#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jv3 n ASN 2 N 0.00 0.79 0.22 6.12 2.04 -1.26 -5.01 115.26 118.15 1jv3 n ASN 2 Ca 0.00 -2.76 0.14 0.00 -0.44 0.00 0.00 54.58 51.52 1jv3 n ASN 2 Cb 0.00 0.95 0.73 0.00 -2.53 0.00 0.00 39.78 38.93 1jv3 n ASN 2 CO 0.00 0.00 0.00 -0.29 -0.44 0.00 0.00 177.26 176.53 1jv3 h ILE 3 N 1.62 0.00 0.06 1.53 6.09 -2.03 -1.96 117.51 122.82 1jv3 h ILE 3 Ca -0.24 0.00 -0.13 0.00 -1.37 0.00 0.00 64.86 63.12 1jv3 h ILE 3 Cb 0.98 0.60 0.01 0.00 0.47 0.00 0.00 36.82 38.88 1jv3 h ILE 3 CO 0.38 0.00 -0.55 0.78 -3.07 0.00 0.00 178.15 175.69 1jv3 h ASN 4 N 0.00 0.38 -0.30 2.19 2.35 -1.99 -2.47 115.58 115.73 1jv3 h ASN 4 Ca 0.00 -0.88 -0.11 0.00 -0.55 0.00 0.00 56.30 54.76 1jv3 h ASN 4 Cb 0.12 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 1jv3 h ASN 4 CO 0.00 1.22 -0.19 0.44 -1.65 0.00 0.00 177.43 177.25 1jv3 h ASP 5 N -0.41 0.77 -0.25 5.81 3.32 -1.77 -2.56 116.42 121.33 1jv3 h ASP 5 Ca -0.09 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.69 1jv3 h ASP 5 Cb 1.36 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 1jv3 h ASP 5 CO 0.11 0.95 0.10 0.25 -1.72 0.00 0.00 179.24 178.93 1jv3 h LEU 6 N 0.67 0.34 -0.69 1.55 5.85 -1.50 -1.04 115.31 120.49 1jv3 h LEU 6 Ca 0.10 -0.16 0.10 0.00 0.84 0.00 0.00 57.88 58.77 1jv3 h LEU 6 Cb 0.69 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.55 1jv3 h LEU 6 CO 0.05 0.40 0.31 0.50 -0.34 0.00 0.00 178.44 179.37 1jv3 h LYS 7 N 0.25 0.50 -0.03 1.25 3.64 -1.30 0.85 116.57 121.73 1jv3 h LYS 7 Ca 0.08 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1jv3 h LYS 7 Cb 0.17 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1jv3 h LYS 7 CO -0.01 0.33 0.02 1.25 -2.27 0.00 0.00 179.45 178.77 1jv3 h LEU 8 N 0.52 0.04 -0.49 5.20 5.85 -1.07 0.16 115.31 125.52 1jv3 h LEU 8 Ca 0.35 -0.10 0.06 0.00 0.84 0.00 0.00 57.88 59.03 1jv3 h LEU 8 Cb 0.43 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 1jv3 h LEU 8 CO -0.31 0.13 0.18 0.74 -0.34 0.00 0.00 178.44 178.85 1jv3 h THR 9 N -0.05 0.85 -0.30 1.05 2.02 -0.61 0.47 112.91 116.33 1jv3 h THR 9 Ca 0.01 -0.13 -0.06 0.00 0.77 0.00 0.00 66.41 67.00 1jv3 h THR 9 Cb 0.10 0.45 -0.01 0.00 -1.74 0.00 0.00 68.15 66.95 1jv3 h THR 9 CO -0.00 0.07 -0.05 -0.07 0.37 0.00 0.00 175.52 175.83 1jv3 h LEU 10 N 0.37 0.57 -0.42 2.58 3.38 -0.62 -2.85 115.31 118.32 1jv3 h LEU 10 Ca 0.23 -0.35 0.03 0.00 0.09 0.00 0.00 57.88 57.88 1jv3 h LEU 10 Cb 0.24 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1jv3 h LEU 10 CO -0.23 0.79 0.23 -1.28 0.09 0.00 0.00 178.44 178.04 1jv3 h SER 11 N 0.35 0.35 0.32 -0.43 0.87 -0.20 0.33 113.55 115.14 1jv3 h SER 11 Ca 0.08 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.63 1jv3 h SER 11 Cb 0.53 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.43 1jv3 h SER 11 CO 0.03 0.25 -0.10 0.11 -0.53 0.00 0.00 176.83 176.59 1jv3 h LYS 12 N 0.46 0.00 -0.57 2.24 1.57 -0.89 -0.23 116.57 119.15 1jv3 h LYS 12 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1jv3 h LYS 12 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1jv3 h LYS 12 CO -0.10 0.10 0.00 0.00 -0.57 0.00 0.00 179.45 178.88 1jv3 n ALA 13 N -2.28 2.45 -1.91 3.86 0.00 -0.69 -4.92 120.51 117.01 1jv3 n ALA 13 Ca -0.02 -1.00 -0.13 0.00 0.00 0.00 0.00 53.44 52.29 1jv3 n ALA 13 Cb 0.21 -0.96 -0.03 0.00 0.00 0.00 0.00 19.45 18.68 1jv3 n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jv3 n GLY 14 N 1.36 0.43 0.30 0.00 0.00 -0.10 -4.92 105.19 102.26 1jv3 n GLY 14 Ca 0.19 -0.37 0.08 0.00 0.00 0.00 0.00 46.02 45.92 1jv3 n GLY 14 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1jv3 n GLN 15 N -2.40 1.20 0.29 1.61 1.13 0.11 -4.80 117.38 114.53 1jv3 n GLN 15 Ca -0.15 -2.61 0.15 0.00 -1.94 0.00 0.00 57.00 52.45 1jv3 n GLN 15 Cb 0.55 -1.39 0.89 0.00 0.11 0.00 0.00 30.24 30.39 1jv3 n GLN 15 CO 0.00 0.00 0.00 1.05 -1.44 0.00 0.00 177.06 176.67 1jv3 h GLU 16 N 0.29 0.00 0.00 -1.09 4.11 -1.83 -1.94 114.58 114.12 1jv3 h GLU 16 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1jv3 h GLU 16 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1jv3 h GLU 16 CO 0.00 0.02 0.00 1.12 0.07 0.00 0.00 179.01 180.23 1jv3 h HIS 17 N 0.00 0.00 0.00 2.06 2.07 -1.93 -1.84 115.15 115.51 1jv3 h HIS 17 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1jv3 h HIS 17 Cb 0.06 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.04 1jv3 h HIS 17 CO 0.00 0.00 0.00 -0.07 -3.07 0.00 0.00 177.93 174.79 1jv3 h LEU 18 N 0.00 0.00 -2.59 6.12 3.38 -1.70 -2.45 115.31 118.08 1jv3 h LEU 18 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1jv3 h LEU 18 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1jv3 h LEU 18 CO 0.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.71 1jv3 n LEU 19 N -2.78 3.22 0.08 1.67 4.77 -0.69 -4.71 117.00 118.56 1jv3 n LEU 19 Ca -0.00 -1.80 0.18 0.00 -0.03 0.00 0.00 56.01 54.36 1jv3 n LEU 19 Cb 0.18 -0.28 0.71 0.00 -2.33 0.00 0.00 43.42 41.70 1jv3 n LEU 19 CO 0.21 0.77 1.16 0.08 -1.33 0.00 0.00 177.39 178.28 1jv3 h ARG 20 N 3.15 0.00 -0.16 3.23 0.11 -1.56 -0.65 114.38 118.50 1jv3 h ARG 20 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1jv3 h ARG 20 Cb 0.83 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.91 1jv3 h ARG 20 CO 0.00 0.00 0.00 1.19 0.10 0.00 0.00 179.97 181.26 1jv3 n PHE 21 N -4.26 0.19 -0.31 4.08 3.01 -1.26 -4.66 117.46 114.25 1jv3 n PHE 21 Ca 0.06 -0.09 0.13 0.00 1.01 0.00 0.00 57.45 58.56 1jv3 n PHE 21 Cb 0.47 0.00 0.28 0.00 -0.01 0.00 0.00 39.48 40.23 1jv3 n PHE 21 CO 0.00 0.00 0.00 2.35 1.01 0.00 0.00 176.76 180.12 1jv3 h TRP 22 N 4.31 0.15 0.00 1.38 2.91 -1.43 0.26 115.95 123.54 1jv3 h TRP 22 Ca 0.00 0.06 0.00 0.00 1.13 0.00 0.00 58.89 60.08 1jv3 h TRP 22 Cb 0.93 0.08 0.00 0.00 -0.51 0.00 0.00 29.16 29.66 1jv3 h TRP 22 CO 0.09 -0.31 0.00 0.09 -1.03 0.00 0.00 178.44 177.28 1jv3 n ASN 23 N -5.35 0.00 -0.35 2.65 3.02 -1.26 -2.73 115.26 111.23 1jv3 n ASN 23 Ca 0.22 0.38 0.10 0.00 -0.03 0.00 0.00 54.58 55.24 1jv3 n ASN 23 Cb 0.71 -0.45 -0.03 0.00 -0.61 0.00 0.00 39.78 39.39 1jv3 n ASN 23 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1jv3 n GLU 24 N -1.45 1.03 -2.90 3.52 1.02 0.88 -4.99 120.64 117.76 1jv3 n GLU 24 Ca 0.06 -0.72 -0.32 0.00 -0.02 0.00 0.00 57.16 56.16 1jv3 n GLU 24 Cb 0.23 -1.45 -0.06 0.00 -0.02 0.00 0.00 31.44 30.14 1jv3 n GLU 24 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1jv3 s LEU 25 N -2.55 3.93 0.73 -4.62 1.43 -1.03 -5.06 118.68 111.51 1jv3 s LEU 25 Ca 0.15 1.41 -0.11 0.00 -1.03 0.00 0.00 54.13 54.55 1jv3 s LEU 25 Cb 0.17 -4.26 0.03 0.00 0.03 0.00 0.00 46.19 42.16 1jv3 s LEU 25 CO 0.62 -0.33 1.07 -1.61 0.23 0.00 0.00 176.35 176.33 1jv3 s GLU 26 N -3.32 2.62 0.31 1.70 2.02 -1.26 -4.80 118.70 115.97 1jv3 s GLU 26 Ca 0.57 0.97 0.02 0.00 0.02 0.00 0.00 54.97 56.54 1jv3 s GLU 26 Cb -0.10 -1.95 0.57 0.00 0.10 0.00 0.00 34.13 32.75 1jv3 s GLU 26 CO 0.20 -1.33 1.91 0.93 0.02 0.00 0.00 175.26 176.99 1jv3 h GLU 27 N -0.89 0.95 -0.11 1.61 5.08 -1.97 -1.50 114.58 117.76 1jv3 h GLU 27 Ca -0.44 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 57.78 1jv3 h GLU 27 Cb 1.22 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 1jv3 h GLU 27 CO 0.56 0.63 -0.28 0.00 -1.00 0.00 0.00 179.01 178.91 1jv3 h ALA 28 N 1.53 1.32 -0.15 3.43 0.00 -2.00 -1.97 119.26 121.42 1jv3 h ALA 28 Ca 0.39 -0.31 -0.19 0.00 0.00 0.00 0.00 54.91 54.80 1jv3 h ALA 28 Cb 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1jv3 h ALA 28 CO -0.15 0.47 -0.69 1.96 0.00 0.00 0.00 179.25 180.84 1jv3 h GLN 29 N 0.18 0.61 -0.50 0.00 4.20 -1.68 -2.58 115.11 115.34 1jv3 h GLN 29 Ca 0.03 -0.46 -0.06 0.00 0.06 0.00 0.00 58.65 58.22 1jv3 h GLN 29 Cb 0.60 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.44 1jv3 h GLN 29 CO 0.04 1.08 0.08 1.96 -0.67 0.00 0.00 178.83 181.33 1jv3 h GLN 30 N 0.43 0.79 -0.28 1.46 4.20 -0.83 0.12 115.11 121.01 1jv3 h GLN 30 Ca -0.02 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.49 1jv3 h GLN 30 Cb 1.28 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.93 1jv3 h GLN 30 CO 0.13 0.74 0.11 0.28 -0.67 0.00 0.00 178.83 179.43 1jv3 h VAL 31 N 0.76 1.17 0.31 -0.54 2.07 -1.28 0.13 116.25 118.87 1jv3 h VAL 31 Ca 0.16 -0.53 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 1jv3 h VAL 31 Cb 0.34 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1jv3 h VAL 31 CO 0.01 0.18 -0.15 -0.08 0.02 0.00 0.00 177.57 177.55 1jv3 h GLU 32 N 0.30 -0.40 -0.27 1.57 4.81 -1.12 -1.82 114.58 117.65 1jv3 h GLU 32 Ca 0.09 0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.37 1jv3 h GLU 32 Cb 0.18 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1jv3 h GLU 32 CO -0.01 -0.17 0.12 1.25 -0.73 0.00 0.00 179.01 179.47 1jv3 h LEU 33 N -0.57 0.16 0.03 1.64 5.85 -0.71 -1.73 115.31 119.97 1jv3 h LEU 33 Ca -0.04 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.73 1jv3 h LEU 33 Cb 0.42 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 1jv3 h LEU 33 CO 0.07 0.12 -0.35 0.22 -0.34 0.00 0.00 178.44 178.17 1jv3 h TYR 34 N 0.25 -0.96 -0.60 1.25 3.20 -0.74 -1.23 116.97 118.14 1jv3 h TYR 34 Ca 0.11 0.03 0.09 0.00 3.14 0.00 0.00 58.73 62.11 1jv3 h TYR 34 Cb 0.06 0.42 -0.07 0.00 1.54 0.00 0.00 36.73 38.68 1jv3 h TYR 34 CO -0.11 -0.44 0.21 0.00 -1.64 0.00 0.00 178.16 176.18 1jv3 h ALA 35 N 0.14 0.76 -0.65 1.82 0.00 -0.96 -1.34 119.26 119.03 1jv3 h ALA 35 Ca 0.05 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1jv3 h ALA 35 Cb 0.59 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1jv3 h ALA 35 CO -0.26 -0.20 0.40 1.49 0.00 0.00 0.00 179.25 180.68 1jv3 h GLU 36 N 0.39 0.88 -0.29 0.00 4.81 -0.88 -2.81 114.58 116.68 1jv3 h GLU 36 Ca 0.30 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 59.37 1jv3 h GLU 36 Cb 0.37 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1jv3 h GLU 36 CO -0.31 0.61 -0.19 -0.07 -0.73 0.00 0.00 179.01 178.33 1jv3 h LEU 37 N 0.88 0.53 -1.35 1.64 3.38 -0.46 -2.80 115.31 117.13 1jv3 h LEU 37 Ca 0.23 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 1jv3 h LEU 37 Cb -0.05 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1jv3 h LEU 37 CO -0.05 0.73 -0.27 1.56 0.09 0.00 0.00 178.44 180.50 1jv3 h GLN 38 N 0.48 0.00 -0.54 1.13 1.08 -1.03 -2.81 115.11 113.41 1jv3 h GLN 38 Ca 0.08 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 1jv3 h GLN 38 Cb 0.60 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.03 1jv3 h GLN 38 CO 0.04 0.27 0.00 0.00 -0.95 0.00 0.00 178.83 178.19 1jv3 n ALA 39 N -2.32 2.75 -2.66 3.87 0.00 -1.06 -4.88 120.51 116.21 1jv3 n ALA 39 Ca -0.01 -0.76 -0.32 0.00 0.00 0.00 0.00 53.44 52.36 1jv3 n ALA 39 Cb 0.38 -1.01 -0.09 0.00 0.00 0.00 0.00 19.45 18.74 1jv3 n ALA 39 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1jv3 s MET 40 N -1.66 2.63 -0.68 0.00 -1.94 -1.06 -5.07 119.30 111.52 1jv3 s MET 40 Ca 0.25 -0.72 -0.11 0.00 -1.71 0.00 0.00 55.69 53.40 1jv3 s MET 40 Cb 0.16 -2.58 0.18 0.00 2.01 0.00 0.00 34.83 34.60 1jv3 s MET 40 CO 0.13 0.59 0.59 1.21 -0.01 0.00 0.00 175.02 177.52 1jv3 s ASN 41 N -1.77 6.18 0.37 3.03 3.84 -1.26 -4.94 114.94 120.39 1jv3 s ASN 41 Ca 0.21 -2.44 0.07 0.00 0.21 0.00 0.00 52.86 50.91 1jv3 s ASN 41 Cb -0.11 -2.11 0.73 0.00 -0.55 0.00 0.00 41.25 39.21 1jv3 s ASN 41 CO 0.12 -0.60 1.93 -0.26 -2.79 0.00 0.00 177.10 175.50 1jv3 h PHE 42 N 7.93 0.42 -0.07 0.43 -1.00 -1.97 -1.00 116.94 121.68 1jv3 h PHE 42 Ca -0.04 -0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.69 1jv3 h PHE 42 Cb 1.04 -0.12 -0.00 0.00 3.61 0.00 0.00 35.95 40.47 1jv3 h PHE 42 CO 0.85 0.42 -0.01 0.93 -1.61 0.00 0.00 178.31 178.89 1jv3 h GLU 43 N 0.40 0.13 -0.65 1.51 5.08 -1.96 -1.05 114.58 118.03 1jv3 h GLU 43 Ca 0.09 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1jv3 h GLU 43 Cb 0.27 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.47 1jv3 h GLU 43 CO 0.01 0.45 0.43 1.49 -1.00 0.00 0.00 179.01 180.38 1jv3 h GLU 44 N -0.21 0.84 -0.80 2.33 4.81 -1.94 -0.12 114.58 119.50 1jv3 h GLU 44 Ca 0.02 -0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1jv3 h GLU 44 Cb 0.40 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.55 1jv3 h GLU 44 CO 0.01 0.55 0.52 -0.07 -0.73 0.00 0.00 179.01 179.29 1jv3 h LEU 45 N 0.86 0.89 -0.45 1.64 3.38 -1.11 0.05 115.31 120.57 1jv3 h LEU 45 Ca 0.24 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 1jv3 h LEU 45 Cb -0.08 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1jv3 h LEU 45 CO -0.06 0.63 0.15 0.78 0.09 0.00 0.00 178.44 180.02 1jv3 h ASN 46 N 1.04 0.64 -0.62 -0.43 2.35 -0.40 -0.77 115.58 117.39 1jv3 h ASN 46 Ca 0.30 -0.20 0.06 0.00 -0.55 0.00 0.00 56.30 55.91 1jv3 h ASN 46 Cb -0.07 -0.17 -0.05 0.00 0.05 0.00 0.00 38.32 38.08 1jv3 h ASN 46 CO -0.08 0.67 0.34 0.15 -1.65 0.00 0.00 177.43 176.85 1jv3 h PHE 47 N 0.58 0.62 -0.61 1.19 3.57 -0.53 0.21 116.94 121.97 1jv3 h PHE 47 Ca 0.14 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.62 1jv3 h PHE 47 Cb 0.25 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 1jv3 h PHE 47 CO 0.01 0.29 0.21 0.74 -2.23 0.00 0.00 178.31 177.33 1jv3 h PHE 48 N 0.63 0.96 -0.54 0.41 0.04 -0.66 -2.23 116.94 115.54 1jv3 h PHE 48 Ca 0.28 -0.09 -0.06 0.00 2.80 0.00 0.00 57.97 60.90 1jv3 h PHE 48 Cb 0.18 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 38.02 1jv3 h PHE 48 CO -0.09 0.79 0.09 0.35 -0.60 0.00 0.00 178.31 178.85 1jv3 h PHE 49 N 0.86 0.89 -0.32 -0.55 3.57 -0.40 -1.86 116.94 119.12 1jv3 h PHE 49 Ca 0.20 -0.10 -0.03 0.00 3.53 0.00 0.00 57.97 61.57 1jv3 h PHE 49 Cb 0.26 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 1jv3 h PHE 49 CO 0.02 0.76 0.09 1.96 -2.23 0.00 0.00 178.31 178.91 1jv3 h GLN 50 N 0.81 0.51 -0.76 1.11 4.20 -0.48 -1.10 115.11 119.39 1jv3 h GLN 50 Ca 0.17 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.72 1jv3 h GLN 50 Cb 0.36 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.03 1jv3 h GLN 50 CO 0.01 0.56 0.31 0.87 -0.67 0.00 0.00 178.83 179.90 1jv3 h LYS 51 N 0.36 1.13 0.47 1.46 1.79 -1.33 0.23 116.57 120.68 1jv3 h LYS 51 Ca 0.10 -0.20 -0.02 0.00 -2.18 0.00 0.00 60.65 58.35 1jv3 h LYS 51 Cb 0.27 -0.19 0.00 0.00 -1.58 0.00 0.00 32.23 30.74 1jv3 h LYS 51 CO -0.00 0.91 -0.22 0.00 -1.08 0.00 0.00 179.45 179.06 1jv3 h ALA 52 N 1.23 -0.63 -0.80 3.86 0.00 -1.12 -0.98 119.26 120.82 1jv3 h ALA 52 Ca 0.26 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1jv3 h ALA 52 Cb 0.20 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 1jv3 h ALA 52 CO -0.02 -0.80 0.44 0.82 0.00 0.00 0.00 179.25 179.69 1jv3 h ILE 53 N -0.73 1.23 0.00 0.00 1.08 -1.08 -0.39 117.51 117.63 1jv3 h ILE 53 Ca -0.06 -0.57 -0.01 0.00 -0.39 0.00 0.00 64.86 63.83 1jv3 h ILE 53 Cb 0.53 0.14 -0.00 0.00 -3.07 0.00 0.00 36.82 34.42 1jv3 h ILE 53 CO 0.11 0.26 -0.04 -0.33 -0.69 0.00 0.00 178.15 177.46 1jv3 h GLU 54 N 1.12 0.00 -2.12 2.37 5.08 -0.72 -2.88 114.58 117.42 1jv3 h GLU 54 Ca 0.28 0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 58.17 1jv3 h GLU 54 Cb 0.02 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.13 1jv3 h GLU 54 CO -0.05 0.04 0.65 0.41 -1.00 0.00 0.00 179.01 179.06 1jv3 n GLY 55 N -0.93 4.19 2.34 -3.84 0.00 -0.15 -5.07 105.19 101.72 1jv3 n GLY 55 Ca -0.02 -1.76 -0.26 0.00 0.00 0.00 0.00 46.02 43.98 1jv3 n GLY 55 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1jv3 n PHE 56 N 1.43 -0.25 -4.63 1.61 3.01 -1.09 -5.00 117.46 112.54 1jv3 n PHE 56 Ca 0.51 -3.51 -0.30 0.00 1.01 0.00 0.00 57.45 55.16 1jv3 n PHE 56 Cb 0.57 -0.08 -0.07 0.00 -0.01 0.00 0.00 39.48 39.89 1jv3 n PHE 56 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1jv3 s ARG 68 N -0.67 2.09 0.36 -1.08 1.81 -1.26 -5.12 118.95 115.07 1jv3 s ARG 68 Ca 0.34 -2.32 -0.24 0.00 -1.72 0.00 0.00 55.73 51.78 1jv3 s ARG 68 Cb 0.10 -0.96 -0.10 0.00 -0.45 0.00 0.00 34.95 33.53 1jv3 s ARG 68 CO -0.15 -0.48 0.95 -1.64 -0.68 0.00 0.00 175.30 173.30 1jv3 s MET 69 N -3.76 4.46 0.02 3.54 -1.94 -1.26 -4.44 119.30 115.92 1jv3 s MET 69 Ca 0.13 1.27 0.01 0.00 -1.71 0.00 0.00 55.69 55.39 1jv3 s MET 69 Cb 0.01 -2.60 -0.02 0.00 2.01 0.00 0.00 34.83 34.24 1jv3 s MET 69 CO 0.09 0.17 -0.04 -1.21 -0.01 0.00 0.00 175.02 174.03 1jv3 s GLU 70 N -2.42 0.30 0.90 2.03 2.02 -0.12 -4.99 118.70 116.43 1jv3 s GLU 70 Ca 0.54 -0.48 -0.11 0.00 0.02 0.00 0.00 54.97 54.95 1jv3 s GLU 70 Cb -0.16 -0.04 0.14 0.00 0.10 0.00 0.00 34.13 34.17 1jv3 s GLU 70 CO 0.20 -0.00 1.11 -2.14 0.02 0.00 0.00 175.26 174.45 1jv3 s PRO 71 N -1.07 1.16 0.40 0.39 0.02 -1.26 -1.29 135.00 133.35 1jv3 s PRO 71 Ca -0.10 1.22 -0.24 0.00 0.02 0.00 0.00 61.00 61.91 1jv3 s PRO 71 Cb -0.07 -1.77 -0.09 0.00 0.02 0.00 0.00 34.50 32.59 1jv3 s PRO 71 CO -0.00 -2.43 1.04 0.14 -0.33 0.00 0.00 177.00 175.42 1jv3 s VAL 72 N -2.75 3.78 0.57 3.83 -7.23 -1.26 -4.56 120.40 112.77 1jv3 s VAL 72 Ca 0.65 1.34 -0.19 0.00 -1.81 0.00 0.00 61.98 61.96 1jv3 s VAL 72 Cb -0.21 -3.68 -0.05 0.00 0.56 0.00 0.00 36.38 33.01 1jv3 s VAL 72 CO 0.58 -0.02 1.18 -2.16 -0.31 0.00 0.00 175.10 174.38 1jv3 s PRO 73 N -2.56 3.15 0.56 4.82 0.04 -1.26 -4.90 135.00 134.86 1jv3 s PRO 73 Ca 0.58 1.76 0.25 0.00 0.04 0.00 0.00 61.00 63.63 1jv3 s PRO 73 Cb -0.21 -1.99 1.56 0.00 0.04 0.00 0.00 34.50 33.91 1jv3 s PRO 73 CO 0.26 -1.04 2.16 0.07 0.04 0.00 0.00 177.00 178.48 1jv3 h ARG 74 N 1.08 0.00 0.00 4.56 -0.00 -1.94 -1.96 114.38 116.12 1jv3 h ARG 74 Ca -0.50 0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 59.48 1jv3 h ARG 74 Cb 1.28 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.25 1jv3 h ARG 74 CO 0.56 0.00 -0.01 0.93 -0.00 0.00 0.00 179.97 181.45 1jv3 h GLU 75 N 0.00 0.00 -0.20 0.08 3.07 -2.03 -2.25 114.58 113.24 1jv3 h GLU 75 Ca 0.05 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 1jv3 h GLU 75 Cb 0.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 1jv3 h GLU 75 CO -0.00 0.01 0.00 1.33 -1.40 0.00 0.00 179.01 178.95 1jv3 n VAL 76 N -3.50 0.46 -3.82 3.13 0.24 -0.74 -4.95 118.33 109.15 1jv3 n VAL 76 Ca -0.03 -0.73 -0.36 0.00 -2.04 0.00 0.00 64.34 61.18 1jv3 n VAL 76 Cb 0.09 0.92 -0.13 0.00 -1.47 0.00 0.00 33.84 33.24 1jv3 n VAL 76 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1jv3 s LEU 77 N -1.06 3.53 0.13 1.34 0.20 -0.85 -0.14 118.68 121.83 1jv3 s LEU 77 Ca 0.21 -0.66 -0.01 0.00 0.69 0.00 0.00 54.13 54.36 1jv3 s LEU 77 Cb 0.13 -1.82 -0.04 0.00 -0.43 0.00 0.00 46.19 44.03 1jv3 s LEU 77 CO 0.18 -0.14 0.30 -0.83 -0.29 0.00 0.00 176.35 175.57 1jv3 s GLY 78 N 1.47 2.05 -0.06 7.98 0.00 0.13 -4.96 107.32 113.92 1jv3 s GLY 78 Ca 0.03 -0.79 0.01 0.00 0.00 0.00 0.00 44.72 43.97 1jv3 s GLY 78 CO 0.00 -0.75 -0.07 -0.45 0.00 0.00 0.00 173.10 171.83 1jv3 s SER 79 N -2.74 1.46 0.43 1.64 0.15 -1.26 -0.98 113.70 112.40 1jv3 s SER 79 Ca 0.37 -0.20 0.10 0.00 0.70 0.00 0.00 55.95 56.92 1jv3 s SER 79 Cb -0.12 -0.62 0.92 0.00 -1.71 0.00 0.00 66.02 64.49 1jv3 s SER 79 CO 0.27 -0.05 2.02 0.00 1.20 0.00 0.00 173.24 176.68 1jv3 h ALA 80 N 7.41 1.69 0.00 5.45 0.00 -1.47 0.05 119.26 132.38 1jv3 h ALA 80 Ca -0.32 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1jv3 h ALA 80 Cb 1.16 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1jv3 h ALA 80 CO 0.44 0.24 -0.04 1.15 0.00 0.00 0.00 179.25 181.04 1jv3 h THR 81 N 0.29 0.00 -0.81 0.00 2.02 -1.95 -3.29 112.91 109.17 1jv3 h THR 81 Ca 0.07 -0.49 0.04 0.00 0.77 0.00 0.00 66.41 66.80 1jv3 h THR 81 Cb 0.13 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.50 1jv3 h THR 81 CO -0.00 0.00 0.54 0.03 0.37 0.00 0.00 175.52 176.45 1jv3 h ARG 82 N -0.49 0.97 -1.11 6.66 3.08 -1.95 -2.52 114.38 119.02 1jv3 h ARG 82 Ca 0.00 -0.06 -0.67 0.00 0.07 0.00 0.00 59.98 59.32 1jv3 h ARG 82 Cb 0.04 -0.22 -0.28 0.00 0.08 0.00 0.00 29.97 29.59 1jv3 h ARG 82 CO 0.00 0.64 0.88 -0.25 -1.07 0.00 0.00 179.97 180.17 1jv3 n ASP 83 N -4.45 7.65 0.20 7.04 8.00 0.00 -4.64 116.55 130.35 1jv3 n ASP 83 Ca 0.11 -3.76 0.10 0.00 0.71 0.00 0.00 54.79 51.94 1jv3 n ASP 83 Cb 0.12 -0.99 0.64 0.00 -0.02 0.00 0.00 41.12 40.86 1jv3 n ASP 83 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 1jv3 h GLN 84 N 2.07 0.03 0.00 -1.24 4.15 -1.51 -1.06 115.11 117.54 1jv3 h GLN 84 Ca 0.59 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.01 1jv3 h GLN 84 Cb 0.75 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.43 1jv3 h GLN 84 CO 1.55 0.02 0.00 0.38 -1.93 0.00 0.00 178.83 178.85 1jv3 h ASP 85 N 0.03 0.00 -0.02 -0.69 3.04 -1.87 -2.57 116.42 114.34 1jv3 h ASP 85 Ca 0.06 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.85 1jv3 h ASP 85 Cb 0.18 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.47 1jv3 h ASP 85 CO -0.00 0.00 -0.15 0.00 -2.04 0.00 0.00 179.24 177.04 1jv3 n GLN 86 N -2.43 1.53 -0.19 4.15 6.02 -0.40 -4.65 117.38 121.40 1jv3 n GLN 86 Ca -0.01 -1.22 -0.02 0.00 -0.01 0.00 0.00 57.00 55.74 1jv3 n GLN 86 Cb 0.11 -1.31 0.08 0.00 1.02 0.00 0.00 30.24 30.14 1jv3 n GLN 86 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1jv3 h LEU 87 N 2.72 0.38 -0.37 1.08 3.38 -1.49 -1.48 115.31 119.52 1jv3 h LEU 87 Ca 0.00 0.04 0.05 0.00 0.09 0.00 0.00 57.88 58.06 1jv3 h LEU 87 Cb 0.65 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.34 1jv3 h LEU 87 CO 0.00 0.25 0.12 -0.61 0.09 0.00 0.00 178.44 178.29 1jv3 h GLN 88 N 0.53 0.25 -0.45 1.13 5.75 -1.82 0.23 115.11 120.72 1jv3 h GLN 88 Ca 0.27 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 58.73 1jv3 h GLN 88 Cb 0.22 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.69 1jv3 h GLN 88 CO -0.21 0.17 0.19 0.00 -2.65 0.00 0.00 178.83 176.33 1jv3 h ALA 89 N 1.25 0.58 -0.59 3.38 0.00 -1.74 -1.33 119.26 120.81 1jv3 h ALA 89 Ca 0.17 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1jv3 h ALA 89 Cb 0.16 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1jv3 h ALA 89 CO -0.19 0.18 0.06 -1.49 0.00 0.00 0.00 179.25 177.81 1jv3 h TRP 90 N 0.58 1.04 -0.48 0.00 6.55 -0.77 -2.01 115.95 120.86 1jv3 h TRP 90 Ca 0.15 -0.15 -0.03 0.00 0.95 0.00 0.00 58.89 59.81 1jv3 h TRP 90 Cb 0.17 -0.29 -0.02 0.00 -0.86 0.00 0.00 29.16 28.16 1jv3 h TRP 90 CO -0.00 0.90 0.17 1.49 -1.05 0.00 0.00 178.44 179.95 1jv3 h GLU 91 N 0.92 0.74 -0.62 0.49 4.81 -0.33 -0.76 114.58 119.83 1jv3 h GLU 91 Ca 0.18 -0.15 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1jv3 h GLU 91 Cb 0.45 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.68 1jv3 h GLU 91 CO 0.02 0.69 0.39 0.77 -0.73 0.00 0.00 179.01 180.14 1jv3 h SER 92 N 0.64 0.65 -0.35 1.04 0.02 -1.05 0.12 113.55 114.62 1jv3 h SER 92 Ca 0.16 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1jv3 h SER 92 Cb 0.24 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 1jv3 h SER 92 CO -0.01 0.46 0.20 -0.08 -1.14 0.00 0.00 176.83 176.27 1jv3 h GLU 93 N 0.78 0.49 -0.34 3.45 4.57 -1.06 -0.41 114.58 122.05 1jv3 h GLU 93 Ca 0.24 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.36 1jv3 h GLU 93 Cb -0.02 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.46 1jv3 h GLU 93 CO -0.08 0.38 0.18 0.78 -1.18 0.00 0.00 179.01 179.09 1jv3 h GLY 94 N 0.45 0.52 1.41 1.92 0.00 -0.43 -0.72 103.07 106.22 1jv3 h GLY 94 Ca 0.13 -0.24 -0.04 0.00 0.00 0.00 0.00 47.33 47.18 1jv3 h GLY 94 CO -0.02 0.23 0.14 1.41 0.00 0.00 0.00 176.54 178.30 1jv3 h LEU 95 N 0.43 0.69 -0.04 3.11 3.38 -0.65 -1.66 115.31 120.57 1jv3 h LEU 95 Ca 0.12 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1jv3 h LEU 95 Cb 0.07 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1jv3 h LEU 95 CO -0.02 0.67 0.02 0.15 0.09 0.00 0.00 178.44 179.35 1jv3 h PHE 96 N 0.73 0.06 -1.00 1.13 3.57 -0.71 0.13 116.94 120.85 1jv3 h PHE 96 Ca 0.17 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.72 1jv3 h PHE 96 Cb 0.24 -0.02 -0.07 0.00 2.79 0.00 0.00 35.95 38.90 1jv3 h PHE 96 CO 0.01 0.18 0.65 1.96 -2.23 0.00 0.00 178.31 178.88 1jv3 h GLN 97 N -0.07 1.16 -0.32 1.11 1.08 -0.81 -1.40 115.11 115.85 1jv3 h GLN 97 Ca 0.01 -0.07 -0.03 0.00 -1.45 0.00 0.00 58.65 57.12 1jv3 h GLN 97 Cb 0.14 -0.26 -0.01 0.00 -0.05 0.00 0.00 27.48 27.29 1jv3 h GLN 97 CO -0.00 0.77 0.09 0.82 -0.95 0.00 0.00 178.83 179.55 1jv3 h ILE 98 N 1.19 1.21 0.00 2.54 2.04 -0.92 -1.84 117.51 121.73 1jv3 h ILE 98 Ca 0.43 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.57 1jv3 h ILE 98 Cb 0.14 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1jv3 h ILE 98 CO -0.16 0.24 -0.03 0.77 0.00 0.00 0.00 178.15 178.97 1jv3 h SER 99 N 0.37 0.00 -0.17 1.72 4.64 -0.05 -1.22 113.55 118.83 1jv3 h SER 99 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1jv3 h SER 99 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 1jv3 h SER 99 CO -0.00 0.03 0.00 0.00 -0.87 0.00 0.00 176.83 175.99 1jv3 n GLN 100 N -3.22 1.77 -2.15 4.77 1.13 -0.59 -4.75 117.38 114.34 1jv3 n GLN 100 Ca -0.01 -1.16 -0.18 0.00 -1.94 0.00 0.00 57.00 53.71 1jv3 n GLN 100 Cb 0.20 -1.40 -0.02 0.00 0.11 0.00 0.00 30.24 29.12 1jv3 n GLN 100 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1jv3 n ASN 101 N 0.39 -5.14 -1.41 1.08 3.02 -0.46 -4.89 115.26 107.85 1jv3 n ASN 101 Ca 0.16 0.08 0.11 0.00 -0.03 0.00 0.00 54.58 54.91 1jv3 n ASN 101 Cb 0.35 -4.22 0.33 0.00 -0.61 0.00 0.00 39.78 35.63 1jv3 n ASN 101 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1jv3 n LYS 102 N -2.65 2.93 -5.09 3.52 4.76 -0.72 -4.47 118.16 116.44 1jv3 n LYS 102 Ca -0.20 -2.72 -0.30 0.00 -2.87 0.00 0.00 58.31 52.22 1jv3 n LYS 102 Cb 0.64 -1.63 -0.17 0.00 -1.84 0.00 0.00 35.03 32.03 1jv3 n LYS 102 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1jv3 s VAL 103 N -1.16 1.82 0.15 -0.18 1.01 -1.25 -1.25 120.40 119.54 1jv3 s VAL 103 Ca 0.50 -0.92 0.04 0.00 0.00 0.00 0.00 61.98 61.60 1jv3 s VAL 103 Cb 0.27 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 1jv3 s VAL 103 CO 0.32 0.51 -0.09 0.00 0.00 0.00 0.00 175.10 175.84 1jv3 s ALA 104 N 0.10 1.48 0.19 5.51 0.00 -0.11 -3.88 121.76 125.04 1jv3 s ALA 104 Ca -0.09 -1.51 0.11 0.00 0.00 0.00 0.00 51.96 50.47 1jv3 s ALA 104 Cb -0.15 0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 1jv3 s ALA 104 CO 0.05 -0.11 -0.24 0.14 0.00 0.00 0.00 175.76 175.60 1jv3 s VAL 105 N -3.34 2.31 -0.13 0.00 -7.23 -0.52 -1.57 120.40 109.92 1jv3 s VAL 105 Ca 0.18 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.33 1jv3 s VAL 105 Cb 0.03 -2.09 0.04 0.00 0.56 0.00 0.00 36.38 34.92 1jv3 s VAL 105 CO 0.01 -0.11 0.02 -0.22 -0.31 0.00 0.00 175.10 174.49 1jv3 s LEU 106 N -2.61 0.87 -0.14 1.32 0.20 0.50 -1.34 118.68 117.47 1jv3 s LEU 106 Ca 0.20 -0.43 -0.17 0.00 0.69 0.00 0.00 54.13 54.42 1jv3 s LEU 106 Cb -0.08 -0.52 -0.04 0.00 -0.43 0.00 0.00 46.19 45.12 1jv3 s LEU 106 CO 0.09 -0.24 0.42 -0.22 -0.29 0.00 0.00 176.35 176.11 1jv3 s LEU 107 N 1.92 4.25 -0.51 -0.68 2.96 0.48 -1.79 118.68 125.30 1jv3 s LEU 107 Ca 0.02 0.70 -0.21 0.00 -0.22 0.00 0.00 54.13 54.42 1jv3 s LEU 107 Cb -0.14 -2.59 0.05 0.00 0.50 0.00 0.00 46.19 44.00 1jv3 s LEU 107 CO -0.07 0.01 0.74 -0.76 -1.32 0.00 0.00 176.35 174.96 1jv3 s LEU 108 N 0.70 4.57 -0.28 -0.68 1.43 -0.49 -0.78 118.68 123.14 1jv3 s LEU 108 Ca 0.23 -0.60 0.16 0.00 -1.03 0.00 0.00 54.13 52.89 1jv3 s LEU 108 Cb -0.14 -2.64 0.48 0.00 0.03 0.00 0.00 46.19 43.92 1jv3 s LEU 108 CO 0.08 -0.99 1.12 0.00 0.23 0.00 0.00 176.35 176.80 1jv3 n ALA 109 N 6.65 3.59 1.00 4.21 0.00 0.20 -3.26 120.51 132.90 1jv3 n ALA 109 Ca -0.03 -3.21 0.10 0.00 0.00 0.00 0.00 53.44 50.31 1jv3 n ALA 109 Cb 0.47 -0.68 -0.06 0.00 0.00 0.00 0.00 19.45 19.18 1jv3 n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jv3 n GLY 110 N -0.59 -0.98 3.71 0.00 0.00 -0.95 -4.33 105.19 102.05 1jv3 n GLY 110 Ca 0.21 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 1jv3 n GLY 110 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jv3 s GLY 111 N -2.97 1.41 0.00 -0.02 0.00 -1.26 -4.30 107.32 100.18 1jv3 s GLY 111 Ca 0.09 1.43 0.00 0.00 0.00 0.00 0.00 44.72 46.24 1jv3 s GLY 111 CO 0.83 2.84 0.00 0.61 0.00 0.00 0.00 173.10 177.38 1jv3 n GLN 112 N 4.53 3.47 -3.61 2.90 10.64 -1.26 -4.76 117.38 129.30 1jv3 n GLN 112 Ca 0.15 0.00 -0.22 0.00 -1.83 0.00 0.00 57.00 55.11 1jv3 n GLN 112 Cb 0.38 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.76 1jv3 n GLN 112 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1jv3 n GLY 113 N 5.00 -1.13 3.62 2.61 0.00 -1.26 -4.77 105.19 109.26 1jv3 n GLY 113 Ca 0.00 0.67 -0.43 0.00 0.00 0.00 0.00 46.02 46.26 1jv3 n GLY 113 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jv3 s THR 114 N -2.80 3.27 -0.76 2.61 2.01 -1.26 -4.79 115.64 113.93 1jv3 s THR 114 Ca 0.05 0.29 0.26 0.00 0.31 0.00 0.00 61.69 62.60 1jv3 s THR 114 Cb -0.01 -3.32 0.17 0.00 0.01 0.00 0.00 72.50 69.36 1jv3 s THR 114 CO 0.87 -0.17 1.60 -1.14 -0.69 0.00 0.00 174.62 175.09 1jv3 n ARG 115 N 8.26 0.22 0.00 4.92 0.63 -1.26 -2.95 116.66 126.48 1jv3 n ARG 115 Ca 0.24 0.12 0.14 0.00 -0.92 0.00 0.00 57.85 57.44 1jv3 n ARG 115 Cb 0.45 -1.70 0.77 0.00 0.45 0.00 0.00 32.46 32.43 1jv3 n ARG 115 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 1jv3 n LEU 116 N -2.04 0.00 0.00 6.15 4.77 -1.26 -4.11 117.00 120.50 1jv3 n LEU 116 Ca 0.05 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 1jv3 n LEU 116 Cb 0.41 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1jv3 n LEU 116 CO 0.33 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 1jv3 n GLY 117 N 0.99 0.48 3.54 -0.72 0.00 -1.15 -4.76 105.19 103.57 1jv3 n GLY 117 Ca 0.17 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.26 1jv3 n GLY 117 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1jv3 s VAL 118 N -2.00 1.70 -0.80 1.61 -7.23 -1.26 -5.07 120.40 107.36 1jv3 s VAL 118 Ca 0.00 -2.02 0.17 0.00 -1.81 0.00 0.00 61.98 58.32 1jv3 s VAL 118 Cb 0.00 -2.87 -0.19 0.00 0.56 0.00 0.00 36.38 33.88 1jv3 s VAL 118 CO 0.00 -0.03 0.73 0.00 -0.31 0.00 0.00 175.10 175.49 1jv3 n ALA 119 N -0.83 4.23 -2.26 1.32 0.00 -1.26 -4.35 120.51 117.36 1jv3 n ALA 119 Ca -0.04 -0.49 -0.22 0.00 0.00 0.00 0.00 53.44 52.69 1jv3 n ALA 119 Cb 0.66 -0.63 0.01 0.00 0.00 0.00 0.00 19.45 19.50 1jv3 n ALA 119 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1jv3 s TYR 120 N -2.67 3.12 0.59 0.00 -0.85 -1.26 -4.97 117.35 111.31 1jv3 s TYR 120 Ca 0.06 0.10 -0.18 0.00 -0.52 0.00 0.00 57.07 56.53 1jv3 s TYR 120 Cb 0.13 -2.37 -0.03 0.00 0.38 0.00 0.00 41.96 40.07 1jv3 s TYR 120 CO 0.72 -0.43 1.16 -1.25 -1.52 0.00 0.00 175.55 174.23 1jv3 s PRO 121 N -4.55 3.05 0.37 -3.49 0.04 -1.26 -4.93 135.00 124.23 1jv3 s PRO 121 Ca 0.50 1.66 0.12 0.00 0.04 0.00 0.00 61.00 63.32 1jv3 s PRO 121 Cb -0.10 -1.96 0.91 0.00 0.04 0.00 0.00 34.50 33.39 1jv3 s PRO 121 CO 0.37 -1.10 1.83 0.87 0.04 0.00 0.00 177.00 179.01 1jv3 h LYS 122 N 0.79 0.57 -0.27 4.56 1.57 -1.96 -0.80 116.57 121.04 1jv3 h LYS 122 Ca -0.49 -0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.33 1jv3 h LYS 122 Cb 1.27 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 1jv3 h LYS 122 CO 0.55 0.38 0.35 0.78 -0.57 0.00 0.00 179.45 180.94 1jv3 h GLY 123 N 0.59 0.00 -1.37 3.86 0.00 -1.92 0.12 103.07 104.36 1jv3 h GLY 123 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.83 1jv3 h GLY 123 CO -0.25 0.00 0.00 1.03 0.00 0.00 0.00 176.54 177.32 1jv3 n MET 124 N -3.58 2.02 -2.57 4.80 2.81 -0.31 -1.05 117.12 119.25 1jv3 n MET 124 Ca 0.04 -1.53 -0.40 0.00 -1.81 0.00 0.00 57.70 54.00 1jv3 n MET 124 Cb 0.49 -1.44 -0.05 0.00 -0.71 0.00 0.00 33.22 31.51 1jv3 n MET 124 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 1jv3 s TYR 125 N -1.70 3.68 -0.41 2.03 5.04 0.43 -4.86 117.35 121.56 1jv3 s TYR 125 Ca 0.34 1.76 -0.09 0.00 -2.44 0.00 0.00 57.07 56.65 1jv3 s TYR 125 Cb 0.19 -3.17 0.07 0.00 0.35 0.00 0.00 41.96 39.40 1jv3 s TYR 125 CO 0.28 -0.23 0.24 0.34 -1.34 0.00 0.00 175.55 174.84 1jv3 s ASP 126 N -1.04 5.61 0.00 4.32 -1.08 -1.26 -3.06 116.67 120.15 1jv3 s ASP 126 Ca 0.45 -1.45 0.24 0.00 -0.52 0.00 0.00 52.55 51.26 1jv3 s ASP 126 Cb -0.29 -1.97 1.42 0.00 -1.46 0.00 0.00 42.92 40.62 1jv3 s ASP 126 CO 0.37 -0.51 1.80 1.33 0.52 0.00 0.00 175.17 178.68 1jv3 n VAL 127 N 4.90 0.00 -0.26 1.11 0.24 -1.26 -4.83 118.33 118.23 1jv3 n VAL 127 Ca -0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.20 1jv3 n VAL 127 Cb 0.43 -0.59 0.00 0.00 -1.47 0.00 0.00 33.84 32.21 1jv3 n VAL 127 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1jv3 n GLY 128 N 0.55 1.45 3.78 7.63 0.00 -1.26 -4.52 105.19 112.82 1jv3 n GLY 128 Ca 0.18 -0.15 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 1jv3 n GLY 128 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jv3 s LEU 129 N 0.00 3.33 0.31 0.99 1.43 -1.26 -4.87 118.68 118.61 1jv3 s LEU 129 Ca 0.00 1.90 0.06 0.00 -1.03 0.00 0.00 54.13 55.06 1jv3 s LEU 129 Cb 0.00 -4.54 0.72 0.00 0.03 0.00 0.00 46.19 42.40 1jv3 s LEU 129 CO 0.00 -1.59 1.82 -0.65 0.23 0.00 0.00 176.35 176.17 1jv3 h PRO 130 N -0.14 0.78 0.00 1.29 0.11 -1.98 0.34 132.00 132.41 1jv3 h PRO 130 Ca -0.46 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1jv3 h PRO 130 Cb 1.24 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1jv3 h PRO 130 CO 0.55 0.52 0.00 -1.13 -0.21 0.00 0.00 178.00 177.72 1jv3 n SER 131 N -4.65 0.50 -0.45 -2.05 3.41 -1.26 -4.92 113.62 104.20 1jv3 n SER 131 Ca 0.20 0.55 -0.06 0.00 -0.26 0.00 0.00 58.87 59.31 1jv3 n SER 131 Cb 0.49 -0.69 -0.03 0.00 -0.26 0.00 0.00 64.21 63.73 1jv3 n SER 131 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1jv3 n ARG 132 N -1.98 -1.58 -1.94 4.33 1.74 0.12 -4.96 116.66 112.40 1jv3 n ARG 132 Ca 0.06 0.66 -0.38 0.00 -0.77 0.00 0.00 57.85 57.42 1jv3 n ARG 132 Cb 0.38 -4.95 0.02 0.00 -1.02 0.00 0.00 32.46 26.89 1jv3 n ARG 132 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1jv3 s LYS 133 N -2.32 3.34 0.67 5.56 1.02 -1.26 -4.85 119.74 121.90 1jv3 s LYS 133 Ca 0.00 2.08 -0.07 0.00 0.02 0.00 0.00 55.97 58.00 1jv3 s LYS 133 Cb 0.00 -2.30 0.04 0.00 -0.52 0.00 0.00 37.83 35.04 1jv3 s LYS 133 CO 0.00 -0.98 0.99 0.95 -0.92 0.00 0.00 175.35 175.38 1jv3 s THR 134 N -1.38 2.93 0.25 2.17 -4.23 -1.26 -4.51 115.64 109.60 1jv3 s THR 134 Ca 0.69 -0.07 -0.05 0.00 -1.18 0.00 0.00 61.69 61.09 1jv3 s THR 134 Cb -0.37 -3.23 0.22 0.00 1.34 0.00 0.00 72.50 70.47 1jv3 s THR 134 CO 0.43 -0.25 1.85 -0.07 -0.54 0.00 0.00 174.62 176.04 1jv3 h LEU 135 N -0.46 0.83 -0.25 4.79 3.38 -1.43 -1.48 115.31 120.68 1jv3 h LEU 135 Ca -0.45 0.02 0.05 0.00 0.09 0.00 0.00 57.88 57.59 1jv3 h LEU 135 Cb 1.29 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.84 1jv3 h LEU 135 CO 0.61 0.52 -0.05 -0.26 0.09 0.00 0.00 178.44 179.35 1jv3 h PHE 136 N 0.95 -0.10 -0.53 1.13 0.05 -1.42 -0.73 116.94 116.30 1jv3 h PHE 136 Ca 0.39 0.02 -0.10 0.00 3.82 0.00 0.00 57.97 62.10 1jv3 h PHE 136 Cb 0.22 0.08 -0.02 0.00 2.00 0.00 0.00 35.95 38.24 1jv3 h PHE 136 CO -0.03 -0.09 -0.07 0.37 -0.18 0.00 0.00 178.31 178.31 1jv3 h GLN 137 N 0.02 0.98 -1.01 1.51 4.15 -1.69 -1.39 115.11 117.68 1jv3 h GLN 137 Ca 0.12 -0.35 0.02 0.00 0.77 0.00 0.00 58.65 59.21 1jv3 h GLN 137 Cb 0.18 -0.07 -0.05 0.00 0.21 0.00 0.00 27.48 27.74 1jv3 h GLN 137 CO -0.24 1.02 0.67 0.82 -1.93 0.00 0.00 178.83 179.16 1jv3 h ILE 138 N 0.85 1.24 -0.40 2.39 2.04 -0.99 -0.59 117.51 122.05 1jv3 h ILE 138 Ca 0.14 -0.46 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 1jv3 h ILE 138 Cb 0.62 -0.22 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 1jv3 h ILE 138 CO 0.04 0.24 0.05 1.56 0.00 0.00 0.00 178.15 180.05 1jv3 h GLN 139 N 1.34 0.67 -0.79 2.37 4.20 -0.75 -2.30 115.11 119.86 1jv3 h GLN 139 Ca 0.38 -0.19 0.02 0.00 0.06 0.00 0.00 58.65 58.92 1jv3 h GLN 139 Cb -0.12 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.54 1jv3 h GLN 139 CO -0.09 0.73 0.51 0.00 -0.67 0.00 0.00 178.83 179.30 1jv3 h ALA 140 N 0.92 1.02 0.00 3.87 0.00 -0.82 -2.20 119.26 122.05 1jv3 h ALA 140 Ca 0.12 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1jv3 h ALA 140 Cb 0.39 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1jv3 h ALA 140 CO 0.01 0.35 -0.46 0.93 0.00 0.00 0.00 179.25 180.08 1jv3 h GLU 141 N 1.01 0.00 -0.25 0.00 5.08 -0.95 -0.89 114.58 118.59 1jv3 h GLU 141 Ca 0.31 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.51 1jv3 h GLU 141 Cb -0.04 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1jv3 h GLU 141 CO -0.09 0.46 -0.49 0.00 -1.00 0.00 0.00 179.01 177.89 1jv3 h ARG 142 N 0.00 0.67 0.06 2.33 3.08 -0.89 0.13 114.38 119.75 1jv3 h ARG 142 Ca -0.00 -0.39 -0.00 0.00 0.07 0.00 0.00 59.98 59.66 1jv3 h ARG 142 Cb 0.89 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.97 1jv3 h ARG 142 CO 0.06 1.00 -0.03 0.82 -1.07 0.00 0.00 179.97 180.76 1jv3 h ILE 143 N 0.53 1.08 -0.80 2.04 2.04 -0.98 -2.01 117.51 119.41 1jv3 h ILE 143 Ca 0.03 -0.43 0.08 0.00 1.00 0.00 0.00 64.86 65.54 1jv3 h ILE 143 Cb 1.04 1.36 -0.07 0.00 -0.74 0.00 0.00 36.82 38.41 1jv3 h ILE 143 CO 0.10 0.11 0.46 -0.07 0.00 0.00 0.00 178.15 178.74 1jv3 h LEU 144 N -0.27 0.66 -0.18 1.44 3.38 -1.10 -1.03 115.31 118.22 1jv3 h LEU 144 Ca -0.01 0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.04 1jv3 h LEU 144 Cb 0.24 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1jv3 h LEU 144 CO 0.01 0.39 -0.04 0.50 0.09 0.00 0.00 178.44 179.40 1jv3 h LYS 145 N 0.79 0.01 -0.53 1.13 1.63 -0.44 -0.91 116.57 118.24 1jv3 h LYS 145 Ca 0.38 -0.00 -0.06 0.00 -0.85 0.00 0.00 60.65 60.11 1jv3 h LYS 145 Cb 0.31 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.91 1jv3 h LYS 145 CO -0.23 0.01 0.08 -0.07 -3.45 0.00 0.00 179.45 175.79 1jv3 h LEU 146 N 0.01 0.80 -0.19 5.20 3.38 -0.79 0.27 115.31 123.99 1jv3 h LEU 146 Ca 0.09 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.91 1jv3 h LEU 146 Cb 0.13 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1jv3 h LEU 146 CO -0.18 0.82 0.07 1.56 0.09 0.00 0.00 178.44 180.81 1jv3 h GLN 147 N 0.81 0.16 -0.06 1.13 4.20 -0.67 0.12 115.11 120.80 1jv3 h GLN 147 Ca 0.17 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.87 1jv3 h GLN 147 Cb 0.37 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.11 1jv3 h GLN 147 CO 0.01 0.11 0.03 1.96 -0.67 0.00 0.00 178.83 180.27 1jv3 h GLN 148 N 0.17 0.08 -0.97 1.46 7.50 -0.68 -1.27 115.11 121.40 1jv3 h GLN 148 Ca 0.08 -0.01 0.02 0.00 0.50 0.00 0.00 58.65 59.24 1jv3 h GLN 148 Cb 0.05 -0.02 -0.05 0.00 0.05 0.00 0.00 27.48 27.51 1jv3 h GLN 148 CO -0.08 0.13 0.64 0.28 -1.50 0.00 0.00 178.83 178.30 1jv3 h VAL 149 N 0.02 1.22 -0.67 -0.54 2.07 -0.21 -1.66 116.25 116.48 1jv3 h VAL 149 Ca 0.02 -0.44 -0.05 0.00 0.82 0.00 0.00 66.70 67.05 1jv3 h VAL 149 Cb 0.07 -0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 29.63 1jv3 h VAL 149 CO -0.00 0.23 0.23 0.00 0.02 0.00 0.00 177.57 178.05 1jv3 h ALA 150 N 1.37 0.87 0.00 1.67 0.00 -0.61 -2.70 119.26 119.87 1jv3 h ALA 150 Ca 0.37 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1jv3 h ALA 150 Cb -0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 1jv3 h ALA 150 CO -0.09 0.53 -0.19 1.49 0.00 0.00 0.00 179.25 180.99 1jv3 h GLU 151 N 0.97 0.00 0.00 0.00 4.81 -0.34 -2.17 114.58 117.85 1jv3 h GLU 151 Ca 0.22 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.35 1jv3 h GLU 151 Cb 0.27 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 1jv3 h GLU 151 CO -0.01 0.19 -0.48 0.87 -0.73 0.00 0.00 179.01 178.85 1jv3 h LYS 152 N 0.00 0.00 -0.02 1.92 1.57 -1.05 0.57 116.57 119.56 1jv3 h LYS 152 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1jv3 h LYS 152 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1jv3 h LYS 152 CO 0.02 0.48 -0.25 0.66 -0.57 0.00 0.00 179.45 179.80 1jv3 n TYR 153 N -3.23 0.00 -0.03 -1.35 0.53 -1.10 -4.41 117.16 107.57 1jv3 n TYR 153 Ca 0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.90 1jv3 n TYR 153 Cb 0.72 -0.01 0.00 0.00 -1.03 0.00 0.00 39.34 39.02 1jv3 n TYR 153 CO 0.00 0.00 0.00 0.66 -1.02 0.00 0.00 176.86 176.50 1jv3 n TYR 154 N 0.49 0.00 0.00 -0.72 4.02 -0.83 -5.04 117.16 115.07 1jv3 n TYR 154 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.01 1jv3 n TYR 154 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.83 1jv3 n TYR 154 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1jv3 n GLY 155 N 0.23 2.80 3.91 2.72 0.00 0.20 -4.99 105.19 110.06 1jv3 n GLY 155 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1jv3 n GLY 155 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jv3 s ASN 156 N -0.55 6.43 0.24 1.61 2.20 -1.25 -4.93 114.94 118.69 1jv3 s ASN 156 Ca 0.00 0.43 -0.30 0.00 -0.94 0.00 0.00 52.86 52.05 1jv3 s ASN 156 Cb 0.00 -2.03 -0.09 0.00 -2.00 0.00 0.00 41.25 37.14 1jv3 s ASN 156 CO 0.00 0.12 1.09 -0.54 -2.94 0.00 0.00 177.10 174.83 1jv3 s LYS 157 N -2.53 4.64 0.11 3.55 1.02 -1.26 -4.04 119.74 121.23 1jv3 s LYS 157 Ca 0.37 1.75 0.02 0.00 0.02 0.00 0.00 55.97 58.14 1jv3 s LYS 157 Cb -0.13 -3.23 -0.04 0.00 -0.52 0.00 0.00 37.83 33.91 1jv3 s LYS 157 CO 0.26 0.18 -0.07 0.00 -0.92 0.00 0.00 175.35 174.80 1jv3 s ILE 159 N -3.58 1.63 -0.35 0.00 -1.09 -1.26 -4.86 121.20 111.68 1jv3 s ILE 159 Ca 0.13 -1.09 0.02 0.00 -2.23 0.00 0.00 60.65 57.48 1jv3 s ILE 159 Cb 0.05 -1.40 0.11 0.00 -1.58 0.00 0.00 42.46 39.64 1jv3 s ILE 159 CO -0.03 0.27 0.10 -0.63 -1.23 0.00 0.00 174.94 173.42 1jv3 s ILE 160 N -0.70 1.70 0.49 2.92 1.01 -1.26 -4.58 121.20 120.78 1jv3 s ILE 160 Ca 0.07 -2.09 -0.24 0.00 0.00 0.00 0.00 60.65 58.40 1jv3 s ILE 160 Cb -0.08 -2.26 -0.07 0.00 0.01 0.00 0.00 42.46 40.06 1jv3 s ILE 160 CO 0.01 -0.67 1.40 -2.84 0.00 0.00 0.00 174.94 172.84 1jv3 s PRO 161 N 1.03 3.45 -0.43 2.79 0.02 -1.25 -4.81 135.00 135.80 1jv3 s PRO 161 Ca 0.12 2.34 0.02 0.00 0.02 0.00 0.00 61.00 63.49 1jv3 s PRO 161 Cb -0.19 -2.48 0.12 0.00 0.02 0.00 0.00 34.50 31.96 1jv3 s PRO 161 CO -0.13 -0.98 0.17 -0.46 -0.33 0.00 0.00 177.00 175.27 1jv3 s TRP 162 N -1.25 3.55 0.03 6.54 -0.00 -0.15 -1.44 118.94 126.24 1jv3 s TRP 162 Ca 0.65 -2.90 -0.24 0.00 -0.00 0.00 0.00 56.10 53.61 1jv3 s TRP 162 Cb -0.42 -2.99 -0.05 0.00 -0.00 0.00 0.00 33.47 30.00 1jv3 s TRP 162 CO 0.53 -0.89 0.73 0.71 -0.00 0.00 0.00 176.95 178.02 1jv3 s TYR 163 N 0.56 3.73 -0.13 5.86 1.51 -0.45 -0.92 117.35 127.50 1jv3 s TYR 163 Ca 0.12 1.41 -0.00 0.00 -1.01 0.00 0.00 57.07 57.60 1jv3 s TYR 163 Cb -0.22 -2.77 0.02 0.00 -0.11 0.00 0.00 41.96 38.89 1jv3 s TYR 163 CO -0.05 0.29 -0.11 0.42 -1.11 0.00 0.00 175.55 175.00 1jv3 s ILE 164 N -0.09 1.28 -0.26 2.71 1.01 -0.18 -0.39 121.20 125.29 1jv3 s ILE 164 Ca 0.37 -0.46 -0.16 0.00 0.00 0.00 0.00 60.65 60.39 1jv3 s ILE 164 Cb -0.20 -1.25 -0.03 0.00 0.01 0.00 0.00 42.46 40.98 1jv3 s ILE 164 CO 0.22 0.40 0.45 -0.32 0.00 0.00 0.00 174.94 175.68 1jv3 s MET 165 N 1.60 4.06 0.49 2.79 -2.45 0.04 -1.55 119.30 124.28 1jv3 s MET 165 Ca 0.05 0.20 0.05 0.00 -1.25 0.00 0.00 55.69 54.74 1jv3 s MET 165 Cb -0.13 -3.64 -0.01 0.00 1.25 0.00 0.00 34.83 32.31 1jv3 s MET 165 CO -0.09 -0.29 0.24 0.95 1.05 0.00 0.00 175.02 176.88 1jv3 s THR 166 N 2.10 1.81 0.45 10.11 -4.23 -0.46 -0.62 115.64 124.79 1jv3 s THR 166 Ca 0.18 -1.67 0.03 0.00 -1.18 0.00 0.00 61.69 59.05 1jv3 s THR 166 Cb -0.16 -2.48 -0.02 0.00 1.34 0.00 0.00 72.50 71.18 1jv3 s THR 166 CO 0.09 0.00 0.06 -0.94 -0.54 0.00 0.00 174.62 173.30 1jv3 s SER 167 N -4.06 3.44 0.55 3.99 1.04 -1.26 -0.72 113.70 116.67 1jv3 s SER 167 Ca 0.31 -1.64 0.22 0.00 0.48 0.00 0.00 55.95 55.32 1jv3 s SER 167 Cb 0.01 0.45 1.45 0.00 0.10 0.00 0.00 66.02 68.03 1jv3 s SER 167 CO 0.18 -0.86 2.12 1.23 0.98 0.00 0.00 173.24 176.88 1jv3 h GLY 168 N 1.60 0.00 0.39 7.32 0.00 -1.90 -0.12 103.07 110.36 1jv3 h GLY 168 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1jv3 h GLY 168 CO 0.66 0.00 -0.26 -2.13 0.00 0.00 0.00 176.54 174.81 1jv3 n ARG 169 N -4.27 0.74 0.00 4.80 3.00 -1.26 -4.27 116.66 115.40 1jv3 n ARG 169 Ca 0.01 -0.42 0.00 0.00 -0.00 0.00 0.00 57.85 57.44 1jv3 n ARG 169 Cb 0.26 -1.49 0.00 0.00 0.00 0.00 0.00 32.46 31.23 1jv3 n ARG 169 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1jv3 n THR 170 N -0.77 0.00 0.05 5.15 -2.24 -0.53 -4.89 114.28 111.05 1jv3 n THR 170 Ca 0.12 -0.20 -0.10 0.00 -2.27 0.00 0.00 64.05 61.59 1jv3 n THR 170 Cb 0.34 0.70 -0.06 0.00 -2.10 0.00 0.00 70.33 69.21 1jv3 n THR 170 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1jv3 h MET 171 N 0.00 -0.43 0.15 -0.78 -1.53 -1.25 -1.71 114.93 109.39 1jv3 h MET 171 Ca 0.00 0.03 0.01 0.00 -3.44 0.00 0.00 59.70 56.30 1jv3 h MET 171 Cb 0.00 0.10 -0.04 0.00 -0.55 0.00 0.00 31.60 31.11 1jv3 h MET 171 CO 0.00 -0.28 -0.50 0.93 0.14 0.00 0.00 176.91 177.20 1jv3 h GLU 172 N -0.44 -0.71 -0.96 0.39 3.07 -1.86 -0.86 114.58 113.21 1jv3 h GLU 172 Ca 0.00 0.05 0.07 0.00 -0.50 0.00 0.00 59.36 58.98 1jv3 h GLU 172 Cb 0.46 0.16 -0.07 0.00 -0.84 0.00 0.00 28.75 28.47 1jv3 h GLU 172 CO -0.21 -0.47 0.62 0.66 -1.40 0.00 0.00 179.01 178.21 1jv3 h SER 173 N -0.74 0.96 -0.32 1.42 4.64 -1.90 -1.62 113.55 116.00 1jv3 h SER 173 Ca -0.01 0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1jv3 h SER 173 Cb 0.73 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 1jv3 h SER 173 CO -0.25 0.60 0.06 0.74 -0.87 0.00 0.00 176.83 177.11 1jv3 h THR 174 N 1.08 1.23 -0.54 2.95 2.02 -0.98 -1.12 112.91 117.56 1jv3 h THR 174 Ca 0.42 -0.81 -0.01 0.00 0.77 0.00 0.00 66.41 66.78 1jv3 h THR 174 Cb 0.23 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.76 1jv3 h THR 174 CO -0.17 0.27 0.29 0.11 0.37 0.00 0.00 175.52 176.39 1jv3 h LYS 175 N 0.36 0.75 -0.37 6.66 1.57 -0.65 -2.01 116.57 122.89 1jv3 h LYS 175 Ca 0.10 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1jv3 h LYS 175 Cb 0.34 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 1jv3 h LYS 175 CO 0.01 0.59 0.11 0.93 -0.57 0.00 0.00 179.45 180.51 1jv3 h GLU 176 N 0.72 0.57 -0.30 3.15 5.08 -1.23 -2.07 114.58 120.51 1jv3 h GLU 176 Ca 0.19 -0.12 0.04 0.00 -1.00 0.00 0.00 59.36 58.46 1jv3 h GLU 176 Cb 0.05 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 1jv3 h GLU 176 CO -0.03 0.59 0.07 0.35 -1.00 0.00 0.00 179.01 178.99 1jv3 h PHE 177 N 0.44 0.11 -0.06 4.33 3.57 -1.00 0.10 116.94 124.43 1jv3 h PHE 177 Ca 0.12 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.63 1jv3 h PHE 177 Cb 0.26 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 38.99 1jv3 h PHE 177 CO 0.01 0.03 0.04 0.74 -2.23 0.00 0.00 178.31 176.90 1jv3 h PHE 178 N 0.18 0.09 -0.50 0.41 -1.00 -1.28 -1.42 116.94 113.41 1jv3 h PHE 178 Ca 0.14 -0.00 0.08 0.00 2.81 0.00 0.00 57.97 61.00 1jv3 h PHE 178 Cb 0.14 -0.03 -0.07 0.00 3.61 0.00 0.00 35.95 39.61 1jv3 h PHE 178 CO -0.17 0.13 0.13 1.15 -1.61 0.00 0.00 178.31 177.94 1jv3 h THR 179 N 0.02 0.75 -0.48 -1.55 2.02 -1.01 0.10 112.91 112.77 1jv3 h THR 179 Ca 0.02 -0.09 0.07 0.00 0.77 0.00 0.00 66.41 67.18 1jv3 h THR 179 Cb 0.07 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 66.91 1jv3 h THR 179 CO -0.00 0.05 0.32 0.50 0.37 0.00 0.00 175.52 176.76 1jv3 h LYS 180 N 0.27 0.35 -0.65 6.66 3.64 -0.53 -1.48 116.57 124.84 1jv3 h LYS 180 Ca 0.25 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 1jv3 h LYS 180 Cb 0.32 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1jv3 h LYS 180 CO -0.30 0.23 0.00 0.72 -2.27 0.00 0.00 179.45 177.83 1jv3 n HIS 181 N -4.47 1.55 -3.54 1.91 8.25 0.23 -4.93 115.22 114.22 1jv3 n HIS 181 Ca 0.07 -0.60 -0.26 0.00 -0.26 0.00 0.00 57.72 56.67 1jv3 n HIS 181 Cb 0.29 -0.28 0.02 0.00 1.12 0.00 0.00 29.99 31.13 1jv3 n HIS 181 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1jv3 n LYS 182 N 1.01 -4.56 -2.38 -0.41 5.02 -0.49 -1.11 118.16 115.24 1jv3 n LYS 182 Ca 0.25 0.60 -0.16 0.00 -2.02 0.00 0.00 58.31 56.98 1jv3 n LYS 182 Cb 0.92 -5.42 -0.01 0.00 -0.02 0.00 0.00 35.03 30.50 1jv3 n LYS 182 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1jv3 n TYR 183 N -4.36 -1.18 -1.37 2.13 4.02 -0.65 -2.69 117.16 113.06 1jv3 n TYR 183 Ca -0.01 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.76 1jv3 n TYR 183 Cb 0.55 -3.31 -0.05 0.00 -0.02 0.00 0.00 39.34 36.50 1jv3 n TYR 183 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1jv3 n PHE 184 N -3.61 -0.40 0.00 -0.72 3.01 -0.27 -0.50 117.46 114.97 1jv3 n PHE 184 Ca -0.19 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.27 1jv3 n PHE 184 Cb 0.64 -2.50 0.00 0.00 -0.01 0.00 0.00 39.48 37.62 1jv3 n PHE 184 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1jv3 n GLY 185 N -0.23 0.54 3.95 1.37 0.00 -1.09 -4.83 105.19 104.89 1jv3 n GLY 185 Ca -0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.66 1jv3 n GLY 185 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jv3 s LEU 186 N 0.00 3.32 -0.01 0.99 1.43 0.34 -5.06 118.68 119.69 1jv3 s LEU 186 Ca 0.00 0.27 -0.22 0.00 -1.03 0.00 0.00 54.13 53.15 1jv3 s LEU 186 Cb 0.00 -3.11 -0.05 0.00 0.03 0.00 0.00 46.19 43.06 1jv3 s LEU 186 CO 0.00 -1.06 0.64 -0.54 0.23 0.00 0.00 176.35 175.62 1jv3 s LYS 187 N -4.80 4.37 0.40 1.70 1.02 -1.26 -4.65 119.74 116.51 1jv3 s LYS 187 Ca 0.54 0.80 0.17 0.00 0.02 0.00 0.00 55.97 57.51 1jv3 s LYS 187 Cb -0.10 -3.37 1.06 0.00 -0.52 0.00 0.00 37.83 34.90 1jv3 s LYS 187 CO 0.40 0.30 1.81 -0.22 -0.92 0.00 0.00 175.35 176.72 1jv3 h LYS 188 N 5.87 0.42 0.00 1.68 3.64 -1.93 0.22 116.57 126.47 1jv3 h LYS 188 Ca -0.44 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1jv3 h LYS 188 Cb 1.20 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1jv3 h LYS 188 CO 0.71 0.28 0.00 1.05 -2.27 0.00 0.00 179.45 179.22 1jv3 h GLU 189 N 0.43 0.00 -0.45 1.90 4.11 -2.04 -2.89 114.58 115.65 1jv3 h GLU 189 Ca 0.54 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.97 1jv3 h GLU 189 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 1jv3 h GLU 189 CO -0.25 0.00 0.00 0.09 0.07 0.00 0.00 179.01 178.92 1jv3 n ASN 190 N -2.59 4.84 -3.83 3.06 3.02 0.76 -4.78 115.26 115.74 1jv3 n ASN 190 Ca 0.01 -2.89 -0.29 0.00 -0.03 0.00 0.00 54.58 51.38 1jv3 n ASN 190 Cb 0.25 -0.61 -0.16 0.00 -0.61 0.00 0.00 39.78 38.65 1jv3 n ASN 190 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1jv3 s VAL 191 N -2.64 1.07 -0.34 2.41 1.01 -1.09 -0.98 120.40 119.84 1jv3 s VAL 191 Ca 0.48 -1.02 -0.08 0.00 0.00 0.00 0.00 61.98 61.36 1jv3 s VAL 191 Cb 0.37 -1.51 0.03 0.00 0.00 0.00 0.00 36.38 35.27 1jv3 s VAL 191 CO 0.14 -0.24 0.13 -0.63 0.00 0.00 0.00 175.10 174.50 1jv3 s ILE 192 N 1.59 4.09 0.16 2.22 1.09 -0.10 -4.97 121.20 125.28 1jv3 s ILE 192 Ca -0.01 -0.95 -0.20 0.00 -1.10 0.00 0.00 60.65 58.39 1jv3 s ILE 192 Cb -0.18 -3.26 -0.08 0.00 -1.06 0.00 0.00 42.46 37.88 1jv3 s ILE 192 CO -0.10 -0.14 0.67 -0.36 -0.10 0.00 0.00 174.94 174.91 1jv3 s PHE 193 N 1.47 3.75 -0.19 3.97 0.40 -1.26 -1.01 117.98 125.11 1jv3 s PHE 193 Ca 0.00 1.37 -0.16 0.00 -0.60 0.00 0.00 56.93 57.54 1jv3 s PHE 193 Cb -0.19 -2.58 0.05 0.00 0.51 0.00 0.00 43.02 40.81 1jv3 s PHE 193 CO 0.04 0.46 0.49 -0.59 0.70 0.00 0.00 175.22 176.32 1jv3 s PHE 194 N -1.31 -0.56 -0.04 0.36 -0.12 -0.59 -4.93 117.98 110.79 1jv3 s PHE 194 Ca 0.37 1.34 -0.15 0.00 -0.05 0.00 0.00 56.93 58.44 1jv3 s PHE 194 Cb -0.19 0.20 -0.05 0.00 -0.63 0.00 0.00 43.02 42.35 1jv3 s PHE 194 CO 0.21 -0.27 0.39 -1.14 -0.05 0.00 0.00 175.22 174.36 1jv3 s GLN 195 N 0.40 3.98 0.57 1.99 0.74 -1.26 -1.36 119.66 124.71 1jv3 s GLN 195 Ca -0.01 0.35 -0.03 0.00 0.05 0.00 0.00 55.36 55.72 1jv3 s GLN 195 Cb -0.04 -3.27 0.02 0.00 1.10 0.00 0.00 33.01 30.82 1jv3 s GLN 195 CO -0.01 0.58 0.85 1.14 -0.55 0.00 0.00 175.29 177.30 1jv3 s GLN 196 N -0.70 2.77 1.04 1.67 -2.07 0.10 -4.79 119.66 117.68 1jv3 s GLN 196 Ca 0.23 -0.28 -0.18 0.00 -1.82 0.00 0.00 55.36 53.31 1jv3 s GLN 196 Cb -0.16 -2.35 0.24 0.00 -1.09 0.00 0.00 33.01 29.65 1jv3 s GLN 196 CO 0.11 -0.69 1.31 0.41 -1.32 0.00 0.00 175.29 175.12 1jv3 n GLY 197 N -2.49 -1.74 3.09 2.60 0.00 -1.26 -4.48 105.19 100.92 1jv3 n GLY 197 Ca 0.05 -1.67 -0.08 0.00 0.00 0.00 0.00 46.02 44.31 1jv3 n GLY 197 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1jv3 s MET 198 N -5.89 0.61 0.03 1.61 1.00 -1.26 -2.55 119.30 112.85 1jv3 s MET 198 Ca 0.76 -1.15 0.03 0.00 0.00 0.00 0.00 55.69 55.33 1jv3 s MET 198 Cb -0.03 0.09 -0.02 0.00 0.00 0.00 0.00 34.83 34.87 1jv3 s MET 198 CO 0.54 -0.08 -0.09 -0.51 0.00 0.00 0.00 175.02 174.89 1jv3 s LEU 199 N -2.70 2.18 0.41 -0.03 1.43 -0.12 -4.81 118.68 115.03 1jv3 s LEU 199 Ca 0.04 -0.42 -0.22 0.00 -1.03 0.00 0.00 54.13 52.50 1jv3 s LEU 199 Cb 0.04 -0.31 -0.11 0.00 0.03 0.00 0.00 46.19 45.85 1jv3 s LEU 199 CO -0.07 -0.08 0.96 -2.16 0.23 0.00 0.00 176.35 175.22 1jv3 s PRO 200 N -1.15 4.28 0.52 1.29 0.04 -1.26 -1.61 135.00 137.12 1jv3 s PRO 200 Ca -0.04 1.19 -0.18 0.00 0.04 0.00 0.00 61.00 62.01 1jv3 s PRO 200 Cb -0.08 -2.32 -0.07 0.00 0.04 0.00 0.00 34.50 32.08 1jv3 s PRO 200 CO 0.01 0.01 1.04 0.00 0.04 0.00 0.00 177.00 178.09 1jv3 s ALA 201 N -2.03 2.85 0.00 8.56 0.00 -0.43 -4.79 121.76 125.92 1jv3 s ALA 201 Ca 0.60 0.49 0.01 0.00 0.00 0.00 0.00 51.96 53.05 1jv3 s ALA 201 Cb -0.12 -3.23 -0.01 0.00 0.00 0.00 0.00 23.12 19.77 1jv3 s ALA 201 CO 0.16 -0.46 -0.03 -1.64 0.00 0.00 0.00 175.76 173.79 1jv3 s MET 202 N -3.60 0.24 0.79 0.00 -1.94 -1.10 -1.82 119.30 111.88 1jv3 s MET 202 Ca 0.65 -0.21 -0.12 0.00 -1.71 0.00 0.00 55.69 54.30 1jv3 s MET 202 Cb -0.15 -0.17 0.07 0.00 2.01 0.00 0.00 34.83 36.59 1jv3 s MET 202 CO 0.27 0.04 1.16 -1.54 -0.01 0.00 0.00 175.02 174.94 1jv3 s SER 203 N -0.36 4.64 0.62 3.03 1.04 -0.24 0.17 113.70 122.61 1jv3 s SER 203 Ca -0.02 0.87 0.41 0.00 0.48 0.00 0.00 55.95 57.69 1jv3 s SER 203 Cb -0.03 -1.43 2.21 0.00 0.10 0.00 0.00 66.02 66.88 1jv3 s SER 203 CO -0.00 -1.83 2.25 -0.26 0.98 0.00 0.00 173.24 174.38 1jv3 h PHE 204 N -1.00 0.00 -0.01 5.02 0.05 -1.91 0.03 116.94 119.12 1jv3 h PHE 204 Ca -0.46 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.33 1jv3 h PHE 204 Cb 1.31 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.26 1jv3 h PHE 204 CO 0.35 0.00 -0.10 -0.40 -0.18 0.00 0.00 178.31 177.98 1jv3 n ASP 205 N -2.95 1.00 0.00 2.17 5.68 -1.26 -4.93 116.55 116.26 1jv3 n ASP 205 Ca -0.03 -1.08 0.00 0.00 -0.50 0.00 0.00 54.79 53.18 1jv3 n ASP 205 Cb 0.09 0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.09 1jv3 n ASP 205 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1jv3 n GLY 206 N 1.23 0.46 3.74 6.12 0.00 -0.00 -5.08 105.19 111.66 1jv3 n GLY 206 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 1jv3 n GLY 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jv3 s LYS 207 N -0.91 4.46 0.27 1.61 1.02 -1.26 -4.83 119.74 120.10 1jv3 s LYS 207 Ca 0.00 0.99 -0.30 0.00 0.02 0.00 0.00 55.97 56.68 1jv3 s LYS 207 Cb 0.00 -3.37 -0.10 0.00 -0.52 0.00 0.00 37.83 33.84 1jv3 s LYS 207 CO 0.00 0.26 1.40 0.42 -0.92 0.00 0.00 175.35 176.51 1jv3 s ILE 208 N 0.06 2.69 -0.14 2.17 1.01 -1.26 -1.08 121.20 124.65 1jv3 s ILE 208 Ca 0.37 0.61 -0.19 0.00 0.00 0.00 0.00 60.65 61.44 1jv3 s ILE 208 Cb -0.20 -3.39 -0.04 0.00 0.01 0.00 0.00 42.46 38.85 1jv3 s ILE 208 CO 0.21 0.11 0.54 -0.63 0.00 0.00 0.00 174.94 175.18 1jv3 s ILE 209 N -0.32 5.12 -0.05 2.92 1.01 -0.76 -4.88 121.20 124.24 1jv3 s ILE 209 Ca 0.56 1.06 -0.22 0.00 0.00 0.00 0.00 60.65 62.06 1jv3 s ILE 209 Cb -0.41 -3.88 -0.04 0.00 0.01 0.00 0.00 42.46 38.14 1jv3 s ILE 209 CO 0.46 0.25 0.63 -0.76 0.00 0.00 0.00 174.94 175.51 1jv3 s LEU 210 N 1.09 4.34 -0.05 2.97 1.43 -1.26 -0.48 118.68 126.73 1jv3 s LEU 210 Ca 0.28 1.11 -0.19 0.00 -1.03 0.00 0.00 54.13 54.30 1jv3 s LEU 210 Cb -0.16 -2.96 -0.31 0.00 0.03 0.00 0.00 46.19 42.79 1jv3 s LEU 210 CO 0.11 -0.02 0.81 -0.08 0.23 0.00 0.00 176.35 177.40 1jv3 h GLU 211 N 6.37 0.34 -5.12 1.70 4.81 0.00 -2.77 114.58 119.91 1jv3 h GLU 211 Ca -0.42 -0.57 -0.39 0.00 -0.13 0.00 0.00 59.36 57.84 1jv3 h GLU 211 Cb 1.19 0.21 -0.14 0.00 0.63 0.00 0.00 28.75 30.65 1jv3 h GLU 211 CO 0.73 1.27 -0.65 -1.21 -0.73 0.00 0.00 179.01 178.43 1jv3 s GLU 212 N -2.48 1.38 0.51 1.92 0.41 -0.79 -3.21 118.70 116.44 1jv3 s GLU 212 Ca -0.15 -1.71 0.23 0.00 -0.41 0.00 0.00 54.97 52.94 1jv3 s GLU 212 Cb 0.03 -0.66 1.32 0.00 -1.78 0.00 0.00 34.13 33.04 1jv3 s GLU 212 CO 0.84 -0.10 1.97 0.87 -0.49 0.00 0.00 175.26 178.35 1jv3 h LYS 213 N 2.42 0.09 -0.10 1.61 1.57 -1.93 -1.53 116.57 118.70 1jv3 h LYS 213 Ca -0.39 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.36 1jv3 h LYS 213 Cb 1.23 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.50 1jv3 h LYS 213 CO 0.65 0.06 -0.13 0.27 -0.57 0.00 0.00 179.45 179.73 1jv3 n ASN 214 N -4.39 2.50 -3.69 0.86 6.94 -1.26 -4.73 115.26 111.49 1jv3 n ASN 214 Ca 0.11 -3.38 -0.12 0.00 -0.02 0.00 0.00 54.58 51.17 1jv3 n ASN 214 Cb 0.61 -0.51 -0.13 0.00 -2.36 0.00 0.00 39.78 37.40 1jv3 n ASN 214 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 1jv3 s LYS 215 N -3.01 0.20 0.06 -3.83 2.47 -0.58 -4.24 119.74 110.81 1jv3 s LYS 215 Ca 0.37 0.69 -0.30 0.00 -1.56 0.00 0.00 55.97 55.17 1jv3 s LYS 215 Cb 0.33 -0.04 -0.05 0.00 -1.46 0.00 0.00 37.83 36.61 1jv3 s LYS 215 CO 0.01 -0.23 1.13 0.08 0.16 0.00 0.00 175.35 176.50 1jv3 s VAL 216 N 1.90 4.24 -0.15 4.02 1.01 -1.26 0.69 120.40 130.85 1jv3 s VAL 216 Ca -0.04 1.65 -0.29 0.00 0.00 0.00 0.00 61.98 63.30 1jv3 s VAL 216 Cb -0.11 -4.05 -0.05 0.00 0.00 0.00 0.00 36.38 32.17 1jv3 s VAL 216 CO -0.09 0.15 1.83 -0.55 0.00 0.00 0.00 175.10 176.44 1jv3 s SER 217 N 0.89 6.20 0.26 3.32 0.15 0.37 -4.62 113.70 120.27 1jv3 s SER 217 Ca 0.56 1.95 0.11 0.00 0.70 0.00 0.00 55.95 59.26 1jv3 s SER 217 Cb -0.27 -2.53 -0.05 0.00 -1.71 0.00 0.00 66.02 61.46 1jv3 s SER 217 CO 0.30 -1.36 -0.18 -0.04 1.20 0.00 0.00 173.24 173.16 1jv3 s MET 218 N 4.97 1.58 0.06 5.44 -1.94 -1.26 -1.32 119.30 126.83 1jv3 s MET 218 Ca 0.82 -1.73 -0.24 0.00 -1.71 0.00 0.00 55.69 52.83 1jv3 s MET 218 Cb -0.31 -1.57 0.06 0.00 2.01 0.00 0.00 34.83 35.02 1jv3 s MET 218 CO 0.33 0.27 0.58 0.00 -0.01 0.00 0.00 175.02 176.19 1jv3 s ALA 219 N -2.66 -1.49 0.51 3.03 0.00 -0.63 -4.91 121.76 115.61 1jv3 s ALA 219 Ca 0.28 0.72 -0.22 0.00 0.00 0.00 0.00 51.96 52.74 1jv3 s ALA 219 Cb -0.03 0.43 -0.07 0.00 0.00 0.00 0.00 23.12 23.45 1jv3 s ALA 219 CO 0.13 -0.55 1.05 -2.30 0.00 0.00 0.00 175.76 174.09 1jv3 n PRO 220 N 0.30 1.26 0.00 0.00 -0.02 -1.26 -0.95 135.00 134.33 1jv3 n PRO 220 Ca -0.18 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 1jv3 n PRO 220 Cb 0.61 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 1jv3 n PRO 220 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1jv3 n ASP 221 N -0.22 2.52 0.00 2.55 3.85 -1.06 -4.69 116.55 119.51 1jv3 n ASP 221 Ca 0.11 -1.99 0.00 0.00 -0.71 0.00 0.00 54.79 52.20 1jv3 n ASP 221 Cb 0.43 -0.50 0.00 0.00 -1.35 0.00 0.00 41.12 39.71 1jv3 n ASP 221 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1jv3 n GLY 222 N 0.39 -0.94 0.08 6.12 0.00 -1.26 -1.75 105.19 107.83 1jv3 n GLY 222 Ca 0.00 -1.57 0.09 0.00 0.00 0.00 0.00 46.02 44.54 1jv3 n GLY 222 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1jv3 n ASN 223 N -1.20 0.36 0.00 1.61 0.23 -1.14 -0.56 115.26 114.56 1jv3 n ASN 223 Ca 0.00 0.61 0.12 0.00 -0.53 0.00 0.00 54.58 54.78 1jv3 n ASN 223 Cb 0.00 -0.68 0.63 0.00 -2.08 0.00 0.00 39.78 37.65 1jv3 n ASN 223 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1jv3 n GLY 224 N -0.44 -1.03 0.00 4.83 0.00 0.40 -2.52 105.19 106.43 1jv3 n GLY 224 Ca 0.02 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.04 1jv3 n GLY 224 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jv3 n GLY 225 N 0.72 -1.01 0.28 -0.02 0.00 0.27 -3.21 105.19 102.22 1jv3 n GLY 225 Ca 0.13 -0.14 0.03 0.00 0.00 0.00 0.00 46.02 46.04 1jv3 n GLY 225 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1jv3 h LEU 226 N 0.00 0.48 -0.33 0.99 5.85 -1.69 -2.12 115.31 118.49 1jv3 h LEU 226 Ca 0.00 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 1jv3 h LEU 226 Cb 0.14 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1jv3 h LEU 226 CO 0.00 0.25 0.11 1.88 -0.34 0.00 0.00 178.44 180.34 1jv3 h TYR 227 N 0.61 0.53 0.00 1.25 -1.99 -1.83 0.21 116.97 115.75 1jv3 h TYR 227 Ca 0.39 -0.05 -0.06 0.00 2.00 0.00 0.00 58.73 61.01 1jv3 h TYR 227 Cb 0.46 -0.16 -0.01 0.00 2.00 0.00 0.00 36.73 39.03 1jv3 h TYR 227 CO -0.10 0.53 -0.27 0.00 -0.00 0.00 0.00 178.16 178.32 1jv3 h ARG 228 N 0.39 0.00 -0.22 4.88 3.08 -1.77 -2.54 114.38 118.20 1jv3 h ARG 228 Ca 0.11 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.97 1jv3 h ARG 228 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.29 1jv3 h ARG 228 CO -0.00 0.27 -0.59 0.00 -1.07 0.00 0.00 179.97 178.57 1jv3 h ALA 229 N 1.73 0.37 -0.90 0.04 0.00 -0.79 -1.01 119.26 118.70 1jv3 h ALA 229 Ca -0.00 -0.53 0.03 0.00 0.00 0.00 0.00 54.91 54.40 1jv3 h ALA 229 Cb 0.82 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.51 1jv3 h ALA 229 CO 0.03 0.61 0.60 -0.07 0.00 0.00 0.00 179.25 180.42 1jv3 h LEU 230 N 0.53 1.00 -0.12 0.00 3.38 -0.39 -2.15 115.31 117.57 1jv3 h LEU 230 Ca -0.01 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 1jv3 h LEU 230 Cb 1.21 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.72 1jv3 h LEU 230 CO 0.13 0.70 -0.20 0.00 0.09 0.00 0.00 178.44 179.15 1jv3 h ALA 231 N 1.46 0.19 0.00 1.53 0.00 -1.31 -1.51 119.26 119.61 1jv3 h ALA 231 Ca 0.35 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1jv3 h ALA 231 Cb -0.04 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1jv3 h ALA 231 CO -0.09 0.13 -0.04 0.00 0.00 0.00 0.00 179.25 179.24 1jv3 h ALA 232 N 0.54 1.19 0.00 0.00 0.00 -0.78 -2.89 119.26 117.32 1jv3 h ALA 232 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1jv3 h ALA 232 Cb 0.78 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1jv3 h ALA 232 CO 0.05 0.05 -0.01 1.04 0.00 0.00 0.00 179.25 180.38 1jv3 n GLN 233 N -3.42 1.67 -2.77 0.00 6.02 -0.84 -4.99 117.38 113.06 1jv3 n GLN 233 Ca -0.02 -2.28 -0.16 0.00 -0.01 0.00 0.00 57.00 54.52 1jv3 n GLN 233 Cb 0.17 -1.36 -0.00 0.00 1.02 0.00 0.00 30.24 30.07 1jv3 n GLN 233 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1jv3 n ASN 234 N -1.18 -4.01 -0.37 1.08 3.02 -0.85 -4.87 115.26 108.08 1jv3 n ASN 234 Ca 0.12 -0.02 0.02 0.00 -0.03 0.00 0.00 54.58 54.67 1jv3 n ASN 234 Cb 0.54 -3.36 0.18 0.00 -0.61 0.00 0.00 39.78 36.53 1jv3 n ASN 234 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1jv3 h ILE 235 N -0.41 1.10 -0.59 2.41 1.08 -1.60 -1.65 117.51 117.86 1jv3 h ILE 235 Ca -0.35 -0.41 -0.08 0.00 -0.39 0.00 0.00 64.86 63.63 1jv3 h ILE 235 Cb 1.25 -0.19 -0.02 0.00 -3.07 0.00 0.00 36.82 34.79 1jv3 h ILE 235 CO 0.42 0.22 0.06 0.58 -0.69 0.00 0.00 178.15 178.73 1jv3 h VAL 236 N 1.19 1.26 -0.60 1.67 2.07 -1.90 -0.42 116.25 119.51 1jv3 h VAL 236 Ca 0.42 -1.04 0.02 0.00 0.82 0.00 0.00 66.70 66.93 1jv3 h VAL 236 Cb 0.14 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.61 1jv3 h VAL 236 CO -0.16 0.38 0.37 -0.33 0.02 0.00 0.00 177.57 177.85 1jv3 h GLU 237 N 0.92 0.72 -0.78 1.57 3.07 -1.68 0.06 114.58 118.46 1jv3 h GLU 237 Ca 0.18 -0.04 0.04 0.00 -0.50 0.00 0.00 59.36 59.04 1jv3 h GLU 237 Cb 0.46 -0.16 -0.05 0.00 -0.84 0.00 0.00 28.75 28.15 1jv3 h GLU 237 CO 0.02 0.48 0.49 0.22 -1.40 0.00 0.00 179.01 178.81 1jv3 h ASP 238 N 0.74 0.79 -0.47 1.42 3.58 -0.49 0.33 116.42 122.33 1jv3 h ASP 238 Ca 0.24 0.01 -0.10 0.00 0.42 0.00 0.00 57.03 57.59 1jv3 h ASP 238 Cb -0.00 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 40.87 1jv3 h ASP 238 CO -0.09 0.53 -0.10 0.24 -2.88 0.00 0.00 179.24 176.94 1jv3 h MET 239 N 0.93 0.94 -0.43 0.28 2.86 -0.41 -1.43 114.93 117.66 1jv3 h MET 239 Ca 0.32 -0.33 -0.13 0.00 -2.06 0.00 0.00 59.70 57.51 1jv3 h MET 239 Cb 0.07 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1jv3 h MET 239 CO -0.13 0.98 -0.23 0.93 1.06 0.00 0.00 176.91 179.52 1jv3 h GLU 240 N 0.84 0.92 -0.54 1.72 5.08 -0.47 0.95 114.58 123.08 1jv3 h GLU 240 Ca 0.14 -0.41 -0.04 0.00 -1.00 0.00 0.00 59.36 58.05 1jv3 h GLU 240 Cb 0.63 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 1jv3 h GLU 240 CO 0.04 1.07 0.20 0.37 -1.00 0.00 0.00 179.01 179.69 1jv3 h GLN 241 N 0.75 0.82 0.00 2.33 4.15 -0.79 -1.68 115.11 120.70 1jv3 h GLN 241 Ca 0.09 -0.16 0.00 0.00 0.77 0.00 0.00 58.65 59.36 1jv3 h GLN 241 Cb 0.80 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.36 1jv3 h GLN 241 CO 0.07 0.73 0.00 0.00 -1.93 0.00 0.00 178.83 177.70 1jv3 h ARG 242 N 0.74 0.00 0.00 1.69 3.08 -1.18 -3.46 114.38 115.25 1jv3 h ARG 242 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 1jv3 h ARG 242 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 1jv3 h ARG 242 CO -0.01 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.30 1jv3 n GLY 243 N -0.09 0.64 3.74 0.04 0.00 -0.63 -4.99 105.19 103.91 1jv3 n GLY 243 Ca 0.01 -0.67 -0.41 0.00 0.00 0.00 0.00 46.02 44.95 1jv3 n GLY 243 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jv3 s ILE 244 N -2.00 3.71 -0.13 -0.61 -1.09 0.26 -4.62 121.20 116.71 1jv3 s ILE 244 Ca 0.00 1.53 0.05 0.00 -2.23 0.00 0.00 60.65 60.00 1jv3 s ILE 244 Cb 0.00 -3.97 -0.12 0.00 -1.58 0.00 0.00 42.46 36.79 1jv3 s ILE 244 CO 0.00 0.29 -0.05 1.87 -1.23 0.00 0.00 174.94 175.81 1jv3 n TRP 245 N 2.07 0.00 -5.21 3.97 -0.00 -0.38 -4.66 117.44 113.24 1jv3 n TRP 245 Ca 0.02 0.00 -0.32 0.00 -0.00 0.00 0.00 57.50 57.20 1jv3 n TRP 245 Cb 0.45 -0.57 -0.16 0.00 -0.00 0.00 0.00 31.31 31.04 1jv3 n TRP 245 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 177.69 176.57 1jv3 s SER 246 N -4.98 3.20 -0.11 5.87 0.01 -0.67 -0.87 113.70 116.15 1jv3 s SER 246 Ca -0.14 -0.47 0.03 0.00 1.31 0.00 0.00 55.95 56.68 1jv3 s SER 246 Cb 0.04 -0.87 0.01 0.00 0.21 0.00 0.00 66.02 65.41 1jv3 s SER 246 CO 0.40 0.25 -0.20 -0.63 0.41 0.00 0.00 173.24 173.47 1jv3 s ILE 247 N -0.19 1.83 -0.43 1.44 -1.09 0.76 -0.94 121.20 122.58 1jv3 s ILE 247 Ca -0.02 -0.86 -0.14 0.00 -2.23 0.00 0.00 60.65 57.39 1jv3 s ILE 247 Cb -0.14 -1.62 0.05 0.00 -1.58 0.00 0.00 42.46 39.17 1jv3 s ILE 247 CO 0.03 0.51 0.32 -2.28 -1.23 0.00 0.00 174.94 172.29 1jv3 s HIS 248 N 0.69 3.25 -0.10 3.97 5.65 -0.61 -0.78 115.29 127.38 1jv3 s HIS 248 Ca -0.11 -0.87 -0.13 0.00 0.25 0.00 0.00 55.06 54.19 1jv3 s HIS 248 Cb -0.16 -2.82 -0.05 0.00 -1.18 0.00 0.00 32.58 28.37 1jv3 s HIS 248 CO 0.02 -0.70 0.31 0.08 -0.65 0.00 0.00 174.74 173.80 1jv3 s VAL 249 N 1.62 5.24 0.12 0.89 1.01 0.97 -0.37 120.40 129.88 1jv3 s VAL 249 Ca 0.04 0.61 -0.11 0.00 0.00 0.00 0.00 61.98 62.52 1jv3 s VAL 249 Cb -0.21 -3.63 0.01 0.00 0.00 0.00 0.00 36.38 32.55 1jv3 s VAL 249 CO 0.07 0.49 0.27 -0.72 0.00 0.00 0.00 175.10 175.22 1jv3 s TYR 250 N -0.33 0.11 0.04 5.22 -0.85 -0.74 -0.65 117.35 120.15 1jv3 s TYR 250 Ca 0.19 -0.50 -0.23 0.00 -0.52 0.00 0.00 57.07 56.02 1jv3 s TYR 250 Cb -0.14 0.04 -0.06 0.00 0.38 0.00 0.00 41.96 42.18 1jv3 s TYR 250 CO 0.07 -0.64 0.68 0.00 -1.52 0.00 0.00 175.55 174.14 1jv3 h VAL 252 N 4.00 0.69 -0.01 0.00 3.04 -1.93 -3.34 116.25 118.70 1jv3 h VAL 252 Ca -0.45 -0.57 0.00 0.00 -1.01 0.00 0.00 66.70 64.67 1jv3 h VAL 252 Cb 1.20 1.35 0.00 0.00 -2.01 0.00 0.00 31.29 31.84 1jv3 h VAL 252 CO 0.69 0.14 -0.01 -0.90 -1.01 0.00 0.00 177.57 176.48 1jv3 n ASP 253 N -3.78 0.58 -4.41 3.17 5.68 -1.26 -4.78 116.55 111.75 1jv3 n ASP 253 Ca -0.02 -1.12 -0.44 0.00 -0.50 0.00 0.00 54.79 52.71 1jv3 n ASP 253 Cb 0.24 -0.01 -0.06 0.00 -1.14 0.00 0.00 41.12 40.15 1jv3 n ASP 253 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 1jv3 s ASN 254 N -2.06 6.20 0.63 -1.12 2.47 -1.26 -1.28 114.94 118.52 1jv3 s ASN 254 Ca 0.42 -1.20 0.34 0.00 0.42 0.00 0.00 52.86 52.84 1jv3 s ASN 254 Cb 0.21 -2.27 1.87 0.00 -1.45 0.00 0.00 41.25 39.61 1jv3 s ASN 254 CO 0.37 -0.90 2.12 -0.29 -3.72 0.00 0.00 177.10 174.68 1jv3 h ILE 255 N 5.86 0.19 -0.33 -5.21 6.09 -1.86 -1.62 117.51 120.64 1jv3 h ILE 255 Ca -0.28 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.21 1jv3 h ILE 255 Cb 1.10 0.83 0.00 0.00 0.47 0.00 0.00 36.82 39.21 1jv3 h ILE 255 CO 0.99 0.00 0.00 0.18 -3.07 0.00 0.00 178.15 176.25 1jv3 n LEU 256 N -3.32 3.41 -4.69 2.19 4.77 -1.26 -4.99 117.00 113.11 1jv3 n LEU 256 Ca -0.01 -1.42 -0.43 0.00 -0.03 0.00 0.00 56.01 54.13 1jv3 n LEU 256 Cb 0.28 -0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 1jv3 n LEU 256 CO 0.21 0.71 1.48 0.55 -1.33 0.00 0.00 177.39 179.01 1jv3 n VAL 257 N 1.48 0.39 -2.70 4.08 3.14 -0.61 -4.60 118.33 119.51 1jv3 n VAL 257 Ca 0.19 -0.07 -0.43 0.00 -2.96 0.00 0.00 64.34 61.07 1jv3 n VAL 257 Cb 0.61 -2.10 -0.01 0.00 -1.06 0.00 0.00 33.84 31.28 1jv3 n VAL 257 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1jv3 s LYS 258 N 2.85 3.90 0.28 1.45 1.02 -1.26 -4.98 119.74 123.00 1jv3 s LYS 258 Ca 0.83 -1.95 -0.30 0.00 0.02 0.00 0.00 55.97 54.56 1jv3 s LYS 258 Cb -0.50 -5.34 -0.12 0.00 -0.52 0.00 0.00 37.83 31.36 1jv3 s LYS 258 CO 0.38 -2.09 1.53 0.28 -0.92 0.00 0.00 175.35 174.54 1jv3 n VAL 259 N 5.98 1.00 -2.72 3.17 0.31 -1.26 -1.35 118.33 123.46 1jv3 n VAL 259 Ca 0.41 -0.25 -0.16 0.00 -0.01 0.00 0.00 64.34 64.33 1jv3 n VAL 259 Cb 0.46 -1.80 -0.00 0.00 -0.91 0.00 0.00 33.84 31.60 1jv3 n VAL 259 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1jv3 n ALA 260 N 2.05 -0.87 -1.43 3.52 0.00 -1.26 -4.77 120.51 117.75 1jv3 n ALA 260 Ca 0.10 0.11 -0.54 0.00 0.00 0.00 0.00 53.44 53.11 1jv3 n ALA 260 Cb 0.35 -2.00 -0.08 0.00 0.00 0.00 0.00 19.45 17.72 1jv3 n ALA 260 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1jv3 n ASP 261 N -1.98 1.85 0.25 0.00 4.64 -0.46 -4.82 116.55 116.03 1jv3 n ASP 261 Ca -0.11 0.56 0.08 0.00 -1.38 0.00 0.00 54.79 53.94 1jv3 n ASP 261 Cb 0.59 -1.16 0.63 0.00 -1.04 0.00 0.00 41.12 40.14 1jv3 n ASP 261 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 1jv3 h PRO 262 N 10.96 0.00 -0.18 -0.67 0.13 -1.90 -1.08 132.00 139.26 1jv3 h PRO 262 Ca -0.26 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.82 1jv3 h PRO 262 Cb 1.34 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.47 1jv3 h PRO 262 CO 1.03 0.05 -0.09 0.00 -0.23 0.00 0.00 178.00 178.76 1jv3 h ARG 263 N 0.00 0.37 -0.31 0.86 3.08 -1.85 0.30 114.38 116.83 1jv3 h ARG 263 Ca -0.00 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 59.84 1jv3 h ARG 263 Cb 0.09 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1jv3 h ARG 263 CO 0.01 0.68 0.02 0.35 -1.07 0.00 0.00 179.97 179.96 1jv3 h PHE 264 N 0.06 0.58 -0.64 3.04 3.57 -1.81 -0.70 116.94 121.03 1jv3 h PHE 264 Ca 0.04 -0.09 -0.03 0.00 3.53 0.00 0.00 57.97 61.42 1jv3 h PHE 264 Cb 0.57 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.13 1jv3 h PHE 264 CO 0.06 0.65 0.28 0.82 -2.23 0.00 0.00 178.31 177.89 1jv3 h ILE 265 N 0.35 1.23 -0.67 1.41 2.04 -1.18 -1.93 117.51 118.76 1jv3 h ILE 265 Ca 0.09 -0.68 -0.06 0.00 1.00 0.00 0.00 64.86 65.22 1jv3 h ILE 265 Cb 0.40 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 1jv3 h ILE 265 CO 0.01 0.27 0.19 1.23 0.00 0.00 0.00 178.15 179.86 1jv3 h GLY 266 N 0.89 1.12 0.93 5.37 0.00 -0.23 -1.47 103.07 109.68 1jv3 h GLY 266 Ca 0.22 -0.66 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 1jv3 h GLY 266 CO -0.02 0.62 -0.23 -2.75 0.00 0.00 0.00 176.54 174.15 1jv3 h PHE 267 N 1.00 -0.59 -0.79 5.60 3.57 -0.93 -0.15 116.94 124.64 1jv3 h PHE 267 Ca 0.22 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.78 1jv3 h PHE 267 Cb 0.31 0.20 -0.07 0.00 2.79 0.00 0.00 35.95 39.18 1jv3 h PHE 267 CO 0.02 -0.33 0.46 0.00 -2.23 0.00 0.00 178.31 176.23 1jv3 h ILE 269 N 0.81 0.76 -0.39 0.00 1.08 -1.06 -1.63 117.51 117.08 1jv3 h ILE 269 Ca 0.37 -0.22 0.11 0.00 -0.39 0.00 0.00 64.86 64.73 1jv3 h ILE 269 Cb 0.28 0.89 -0.02 0.00 -3.07 0.00 0.00 36.82 34.90 1jv3 h ILE 269 CO -0.22 0.05 0.29 -0.61 -0.69 0.00 0.00 178.15 176.97 1jv3 h GLN 270 N -0.48 0.00 -0.01 2.37 4.15 -0.77 0.89 115.11 121.26 1jv3 h GLN 270 Ca -0.04 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.38 1jv3 h GLN 270 Cb 0.36 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.05 1jv3 h GLN 270 CO 0.06 0.00 -0.16 1.63 -1.93 0.00 0.00 178.83 178.43 1jv3 n LYS 271 N -4.37 1.03 -2.52 1.69 4.76 -0.79 -4.94 118.16 113.02 1jv3 n LYS 271 Ca 0.06 -0.56 -0.13 0.00 -2.87 0.00 0.00 58.31 54.81 1jv3 n LYS 271 Cb 0.47 -1.49 0.01 0.00 -1.84 0.00 0.00 35.03 32.19 1jv3 n LYS 271 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1jv3 n GLY 272 N 1.28 -0.11 3.86 0.72 0.00 0.31 -4.99 105.19 106.26 1jv3 n GLY 272 Ca 0.15 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 1jv3 n GLY 272 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jv3 s ALA 273 N -2.81 3.31 -0.83 4.61 0.00 -0.66 -4.83 121.76 120.56 1jv3 s ALA 273 Ca 0.11 -0.03 0.14 0.00 0.00 0.00 0.00 51.96 52.18 1jv3 s ALA 273 Cb -0.05 -2.77 -0.12 0.00 0.00 0.00 0.00 23.12 20.19 1jv3 s ALA 273 CO 0.13 0.18 0.64 -0.40 0.00 0.00 0.00 175.76 176.32 1jv3 n ASP 274 N -0.77 0.87 -3.71 0.00 3.85 -0.36 -4.81 116.55 111.63 1jv3 n ASP 274 Ca 0.03 -0.93 -0.11 0.00 -0.71 0.00 0.00 54.79 53.07 1jv3 n ASP 274 Cb 0.53 0.87 -0.11 0.00 -1.35 0.00 0.00 41.12 41.07 1jv3 n ASP 274 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1jv3 s GLY 276 N 1.08 0.24 -0.07 0.00 0.00 0.53 -1.36 107.32 107.74 1jv3 s GLY 276 Ca -0.07 -0.61 0.02 0.00 0.00 0.00 0.00 44.72 44.06 1jv3 s GLY 276 CO -0.09 -0.70 -0.10 0.00 0.00 0.00 0.00 173.10 172.21 1jv3 s ALA 277 N -1.90 1.19 0.03 3.20 0.00 -0.61 -0.71 121.76 122.96 1jv3 s ALA 277 Ca -0.12 -0.39 -0.21 0.00 0.00 0.00 0.00 51.96 51.25 1jv3 s ALA 277 Cb -0.06 -0.60 -0.06 0.00 0.00 0.00 0.00 23.12 22.39 1jv3 s ALA 277 CO -0.02 0.01 0.61 0.21 0.00 0.00 0.00 175.76 176.57 1jv3 s LYS 278 N 0.87 4.31 0.23 0.00 2.20 -0.01 -1.06 119.74 126.27 1jv3 s LYS 278 Ca -0.11 0.78 0.01 0.00 -0.36 0.00 0.00 55.97 56.29 1jv3 s LYS 278 Cb -0.15 -3.31 -0.05 0.00 -1.51 0.00 0.00 37.83 32.81 1jv3 s LYS 278 CO 0.01 0.45 0.08 0.14 -0.36 0.00 0.00 175.35 175.67 1jv3 s VAL 279 N -0.51 0.50 0.13 4.02 -7.23 0.60 -2.95 120.40 114.96 1jv3 s VAL 279 Ca 0.31 -1.99 0.05 0.00 -1.81 0.00 0.00 61.98 58.54 1jv3 s VAL 279 Cb -0.19 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.23 1jv3 s VAL 279 CO 0.19 -0.13 -0.12 0.68 -0.31 0.00 0.00 175.10 175.41 1jv3 s VAL 280 N -3.80 1.21 0.06 1.32 -7.23 -0.78 -1.14 120.40 110.04 1jv3 s VAL 280 Ca 0.34 -1.83 -0.31 0.00 -1.81 0.00 0.00 61.98 58.38 1jv3 s VAL 280 Cb 0.07 -1.61 -0.07 0.00 0.56 0.00 0.00 36.38 35.33 1jv3 s VAL 280 CO 0.11 -0.56 1.49 -0.70 -0.31 0.00 0.00 175.10 175.13 1jv3 s GLU 281 N -3.06 4.26 -0.16 4.82 2.12 -1.26 -1.44 118.70 123.97 1jv3 s GLU 281 Ca 0.11 2.14 -0.22 0.00 0.36 0.00 0.00 54.97 57.35 1jv3 s GLU 281 Cb -0.02 -3.49 -0.03 0.00 0.26 0.00 0.00 34.13 30.85 1jv3 s GLU 281 CO 0.02 -0.60 0.68 0.21 -0.54 0.00 0.00 175.26 175.02 1jv3 s LYS 282 N 2.14 4.28 -0.04 4.30 2.20 -0.23 -4.86 119.74 127.53 1jv3 s LYS 282 Ca 0.68 0.75 0.03 0.00 -0.36 0.00 0.00 55.97 57.06 1jv3 s LYS 282 Cb -0.36 -3.54 -0.05 0.00 -1.51 0.00 0.00 37.83 32.37 1jv3 s LYS 282 CO 0.29 -0.17 0.00 0.25 -0.36 0.00 0.00 175.35 175.36 1jv3 n THR 283 N 4.45 0.30 -3.20 3.43 -2.24 -1.26 -4.61 114.28 111.15 1jv3 n THR 283 Ca -0.00 -0.17 -0.40 0.00 -2.27 0.00 0.00 64.05 61.20 1jv3 n THR 283 Cb 0.50 -0.85 -0.07 0.00 -2.10 0.00 0.00 70.33 67.81 1jv3 n THR 283 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1jv3 s ASN 284 N -3.73 6.43 0.40 3.42 3.84 -1.26 -4.87 114.94 119.18 1jv3 s ASN 284 Ca -0.03 0.41 0.20 0.00 0.21 0.00 0.00 52.86 53.65 1jv3 s ASN 284 Cb 0.01 -2.29 1.15 0.00 -0.55 0.00 0.00 41.25 39.57 1jv3 s ASN 284 CO 0.16 -0.37 1.75 -0.65 -2.79 0.00 0.00 177.10 175.20 1jv3 h PRO 285 N 8.14 0.34 -0.65 0.43 0.11 -1.93 -1.86 132.00 136.58 1jv3 h PRO 285 Ca -0.28 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1jv3 h PRO 285 Cb 1.13 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1jv3 h PRO 285 CO 0.75 0.22 0.00 0.25 -0.21 0.00 0.00 178.00 179.01 1jv3 n THR 286 N -4.64 1.70 -1.89 -1.15 -2.24 -1.26 -4.74 114.28 100.07 1jv3 n THR 286 Ca 0.27 -1.08 -0.42 0.00 -2.27 0.00 0.00 64.05 60.56 1jv3 n THR 286 Cb 0.96 0.06 -0.02 0.00 -2.10 0.00 0.00 70.33 69.23 1jv3 n THR 286 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1jv3 s GLU 287 N -1.86 4.19 -1.23 -0.78 2.12 -0.70 -4.87 118.70 115.57 1jv3 s GLU 287 Ca 0.47 2.44 -0.13 0.00 0.36 0.00 0.00 54.97 58.11 1jv3 s GLU 287 Cb 0.30 -3.08 -0.06 0.00 0.26 0.00 0.00 34.13 31.55 1jv3 s GLU 287 CO 0.22 -0.56 2.34 -0.35 -0.54 0.00 0.00 175.26 176.37 1jv3 n PRO 288 N 2.72 2.62 -4.57 4.30 -0.04 -1.26 -4.85 135.00 133.93 1jv3 n PRO 288 Ca 0.09 -2.06 -0.21 0.00 -0.04 0.00 0.00 63.50 61.28 1jv3 n PRO 288 Cb 0.38 -2.88 -0.15 0.00 -0.04 0.00 0.00 33.50 30.82 1jv3 n PRO 288 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1jv3 s VAL 289 N 3.34 1.00 0.85 0.52 -7.23 -1.26 -4.91 120.40 112.72 1jv3 s VAL 289 Ca 0.54 -0.54 -0.11 0.00 -1.81 0.00 0.00 61.98 60.06 1jv3 s VAL 289 Cb 0.14 -0.84 0.10 0.00 0.56 0.00 0.00 36.38 36.35 1jv3 s VAL 289 CO -0.02 0.29 1.10 -0.83 -0.31 0.00 0.00 175.10 175.32 1jv3 s GLY 290 N -0.26 1.66 -0.08 2.32 0.00 -1.26 -3.99 107.32 105.72 1jv3 s GLY 290 Ca 0.04 0.27 0.04 0.00 0.00 0.00 0.00 44.72 45.07 1jv3 s GLY 290 CO -0.00 0.68 -0.20 -1.34 0.00 0.00 0.00 173.10 172.23 1jv3 s VAL 291 N -2.83 2.48 0.28 1.40 -7.23 -0.50 -0.89 120.40 113.11 1jv3 s VAL 291 Ca 0.63 -0.90 -0.29 0.00 -1.81 0.00 0.00 61.98 59.61 1jv3 s VAL 291 Cb -0.19 -1.95 -0.09 0.00 0.56 0.00 0.00 36.38 34.70 1jv3 s VAL 291 CO 0.57 0.56 0.97 -0.69 -0.31 0.00 0.00 175.10 176.21 1jv3 s VAL 292 N -0.13 4.00 0.03 1.32 1.01 -0.26 -1.40 120.40 124.97 1jv3 s VAL 292 Ca -0.03 1.89 -0.05 0.00 0.00 0.00 0.00 61.98 63.79 1jv3 s VAL 292 Cb -0.14 -4.15 0.02 0.00 0.00 0.00 0.00 36.38 32.10 1jv3 s VAL 292 CO 0.04 0.36 0.24 0.00 0.00 0.00 0.00 175.10 175.73 1jv3 s ARG 294 N -2.01 0.25 -0.06 0.00 1.70 -0.42 -0.90 118.95 117.51 1jv3 s ARG 294 Ca 0.05 -0.41 0.00 0.00 -0.47 0.00 0.00 55.73 54.90 1jv3 s ARG 294 Cb -0.01 0.00 0.02 0.00 -0.57 0.00 0.00 34.95 34.40 1jv3 s ARG 294 CO 0.01 -0.01 -0.03 0.54 -1.08 0.00 0.00 175.30 174.72 1jv3 s VAL 295 N -0.93 0.51 -1.37 4.99 0.11 -0.70 -0.94 120.40 122.07 1jv3 s VAL 295 Ca -0.09 -0.05 -0.09 0.00 -2.93 0.00 0.00 61.98 58.81 1jv3 s VAL 295 Cb -0.06 -0.58 0.02 0.00 -1.53 0.00 0.00 36.38 34.23 1jv3 s VAL 295 CO -0.00 0.24 1.12 0.47 -3.33 0.00 0.00 175.10 173.60 1jv3 n ASP 296 N 4.44 -5.53 0.00 3.54 8.00 -1.26 -1.80 116.55 123.94 1jv3 n ASP 296 Ca -0.19 -0.60 0.00 0.00 0.71 0.00 0.00 54.79 54.71 1jv3 n ASP 296 Cb 0.51 -4.81 0.00 0.00 -0.02 0.00 0.00 41.12 36.80 1jv3 n ASP 296 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jv3 n GLY 297 N -1.86 0.99 3.65 0.44 0.00 -1.26 -4.99 105.19 102.17 1jv3 n GLY 297 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 1jv3 n GLY 297 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jv3 s VAL 298 N -2.81 5.21 0.42 1.61 1.01 -0.75 -5.07 120.40 120.03 1jv3 s VAL 298 Ca 0.00 0.13 -0.23 0.00 0.00 0.00 0.00 61.98 61.88 1jv3 s VAL 298 Cb 0.00 -3.41 -0.09 0.00 0.00 0.00 0.00 36.38 32.88 1jv3 s VAL 298 CO 0.00 0.38 1.05 -0.31 0.00 0.00 0.00 175.10 176.22 1jv3 s TYR 299 N 0.88 3.18 0.17 5.22 1.51 -1.26 -1.72 117.35 125.34 1jv3 s TYR 299 Ca 0.07 1.62 -0.22 0.00 -1.01 0.00 0.00 57.07 57.53 1jv3 s TYR 299 Cb -0.13 -3.13 0.08 0.00 -0.11 0.00 0.00 41.96 38.67 1jv3 s TYR 299 CO 0.03 -0.73 1.04 0.00 -1.11 0.00 0.00 175.55 174.79 1jv3 n GLN 300 N -0.28 0.63 -5.05 -0.62 10.64 -0.08 -2.33 117.38 120.28 1jv3 n GLN 300 Ca 0.06 -1.45 -0.28 0.00 -1.83 0.00 0.00 57.00 53.50 1jv3 n GLN 300 Cb 0.50 1.97 -0.16 0.00 -0.86 0.00 0.00 30.24 31.69 1jv3 n GLN 300 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 1jv3 s VAL 301 N -2.06 1.72 -0.30 -0.39 1.01 -1.26 -0.56 120.40 118.56 1jv3 s VAL 301 Ca 0.23 -0.90 -0.08 0.00 0.00 0.00 0.00 61.98 61.23 1jv3 s VAL 301 Cb -0.03 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.90 1jv3 s VAL 301 CO 0.05 0.49 0.12 -0.69 0.00 0.00 0.00 175.10 175.07 1jv3 s VAL 302 N -0.18 4.32 0.73 2.92 1.01 -0.49 -4.91 120.40 123.79 1jv3 s VAL 302 Ca -0.00 -0.55 -0.15 0.00 0.00 0.00 0.00 61.98 61.28 1jv3 s VAL 302 Cb -0.11 -3.22 0.04 0.00 0.00 0.00 0.00 36.38 33.09 1jv3 s VAL 302 CO 0.02 0.07 1.24 -0.70 0.00 0.00 0.00 175.10 175.72 1jv3 s GLU 303 N 1.56 2.07 0.48 2.72 2.56 -1.26 -1.40 118.70 125.43 1jv3 s GLU 303 Ca 0.04 1.86 0.15 0.00 0.00 0.00 0.00 54.97 57.03 1jv3 s GLU 303 Cb -0.17 -1.81 1.16 0.00 2.00 0.00 0.00 34.13 35.31 1jv3 s GLU 303 CO 0.05 -1.91 2.07 0.10 -0.56 0.00 0.00 175.26 175.00 1jv3 h TYR 304 N -0.25 0.19 -0.00 5.30 -0.00 -1.90 -0.75 116.97 119.55 1jv3 h TYR 304 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.25 1jv3 h TYR 304 Cb 1.31 -0.06 0.00 0.00 0.00 0.00 0.00 36.73 37.98 1jv3 h TYR 304 CO 0.45 0.11 0.00 -1.13 -0.00 0.00 0.00 178.16 177.59 1jv3 n SER 305 N -4.48 0.33 0.00 0.10 3.41 -1.26 -3.52 113.62 108.20 1jv3 n SER 305 Ca 0.03 -1.11 0.00 0.00 -0.26 0.00 0.00 58.87 57.53 1jv3 n SER 305 Cb 0.23 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.18 1jv3 n SER 305 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1jv3 n GLU 306 N -0.74 2.21 -3.94 4.33 1.02 -0.30 -5.02 120.64 118.20 1jv3 n GLU 306 Ca 0.23 -1.27 -0.30 0.00 -0.02 0.00 0.00 57.16 55.80 1jv3 n GLU 306 Cb 0.16 -0.95 -0.04 0.00 -0.02 0.00 0.00 31.44 30.59 1jv3 n GLU 306 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 1jv3 s ILE 307 N -0.78 5.29 0.40 -3.67 2.07 -1.16 -4.91 121.20 118.44 1jv3 s ILE 307 Ca 0.00 -0.51 -0.06 0.00 -1.41 0.00 0.00 60.65 58.67 1jv3 s ILE 307 Cb 0.00 -3.62 -0.05 0.00 0.13 0.00 0.00 42.46 38.92 1jv3 s ILE 307 CO 0.00 0.07 0.70 -0.94 -1.91 0.00 0.00 174.94 172.86 1jv3 s SER 308 N -2.71 6.37 0.16 4.50 1.04 -1.26 -4.95 113.70 116.86 1jv3 s SER 308 Ca 0.34 0.87 -0.12 0.00 0.48 0.00 0.00 55.95 57.52 1jv3 s SER 308 Cb -0.12 -2.21 0.06 0.00 0.10 0.00 0.00 66.02 63.84 1jv3 s SER 308 CO 0.28 -0.41 1.70 0.25 0.98 0.00 0.00 173.24 176.04 1jv3 h LEU 309 N 0.89 0.80 -0.59 2.42 5.85 -1.98 -0.88 115.31 121.82 1jv3 h LEU 309 Ca -0.48 -0.19 0.10 0.00 0.84 0.00 0.00 57.88 58.15 1jv3 h LEU 309 Cb 1.20 -0.21 -0.08 0.00 0.37 0.00 0.00 40.66 41.94 1jv3 h LEU 309 CO 0.63 0.78 0.17 0.00 -0.34 0.00 0.00 178.44 179.67 1jv3 h ALA 310 N 1.05 0.72 -0.23 1.25 0.00 -1.98 0.71 119.26 120.79 1jv3 h ALA 310 Ca 0.18 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.15 1jv3 h ALA 310 Cb 0.25 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1jv3 h ALA 310 CO -0.01 -0.26 -0.05 1.15 0.00 0.00 0.00 179.25 180.07 1jv3 h THR 311 N 0.32 1.28 -0.21 0.00 2.02 -1.90 -2.23 112.91 112.19 1jv3 h THR 311 Ca 0.30 -1.05 -0.03 0.00 0.77 0.00 0.00 66.41 66.40 1jv3 h THR 311 Cb 0.41 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.30 1jv3 h THR 311 CO -0.35 0.33 -0.01 0.00 0.37 0.00 0.00 175.52 175.85 1jv3 h ALA 312 N 0.76 1.60 -0.00 6.16 0.00 -0.56 -2.86 119.26 124.35 1jv3 h ALA 312 Ca 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1jv3 h ALA 312 Cb 0.51 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1jv3 h ALA 312 CO 0.02 0.30 -0.50 1.04 0.00 0.00 0.00 179.25 180.11 1jv3 n GLN 313 N -4.35 0.12 -1.67 0.00 6.02 0.19 -4.59 117.38 113.09 1jv3 n GLN 313 Ca 0.00 -0.07 -0.46 0.00 -0.01 0.00 0.00 57.00 56.46 1jv3 n GLN 313 Cb 0.20 -1.50 -0.04 0.00 1.02 0.00 0.00 30.24 29.92 1jv3 n GLN 313 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1jv3 n LYS 314 N -1.38 2.16 -4.25 -1.09 4.81 -0.84 -4.89 118.16 112.68 1jv3 n LYS 314 Ca 0.06 0.78 -0.27 0.00 -0.87 0.00 0.00 58.31 58.01 1jv3 n LYS 314 Cb 0.34 -2.55 -0.09 0.00 0.02 0.00 0.00 35.03 32.75 1jv3 n LYS 314 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1jv3 s ARG 315 N 0.86 2.18 0.52 1.64 0.52 -1.26 0.09 118.95 123.49 1jv3 s ARG 315 Ca 0.78 -1.16 0.04 0.00 -0.52 0.00 0.00 55.73 54.87 1jv3 s ARG 315 Cb -0.67 -2.25 0.04 0.00 0.52 0.00 0.00 34.95 32.58 1jv3 s ARG 315 CO 0.38 0.46 0.72 -1.54 0.02 0.00 0.00 175.30 175.34 1jv3 s SER 316 N -2.72 5.32 0.54 0.23 1.04 0.14 -4.61 113.70 113.63 1jv3 s SER 316 Ca 0.25 -0.28 0.26 0.00 0.48 0.00 0.00 55.95 56.66 1jv3 s SER 316 Cb -0.09 -0.60 1.42 0.00 0.10 0.00 0.00 66.02 66.84 1jv3 s SER 316 CO 0.16 -1.09 1.99 0.77 0.98 0.00 0.00 173.24 176.06 1jv3 h SER 317 N 0.24 0.00 0.58 7.02 4.64 -2.00 -0.18 113.55 123.84 1jv3 h SER 317 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1jv3 h SER 317 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1jv3 h SER 317 CO 0.47 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.53 1jv3 n ASP 318 N -4.30 0.00 0.00 4.97 5.68 -1.26 -4.91 116.55 116.73 1jv3 n ASP 318 Ca 0.09 -0.02 0.00 0.00 -0.50 0.00 0.00 54.79 54.36 1jv3 n ASP 318 Cb 0.60 -0.32 0.00 0.00 -1.14 0.00 0.00 41.12 40.26 1jv3 n ASP 318 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1jv3 n GLY 319 N 1.09 0.51 3.91 6.12 0.00 -0.08 -5.07 105.19 111.68 1jv3 n GLY 319 Ca 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 1jv3 n GLY 319 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1jv3 s ARG 320 N -0.84 2.95 0.38 1.61 0.52 -1.26 -4.78 118.95 117.53 1jv3 s ARG 320 Ca 0.00 0.06 -0.27 0.00 -0.52 0.00 0.00 55.73 55.00 1jv3 s ARG 320 Cb 0.00 -2.25 -0.09 0.00 0.52 0.00 0.00 34.95 33.13 1jv3 s ARG 320 CO 0.00 -0.71 1.25 -0.51 0.02 0.00 0.00 175.30 175.36 1jv3 s LEU 321 N -5.02 4.28 0.20 2.53 1.43 -1.26 -0.69 118.68 120.15 1jv3 s LEU 321 Ca 0.54 2.55 -0.11 0.00 -1.03 0.00 0.00 54.13 56.08 1jv3 s LEU 321 Cb -0.11 -3.86 0.14 0.00 0.03 0.00 0.00 46.19 42.39 1jv3 s LEU 321 CO 0.46 -0.69 1.86 0.25 0.23 0.00 0.00 176.35 178.46 1jv3 h LEU 322 N 2.89 0.76 -7.63 1.79 5.85 -0.60 -3.26 115.31 115.11 1jv3 h LEU 322 Ca -0.49 -0.02 -0.75 0.00 0.84 0.00 0.00 57.88 57.47 1jv3 h LEU 322 Cb 1.24 -0.18 -0.31 0.00 0.37 0.00 0.00 40.66 41.78 1jv3 h LEU 322 CO 0.63 0.54 -0.02 -0.36 -0.34 0.00 0.00 178.44 178.89 1jv3 s PHE 323 N -6.14 3.75 -0.54 1.25 0.40 -1.26 -4.77 117.98 110.67 1jv3 s PHE 323 Ca -0.13 -2.49 0.09 0.00 -0.60 0.00 0.00 56.93 53.80 1jv3 s PHE 323 Cb 0.14 -3.54 0.25 0.00 0.51 0.00 0.00 43.02 40.38 1jv3 s PHE 323 CO 0.77 -0.90 1.20 0.27 0.70 0.00 0.00 175.22 177.26 1jv3 n ASN 324 N 3.36 2.76 -4.42 1.36 6.94 -1.23 -4.86 115.26 119.18 1jv3 n ASN 324 Ca 0.15 -2.18 -0.45 0.00 -0.02 0.00 0.00 54.58 52.08 1jv3 n ASN 324 Cb 0.41 -0.22 -0.01 0.00 -2.36 0.00 0.00 39.78 37.60 1jv3 n ASN 324 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1jv3 s ALA 325 N -1.32 3.85 -0.41 -2.53 0.00 -1.26 -1.07 121.76 119.01 1jv3 s ALA 325 Ca 0.20 -3.17 -0.29 0.00 0.00 0.00 0.00 51.96 48.70 1jv3 s ALA 325 Cb 0.12 -3.91 0.02 0.00 0.00 0.00 0.00 23.12 19.36 1jv3 s ALA 325 CO 0.10 -2.69 1.13 0.20 0.00 0.00 0.00 175.76 174.50 1jv3 s GLY 326 N 2.85 1.39 -0.06 0.00 0.00 -0.52 -1.11 107.32 109.86 1jv3 s GLY 326 Ca 0.32 -0.29 -0.34 0.00 0.00 0.00 0.00 44.72 44.42 1jv3 s GLY 326 CO -0.07 2.38 1.87 -2.01 0.00 0.00 0.00 173.10 175.28 1jv3 n ASN 327 N 7.51 3.49 -1.23 1.64 5.15 -0.07 -1.87 115.26 129.89 1jv3 n ASN 327 Ca 0.12 0.97 0.04 0.00 -0.60 0.00 0.00 54.58 55.12 1jv3 n ASN 327 Cb 0.48 -1.39 0.27 0.00 -0.53 0.00 0.00 39.78 38.62 1jv3 n ASN 327 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1jv3 n ILE 328 N 5.09 2.49 -3.65 -1.44 -5.35 -1.15 -4.44 119.36 110.91 1jv3 n ILE 328 Ca 0.22 -1.93 -0.24 0.00 -0.27 0.00 0.00 62.75 60.53 1jv3 n ILE 328 Cb 0.30 -0.29 0.07 0.00 -1.74 0.00 0.00 39.64 37.98 1jv3 n ILE 328 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1jv3 n ALA 329 N -0.44 -1.48 -3.80 -1.28 0.00 -1.26 -4.77 120.51 107.48 1jv3 n ALA 329 Ca 0.27 0.24 -0.29 0.00 0.00 0.00 0.00 53.44 53.66 1jv3 n ALA 329 Cb 1.03 -4.51 -0.16 0.00 0.00 0.00 0.00 19.45 15.82 1jv3 n ALA 329 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1jv3 s ASN 330 N -3.57 3.37 0.13 0.00 0.01 -1.26 -2.29 114.94 111.34 1jv3 s ASN 330 Ca 0.46 -1.05 0.09 0.00 -0.71 0.00 0.00 52.86 51.65 1jv3 s ASN 330 Cb -0.21 -0.83 -0.04 0.00 0.41 0.00 0.00 41.25 40.58 1jv3 s ASN 330 CO 0.76 -0.30 -0.20 -1.00 -1.51 0.00 0.00 177.10 174.85 1jv3 s HIS 331 N 1.67 1.84 -0.19 2.20 3.76 0.17 -0.83 115.29 123.92 1jv3 s HIS 331 Ca -0.01 -0.44 -0.04 0.00 -0.15 0.00 0.00 55.06 54.43 1jv3 s HIS 331 Cb -0.18 -0.97 -0.02 0.00 1.11 0.00 0.00 32.58 32.53 1jv3 s HIS 331 CO -0.09 0.28 -0.04 0.12 -0.85 0.00 0.00 174.74 174.15 1jv3 s PHE 332 N -1.56 2.97 -0.02 1.40 5.36 0.12 -0.02 117.98 126.22 1jv3 s PHE 332 Ca 0.11 -0.64 0.04 0.00 -0.96 0.00 0.00 56.93 55.48 1jv3 s PHE 332 Cb -0.08 -2.03 -0.01 0.00 -0.34 0.00 0.00 43.02 40.56 1jv3 s PHE 332 CO 0.06 -0.32 -0.12 -0.06 -1.46 0.00 0.00 175.22 173.31 1jv3 s PHE 333 N 0.98 1.14 0.49 10.12 2.99 0.04 -0.35 117.98 133.39 1jv3 s PHE 333 Ca 0.00 -0.25 -0.05 0.00 0.00 0.00 0.00 56.93 56.64 1jv3 s PHE 333 Cb -0.15 -0.75 -0.03 0.00 0.00 0.00 0.00 43.02 42.09 1jv3 s PHE 333 CO 0.01 -0.05 0.78 0.95 -0.00 0.00 0.00 175.22 176.90 1jv3 s THR 334 N -0.13 4.71 0.17 0.64 -4.23 -0.87 -0.17 115.64 115.75 1jv3 s THR 334 Ca 0.02 0.09 -0.10 0.00 -1.18 0.00 0.00 61.69 60.52 1jv3 s THR 334 Cb -0.06 -3.79 0.04 0.00 1.34 0.00 0.00 72.50 70.03 1jv3 s THR 334 CO 0.00 -0.75 1.62 0.58 -0.54 0.00 0.00 174.62 175.52 1jv3 h VAL 335 N 0.21 1.27 -0.93 2.29 2.07 -1.27 -2.37 116.25 117.52 1jv3 h VAL 335 Ca -0.47 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 65.91 1jv3 h VAL 335 Cb 1.21 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 31.83 1jv3 h VAL 335 CO 0.61 0.41 0.59 -0.65 0.02 0.00 0.00 177.57 178.56 1jv3 h PRO 336 N 0.88 1.24 -0.41 1.57 0.11 -1.91 -0.21 132.00 133.26 1jv3 h PRO 336 Ca 0.16 -0.09 -0.02 0.00 0.11 0.00 0.00 66.00 66.16 1jv3 h PRO 336 Cb 0.57 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 31.39 1jv3 h PRO 336 CO 0.03 0.84 0.19 0.35 -0.21 0.00 0.00 178.00 179.20 1jv3 h PHE 337 N 1.27 0.60 -0.80 0.65 3.57 -1.85 -2.05 116.94 118.33 1jv3 h PHE 337 Ca 0.34 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.80 1jv3 h PHE 337 Cb -0.11 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.41 1jv3 h PHE 337 CO 0.00 0.50 0.49 -0.07 -2.23 0.00 0.00 178.31 177.01 1jv3 h LEU 338 N 0.52 0.95 -0.29 0.59 3.38 -0.85 -0.71 115.31 118.91 1jv3 h LEU 338 Ca 0.14 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.07 1jv3 h LEU 338 Cb 0.14 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1jv3 h LEU 338 CO -0.02 0.73 0.17 -0.09 0.09 0.00 0.00 178.44 179.33 1jv3 h ARG 339 N 1.10 0.35 -0.96 1.13 2.43 -0.61 0.93 114.38 118.76 1jv3 h ARG 339 Ca 0.29 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.45 1jv3 h ARG 339 Cb -0.05 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.37 1jv3 h ARG 339 CO -0.06 0.23 0.63 -0.44 -1.51 0.00 0.00 179.97 178.83 1jv3 h ASP 340 N 0.36 1.08 0.01 -3.80 3.45 -0.72 -0.41 116.42 116.39 1jv3 h ASP 340 Ca 0.11 -0.02 -0.00 0.00 0.43 0.00 0.00 57.03 57.55 1jv3 h ASP 340 Cb -0.02 -0.27 0.00 0.00 -0.56 0.00 0.00 39.33 38.49 1jv3 h ASP 340 CO -0.04 0.78 -0.00 0.58 -1.57 0.00 0.00 179.24 178.98 1jv3 h VAL 341 N 1.28 1.19 -0.52 -1.35 2.07 -0.54 0.34 116.25 118.72 1jv3 h VAL 341 Ca 0.36 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 1jv3 h VAL 341 Cb -0.12 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1jv3 h VAL 341 CO -0.08 0.15 0.19 0.58 0.02 0.00 0.00 177.57 178.42 1jv3 h VAL 342 N -0.27 1.20 -0.12 2.57 2.07 -0.50 0.03 116.25 121.23 1jv3 h VAL 342 Ca -0.00 -0.65 0.00 0.00 0.82 0.00 0.00 66.70 66.87 1jv3 h VAL 342 Cb 0.26 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1jv3 h VAL 342 CO 0.00 0.25 0.00 0.59 0.02 0.00 0.00 177.57 178.43 1jv3 n ASN 343 N -4.33 2.96 0.05 0.57 4.13 -0.19 -4.75 115.26 113.69 1jv3 n ASN 343 Ca 0.04 -1.92 0.00 0.00 1.68 0.00 0.00 54.58 54.38 1jv3 n ASN 343 Cb 0.17 -0.06 0.00 0.00 -1.54 0.00 0.00 39.78 38.35 1jv3 n ASN 343 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 1jv3 n VAL 344 N 1.26 0.00 -0.04 2.41 0.31 0.08 -4.99 118.33 117.36 1jv3 n VAL 344 Ca 0.14 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.42 1jv3 n VAL 344 Cb 0.55 -0.13 0.15 0.00 -0.91 0.00 0.00 33.84 33.50 1jv3 n VAL 344 CO 0.00 0.00 0.00 1.88 -1.32 0.00 0.00 176.83 177.39 1jv3 h TYR 345 N 0.00 0.72 -0.60 3.52 0.99 -1.27 -3.37 116.97 116.97 1jv3 h TYR 345 Ca 0.00 -0.15 0.11 0.00 2.00 0.00 0.00 58.73 60.68 1jv3 h TYR 345 Cb 0.00 -0.18 -0.11 0.00 1.00 0.00 0.00 36.73 37.45 1jv3 h TYR 345 CO 0.00 0.81 -0.20 -1.91 -0.00 0.00 0.00 178.16 176.86 1jv3 n GLU 346 N -4.13 -0.10 0.26 4.88 0.00 -0.02 0.13 120.64 121.66 1jv3 n GLU 346 Ca 0.00 0.94 0.18 0.00 0.00 0.00 0.00 57.16 58.27 1jv3 n GLU 346 Cb 0.41 -1.39 0.90 0.00 0.00 0.00 0.00 31.44 31.35 1jv3 n GLU 346 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 1jv3 h PRO 347 N 0.00 0.00 -0.00 5.31 0.11 -1.87 -0.48 132.00 135.07 1jv3 h PRO 347 Ca 0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.36 1jv3 h PRO 347 Cb 0.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1jv3 h PRO 347 CO -0.61 0.00 -0.09 1.04 -0.21 0.00 0.00 178.00 178.13 1jv3 n GLN 348 N -2.75 0.77 -2.65 1.05 6.02 0.34 -4.79 117.38 115.38 1jv3 n GLN 348 Ca -0.02 -0.25 -0.42 0.00 -0.01 0.00 0.00 57.00 56.30 1jv3 n GLN 348 Cb 0.10 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.83 1jv3 n GLN 348 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1jv3 s LEU 349 N -2.40 4.36 0.20 1.08 1.43 -0.19 -5.03 118.68 118.13 1jv3 s LEU 349 Ca 0.31 1.73 -0.00 0.00 -1.03 0.00 0.00 54.13 55.14 1jv3 s LEU 349 Cb 0.20 -3.57 -0.04 0.00 0.03 0.00 0.00 46.19 42.81 1jv3 s LEU 349 CO 0.46 -0.31 0.38 -1.10 0.23 0.00 0.00 176.35 176.00 1jv3 s GLN 350 N 1.07 3.51 0.16 1.70 -0.21 -1.26 -5.07 119.66 119.55 1jv3 s GLN 350 Ca 0.53 -0.37 -0.29 0.00 0.02 0.00 0.00 55.36 55.26 1jv3 s GLN 350 Cb -0.23 -2.85 -0.07 0.00 1.00 0.00 0.00 33.01 30.86 1jv3 s GLN 350 CO 0.28 0.41 0.90 -1.01 -2.12 0.00 0.00 175.29 173.75 1jv3 s HIS 351 N -1.86 3.88 -0.11 0.91 3.76 -1.26 -4.55 115.29 116.05 1jv3 s HIS 351 Ca 0.38 1.78 -0.12 0.00 -0.15 0.00 0.00 55.06 56.95 1jv3 s HIS 351 Cb -0.11 -2.96 -0.05 0.00 1.11 0.00 0.00 32.58 30.57 1jv3 s HIS 351 CO 0.29 0.35 0.28 -1.01 -0.85 0.00 0.00 174.74 173.79 1jv3 s HIS 352 N -0.59 3.57 -0.16 1.40 3.76 0.22 -4.86 115.29 118.64 1jv3 s HIS 352 Ca 0.42 0.67 -0.03 0.00 -0.15 0.00 0.00 55.06 55.98 1jv3 s HIS 352 Cb -0.24 -2.22 -0.02 0.00 1.11 0.00 0.00 32.58 31.21 1jv3 s HIS 352 CO 0.29 0.48 -0.07 0.08 -0.85 0.00 0.00 174.74 174.67 1jv3 s VAL 353 N -0.33 3.57 -0.04 -0.90 1.01 -1.26 -1.84 120.40 120.61 1jv3 s VAL 353 Ca 0.18 -0.47 0.06 0.00 0.00 0.00 0.00 61.98 61.75 1jv3 s VAL 353 Cb -0.14 -2.55 -0.02 0.00 0.00 0.00 0.00 36.38 33.67 1jv3 s VAL 353 CO 0.06 0.49 -0.21 0.00 0.00 0.00 0.00 175.10 175.44 1jv3 s ALA 354 N 0.49 2.35 -0.38 5.51 0.00 -0.89 -4.97 121.76 123.87 1jv3 s ALA 354 Ca -0.05 -1.06 -0.21 0.00 0.00 0.00 0.00 51.96 50.64 1jv3 s ALA 354 Cb -0.15 -0.72 0.01 0.00 0.00 0.00 0.00 23.12 22.26 1jv3 s ALA 354 CO 0.03 0.53 0.67 -0.65 0.00 0.00 0.00 175.76 176.34 1jv3 s GLN 355 N -0.61 3.57 0.39 0.00 -0.21 -1.26 -1.20 119.66 120.35 1jv3 s GLN 355 Ca 0.09 -0.03 0.08 0.00 0.02 0.00 0.00 55.36 55.52 1jv3 s GLN 355 Cb -0.11 -3.85 -0.08 0.00 1.00 0.00 0.00 33.01 29.98 1jv3 s GLN 355 CO -0.00 -0.85 -0.01 0.15 -2.12 0.00 0.00 175.29 172.47 1jv3 s LYS 356 N 2.83 1.94 -0.49 2.91 1.02 -0.39 -4.97 119.74 122.60 1jv3 s LYS 356 Ca 0.25 -2.06 -0.16 0.00 0.02 0.00 0.00 55.97 54.03 1jv3 s LYS 356 Cb -0.14 -1.67 0.09 0.00 -0.52 0.00 0.00 37.83 35.59 1jv3 s LYS 356 CO 0.17 -0.01 0.42 0.15 -0.92 0.00 0.00 175.35 175.16 1jv3 s LYS 357 N -3.69 2.98 -0.33 1.68 1.02 -1.26 -1.47 119.74 118.67 1jv3 s LYS 357 Ca 0.35 -1.44 -0.12 0.00 0.02 0.00 0.00 55.97 54.77 1jv3 s LYS 357 Cb 0.08 -4.17 -0.02 0.00 -0.52 0.00 0.00 37.83 33.19 1jv3 s LYS 357 CO 0.18 -1.10 0.22 0.42 -0.92 0.00 0.00 175.35 174.14 1jv3 s ILE 358 N 1.63 5.18 0.36 2.17 1.09 -1.26 -4.92 121.20 125.45 1jv3 s ILE 358 Ca 0.04 -0.18 -0.28 0.00 -1.10 0.00 0.00 60.65 59.12 1jv3 s ILE 358 Cb -0.26 -3.63 -0.11 0.00 -1.06 0.00 0.00 42.46 37.40 1jv3 s ILE 358 CO 0.06 0.05 1.50 -0.81 -0.10 0.00 0.00 174.94 175.63 1jv3 n PRO 359 N 5.08 2.64 -4.02 2.79 -0.04 -1.26 -4.64 135.00 135.55 1jv3 n PRO 359 Ca -0.13 0.93 -0.11 0.00 -0.04 0.00 0.00 63.50 64.15 1jv3 n PRO 359 Cb 0.50 -2.66 -0.04 0.00 -0.04 0.00 0.00 33.50 31.25 1jv3 n PRO 359 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1jv3 s TYR 360 N -0.87 0.59 -0.20 0.54 -0.85 -0.86 -4.63 117.35 111.07 1jv3 s TYR 360 Ca 0.56 -0.94 -0.07 0.00 -0.52 0.00 0.00 57.07 56.10 1jv3 s TYR 360 Cb -0.49 0.13 -0.04 0.00 0.38 0.00 0.00 41.96 41.95 1jv3 s TYR 360 CO 0.60 -1.08 0.05 0.54 -1.52 0.00 0.00 175.55 174.15 1jv3 s VAL 361 N -3.57 4.55 0.90 -3.49 0.11 -1.05 -0.07 120.40 117.79 1jv3 s VAL 361 Ca 0.25 -0.11 -0.12 0.00 -2.93 0.00 0.00 61.98 59.07 1jv3 s VAL 361 Cb -0.01 -3.07 0.19 0.00 -1.53 0.00 0.00 36.38 31.96 1jv3 s VAL 361 CO 0.13 0.43 1.24 1.51 -3.33 0.00 0.00 175.10 175.07 1jv3 s ASP 362 N 0.72 3.40 0.66 3.54 1.47 -0.84 -4.86 116.67 120.77 1jv3 s ASP 362 Ca 0.03 0.06 0.44 0.00 1.18 0.00 0.00 52.55 54.26 1jv3 s ASP 362 Cb -0.13 -0.17 2.39 0.00 -0.34 0.00 0.00 42.92 44.67 1jv3 s ASP 362 CO 0.02 -2.53 2.36 0.71 0.68 0.00 0.00 175.17 176.41 1jv3 h THR 363 N -1.35 0.01 -0.01 2.11 1.35 -1.99 0.17 112.91 113.20 1jv3 h THR 363 Ca -0.42 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 1jv3 h THR 363 Cb 1.24 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 1jv3 h THR 363 CO 0.37 0.00 -0.06 0.00 -0.25 0.00 0.00 175.52 175.58 1jv3 n GLN 364 N -3.09 1.23 -0.91 4.72 1.13 -1.26 -4.92 117.38 114.27 1jv3 n GLN 364 Ca -0.03 -0.58 0.00 0.00 -1.94 0.00 0.00 57.00 54.45 1jv3 n GLN 364 Cb 0.08 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 28.94 1jv3 n GLN 364 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1jv3 n GLY 365 N 1.19 0.51 3.63 1.08 0.00 0.61 -5.05 105.19 107.16 1jv3 n GLY 365 Ca 0.18 -0.36 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 1jv3 n GLY 365 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1jv3 s GLN 366 N -0.72 3.55 0.09 1.61 -2.07 -1.26 -4.81 119.66 116.05 1jv3 s GLN 366 Ca 0.00 -0.40 -0.31 0.00 -1.82 0.00 0.00 55.36 52.83 1jv3 s GLN 366 Cb 0.00 -3.00 -0.08 0.00 -1.09 0.00 0.00 33.01 28.84 1jv3 s GLN 366 CO 0.00 0.43 1.60 -0.51 -1.32 0.00 0.00 175.29 175.49 1jv3 s LEU 367 N -0.12 4.36 0.02 2.60 1.43 -1.26 -1.98 118.68 123.74 1jv3 s LEU 367 Ca 0.05 2.47 0.06 0.00 -1.03 0.00 0.00 54.13 55.68 1jv3 s LEU 367 Cb -0.12 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.51 1jv3 s LEU 367 CO 0.02 -0.85 -0.17 -0.63 0.23 0.00 0.00 176.35 174.96 1jv3 s ILE 368 N 2.22 1.32 -0.44 -0.59 1.01 0.90 -4.98 121.20 120.64 1jv3 s ILE 368 Ca 0.72 -0.95 -0.07 0.00 0.00 0.00 0.00 60.65 60.34 1jv3 s ILE 368 Cb -0.40 -1.15 0.10 0.00 0.01 0.00 0.00 42.46 41.03 1jv3 s ILE 368 CO 0.31 0.18 0.27 -0.54 0.00 0.00 0.00 174.94 175.16 1jv3 s LYS 369 N -0.90 2.38 0.25 2.79 3.01 -1.26 -2.02 119.74 123.98 1jv3 s LYS 369 Ca 0.05 -1.69 -0.30 0.00 -1.01 0.00 0.00 55.97 53.01 1jv3 s LYS 369 Cb -0.08 -3.77 -0.14 0.00 -1.01 0.00 0.00 37.83 32.83 1jv3 s LYS 369 CO 0.01 -1.08 1.25 -0.35 0.51 0.00 0.00 175.35 175.68 1jv3 n PRO 370 N 4.82 1.69 0.11 -1.68 -0.04 -1.26 -4.91 135.00 133.73 1jv3 n PRO 370 Ca -0.07 0.60 0.02 0.00 -0.04 0.00 0.00 63.50 64.01 1jv3 n PRO 370 Cb 0.41 -2.15 -0.00 0.00 -0.04 0.00 0.00 33.50 31.73 1jv3 n PRO 370 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1jv3 h ASP 371 N 3.30 0.00 -4.22 3.54 3.32 -2.00 -3.46 116.42 116.90 1jv3 h ASP 371 Ca -0.44 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.07 1jv3 h ASP 371 Cb 1.31 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.64 1jv3 h ASP 371 CO 0.69 0.52 -0.82 -0.54 -1.72 0.00 0.00 179.24 177.37 1jv3 s LYS 372 N -2.96 1.09 0.22 3.56 1.02 -1.26 -5.10 119.74 116.32 1jv3 s LYS 372 Ca 0.02 -1.14 -0.32 0.00 0.02 0.00 0.00 55.97 54.56 1jv3 s LYS 372 Cb 0.08 -1.33 -0.14 0.00 -0.52 0.00 0.00 37.83 35.93 1jv3 s LYS 372 CO 0.76 0.31 1.40 -2.30 -0.92 0.00 0.00 175.35 174.60 1jv3 n PRO 373 N 1.11 1.95 0.00 -1.68 -0.02 -1.26 -4.79 135.00 130.31 1jv3 n PRO 373 Ca -0.20 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 1jv3 n PRO 373 Cb 0.54 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 1jv3 n PRO 373 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1jv3 n ASN 374 N 2.27 1.69 -2.17 2.55 6.94 -0.54 -4.94 115.26 121.07 1jv3 n ASN 374 Ca 0.13 -1.80 0.00 0.00 -0.02 0.00 0.00 54.58 52.89 1jv3 n ASN 374 Cb 0.30 0.00 0.01 0.00 -2.36 0.00 0.00 39.78 37.73 1jv3 n ASN 374 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1jv3 n GLY 375 N -0.40 0.62 3.38 4.83 0.00 -1.13 -3.86 105.19 108.64 1jv3 n GLY 375 Ca 0.00 -0.96 -0.20 0.00 0.00 0.00 0.00 46.02 44.86 1jv3 n GLY 375 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1jv3 s ILE 376 N -2.17 1.86 -0.10 -0.61 -4.36 0.13 -1.26 121.20 114.69 1jv3 s ILE 376 Ca 0.12 -2.23 0.02 0.00 -0.26 0.00 0.00 60.65 58.30 1jv3 s ILE 376 Cb -0.01 -2.15 0.01 0.00 1.25 0.00 0.00 42.46 41.56 1jv3 s ILE 376 CO 0.01 -0.52 -0.17 -0.75 0.24 0.00 0.00 174.94 173.75 1jv3 s LYS 377 N -3.63 2.32 -0.12 0.37 2.20 -0.34 -2.70 119.74 117.83 1jv3 s LYS 377 Ca 0.25 -0.61 -0.06 0.00 -0.36 0.00 0.00 55.97 55.18 1jv3 s LYS 377 Cb -0.01 -1.89 -0.04 0.00 -1.51 0.00 0.00 37.83 34.38 1jv3 s LYS 377 CO 0.09 0.01 0.12 -1.64 -0.36 0.00 0.00 175.35 173.57 1jv3 s MET 378 N 0.76 3.43 -0.11 4.03 -1.94 -1.26 -2.10 119.30 122.10 1jv3 s MET 378 Ca -0.11 -0.18 -0.22 0.00 -1.71 0.00 0.00 55.69 53.48 1jv3 s MET 378 Cb -0.16 -3.15 0.05 0.00 2.01 0.00 0.00 34.83 33.58 1jv3 s MET 378 CO 0.02 0.73 0.53 -1.83 -0.01 0.00 0.00 175.02 174.46 1jv3 s GLU 379 N -0.91 0.77 0.16 2.03 -1.05 -0.77 -4.56 118.70 114.38 1jv3 s GLU 379 Ca 0.14 0.37 0.02 0.00 -0.15 0.00 0.00 54.97 55.36 1jv3 s GLU 379 Cb -0.12 0.37 -0.04 0.00 -0.44 0.00 0.00 34.13 33.90 1jv3 s GLU 379 CO 0.03 -0.18 0.31 0.15 0.95 0.00 0.00 175.26 176.52 1jv3 s LYS 380 N -0.56 3.45 -0.07 -4.83 1.02 -0.72 0.72 119.74 118.76 1jv3 s LYS 380 Ca -0.07 -0.58 0.01 0.00 0.02 0.00 0.00 55.97 55.35 1jv3 s LYS 380 Cb -0.03 -2.94 -0.03 0.00 -0.52 0.00 0.00 37.83 34.31 1jv3 s LYS 380 CO 0.04 0.50 -0.07 -0.06 -0.92 0.00 0.00 175.35 174.84 1jv3 s PHE 381 N -1.78 2.93 0.46 3.18 0.08 -1.26 -0.46 117.98 121.13 1jv3 s PHE 381 Ca 0.35 0.01 0.15 0.00 0.12 0.00 0.00 56.93 57.56 1jv3 s PHE 381 Cb -0.11 -1.72 1.07 0.00 -0.57 0.00 0.00 43.02 41.70 1jv3 s PHE 381 CO 0.29 0.32 2.02 -0.24 -0.10 0.00 0.00 175.22 177.50 1jv3 h VAL 382 N 4.28 1.08 -0.01 -0.44 3.04 -1.87 -2.32 116.25 120.02 1jv3 h VAL 382 Ca -0.48 -0.52 0.00 0.00 -1.01 0.00 0.00 66.70 64.69 1jv3 h VAL 382 Cb 1.17 1.28 0.00 0.00 -2.01 0.00 0.00 31.29 31.74 1jv3 h VAL 382 CO 0.53 0.15 0.00 2.22 -1.01 0.00 0.00 177.57 179.45 1jv3 n PHE 383 N -4.32 0.00 1.09 3.17 1.16 -1.26 -3.82 117.46 113.49 1jv3 n PHE 383 Ca -0.03 -0.00 0.08 0.00 -1.87 0.00 0.00 57.45 55.63 1jv3 n PHE 383 Cb 0.22 0.00 0.47 0.00 -1.61 0.00 0.00 39.48 38.56 1jv3 n PHE 383 CO 0.00 0.00 0.00 -0.25 -1.87 0.00 0.00 176.76 174.64 1jv3 n ASP 384 N -0.54 0.00 -0.43 5.98 10.43 -0.87 -1.98 116.55 129.14 1jv3 n ASP 384 Ca 0.22 -0.59 0.12 0.00 2.57 0.00 0.00 54.79 57.11 1jv3 n ASP 384 Cb 0.20 0.00 0.16 0.00 1.84 0.00 0.00 41.12 43.32 1jv3 n ASP 384 CO 0.00 0.00 0.00 2.30 -1.07 0.00 0.00 177.20 178.43 1jv3 n ILE 385 N -0.96 0.00 -0.35 0.53 -5.35 -1.25 -4.25 119.36 107.74 1jv3 n ILE 385 Ca 0.12 -0.22 0.06 0.00 -0.27 0.00 0.00 62.75 62.44 1jv3 n ILE 385 Cb 0.05 0.93 0.22 0.00 -1.74 0.00 0.00 39.64 39.10 1jv3 n ILE 385 CO 0.00 0.00 0.00 -0.26 -1.76 0.00 0.00 176.55 174.53 1jv3 h PHE 386 N 2.09 1.09 -0.14 4.28 -1.00 -1.67 -0.95 116.94 120.64 1jv3 h PHE 386 Ca 0.00 0.03 0.04 0.00 2.81 0.00 0.00 57.97 60.85 1jv3 h PHE 386 Cb 0.67 -0.34 -0.01 0.00 3.61 0.00 0.00 35.95 39.88 1jv3 h PHE 386 CO 0.00 0.45 0.19 -0.56 -1.61 0.00 0.00 178.31 176.78 1jv3 h GLN 387 N 0.97 0.00 -0.02 1.51 3.07 -1.64 -1.26 115.11 117.74 1jv3 h GLN 387 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.21 1jv3 h GLN 387 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.99 1jv3 h GLN 387 CO -0.25 0.00 -0.02 1.19 0.09 0.00 0.00 178.83 179.84 1jv3 n PHE 388 N -3.61 0.00 -2.20 0.06 3.01 -0.36 -4.75 117.46 109.60 1jv3 n PHE 388 Ca 0.01 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 58.09 1jv3 n PHE 388 Cb 0.30 -0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.76 1jv3 n PHE 388 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1jv3 s ALA 389 N -2.02 3.04 0.07 4.37 0.00 -0.48 -4.94 121.76 121.79 1jv3 s ALA 389 Ca 0.33 1.02 0.09 0.00 0.00 0.00 0.00 51.96 53.39 1jv3 s ALA 389 Cb 0.20 -3.41 -0.21 0.00 0.00 0.00 0.00 23.12 19.71 1jv3 s ALA 389 CO 0.33 -0.72 1.12 0.87 0.00 0.00 0.00 175.76 177.36 1jv3 h LYS 390 N 2.21 0.00 -1.82 0.00 1.57 -1.93 -3.43 116.57 113.18 1jv3 h LYS 390 Ca -0.49 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.05 1jv3 h LYS 390 Cb 1.25 0.00 -0.30 0.00 0.08 0.00 0.00 32.23 33.26 1jv3 h LYS 390 CO 0.61 0.84 -0.57 0.21 -0.57 0.00 0.00 179.45 179.97 1jv3 s LYS 391 N -2.69 0.41 -0.12 3.15 2.47 -1.26 -5.00 119.74 116.69 1jv3 s LYS 391 Ca -0.00 0.01 -0.11 0.00 -1.56 0.00 0.00 55.97 54.30 1jv3 s LYS 391 Cb 0.09 -0.41 -0.05 0.00 -1.46 0.00 0.00 37.83 36.01 1jv3 s LYS 391 CO 0.82 -1.05 0.25 0.12 0.16 0.00 0.00 175.35 175.65 1jv3 s PHE 392 N 2.44 3.55 0.15 4.03 5.36 -1.26 -1.22 117.98 131.03 1jv3 s PHE 392 Ca 0.10 0.62 0.04 0.00 -0.96 0.00 0.00 56.93 56.73 1jv3 s PHE 392 Cb -0.13 -2.19 -0.04 0.00 -0.34 0.00 0.00 43.02 40.32 1jv3 s PHE 392 CO -0.29 0.48 -0.09 0.14 -1.46 0.00 0.00 175.22 174.00 1jv3 s VAL 393 N -0.31 1.11 -0.02 3.12 -7.23 -0.46 -4.92 120.40 111.69 1jv3 s VAL 393 Ca 0.16 -2.05 0.06 0.00 -1.81 0.00 0.00 61.98 58.35 1jv3 s VAL 393 Cb -0.13 -1.89 -0.01 0.00 0.56 0.00 0.00 36.38 34.91 1jv3 s VAL 393 CO 0.05 -0.71 -0.22 -0.69 -0.31 0.00 0.00 175.10 173.22 1jv3 s VAL 394 N -3.37 1.73 -0.17 1.32 1.01 0.80 -1.58 120.40 120.15 1jv3 s VAL 394 Ca 0.18 -0.93 -0.01 0.00 0.00 0.00 0.00 61.98 61.22 1jv3 s VAL 394 Cb 0.03 -1.44 0.05 0.00 0.00 0.00 0.00 36.38 35.01 1jv3 s VAL 394 CO 0.01 0.49 -0.03 -0.47 0.00 0.00 0.00 175.10 175.10 1jv3 s TYR 395 N -0.42 1.56 -0.16 5.22 5.04 -0.23 0.23 117.35 128.59 1jv3 s TYR 395 Ca 0.06 -1.04 -0.13 0.00 -2.44 0.00 0.00 57.07 53.52 1jv3 s TYR 395 Cb -0.09 -1.25 -0.05 0.00 0.35 0.00 0.00 41.96 40.92 1jv3 s TYR 395 CO -0.00 -0.61 0.26 -2.00 -1.34 0.00 0.00 175.55 171.86 1jv3 s GLU 396 N 1.68 4.18 0.33 4.97 2.12 -0.15 -0.29 118.70 131.54 1jv3 s GLU 396 Ca 0.00 0.03 0.04 0.00 0.36 0.00 0.00 54.97 55.40 1jv3 s GLU 396 Cb -0.16 -3.40 -0.07 0.00 0.26 0.00 0.00 34.13 30.77 1jv3 s GLU 396 CO -0.07 0.30 0.05 0.14 -0.54 0.00 0.00 175.26 175.14 1jv3 s VAL 397 N 0.30 1.27 0.04 3.70 -7.23 -0.29 -1.17 120.40 117.01 1jv3 s VAL 397 Ca 0.15 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 58.05 1jv3 s VAL 397 Cb -0.13 -2.81 -0.05 0.00 0.56 0.00 0.00 36.38 33.96 1jv3 s VAL 397 CO 0.03 -0.01 0.83 -0.76 -0.31 0.00 0.00 175.10 174.88 1jv3 s LEU 398 N -3.50 4.44 0.30 1.32 1.43 -1.26 -4.30 118.68 117.11 1jv3 s LEU 398 Ca 0.36 1.52 0.01 0.00 -1.03 0.00 0.00 54.13 55.00 1jv3 s LEU 398 Cb 0.09 -3.34 0.48 0.00 0.03 0.00 0.00 46.19 43.45 1jv3 s LEU 398 CO 0.16 -0.05 1.85 0.08 0.23 0.00 0.00 176.35 178.61 1jv3 h ARG 399 N 5.88 0.72 0.00 1.70 0.11 -1.94 -1.80 114.38 119.05 1jv3 h ARG 399 Ca -0.43 -0.15 -0.00 0.00 0.10 0.00 0.00 59.98 59.50 1jv3 h ARG 399 Cb 1.21 -0.11 -0.00 0.00 1.11 0.00 0.00 29.97 32.18 1jv3 h ARG 399 CO 0.72 0.67 -0.02 1.05 0.10 0.00 0.00 179.97 182.49 1jv3 h GLU 400 N 0.69 0.00 0.00 0.08 9.09 -1.94 0.19 114.58 122.69 1jv3 h GLU 400 Ca 0.15 0.00 -0.11 0.00 0.05 0.00 0.00 59.36 59.45 1jv3 h GLU 400 Cb 0.30 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.38 1jv3 h GLU 400 CO 0.00 0.02 -1.71 -0.25 0.05 0.00 0.00 179.01 177.13 1jv3 n ASP 401 N -3.46 0.42 0.00 3.06 8.00 -0.78 -4.77 116.55 119.01 1jv3 n ASP 401 Ca -0.03 0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.65 1jv3 n ASP 401 Cb 0.11 0.99 0.00 0.00 -0.02 0.00 0.00 41.12 42.20 1jv3 n ASP 401 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1jv3 n GLU 402 N -2.61 0.64 -3.49 -1.24 1.02 -0.75 -4.91 120.64 109.30 1jv3 n GLU 402 Ca -0.10 -0.03 -0.21 0.00 -0.02 0.00 0.00 57.16 56.80 1jv3 n GLU 402 Cb 0.75 -0.26 -0.13 0.00 -0.02 0.00 0.00 31.44 31.78 1jv3 n GLU 402 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 1jv3 s PHE 403 N -0.10 -0.14 -0.38 -0.32 5.36 0.59 -4.22 117.98 118.77 1jv3 s PHE 403 Ca 0.00 -0.25 0.03 0.00 -0.96 0.00 0.00 56.93 55.75 1jv3 s PHE 403 Cb 0.00 -0.57 0.16 0.00 -0.34 0.00 0.00 43.02 42.27 1jv3 s PHE 403 CO 0.00 -0.76 0.34 0.45 -1.46 0.00 0.00 175.22 173.79 1jv3 s SER 404 N 2.26 1.60 0.48 6.13 0.15 -1.26 -4.70 113.70 118.35 1jv3 s SER 404 Ca 0.08 -2.04 -0.22 0.00 0.70 0.00 0.00 55.95 54.47 1jv3 s SER 404 Cb -0.15 0.18 -0.07 0.00 -1.71 0.00 0.00 66.02 64.26 1jv3 s SER 404 CO -0.25 -0.25 1.11 -2.16 1.20 0.00 0.00 173.24 172.89 1jv3 s PRO 405 N 1.04 3.72 -0.43 5.44 0.04 -1.26 -3.34 135.00 140.21 1jv3 s PRO 405 Ca 0.21 1.60 -0.06 0.00 0.04 0.00 0.00 61.00 62.79 1jv3 s PRO 405 Cb -0.14 -2.25 0.10 0.00 0.04 0.00 0.00 34.50 32.25 1jv3 s PRO 405 CO -0.04 -0.55 0.25 -1.17 0.04 0.00 0.00 177.00 175.54 1jv3 s LEU 406 N -3.27 5.31 0.00 -3.56 2.96 -0.41 -3.90 118.68 115.81 1jv3 s LEU 406 Ca 0.66 -1.82 0.00 0.00 -0.22 0.00 0.00 54.13 52.75 1jv3 s LEU 406 Cb -0.24 -1.92 0.00 0.00 0.50 0.00 0.00 46.19 44.53 1jv3 s LEU 406 CO 0.28 -0.58 0.00 0.29 -1.32 0.00 0.00 176.35 175.02 1jv3 n LYS 407 N 4.78 2.34 -4.39 1.98 4.76 0.53 -4.85 118.16 123.32 1jv3 n LYS 407 Ca -0.07 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.15 1jv3 n LYS 407 Cb 0.42 -0.89 -0.11 0.00 -1.84 0.00 0.00 35.03 32.61 1jv3 n LYS 407 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1jv3 s ASN 408 N -2.14 3.02 0.64 4.39 0.01 -0.09 -4.68 114.94 116.09 1jv3 s ASN 408 Ca 0.00 -0.95 -0.11 0.00 -0.71 0.00 0.00 52.86 51.09 1jv3 s ASN 408 Cb 0.00 -0.21 -0.03 0.00 0.41 0.00 0.00 41.25 41.43 1jv3 s ASN 408 CO 0.00 -0.02 1.04 0.00 -1.51 0.00 0.00 177.10 176.61 1jv3 s ALA 409 N -2.34 3.04 0.35 0.60 0.00 -1.26 -4.08 121.76 118.07 1jv3 s ALA 409 Ca 0.22 -0.12 0.04 0.00 0.00 0.00 0.00 51.96 52.11 1jv3 s ALA 409 Cb -0.05 -3.08 0.69 0.00 0.00 0.00 0.00 23.12 20.69 1jv3 s ALA 409 CO 0.09 -0.79 1.96 -0.44 0.00 0.00 0.00 175.76 176.58 1jv3 h ASP 410 N -0.40 0.71 0.00 0.00 3.45 -1.95 -2.57 116.42 115.67 1jv3 h ASP 410 Ca -0.44 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.02 1jv3 h ASP 410 Cb 1.20 -0.15 0.00 0.00 -0.56 0.00 0.00 39.33 39.82 1jv3 h ASP 410 CO 0.62 0.47 0.00 -1.54 -1.57 0.00 0.00 179.24 177.22 1jv3 n SER 411 N -4.47 0.00 0.00 6.45 3.41 -1.26 -4.56 113.62 113.19 1jv3 n SER 411 Ca 0.10 -1.21 0.00 0.00 -0.26 0.00 0.00 58.87 57.50 1jv3 n SER 411 Cb 0.19 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 1jv3 n SER 411 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jv3 n GLN 412 N -0.75 0.00 0.00 4.33 6.02 -0.97 -4.94 117.38 121.08 1jv3 n GLN 412 Ca 0.10 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.21 1jv3 n GLN 412 Cb 0.04 0.00 0.56 0.00 1.02 0.00 0.00 30.24 31.87 1jv3 n GLN 412 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1jv3 n ASN 413 N 0.00 0.00 0.00 1.08 0.23 -1.26 -4.94 115.26 110.37 1jv3 n ASN 413 Ca 0.00 0.35 0.00 0.00 -0.53 0.00 0.00 54.58 54.40 1jv3 n ASN 413 Cb 0.00 -0.44 0.00 0.00 -2.08 0.00 0.00 39.78 37.26 1jv3 n ASN 413 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1jv3 n GLY 414 N 1.04 0.58 3.24 4.83 0.00 -1.26 -5.08 105.19 108.53 1jv3 n GLY 414 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 1jv3 n GLY 414 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jv3 s LYS 415 N -0.97 1.20 -1.37 1.61 1.02 -1.26 -4.91 119.74 115.05 1jv3 s LYS 415 Ca 0.00 -1.61 -0.10 0.00 0.02 0.00 0.00 55.97 54.28 1jv3 s LYS 415 Cb 0.00 -0.05 0.01 0.00 -0.52 0.00 0.00 37.83 37.26 1jv3 s LYS 415 CO 0.00 -0.27 0.39 -0.25 -0.92 0.00 0.00 175.35 174.31 1jv3 n ASP 416 N -0.29 -1.36 -3.65 2.83 8.00 -1.26 -4.43 116.55 116.38 1jv3 n ASP 416 Ca -0.02 -1.15 -0.22 0.00 0.71 0.00 0.00 54.79 54.11 1jv3 n ASP 416 Cb 0.65 -2.39 -0.05 0.00 -0.02 0.00 0.00 41.12 39.30 1jv3 n ASP 416 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1jv3 n ASN 417 N -2.75 1.99 -0.28 -2.24 0.23 -1.25 -0.35 115.26 110.60 1jv3 n ASN 417 Ca -0.25 -2.70 0.02 0.00 -0.53 0.00 0.00 54.58 51.12 1jv3 n ASN 417 Cb 0.65 0.57 0.22 0.00 -2.08 0.00 0.00 39.78 39.15 1jv3 n ASN 417 CO 0.00 0.00 0.00 -0.65 -0.93 0.00 0.00 177.26 175.68 1jv3 h PRO 418 N 0.00 1.06 -0.32 -0.53 0.11 -1.91 -0.80 132.00 129.59 1jv3 h PRO 418 Ca -0.28 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.74 1jv3 h PRO 418 Cb 0.96 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.82 1jv3 h PRO 418 CO 0.46 0.70 0.11 1.15 -0.21 0.00 0.00 178.00 180.20 1jv3 h THR 419 N 1.09 1.20 -0.17 -1.15 2.02 -1.94 -0.92 112.91 113.04 1jv3 h THR 419 Ca 0.34 -0.64 -0.10 0.00 0.77 0.00 0.00 66.41 66.78 1jv3 h THR 419 Cb 0.01 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 1jv3 h THR 419 CO -0.10 0.22 -0.34 0.71 0.37 0.00 0.00 175.52 176.38 1jv3 h THR 420 N 0.37 1.29 0.24 3.16 1.35 -1.87 -2.42 112.91 115.03 1jv3 h THR 420 Ca 0.11 -1.40 -0.01 0.00 -0.55 0.00 0.00 66.41 64.55 1jv3 h THR 420 Cb 0.23 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 68.19 1jv3 h THR 420 CO -0.00 0.43 -0.12 0.00 -0.25 0.00 0.00 175.52 175.58 1jv3 h ALA 421 N 1.34 -0.33 -0.42 6.62 0.00 -0.91 -0.54 119.26 125.02 1jv3 h ALA 421 Ca 0.04 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1jv3 h ALA 421 Cb 0.75 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1jv3 h ALA 421 CO 0.06 -0.51 0.11 0.07 0.00 0.00 0.00 179.25 178.98 1jv3 h ARG 422 N -0.68 0.61 -0.07 0.00 0.11 -1.17 -2.12 114.38 111.06 1jv3 h ARG 422 Ca -0.03 -0.10 -0.12 0.00 0.10 0.00 0.00 59.98 59.83 1jv3 h ARG 422 Cb 0.47 -0.10 -0.01 0.00 1.11 0.00 0.00 29.97 31.44 1jv3 h ARG 422 CO 0.06 0.55 -0.50 0.45 0.10 0.00 0.00 179.97 180.63 1jv3 h HIS 423 N 0.60 0.21 -0.37 4.08 3.86 -1.39 -0.81 115.15 121.33 1jv3 h HIS 423 Ca 0.14 -0.07 -0.14 0.00 -1.16 0.00 0.00 60.37 59.14 1jv3 h HIS 423 Cb 0.21 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 1jv3 h HIS 423 CO 0.01 0.64 -0.32 0.00 0.86 0.00 0.00 177.93 179.12 1jv3 h ALA 424 N 1.35 0.54 0.33 2.45 0.00 -0.52 -0.66 119.26 122.74 1jv3 h ALA 424 Ca 0.00 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 1jv3 h ALA 424 Cb 0.94 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1jv3 h ALA 424 CO 0.07 0.59 -0.16 1.25 0.00 0.00 0.00 179.25 181.01 1jv3 h LEU 425 N 0.67 -0.38 -1.11 0.00 7.12 -1.21 -1.81 115.31 118.60 1jv3 h LEU 425 Ca 0.06 -0.14 0.06 0.00 0.13 0.00 0.00 57.88 58.00 1jv3 h LEU 425 Cb 0.90 0.10 -0.06 0.00 -0.53 0.00 0.00 40.66 41.07 1jv3 h LEU 425 CO 0.08 -0.05 0.61 0.24 -0.13 0.00 0.00 178.44 179.19 1jv3 h MET 426 N -0.72 1.04 -0.59 1.25 2.86 -1.18 -0.69 114.93 116.91 1jv3 h MET 426 Ca -0.05 -0.06 -0.08 0.00 -2.06 0.00 0.00 59.70 57.45 1jv3 h MET 426 Cb 0.49 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.90 1jv3 h MET 426 CO 0.07 0.69 0.04 1.03 1.06 0.00 0.00 176.91 179.81 1jv3 h SER 427 N 1.07 0.98 0.29 1.22 0.87 -1.09 0.83 113.55 117.73 1jv3 h SER 427 Ca 0.40 -0.29 -0.01 0.00 -1.23 0.00 0.00 61.79 60.66 1jv3 h SER 427 Cb 0.18 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 1jv3 h SER 427 CO -0.15 1.02 -0.14 0.25 -0.53 0.00 0.00 176.83 177.28 1jv3 h LEU 428 N 0.90 -0.33 -1.36 2.23 5.85 -0.42 -0.29 115.31 121.89 1jv3 h LEU 428 Ca 0.17 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 1jv3 h LEU 428 Cb 0.50 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.59 1jv3 h LEU 428 CO 0.02 -0.23 0.29 0.45 -0.34 0.00 0.00 178.44 178.63 1jv3 h HIS 429 N -0.40 0.71 -0.46 1.25 3.86 -1.04 0.32 115.15 119.39 1jv3 h HIS 429 Ca -0.04 -0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.19 1jv3 h HIS 429 Cb 0.30 -0.23 -0.03 0.00 1.06 0.00 0.00 27.41 28.51 1jv3 h HIS 429 CO -0.06 0.49 0.27 1.25 0.86 0.00 0.00 177.93 180.75 1jv3 h HIS 430 N 0.74 0.51 -0.47 2.45 -0.00 -0.50 -1.90 115.15 115.97 1jv3 h HIS 430 Ca 0.19 0.02 -0.06 0.00 -0.00 0.00 0.00 60.37 60.52 1jv3 h HIS 430 Cb 0.01 -0.16 -0.02 0.00 -0.00 0.00 0.00 27.41 27.24 1jv3 h HIS 430 CO 0.00 0.30 0.05 0.00 -0.00 0.00 0.00 177.93 178.28 1jv3 h TRP 432 N 0.71 0.98 -0.10 0.00 6.55 -0.25 -0.36 115.95 123.48 1jv3 h TRP 432 Ca 0.15 0.03 -0.01 0.00 0.95 0.00 0.00 58.89 60.01 1jv3 h TRP 432 Cb 0.36 -0.32 -0.00 0.00 -0.86 0.00 0.00 29.16 28.34 1jv3 h TRP 432 CO 0.02 0.52 0.03 0.28 -1.05 0.00 0.00 178.44 178.24 1jv3 h VAL 433 N 0.98 1.18 -0.63 1.49 2.07 -1.14 -1.71 116.25 118.50 1jv3 h VAL 433 Ca 0.36 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 1jv3 h VAL 433 Cb 0.12 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 1jv3 h VAL 433 CO -0.16 0.16 0.34 -0.07 0.02 0.00 0.00 177.57 177.87 1jv3 h LEU 434 N -0.03 0.80 -1.68 2.57 4.07 -1.16 0.76 115.31 120.63 1jv3 h LEU 434 Ca 0.03 -0.10 -0.02 0.00 0.08 0.00 0.00 57.88 57.87 1jv3 h LEU 434 Cb 0.23 -0.20 -0.00 0.00 1.08 0.00 0.00 40.66 41.76 1jv3 h LEU 434 CO -0.00 0.67 -0.09 0.78 -1.08 0.00 0.00 178.44 178.71 1jv3 h ASN 435 N 0.86 0.00 -0.11 -0.43 2.35 -0.99 -1.55 115.58 115.71 1jv3 h ASN 435 Ca 0.22 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 1jv3 h ASN 435 Cb 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 1jv3 h ASN 435 CO -0.03 0.09 0.00 0.00 -1.65 0.00 0.00 177.43 175.84 1jv3 n ALA 436 N -2.18 2.54 0.00 -0.83 0.00 -0.65 -4.92 120.51 114.48 1jv3 n ALA 436 Ca -0.01 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1jv3 n ALA 436 Cb 0.29 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1jv3 n ALA 436 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jv3 n GLY 437 N 1.13 0.45 3.96 0.00 0.00 -0.58 -3.96 105.19 106.20 1jv3 n GLY 437 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.93 1jv3 n GLY 437 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jv3 s GLY 438 N -1.17 1.77 0.15 -0.02 0.00 0.21 -1.59 107.32 106.66 1jv3 s GLY 438 Ca 0.00 -1.48 -0.11 0.00 0.00 0.00 0.00 44.72 43.13 1jv3 s GLY 438 CO 0.00 -0.84 0.30 0.30 0.00 0.00 0.00 173.10 172.86 1jv3 s HIS 439 N -3.45 0.23 0.10 1.90 0.09 -0.53 -4.17 115.29 109.46 1jv3 s HIS 439 Ca 0.69 -0.60 0.09 0.00 -0.00 0.00 0.00 55.06 55.24 1jv3 s HIS 439 Cb -0.05 0.03 -0.04 0.00 -0.00 0.00 0.00 32.58 32.52 1jv3 s HIS 439 CO 0.48 -0.70 -0.21 -0.06 -0.00 0.00 0.00 174.74 174.25 1jv3 s PHE 440 N -3.92 2.48 0.09 1.40 0.40 -1.26 -1.24 117.98 115.93 1jv3 s PHE 440 Ca 0.12 -0.30 0.01 0.00 -0.60 0.00 0.00 56.93 56.16 1jv3 s PHE 440 Cb 0.03 -1.35 -0.04 0.00 0.51 0.00 0.00 43.02 42.17 1jv3 s PHE 440 CO -0.04 0.34 -0.05 0.96 0.70 0.00 0.00 175.22 177.13 1jv3 s ILE 441 N -1.07 0.54 0.00 0.64 -4.36 -0.09 -0.55 121.20 116.32 1jv3 s ILE 441 Ca 0.16 -1.90 0.00 0.00 -0.26 0.00 0.00 60.65 58.65 1jv3 s ILE 441 Cb -0.10 -1.67 0.00 0.00 1.25 0.00 0.00 42.46 41.94 1jv3 s ILE 441 CO 0.08 -0.88 0.00 -0.90 0.24 0.00 0.00 174.94 173.48 1jv3 n ASP 442 N -0.01 0.00 0.27 4.36 5.68 0.31 -4.45 116.55 122.71 1jv3 n ASP 442 Ca -0.12 -0.20 0.15 0.00 -0.50 0.00 0.00 54.79 54.13 1jv3 n ASP 442 Cb 0.61 0.00 0.65 0.00 -1.14 0.00 0.00 41.12 41.24 1jv3 n ASP 442 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1jv3 h GLU 443 N 0.00 0.00 -0.55 0.11 3.07 -2.00 -2.74 114.58 112.47 1jv3 h GLU 443 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1jv3 h GLU 443 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1jv3 h GLU 443 CO 0.00 0.06 0.00 0.09 -1.40 0.00 0.00 179.01 177.76 1jv3 n ASN 444 N -3.20 3.71 0.00 1.42 3.02 -1.26 -4.92 115.26 114.02 1jv3 n ASN 444 Ca 0.00 -2.00 0.00 0.00 -0.03 0.00 0.00 54.58 52.56 1jv3 n ASN 444 Cb 0.33 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 39.13 1jv3 n ASN 444 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jv3 n GLY 445 N 1.57 0.55 3.77 7.41 0.00 -1.03 -5.04 105.19 112.43 1jv3 n GLY 445 Ca 0.22 -0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 1jv3 n GLY 445 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jv3 s SER 446 N -2.26 7.42 0.02 1.61 0.01 -1.26 -4.77 113.70 114.47 1jv3 s SER 446 Ca 0.00 1.74 -0.30 0.00 1.31 0.00 0.00 55.95 58.69 1jv3 s SER 446 Cb 0.00 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.64 1jv3 s SER 446 CO 0.00 0.14 1.25 -0.60 0.41 0.00 0.00 173.24 174.44 1jv3 s ARG 447 N -1.37 4.37 0.26 12.44 3.52 -1.26 -0.53 118.95 136.39 1jv3 s ARG 447 Ca 0.40 1.81 -0.18 0.00 -0.13 0.00 0.00 55.73 57.62 1jv3 s ARG 447 Cb -0.23 -3.44 -0.09 0.00 -1.56 0.00 0.00 34.95 29.64 1jv3 s ARG 447 CO 0.27 -0.39 0.74 -0.51 -0.81 0.00 0.00 175.30 174.61 1jv3 s LEU 448 N 1.64 4.24 0.82 -0.88 1.43 0.29 -4.90 118.68 121.32 1jv3 s LEU 448 Ca 0.59 1.40 -0.12 0.00 -1.03 0.00 0.00 54.13 54.97 1jv3 s LEU 448 Cb -0.29 -3.78 0.08 0.00 0.03 0.00 0.00 46.19 42.23 1jv3 s LEU 448 CO 0.27 -0.06 1.10 -2.16 0.23 0.00 0.00 176.35 175.73 1jv3 s PRO 449 N -2.33 1.93 0.41 1.29 0.04 -1.26 -4.67 135.00 130.41 1jv3 s PRO 449 Ca 0.47 0.59 0.08 0.00 0.04 0.00 0.00 61.00 62.18 1jv3 s PRO 449 Cb -0.14 -1.90 0.87 0.00 0.04 0.00 0.00 34.50 33.36 1jv3 s PRO 449 CO 0.20 -1.72 2.03 0.00 0.04 0.00 0.00 177.00 177.55 1jv3 h ALA 450 N -1.16 1.68 -3.67 8.56 0.00 -1.99 -3.37 119.26 119.31 1jv3 h ALA 450 Ca -0.48 -0.07 -0.63 0.00 0.00 0.00 0.00 54.91 53.74 1jv3 h ALA 450 Cb 1.28 -0.14 -0.38 0.00 0.00 0.00 0.00 17.79 18.56 1jv3 h ALA 450 CO 0.60 0.27 -0.79 0.42 0.00 0.00 0.00 179.25 179.74 1jv3 s ILE 451 N -5.30 1.73 0.45 0.00 1.01 -1.26 -5.07 121.20 112.76 1jv3 s ILE 451 Ca -0.07 -1.31 -0.25 0.00 0.00 0.00 0.00 60.65 59.01 1jv3 s ILE 451 Cb 0.17 -1.92 -0.09 0.00 0.01 0.00 0.00 42.46 40.63 1jv3 s ILE 451 CO 0.73 -0.04 1.41 -0.81 0.00 0.00 0.00 174.94 176.23 1jv3 n PRO 452 N 4.60 2.21 -3.01 2.79 -0.04 -1.26 -4.98 135.00 135.31 1jv3 n PRO 452 Ca -0.13 0.79 -0.42 0.00 -0.04 0.00 0.00 63.50 63.70 1jv3 n PRO 452 Cb 0.44 -2.60 -0.06 0.00 -0.04 0.00 0.00 33.50 31.24 1jv3 n PRO 452 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1jv3 s ARG 453 N -2.41 3.71 -0.74 0.54 0.52 -1.26 -4.99 118.95 114.32 1jv3 s ARG 453 Ca 0.61 0.21 -0.04 0.00 -0.52 0.00 0.00 55.73 55.98 1jv3 s ARG 453 Cb -0.46 -3.81 0.19 0.00 0.52 0.00 0.00 34.95 31.39 1jv3 s ARG 453 CO 0.58 -0.82 0.59 -0.51 0.02 0.00 0.00 175.30 175.16 1jv3 s LEU 454 N 2.97 5.58 -0.12 2.53 1.43 -1.26 -4.85 118.68 124.95 1jv3 s LEU 454 Ca 0.29 -3.08 0.10 0.00 -1.03 0.00 0.00 54.13 50.41 1jv3 s LEU 454 Cb -0.14 -1.93 -0.15 0.00 0.03 0.00 0.00 46.19 44.01 1jv3 s LEU 454 CO 0.16 -0.35 0.02 0.29 0.23 0.00 0.00 176.35 176.71 1jv3 n LYS 455 N 3.23 1.83 -3.96 1.70 4.76 -1.26 -5.03 118.16 119.44 1jv3 n LYS 455 Ca 0.13 0.00 -0.21 0.00 -2.87 0.00 0.00 58.31 55.36 1jv3 n LYS 455 Cb 0.39 -1.31 -0.03 0.00 -1.84 0.00 0.00 35.03 32.23 1jv3 n LYS 455 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1jv3 s ASP 456 N -4.61 5.71 0.28 4.39 1.01 -1.26 -5.01 116.67 117.17 1jv3 s ASP 456 Ca -0.08 -0.22 0.01 0.00 0.71 0.00 0.00 52.55 52.98 1jv3 s ASP 456 Cb 0.04 -1.41 0.57 0.00 1.01 0.00 0.00 42.92 43.12 1jv3 s ASP 456 CO 0.49 -0.14 1.81 0.00 0.21 0.00 0.00 175.17 177.53 1jv3 h ALA 457 N 1.31 1.46 0.00 5.23 0.00 -2.03 -1.67 119.26 123.57 1jv3 h ALA 457 Ca -0.48 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1jv3 h ALA 457 Cb 1.24 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1jv3 h ALA 457 CO 0.60 0.10 -0.09 0.09 0.00 0.00 0.00 179.25 179.94 1jv3 n ASN 458 N -4.71 0.65 -4.74 0.00 3.02 -1.26 -4.87 115.26 103.34 1jv3 n ASN 458 Ca 0.19 0.49 -0.41 0.00 -0.03 0.00 0.00 54.58 54.81 1jv3 n ASN 458 Cb 0.41 -0.60 -0.02 0.00 -0.61 0.00 0.00 39.78 38.95 1jv3 n ASN 458 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1jv3 s ASP 459 N -4.18 6.51 0.04 6.41 1.01 -0.63 -5.01 116.67 120.83 1jv3 s ASP 459 Ca 0.11 2.80 -0.00 0.00 0.71 0.00 0.00 52.55 56.16 1jv3 s ASP 459 Cb 0.14 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.41 1jv3 s ASP 459 CO 0.60 -0.81 -0.03 0.68 0.21 0.00 0.00 175.17 175.81 1jv3 s VAL 460 N 0.10 0.23 0.80 -1.27 -7.23 -1.26 -4.92 120.40 106.85 1jv3 s VAL 460 Ca 0.62 -1.53 -0.11 0.00 -1.81 0.00 0.00 61.98 59.15 1jv3 s VAL 460 Cb -0.45 -1.13 0.07 0.00 0.56 0.00 0.00 36.38 35.44 1jv3 s VAL 460 CO 0.44 -0.82 1.09 -2.16 -0.31 0.00 0.00 175.10 173.34 1jv3 s PRO 461 N -3.11 2.03 0.16 4.82 0.04 -1.26 -4.95 135.00 132.73 1jv3 s PRO 461 Ca -0.00 0.92 -0.32 0.00 0.04 0.00 0.00 61.00 61.65 1jv3 s PRO 461 Cb 0.02 -1.89 -0.10 0.00 0.04 0.00 0.00 34.50 32.57 1jv3 s PRO 461 CO -0.07 -1.73 1.61 0.42 0.04 0.00 0.00 177.00 177.27 1jv3 s ILE 462 N -2.99 2.56 -0.32 0.56 1.01 -1.26 -4.96 121.20 115.81 1jv3 s ILE 462 Ca 0.61 0.37 -0.13 0.00 0.00 0.00 0.00 60.65 61.50 1jv3 s ILE 462 Cb -0.16 -3.24 -0.03 0.00 0.01 0.00 0.00 42.46 39.04 1jv3 s ILE 462 CO 0.56 0.02 0.26 -1.10 0.00 0.00 0.00 174.94 174.68 1jv3 s GLN 463 N 1.34 3.69 -0.00 2.79 -0.21 -1.26 -4.68 119.66 121.32 1jv3 s GLN 463 Ca 0.71 -0.45 0.00 0.00 0.02 0.00 0.00 55.36 55.65 1jv3 s GLN 463 Cb -0.44 -3.75 -0.00 0.00 1.00 0.00 0.00 33.01 29.82 1jv3 s GLN 463 CO 0.32 -0.36 -0.01 0.00 -2.12 0.00 0.00 175.29 173.11 1jv3 s GLU 465 N -0.05 0.16 -0.17 0.00 2.12 -0.21 -4.19 118.70 116.36 1jv3 s GLU 465 Ca 0.00 0.65 -0.02 0.00 0.36 0.00 0.00 54.97 55.97 1jv3 s GLU 465 Cb -0.01 -0.08 -0.01 0.00 0.26 0.00 0.00 34.13 34.29 1jv3 s GLU 465 CO -0.00 -0.24 -0.10 0.42 -0.54 0.00 0.00 175.26 174.80 1jv3 s ILE 466 N 1.96 3.11 0.38 -3.70 -1.09 -1.26 -1.99 121.20 118.61 1jv3 s ILE 466 Ca -0.03 -0.61 -0.28 0.00 -2.23 0.00 0.00 60.65 57.50 1jv3 s ILE 466 Cb -0.11 -2.35 -0.10 0.00 -1.58 0.00 0.00 42.46 38.31 1jv3 s ILE 466 CO -0.08 0.49 1.38 -0.55 -1.23 0.00 0.00 174.94 174.95 1jv3 s SER 467 N 0.85 6.43 0.49 3.58 0.15 -0.67 -4.83 113.70 119.69 1jv3 s SER 467 Ca -0.03 2.84 0.15 0.00 0.70 0.00 0.00 55.95 59.61 1jv3 s SER 467 Cb -0.15 -2.65 1.17 0.00 -1.71 0.00 0.00 66.02 62.68 1jv3 s SER 467 CO 0.01 -0.79 2.08 -0.65 1.20 0.00 0.00 173.24 175.09 1jv3 h PRO 468 N 2.99 0.17 0.00 5.44 0.11 -1.87 0.12 132.00 138.95 1jv3 h PRO 468 Ca -0.50 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 1jv3 h PRO 468 Cb 1.24 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1jv3 h PRO 468 CO 0.64 0.11 -0.02 -0.07 -0.21 0.00 0.00 178.00 178.45 1jv3 h LEU 469 N 0.17 0.00 0.04 2.35 3.38 -1.91 -2.91 115.31 116.43 1jv3 h LEU 469 Ca 0.11 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.72 1jv3 h LEU 469 Cb 0.22 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 1jv3 h LEU 469 CO -0.02 0.02 -2.07 -0.38 0.09 0.00 0.00 178.44 176.08 1jv3 n ILE 470 N -3.40 1.60 -3.72 1.22 2.08 0.32 -4.95 119.36 112.51 1jv3 n ILE 470 Ca -0.02 -0.43 -0.14 0.00 0.56 0.00 0.00 62.75 62.72 1jv3 n ILE 470 Cb 0.12 -1.76 -0.14 0.00 -0.75 0.00 0.00 39.64 37.11 1jv3 n ILE 470 CO 0.00 0.00 0.00 -0.55 0.56 0.00 0.00 176.55 176.56 1jv3 s SER 471 N -6.97 0.07 -0.12 4.38 0.15 -0.56 -4.81 113.70 105.84 1jv3 s SER 471 Ca -0.31 0.38 -0.28 0.00 0.70 0.00 0.00 55.95 56.45 1jv3 s SER 471 Cb 0.09 0.30 -0.27 0.00 -1.71 0.00 0.00 66.02 64.43 1jv3 s SER 471 CO 0.63 -0.18 0.81 0.22 1.20 0.00 0.00 173.24 175.92 1jv3 h TYR 472 N 7.55 0.09 -0.34 3.44 3.20 -1.82 -3.36 116.97 125.73 1jv3 h TYR 472 Ca -0.34 -0.07 -0.23 0.00 3.14 0.00 0.00 58.73 61.24 1jv3 h TYR 472 Cb 1.14 -0.00 -0.38 0.00 1.54 0.00 0.00 36.73 39.02 1jv3 h TYR 472 CO 0.41 1.03 -1.05 0.00 -1.64 0.00 0.00 178.16 176.92 1jv3 n ALA 473 N -2.61 2.58 0.00 1.82 0.00 -1.26 -4.97 120.51 116.07 1jv3 n ALA 473 Ca -0.11 -2.56 0.00 0.00 0.00 0.00 0.00 53.44 50.77 1jv3 n ALA 473 Cb 0.53 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 19.13 1jv3 n ALA 473 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jv3 n GLY 474 N -0.50 0.40 3.89 0.00 0.00 -1.26 -5.08 105.19 102.64 1jv3 n GLY 474 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 1jv3 n GLY 474 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1jv3 s GLU 475 N -0.96 3.18 -1.11 1.61 1.03 -1.26 -4.41 118.70 116.78 1jv3 s GLU 475 Ca 0.00 0.40 0.00 0.00 0.03 0.00 0.00 54.97 55.40 1jv3 s GLU 475 Cb 0.00 -2.14 0.00 0.00 -0.80 0.00 0.00 34.13 31.19 1jv3 s GLU 475 CO 0.00 -0.71 0.00 0.41 -1.33 0.00 0.00 175.26 173.63 1jv3 n GLY 476 N -2.73 0.30 0.00 -3.83 0.00 -1.26 -4.55 105.19 93.12 1jv3 n GLY 476 Ca 0.05 -0.41 0.06 0.00 0.00 0.00 0.00 46.02 45.72 1jv3 n GLY 476 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jv3 n LEU 477 N -1.62 0.07 -0.33 0.99 4.77 -1.26 -4.68 117.00 114.93 1jv3 n LEU 477 Ca -0.14 -0.06 0.19 0.00 -0.03 0.00 0.00 56.01 55.97 1jv3 n LEU 477 Cb 0.55 0.00 0.40 0.00 -2.33 0.00 0.00 43.42 42.04 1jv3 n LEU 477 CO 0.17 0.02 1.11 -0.33 -1.33 0.00 0.00 177.39 177.03 1jv3 h GLU 478 N 0.00 0.42 0.00 3.23 3.07 -1.92 0.62 114.58 120.01 1jv3 h GLU 478 Ca 0.00 -0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 58.79 1jv3 h GLU 478 Cb 0.49 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.30 1jv3 h GLU 478 CO 0.00 0.28 -0.20 0.66 -1.40 0.00 0.00 179.01 178.35 1jv3 h SER 479 N 0.44 0.00 0.41 1.42 4.64 -1.91 -0.16 113.55 118.40 1jv3 h SER 479 Ca 0.66 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.67 1jv3 h SER 479 Cb 1.36 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.43 1jv3 h SER 479 CO -0.54 0.20 -1.67 1.88 -0.87 0.00 0.00 176.83 175.83 1jv3 h TYR 480 N 0.00 0.30 0.00 4.77 -1.99 -0.12 -3.43 116.97 116.51 1jv3 h TYR 480 Ca -0.00 -0.22 0.00 0.00 2.00 0.00 0.00 58.73 60.51 1jv3 h TYR 480 Cb 0.65 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.37 1jv3 h TYR 480 CO 0.00 1.34 -0.15 1.33 -0.00 0.00 0.00 178.16 180.69 1jv3 n VAL 481 N -3.33 0.00 -1.68 -2.88 0.24 -0.36 -4.94 118.33 105.38 1jv3 n VAL 481 Ca -0.19 -0.37 -0.46 0.00 -2.04 0.00 0.00 64.34 61.28 1jv3 n VAL 481 Cb 1.04 0.91 -0.04 0.00 -1.47 0.00 0.00 33.84 34.28 1jv3 n VAL 481 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jv3 n ALA 482 N -0.95 1.43 -0.92 2.33 0.00 -0.08 -1.49 120.51 120.83 1jv3 n ALA 482 Ca 0.00 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1jv3 n ALA 482 Cb 0.00 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.03 1jv3 n ALA 482 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1jv3 n ASP 483 N 4.45 -3.76 -4.75 0.00 8.00 -0.62 -4.90 116.55 114.98 1jv3 n ASP 483 Ca 0.18 0.00 -0.24 0.00 0.71 0.00 0.00 54.79 55.44 1jv3 n ASP 483 Cb 0.30 -2.31 -0.06 0.00 -0.02 0.00 0.00 41.12 39.03 1jv3 n ASP 483 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1jv3 s LYS 484 N -1.18 2.68 0.11 -1.24 1.02 -0.55 -5.01 119.74 115.57 1jv3 s LYS 484 Ca 0.00 -1.09 0.11 0.00 0.02 0.00 0.00 55.97 55.01 1jv3 s LYS 484 Cb 0.00 -2.46 -0.04 0.00 -0.52 0.00 0.00 37.83 34.81 1jv3 s LYS 484 CO 0.00 0.43 -0.27 -1.21 -0.92 0.00 0.00 175.35 173.38 1jv3 s GLU 485 N -3.42 1.50 0.04 1.68 2.02 -1.26 -1.45 118.70 117.81 1jv3 s GLU 485 Ca 0.31 -1.29 0.02 0.00 0.02 0.00 0.00 54.97 54.03 1jv3 s GLU 485 Cb -0.08 -1.92 -0.02 0.00 0.10 0.00 0.00 34.13 32.20 1jv3 s GLU 485 CO 0.22 0.46 -0.07 -0.06 0.02 0.00 0.00 175.26 175.83 1jv3 s PHE 486 N -1.00 0.64 -0.20 1.61 0.40 -0.37 -4.95 117.98 114.11 1jv3 s PHE 486 Ca 0.14 -0.48 -0.14 0.00 -0.60 0.00 0.00 56.93 55.84 1jv3 s PHE 486 Cb -0.10 -0.39 -0.04 0.00 0.51 0.00 0.00 43.02 43.00 1jv3 s PHE 486 CO 0.05 -0.09 0.32 -1.01 0.70 0.00 0.00 175.22 175.20 1jv3 s HIS 487 N -1.33 3.37 0.54 0.36 3.76 -1.26 -0.91 115.29 119.82 1jv3 s HIS 487 Ca -0.10 0.51 -0.13 0.00 -0.15 0.00 0.00 55.06 55.20 1jv3 s HIS 487 Cb -0.10 -2.43 -0.06 0.00 1.11 0.00 0.00 32.58 31.11 1jv3 s HIS 487 CO 0.00 0.05 0.96 0.00 -0.85 0.00 0.00 174.74 174.91 1jv3 s ALA 488 N 1.10 3.14 0.26 -1.40 0.00 -1.26 -4.23 121.76 119.36 1jv3 s ALA 488 Ca 0.16 -0.02 -0.30 0.00 0.00 0.00 0.00 51.96 51.80 1jv3 s ALA 488 Cb -0.14 -3.01 -0.09 0.00 0.00 0.00 0.00 23.12 19.87 1jv3 s ALA 488 CO 0.06 -0.40 1.22 -2.14 0.00 0.00 0.00 175.76 174.50 1jv3 s PRO 489 N -4.54 4.48 -0.11 0.00 0.02 -1.25 -4.79 135.00 128.81 1jv3 s PRO 489 Ca 0.56 1.98 0.01 0.00 0.02 0.00 0.00 61.00 63.56 1jv3 s PRO 489 Cb -0.10 -3.17 -0.02 0.00 0.02 0.00 0.00 34.50 31.23 1jv3 s PRO 489 CO 0.41 -0.05 -0.14 -1.17 -0.33 0.00 0.00 177.00 175.72 1jv3 s LEU 490 N -0.99 2.65 -0.03 -5.54 2.96 -0.44 0.27 118.68 117.56 1jv3 s LEU 490 Ca 0.50 -0.32 0.03 0.00 -0.22 0.00 0.00 54.13 54.12 1jv3 s LEU 490 Cb -0.35 -1.58 -0.00 0.00 0.50 0.00 0.00 46.19 44.76 1jv3 s LEU 490 CO 0.43 0.20 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.90 1jv3 s ILE 491 N 0.12 1.09 -0.19 6.68 1.01 0.32 -1.04 121.20 129.19 1jv3 s ILE 491 Ca -0.07 -0.53 -0.01 0.00 0.00 0.00 0.00 60.65 60.04 1jv3 s ILE 491 Cb -0.15 -0.94 0.05 0.00 0.01 0.00 0.00 42.46 41.43 1jv3 s ILE 491 CO 0.05 0.32 -0.03 -0.63 0.00 0.00 0.00 174.94 174.65 1jv3 s ILE 492 N 0.09 1.11 0.00 2.92 1.01 -0.84 0.25 121.20 125.74 1jv3 s ILE 492 Ca -0.03 -0.78 0.00 0.00 0.00 0.00 0.00 60.65 59.84 1jv3 s ILE 492 Cb -0.10 -1.38 0.00 0.00 0.01 0.00 0.00 42.46 41.00 1jv3 s ILE 492 CO 0.01 -0.01 0.00 -0.90 0.00 0.00 0.00 174.94 174.04 1jv3 n ASP 493 N 4.85 0.54 0.19 3.58 5.68 -0.59 -1.68 116.55 129.11 1jv3 n ASP 493 Ca -0.11 -0.74 0.13 0.00 -0.50 0.00 0.00 54.79 53.57 1jv3 n ASP 493 Cb 0.46 0.00 0.66 0.00 -1.14 0.00 0.00 41.12 41.10 1jv3 n ASP 493 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1jv3 h GLU 494 N 0.00 0.00 -0.31 0.11 9.09 -1.95 -0.66 114.58 120.86 1jv3 h GLU 494 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1jv3 h GLU 494 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1jv3 h GLU 494 CO 0.00 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.15 1jv3 n ASN 495 N -2.41 2.72 0.00 3.06 3.02 -1.26 -5.07 115.26 115.33 1jv3 n ASN 495 Ca -0.01 -1.89 0.00 0.00 -0.03 0.00 0.00 54.58 52.65 1jv3 n ASN 495 Cb 0.10 -0.20 0.00 0.00 -0.61 0.00 0.00 39.78 39.07 1jv3 n ASN 495 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jv3 n GLY 496 N 1.35 -0.32 3.69 7.41 0.00 -0.26 -4.98 105.19 112.09 1jv3 n GLY 496 Ca 0.18 -2.20 -0.37 0.00 0.00 0.00 0.00 46.02 43.62 1jv3 n GLY 496 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jv3 s VAL 497 N 0.00 5.26 -0.08 1.61 1.01 -1.26 -1.55 120.40 125.39 1jv3 s VAL 497 Ca 0.00 0.59 0.00 0.00 0.00 0.00 0.00 61.98 62.57 1jv3 s VAL 497 Cb 0.00 -3.67 0.02 0.00 0.00 0.00 0.00 36.38 32.74 1jv3 s VAL 497 CO 0.00 0.32 -0.06 -1.00 0.00 0.00 0.00 175.10 174.36 1jv3 s HIS 498 N 0.95 1.10 -0.29 5.22 4.02 0.14 -5.00 115.29 121.43 1jv3 s HIS 498 Ca 0.17 -0.43 -0.11 0.00 1.02 0.00 0.00 55.06 55.70 1jv3 s HIS 498 Cb -0.14 -0.95 -0.05 0.00 -1.02 0.00 0.00 32.58 30.42 1jv3 s HIS 498 CO 0.06 -0.34 0.20 -1.21 1.02 0.00 0.00 174.74 174.48 1jv3 s GLU 499 N 1.33 3.91 0.38 1.40 2.02 -1.26 -0.52 118.70 125.96 1jv3 s GLU 499 Ca -0.03 -0.34 -0.23 0.00 0.02 0.00 0.00 54.97 54.38 1jv3 s GLU 499 Cb -0.14 -3.67 -0.10 0.00 0.10 0.00 0.00 34.13 30.32 1jv3 s GLU 499 CO -0.03 -0.21 0.95 -0.51 0.02 0.00 0.00 175.26 175.48 1jv3 s LEU 500 N 1.77 4.13 0.00 1.80 1.43 0.14 -4.98 118.68 122.98 1jv3 s LEU 500 Ca 0.07 1.77 0.23 0.00 -1.03 0.00 0.00 54.13 55.18 1jv3 s LEU 500 Cb -0.16 -4.28 0.18 0.00 0.03 0.00 0.00 46.19 41.96 1jv3 s LEU 500 CO 0.11 -0.23 1.24 1.33 0.23 0.00 0.00 176.35 179.02