#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dv3 n GLN 4 N 0.00 0.05 -3.31 2.98 1.13 -1.26 -5.00 117.38 111.97 1dv3 n GLN 4 Ca 0.00 -0.01 -0.21 0.00 -1.94 0.00 0.00 57.00 54.84 1dv3 n GLN 4 Cb 0.00 -1.51 0.06 0.00 0.11 0.00 0.00 30.24 28.90 1dv3 n GLN 4 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1dv3 n ASN 5 N -1.56 -5.82 -0.01 1.08 5.15 -1.26 -4.90 115.26 107.93 1dv3 n ASN 5 Ca 0.04 -0.41 -0.20 0.00 -0.60 0.00 0.00 54.58 53.41 1dv3 n ASN 5 Cb 0.35 -4.51 -0.14 0.00 -0.53 0.00 0.00 39.78 34.95 1dv3 n ASN 5 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1dv3 n ILE 6 N -4.62 1.74 -4.67 -1.44 2.08 -1.26 -4.89 119.36 106.30 1dv3 n ILE 6 Ca -0.03 -0.65 -0.25 0.00 0.56 0.00 0.00 62.75 62.38 1dv3 n ILE 6 Cb 0.57 -1.66 -0.14 0.00 -0.75 0.00 0.00 39.64 37.66 1dv3 n ILE 6 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 1dv3 s PHE 7 N -2.56 1.70 0.43 1.39 0.08 -1.26 -4.83 117.98 112.93 1dv3 s PHE 7 Ca -0.23 -0.36 -0.23 0.00 0.12 0.00 0.00 56.93 56.23 1dv3 s PHE 7 Cb 0.07 -1.03 -0.08 0.00 -0.57 0.00 0.00 43.02 41.40 1dv3 s PHE 7 CO 0.75 0.06 1.10 -1.12 -0.10 0.00 0.00 175.22 175.91 1dv3 s SER 8 N -0.99 6.48 -0.09 1.36 0.01 -0.45 -4.98 113.70 115.04 1dv3 s SER 8 Ca 0.07 2.15 -0.18 0.00 1.31 0.00 0.00 55.95 59.30 1dv3 s SER 8 Cb -0.08 -2.59 -0.28 0.00 0.21 0.00 0.00 66.02 63.28 1dv3 s SER 8 CO 0.01 -0.69 0.64 1.56 0.41 0.00 0.00 173.24 175.16 1dv3 h GLN 9 N 2.26 0.25 -4.22 12.44 4.20 -1.97 -3.46 115.11 124.60 1dv3 h GLN 9 Ca -0.49 -0.42 -0.45 0.00 0.06 0.00 0.00 58.65 57.35 1dv3 h GLN 9 Cb 1.23 0.16 -0.34 0.00 0.30 0.00 0.00 27.48 28.83 1dv3 h GLN 9 CO 0.61 1.20 -0.79 0.54 -0.67 0.00 0.00 178.83 179.73 1dv3 s VAL 10 N -2.46 0.77 -0.05 -0.54 0.11 -1.26 -5.13 120.40 111.84 1dv3 s VAL 10 Ca -0.18 -0.26 -0.11 0.00 -2.93 0.00 0.00 61.98 58.49 1dv3 s VAL 10 Cb 0.03 -0.75 -0.05 0.00 -1.53 0.00 0.00 36.38 34.09 1dv3 s VAL 10 CO 0.78 0.27 0.30 -1.10 -3.33 0.00 0.00 175.10 172.02 1dv3 s GLN 11 N 0.82 3.72 0.07 1.54 -0.21 -1.26 -5.09 119.66 119.25 1dv3 s GLN 11 Ca -0.12 0.19 0.07 0.00 0.02 0.00 0.00 55.36 55.52 1dv3 s GLN 11 Cb -0.15 -3.20 -0.03 0.00 1.00 0.00 0.00 33.01 30.63 1dv3 s GLN 11 CO 0.01 0.73 -0.20 0.54 -2.12 0.00 0.00 175.29 174.26 1dv3 s VAL 12 N -1.06 1.59 -0.01 1.09 0.11 -1.26 -5.15 120.40 115.70 1dv3 s VAL 12 Ca 0.20 -1.34 -0.06 0.00 -2.93 0.00 0.00 61.98 57.85 1dv3 s VAL 12 Cb -0.15 -1.42 0.00 0.00 -1.53 0.00 0.00 36.38 33.28 1dv3 s VAL 12 CO 0.10 0.03 0.12 -0.60 -3.33 0.00 0.00 175.10 171.42 1dv3 s ARG 13 N -1.54 0.39 0.00 1.54 3.52 -1.26 -5.05 118.95 116.54 1dv3 s ARG 13 Ca 0.06 -0.27 0.00 0.00 -0.13 0.00 0.00 55.73 55.39 1dv3 s ARG 13 Cb -0.09 0.16 0.00 0.00 -1.56 0.00 0.00 34.95 33.46 1dv3 s ARG 13 CO 0.03 -0.08 0.00 0.41 -0.81 0.00 0.00 175.30 174.84 1dv3 n GLY 14 N 1.86 4.83 3.65 8.12 0.00 -1.26 -5.12 105.19 117.27 1dv3 n GLY 14 Ca -0.20 -1.58 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 1dv3 n GLY 14 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1dv3 n PRO 15 N 0.00 1.77 -1.65 1.61 -0.02 -1.26 -4.86 135.00 130.59 1dv3 n PRO 15 Ca 0.00 0.62 -0.44 0.00 -2.02 0.00 0.00 63.50 61.66 1dv3 n PRO 15 Cb 0.00 -2.15 -0.02 0.00 -0.02 0.00 0.00 33.50 31.31 1dv3 n PRO 15 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dv3 n ALA 16 N 0.13 0.61 -2.60 3.55 0.00 -1.26 -4.92 120.51 116.02 1dv3 n ALA 16 Ca 0.07 0.40 -0.40 0.00 0.00 0.00 0.00 53.44 53.51 1dv3 n ALA 16 Cb 0.36 -2.17 -0.09 0.00 0.00 0.00 0.00 19.45 17.55 1dv3 n ALA 16 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1dv3 s ASP 17 N -0.15 6.30 0.00 0.00 -1.08 -1.26 -4.94 116.67 115.54 1dv3 s ASP 17 Ca 0.62 0.26 0.27 0.00 -0.52 0.00 0.00 52.55 53.18 1dv3 s ASP 17 Cb -0.66 -2.24 0.86 0.00 -1.46 0.00 0.00 42.92 39.43 1dv3 s ASP 17 CO 0.57 -0.27 1.66 0.18 0.52 0.00 0.00 175.17 177.83 1dv3 n LEU 18 N 5.45 0.30 0.00 -1.34 4.77 -1.26 -4.68 117.00 120.24 1dv3 n LEU 18 Ca -0.07 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 1dv3 n LEU 18 Cb 0.50 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1dv3 n LEU 18 CO 0.39 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1dv3 n GLY 19 N 1.48 -1.44 3.75 -0.72 0.00 -1.26 -4.94 105.19 102.07 1dv3 n GLY 19 Ca 0.07 -1.57 -0.38 0.00 0.00 0.00 0.00 46.02 44.14 1dv3 n GLY 19 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1dv3 s MET 20 N -2.46 3.03 -0.18 1.61 -1.94 -1.26 -4.98 119.30 113.12 1dv3 s MET 20 Ca 0.00 2.13 -0.14 0.00 -1.71 0.00 0.00 55.69 55.97 1dv3 s MET 20 Cb 0.00 -2.14 -0.08 0.00 2.01 0.00 0.00 34.83 34.62 1dv3 s MET 20 CO 0.00 -1.25 -0.17 2.41 -0.01 0.00 0.00 175.02 176.01 1dv3 n THR 21 N -1.25 1.47 -1.62 2.05 -1.04 -1.26 -4.95 114.28 107.69 1dv3 n THR 21 Ca 0.12 0.08 0.00 0.00 -2.04 0.00 0.00 64.05 62.20 1dv3 n THR 21 Cb 0.46 -2.25 0.00 0.00 -1.82 0.00 0.00 70.33 66.72 1dv3 n THR 21 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1dv3 n GLU 22 N -4.50 0.00 -0.51 -2.82 4.07 -1.26 -1.48 120.64 114.13 1dv3 n GLU 22 Ca -0.20 0.00 0.07 0.00 -0.06 0.00 0.00 57.16 56.98 1dv3 n GLU 22 Cb 0.49 0.00 0.29 0.00 -0.06 0.00 0.00 31.44 32.16 1dv3 n GLU 22 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1dv3 n ASP 23 N -0.08 3.96 -4.80 4.31 8.00 -0.34 -4.97 116.55 122.63 1dv3 n ASP 23 Ca 0.00 -2.39 -0.35 0.00 0.71 0.00 0.00 54.79 52.75 1dv3 n ASP 23 Cb 0.00 -0.53 -0.06 0.00 -0.02 0.00 0.00 41.12 40.51 1dv3 n ASP 23 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1dv3 s VAL 24 N -1.84 4.21 -0.90 2.53 0.11 -0.55 -4.90 120.40 119.06 1dv3 s VAL 24 Ca 0.41 1.63 -0.24 0.00 -2.93 0.00 0.00 61.98 60.84 1dv3 s VAL 24 Cb 0.27 -3.81 0.01 0.00 -1.53 0.00 0.00 36.38 31.31 1dv3 s VAL 24 CO 0.19 -0.05 1.63 0.21 -3.33 0.00 0.00 175.10 173.75 1dv3 s ASN 25 N -1.82 5.89 0.63 3.54 3.84 -1.26 -4.86 114.94 120.91 1dv3 s ASN 25 Ca 0.56 -0.86 0.26 0.00 0.21 0.00 0.00 52.86 53.02 1dv3 s ASN 25 Cb -0.16 -2.56 1.34 0.00 -0.55 0.00 0.00 41.25 39.32 1dv3 s ASN 25 CO 0.20 -2.04 1.76 -0.07 -2.79 0.00 0.00 177.10 174.16 1dv3 h LEU 26 N 14.82 0.00 -1.32 3.21 4.07 -1.93 -0.17 115.31 133.99 1dv3 h LEU 26 Ca 0.05 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.94 1dv3 h LEU 26 Cb 1.03 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.76 1dv3 h LEU 26 CO 1.32 0.00 -0.31 0.00 -1.08 0.00 0.00 178.44 178.37 1dv3 h ALA 27 N 1.17 1.23 -0.10 1.53 0.00 -2.02 -2.79 119.26 118.29 1dv3 h ALA 27 Ca 0.11 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1dv3 h ALA 27 Cb 1.17 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1dv3 h ALA 27 CO -0.00 0.39 0.00 0.09 0.00 0.00 0.00 179.25 179.73 1dv3 n ASN 28 N -3.80 1.53 -4.72 0.00 3.02 -0.08 -4.85 115.26 106.36 1dv3 n ASN 28 Ca -0.01 -1.60 -0.39 0.00 -0.03 0.00 0.00 54.58 52.55 1dv3 n ASN 28 Cb 0.40 -0.06 -0.05 0.00 -0.61 0.00 0.00 39.78 39.46 1dv3 n ASN 28 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1dv3 s ARG 29 N -1.88 4.38 0.44 3.52 6.06 -1.05 -0.67 118.95 129.73 1dv3 s ARG 29 Ca 0.35 0.68 -0.07 0.00 -2.50 0.00 0.00 55.73 54.19 1dv3 s ARG 29 Cb 0.19 -3.43 0.11 0.00 0.06 0.00 0.00 34.95 31.87 1dv3 s ARG 29 CO 0.29 0.14 0.45 -1.13 -2.50 0.00 0.00 175.30 172.55 1dv3 n SER 30 N 3.61 -0.93 -4.92 -2.12 3.41 -0.06 -4.97 113.62 107.64 1dv3 n SER 30 Ca -0.04 -0.90 -0.21 0.00 -0.26 0.00 0.00 58.87 57.46 1dv3 n SER 30 Cb 0.51 -0.38 0.05 0.00 -0.26 0.00 0.00 64.21 64.13 1dv3 n SER 30 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1dv3 s GLY 31 N -3.54 1.81 0.35 5.00 0.00 -1.26 -4.63 107.32 105.05 1dv3 s GLY 31 Ca 0.28 -1.44 -0.28 0.00 0.00 0.00 0.00 44.72 43.28 1dv3 s GLY 31 CO 0.20 -1.09 1.26 0.14 0.00 0.00 0.00 173.10 173.62 1dv3 s VAL 32 N -2.84 2.85 0.00 1.40 1.01 -1.26 -4.29 120.40 117.27 1dv3 s VAL 32 Ca 0.59 0.82 0.00 0.00 0.00 0.00 0.00 61.98 63.39 1dv3 s VAL 32 Cb -0.09 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.78 1dv3 s VAL 32 CO 0.40 0.17 0.00 0.61 0.00 0.00 0.00 175.10 176.27 1dv3 n GLY 33 N 0.80 -0.18 3.90 4.51 0.00 0.03 -4.95 105.19 109.30 1dv3 n GLY 33 Ca 0.01 -1.79 -0.29 0.00 0.00 0.00 0.00 46.02 43.96 1dv3 n GLY 33 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1dv3 s PRO 34 N -1.81 2.04 -0.18 1.61 0.04 -1.26 -4.66 135.00 130.78 1dv3 s PRO 34 Ca 0.00 0.07 -0.07 0.00 0.04 0.00 0.00 61.00 61.03 1dv3 s PRO 34 Cb 0.00 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.51 1dv3 s PRO 34 CO 0.00 -1.51 0.06 -0.06 0.04 0.00 0.00 177.00 175.52 1dv3 s PHE 35 N -3.51 3.24 -0.34 0.56 0.40 -1.26 -2.60 117.98 114.47 1dv3 s PHE 35 Ca 0.61 0.05 -0.11 0.00 -0.60 0.00 0.00 56.93 56.88 1dv3 s PHE 35 Cb -0.11 -2.07 -0.00 0.00 0.51 0.00 0.00 43.02 41.35 1dv3 s PHE 35 CO 0.48 0.15 0.20 0.45 0.70 0.00 0.00 175.22 177.20 1dv3 s SER 36 N 0.36 5.79 0.32 1.36 0.15 0.12 -4.93 113.70 116.87 1dv3 s SER 36 Ca 0.03 -0.60 0.12 0.00 0.70 0.00 0.00 55.95 56.20 1dv3 s SER 36 Cb -0.12 -2.06 0.53 0.00 -1.71 0.00 0.00 66.02 62.66 1dv3 s SER 36 CO 0.00 -0.26 1.71 0.74 1.20 0.00 0.00 173.24 176.63 1dv3 h THR 37 N 5.64 1.32 -0.01 6.45 2.02 -1.97 -1.29 112.91 125.07 1dv3 h THR 37 Ca -0.30 -1.73 -0.00 0.00 0.77 0.00 0.00 66.41 65.14 1dv3 h THR 37 Cb 1.14 1.95 -0.00 0.00 -1.74 0.00 0.00 68.15 69.50 1dv3 h THR 37 CO 0.64 0.49 0.00 0.25 0.37 0.00 0.00 175.52 177.27 1dv3 h LEU 38 N 0.00 0.01 -1.02 2.58 5.85 -1.96 -2.56 115.31 118.21 1dv3 h LEU 38 Ca -0.00 -0.17 -0.10 0.00 0.84 0.00 0.00 57.88 58.45 1dv3 h LEU 38 Cb 0.91 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.92 1dv3 h LEU 38 CO 0.06 0.18 -0.35 -0.07 -0.34 0.00 0.00 178.44 177.93 1dv3 h LEU 39 N -0.15 0.27 -2.41 2.25 3.38 -1.85 -3.05 115.31 113.74 1dv3 h LEU 39 Ca 0.00 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 57.88 1dv3 h LEU 39 Cb 0.17 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 1dv3 h LEU 39 CO -0.00 0.60 0.19 1.23 0.09 0.00 0.00 178.44 180.55 1dv3 h GLY 40 N 1.12 0.00 2.00 0.83 0.00 -0.81 0.20 103.07 106.40 1dv3 h GLY 40 Ca 0.03 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.25 1dv3 h GLY 40 CO 0.05 0.00 -0.49 1.49 0.00 0.00 0.00 176.54 177.60 1dv3 h TRP 41 N 0.00 0.00 0.00 5.60 4.06 -1.43 -3.37 115.95 120.81 1dv3 h TRP 41 Ca 0.01 0.00 -0.29 0.00 2.06 0.00 0.00 58.89 60.67 1dv3 h TRP 41 Cb 0.40 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.51 1dv3 h TRP 41 CO 0.00 0.49 -2.07 0.34 -3.56 0.00 0.00 178.44 173.63 1dv3 n PHE 42 N -3.38 0.00 -1.67 0.49 7.35 0.05 -1.33 117.46 118.97 1dv3 n PHE 42 Ca 0.01 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.70 1dv3 n PHE 42 Cb 0.65 -0.72 0.00 0.00 0.35 0.00 0.00 39.48 39.76 1dv3 n PHE 42 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1dv3 n GLY 43 N 2.48 4.49 3.76 7.13 0.00 0.47 -4.92 105.19 118.60 1dv3 n GLY 43 Ca -0.34 -0.87 -0.39 0.00 0.00 0.00 0.00 46.02 44.42 1dv3 n GLY 43 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dv3 s ASN 44 N 1.45 5.60 0.13 1.61 0.01 -1.26 -3.81 114.94 118.66 1dv3 s ASN 44 Ca 0.00 2.75 0.19 0.00 -0.71 0.00 0.00 52.86 55.09 1dv3 s ASN 44 Cb 0.00 -2.64 -0.07 0.00 0.41 0.00 0.00 41.25 38.95 1dv3 s ASN 44 CO 0.00 -1.35 0.93 0.00 -1.51 0.00 0.00 177.10 175.17 1dv3 h ALA 45 N 1.83 0.58 -2.53 0.60 0.00 -1.84 -3.36 119.26 114.56 1dv3 h ALA 45 Ca -0.51 -0.45 -0.53 0.00 0.00 0.00 0.00 54.91 53.42 1dv3 h ALA 45 Cb 1.28 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.22 1dv3 h ALA 45 CO 0.59 0.49 0.47 -1.14 0.00 0.00 0.00 179.25 179.66 1dv3 s GLN 46 N -3.13 4.54 -0.09 0.00 0.74 -1.26 0.14 119.66 120.60 1dv3 s GLN 46 Ca -0.02 1.63 -0.01 0.00 0.05 0.00 0.00 55.36 57.02 1dv3 s GLN 46 Cb 0.09 -3.36 -0.03 0.00 1.10 0.00 0.00 33.01 30.81 1dv3 s GLN 46 CO 0.80 -0.06 -0.03 -0.51 -0.55 0.00 0.00 175.29 174.94 1dv3 s LEU 47 N 0.51 3.36 0.21 3.68 1.02 -1.07 -4.96 118.68 121.43 1dv3 s LEU 47 Ca 0.53 0.03 0.00 0.00 0.02 0.00 0.00 54.13 54.71 1dv3 s LEU 47 Cb -0.27 -1.76 0.00 0.00 0.02 0.00 0.00 46.19 44.18 1dv3 s LEU 47 CO 0.31 0.34 0.00 0.61 0.02 0.00 0.00 176.35 177.63 1dv3 n GLY 48 N 2.39 -1.74 3.79 -3.19 0.00 -1.26 -0.79 105.19 104.39 1dv3 n GLY 48 Ca -0.18 -1.30 -0.30 0.00 0.00 0.00 0.00 46.02 44.24 1dv3 n GLY 48 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1dv3 s PRO 49 N -1.88 1.77 0.14 1.61 0.04 -1.26 -4.56 135.00 130.86 1dv3 s PRO 49 Ca 0.00 0.57 0.10 0.00 0.04 0.00 0.00 61.00 61.71 1dv3 s PRO 49 Cb 0.00 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.61 1dv3 s PRO 49 CO 0.00 -1.82 -0.22 -1.50 0.04 0.00 0.00 177.00 173.49 1dv3 s ILE 50 N -3.17 2.53 -0.24 0.56 2.07 -1.26 -4.92 121.20 116.77 1dv3 s ILE 50 Ca 0.62 -1.73 -0.15 0.00 -1.41 0.00 0.00 60.65 57.98 1dv3 s ILE 50 Cb -0.15 -2.16 -0.04 0.00 0.13 0.00 0.00 42.46 40.24 1dv3 s ILE 50 CO 0.54 0.04 0.37 -0.47 -1.91 0.00 0.00 174.94 173.51 1dv3 s TYR 51 N -1.26 3.31 -0.68 3.50 6.14 -1.26 -0.88 117.35 126.22 1dv3 s TYR 51 Ca 0.17 0.49 0.05 0.00 0.64 0.00 0.00 57.07 58.42 1dv3 s TYR 51 Cb -0.10 -2.53 0.17 0.00 0.42 0.00 0.00 41.96 39.92 1dv3 s TYR 51 CO 0.09 -0.11 0.50 1.28 0.64 0.00 0.00 175.55 177.94 1dv3 n LEU 52 N 4.89 2.80 0.00 6.97 4.77 0.15 -4.95 117.00 131.63 1dv3 n LEU 52 Ca -0.09 -5.16 -0.01 0.00 -0.03 0.00 0.00 56.01 50.72 1dv3 n LEU 52 Cb 0.51 -0.65 0.01 0.00 -2.33 0.00 0.00 43.42 40.96 1dv3 n LEU 52 CO 0.38 1.78 0.03 0.61 -1.33 0.00 0.00 177.39 178.86 1dv3 n GLY 53 N 1.96 -0.23 0.27 -0.72 0.00 -1.26 -4.84 105.19 100.36 1dv3 n GLY 53 Ca 0.21 -1.81 -0.11 0.00 0.00 0.00 0.00 46.02 44.31 1dv3 n GLY 53 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1dv3 h SER 54 N -0.05 0.95 -0.75 1.61 0.02 -1.99 -1.92 113.55 111.42 1dv3 h SER 54 Ca -0.02 -0.37 -0.00 0.00 -0.84 0.00 0.00 61.79 60.56 1dv3 h SER 54 Cb 0.05 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.29 1dv3 h SER 54 CO 0.01 1.10 0.47 0.25 -1.14 0.00 0.00 176.83 177.52 1dv3 h LEU 55 N 0.78 0.89 -0.39 5.07 5.85 -1.94 -0.21 115.31 125.35 1dv3 h LEU 55 Ca 0.12 -0.04 -0.18 0.00 0.84 0.00 0.00 57.88 58.61 1dv3 h LEU 55 Cb 0.70 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 1dv3 h LEU 55 CO 0.05 0.67 -0.65 1.23 -0.34 0.00 0.00 178.44 179.41 1dv3 h GLY 56 N 1.05 0.65 0.91 3.75 0.00 -1.84 -1.32 103.07 106.27 1dv3 h GLY 56 Ca 0.27 -0.84 -0.06 0.00 0.00 0.00 0.00 47.33 46.70 1dv3 h GLY 56 CO -0.05 0.75 -0.05 -2.08 0.00 0.00 0.00 176.54 175.10 1dv3 h VAL 57 N 0.43 1.27 -0.14 4.60 2.07 -0.86 -0.31 116.25 123.31 1dv3 h VAL 57 Ca -0.01 -1.07 0.01 0.00 0.82 0.00 0.00 66.70 66.44 1dv3 h VAL 57 Cb 1.22 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.29 1dv3 h VAL 57 CO 0.12 0.35 0.07 0.25 0.02 0.00 0.00 177.57 178.39 1dv3 h LEU 58 N 0.39 0.12 -0.20 2.57 5.85 -1.03 0.11 115.31 123.12 1dv3 h LEU 58 Ca 0.09 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.84 1dv3 h LEU 58 Cb 0.53 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 1dv3 h LEU 58 CO 0.03 0.09 0.03 -1.28 -0.34 0.00 0.00 178.44 176.97 1dv3 h SER 59 N 0.16 -0.00 -0.61 1.25 0.87 -1.07 -0.72 113.55 113.44 1dv3 h SER 59 Ca 0.06 0.03 -0.04 0.00 -1.23 0.00 0.00 61.79 60.61 1dv3 h SER 59 Cb 0.00 0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 61.98 1dv3 h SER 59 CO -0.03 0.03 0.25 0.25 -0.53 0.00 0.00 176.83 176.80 1dv3 h LEU 60 N 0.11 0.86 0.45 2.23 6.46 -0.84 -0.06 115.31 124.52 1dv3 h LEU 60 Ca 0.09 -0.12 -0.02 0.00 -0.12 0.00 0.00 57.88 57.71 1dv3 h LEU 60 Cb 0.09 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 39.80 1dv3 h LEU 60 CO -0.12 0.77 -0.21 0.15 -0.62 0.00 0.00 178.44 178.41 1dv3 h PHE 61 N 0.92 -0.55 -0.91 1.25 3.57 -0.09 -0.67 116.94 120.45 1dv3 h PHE 61 Ca 0.22 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.71 1dv3 h PHE 61 Cb 0.19 0.18 -0.05 0.00 2.79 0.00 0.00 35.95 39.07 1dv3 h PHE 61 CO 0.01 -0.28 0.60 0.77 -2.23 0.00 0.00 178.31 177.19 1dv3 h SER 62 N -0.73 1.05 -0.48 0.41 0.02 -1.06 -0.01 113.55 112.74 1dv3 h SER 62 Ca -0.06 -0.03 0.08 0.00 -0.84 0.00 0.00 61.79 60.93 1dv3 h SER 62 Cb 0.53 -0.26 -0.06 0.00 0.14 0.00 0.00 62.40 62.74 1dv3 h SER 62 CO 0.10 0.77 0.12 1.23 -1.14 0.00 0.00 176.83 177.91 1dv3 h GLY 63 N 1.24 0.60 1.12 -3.77 0.00 -0.85 0.21 103.07 101.61 1dv3 h GLY 63 Ca 0.33 -0.04 -0.14 0.00 0.00 0.00 0.00 47.33 47.48 1dv3 h GLY 63 CO -0.07 -0.05 -0.26 1.41 0.00 0.00 0.00 176.54 177.58 1dv3 h LEU 64 N 0.26 1.03 -1.26 3.11 3.38 -0.44 -2.33 115.31 119.06 1dv3 h LEU 64 Ca 0.24 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 1dv3 h LEU 64 Cb 0.30 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1dv3 h LEU 64 CO -0.29 1.22 0.17 0.24 0.09 0.00 0.00 178.44 179.86 1dv3 h MET 65 N 0.84 0.68 0.15 1.13 2.86 -0.13 0.26 114.93 120.72 1dv3 h MET 65 Ca 0.10 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1dv3 h MET 65 Cb 0.84 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.38 1dv3 h MET 65 CO 0.07 0.58 -0.07 2.35 1.06 0.00 0.00 176.91 180.90 1dv3 h TRP 66 N 0.67 -0.19 -0.70 -0.22 7.01 -0.42 0.70 115.95 122.81 1dv3 h TRP 66 Ca 0.16 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.14 1dv3 h TRP 66 Cb 0.16 0.06 -0.03 0.00 -2.10 0.00 0.00 29.16 27.25 1dv3 h TRP 66 CO 0.01 0.01 0.38 0.35 -2.79 0.00 0.00 178.44 176.40 1dv3 h PHE 67 N -0.35 0.94 -0.28 2.65 3.57 -1.04 -2.56 116.94 119.88 1dv3 h PHE 67 Ca -0.02 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.41 1dv3 h PHE 67 Cb 0.27 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 1dv3 h PHE 67 CO -0.02 0.66 -0.03 0.35 -2.23 0.00 0.00 178.31 177.04 1dv3 h PHE 68 N 0.97 0.56 -0.49 0.41 3.57 -0.21 -0.85 116.94 120.90 1dv3 h PHE 68 Ca 0.25 -0.11 0.06 0.00 3.53 0.00 0.00 57.97 61.70 1dv3 h PHE 68 Cb 0.03 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 38.57 1dv3 h PHE 68 CO 0.01 0.68 0.21 1.15 -2.23 0.00 0.00 178.31 178.12 1dv3 h THR 69 N 0.28 0.89 -0.17 4.41 2.02 -0.58 0.17 112.91 119.92 1dv3 h THR 69 Ca 0.07 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 1dv3 h THR 69 Cb 0.48 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1dv3 h THR 69 CO 0.02 0.07 0.04 0.40 0.37 0.00 0.00 175.52 176.42 1dv3 h ILE 70 N 0.41 1.20 -0.90 3.11 2.04 -1.42 -2.84 117.51 119.10 1dv3 h ILE 70 Ca 0.23 -0.65 0.06 0.00 1.00 0.00 0.00 64.86 65.50 1dv3 h ILE 70 Cb 0.20 1.31 -0.06 0.00 -0.74 0.00 0.00 36.82 37.53 1dv3 h ILE 70 CO -0.20 0.20 0.57 1.23 0.00 0.00 0.00 178.15 179.94 1dv3 h GLY 71 N 0.08 1.37 1.59 5.37 0.00 -0.52 -1.09 103.07 109.87 1dv3 h GLY 71 Ca 0.05 -0.41 -0.11 0.00 0.00 0.00 0.00 47.33 46.87 1dv3 h GLY 71 CO 0.00 0.28 -0.31 1.19 0.00 0.00 0.00 176.54 177.70 1dv3 h ILE 72 N 1.03 1.28 -0.36 2.60 2.10 -0.62 -1.48 117.51 122.06 1dv3 h ILE 72 Ca 0.39 -1.38 -0.13 0.00 1.08 0.00 0.00 64.86 64.82 1dv3 h ILE 72 Cb 0.18 1.45 -0.01 0.00 -1.09 0.00 0.00 36.82 37.35 1dv3 h ILE 72 CO -0.18 0.43 -0.31 -0.25 -1.08 0.00 0.00 178.15 176.76 1dv3 h TRP 73 N 0.40 0.92 -0.41 2.19 2.91 -1.14 -1.50 115.95 119.32 1dv3 h TRP 73 Ca 0.05 -0.24 -0.05 0.00 1.13 0.00 0.00 58.89 59.78 1dv3 h TRP 73 Cb 0.75 -0.21 -0.02 0.00 -0.51 0.00 0.00 29.16 29.17 1dv3 h TRP 73 CO 0.02 1.00 0.07 0.74 -1.03 0.00 0.00 178.44 179.24 1dv3 h PHE 74 N 0.66 0.73 -0.40 2.65 -1.00 -0.97 -0.02 116.94 118.60 1dv3 h PHE 74 Ca 0.07 -0.10 -0.05 0.00 2.81 0.00 0.00 57.97 60.70 1dv3 h PHE 74 Cb 0.85 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 40.19 1dv3 h PHE 74 CO 0.05 0.71 0.03 -1.49 -1.61 0.00 0.00 178.31 175.99 1dv3 h TRP 75 N 0.54 0.64 -0.43 -0.55 4.06 -1.16 -0.53 115.95 118.51 1dv3 h TRP 75 Ca 0.13 -0.06 -0.07 0.00 2.06 0.00 0.00 58.89 60.94 1dv3 h TRP 75 Cb 0.37 -0.18 -0.02 0.00 -1.00 0.00 0.00 29.16 28.33 1dv3 h TRP 75 CO 0.03 0.60 -0.01 -0.92 -3.56 0.00 0.00 178.44 174.57 1dv3 h TYR 76 N 0.59 0.84 0.00 0.49 3.20 -0.89 -0.66 116.97 120.54 1dv3 h TYR 76 Ca 0.13 -0.15 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 1dv3 h TYR 76 Cb 0.33 -0.22 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 1dv3 h TYR 76 CO 0.01 0.83 -0.01 1.96 -1.64 0.00 0.00 178.16 179.32 1dv3 h GLN 77 N 0.61 0.00 -0.17 1.82 4.20 -0.26 -1.93 115.11 119.38 1dv3 h GLN 77 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1dv3 h GLN 77 Cb 0.51 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1dv3 h GLN 77 CO 0.02 0.01 0.00 0.00 -0.67 0.00 0.00 178.83 178.19 1dv3 n ALA 78 N -2.10 2.49 -1.99 3.87 0.00 -0.28 -4.93 120.51 117.58 1dv3 n ALA 78 Ca -0.01 -0.67 -0.15 0.00 0.00 0.00 0.00 53.44 52.61 1dv3 n ALA 78 Cb 0.20 -0.99 -0.03 0.00 0.00 0.00 0.00 19.45 18.63 1dv3 n ALA 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dv3 n GLY 79 N 1.29 0.37 2.56 0.00 0.00 -0.73 -2.30 105.19 106.39 1dv3 n GLY 79 Ca 0.17 -0.27 -0.20 0.00 0.00 0.00 0.00 46.02 45.72 1dv3 n GLY 79 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1dv3 n TRP 80 N -3.51 -1.29 -3.72 1.61 7.02 -0.32 -4.96 117.44 112.27 1dv3 n TRP 80 Ca -0.17 0.12 -0.38 0.00 -1.02 0.00 0.00 57.50 56.05 1dv3 n TRP 80 Cb 0.59 -3.82 -0.12 0.00 -2.42 0.00 0.00 31.31 25.53 1dv3 n TRP 80 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 1dv3 s ASN 81 N -2.20 5.40 0.29 -0.99 3.84 -0.97 -4.99 114.94 115.32 1dv3 s ASN 81 Ca 0.07 -1.17 0.04 0.00 0.21 0.00 0.00 52.86 52.00 1dv3 s ASN 81 Cb -0.03 -1.90 0.71 0.00 -0.55 0.00 0.00 41.25 39.48 1dv3 s ASN 81 CO 0.09 -0.36 1.71 -0.65 -2.79 0.00 0.00 177.10 175.10 1dv3 h PRO 82 N 8.26 0.44 -0.45 0.43 0.11 -1.93 0.10 132.00 138.98 1dv3 h PRO 82 Ca -0.23 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.83 1dv3 h PRO 82 Cb 1.08 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 1dv3 h PRO 82 CO 0.63 0.29 0.20 0.00 -0.21 0.00 0.00 178.00 178.91 1dv3 h ALA 83 N 1.69 0.58 -0.32 -0.75 0.00 -1.96 -2.14 119.26 116.35 1dv3 h ALA 83 Ca 0.55 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 55.21 1dv3 h ALA 83 Cb 1.01 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1dv3 h ALA 83 CO -0.49 0.16 -0.32 0.28 0.00 0.00 0.00 179.25 178.88 1dv3 h VAL 84 N 0.58 1.28 -0.93 0.00 2.07 -1.46 -2.34 116.25 115.45 1dv3 h VAL 84 Ca 0.15 -1.45 0.02 0.00 0.82 0.00 0.00 66.70 66.24 1dv3 h VAL 84 Cb 0.15 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 1dv3 h VAL 84 CO -0.02 0.47 0.61 0.15 0.02 0.00 0.00 177.57 178.81 1dv3 h PHE 85 N 0.59 1.14 0.15 1.57 3.57 -0.60 -1.91 116.94 121.45 1dv3 h PHE 85 Ca 0.07 0.03 -0.29 0.00 3.53 0.00 0.00 57.97 61.31 1dv3 h PHE 85 Cb 0.83 -0.38 0.01 0.00 2.79 0.00 0.00 35.95 39.19 1dv3 h PHE 85 CO 0.04 0.69 -1.31 -0.07 -2.23 0.00 0.00 178.31 175.42 1dv3 h LEU 86 N 1.20 0.49 -0.26 0.59 3.38 -1.26 -2.16 115.31 117.30 1dv3 h LEU 86 Ca 0.36 -0.53 -0.14 0.00 0.09 0.00 0.00 57.88 57.65 1dv3 h LEU 86 Cb -0.06 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1dv3 h LEU 86 CO -0.10 1.42 -0.65 0.08 0.09 0.00 0.00 178.44 179.28 1dv3 h ARG 87 N 0.08 0.00 -0.46 1.13 0.11 -1.32 -3.27 114.38 110.65 1dv3 h ARG 87 Ca -0.16 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.92 1dv3 h ARG 87 Cb 2.01 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.09 1dv3 h ARG 87 CO 0.21 0.65 0.00 -0.25 0.10 0.00 0.00 179.97 180.68 1dv3 n ASP 88 N -3.38 3.31 -0.30 0.08 8.00 -0.73 -4.70 116.55 118.82 1dv3 n ASP 88 Ca 0.01 -1.95 0.10 0.00 0.71 0.00 0.00 54.79 53.66 1dv3 n ASP 88 Cb 0.75 -0.30 0.23 0.00 -0.02 0.00 0.00 41.12 41.78 1dv3 n ASP 88 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1dv3 h LEU 89 N 3.32 -0.36 -0.21 0.64 5.85 -1.44 0.19 115.31 123.30 1dv3 h LEU 89 Ca 0.00 0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.95 1dv3 h LEU 89 Cb 0.85 0.40 0.00 0.00 0.37 0.00 0.00 40.66 42.28 1dv3 h LEU 89 CO 0.00 -0.25 0.00 0.49 -0.34 0.00 0.00 178.44 178.34 1dv3 n PHE 90 N -5.39 0.56 0.06 1.25 3.72 -1.26 -3.45 117.46 112.95 1dv3 n PHE 90 Ca 0.19 0.19 0.11 0.00 -0.05 0.00 0.00 57.45 57.89 1dv3 n PHE 90 Cb 0.62 -0.80 -0.10 0.00 -0.94 0.00 0.00 39.48 38.26 1dv3 n PHE 90 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1dv3 n PHE 91 N -1.98 0.34 -1.11 1.38 3.01 0.63 -1.95 117.46 117.78 1dv3 n PHE 91 Ca 0.04 0.10 -0.32 0.00 1.01 0.00 0.00 57.45 58.28 1dv3 n PHE 91 Cb 0.31 -0.65 0.12 0.00 -0.01 0.00 0.00 39.48 39.25 1dv3 n PHE 91 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1dv3 s PHE 92 N -3.45 1.99 -0.28 1.38 0.08 -0.93 -4.83 117.98 111.93 1dv3 s PHE 92 Ca -0.05 1.67 -0.18 0.00 0.12 0.00 0.00 56.93 58.50 1dv3 s PHE 92 Cb 0.13 -3.33 0.08 0.00 -0.57 0.00 0.00 43.02 39.33 1dv3 s PHE 92 CO 0.86 -2.51 0.72 0.45 -0.10 0.00 0.00 175.22 174.65 1dv3 s SER 93 N -2.56 -0.87 -0.50 1.36 0.15 -1.26 -4.39 113.70 105.63 1dv3 s SER 93 Ca 0.69 1.44 -0.16 0.00 0.70 0.00 0.00 55.95 58.61 1dv3 s SER 93 Cb -0.24 1.38 0.09 0.00 -1.71 0.00 0.00 66.02 65.54 1dv3 s SER 93 CO 0.52 -0.23 0.47 -0.22 1.20 0.00 0.00 173.24 174.98 1dv3 s LEU 94 N 1.35 5.70 0.25 3.45 0.20 -0.40 -4.94 118.68 124.28 1dv3 s LEU 94 Ca -0.08 -1.42 -0.10 0.00 0.69 0.00 0.00 54.13 53.22 1dv3 s LEU 94 Cb -0.05 -2.23 -0.07 0.00 -0.43 0.00 0.00 46.19 43.41 1dv3 s LEU 94 CO -0.15 -0.77 0.58 -1.61 -0.29 0.00 0.00 176.35 174.11 1dv3 s GLU 95 N 1.81 3.83 0.95 1.98 0.41 -1.26 -1.36 118.70 125.07 1dv3 s GLU 95 Ca 0.05 0.33 -0.14 0.00 -0.41 0.00 0.00 54.97 54.80 1dv3 s GLU 95 Cb -0.25 -2.61 0.17 0.00 -1.78 0.00 0.00 34.13 29.65 1dv3 s GLU 95 CO 0.06 0.29 1.19 -1.25 -0.49 0.00 0.00 175.26 175.06 1dv3 s PRO 96 N -2.87 0.76 0.71 0.39 0.04 -1.26 -4.13 135.00 128.64 1dv3 s PRO 96 Ca 0.48 0.02 -0.16 0.00 0.04 0.00 0.00 61.00 61.38 1dv3 s PRO 96 Cb -0.11 -1.82 0.01 0.00 0.04 0.00 0.00 34.50 32.62 1dv3 s PRO 96 CO 0.21 -2.40 1.10 -2.30 0.04 0.00 0.00 177.00 173.65 1dv3 n PRO 97 N -3.85 0.62 -1.32 0.56 -0.02 -1.26 -4.51 135.00 125.21 1dv3 n PRO 97 Ca 0.10 0.27 -0.31 0.00 -2.02 0.00 0.00 63.50 61.55 1dv3 n PRO 97 Cb 0.60 -2.35 0.10 0.00 -0.02 0.00 0.00 33.50 31.82 1dv3 n PRO 97 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1dv3 s ALA 98 N -1.75 2.16 0.36 3.55 0.00 -1.26 -3.25 121.76 121.57 1dv3 s ALA 98 Ca 0.76 0.12 0.10 0.00 0.00 0.00 0.00 51.96 52.95 1dv3 s ALA 98 Cb -0.35 -3.22 0.87 0.00 0.00 0.00 0.00 23.12 20.41 1dv3 s ALA 98 CO 0.47 -1.81 1.83 -1.35 0.00 0.00 0.00 175.76 174.91 1dv3 h PRO 99 N -1.15 0.62 -0.50 0.00 0.11 -1.93 -1.71 132.00 127.44 1dv3 h PRO 99 Ca -0.45 -0.04 0.15 0.00 0.11 0.00 0.00 66.00 65.77 1dv3 h PRO 99 Cb 1.24 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1dv3 h PRO 99 CO 0.54 0.41 0.43 0.93 -0.21 0.00 0.00 178.00 180.10 1dv3 h GLU 100 N 0.64 0.00 -0.00 1.05 3.07 -2.01 -0.57 114.58 116.76 1dv3 h GLU 100 Ca 0.50 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.36 1dv3 h GLU 100 Cb 0.92 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.83 1dv3 h GLU 100 CO -0.25 0.00 -0.10 0.66 -1.40 0.00 0.00 179.01 177.91 1dv3 n TYR 101 N -4.05 0.00 0.00 4.33 4.01 -0.64 -4.99 117.16 115.82 1dv3 n TYR 101 Ca 0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.83 1dv3 n TYR 101 Cb 0.64 -0.30 0.00 0.00 -0.31 0.00 0.00 39.34 39.37 1dv3 n TYR 101 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1dv3 n GLY 102 N 1.37 3.41 1.20 2.72 0.00 -0.23 -1.61 105.19 112.04 1dv3 n GLY 102 Ca 0.11 -0.01 0.05 0.00 0.00 0.00 0.00 46.02 46.18 1dv3 n GLY 102 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1dv3 n LEU 103 N 0.00 4.46 -4.90 0.99 4.77 -1.24 -1.64 117.00 119.44 1dv3 n LEU 103 Ca 0.00 -3.11 -0.28 0.00 -0.03 0.00 0.00 56.01 52.59 1dv3 n LEU 103 Cb 0.00 -0.60 0.02 0.00 -2.33 0.00 0.00 43.42 40.51 1dv3 n LEU 103 CO 0.00 0.74 0.58 -0.94 -1.33 0.00 0.00 177.39 176.44 1dv3 s SER 104 N -1.73 5.82 -0.32 -1.43 1.04 -0.64 -4.97 113.70 111.48 1dv3 s SER 104 Ca 0.46 0.94 0.10 0.00 0.48 0.00 0.00 55.95 57.93 1dv3 s SER 104 Cb 0.37 -1.99 0.65 0.00 0.10 0.00 0.00 66.02 65.15 1dv3 s SER 104 CO 0.09 -0.96 1.70 0.49 0.98 0.00 0.00 173.24 175.54 1dv3 n PHE 105 N -2.60 2.04 0.12 5.02 3.72 -1.26 -4.55 117.46 119.95 1dv3 n PHE 105 Ca 0.04 -1.37 0.04 0.00 -0.05 0.00 0.00 57.45 56.11 1dv3 n PHE 105 Cb 0.56 -0.64 0.01 0.00 -0.94 0.00 0.00 39.48 38.48 1dv3 n PHE 105 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1dv3 h ALA 106 N 1.83 0.69 -1.45 4.37 0.00 -1.94 -3.48 119.26 119.29 1dv3 h ALA 106 Ca 0.29 -0.45 -0.68 0.00 0.00 0.00 0.00 54.91 54.08 1dv3 h ALA 106 Cb 2.16 0.03 0.08 0.00 0.00 0.00 0.00 17.79 20.06 1dv3 h ALA 106 CO 0.66 0.56 0.02 0.00 0.00 0.00 0.00 179.25 180.48 1dv3 n ALA 107 N -2.25 -1.78 -1.64 0.00 0.00 -1.26 -4.90 120.51 108.68 1dv3 n ALA 107 Ca -0.01 0.48 -0.35 0.00 0.00 0.00 0.00 53.44 53.56 1dv3 n ALA 107 Cb 0.72 -1.87 0.04 0.00 0.00 0.00 0.00 19.45 18.34 1dv3 n ALA 107 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1dv3 s PRO 108 N -0.58 2.83 0.24 0.00 0.02 -1.26 -3.81 135.00 132.44 1dv3 s PRO 108 Ca 0.73 1.73 -0.11 0.00 0.02 0.00 0.00 61.00 63.36 1dv3 s PRO 108 Cb -0.93 -1.92 0.34 0.00 0.02 0.00 0.00 34.50 32.01 1dv3 s PRO 108 CO 0.55 -1.29 1.59 -0.07 -0.33 0.00 0.00 177.00 177.44 1dv3 h LEU 109 N 0.57 -0.81 0.00 -5.54 3.38 -1.90 0.23 115.31 111.23 1dv3 h LEU 109 Ca -0.49 0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1dv3 h LEU 109 Cb 1.29 0.52 0.00 0.00 0.09 0.00 0.00 40.66 42.56 1dv3 h LEU 109 CO 0.54 -0.28 0.00 0.29 0.09 0.00 0.00 178.44 179.09 1dv3 n LYS 110 N -5.53 0.89 -2.55 1.13 5.02 -1.26 -1.77 118.16 114.09 1dv3 n LYS 110 Ca 0.12 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.31 1dv3 n LYS 110 Cb 0.42 -1.36 0.04 0.00 -0.02 0.00 0.00 35.03 34.10 1dv3 n LYS 110 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1dv3 n GLU 111 N -0.86 2.36 0.00 1.97 1.02 0.73 -4.93 120.64 120.92 1dv3 n GLU 111 Ca 0.16 -3.74 0.00 0.00 -0.02 0.00 0.00 57.16 53.55 1dv3 n GLU 111 Cb 0.07 -1.82 0.00 0.00 -0.02 0.00 0.00 31.44 29.67 1dv3 n GLU 111 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1dv3 n GLY 112 N -0.59 1.41 0.29 0.62 0.00 -1.17 -4.36 105.19 101.39 1dv3 n GLY 112 Ca 0.20 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.13 1dv3 n GLY 112 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1dv3 h GLY 113 N 0.00 1.10 1.48 -0.02 0.00 -1.35 -1.73 103.07 102.56 1dv3 h GLY 113 Ca 0.00 -0.78 -0.10 0.00 0.00 0.00 0.00 47.33 46.45 1dv3 h GLY 113 CO 0.00 0.72 -0.21 1.41 0.00 0.00 0.00 176.54 178.46 1dv3 h LEU 114 N 0.92 0.61 -0.43 3.11 4.07 -1.59 -1.83 115.31 120.18 1dv3 h LEU 114 Ca 0.17 -0.20 -0.02 0.00 0.08 0.00 0.00 57.88 57.91 1dv3 h LEU 114 Cb 0.50 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 42.05 1dv3 h LEU 114 CO 0.02 0.82 0.17 -0.25 -1.08 0.00 0.00 178.44 178.12 1dv3 h TRP 115 N 0.54 0.65 -0.83 1.13 7.01 -1.73 0.20 115.95 122.93 1dv3 h TRP 115 Ca 0.08 -0.05 -0.01 0.00 2.11 0.00 0.00 58.89 61.02 1dv3 h TRP 115 Cb 0.65 -0.19 -0.04 0.00 -2.10 0.00 0.00 29.16 27.48 1dv3 h TRP 115 CO 0.03 0.57 0.46 -0.07 -2.79 0.00 0.00 178.44 176.63 1dv3 h LEU 116 N 0.54 1.03 -0.20 0.65 3.38 -0.98 -0.35 115.31 119.39 1dv3 h LEU 116 Ca 0.14 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1dv3 h LEU 116 Cb 0.19 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1dv3 h LEU 116 CO -0.01 0.83 0.04 0.40 0.09 0.00 0.00 178.44 179.79 1dv3 h ILE 117 N 1.15 1.21 -0.83 1.22 2.04 -1.04 -1.61 117.51 119.65 1dv3 h ILE 117 Ca 0.29 -0.69 0.10 0.00 1.00 0.00 0.00 64.86 65.56 1dv3 h ILE 117 Cb 0.02 1.29 -0.08 0.00 -0.74 0.00 0.00 36.82 37.32 1dv3 h ILE 117 CO -0.05 0.22 0.48 0.00 0.00 0.00 0.00 178.15 178.79 1dv3 h ALA 118 N 0.85 1.20 -0.12 1.87 0.00 -0.58 -1.17 119.26 121.31 1dv3 h ALA 118 Ca 0.06 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 1dv3 h ALA 118 Cb 0.29 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1dv3 h ALA 118 CO 0.00 0.09 -0.36 0.77 0.00 0.00 0.00 179.25 179.75 1dv3 h SER 119 N 0.79 0.24 -0.02 0.00 0.02 -0.79 -1.73 113.55 112.06 1dv3 h SER 119 Ca 0.41 -0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 61.26 1dv3 h SER 119 Cb 0.39 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 62.86 1dv3 h SER 119 CO -0.26 0.59 0.00 0.15 -1.14 0.00 0.00 176.83 176.17 1dv3 h PHE 120 N 0.20 0.04 -0.75 3.45 3.57 -0.25 0.13 116.94 123.33 1dv3 h PHE 120 Ca 0.02 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 1dv3 h PHE 120 Cb 0.73 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.43 1dv3 h PHE 120 CO 0.01 0.31 0.45 0.74 -2.23 0.00 0.00 178.31 177.60 1dv3 h PHE 121 N -0.25 0.99 -0.57 0.41 0.04 -1.21 -1.76 116.94 114.60 1dv3 h PHE 121 Ca 0.01 -0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.71 1dv3 h PHE 121 Cb 0.30 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 1dv3 h PHE 121 CO 0.03 0.67 0.09 1.98 -0.60 0.00 0.00 178.31 180.48 1dv3 h MET 122 N 1.02 0.94 -0.32 1.51 4.05 -1.22 -0.32 114.93 120.59 1dv3 h MET 122 Ca 0.27 -0.25 0.05 0.00 -0.28 0.00 0.00 59.70 59.49 1dv3 h MET 122 Cb -0.03 -0.11 -0.05 0.00 -0.80 0.00 0.00 31.60 30.61 1dv3 h MET 122 CO -0.05 0.90 0.01 0.35 0.23 0.00 0.00 176.91 178.35 1dv3 h PHE 123 N 0.84 0.01 -0.48 1.39 3.57 -0.51 -0.97 116.94 120.79 1dv3 h PHE 123 Ca 0.17 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.61 1dv3 h PHE 123 Cb 0.41 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.18 1dv3 h PHE 123 CO 0.03 -0.04 -0.04 0.28 -2.23 0.00 0.00 178.31 176.31 1dv3 h VAL 124 N 0.11 1.27 0.24 1.41 2.07 -1.11 -2.39 116.25 117.84 1dv3 h VAL 124 Ca 0.15 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.54 1dv3 h VAL 124 Cb 0.20 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1dv3 h VAL 124 CO -0.24 0.39 -0.21 0.00 0.02 0.00 0.00 177.57 177.53 1dv3 h ALA 125 N 0.91 -0.44 -0.06 1.67 0.00 -0.64 -1.25 119.26 119.44 1dv3 h ALA 125 Ca 0.13 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1dv3 h ALA 125 Cb 0.56 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 1dv3 h ALA 125 CO 0.03 -0.77 0.04 0.28 0.00 0.00 0.00 179.25 178.83 1dv3 h VAL 126 N -0.46 1.06 -0.07 0.00 2.07 -1.18 -1.37 116.25 116.30 1dv3 h VAL 126 Ca -0.01 -0.17 -0.10 0.00 0.82 0.00 0.00 66.70 67.24 1dv3 h VAL 126 Cb 0.42 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1dv3 h VAL 126 CO -0.03 0.05 -0.42 -0.50 0.02 0.00 0.00 177.57 176.70 1dv3 h TRP 127 N 0.03 0.19 -0.17 1.57 4.06 -1.42 -0.55 115.95 119.65 1dv3 h TRP 127 Ca 0.02 -0.05 -0.16 0.00 2.06 0.00 0.00 58.89 60.76 1dv3 h TRP 127 Cb 0.05 -0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 28.16 1dv3 h TRP 127 CO -0.05 0.55 -0.56 0.66 -3.56 0.00 0.00 178.44 175.48 1dv3 h SER 128 N 0.13 0.59 -0.39 -3.49 4.64 -1.13 -1.88 113.55 112.02 1dv3 h SER 128 Ca 0.01 -0.32 -0.09 0.00 -0.47 0.00 0.00 61.79 60.93 1dv3 h SER 128 Cb 0.80 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.70 1dv3 h SER 128 CO 0.06 1.02 -0.06 -0.25 -0.87 0.00 0.00 176.83 176.73 1dv3 h TRP 129 N 0.41 0.89 -0.72 4.77 2.91 -0.86 -1.70 115.95 121.64 1dv3 h TRP 129 Ca 0.01 -0.15 -0.04 0.00 1.13 0.00 0.00 58.89 59.84 1dv3 h TRP 129 Cb 1.10 -0.23 -0.03 0.00 -0.51 0.00 0.00 29.16 29.48 1dv3 h TRP 129 CO 0.04 0.85 0.31 2.35 -1.03 0.00 0.00 178.44 180.96 1dv3 h TRP 130 N 0.75 1.06 -0.77 2.65 7.01 -0.82 -1.30 115.95 124.52 1dv3 h TRP 130 Ca 0.13 -0.06 -0.05 0.00 2.11 0.00 0.00 58.89 61.02 1dv3 h TRP 130 Cb 0.54 -0.33 -0.03 0.00 -2.10 0.00 0.00 29.16 27.24 1dv3 h TRP 130 CO 0.03 0.80 0.27 0.78 -2.79 0.00 0.00 178.44 177.52 1dv3 h GLY 131 N 1.09 1.27 0.96 2.65 0.00 -0.77 -2.78 103.07 105.50 1dv3 h GLY 131 Ca 0.25 -0.73 0.01 0.00 0.00 0.00 0.00 47.33 46.86 1dv3 h GLY 131 CO -0.02 0.68 0.26 -0.09 0.00 0.00 0.00 176.54 177.37 1dv3 h ARG 132 N 1.14 0.52 -0.54 4.80 2.43 -0.56 -0.81 114.38 121.36 1dv3 h ARG 132 Ca 0.25 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.42 1dv3 h ARG 132 Cb 0.27 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.68 1dv3 h ARG 132 CO -0.01 0.34 0.36 1.79 -1.51 0.00 0.00 179.97 180.94 1dv3 h THR 133 N 0.53 1.07 0.07 0.20 1.35 -1.01 -0.81 112.91 114.31 1dv3 h THR 133 Ca 0.16 -0.21 -0.00 0.00 -0.55 0.00 0.00 66.41 65.80 1dv3 h THR 133 Cb -0.04 0.39 0.00 0.00 -1.73 0.00 0.00 68.15 66.77 1dv3 h THR 133 CO -0.05 0.11 -0.03 0.22 -0.25 0.00 0.00 175.52 175.52 1dv3 h TYR 134 N 0.62 -0.09 -0.68 4.73 5.03 -1.19 -3.19 116.97 122.21 1dv3 h TYR 134 Ca 0.21 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.51 1dv3 h TYR 134 Cb 0.09 0.03 -0.03 0.00 1.55 0.00 0.00 36.73 38.36 1dv3 h TYR 134 CO -0.00 0.41 0.39 -0.07 -1.32 0.00 0.00 178.16 177.58 1dv3 h LEU 135 N -0.66 0.83 -1.78 2.82 3.38 -0.77 -1.20 115.31 117.93 1dv3 h LEU 135 Ca -0.01 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1dv3 h LEU 135 Cb 0.54 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 1dv3 h LEU 135 CO 0.02 0.66 -0.12 0.03 0.09 0.00 0.00 178.44 179.12 1dv3 h ARG 136 N 0.92 0.00 0.00 1.13 2.47 -1.28 0.15 114.38 117.77 1dv3 h ARG 136 Ca 0.24 0.00 -0.27 0.00 -1.26 0.00 0.00 59.98 58.69 1dv3 h ARG 136 Cb 0.00 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 28.34 1dv3 h ARG 136 CO -0.04 0.12 -1.05 0.00 0.56 0.00 0.00 179.97 179.56 1dv3 h ALA 137 N 1.88 0.13 -0.43 0.04 0.00 -1.39 -3.18 119.26 116.31 1dv3 h ALA 137 Ca -0.00 -0.70 -0.03 0.00 0.00 0.00 0.00 54.91 54.18 1dv3 h ALA 137 Cb 0.22 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1dv3 h ALA 137 CO 0.02 0.69 0.15 0.37 0.00 0.00 0.00 179.25 180.47 1dv3 h GLN 138 N 0.39 0.65 -0.00 0.00 4.15 -0.33 0.75 115.11 120.73 1dv3 h GLN 138 Ca -0.13 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 59.16 1dv3 h GLN 138 Cb 1.70 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 29.29 1dv3 h GLN 138 CO 0.21 0.62 0.00 0.00 -1.93 0.00 0.00 178.83 177.73 1dv3 h ALA 139 N 1.00 1.70 -0.33 3.38 0.00 -0.79 -0.87 119.26 123.34 1dv3 h ALA 139 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1dv3 h ALA 139 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1dv3 h ALA 139 CO -0.01 -0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.52 1dv3 n LEU 140 N -4.09 3.37 -0.12 0.00 4.77 -1.06 -1.20 117.00 118.66 1dv3 n LEU 140 Ca -0.03 -1.44 -0.02 0.00 -0.03 0.00 0.00 56.01 54.50 1dv3 n LEU 140 Cb 0.09 -0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 40.96 1dv3 n LEU 140 CO 0.30 0.71 -0.02 0.61 -1.33 0.00 0.00 177.39 177.66 1dv3 n GLY 141 N 1.44 0.46 3.89 -0.72 0.00 -0.33 -4.94 105.19 104.99 1dv3 n GLY 141 Ca 0.18 -0.15 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1dv3 n GLY 141 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1dv3 s MET 142 N -1.14 2.86 0.91 1.61 -1.94 0.20 -4.98 119.30 116.82 1dv3 s MET 142 Ca 0.00 0.37 -0.12 0.00 -1.71 0.00 0.00 55.69 54.23 1dv3 s MET 142 Cb 0.00 -2.07 0.14 0.00 2.01 0.00 0.00 34.83 34.91 1dv3 s MET 142 CO 0.00 -0.98 1.09 0.20 -0.01 0.00 0.00 175.02 175.32 1dv3 s GLY 143 N -4.35 1.61 -0.28 -0.03 0.00 -1.26 -4.43 107.32 98.58 1dv3 s GLY 143 Ca 0.57 -0.12 0.08 0.00 0.00 0.00 0.00 44.72 45.25 1dv3 s GLY 143 CO 0.50 0.39 1.63 0.28 0.00 0.00 0.00 173.10 175.91 1dv3 n LYS 144 N -3.92 3.18 0.02 2.90 4.76 -1.26 -4.60 118.16 119.23 1dv3 n LYS 144 Ca 0.07 -2.53 0.15 0.00 -2.87 0.00 0.00 58.31 53.13 1dv3 n LYS 144 Cb 0.56 -2.05 0.62 0.00 -1.84 0.00 0.00 35.03 32.31 1dv3 n LYS 144 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1dv3 h HIS 145 N 2.12 0.15 -0.16 2.13 3.86 -1.98 -2.15 115.15 119.11 1dv3 h HIS 145 Ca 0.25 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.30 1dv3 h HIS 145 Cb 2.11 -0.05 0.01 0.00 1.06 0.00 0.00 27.41 30.53 1dv3 h HIS 145 CO 1.09 0.07 -0.53 1.15 0.86 0.00 0.00 177.93 180.57 1dv3 h THR 146 N 0.14 1.32 -0.58 2.45 2.02 -1.93 -2.07 112.91 114.27 1dv3 h THR 146 Ca 0.22 -1.78 -0.06 0.00 0.77 0.00 0.00 66.41 65.55 1dv3 h THR 146 Cb 0.67 1.98 -0.02 0.00 -1.74 0.00 0.00 68.15 69.05 1dv3 h THR 146 CO -0.03 0.55 0.12 0.00 0.37 0.00 0.00 175.52 176.54 1dv3 h ALA 147 N 0.55 0.76 -0.37 6.16 0.00 -1.68 -1.24 119.26 123.44 1dv3 h ALA 147 Ca -0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 1dv3 h ALA 147 Cb 1.16 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1dv3 h ALA 147 CO 0.11 0.49 0.11 -1.49 0.00 0.00 0.00 179.25 178.47 1dv3 h TRP 148 N 0.84 0.59 -0.47 0.00 -0.00 -1.42 -1.85 115.95 113.64 1dv3 h TRP 148 Ca 0.18 -0.06 -0.06 0.00 -0.00 0.00 0.00 58.89 58.94 1dv3 h TRP 148 Cb 0.38 -0.17 -0.02 0.00 -0.00 0.00 0.00 29.16 29.34 1dv3 h TRP 148 CO 0.03 0.57 0.03 0.00 -0.00 0.00 0.00 178.44 179.06 1dv3 h ALA 149 N 0.96 1.17 -0.25 1.49 0.00 -1.27 -2.31 119.26 119.05 1dv3 h ALA 149 Ca 0.12 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1dv3 h ALA 149 Cb 0.26 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1dv3 h ALA 149 CO -0.00 0.54 -0.10 0.35 0.00 0.00 0.00 179.25 180.04 1dv3 h PHE 150 N 0.71 0.42 -0.79 0.00 3.57 -0.91 -2.50 116.94 117.44 1dv3 h PHE 150 Ca 0.14 -0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.61 1dv3 h PHE 150 Cb 0.40 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 1dv3 h PHE 150 CO 0.02 0.49 0.52 -0.07 -2.23 0.00 0.00 178.31 177.05 1dv3 h LEU 151 N 0.38 0.89 -1.06 0.59 3.38 -0.75 -0.76 115.31 117.98 1dv3 h LEU 151 Ca 0.08 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.04 1dv3 h LEU 151 Cb 0.41 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 1dv3 h LEU 151 CO 0.02 0.64 0.64 -1.28 0.09 0.00 0.00 178.44 178.55 1dv3 h SER 152 N 1.05 1.11 -0.12 -0.43 0.87 -1.42 0.20 113.55 114.80 1dv3 h SER 152 Ca 0.29 -0.03 -0.18 0.00 -1.23 0.00 0.00 61.79 60.65 1dv3 h SER 152 Cb -0.09 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 61.60 1dv3 h SER 152 CO -0.07 0.80 -0.58 0.00 -0.53 0.00 0.00 176.83 176.45 1dv3 h ALA 153 N 1.40 0.55 -0.71 6.23 0.00 -1.40 -2.96 119.26 122.37 1dv3 h ALA 153 Ca 0.35 -0.53 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1dv3 h ALA 153 Cb -0.15 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1dv3 h ALA 153 CO -0.08 0.69 0.36 0.82 0.00 0.00 0.00 179.25 181.04 1dv3 h ILE 154 N 0.54 1.22 -0.26 0.00 2.04 -0.38 -2.93 117.51 117.74 1dv3 h ILE 154 Ca 0.00 -0.60 0.06 0.00 1.00 0.00 0.00 64.86 65.33 1dv3 h ILE 154 Cb 1.17 0.30 -0.06 0.00 -0.74 0.00 0.00 36.82 37.48 1dv3 h ILE 154 CO 0.12 0.26 -0.16 -0.25 0.00 0.00 0.00 178.15 178.12 1dv3 h TRP 155 N 1.00 -0.40 -0.41 1.37 2.91 -0.46 0.41 115.95 120.36 1dv3 h TRP 155 Ca 0.25 0.03 -0.00 0.00 1.13 0.00 0.00 58.89 60.30 1dv3 h TRP 155 Cb 0.08 0.22 -0.02 0.00 -0.51 0.00 0.00 29.16 28.92 1dv3 h TRP 155 CO 0.01 -0.23 0.24 1.25 -1.03 0.00 0.00 178.44 178.68 1dv3 h LEU 156 N -0.14 0.50 -0.37 0.65 6.46 -1.52 -0.76 115.31 120.12 1dv3 h LEU 156 Ca 0.14 -0.06 0.02 0.00 -0.12 0.00 0.00 57.88 57.86 1dv3 h LEU 156 Cb 0.35 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 40.13 1dv3 h LEU 156 CO -0.34 0.41 0.21 -0.25 -0.62 0.00 0.00 178.44 177.85 1dv3 h TRP 157 N 0.54 0.39 -0.54 1.25 7.01 -1.28 -1.16 115.95 122.16 1dv3 h TRP 157 Ca 0.15 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.16 1dv3 h TRP 157 Cb 0.01 -0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 26.92 1dv3 h TRP 157 CO -0.03 0.23 0.34 0.52 -2.79 0.00 0.00 178.44 176.70 1dv3 h MET 158 N 0.43 0.73 -0.50 2.65 2.86 0.14 -2.12 114.93 119.12 1dv3 h MET 158 Ca 0.15 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.71 1dv3 h MET 158 Cb 0.02 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.50 1dv3 h MET 158 CO -0.08 0.51 0.24 0.28 1.06 0.00 0.00 176.91 178.93 1dv3 h VAL 159 N 0.73 1.19 -0.25 -2.22 2.07 -0.87 -0.07 116.25 116.83 1dv3 h VAL 159 Ca 0.20 -0.53 -0.03 0.00 0.82 0.00 0.00 66.70 67.15 1dv3 h VAL 159 Cb -0.03 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1dv3 h VAL 159 CO -0.04 0.21 0.02 -0.07 0.02 0.00 0.00 177.57 177.72 1dv3 h LEU 160 N 0.66 0.41 -1.23 2.57 3.38 -1.02 -1.91 115.31 118.17 1dv3 h LEU 160 Ca 0.17 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1dv3 h LEU 160 Cb 0.11 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1dv3 h LEU 160 CO -0.02 0.59 -0.20 0.61 0.09 0.00 0.00 178.44 179.51 1dv3 n GLY 161 N -0.40 0.12 1.83 0.83 0.00 -0.81 -4.30 105.19 102.46 1dv3 n GLY 161 Ca -0.03 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1dv3 n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1dv3 n PHE 162 N 0.36 -0.47 -0.06 1.61 3.72 -0.26 -4.83 117.46 117.53 1dv3 n PHE 162 Ca 0.08 0.08 -0.07 0.00 -0.05 0.00 0.00 57.45 57.49 1dv3 n PHE 162 Cb 0.39 0.43 -0.01 0.00 -0.94 0.00 0.00 39.48 39.35 1dv3 n PHE 162 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 1dv3 h ILE 163 N 0.00 0.77 -0.20 4.37 2.04 -1.23 -0.97 117.51 122.29 1dv3 h ILE 163 Ca 0.00 -0.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.81 1dv3 h ILE 163 Cb 0.00 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 1dv3 h ILE 163 CO 0.00 0.00 -0.05 -0.09 0.00 0.00 0.00 178.15 178.02 1dv3 h ARG 164 N 0.03 0.39 -0.80 2.37 2.43 -1.55 -1.71 114.38 115.53 1dv3 h ARG 164 Ca 0.12 -0.15 0.07 0.00 -0.81 0.00 0.00 59.98 59.22 1dv3 h ARG 164 Cb 0.18 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.64 1dv3 h ARG 164 CO -0.25 0.64 0.47 -1.35 -1.51 0.00 0.00 179.97 177.98 1dv3 h PRO 165 N 0.12 0.82 -0.41 0.20 0.11 -1.72 0.90 132.00 132.02 1dv3 h PRO 165 Ca 0.05 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 1dv3 h PRO 165 Cb 0.50 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.40 1dv3 h PRO 165 CO 0.02 0.54 0.17 0.82 -0.21 0.00 0.00 178.00 179.34 1dv3 h ILE 166 N 0.84 1.19 0.00 4.15 2.04 -1.08 -0.69 117.51 123.97 1dv3 h ILE 166 Ca 0.37 -0.59 -0.08 0.00 1.00 0.00 0.00 64.86 65.55 1dv3 h ILE 166 Cb 0.24 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1dv3 h ILE 166 CO -0.20 0.22 -0.37 -0.07 0.00 0.00 0.00 178.15 177.73 1dv3 h LEU 167 N 0.52 0.00 -0.22 1.44 3.38 -0.66 -2.14 115.31 117.64 1dv3 h LEU 167 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1dv3 h LEU 167 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1dv3 h LEU 167 CO -0.01 0.37 0.00 0.24 0.09 0.00 0.00 178.44 179.12 1dv3 h MET 168 N 0.00 0.00 0.00 1.13 2.86 -0.47 -3.48 114.93 114.98 1dv3 h MET 168 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1dv3 h MET 168 Cb 0.66 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.32 1dv3 h MET 168 CO 0.05 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.43 1dv3 n GLY 169 N 0.96 0.70 3.59 8.32 0.00 -0.34 -5.07 105.19 113.35 1dv3 n GLY 169 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 1dv3 n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dv3 s SER 170 N -2.67 -0.69 0.58 1.61 1.04 -0.75 -3.61 113.70 109.22 1dv3 s SER 170 Ca 0.00 1.10 0.33 0.00 0.48 0.00 0.00 55.95 57.86 1dv3 s SER 170 Cb 0.00 1.04 1.80 0.00 0.10 0.00 0.00 66.02 68.96 1dv3 s SER 170 CO 0.00 -0.39 2.20 -0.50 0.98 0.00 0.00 173.24 175.53 1dv3 h TRP 171 N 4.10 0.00 0.00 5.02 -0.00 -1.56 -2.49 115.95 121.02 1dv3 h TRP 171 Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.61 1dv3 h TRP 171 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.31 1dv3 h TRP 171 CO 0.38 0.04 0.00 -1.13 -0.00 0.00 0.00 178.44 177.73 1dv3 n SER 172 N -3.55 0.55 0.08 -3.49 3.41 -1.20 -1.04 113.62 108.39 1dv3 n SER 172 Ca -0.02 0.75 0.13 0.00 -0.26 0.00 0.00 58.87 59.47 1dv3 n SER 172 Cb 0.15 -0.83 0.40 0.00 -0.26 0.00 0.00 64.21 63.68 1dv3 n SER 172 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1dv3 n GLU 173 N -2.24 0.23 -1.69 4.33 -0.58 -0.94 -4.89 120.64 114.85 1dv3 n GLU 173 Ca -0.01 0.17 -0.29 0.00 -0.42 0.00 0.00 57.16 56.60 1dv3 n GLU 173 Cb 0.04 -1.74 0.15 0.00 -0.57 0.00 0.00 31.44 29.32 1dv3 n GLU 173 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1dv3 s ALA 174 N -3.09 1.99 -0.01 0.62 0.00 -0.21 -4.86 121.76 116.20 1dv3 s ALA 174 Ca 0.11 -0.82 -0.19 0.00 0.00 0.00 0.00 51.96 51.05 1dv3 s ALA 174 Cb 0.13 -2.92 -0.05 0.00 0.00 0.00 0.00 23.12 20.28 1dv3 s ALA 174 CO 0.60 -2.34 0.55 0.08 0.00 0.00 0.00 175.76 174.65 1dv3 s VAL 175 N -3.51 4.95 0.59 0.00 1.01 -1.26 -4.90 120.40 117.27 1dv3 s VAL 175 Ca 0.67 1.15 -0.13 0.00 0.00 0.00 0.00 61.98 63.67 1dv3 s VAL 175 Cb -0.10 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.35 1dv3 s VAL 175 CO 0.52 0.44 1.02 -2.16 0.00 0.00 0.00 175.10 174.92 1dv3 s PRO 176 N -0.27 3.62 -0.61 2.72 0.04 -1.26 -4.86 135.00 134.39 1dv3 s PRO 176 Ca 0.29 0.87 -0.20 0.00 0.04 0.00 0.00 61.00 62.00 1dv3 s PRO 176 Cb -0.18 -2.09 0.09 0.00 0.04 0.00 0.00 34.50 32.37 1dv3 s PRO 176 CO 0.16 -0.54 0.80 0.71 0.04 0.00 0.00 177.00 178.17 1dv3 s TYR 177 N -2.93 2.87 -0.26 0.56 2.02 -0.46 -4.46 117.35 114.69 1dv3 s TYR 177 Ca 0.57 -0.78 -0.27 0.00 -0.37 0.00 0.00 57.07 56.22 1dv3 s TYR 177 Cb -0.11 -4.11 0.16 0.00 -0.40 0.00 0.00 41.96 37.50 1dv3 s TYR 177 CO 0.45 -1.42 1.21 0.20 -1.57 0.00 0.00 175.55 174.42 1dv3 s GLY 178 N 3.61 0.01 0.05 0.71 0.00 -1.26 -1.27 107.32 109.16 1dv3 s GLY 178 Ca 0.16 2.78 -0.27 0.00 0.00 0.00 0.00 44.72 47.38 1dv3 s GLY 178 CO 0.08 1.50 1.41 -2.22 0.00 0.00 0.00 173.10 173.88 1dv3 h ILE 179 N 2.86 0.00 0.08 0.90 1.08 -1.77 -2.39 117.51 118.28 1dv3 h ILE 179 Ca -0.21 0.00 -0.26 0.00 -0.39 0.00 0.00 64.86 64.00 1dv3 h ILE 179 Cb 1.18 0.00 0.01 0.00 -3.07 0.00 0.00 36.82 34.94 1dv3 h ILE 179 CO 0.20 0.00 -1.14 -0.26 -0.69 0.00 0.00 178.15 176.26 1dv3 h PHE 180 N -0.95 0.65 -0.93 1.37 0.04 -1.70 -3.32 116.94 112.11 1dv3 h PHE 180 Ca -0.09 -0.42 0.05 0.00 2.80 0.00 0.00 57.97 60.31 1dv3 h PHE 180 Cb 0.74 -0.05 -0.06 0.00 2.20 0.00 0.00 35.95 38.78 1dv3 h PHE 180 CO 0.00 1.28 0.60 0.66 -0.60 0.00 0.00 178.31 180.25 1dv3 h SER 181 N 0.17 0.98 1.02 2.17 4.64 -1.78 -0.50 113.55 120.25 1dv3 h SER 181 Ca -0.13 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 1dv3 h SER 181 Cb 1.82 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 63.70 1dv3 h SER 181 CO 0.20 0.66 0.00 1.12 -0.87 0.00 0.00 176.83 177.93 1dv3 h HIS 182 N 1.14 0.00 0.10 4.77 2.07 -1.53 -0.74 115.15 120.95 1dv3 h HIS 182 Ca 0.38 0.00 -0.20 0.00 -2.85 0.00 0.00 60.37 57.70 1dv3 h HIS 182 Cb 0.07 0.00 0.02 0.00 2.57 0.00 0.00 27.41 30.07 1dv3 h HIS 182 CO -0.01 0.00 -0.86 -0.07 -3.07 0.00 0.00 177.93 173.92 1dv3 h LEU 183 N 0.00 0.59 -0.92 6.12 3.38 -1.23 -2.54 115.31 120.70 1dv3 h LEU 183 Ca 0.00 -0.86 0.03 0.00 0.09 0.00 0.00 57.88 57.14 1dv3 h LEU 183 Cb 0.51 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 1dv3 h LEU 183 CO 0.00 1.39 0.60 0.44 0.09 0.00 0.00 178.44 180.96 1dv3 h ASP 184 N -0.14 1.00 -0.72 -0.43 3.32 -0.74 -1.16 116.42 117.56 1dv3 h ASP 184 Ca -0.13 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 1dv3 h ASP 184 Cb 1.61 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.89 1dv3 h ASP 184 CO 0.16 0.69 0.41 -0.25 -1.72 0.00 0.00 179.24 178.54 1dv3 h TRP 185 N 1.17 0.97 -0.34 4.55 7.01 -1.16 0.58 115.95 128.73 1dv3 h TRP 185 Ca 0.36 -0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.31 1dv3 h TRP 185 Cb -0.02 -0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 26.72 1dv3 h TRP 185 CO -0.01 0.67 0.07 1.15 -2.79 0.00 0.00 178.44 177.53 1dv3 h THR 186 N 0.98 1.23 -0.18 2.65 2.02 -0.91 0.31 112.91 119.01 1dv3 h THR 186 Ca 0.26 -0.78 -0.01 0.00 0.77 0.00 0.00 66.41 66.65 1dv3 h THR 186 Cb 0.00 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 1dv3 h THR 186 CO -0.04 0.26 0.08 -1.13 0.37 0.00 0.00 175.52 175.06 1dv3 h ASN 187 N 0.40 0.24 -0.82 4.18 -1.24 -0.97 -2.85 115.58 114.52 1dv3 h ASN 187 Ca 0.11 -0.14 0.01 0.00 0.71 0.00 0.00 56.30 56.98 1dv3 h ASN 187 Cb 0.32 -0.06 -0.04 0.00 0.73 0.00 0.00 38.32 39.27 1dv3 h ASN 187 CO 0.00 0.31 0.53 -1.13 -1.29 0.00 0.00 177.43 175.86 1dv3 h ASN 188 N 0.15 0.94 -0.97 1.15 -1.24 -0.74 -2.18 115.58 112.69 1dv3 h ASN 188 Ca 0.06 -0.03 0.04 0.00 0.71 0.00 0.00 56.30 57.08 1dv3 h ASN 188 Cb 0.14 -0.24 -0.06 0.00 0.73 0.00 0.00 38.32 38.90 1dv3 h ASN 188 CO -0.01 0.69 0.64 0.15 -1.29 0.00 0.00 177.43 177.61 1dv3 h PHE 189 N 1.11 1.19 -0.20 0.67 3.04 -0.71 0.74 116.94 122.78 1dv3 h PHE 189 Ca 0.30 0.03 -0.09 0.00 3.98 0.00 0.00 57.97 62.19 1dv3 h PHE 189 Cb -0.12 -0.40 -0.00 0.00 2.56 0.00 0.00 35.95 37.99 1dv3 h PHE 189 CO 0.00 0.68 -0.21 1.03 -2.02 0.00 0.00 178.31 177.79 1dv3 h SER 190 N 1.22 0.53 0.11 0.41 0.87 -1.23 -2.62 113.55 112.83 1dv3 h SER 190 Ca 0.39 -0.49 0.02 0.00 -1.23 0.00 0.00 61.79 60.48 1dv3 h SER 190 Cb 0.02 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 61.80 1dv3 h SER 190 CO -0.12 0.91 -0.25 -0.07 -0.53 0.00 0.00 176.83 176.76 1dv3 h LEU 191 N 0.16 -0.72 -2.41 2.23 4.07 -0.82 -0.35 115.31 117.46 1dv3 h LEU 191 Ca 0.03 0.09 -0.01 0.00 0.08 0.00 0.00 57.88 58.07 1dv3 h LEU 191 Cb 0.77 0.28 -0.00 0.00 1.08 0.00 0.00 40.66 42.78 1dv3 h LEU 191 CO 0.05 -0.34 -0.03 0.58 -1.08 0.00 0.00 178.44 177.62 1dv3 h VAL 192 N -0.45 0.42 -0.49 1.22 2.07 -0.91 -2.80 116.25 115.32 1dv3 h VAL 192 Ca 0.03 -0.14 -0.15 0.00 0.82 0.00 0.00 66.70 67.27 1dv3 h VAL 192 Cb 0.48 1.09 -0.09 0.00 -1.52 0.00 0.00 31.29 31.26 1dv3 h VAL 192 CO -0.15 0.03 0.10 1.41 0.02 0.00 0.00 177.57 178.98 1dv3 n HIS 193 N -3.64 1.61 -3.23 1.57 8.25 -0.93 -4.86 115.22 114.00 1dv3 n HIS 193 Ca -0.03 -1.23 -0.16 0.00 -0.26 0.00 0.00 57.72 56.04 1dv3 n HIS 193 Cb 0.12 -0.52 0.05 0.00 1.12 0.00 0.00 29.99 30.76 1dv3 n HIS 193 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1dv3 n GLY 194 N -0.59 -0.07 1.57 -1.41 0.00 -1.06 -1.51 105.19 102.12 1dv3 n GLY 194 Ca 0.33 -0.04 -0.01 0.00 0.00 0.00 0.00 46.02 46.30 1dv3 n GLY 194 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1dv3 n ASN 195 N -1.63 -3.20 0.27 1.61 2.85 -0.19 -3.14 115.26 111.83 1dv3 n ASN 195 Ca -0.01 0.50 0.18 0.00 -0.11 0.00 0.00 54.58 55.15 1dv3 n ASN 195 Cb 0.55 -2.28 0.90 0.00 1.24 0.00 0.00 39.78 40.19 1dv3 n ASN 195 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1dv3 h LEU 196 N 1.27 0.00 -2.71 1.20 3.38 -1.84 -2.22 115.31 114.39 1dv3 h LEU 196 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1dv3 h LEU 196 Cb 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1dv3 h LEU 196 CO 0.00 0.00 0.08 -0.26 0.09 0.00 0.00 178.44 178.35 1dv3 h PHE 197 N 0.00 0.00 -0.01 1.13 0.04 -1.96 0.31 116.94 116.45 1dv3 h PHE 197 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1dv3 h PHE 197 Cb 0.18 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.33 1dv3 h PHE 197 CO 0.00 0.00 -0.16 0.66 -0.60 0.00 0.00 178.31 178.21 1dv3 n TYR 198 N -3.15 0.00 -2.80 -0.55 4.01 -0.83 -4.77 117.16 109.06 1dv3 n TYR 198 Ca -0.02 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.29 1dv3 n TYR 198 Cb 0.15 -0.07 -0.03 0.00 -0.31 0.00 0.00 39.34 39.08 1dv3 n TYR 198 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1dv3 s ASN 199 N -2.30 6.85 0.29 7.72 3.84 0.11 -4.77 114.94 126.68 1dv3 s ASN 199 Ca 0.29 0.98 -0.00 0.00 0.21 0.00 0.00 52.86 54.34 1dv3 s ASN 199 Cb 0.20 -2.47 0.48 0.00 -0.55 0.00 0.00 41.25 38.91 1dv3 s ASN 199 CO 0.45 -0.67 1.91 1.55 -2.79 0.00 0.00 177.10 177.55 1dv3 h PRO 200 N 7.89 1.05 0.00 0.43 0.13 -1.86 -1.78 132.00 137.85 1dv3 h PRO 200 Ca -0.22 -0.06 -0.04 0.00 -0.87 0.00 0.00 66.00 64.81 1dv3 h PRO 200 Cb 1.08 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 31.97 1dv3 h PRO 200 CO 0.94 0.70 -0.19 0.74 -0.23 0.00 0.00 178.00 179.95 1dv3 h PHE 201 N 1.08 0.00 -0.16 1.56 0.04 -1.91 -1.93 116.94 115.63 1dv3 h PHE 201 Ca 0.40 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.95 1dv3 h PHE 201 Cb 0.16 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.32 1dv3 h PHE 201 CO -0.00 0.19 -0.76 1.25 -0.60 0.00 0.00 178.31 178.39 1dv3 h HIS 202 N 0.00 1.03 -0.53 -0.55 2.76 -1.61 -1.56 115.15 114.68 1dv3 h HIS 202 Ca -0.00 -0.45 -0.08 0.00 -2.20 0.00 0.00 60.37 57.64 1dv3 h HIS 202 Cb 0.66 -0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.43 1dv3 h HIS 202 CO 0.00 1.27 -0.01 0.78 -1.30 0.00 0.00 177.93 178.67 1dv3 h GLY 203 N 0.64 0.97 0.88 5.26 0.00 -1.09 -1.74 103.07 107.99 1dv3 h GLY 203 Ca -0.05 -0.68 -0.04 0.00 0.00 0.00 0.00 47.33 46.56 1dv3 h GLY 203 CO 0.16 0.63 0.03 1.41 0.00 0.00 0.00 176.54 178.76 1dv3 h LEU 204 N 0.83 0.47 -1.16 3.11 3.38 -1.32 -1.86 115.31 118.76 1dv3 h LEU 204 Ca 0.15 -0.28 0.11 0.00 0.09 0.00 0.00 57.88 57.95 1dv3 h LEU 204 Cb 0.51 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 41.06 1dv3 h LEU 204 CO 0.03 0.63 0.59 -1.28 0.09 0.00 0.00 178.44 178.51 1dv3 h SER 205 N 0.29 0.82 -0.44 -0.43 0.87 -1.01 -0.46 113.55 113.19 1dv3 h SER 205 Ca 0.08 0.03 -0.13 0.00 -1.23 0.00 0.00 61.79 60.54 1dv3 h SER 205 Cb 0.38 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.19 1dv3 h SER 205 CO 0.01 0.46 -0.24 0.40 -0.53 0.00 0.00 176.83 176.93 1dv3 h ILE 206 N 0.89 1.27 -0.89 2.23 2.04 -1.08 -0.83 117.51 121.15 1dv3 h ILE 206 Ca 0.45 -1.40 0.03 0.00 1.00 0.00 0.00 64.86 64.93 1dv3 h ILE 206 Cb 0.48 1.21 -0.05 0.00 -0.74 0.00 0.00 36.82 37.73 1dv3 h ILE 206 CO -0.21 0.48 0.59 0.00 0.00 0.00 0.00 178.15 179.01 1dv3 h ALA 207 N 0.84 1.42 0.00 1.87 0.00 -0.28 0.54 119.26 123.64 1dv3 h ALA 207 Ca 0.10 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.78 1dv3 h ALA 207 Cb 0.82 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1dv3 h ALA 207 CO 0.07 0.51 -0.86 0.74 0.00 0.00 0.00 179.25 179.71 1dv3 h PHE 208 N 1.14 0.00 -0.09 0.00 0.04 -1.05 0.20 116.94 117.18 1dv3 h PHE 208 Ca 0.35 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.08 1dv3 h PHE 208 Cb -0.03 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.12 1dv3 h PHE 208 CO -0.00 0.86 -0.08 1.25 -0.60 0.00 0.00 178.31 179.74 1dv3 h LEU 209 N 0.00 0.23 -0.27 1.54 5.85 -0.58 0.76 115.31 122.83 1dv3 h LEU 209 Ca -0.01 -0.47 -0.01 0.00 0.84 0.00 0.00 57.88 58.23 1dv3 h LEU 209 Cb 1.56 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.52 1dv3 h LEU 209 CO 0.11 0.65 0.12 1.88 -0.34 0.00 0.00 178.44 180.87 1dv3 h TYR 210 N -0.20 0.39 0.00 1.25 0.05 -0.94 -2.74 116.97 114.78 1dv3 h TYR 210 Ca 0.02 -0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.77 1dv3 h TYR 210 Cb 0.59 -0.12 -0.00 0.00 1.01 0.00 0.00 36.73 38.21 1dv3 h TYR 210 CO 0.09 0.37 -0.00 0.78 -1.05 0.00 0.00 178.16 178.35 1dv3 h GLY 211 N 0.29 0.00 1.31 3.88 0.00 -0.49 -0.37 103.07 107.69 1dv3 h GLY 211 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.22 1dv3 h GLY 211 CO -0.01 0.00 -0.69 1.76 0.00 0.00 0.00 176.54 177.60 1dv3 h SER 212 N 0.00 0.80 0.15 0.19 0.02 -0.54 0.15 113.55 114.32 1dv3 h SER 212 Ca -0.00 -0.49 -0.15 0.00 -0.84 0.00 0.00 61.79 60.31 1dv3 h SER 212 Cb 0.00 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 1dv3 h SER 212 CO 0.00 1.27 -0.54 0.00 -1.14 0.00 0.00 176.83 176.42 1dv3 h ALA 213 N 0.73 0.80 0.05 3.77 0.00 -1.23 -0.58 119.26 122.80 1dv3 h ALA 213 Ca -0.03 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.38 1dv3 h ALA 213 Cb 1.29 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1dv3 h ALA 213 CO 0.14 0.69 -0.03 1.25 0.00 0.00 0.00 179.25 181.30 1dv3 h LEU 214 N 0.33 -0.06 -0.56 0.00 5.85 -0.92 -2.09 115.31 117.86 1dv3 h LEU 214 Ca 0.01 -0.25 -0.12 0.00 0.84 0.00 0.00 57.88 58.35 1dv3 h LEU 214 Cb 1.05 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1dv3 h LEU 214 CO 0.09 0.22 -0.19 0.25 -0.34 0.00 0.00 178.44 178.47 1dv3 h LEU 215 N -0.35 0.97 -0.59 2.25 5.85 -0.64 -1.91 115.31 120.89 1dv3 h LEU 215 Ca -0.01 -0.35 -0.15 0.00 0.84 0.00 0.00 57.88 58.20 1dv3 h LEU 215 Cb 0.31 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 1dv3 h LEU 215 CO 0.01 1.13 -0.61 0.15 -0.34 0.00 0.00 178.44 178.79 1dv3 h PHE 216 N 0.83 0.43 -0.52 1.25 3.04 -1.16 0.35 116.94 121.15 1dv3 h PHE 216 Ca 0.11 -0.16 -0.03 0.00 3.98 0.00 0.00 57.97 61.87 1dv3 h PHE 216 Cb 0.76 -0.08 -0.02 0.00 2.56 0.00 0.00 35.95 39.17 1dv3 h PHE 216 CO 0.05 0.85 0.21 0.00 -2.02 0.00 0.00 178.31 177.40 1dv3 h ALA 217 N 1.11 0.68 0.46 2.41 0.00 -1.29 0.33 119.26 122.96 1dv3 h ALA 217 Ca -0.01 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1dv3 h ALA 217 Cb 1.13 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1dv3 h ALA 217 CO 0.10 0.29 -0.22 0.52 0.00 0.00 0.00 179.25 179.94 1dv3 h MET 218 N 0.71 -0.60 -0.20 0.00 2.86 -0.99 -1.37 114.93 115.35 1dv3 h MET 218 Ca 0.18 0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.82 1dv3 h MET 218 Cb 0.19 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 1dv3 h MET 218 CO -0.01 -0.36 -0.01 1.25 1.06 0.00 0.00 176.91 178.83 1dv3 h HIS 219 N -0.69 0.39 -0.73 -0.22 -0.00 -0.22 -1.12 115.15 112.55 1dv3 h HIS 219 Ca -0.06 -0.07 0.03 0.00 -0.00 0.00 0.00 60.37 60.27 1dv3 h HIS 219 Cb 0.51 -0.10 -0.05 0.00 -0.00 0.00 0.00 27.41 27.78 1dv3 h HIS 219 CO -0.03 0.56 0.46 0.78 -0.00 0.00 0.00 177.93 179.70 1dv3 h GLY 220 N 0.10 1.06 1.61 5.26 0.00 -0.39 -1.48 103.07 109.23 1dv3 h GLY 220 Ca 0.05 -0.35 -0.11 0.00 0.00 0.00 0.00 47.33 46.92 1dv3 h GLY 220 CO 0.01 0.29 -0.36 0.00 0.00 0.00 0.00 176.54 176.48 1dv3 h ALA 221 N 1.32 1.00 0.14 3.60 0.00 -1.18 -2.64 119.26 121.50 1dv3 h ALA 221 Ca 0.30 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1dv3 h ALA 221 Cb 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1dv3 h ALA 221 CO -0.12 0.60 -0.07 1.15 0.00 0.00 0.00 179.25 180.82 1dv3 h THR 222 N 0.37 1.00 -0.59 0.00 2.02 -0.64 -1.04 112.91 114.02 1dv3 h THR 222 Ca 0.04 -0.58 0.05 0.00 0.77 0.00 0.00 66.41 66.69 1dv3 h THR 222 Cb 0.81 1.35 -0.05 0.00 -1.74 0.00 0.00 68.15 68.53 1dv3 h THR 222 CO 0.07 0.14 0.32 0.40 0.37 0.00 0.00 175.52 176.81 1dv3 h ILE 223 N -0.46 0.97 -0.14 3.11 1.08 -1.29 -0.52 117.51 120.27 1dv3 h ILE 223 Ca -0.02 -0.21 -0.05 0.00 -0.39 0.00 0.00 64.86 64.19 1dv3 h ILE 223 Cb 0.36 0.31 -0.01 0.00 -3.07 0.00 0.00 36.82 34.41 1dv3 h ILE 223 CO 0.03 0.11 -0.15 -0.07 -0.69 0.00 0.00 178.15 177.38 1dv3 h LEU 224 N 0.61 0.21 -1.05 1.44 3.38 -1.43 -0.10 115.31 118.36 1dv3 h LEU 224 Ca 0.26 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.12 1dv3 h LEU 224 Cb 0.14 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1dv3 h LEU 224 CO -0.16 0.39 -0.32 0.00 0.09 0.00 0.00 178.44 178.44 1dv3 h ALA 225 N 1.64 1.03 -0.19 1.53 0.00 0.24 -2.95 119.26 120.57 1dv3 h ALA 225 Ca 0.04 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1dv3 h ALA 225 Cb 0.40 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1dv3 h ALA 225 CO 0.02 0.39 -0.01 1.33 0.00 0.00 0.00 179.25 180.99 1dv3 n VAL 226 N -3.52 2.19 0.45 0.00 0.24 -0.53 -4.55 118.33 112.61 1dv3 n VAL 226 Ca -0.00 -2.06 0.13 0.00 -2.04 0.00 0.00 64.34 60.36 1dv3 n VAL 226 Cb 0.47 -0.26 0.47 0.00 -1.47 0.00 0.00 33.84 33.05 1dv3 n VAL 226 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1dv3 h SER 227 N 1.22 0.00 0.46 -1.34 4.64 -0.85 -1.16 113.55 116.53 1dv3 h SER 227 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1dv3 h SER 227 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1dv3 h SER 227 CO 0.17 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 174.02 1dv3 n ARG 228 N -2.37 0.16 -0.10 4.77 1.85 -1.26 -1.70 116.66 118.01 1dv3 n ARG 228 Ca 0.03 0.14 0.09 0.00 -1.00 0.00 0.00 57.85 57.11 1dv3 n ARG 228 Cb 0.31 -1.50 0.13 0.00 -1.05 0.00 0.00 32.46 30.35 1dv3 n ARG 228 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1dv3 n PHE 229 N -1.37 0.00 -1.66 2.89 3.72 -0.63 -4.96 117.46 115.45 1dv3 n PHE 229 Ca 0.07 -0.91 -0.07 0.00 -0.05 0.00 0.00 57.45 56.49 1dv3 n PHE 229 Cb 0.18 -0.14 -0.02 0.00 -0.94 0.00 0.00 39.48 38.56 1dv3 n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1dv3 n GLY 230 N -1.31 0.51 0.35 1.37 0.00 -0.69 -4.50 105.19 100.92 1dv3 n GLY 230 Ca 0.14 -0.66 0.17 0.00 0.00 0.00 0.00 46.02 45.67 1dv3 n GLY 230 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1dv3 h GLY 231 N 0.00 1.84 2.00 -0.02 0.00 -1.41 -2.40 103.07 103.08 1dv3 h GLY 231 Ca -0.15 -0.32 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1dv3 h GLY 231 CO 0.20 -0.19 0.00 1.05 0.00 0.00 0.00 176.54 177.61 1dv3 h GLU 232 N 0.62 0.00 -3.12 4.80 9.09 -1.84 -3.25 114.58 120.89 1dv3 h GLU 232 Ca 0.62 0.00 -0.68 0.00 0.05 0.00 0.00 59.36 59.35 1dv3 h GLU 232 Cb 1.15 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.26 1dv3 h GLU 232 CO -0.44 0.00 3.62 0.54 0.05 0.00 0.00 179.01 182.78 1dv3 n ARG 233 N -2.33 3.66 -0.33 1.06 1.74 -0.90 -4.68 116.66 114.88 1dv3 n ARG 233 Ca 0.01 -2.38 0.04 0.00 -0.77 0.00 0.00 57.85 54.75 1dv3 n ARG 233 Cb 0.18 -2.86 0.23 0.00 -1.02 0.00 0.00 32.46 28.99 1dv3 n ARG 233 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1dv3 h GLU 234 N 5.12 1.02 -0.63 5.56 5.08 -1.83 -2.22 114.58 126.68 1dv3 h GLU 234 Ca 0.81 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 59.13 1dv3 h GLU 234 Cb 0.34 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 29.32 1dv3 h GLU 234 CO 1.78 0.67 0.41 -0.07 -1.00 0.00 0.00 179.01 180.80 1dv3 h LEU 235 N 1.05 0.68 -0.51 1.33 3.38 -1.93 -0.68 115.31 118.64 1dv3 h LEU 235 Ca 0.42 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 58.22 1dv3 h LEU 235 Cb 0.26 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1dv3 h LEU 235 CO -0.17 0.49 -0.74 -0.08 0.09 0.00 0.00 178.44 178.02 1dv3 h GLU 236 N 0.81 0.04 0.00 1.13 4.57 -1.90 -2.33 114.58 116.91 1dv3 h GLU 236 Ca 0.24 -0.04 -0.04 0.00 -1.18 0.00 0.00 59.36 58.34 1dv3 h GLU 236 Cb -0.04 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 1dv3 h GLU 236 CO -0.08 0.76 -0.21 1.96 -1.18 0.00 0.00 179.01 180.27 1dv3 h GLN 237 N 0.03 0.00 -0.01 1.92 1.08 -0.90 0.32 115.11 117.54 1dv3 h GLN 237 Ca -0.01 0.00 -0.11 0.00 -1.45 0.00 0.00 58.65 57.07 1dv3 h GLN 237 Cb 1.31 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.75 1dv3 h GLN 237 CO 0.10 0.21 -0.43 0.82 -0.95 0.00 0.00 178.83 178.58 1dv3 h ILE 238 N 0.00 1.47 0.00 2.54 2.04 -0.74 -2.56 117.51 120.26 1dv3 h ILE 238 Ca -0.00 -1.98 -0.13 0.00 1.00 0.00 0.00 64.86 63.76 1dv3 h ILE 238 Cb 0.46 2.61 -0.02 0.00 -0.74 0.00 0.00 36.82 39.13 1dv3 h ILE 238 CO 0.03 0.56 -0.60 0.00 0.00 0.00 0.00 178.15 178.14 1dv3 h ALA 239 N 0.32 0.96 -1.78 1.87 0.00 -1.04 -3.39 119.26 116.19 1dv3 h ALA 239 Ca -0.05 -0.55 -0.39 0.00 0.00 0.00 0.00 54.91 53.92 1dv3 h ALA 239 Cb 1.15 -0.10 -0.29 0.00 0.00 0.00 0.00 17.79 18.56 1dv3 h ALA 239 CO 0.09 0.75 -0.75 0.34 0.00 0.00 0.00 179.25 179.68 1dv3 s ASP 240 N -6.80 0.28 0.07 0.00 2.15 0.11 -5.09 116.67 107.38 1dv3 s ASP 240 Ca -0.01 -2.34 -0.36 0.00 0.43 0.00 0.00 52.55 50.27 1dv3 s ASP 240 Cb 0.12 0.60 -0.19 0.00 -0.30 0.00 0.00 42.92 43.15 1dv3 s ASP 240 CO 0.76 -0.14 0.90 -1.14 -0.17 0.00 0.00 175.17 175.38 1dv3 n ARG 241 N 3.09 0.05 -4.70 4.34 0.63 -0.96 -4.48 116.66 114.63 1dv3 n ARG 241 Ca 0.23 0.02 -0.31 0.00 -0.92 0.00 0.00 57.85 56.86 1dv3 n ARG 241 Cb 0.51 -1.36 -0.08 0.00 0.45 0.00 0.00 32.46 31.98 1dv3 n ARG 241 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1dv3 s GLY 242 N -0.32 2.93 0.63 5.14 0.00 -1.26 -5.02 107.32 109.43 1dv3 s GLY 242 Ca 0.82 -0.60 0.41 0.00 0.00 0.00 0.00 44.72 45.35 1dv3 s GLY 242 CO 0.56 -2.11 2.28 0.00 0.00 0.00 0.00 173.10 173.84 1dv3 h THR 243 N 1.46 0.08 0.04 0.90 1.03 -1.94 -2.12 112.91 112.36 1dv3 h THR 243 Ca -0.42 -0.12 -0.00 0.00 -0.01 0.00 0.00 66.41 65.86 1dv3 h THR 243 Cb 1.30 1.11 0.00 0.00 -1.07 0.00 0.00 68.15 69.50 1dv3 h THR 243 CO 0.70 0.01 -0.02 0.00 -0.01 0.00 0.00 175.52 176.20 1dv3 h ALA 244 N 1.99 -0.05 -0.79 0.00 0.00 -1.89 -1.31 119.26 117.21 1dv3 h ALA 244 Ca -0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1dv3 h ALA 244 Cb 0.11 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 1dv3 h ALA 244 CO 0.00 -0.40 0.42 0.00 0.00 0.00 0.00 179.25 179.27 1dv3 h ALA 245 N 0.64 1.25 -0.12 0.00 0.00 -1.77 -2.14 119.26 117.12 1dv3 h ALA 245 Ca -0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1dv3 h ALA 245 Cb 0.29 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1dv3 h ALA 245 CO 0.01 0.60 -0.01 0.93 0.00 0.00 0.00 179.25 180.78 1dv3 h GLU 246 N 1.11 0.22 -0.34 0.00 5.08 -1.37 -1.49 114.58 117.78 1dv3 h GLU 246 Ca 0.28 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.50 1dv3 h GLU 246 Cb 0.05 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1dv3 h GLU 246 CO -0.04 0.49 -0.06 0.00 -1.00 0.00 0.00 179.01 178.39 1dv3 h ARG 247 N -0.08 0.57 -0.09 2.33 3.08 -1.17 -0.38 114.38 118.64 1dv3 h ARG 247 Ca 0.03 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 1dv3 h ARG 247 Cb 0.40 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.38 1dv3 h ARG 247 CO 0.01 0.64 0.00 0.00 -1.07 0.00 0.00 179.97 179.55 1dv3 h ALA 248 N 1.41 0.13 -0.44 0.04 0.00 -1.33 -0.73 119.26 118.35 1dv3 h ALA 248 Ca 0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1dv3 h ALA 248 Cb 0.44 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1dv3 h ALA 248 CO 0.02 -0.19 0.23 0.00 0.00 0.00 0.00 179.25 179.31 1dv3 h ALA 249 N 0.74 0.56 0.00 0.00 0.00 -1.04 -2.79 119.26 116.73 1dv3 h ALA 249 Ca 0.03 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1dv3 h ALA 249 Cb 0.34 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1dv3 h ALA 249 CO 0.00 0.10 -0.23 -0.07 0.00 0.00 0.00 179.25 179.05 1dv3 h LEU 250 N 0.57 0.00 -0.23 0.00 3.38 -1.00 -0.32 115.31 117.71 1dv3 h LEU 250 Ca 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 1dv3 h LEU 250 Cb 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1dv3 h LEU 250 CO -0.02 0.23 0.12 0.15 0.09 0.00 0.00 178.44 179.01 1dv3 h PHE 251 N 0.00 0.32 -0.04 1.13 3.57 -0.85 -1.08 116.94 119.99 1dv3 h PHE 251 Ca -0.00 -0.01 -0.22 0.00 3.53 0.00 0.00 57.97 61.27 1dv3 h PHE 251 Cb 0.52 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.16 1dv3 h PHE 251 CO 0.00 0.28 -0.87 -1.49 -2.23 0.00 0.00 178.31 174.00 1dv3 h TRP 252 N 0.26 0.67 -0.63 0.41 4.06 -1.42 -1.69 115.95 117.61 1dv3 h TRP 252 Ca 0.08 -0.34 -0.03 0.00 2.06 0.00 0.00 58.89 60.66 1dv3 h TRP 252 Cb 0.07 -0.09 -0.03 0.00 -1.00 0.00 0.00 29.16 28.12 1dv3 h TRP 252 CO -0.03 1.14 0.28 -0.09 -3.56 0.00 0.00 178.44 176.18 1dv3 h ARG 253 N 0.29 0.93 0.00 0.49 2.43 -0.98 0.20 114.38 117.74 1dv3 h ARG 253 Ca -0.07 -0.15 -0.06 0.00 -0.81 0.00 0.00 59.98 58.89 1dv3 h ARG 253 Cb 1.49 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.87 1dv3 h ARG 253 CO 0.15 0.76 -0.30 -1.49 -1.51 0.00 0.00 179.97 177.59 1dv3 h TRP 254 N 0.88 0.00 0.03 2.20 6.55 -1.20 -1.09 115.95 123.33 1dv3 h TRP 254 Ca 0.21 0.00 -0.12 0.00 0.95 0.00 0.00 58.89 59.93 1dv3 h TRP 254 Cb 0.16 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.45 1dv3 h TRP 254 CO 0.01 0.30 -0.64 1.15 -1.05 0.00 0.00 178.44 178.21 1dv3 h THR 255 N 0.00 1.42 0.00 1.49 2.02 -0.59 -3.42 112.91 113.83 1dv3 h THR 255 Ca -0.00 -2.33 0.00 0.00 0.77 0.00 0.00 66.41 64.84 1dv3 h THR 255 Cb 0.85 2.96 0.00 0.00 -1.74 0.00 0.00 68.15 70.23 1dv3 h THR 255 CO 0.04 0.56 -0.04 1.15 0.37 0.00 0.00 175.52 177.60 1dv3 n MET 256 N -4.40 1.87 0.00 6.66 0.00 0.64 -5.02 117.12 116.87 1dv3 n MET 256 Ca -0.19 -1.66 0.00 0.00 0.00 0.00 0.00 57.70 55.86 1dv3 n MET 256 Cb 0.64 -1.05 0.00 0.00 0.00 0.00 0.00 33.22 32.81 1dv3 n MET 256 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1dv3 n GLY 257 N -0.68 2.41 3.46 3.17 0.00 -0.41 -4.99 105.19 108.15 1dv3 n GLY 257 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 1dv3 n GLY 257 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1dv3 s PHE 258 N -2.54 0.25 0.23 1.61 -0.71 -1.26 -4.92 117.98 110.66 1dv3 s PHE 258 Ca 0.00 -0.61 -0.04 0.00 -1.04 0.00 0.00 56.93 55.24 1dv3 s PHE 258 Cb 0.00 0.14 0.01 0.00 -1.21 0.00 0.00 43.02 41.96 1dv3 s PHE 258 CO 0.00 -0.86 0.36 0.27 -1.34 0.00 0.00 175.22 173.66 1dv3 n ASN 259 N -0.30 -1.03 -2.65 1.98 6.94 -1.26 -3.33 115.26 115.61 1dv3 n ASN 259 Ca -0.06 -2.13 -0.09 0.00 -0.02 0.00 0.00 54.58 52.28 1dv3 n ASN 259 Cb 0.63 1.83 -0.02 0.00 -2.36 0.00 0.00 39.78 39.86 1dv3 n ASN 259 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1dv3 n ALA 260 N -1.53 0.13 -2.57 -2.53 0.00 -1.26 -5.05 120.51 107.70 1dv3 n ALA 260 Ca -0.09 -0.64 -0.27 0.00 0.00 0.00 0.00 53.44 52.44 1dv3 n ALA 260 Cb 0.37 0.36 -0.10 0.00 0.00 0.00 0.00 19.45 20.08 1dv3 n ALA 260 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1dv3 s THR 261 N -1.61 2.10 0.36 0.00 -4.23 -1.26 -4.73 115.64 106.28 1dv3 s THR 261 Ca 0.01 -1.93 0.05 0.00 -1.18 0.00 0.00 61.69 58.64 1dv3 s THR 261 Cb 0.00 -2.98 0.21 0.00 1.34 0.00 0.00 72.50 71.07 1dv3 s THR 261 CO 0.01 -0.01 1.96 -0.03 -0.54 0.00 0.00 174.62 176.00 1dv3 h MET 262 N 1.69 0.57 0.06 3.99 4.05 -1.91 -1.67 114.93 121.71 1dv3 h MET 262 Ca -0.44 -0.08 -0.15 0.00 -0.28 0.00 0.00 59.70 58.76 1dv3 h MET 262 Cb 1.24 -0.11 -0.00 0.00 -0.80 0.00 0.00 31.60 31.93 1dv3 h MET 262 CO 0.77 0.49 -0.74 1.49 0.23 0.00 0.00 176.91 179.15 1dv3 h GLU 263 N 0.57 0.12 -0.58 0.39 4.81 -1.94 -3.39 114.58 114.56 1dv3 h GLU 263 Ca 0.14 -0.20 0.09 0.00 -0.13 0.00 0.00 59.36 59.26 1dv3 h GLU 263 Cb 0.14 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1dv3 h GLU 263 CO -0.01 1.10 0.39 0.78 -0.73 0.00 0.00 179.01 180.53 1dv3 h GLY 264 N -0.63 0.58 1.87 1.92 0.00 -1.93 -1.81 103.07 103.07 1dv3 h GLY 264 Ca -0.17 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 46.99 1dv3 h GLY 264 CO 0.00 0.11 0.07 1.19 0.00 0.00 0.00 176.54 177.91 1dv3 h ILE 265 N 0.43 1.05 0.00 2.60 6.09 -1.49 -0.07 117.51 126.12 1dv3 h ILE 265 Ca 0.26 -0.14 0.00 0.00 -1.37 0.00 0.00 64.86 63.62 1dv3 h ILE 265 Cb 0.48 0.88 0.00 0.00 0.47 0.00 0.00 36.82 38.65 1dv3 h ILE 265 CO -0.07 0.05 0.00 0.45 -3.07 0.00 0.00 178.15 175.51 1dv3 h HIS 266 N 0.18 0.00 0.13 2.19 3.86 -1.53 -1.22 115.15 118.76 1dv3 h HIS 266 Ca 0.05 0.00 -0.30 0.00 -1.16 0.00 0.00 60.37 58.96 1dv3 h HIS 266 Cb 0.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.49 1dv3 h HIS 266 CO 0.00 0.00 -1.44 0.00 0.86 0.00 0.00 177.93 177.35 1dv3 h ARG 267 N 0.00 0.28 -0.53 2.45 3.08 -1.07 -2.46 114.38 116.13 1dv3 h ARG 267 Ca 0.00 -0.48 -0.08 0.00 0.07 0.00 0.00 59.98 59.48 1dv3 h ARG 267 Cb 0.62 0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.83 1dv3 h ARG 267 CO 0.00 1.18 0.00 -1.49 -1.07 0.00 0.00 179.97 178.59 1dv3 h TRP 268 N 0.08 1.02 0.41 3.04 4.06 -1.10 -2.87 115.95 120.59 1dv3 h TRP 268 Ca -0.21 -0.18 -0.02 0.00 2.06 0.00 0.00 58.89 60.54 1dv3 h TRP 268 Cb 2.02 -0.27 0.00 0.00 -1.00 0.00 0.00 29.16 29.91 1dv3 h TRP 268 CO 0.07 0.94 -0.20 0.00 -3.56 0.00 0.00 178.44 175.69 1dv3 h ALA 269 N 0.95 -0.55 -0.99 1.49 0.00 -1.26 -1.19 119.26 117.71 1dv3 h ALA 269 Ca 0.15 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1dv3 h ALA 269 Cb 0.53 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.47 1dv3 h ALA 269 CO 0.03 -0.76 0.65 0.97 0.00 0.00 0.00 179.25 180.13 1dv3 h ILE 270 N -0.64 1.18 -0.18 0.00 2.10 -1.47 -2.36 117.51 116.14 1dv3 h ILE 270 Ca -0.06 -0.43 -0.20 0.00 1.08 0.00 0.00 64.86 65.25 1dv3 h ILE 270 Cb 0.47 -0.19 0.00 0.00 -1.09 0.00 0.00 36.82 36.01 1dv3 h ILE 270 CO 0.09 0.23 -0.68 -0.50 -1.08 0.00 0.00 178.15 176.21 1dv3 h TRP 271 N 1.26 0.92 -0.53 2.19 4.06 -1.47 -1.10 115.95 121.28 1dv3 h TRP 271 Ca 0.39 -0.38 0.06 0.00 2.06 0.00 0.00 58.89 61.02 1dv3 h TRP 271 Cb -0.01 -0.15 -0.05 0.00 -1.00 0.00 0.00 29.16 27.95 1dv3 h TRP 271 CO -0.00 1.18 0.25 1.98 -3.56 0.00 0.00 178.44 178.29 1dv3 h MET 272 N 0.51 0.47 0.00 0.49 4.05 -0.76 -0.24 114.93 119.45 1dv3 h MET 272 Ca -0.02 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1dv3 h MET 272 Cb 1.28 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 31.98 1dv3 h MET 272 CO 0.14 0.31 -0.00 0.00 0.23 0.00 0.00 176.91 177.58 1dv3 h ALA 273 N 1.31 -0.01 -0.88 0.39 0.00 -1.45 -3.31 119.26 115.32 1dv3 h ALA 273 Ca 0.24 -0.31 0.10 0.00 0.00 0.00 0.00 54.91 54.94 1dv3 h ALA 273 Cb 0.19 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 1dv3 h ALA 273 CO -0.19 -0.19 0.57 0.28 0.00 0.00 0.00 179.25 179.72 1dv3 h VAL 274 N -0.64 0.96 0.00 0.00 2.07 -1.05 -1.17 116.25 116.43 1dv3 h VAL 274 Ca -0.00 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.22 1dv3 h VAL 274 Cb 0.63 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1dv3 h VAL 274 CO 0.00 0.16 0.00 -0.07 0.02 0.00 0.00 177.57 177.68 1dv3 h LEU 275 N 0.86 0.00 0.32 2.57 3.38 -1.12 -2.63 115.31 118.68 1dv3 h LEU 275 Ca 0.41 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.37 1dv3 h LEU 275 Cb 0.41 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 1dv3 h LEU 275 CO -0.17 0.00 -0.25 0.58 0.09 0.00 0.00 178.44 178.69 1dv3 h VAL 276 N 0.00 0.47 0.00 1.22 2.07 -1.30 -2.15 116.25 116.56 1dv3 h VAL 276 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1dv3 h VAL 276 Cb 0.34 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1dv3 h VAL 276 CO 0.00 0.00 -0.50 0.71 0.02 0.00 0.00 177.57 177.80 1dv3 h THR 277 N -0.57 0.00 0.23 2.57 1.35 -1.70 -2.17 112.91 112.62 1dv3 h THR 277 Ca -0.02 -0.99 -0.01 0.00 -0.55 0.00 0.00 66.41 64.84 1dv3 h THR 277 Cb 0.50 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 68.66 1dv3 h THR 277 CO -0.01 0.00 -0.11 0.25 -0.25 0.00 0.00 175.52 175.39 1dv3 h LEU 278 N 0.00 -0.27 -0.55 3.87 5.85 -1.43 0.17 115.31 122.95 1dv3 h LEU 278 Ca 0.00 -0.25 -0.12 0.00 0.84 0.00 0.00 57.88 58.35 1dv3 h LEU 278 Cb 0.99 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1dv3 h LEU 278 CO 0.00 0.16 -0.19 0.71 -0.34 0.00 0.00 178.44 178.77 1dv3 h THR 279 N -0.75 1.27 -0.47 1.05 1.35 -1.50 -2.87 112.91 110.99 1dv3 h THR 279 Ca -0.03 -1.35 0.04 0.00 -0.55 0.00 0.00 66.41 64.52 1dv3 h THR 279 Cb 0.50 1.10 -0.04 0.00 -1.73 0.00 0.00 68.15 67.98 1dv3 h THR 279 CO 0.05 0.46 0.24 1.23 -0.25 0.00 0.00 175.52 177.26 1dv3 h GLY 280 N 0.91 0.65 1.00 5.82 0.00 -1.38 -1.30 103.07 108.77 1dv3 h GLY 280 Ca 0.11 -0.17 -0.00 0.00 0.00 0.00 0.00 47.33 47.27 1dv3 h GLY 280 CO 0.06 0.12 0.39 -1.33 0.00 0.00 0.00 176.54 175.79 1dv3 h GLY 281 N 0.48 0.92 0.99 4.60 0.00 -0.88 -2.27 103.07 106.91 1dv3 h GLY 281 Ca 0.20 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 1dv3 h GLY 281 CO -0.13 0.36 0.29 -2.22 0.00 0.00 0.00 176.54 174.84 1dv3 h ILE 282 N 0.86 1.15 -0.78 2.60 2.04 -1.24 -0.14 117.51 122.00 1dv3 h ILE 282 Ca 0.23 -0.34 0.03 0.00 1.00 0.00 0.00 64.86 65.78 1dv3 h ILE 282 Cb -0.04 0.51 -0.05 0.00 -0.74 0.00 0.00 36.82 36.50 1dv3 h ILE 282 CO -0.04 0.15 0.50 1.23 0.00 0.00 0.00 178.15 179.99 1dv3 h GLY 283 N 0.64 1.13 1.12 5.37 0.00 -0.94 -2.02 103.07 108.36 1dv3 h GLY 283 Ca 0.17 -0.38 -0.22 0.00 0.00 0.00 0.00 47.33 46.90 1dv3 h GLY 283 CO -0.03 0.33 -0.77 -2.22 0.00 0.00 0.00 176.54 173.85 1dv3 h ILE 284 N 0.98 1.30 -0.37 2.60 1.08 -1.18 -3.10 117.51 118.83 1dv3 h ILE 284 Ca 0.31 -1.99 0.00 0.00 -0.39 0.00 0.00 64.86 62.79 1dv3 h ILE 284 Cb -0.01 2.10 -0.02 0.00 -3.07 0.00 0.00 36.82 35.82 1dv3 h ILE 284 CO -0.10 0.62 0.24 0.25 -0.69 0.00 0.00 178.15 178.47 1dv3 h LEU 285 N 0.43 0.42 -0.16 1.44 5.85 -0.79 -1.52 115.31 120.98 1dv3 h LEU 285 Ca -0.06 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1dv3 h LEU 285 Cb 1.41 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.33 1dv3 h LEU 285 CO 0.16 0.30 0.00 -0.07 -0.34 0.00 0.00 178.44 178.49 1dv3 h LEU 286 N 0.50 0.00 -8.99 2.25 3.38 -1.37 -3.40 115.31 107.67 1dv3 h LEU 286 Ca 0.14 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.53 1dv3 h LEU 286 Cb -0.05 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.64 1dv3 h LEU 286 CO -0.03 0.00 0.86 -0.44 0.09 0.00 0.00 178.44 178.92 1dv3 s SER 287 N -5.52 6.93 0.00 -0.43 0.01 -0.57 -1.44 113.70 112.68 1dv3 s SER 287 Ca 0.08 1.19 0.00 0.00 1.31 0.00 0.00 55.95 58.52 1dv3 s SER 287 Cb 0.08 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.77 1dv3 s SER 287 CO 0.62 -0.85 0.00 0.61 0.41 0.00 0.00 173.24 174.03 1dv3 n GLY 288 N 3.79 3.29 0.13 3.44 0.00 0.39 -4.81 105.19 111.43 1dv3 n GLY 288 Ca 0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 1dv3 n GLY 288 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1dv3 n THR 289 N -1.78 1.52 -0.02 2.61 -2.24 -1.22 -4.78 114.28 108.38 1dv3 n THR 289 Ca 0.00 -0.52 -0.02 0.00 -2.27 0.00 0.00 64.05 61.24 1dv3 n THR 289 Cb 0.00 -1.57 -0.02 0.00 -2.10 0.00 0.00 70.33 66.63 1dv3 n THR 289 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1dv3 n VAL 290 N -3.55 0.23 -4.01 2.28 0.31 -0.88 -5.00 118.33 107.71 1dv3 n VAL 290 Ca -0.47 -0.12 -0.30 0.00 -0.01 0.00 0.00 64.34 63.45 1dv3 n VAL 290 Cb 0.96 -0.79 -0.16 0.00 -0.91 0.00 0.00 33.84 32.94 1dv3 n VAL 290 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1dv3 s VAL 291 N -2.08 1.54 -0.01 2.52 1.01 -0.52 -5.01 120.40 117.85 1dv3 s VAL 291 Ca -0.04 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.37 1dv3 s VAL 291 Cb 0.01 -1.46 -0.24 0.00 0.00 0.00 0.00 36.38 34.69 1dv3 s VAL 291 CO 0.12 0.43 0.81 0.44 0.00 0.00 0.00 175.10 176.89 1dv3 h ASP 292 N 8.06 0.13 -2.91 3.32 3.32 -1.89 0.11 116.42 126.56 1dv3 h ASP 292 Ca -0.37 -0.21 -0.40 0.00 0.02 0.00 0.00 57.03 56.07 1dv3 h ASP 292 Cb 1.13 -0.04 -0.39 0.00 0.22 0.00 0.00 39.33 40.25 1dv3 h ASP 292 CO 0.52 1.18 -0.71 0.21 -1.72 0.00 0.00 179.24 178.72 1dv3 s ASN 293 N -6.51 1.89 0.41 6.45 3.84 -1.26 -4.25 114.94 115.50 1dv3 s ASN 293 Ca -0.06 -0.40 0.16 0.00 0.21 0.00 0.00 52.86 52.77 1dv3 s ASN 293 Cb 0.08 -0.02 0.87 0.00 -0.55 0.00 0.00 41.25 41.64 1dv3 s ASN 293 CO 0.83 -0.33 1.88 -0.50 -2.79 0.00 0.00 177.10 176.18 1dv3 h TRP 294 N 8.39 0.00 0.10 0.43 4.06 -1.42 -0.31 115.95 127.19 1dv3 h TRP 294 Ca -0.15 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.79 1dv3 h TRP 294 Cb 1.15 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.31 1dv3 h TRP 294 CO 0.18 0.31 -0.05 -0.92 -3.56 0.00 0.00 178.44 174.41 1dv3 h TYR 295 N 0.00 -0.12 -0.30 0.49 3.20 -1.79 0.23 116.97 118.68 1dv3 h TYR 295 Ca -0.00 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.88 1dv3 h TYR 295 Cb 0.60 0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.88 1dv3 h TYR 295 CO 0.00 0.07 0.15 0.28 -1.64 0.00 0.00 178.16 177.02 1dv3 h VAL 296 N -0.29 1.00 -0.54 1.81 2.07 -1.82 -2.15 116.25 116.33 1dv3 h VAL 296 Ca -0.01 -0.11 0.08 0.00 0.82 0.00 0.00 66.70 67.48 1dv3 h VAL 296 Cb 0.24 0.65 -0.07 0.00 -1.52 0.00 0.00 31.29 30.60 1dv3 h VAL 296 CO 0.02 0.06 0.18 -0.25 0.02 0.00 0.00 177.57 177.60 1dv3 h TRP 297 N 0.32 0.31 -0.30 1.57 7.01 -0.80 -1.71 115.95 122.35 1dv3 h TRP 297 Ca 0.12 0.03 0.02 0.00 2.11 0.00 0.00 58.89 61.17 1dv3 h TRP 297 Cb 0.03 -0.06 -0.02 0.00 -2.10 0.00 0.00 29.16 27.02 1dv3 h TRP 297 CO -0.09 0.08 0.20 0.78 -2.79 0.00 0.00 178.44 176.62 1dv3 h GLY 298 N 0.35 0.35 2.00 2.65 0.00 0.03 -1.73 103.07 106.72 1dv3 h GLY 298 Ca 0.27 -0.13 -0.03 0.00 0.00 0.00 0.00 47.33 47.45 1dv3 h GLY 298 CO -0.28 0.12 -0.13 1.46 0.00 0.00 0.00 176.54 177.71 1dv3 h GLN 299 N 0.32 0.00 -0.51 4.80 1.08 -0.70 -2.58 115.11 117.53 1dv3 h GLN 299 Ca 0.12 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.32 1dv3 h GLN 299 Cb 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 1dv3 h GLN 299 CO -0.03 0.13 0.00 0.09 -0.95 0.00 0.00 178.83 178.07 1dv3 n ASN 300 N -3.77 4.55 0.00 1.46 5.03 -0.66 -5.13 115.26 116.74 1dv3 n ASN 300 Ca -0.02 -2.63 0.00 0.00 0.87 0.00 0.00 54.58 52.80 1dv3 n ASN 300 Cb 0.23 -0.55 0.00 0.00 -1.02 0.00 0.00 39.78 38.44 1dv3 n ASN 300 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00