 3h0g n LEU 101 Cb -0.04 -1.52 0.78 0.00 -2.33 0.00 0.00 43.42 40.31 3h0g n LEU 101 CO 0.74 -0.44 1.02 -0.33 -1.33 0.00 0.00 177.39 177.05 3h0g h GLU 102 N 13.45 0.00 0.00 3.23 4.39 -2.00 -3.45 114.58 130.21 3h0g h GLU 102 Ca -0.43 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.27 3h0g h GLU 102 Cb 1.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 3h0g h GLU 102 CO 0.96 0.03 0.00 0.41 -1.16 0.00 0.00 179.01 179.25 3h0g n GLY 103 N -0.24 0.89 1.89 -3.84 0.00 -1.26 -5.15 105.19 97.49 3h0g n GLY 103 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 3h0g n GLY 103 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3h0g n GLU 104 N 0.00 0.49 0.00 1.61 4.07 -1.26 -5.05 120.64 120.50 3h0g n GLU 104 Ca 0.00 -1.40 0.00 0.00 -0.06 0.00 0.00 57.16 55.70 3h0g n GLU 104 Cb 0.00 -0.24 0.00 0.00 -0.06 0.00 0.00 31.44 31.14 3h0g n GLU 104 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 3h0g n THR 105 N -1.90 0.00 -3.17 6.31 -1.04 -1.26 -5.06 114.28 108.16 3h0g n THR 105 Ca 0.08 0.00 -0.44 0.00 -2.04 0.00 0.00 64.05 61.65 3h0g n THR 105 Cb 0.29 -0.06 -0.06 0.00 -1.82 0.00 0.00 70.33 68.69 3h0g n THR 105 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3h0g s ASP 106 N -0.94 6.20 0.15 8.00 2.15 -1.26 -4.92 116.67 126.06 3h0g s ASP 106 Ca 0.00 -1.21 0.00 0.00 0.43 0.00 0.00 52.55 51.77 3h0g s ASP 106 Cb 0.00 -2.28 0.00 0.00 -0.30 0.00 0.00 42.92 40.34 3h0g s ASP 106 CO 0.00 -0.95 0.61 -2.65 -0.17 0.00 0.00 175.17 172.01 3h0g n PRO 107 N 6.08 0.01 -0.06 4.34 -0.02 -1.26 0.20 135.00 144.27 3h0g n PRO 107 Ca -0.09 0.22 -0.14 0.00 -2.02 0.00 0.00 63.50 61.48 3h0g n PRO 107 Cb 0.44 -2.11 -0.05 0.00 -0.02 0.00 0.00 33.50 31.76 3h0g n PRO 107 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 3h0g n LEU 108 N -1.34 0.91 0.29 2.45 0.00 -1.26 -3.75 117.00 114.30 3h0g n LEU 108 Ca 0.00 0.16 0.18 0.00 0.00 0.00 0.00 56.01 56.35 3h0g n LEU 108 Cb 0.61 -0.38 0.91 0.00 0.00 0.00 0.00 43.42 44.56 3h0g n LEU 108 CO 0.00 0.27 1.15 1.56 0.00 0.00 0.00 177.39 180.37 3h0g h GLN 109 N -0.46 0.00 0.05 1.96 4.20 -0.67 0.48 115.11 120.67 3h0g h GLN 109 Ca -0.33 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.29 3h0g h GLN 109 Cb 1.29 0.00 0.01 0.00 0.30 0.00 0.00 27.48 29.08 3h0g h GLN 109 CO -0.20 0.00 -0.39 0.97 -0.67 0.00 0.00 178.83 178.54 3h0g h ILE 110 N 0.00 1.60 -0.73 2.54 2.10 -1.27 -3.12 117.51 118.63 3h0g h ILE 110 Ca 0.03 -2.27 0.13 0.00 1.08 0.00 0.00 64.86 63.82 3h0g h ILE 110 Cb 0.51 3.09 -0.05 0.00 -1.09 0.00 0.00 36.82 39.29 3h0g h ILE 110 CO -0.00 0.62 0.49 0.00 -1.08 0.00 0.00 178.15 178.18 3h0g h ALA 111 N 0.13 2.00 -0.26 0.18 0.00 -0.23 0.20 119.26 121.28 3h0g h ALA 111 Ca -0.06 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 3h0g h ALA 111 Cb 1.24 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3h0g h ALA 111 CO 0.07 -0.18 -0.27 0.52 0.00 0.00 0.00 179.25 179.40 3h0g h MET 112 N 0.50 0.50 -0.72 0.00 2.86 -1.02 0.23 114.93 117.27 3h0g h MET 112 Ca 0.35 -0.20 0.02 0.00 -2.06 0.00 0.00 59.70 57.82 3h0g h MET 112 Cb 0.68 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.28 3h0g h MET 112 CO -0.12 0.72 0.48 0.87 1.06 0.00 0.00 176.91 179.92 3h0g h LYS 113 N 0.44 0.90 0.36 1.72 1.79 -0.56 -1.82 116.57 119.39 3h0g h LYS 113 Ca 0.06 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.46 3h0g h LYS 113 Cb 0.70 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 31.15 3h0g h LYS 113 CO 0.05 0.60 -0.17 0.93 -1.08 0.00 0.00 179.45 179.78 3h0g h GLU 114 N 0.93 -0.46 -0.76 3.15 5.08 -0.77 -3.20 114.58 118.54 3h0g h GLU 114 Ca 0.28 0.03 0.17 0.00 -1.00 0.00 0.00 59.36 58.83 3h0g h GLU 114 Cb -0.03 0.10 -0.11 0.00 0.50 0.00 0.00 28.75 29.21 3h0g h GLU 114 CO -0.07 -0.14 0.22 1.25 -1.00 0.00 0.00 179.01 179.27 3h0g h LEU 115 N -0.87 0.09 -1.16 1.33 7.12 -0.69 0.76 115.31 121.90 3h0g h LEU 115 Ca -0.05 0.14 0.08 0.00 0.13 0.00 0.00 57.88 58.18 3h0g h LEU 115 Cb 0.53 0.17 -0.06 0.00 -0.53 0.00 0.00 40.66 40.78 3h0g h LEU 115 CO 0.08 -0.01 0.59 0.00 -0.13 0.00 0.00 178.44 178.96 3h0g h ALA 116 N 1.62 1.55 -0.34 1.25 0.00 -1.39 0.22 119.26 122.17 3h0g h ALA 116 Ca 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.33 3h0g h ALA 116 Cb 0.75 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3h0g h ALA 116 CO -0.50 0.30 0.00 1.04 0.00 0.00 0.00 179.25 180.09 3h0g n GLN 117 N -4.50 1.94 -3.18 0.00 6.02 0.09 -4.92 117.38 112.82 3h0g n GLN 117 Ca 0.14 -1.44 -0.19 0.00 -0.01 0.00 0.00 57.00 55.50 3h0g n GLN 117 Cb 0.23 -1.36 -0.01 0.00 1.02 0.00 0.00 30.24 30.12 3h0g n GLN 117 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3h0g n LYS 118 N 0.66 -2.72 -2.43 -1.09 5.02 0.79 -4.82 118.16 113.57 3h0g n LYS 118 Ca 0.15 0.32 -0.33 0.00 -2.02 0.00 0.00 58.31 56.43 3h0g n LYS 118 Cb 0.37 -4.94 0.01 0.00 -0.02 0.00 0.00 35.03 30.44 3h0g n LYS 118 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3h0g n LYS 119 N -3.32 3.51 -4.22 1.97 5.02 -1.07 -4.36 118.16 115.69 3h0g n LYS 119 Ca -0.01 -4.32 -0.21 0.00 -2.02 0.00 0.00 58.31 51.75 3h0g n LYS 119 Cb 0.53 -2.29 -0.16 0.00 -0.02 0.00 0.00 35.03 33.09 3h0g n LYS 119 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 3h0g s ILE 120 N -5.02 0.65 0.00 -0.18 2.07 -1.26 -4.66 121.20 112.80 3h0g s ILE 120 Ca 0.48 -0.18 0.00 0.00 -1.41 0.00 0.00 60.65 59.54 3h0g s ILE 120 Cb 0.36 -0.65 0.00 0.00 0.13 0.00 0.00 42.46 42.29 3h0g s ILE 120 CO -0.24 0.25 0.00 -2.65 -1.91 0.00 0.00 174.94 170.39 3h0g n PRO 121 N 4.06 3.23 -1.77 3.50 -0.02 -1.26 -4.52 135.00 138.22 3h0g n PRO 121 Ca -0.24 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.24 3h0g n PRO 121 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.99 3h0g n PRO 121 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3h0g n LEU 122 N 0.00 -3.94 -4.36 2.45 4.77 -1.26 -4.60 117.00 110.06 3h0g n LEU 122 Ca 0.00 2.96 -0.18 0.00 -0.03 0.00 0.00 56.01 58.76 3h0g n LEU 122 Cb 0.00 -3.08 -0.10 0.00 -2.33 0.00 0.00 43.42 37.91 3h0g n LEU 122 CO 0.00 -0.10 -0.32 -0.76 -1.33 0.00 0.00 177.39 174.88 3h0g s LEU 123 N -2.64 2.17 -0.18 2.23 1.43 -1.26 -4.06 118.68 116.37 3h0g s LEU 123 Ca 0.00 -1.26 0.00 0.00 -1.03 0.00 0.00 54.13 51.84 3h0g s LEU 123 Cb 0.00 -0.31 0.01 0.00 0.03 0.00 0.00 46.19 45.93 3h0g s LEU 123 CO 0.00 -0.53 -0.17 0.68 0.23 0.00 0.00 176.35 176.56 3h0g s VAL 124 N -3.38 2.33 -0.37 -1.59 -7.23 -0.66 -4.90 120.40 104.60 3h0g s VAL 124 Ca 0.31 -0.85 -0.18 0.00 -1.81 0.00 0.00 61.98 59.45 3h0g s VAL 124 Cb 0.06 -1.99 0.00 0.00 0.56 0.00 0.00 36.38 35.01 3h0g s VAL 124 CO 0.11 0.52 0.48 -0.13 -0.31 0.00 0.00 175.10 175.77 3h0g s ARG 125 N 1.22 3.50 -0.76 4.82 0.52 -1.25 -1.78 118.95 125.22 3h0g s ARG 125 Ca 0.03 -0.32 -0.17 0.00 -0.52 0.00 0.00 55.73 54.75 3h0g s ARG 125 Cb -0.14 -3.84 0.16 0.00 0.52 0.00 0.00 34.95 31.65 3h0g s ARG 125 CO -0.09 -0.68 0.81 1.03 0.02 0.00 0.00 175.30 176.39 3h0g s ARG 126 N 2.31 3.38 0.07 3.54 0.52 0.95 -4.86 118.95 124.86 3h0g s ARG 126 Ca 0.17 -1.89 -0.31 0.00 -0.52 0.00 0.00 55.73 53.18 3h0g s ARG 126 Cb -0.16 -4.49 -0.08 0.00 0.52 0.00 0.00 34.95 30.74 3h0g s ARG 126 CO 0.13 -1.48 1.63 0.71 0.02 0.00 0.00 175.30 176.31 3h0g s TYR 127 N 1.64 2.49 0.69 -0.53 1.51 -1.26 -2.96 117.35 118.92 3h0g s TYR 127 Ca 0.18 0.37 -0.11 0.00 -1.01 0.00 0.00 57.07 56.50 3h0g s TYR 127 Cb -0.15 -3.94 0.00 0.00 -0.11 0.00 0.00 41.96 37.77 3h0g s TYR 127 CO -0.04 -3.73 1.08 -0.51 -1.11 0.00 0.00 175.55 171.24 3h0g s LEU 128 N 2.55 2.97 0.18 -1.29 2.01 0.40 -4.99 118.68 120.51 3h0g s LEU 128 Ca 0.73 1.17 -0.13 0.00 0.01 0.00 0.00 54.13 55.91 3h0g s LEU 128 Cb -0.39 -4.02 0.09 0.00 0.01 0.00 0.00 46.19 41.88 3h0g s LEU 128 CO 0.32 -1.24 1.85 -0.65 1.01 0.00 0.00 176.35 177.63 3h0g h PRO 129 N -0.58 0.76 -0.95 1.29 0.11 -1.95 -2.40 132.00 128.28 3h0g h PRO 129 Ca -0.45 -0.05 0.11 0.00 0.11 0.00 0.00 66.00 65.73 3h0g h PRO 129 Cb 1.24 -0.17 -0.13 0.00 0.11 0.00 0.00 31.00 32.05 3h0g h PRO 129 CO 0.63 0.50 -0.50 0.22 -0.21 0.00 0.00 178.00 178.65 3h0g h ASP 130 N 0.78 -1.83 0.00 -2.05 -0.00 -1.99 -3.44 116.42 107.89 3h0g h ASP 130 Ca 0.22 0.31 0.00 0.00 -0.00 0.00 0.00 57.03 57.56 3h0g h ASP 130 Cb -0.08 0.86 0.00 0.00 -0.00 0.00 0.00 39.33 40.11 3h0g h ASP 130 CO -0.05 -0.27 0.00 0.61 -0.00 0.00 0.00 179.24 179.53 3h0g n GLY 131 N -1.35 -0.30 3.94 -0.78 0.00 -0.90 -4.91 105.19 100.89 3h0g n GLY 131 Ca 0.05 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 3h0g n GLY 131 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3h0g s SER 132 N -0.09 3.89 0.29 1.61 1.04 -1.26 -3.73 113.70 115.44 3h0g s SER 132 Ca 0.00 0.22 -0.06 0.00 0.48 0.00 0.00 55.95 56.60 3h0g s SER 132 Cb 0.00 -0.51 -0.01 0.00 0.10 0.00 0.00 66.02 65.60 3h0g s SER 132 CO 0.00 -2.22 0.42 -0.72 0.98 0.00 0.00 173.24 171.70 3h0g s TYR 133 N -3.56 0.84 0.01 5.02 -0.85 -1.26 -0.45 117.35 117.10 3h0g s TYR 133 Ca 0.68 -1.11 0.01 0.00 -0.52 0.00 0.00 57.07 56.12 3h0g s TYR 133 Cb -0.06 -0.07 -0.01 0.00 0.38 0.00 0.00 41.96 42.20 3h0g s TYR 133 CO 0.49 -1.01 -0.03 -1.21 -1.52 0.00 0.00 175.55 172.27 3h0g s GLU 134 N -3.56 0.26 -0.17 -3.49 2.02 -1.16 -2.96 118.70 109.65 3h0g s GLU 134 Ca 0.29 -0.39 -0.04 0.00 0.02 0.00 0.00 54.97 54.85 3h0g s GLU 134 Cb 0.01 -0.06 -0.02 0.00 0.10 0.00 0.00 34.13 34.16 3h0g s GLU 134 CO 0.15 0.00 -0.04 -0.51 0.02 0.00 0.00 175.26 174.88 3h0g s ASP 135 N -0.86 4.68 0.04 -0.19 1.01 -1.26 -0.03 116.67 120.07 3h0g s ASP 135 Ca -0.08 -0.19 0.08 0.00 0.71 0.00 0.00 52.55 53.08 3h0g s ASP 135 Cb -0.06 -1.77 -0.03 0.00 1.01 0.00 0.00 42.92 42.07 3h0g s ASP 135 CO -0.00 0.13 -0.23 0.26 0.21 0.00 0.00 175.17 175.54 3h0g s TRP 136 N 0.59 2.00 -0.09 4.23 0.52 -0.73 -4.92 118.94 120.54 3h0g s TRP 136 Ca -0.03 -0.39 -0.07 0.00 0.02 0.00 0.00 56.10 55.64 3h0g s TRP 136 Cb -0.14 -1.20 -0.04 0.00 -1.15 0.00 0.00 33.47 30.94 3h0g s TRP 136 CO 0.03 0.10 0.17 -1.54 0.02 0.00 0.00 176.95 175.72 3h0g s SER 137 N -1.17 6.41 0.43 2.95 1.04 -1.26 -1.65 113.70 120.45 3h0g s SER 137 Ca 0.09 0.47 0.14 0.00 0.48 0.00 0.00 55.95 57.13 3h0g s SER 137 Cb -0.09 -2.07 1.03 0.00 0.10 0.00 0.00 66.02 64.99 3h0g s SER 137 CO 0.02 0.37 1.98 0.58 0.98 0.00 0.00 173.24 177.17 3h0g h VAL 138 N 3.72 0.90 0.00 5.02 2.07 -1.80 0.20 116.25 126.36 3h0g h VAL 138 Ca -0.54 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 66.81 3h0g h VAL 138 Cb 1.22 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3h0g h VAL 138 CO 0.60 0.07 -0.15 0.00 0.02 0.00 0.00 177.57 178.12 3h0g h ALA 139 N 1.70 0.97 -0.07 1.67 0.00 -1.85 -3.07 119.26 118.61 3h0g h ALA 139 Ca 0.27 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 3h0g h ALA 139 Cb 0.53 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3h0g h ALA 139 CO -0.07 0.19 -0.21 1.49 0.00 0.00 0.00 179.25 180.64 3h0g h GLU 140 N 0.00 0.27 -7.24 0.00 4.81 -1.02 -3.48 114.58 107.93 3h0g h GLU 140 Ca -0.00 -0.19 -0.44 0.00 -0.13 0.00 0.00 59.36 58.59 3h0g h GLU 140 Cb 0.81 0.03 0.19 0.00 0.63 0.00 0.00 28.75 30.41 3h0g h GLU 140 CO 0.02 0.81 0.08 -0.51 -0.73 0.00 0.00 179.01 178.68 3h0g s LEU 141 N -8.85 1.09 0.00 1.64 1.43 -0.83 -4.98 118.68 108.18 3h0g s LEU 141 Ca -0.15 1.35 0.00 0.00 -1.03 0.00 0.00 54.13 54.30 3h0g s LEU 141 Cb 0.03 -3.36 0.00 0.00 0.03 0.00 0.00 46.19 42.89 3h0g s LEU 141 CO 0.75 -3.80 0.00 -0.38 0.23 0.00 0.00 176.35 173.15