#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jvn n SER -2 N 0.00 0.00 -0.00 1.61 3.41 -1.26 -4.97 113.62 112.40 1jvn n SER -2 Ca 0.00 -0.38 -0.05 0.00 -0.26 0.00 0.00 58.87 58.18 1jvn n SER -2 Cb 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.83 1jvn n SER -2 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jvn n HIS -1 N 0.00 0.96 -4.32 7.33 -0.00 -1.26 -4.93 115.22 113.00 1jvn n HIS -1 Ca 0.00 0.34 -0.18 0.00 -0.00 0.00 0.00 57.72 57.87 1jvn n HIS -1 Cb 0.10 -1.14 -0.14 0.00 -0.00 0.00 0.00 29.99 28.81 1jvn n HIS -1 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 1jvn s MET 1 N -2.72 0.77 0.65 -1.40 1.00 -1.26 -5.15 119.30 111.19 1jvn s MET 1 Ca -0.04 -0.54 -0.15 0.00 0.00 0.00 0.00 55.69 54.96 1jvn s MET 1 Cb 0.08 -0.73 -0.01 0.00 0.00 0.00 0.00 34.83 34.17 1jvn s MET 1 CO 0.82 0.19 1.10 -1.25 0.00 0.00 0.00 175.02 175.88 1jvn s PRO 2 N -0.74 2.90 0.42 2.03 0.04 -1.26 -4.80 135.00 133.59 1jvn s PRO 2 Ca 0.01 1.36 -0.11 0.00 0.04 0.00 0.00 61.00 62.30 1jvn s PRO 2 Cb -0.06 -1.97 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 1jvn s PRO 2 CO 0.00 -1.17 0.79 0.08 0.04 0.00 0.00 177.00 176.75 1jvn s VAL 3 N -2.36 4.76 -0.30 -0.36 1.01 -1.26 -4.65 120.40 117.25 1jvn s VAL 3 Ca 0.66 0.67 -0.08 0.00 0.00 0.00 0.00 61.98 63.23 1jvn s VAL 3 Cb -0.20 -3.74 -0.00 0.00 0.00 0.00 0.00 36.38 32.44 1jvn s VAL 3 CO 0.41 -0.55 0.11 -0.69 0.00 0.00 0.00 175.10 174.38 1jvn s VAL 4 N -2.42 4.32 -0.21 2.92 1.01 0.09 -4.27 120.40 121.84 1jvn s VAL 4 Ca 0.52 -0.50 -0.21 0.00 0.00 0.00 0.00 61.98 61.79 1jvn s VAL 4 Cb -0.10 -3.19 -0.02 0.00 0.00 0.00 0.00 36.38 33.06 1jvn s VAL 4 CO 0.32 0.10 0.62 -1.00 0.00 0.00 0.00 175.10 175.15 1jvn s HIS 5 N 1.57 3.35 -0.21 5.22 3.76 0.18 -0.11 115.29 129.06 1jvn s HIS 5 Ca 0.04 0.89 0.02 0.00 -0.15 0.00 0.00 55.06 55.86 1jvn s HIS 5 Cb -0.17 -2.80 0.03 0.00 1.11 0.00 0.00 32.58 30.75 1jvn s HIS 5 CO 0.04 -0.20 -0.17 0.08 -0.85 0.00 0.00 174.74 173.64 1jvn s VAL 6 N 2.03 2.10 0.07 -0.90 1.01 -0.30 -0.20 120.40 124.21 1jvn s VAL 6 Ca 0.28 -1.17 -0.31 0.00 0.00 0.00 0.00 61.98 60.78 1jvn s VAL 6 Cb -0.16 -2.00 -0.07 0.00 0.00 0.00 0.00 36.38 34.15 1jvn s VAL 6 CO 0.10 0.35 1.42 -0.63 0.00 0.00 0.00 175.10 176.34 1jvn s ILE 7 N 1.23 3.42 -0.27 2.22 1.01 -0.53 -0.35 121.20 127.92 1jvn s ILE 7 Ca 0.00 0.95 0.02 0.00 0.00 0.00 0.00 60.65 61.62 1jvn s ILE 7 Cb -0.15 -3.61 0.07 0.00 0.01 0.00 0.00 42.46 38.78 1jvn s ILE 7 CO -0.10 0.04 -0.03 -0.62 0.00 0.00 0.00 174.94 174.23 1jvn s ASP 8 N 1.49 4.20 0.00 3.58 2.15 0.40 -4.46 116.67 124.03 1jvn s ASP 8 Ca 0.65 -1.49 0.18 0.00 0.43 0.00 0.00 52.55 52.32 1jvn s ASP 8 Cb -0.35 -1.32 0.66 0.00 -0.30 0.00 0.00 42.92 41.61 1jvn s ASP 8 CO 0.29 -0.28 1.48 1.33 -0.17 0.00 0.00 175.17 177.83 1jvn n VAL 9 N 4.55 0.24 -3.67 1.11 0.24 -1.26 -4.14 118.33 115.40 1jvn n VAL 9 Ca -0.08 -0.33 -0.21 0.00 -2.04 0.00 0.00 64.34 61.68 1jvn n VAL 9 Cb 0.43 0.27 0.04 0.00 -1.47 0.00 0.00 33.84 33.10 1jvn n VAL 9 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1jvn n GLU 10 N 0.24 -5.11 -3.70 7.34 1.02 -1.26 -5.00 120.64 114.17 1jvn n GLU 10 Ca 0.14 0.65 -0.11 0.00 -0.02 0.00 0.00 57.16 57.82 1jvn n GLU 10 Cb 0.29 -5.26 -0.12 0.00 -0.02 0.00 0.00 31.44 26.33 1jvn n GLU 10 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1jvn s SER 11 N -4.36 -0.28 0.00 1.62 0.15 -1.26 -5.11 113.70 104.45 1jvn s SER 11 Ca 0.00 0.73 0.00 0.00 0.70 0.00 0.00 55.95 57.38 1jvn s SER 11 Cb -0.00 0.69 0.00 0.00 -1.71 0.00 0.00 66.02 65.00 1jvn s SER 11 CO 0.80 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 175.66 1jvn n GLY 12 N 4.51 -0.73 3.60 9.45 0.00 -1.26 -4.80 105.19 115.96 1jvn n GLY 12 Ca -0.20 -1.73 -0.43 0.00 0.00 0.00 0.00 46.02 43.66 1jvn n GLY 12 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1jvn s ASN 13 N -1.38 6.31 0.00 1.61 2.47 -1.14 -3.95 114.94 118.85 1jvn s ASN 13 Ca 0.00 0.71 0.07 0.00 0.42 0.00 0.00 52.86 54.06 1jvn s ASN 13 Cb 0.00 -2.54 -0.01 0.00 -1.45 0.00 0.00 41.25 37.25 1jvn s ASN 13 CO 0.00 -1.48 0.49 -0.11 -3.72 0.00 0.00 177.10 172.29 1jvn n LEU 14 N 8.93 0.93 -0.01 3.21 7.94 -1.26 -4.66 117.00 132.08 1jvn n LEU 14 Ca 0.16 -0.74 -0.10 0.00 -1.11 0.00 0.00 56.01 54.22 1jvn n LEU 14 Cb 0.48 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.39 1jvn n LEU 14 CO 0.71 0.20 0.88 1.56 -1.11 0.00 0.00 177.39 179.62 1jvn h GLN 15 N 0.69 0.07 -0.38 1.96 1.08 -1.86 -2.11 115.11 114.56 1jvn h GLN 15 Ca 0.00 -0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.21 1jvn h GLN 15 Cb 0.23 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.62 1jvn h GLN 15 CO 0.00 0.04 0.24 0.77 -0.95 0.00 0.00 178.83 178.93 1jvn h SER 16 N 0.07 0.40 0.05 1.46 0.02 -1.83 0.90 113.55 114.61 1jvn h SER 16 Ca 0.06 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1jvn h SER 16 Cb 0.05 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.51 1jvn h SER 16 CO -0.08 0.29 -0.02 0.25 -1.14 0.00 0.00 176.83 176.12 1jvn h LEU 17 N 0.48 -0.05 -0.93 5.07 5.85 -1.83 -0.22 115.31 123.69 1jvn h LEU 17 Ca 0.14 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.62 1jvn h LEU 17 Cb -0.03 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1jvn h LEU 17 CO -0.05 0.16 0.16 0.71 -0.34 0.00 0.00 178.44 179.08 1jvn h THR 18 N -0.27 1.24 -0.17 1.05 1.35 -1.32 -1.13 112.91 113.66 1jvn h THR 18 Ca -0.01 -0.86 -0.12 0.00 -0.55 0.00 0.00 66.41 64.88 1jvn h THR 18 Cb 0.24 0.59 -0.01 0.00 -1.73 0.00 0.00 68.15 67.24 1jvn h THR 18 CO 0.01 0.33 -0.40 0.78 -0.25 0.00 0.00 175.52 175.99 1jvn h ASN 19 N 0.91 0.40 -0.46 5.36 2.35 -0.75 -1.40 115.58 121.99 1jvn h ASN 19 Ca 0.20 -0.17 -0.06 0.00 -0.55 0.00 0.00 56.30 55.72 1jvn h ASN 19 Cb 0.30 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 1jvn h ASN 19 CO -0.00 0.76 0.05 0.00 -1.65 0.00 0.00 177.43 176.59 1jvn h ALA 20 N 1.26 0.61 -0.23 -0.83 0.00 -0.51 0.12 119.26 119.68 1jvn h ALA 20 Ca 0.03 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1jvn h ALA 20 Cb 0.84 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1jvn h ALA 20 CO 0.07 0.36 0.01 0.82 0.00 0.00 0.00 179.25 180.51 1jvn h ILE 21 N 0.63 1.25 -0.29 0.00 2.04 -1.06 -2.30 117.51 117.78 1jvn h ILE 21 Ca 0.14 -0.86 -0.08 0.00 1.00 0.00 0.00 64.86 65.06 1jvn h ILE 21 Cb 0.42 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 1jvn h ILE 21 CO 0.01 0.27 -0.15 -0.33 0.00 0.00 0.00 178.15 177.95 1jvn h GLU 22 N 0.17 0.51 0.00 2.37 5.08 -1.18 -2.04 114.58 119.50 1jvn h GLU 22 Ca 0.07 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 1jvn h GLU 22 Cb 0.38 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1jvn h GLU 22 CO 0.01 0.65 -0.15 1.25 -1.00 0.00 0.00 179.01 179.76 1jvn h HIS 23 N 0.47 0.00 -0.01 4.33 2.76 -0.58 -0.84 115.15 121.27 1jvn h HIS 23 Ca 0.08 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 1jvn h HIS 23 Cb 0.53 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.49 1jvn h HIS 23 CO 0.02 0.15 0.00 1.28 -1.30 0.00 0.00 177.93 178.08 1jvn n LEU 24 N -3.95 1.08 0.00 0.26 4.77 -0.81 -4.92 117.00 113.44 1jvn n LEU 24 Ca -0.02 -0.36 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 1jvn n LEU 24 Cb 0.24 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1jvn n LEU 24 CO 0.33 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.18 1jvn n GLY 25 N 1.12 0.78 3.84 -0.72 0.00 -0.32 -5.08 105.19 104.81 1jvn n GLY 25 Ca 0.20 -0.18 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 1jvn n GLY 25 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jvn s TYR 26 N -2.00 3.09 -0.13 1.61 1.51 -0.96 -5.02 117.35 115.45 1jvn s TYR 26 Ca 0.00 -0.14 -0.08 0.00 -1.01 0.00 0.00 57.07 55.84 1jvn s TYR 26 Cb 0.00 -1.48 -0.04 0.00 -0.11 0.00 0.00 41.96 40.33 1jvn s TYR 26 CO 0.00 0.46 0.16 -2.00 -1.11 0.00 0.00 175.55 173.05 1jvn s GLU 27 N -3.88 3.60 -0.15 -0.62 2.12 -1.26 -3.83 118.70 114.68 1jvn s GLU 27 Ca 0.34 -0.11 -0.07 0.00 0.36 0.00 0.00 54.97 55.50 1jvn s GLU 27 Cb -0.08 -3.23 -0.04 0.00 0.26 0.00 0.00 34.13 31.04 1jvn s GLU 27 CO 0.25 0.69 0.07 0.08 -0.54 0.00 0.00 175.26 175.81 1jvn s VAL 28 N -0.78 4.90 -0.26 3.70 1.01 -1.26 -0.73 120.40 126.98 1jvn s VAL 28 Ca 0.14 -0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.14 1jvn s VAL 28 Cb -0.12 -3.17 0.06 0.00 0.00 0.00 0.00 36.38 33.15 1jvn s VAL 28 CO 0.04 0.52 -0.10 -1.58 0.00 0.00 0.00 175.10 173.97 1jvn s GLN 29 N -0.14 2.17 0.13 2.72 2.00 0.85 -4.93 119.66 122.45 1jvn s GLN 29 Ca 0.08 -1.30 -0.30 0.00 -2.00 0.00 0.00 55.36 51.84 1jvn s GLN 29 Cb -0.12 -2.85 -0.07 0.00 0.80 0.00 0.00 33.01 30.78 1jvn s GLN 29 CO 0.01 -0.57 1.10 -0.51 -0.50 0.00 0.00 175.29 174.82 1jvn s LEU 30 N 1.14 4.45 -0.45 3.68 1.43 -1.26 -1.15 118.68 126.52 1jvn s LEU 30 Ca -0.08 2.01 0.02 0.00 -1.03 0.00 0.00 54.13 55.05 1jvn s LEU 30 Cb -0.20 -3.59 0.12 0.00 0.03 0.00 0.00 46.19 42.55 1jvn s LEU 30 CO -0.05 -0.27 0.20 -0.69 0.23 0.00 0.00 176.35 175.77 1jvn s VAL 31 N 0.19 2.72 -0.44 -1.59 1.01 0.52 -4.90 120.40 117.91 1jvn s VAL 31 Ca 0.52 -2.74 0.23 0.00 0.00 0.00 0.00 61.98 59.98 1jvn s VAL 31 Cb -0.28 -2.91 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 1jvn s VAL 31 CO 0.32 -0.72 1.13 0.29 0.00 0.00 0.00 175.10 176.12 1jvn n LYS 32 N 3.78 0.44 -3.83 2.72 5.02 -1.26 -0.45 118.16 124.58 1jvn n LYS 32 Ca 0.04 0.08 -0.12 0.00 -2.02 0.00 0.00 58.31 56.30 1jvn n LYS 32 Cb 0.38 -1.73 -0.09 0.00 -0.02 0.00 0.00 35.03 33.57 1jvn n LYS 32 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1jvn s SER 33 N -4.69 -0.04 0.11 4.39 0.15 -1.26 -4.86 113.70 107.50 1jvn s SER 33 Ca 0.02 -0.17 0.09 0.00 0.70 0.00 0.00 55.95 56.59 1jvn s SER 33 Cb 0.12 0.26 0.44 0.00 -1.71 0.00 0.00 66.02 65.13 1jvn s SER 33 CO 0.77 -0.45 1.26 -2.65 1.20 0.00 0.00 173.24 173.37 1jvn n PRO 34 N 1.17 0.05 0.22 5.44 -0.02 -1.26 -0.06 135.00 140.55 1jvn n PRO 34 Ca -0.21 0.52 0.12 0.00 -2.02 0.00 0.00 63.50 61.90 1jvn n PRO 34 Cb 0.57 -1.65 0.30 0.00 -0.02 0.00 0.00 33.50 32.69 1jvn n PRO 34 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1jvn h LYS 35 N 0.00 0.00 0.00 -0.52 1.57 -1.95 -3.26 116.57 112.40 1jvn h LYS 35 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1jvn h LYS 35 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1jvn h LYS 35 CO 0.00 0.09 0.00 -0.25 -0.57 0.00 0.00 179.45 178.72 1jvn n ASP 36 N -3.15 0.00 -3.46 0.86 8.00 0.92 -4.87 116.55 114.85 1jvn n ASP 36 Ca 0.03 -0.86 -0.12 0.00 0.71 0.00 0.00 54.79 54.55 1jvn n ASP 36 Cb 0.50 -0.02 -0.03 0.00 -0.02 0.00 0.00 41.12 41.55 1jvn n ASP 36 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 1jvn s PHE 37 N -2.03 -0.50 0.04 1.24 -0.00 -1.23 -4.85 117.98 110.65 1jvn s PHE 37 Ca 0.42 0.30 0.03 0.00 -0.00 0.00 0.00 56.93 57.68 1jvn s PHE 37 Cb 0.20 0.51 -0.02 0.00 -0.00 0.00 0.00 43.02 43.70 1jvn s PHE 37 CO 0.34 -0.82 -0.09 0.54 -0.00 0.00 0.00 175.22 175.19 1jvn s ASN 38 N -2.68 0.99 0.14 1.98 2.20 -1.26 -4.95 114.94 111.35 1jvn s ASN 38 Ca 0.01 -0.50 -0.27 0.00 -0.94 0.00 0.00 52.86 51.16 1jvn s ASN 38 Cb -0.01 0.00 -0.03 0.00 -2.00 0.00 0.00 41.25 39.22 1jvn s ASN 38 CO -0.12 -0.14 1.60 0.40 -2.94 0.00 0.00 177.10 175.90 1jvn h ILE 39 N 4.53 0.24 -0.45 0.54 1.08 -1.97 -2.00 117.51 119.47 1jvn h ILE 39 Ca -0.36 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.11 1jvn h ILE 39 Cb 1.20 0.24 -0.02 0.00 -3.07 0.00 0.00 36.82 35.16 1jvn h ILE 39 CO 0.42 0.00 0.27 0.77 -0.69 0.00 0.00 178.15 178.91 1jvn h SER 40 N -0.43 0.53 0.08 1.72 4.64 -2.01 -2.88 113.55 115.20 1jvn h SER 40 Ca 0.09 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1jvn h SER 40 Cb 0.58 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1jvn h SER 40 CO -0.37 0.41 -0.10 0.61 -0.87 0.00 0.00 176.83 176.51 1jvn n GLY 41 N -1.38 -0.19 3.53 -0.77 0.00 -0.98 -4.85 105.19 100.55 1jvn n GLY 41 Ca 0.04 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.28 1jvn n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jvn s THR 42 N -2.19 4.06 0.00 2.61 2.01 -0.79 -4.95 115.64 116.39 1jvn s THR 42 Ca 0.32 -0.30 0.00 0.00 0.31 0.00 0.00 61.69 62.02 1jvn s THR 42 Cb 0.20 -2.78 0.00 0.00 0.01 0.00 0.00 72.50 69.93 1jvn s THR 42 CO 0.41 0.50 0.00 -1.54 -0.69 0.00 0.00 174.62 173.29 1jvn n SER 43 N 3.41 3.55 -3.68 3.53 3.41 -1.26 -4.92 113.62 117.66 1jvn n SER 43 Ca -0.17 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.14 1jvn n SER 43 Cb 0.52 0.71 -0.15 0.00 -0.26 0.00 0.00 64.21 65.04 1jvn n SER 43 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1jvn s ARG 44 N -1.42 0.67 -0.16 4.33 1.81 -1.26 -3.78 118.95 119.14 1jvn s ARG 44 Ca 0.00 -1.10 -0.04 0.00 -1.72 0.00 0.00 55.73 52.87 1jvn s ARG 44 Cb 0.00 -1.82 -0.03 0.00 -0.45 0.00 0.00 34.95 32.65 1jvn s ARG 44 CO 0.00 -1.03 -0.02 -1.17 -0.68 0.00 0.00 175.30 172.40 1jvn s LEU 45 N 1.52 3.33 -0.11 2.53 2.96 -0.95 -0.65 118.68 127.31 1jvn s LEU 45 Ca 0.11 -0.10 0.03 0.00 -0.22 0.00 0.00 54.13 53.96 1jvn s LEU 45 Cb -0.18 -1.81 0.00 0.00 0.50 0.00 0.00 46.19 44.70 1jvn s LEU 45 CO -0.23 0.17 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.12 1jvn s ILE 46 N 0.35 2.18 -0.82 6.68 1.01 0.72 -0.36 121.20 130.96 1jvn s ILE 46 Ca -0.03 -0.97 0.01 0.00 0.00 0.00 0.00 60.65 59.67 1jvn s ILE 46 Cb -0.14 -1.85 0.23 0.00 0.01 0.00 0.00 42.46 40.71 1jvn s ILE 46 CO 0.03 0.55 0.82 -0.11 0.00 0.00 0.00 174.94 176.23 1jvn n LEU 47 N 3.67 4.19 -4.78 2.97 7.94 0.24 -1.46 117.00 129.77 1jvn n LEU 47 Ca -0.19 -5.25 -0.36 0.00 -1.11 0.00 0.00 56.01 49.10 1jvn n LEU 47 Cb 0.53 -0.94 -0.02 0.00 0.53 0.00 0.00 43.42 43.52 1jvn n LEU 47 CO 0.28 1.77 0.78 -2.16 -1.11 0.00 0.00 177.39 176.94 1jvn s PRO 48 N -1.93 3.73 0.02 1.96 0.04 -1.26 -2.57 135.00 134.99 1jvn s PRO 48 Ca 0.31 1.61 -0.10 0.00 0.04 0.00 0.00 61.00 62.86 1jvn s PRO 48 Cb 0.02 -2.27 0.01 0.00 0.04 0.00 0.00 34.50 32.30 1jvn s PRO 48 CO -0.07 -0.53 0.19 0.20 0.04 0.00 0.00 177.00 176.83 1jvn s GLY 49 N -1.62 0.01 -0.03 0.56 0.00 -0.73 -4.71 107.32 100.80 1jvn s GLY 49 Ca 0.66 -0.12 -0.21 0.00 0.00 0.00 0.00 44.72 45.05 1jvn s GLY 49 CO 0.28 -0.29 0.44 0.14 0.00 0.00 0.00 173.10 173.68 1jvn s VAL 50 N -1.91 0.04 0.00 1.40 1.01 -1.26 -3.62 120.40 116.06 1jvn s VAL 50 Ca -0.10 -0.30 0.00 0.00 0.00 0.00 0.00 61.98 61.57 1jvn s VAL 50 Cb -0.04 -0.75 0.00 0.00 0.00 0.00 0.00 36.38 35.59 1jvn s VAL 50 CO -0.00 -0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.54 1jvn n GLY 51 N 1.14 -1.46 3.76 4.51 0.00 -1.26 -4.70 105.19 107.18 1jvn n GLY 51 Ca -0.21 -1.48 -0.41 0.00 0.00 0.00 0.00 46.02 43.92 1jvn n GLY 51 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1jvn s ASN 52 N -4.00 6.35 0.13 1.61 3.84 -0.76 -4.74 114.94 117.37 1jvn s ASN 52 Ca 0.00 3.00 -0.27 0.00 0.21 0.00 0.00 52.86 55.80 1jvn s ASN 52 Cb 0.00 -2.65 -0.04 0.00 -0.55 0.00 0.00 41.25 38.01 1jvn s ASN 52 CO 0.00 -0.91 1.61 0.22 -2.79 0.00 0.00 177.10 175.24 1jvn h TYR 53 N 4.16 -0.89 -0.81 0.43 3.20 -1.91 -1.76 116.97 119.40 1jvn h TYR 53 Ca -0.48 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.39 1jvn h TYR 53 Cb 1.23 0.40 -0.04 0.00 1.54 0.00 0.00 36.73 39.86 1jvn h TYR 53 CO 0.57 -0.41 0.40 0.78 -1.64 0.00 0.00 178.16 177.85 1jvn h GLY 54 N -0.45 1.24 0.72 1.82 0.00 -1.91 -0.44 103.07 104.05 1jvn h GLY 54 Ca 0.07 -0.60 0.07 0.00 0.00 0.00 0.00 47.33 46.87 1jvn h GLY 54 CO -0.30 0.57 0.65 0.84 0.00 0.00 0.00 176.54 178.31 1jvn h HIS 55 N 1.15 1.20 0.00 5.60 -0.00 -1.77 -0.29 115.15 121.05 1jvn h HIS 55 Ca 0.28 0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.68 1jvn h HIS 55 Cb 0.10 -0.39 -0.00 0.00 -0.00 0.00 0.00 27.41 27.12 1jvn h HIS 55 CO 0.01 0.61 -0.01 0.35 -0.00 0.00 0.00 177.93 178.90 1jvn h PHE 56 N 1.17 0.00 -0.77 5.26 3.57 -0.99 -3.26 116.94 121.92 1jvn h PHE 56 Ca 0.44 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.95 1jvn h PHE 56 Cb 0.19 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.89 1jvn h PHE 56 CO -0.00 0.44 0.51 0.28 -2.23 0.00 0.00 178.31 177.31 1jvn h VAL 57 N -1.00 1.19 -0.15 1.41 2.07 -1.06 1.00 116.25 119.70 1jvn h VAL 57 Ca -0.00 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.15 1jvn h VAL 57 Cb 0.44 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 1jvn h VAL 57 CO -0.00 0.19 0.03 0.44 0.02 0.00 0.00 177.57 178.25 1jvn h ASP 58 N 1.03 0.24 0.02 0.57 3.32 -1.22 0.43 116.42 120.81 1jvn h ASP 58 Ca 0.29 -0.25 0.01 0.00 0.02 0.00 0.00 57.03 57.10 1jvn h ASP 58 Cb -0.10 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1jvn h ASP 58 CO -0.06 0.43 -0.08 -1.13 -1.72 0.00 0.00 179.24 176.67 1jvn h ASN 59 N 0.04 -0.23 -0.34 6.45 -0.73 -1.50 0.14 115.58 119.41 1jvn h ASN 59 Ca 0.05 0.03 0.03 0.00 1.87 0.00 0.00 56.30 58.28 1jvn h ASN 59 Cb 0.29 0.10 -0.03 0.00 0.27 0.00 0.00 38.32 38.95 1jvn h ASN 59 CO 0.00 -0.12 0.16 0.25 -0.37 0.00 0.00 177.43 177.34 1jvn h LEU 60 N -0.16 0.22 -0.42 0.34 5.85 -0.73 -2.56 115.31 117.86 1jvn h LEU 60 Ca 0.02 0.02 -0.18 0.00 0.84 0.00 0.00 57.88 58.58 1jvn h LEU 60 Cb 0.18 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1jvn h LEU 60 CO -0.07 0.17 -0.76 -0.26 -0.34 0.00 0.00 178.44 177.18 1jvn h PHE 61 N 0.33 0.41 -0.01 1.25 -1.00 -0.74 -2.73 116.94 114.44 1jvn h PHE 61 Ca 0.14 -0.19 0.00 0.00 2.81 0.00 0.00 57.97 60.73 1jvn h PHE 61 Cb 0.07 -0.06 0.00 0.00 3.61 0.00 0.00 35.95 39.57 1jvn h PHE 61 CO -0.11 0.94 0.00 0.27 -1.61 0.00 0.00 178.31 177.81 1jvn n ASN 62 N -3.79 0.86 0.01 2.17 0.23 0.02 -2.14 115.26 112.63 1jvn n ASN 62 Ca -0.04 -1.30 0.12 0.00 -0.53 0.00 0.00 54.58 52.83 1jvn n ASN 62 Cb 0.72 -0.00 0.19 0.00 -2.08 0.00 0.00 39.78 38.61 1jvn n ASN 62 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1jvn n ARG 63 N -0.32 0.07 -0.54 -3.83 1.74 -0.97 -4.97 116.66 107.84 1jvn n ARG 63 Ca 0.21 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.30 1jvn n ARG 63 Cb 0.25 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 30.15 1jvn n ARG 63 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jvn n GLY 64 N 1.46 0.93 0.07 -0.13 0.00 -0.91 -4.46 105.19 102.15 1jvn n GLY 64 Ca 0.05 -0.42 0.12 0.00 0.00 0.00 0.00 46.02 45.77 1jvn n GLY 64 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1jvn n PHE 65 N -2.35 0.58 0.16 1.61 3.01 -1.04 -4.43 117.46 115.00 1jvn n PHE 65 Ca 0.00 0.17 -0.11 0.00 1.01 0.00 0.00 57.45 58.52 1jvn n PHE 65 Cb 0.07 -0.69 -0.06 0.00 -0.01 0.00 0.00 39.48 38.78 1jvn n PHE 65 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 1jvn h GLU 66 N 0.00 -0.57 -0.45 -1.08 4.81 -1.82 0.21 114.58 115.68 1jvn h GLU 66 Ca 0.00 0.04 0.08 0.00 -0.13 0.00 0.00 59.36 59.35 1jvn h GLU 66 Cb 0.70 0.13 -0.07 0.00 0.63 0.00 0.00 28.75 30.15 1jvn h GLU 66 CO 0.00 -0.38 0.06 0.87 -0.73 0.00 0.00 179.01 178.83 1jvn h LYS 67 N -0.59 0.17 -0.12 1.92 1.57 -1.97 -1.49 116.57 116.06 1jvn h LYS 67 Ca -0.03 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1jvn h LYS 67 Cb 0.52 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.77 1jvn h LYS 67 CO -0.06 0.12 -0.02 -1.35 -0.57 0.00 0.00 179.45 177.57 1jvn h PRO 68 N 0.18 0.01 -0.83 3.15 0.11 -1.74 -0.30 132.00 132.58 1jvn h PRO 68 Ca 0.22 -0.00 0.05 0.00 0.11 0.00 0.00 66.00 66.38 1jvn h PRO 68 Cb 0.30 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.35 1jvn h PRO 68 CO -0.32 0.01 0.52 0.82 -0.21 0.00 0.00 178.00 178.82 1jvn h ILE 69 N 0.01 1.09 -0.60 4.15 2.04 -0.41 0.58 117.51 124.38 1jvn h ILE 69 Ca 0.06 -0.34 -0.03 0.00 1.00 0.00 0.00 64.86 65.55 1jvn h ILE 69 Cb 0.08 0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.14 1jvn h ILE 69 CO -0.11 0.18 0.26 0.03 0.00 0.00 0.00 178.15 178.51 1jvn h ARG 70 N 0.99 0.88 -0.41 2.37 3.08 -0.92 -0.77 114.38 119.61 1jvn h ARG 70 Ca 0.35 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.24 1jvn h ARG 70 Cb 0.08 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 1jvn h ARG 70 CO -0.14 0.73 0.21 0.93 -1.07 0.00 0.00 179.97 180.64 1jvn h GLU 71 N 0.82 0.58 -0.75 0.04 5.08 -0.14 0.44 114.58 120.66 1jvn h GLU 71 Ca 0.20 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 1jvn h GLU 71 Cb 0.17 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1jvn h GLU 71 CO -0.02 0.49 0.38 -0.92 -1.00 0.00 0.00 179.01 177.94 1jvn h TYR 72 N 0.53 1.06 -0.44 4.33 3.20 -0.74 -1.12 116.97 123.79 1jvn h TYR 72 Ca 0.14 -0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.92 1jvn h TYR 72 Cb 0.09 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.00 1jvn h TYR 72 CO -0.02 0.77 0.06 0.82 -1.64 0.00 0.00 178.16 178.15 1jvn h ILE 73 N 1.05 1.21 0.00 1.81 2.04 -0.68 -2.30 117.51 120.64 1jvn h ILE 73 Ca 0.26 -0.80 -0.06 0.00 1.00 0.00 0.00 64.86 65.26 1jvn h ILE 73 Cb 0.08 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 1jvn h ILE 73 CO -0.04 0.29 -0.28 -0.33 0.00 0.00 0.00 178.15 177.79 1jvn h GLU 74 N 0.65 0.00 0.00 2.37 5.08 -0.28 -2.56 114.58 119.84 1jvn h GLU 74 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1jvn h GLU 74 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1jvn h GLU 74 CO 0.01 0.28 0.00 -1.13 -1.00 0.00 0.00 179.01 177.16 1jvn n SER 75 N -3.36 0.50 -0.04 1.42 3.41 -0.48 -4.87 113.62 110.20 1jvn n SER 75 Ca 0.01 0.64 -0.01 0.00 -0.26 0.00 0.00 58.87 59.25 1jvn n SER 75 Cb 0.50 -0.74 -0.00 0.00 -0.26 0.00 0.00 64.21 63.71 1jvn n SER 75 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jvn n GLY 76 N -0.17 0.46 3.89 5.00 0.00 -0.96 -5.04 105.19 108.38 1jvn n GLY 76 Ca 0.02 -0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 1jvn n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jvn s LYS 77 N -0.63 3.72 0.20 1.61 1.02 -1.25 -4.65 119.74 119.77 1jvn s LYS 77 Ca 0.00 0.20 -0.32 0.00 0.02 0.00 0.00 55.97 55.87 1jvn s LYS 77 Cb 0.00 -2.59 -0.12 0.00 -0.52 0.00 0.00 37.83 34.60 1jvn s LYS 77 CO 0.00 0.19 1.73 -2.30 -0.92 0.00 0.00 175.35 174.05 1jvn n PRO 78 N -0.75 2.77 -4.25 -1.68 -0.02 -1.25 -4.76 135.00 125.06 1jvn n PRO 78 Ca -0.00 1.00 -0.17 0.00 -2.02 0.00 0.00 63.50 62.30 1jvn n PRO 78 Cb 0.53 -2.85 -0.15 0.00 -0.02 0.00 0.00 33.50 31.02 1jvn n PRO 78 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1jvn s ILE 79 N 1.30 0.55 -0.12 4.25 2.07 -0.66 -2.23 121.20 126.35 1jvn s ILE 79 Ca 0.76 -0.28 0.01 0.00 -1.41 0.00 0.00 60.65 59.73 1jvn s ILE 79 Cb -0.51 -0.48 0.02 0.00 0.13 0.00 0.00 42.46 41.62 1jvn s ILE 79 CO 0.33 0.16 -0.16 -0.32 -1.91 0.00 0.00 174.94 173.05 1jvn s MET 80 N -0.04 2.32 -0.06 3.50 -2.45 0.52 -1.17 119.30 121.92 1jvn s MET 80 Ca 0.01 -0.59 -0.02 0.00 -1.25 0.00 0.00 55.69 53.84 1jvn s MET 80 Cb -0.04 -2.01 -0.04 0.00 1.25 0.00 0.00 34.83 34.00 1jvn s MET 80 CO -0.00 -0.11 0.07 0.20 1.05 0.00 0.00 175.02 176.23 1jvn s GLY 81 N 1.12 1.99 -0.10 2.11 0.00 0.81 0.83 107.32 114.09 1jvn s GLY 81 Ca -0.03 -0.80 0.18 0.00 0.00 0.00 0.00 44.72 44.07 1jvn s GLY 81 CO -0.04 -0.61 1.18 1.39 0.00 0.00 0.00 173.10 175.02 1jvn n ILE 82 N 1.68 1.07 0.00 0.90 5.41 -1.06 -0.70 119.36 126.66 1jvn n ILE 82 Ca -0.16 -2.01 0.00 0.00 1.00 0.00 0.00 62.75 61.57 1jvn n ILE 82 Cb 0.53 0.37 0.00 0.00 -0.71 0.00 0.00 39.64 39.83 1jvn n ILE 82 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1jvn n VAL 84 N -0.33 0.00 0.20 1.39 0.31 -1.24 -1.78 118.33 116.88 1jvn n VAL 84 Ca 0.12 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.50 1jvn n VAL 84 Cb 0.90 0.00 0.40 0.00 -0.91 0.00 0.00 33.84 34.23 1jvn n VAL 84 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1jvn h GLY 85 N 0.00 0.00 0.70 2.92 0.00 -1.81 -0.38 103.07 104.50 1jvn h GLY 85 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.08 1jvn h GLY 85 CO 0.00 0.00 -1.16 -2.00 0.00 0.00 0.00 176.54 173.38 1jvn h LEU 86 N 0.00 0.48 -2.09 3.11 6.46 -1.78 -3.33 115.31 118.16 1jvn h LEU 86 Ca -0.00 -0.91 -0.02 0.00 -0.12 0.00 0.00 57.88 56.83 1jvn h LEU 86 Cb 0.70 -0.16 -0.00 0.00 -0.73 0.00 0.00 40.66 40.47 1jvn h LEU 86 CO 0.05 1.53 -0.07 1.56 -0.62 0.00 0.00 178.44 180.89 1jvn h GLN 87 N -0.27 0.00 0.00 1.25 4.20 -1.85 -1.89 115.11 116.54 1jvn h GLN 87 Ca -0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.48 1jvn h GLN 87 Cb 1.77 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.55 1jvn h GLN 87 CO 0.13 0.07 0.00 0.00 -0.67 0.00 0.00 178.83 178.36 1jvn h ALA 88 N 1.93 1.00 0.00 3.87 0.00 -1.18 -2.26 119.26 122.61 1jvn h ALA 88 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1jvn h ALA 88 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1jvn h ALA 88 CO 0.01 0.00 0.00 -0.07 0.00 0.00 0.00 179.25 179.19 1jvn h LEU 89 N 0.00 0.00 0.00 0.00 3.38 -1.51 0.35 115.31 117.53 1jvn h LEU 89 Ca 0.00 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.52 1jvn h LEU 89 Cb 0.37 0.00 0.12 0.00 0.09 0.00 0.00 40.66 41.24 1jvn h LEU 89 CO 0.00 0.00 0.23 0.49 0.09 0.00 0.00 178.44 179.25 1jvn n PHE 90 N -2.58 -3.35 0.42 1.13 3.01 -0.85 0.39 117.46 115.64 1jvn n PHE 90 Ca 0.04 -1.53 0.12 0.00 1.01 0.00 0.00 57.45 57.09 1jvn n PHE 90 Cb 0.40 -0.84 0.49 0.00 -0.01 0.00 0.00 39.48 39.52 1jvn n PHE 90 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1jvn n ALA 91 N -3.27 1.75 0.00 4.37 0.00 -0.12 -1.90 120.51 121.34 1jvn n ALA 91 Ca -0.18 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1jvn n ALA 91 Cb 0.58 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.62 1jvn n ALA 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jvn n GLY 92 N 0.20 0.19 3.09 0.00 0.00 -1.26 -2.87 105.19 104.53 1jvn n GLY 92 Ca 0.03 -1.63 -0.12 0.00 0.00 0.00 0.00 46.02 44.29 1jvn n GLY 92 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jvn s SER 93 N -4.00 -0.17 0.48 1.61 0.15 -1.26 -1.44 113.70 109.06 1jvn s SER 93 Ca 0.00 0.30 0.32 0.00 0.70 0.00 0.00 55.95 57.28 1jvn s SER 93 Cb 0.00 0.37 1.50 0.00 -1.71 0.00 0.00 66.02 66.18 1jvn s SER 93 CO 0.00 -0.12 1.97 1.62 1.20 0.00 0.00 173.24 177.90 1jvn h VAL 94 N 4.72 0.00 -0.89 4.45 3.04 -1.50 -2.31 116.25 123.76 1jvn h VAL 94 Ca -0.26 -0.26 0.03 0.00 -1.01 0.00 0.00 66.70 65.19 1jvn h VAL 94 Cb 1.20 1.13 -0.05 0.00 -2.01 0.00 0.00 31.29 31.56 1jvn h VAL 94 CO 0.39 0.00 0.59 -0.08 -1.01 0.00 0.00 177.57 177.45 1jvn h GLU 95 N 0.00 1.11 -2.93 4.17 4.81 -1.96 -3.29 114.58 116.49 1jvn h GLU 95 Ca 0.00 -0.07 -0.61 0.00 -0.13 0.00 0.00 59.36 58.55 1jvn h GLU 95 Cb 0.29 -0.25 -0.40 0.00 0.63 0.00 0.00 28.75 29.02 1jvn h GLU 95 CO 0.00 0.73 -0.75 -1.12 -0.73 0.00 0.00 179.01 177.15 1jvn s SER 96 N -6.17 3.53 0.31 1.04 0.01 -0.87 -4.92 113.70 106.64 1jvn s SER 96 Ca -0.12 -2.75 0.06 0.00 1.31 0.00 0.00 55.95 54.45 1jvn s SER 96 Cb 0.19 -1.01 0.71 0.00 0.21 0.00 0.00 66.02 66.12 1jvn s SER 96 CO 0.80 -0.25 1.82 -0.65 0.41 0.00 0.00 173.24 175.37 1jvn h PRO 97 N 6.54 0.79 0.00 12.44 0.11 -1.64 -1.73 132.00 148.51 1jvn h PRO 97 Ca 0.03 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1jvn h PRO 97 Cb 0.91 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.85 1jvn h PRO 97 CO 0.48 0.52 -0.39 1.63 -0.21 0.00 0.00 178.00 180.03 1jvn n LYS 98 N -4.67 0.00 -1.96 1.05 5.02 -1.26 -4.89 118.16 111.46 1jvn n LYS 98 Ca 0.21 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 56.16 1jvn n LYS 98 Cb 0.49 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 34.03 1jvn n LYS 98 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1jvn s SER 99 N -3.00 5.31 0.46 4.39 0.01 -0.65 -5.06 113.70 115.16 1jvn s SER 99 Ca 0.12 2.11 0.05 0.00 1.31 0.00 0.00 55.95 59.54 1jvn s SER 99 Cb 0.18 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.81 1jvn s SER 99 CO 0.66 -1.50 0.12 0.28 0.41 0.00 0.00 173.24 173.22 1jvn s THR 100 N -2.05 1.81 0.33 1.44 -1.32 -1.26 -4.60 115.64 109.99 1jvn s THR 100 Ca 0.70 -1.82 0.04 0.00 -1.21 0.00 0.00 61.69 59.39 1jvn s THR 100 Cb -0.23 -2.64 -0.04 0.00 -1.51 0.00 0.00 72.50 68.09 1jvn s THR 100 CO 0.35 0.00 0.16 -0.83 -2.21 0.00 0.00 174.62 172.09 1jvn s GLY 101 N -3.91 2.19 0.47 6.08 0.00 -1.14 -4.67 107.32 106.35 1jvn s GLY 101 Ca 0.29 -1.70 0.32 0.00 0.00 0.00 0.00 44.72 43.63 1jvn s GLY 101 CO 0.16 -1.63 1.95 1.41 0.00 0.00 0.00 173.10 174.98 1jvn h LEU 102 N 2.12 0.00 1.18 0.66 3.38 -0.09 -3.46 115.31 119.10 1jvn h LEU 102 Ca -0.33 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.23 1jvn h LEU 102 Cb 1.25 0.00 0.05 0.00 0.09 0.00 0.00 40.66 42.06 1jvn h LEU 102 CO 0.52 0.00 -0.60 -3.20 0.09 0.00 0.00 178.44 175.26 1jvn n ASN 103 N -2.76 -6.10 0.11 -0.43 5.15 -0.80 -4.88 115.26 105.55 1jvn n ASN 103 Ca 0.00 -0.26 -0.03 0.00 -0.60 0.00 0.00 54.58 53.69 1jvn n ASN 103 Cb 0.20 -4.93 0.08 0.00 -0.53 0.00 0.00 39.78 34.60 1jvn n ASN 103 CO 0.00 0.00 0.00 1.88 1.40 0.00 0.00 177.26 180.54 1jvn h TYR 104 N -1.25 0.00 -3.80 1.20 -1.99 -0.31 -3.37 116.97 107.45 1jvn h TYR 104 Ca -0.53 0.00 -0.68 0.00 2.00 0.00 0.00 58.73 59.53 1jvn h TYR 104 Cb 1.36 0.00 -0.35 0.00 2.00 0.00 0.00 36.73 39.75 1jvn h TYR 104 CO 0.52 0.73 -0.74 0.42 -0.00 0.00 0.00 178.16 179.10 1jvn s ILE 105 N -3.34 2.62 -0.04 -2.88 1.01 -0.29 -5.02 121.20 113.26 1jvn s ILE 105 Ca -0.01 -1.55 -0.05 0.00 0.00 0.00 0.00 60.65 59.04 1jvn s ILE 105 Cb 0.12 -2.55 -0.22 0.00 0.01 0.00 0.00 42.46 39.83 1jvn s ILE 105 CO 0.78 -0.11 3.03 -0.90 0.00 0.00 0.00 174.94 177.74 1jvn n ASP 106 N 4.52 4.34 -3.55 3.58 5.75 -1.26 -0.94 116.55 128.99 1jvn n ASP 106 Ca -0.12 -2.30 -0.15 0.00 -0.01 0.00 0.00 54.79 52.20 1jvn n ASP 106 Cb 0.43 -1.16 -0.05 0.00 -1.03 0.00 0.00 41.12 39.30 1jvn n ASP 106 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 1jvn s PHE 107 N 1.41 -0.51 0.21 2.11 -0.12 -1.26 -4.89 117.98 114.93 1jvn s PHE 107 Ca 0.55 0.70 -0.06 0.00 -0.05 0.00 0.00 56.93 58.06 1jvn s PHE 107 Cb 0.26 0.38 -0.06 0.00 -0.63 0.00 0.00 43.02 42.96 1jvn s PHE 107 CO -0.00 -0.64 0.47 0.15 -0.05 0.00 0.00 175.22 175.16 1jvn s LYS 108 N -2.02 3.68 0.34 1.99 1.02 -1.26 -2.66 119.74 120.83 1jvn s LYS 108 Ca -0.07 0.04 -0.27 0.00 0.02 0.00 0.00 55.97 55.69 1jvn s LYS 108 Cb -0.01 -2.73 -0.09 0.00 -0.52 0.00 0.00 37.83 34.48 1jvn s LYS 108 CO 0.02 0.36 1.07 -0.51 -0.92 0.00 0.00 175.35 175.37 1jvn s LEU 109 N -2.96 4.33 0.30 3.17 1.02 -0.52 -4.82 118.68 119.21 1jvn s LEU 109 Ca 0.44 2.15 0.06 0.00 0.02 0.00 0.00 54.13 56.79 1jvn s LEU 109 Cb -0.11 -3.93 -0.06 0.00 0.02 0.00 0.00 46.19 42.11 1jvn s LEU 109 CO 0.25 -0.34 -0.02 -0.94 0.02 0.00 0.00 176.35 175.33 1jvn s SER 110 N -1.25 2.72 0.29 2.29 1.04 -0.32 -1.18 113.70 117.29 1jvn s SER 110 Ca 0.52 -1.26 -0.28 0.00 0.48 0.00 0.00 55.95 55.41 1jvn s SER 110 Cb -0.27 -0.16 -0.09 0.00 0.10 0.00 0.00 66.02 65.60 1jvn s SER 110 CO 0.34 -0.43 0.96 -0.60 0.98 0.00 0.00 173.24 174.48 1jvn s ARG 111 N -3.78 4.67 0.54 4.02 3.52 -1.26 -1.07 118.95 125.59 1jvn s ARG 111 Ca 0.32 1.43 -0.21 0.00 -0.13 0.00 0.00 55.73 57.14 1jvn s ARG 111 Cb 0.06 -3.00 -0.05 0.00 -1.56 0.00 0.00 34.95 30.40 1jvn s ARG 111 CO 0.13 0.35 1.24 -0.06 -0.81 0.00 0.00 175.30 176.15 1jvn s PHE 112 N -1.42 2.50 -0.24 5.12 2.99 -0.47 -4.93 117.98 121.53 1jvn s PHE 112 Ca 0.47 1.48 -0.29 0.00 0.00 0.00 0.00 56.93 58.58 1jvn s PHE 112 Cb -0.22 -3.55 -0.01 0.00 0.00 0.00 0.00 43.02 39.23 1jvn s PHE 112 CO 0.28 -2.22 1.42 0.34 -0.00 0.00 0.00 175.22 175.04 1jvn s ASP 113 N -1.32 6.62 0.00 1.36 3.68 -1.26 -4.89 116.67 120.86 1jvn s ASP 113 Ca 0.71 1.48 0.17 0.00 2.13 0.00 0.00 52.55 57.05 1jvn s ASP 113 Cb -0.33 -2.54 0.53 0.00 -1.45 0.00 0.00 42.92 39.14 1jvn s ASP 113 CO 0.38 -1.08 1.42 -0.90 0.13 0.00 0.00 175.17 175.12 1jvn n ASP 114 N 7.71 2.11 0.04 -0.34 5.68 -1.26 -3.97 116.55 126.53 1jvn n ASP 114 Ca 0.16 -1.88 -0.09 0.00 -0.50 0.00 0.00 54.79 52.49 1jvn n ASP 114 Cb 0.46 -0.20 0.06 0.00 -1.14 0.00 0.00 41.12 40.29 1jvn n ASP 114 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1jvn h SER 115 N 2.54 0.50 0.00 -1.12 0.02 -1.99 -3.33 113.55 110.17 1jvn h SER 115 Ca 0.00 -0.29 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 1jvn h SER 115 Cb 0.57 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1jvn h SER 115 CO 0.00 1.00 -1.74 -1.84 -1.14 0.00 0.00 176.83 173.11 1jvn n GLU 116 N -3.91 0.61 -3.62 3.45 0.28 -1.26 -5.04 120.64 111.15 1jvn n GLU 116 Ca -0.03 -0.15 -0.10 0.00 -0.16 0.00 0.00 57.16 56.71 1jvn n GLU 116 Cb 0.64 -1.45 -0.04 0.00 1.43 0.00 0.00 31.44 32.01 1jvn n GLU 116 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 177.13 175.38 1jvn s LYS 117 N -3.27 1.12 0.32 3.44 -2.85 -1.25 -5.06 119.74 112.18 1jvn s LYS 117 Ca -0.05 -0.70 -0.29 0.00 -1.00 0.00 0.00 55.97 53.93 1jvn s LYS 117 Cb 0.13 0.48 -0.10 0.00 -2.06 0.00 0.00 37.83 36.28 1jvn s LYS 117 CO 0.81 -0.45 1.38 -2.14 0.10 0.00 0.00 175.35 175.06 1jvn s PRO 118 N -3.81 4.28 -0.06 1.78 0.02 -1.26 -4.32 135.00 131.63 1jvn s PRO 118 Ca 0.03 2.32 0.03 0.00 0.02 0.00 0.00 61.00 63.40 1jvn s PRO 118 Cb 0.01 -3.06 0.01 0.00 0.02 0.00 0.00 34.50 31.48 1jvn s PRO 118 CO -0.11 -0.33 -0.15 0.08 -0.33 0.00 0.00 177.00 176.16 1jvn s VAL 119 N -0.81 1.32 0.74 3.83 1.01 -1.01 -4.15 120.40 121.32 1jvn s VAL 119 Ca 0.53 -0.61 -0.11 0.00 0.00 0.00 0.00 61.98 61.79 1jvn s VAL 119 Cb -0.42 -1.17 0.03 0.00 0.00 0.00 0.00 36.38 34.82 1jvn s VAL 119 CO 0.52 0.39 1.08 -2.16 0.00 0.00 0.00 175.10 174.93 1jvn s PRO 120 N 0.44 2.56 -0.12 2.72 0.04 -1.26 -4.57 135.00 134.82 1jvn s PRO 120 Ca -0.12 1.04 -0.29 0.00 0.04 0.00 0.00 61.00 61.67 1jvn s PRO 120 Cb -0.15 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 1jvn s PRO 120 CO 0.04 -1.39 1.41 -2.00 0.04 0.00 0.00 177.00 175.10 1jvn s GLU 121 N -4.98 4.22 -0.19 4.56 2.12 0.10 -4.74 118.70 119.79 1jvn s GLU 121 Ca 0.60 1.86 -0.02 0.00 0.36 0.00 0.00 54.97 57.77 1jvn s GLU 121 Cb -0.16 -3.84 0.05 0.00 0.26 0.00 0.00 34.13 30.45 1jvn s GLU 121 CO 0.56 -0.75 -0.00 0.42 -0.54 0.00 0.00 175.26 174.94 1jvn s ILE 122 N 3.65 0.83 -5.00 -3.70 1.01 -1.26 -1.21 121.20 115.53 1jvn s ILE 122 Ca 0.62 -0.67 0.00 0.00 0.00 0.00 0.00 60.65 60.60 1jvn s ILE 122 Cb -0.26 -1.21 0.00 0.00 0.01 0.00 0.00 42.46 41.00 1jvn s ILE 122 CO 0.20 -0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.66 1jvn n GLY 123 N 4.94 -0.09 3.39 6.18 0.00 -0.03 -5.01 105.19 114.57 1jvn n GLY 123 Ca -0.10 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 43.95 1jvn n GLY 123 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1jvn s TRP 124 N -2.63 3.26 0.53 1.61 0.52 -1.26 -0.02 118.94 120.95 1jvn s TRP 124 Ca 0.00 -0.93 0.05 0.00 0.02 0.00 0.00 56.10 55.25 1jvn s TRP 124 Cb 0.00 -2.78 0.03 0.00 -1.15 0.00 0.00 33.47 29.57 1jvn s TRP 124 CO 0.00 -0.71 0.37 1.21 0.02 0.00 0.00 176.95 177.84 1jvn s ASN 125 N 1.99 4.61 0.13 2.95 3.84 -0.81 -2.02 114.94 125.63 1jvn s ASN 125 Ca 0.04 -1.24 0.05 0.00 0.21 0.00 0.00 52.86 51.91 1jvn s ASN 125 Cb -0.21 0.35 -0.04 0.00 -0.55 0.00 0.00 41.25 40.79 1jvn s ASN 125 CO 0.07 -1.05 -0.11 -0.94 -2.79 0.00 0.00 177.10 172.28 1jvn s SER 126 N -4.24 1.75 0.18 -4.21 1.04 -1.26 -1.80 113.70 105.17 1jvn s SER 126 Ca 0.33 -0.94 -0.28 0.00 0.48 0.00 0.00 55.95 55.54 1jvn s SER 126 Cb -0.02 -0.02 -0.08 0.00 0.10 0.00 0.00 66.02 66.01 1jvn s SER 126 CO 0.20 -0.29 0.88 0.00 0.98 0.00 0.00 173.24 175.02 1jvn s ILE 128 N -0.91 3.58 0.28 0.00 1.01 0.12 -4.27 121.20 121.00 1jvn s ILE 128 Ca 0.40 1.28 -0.30 0.00 0.00 0.00 0.00 60.65 62.03 1jvn s ILE 128 Cb -0.24 -3.82 -0.12 0.00 0.01 0.00 0.00 42.46 38.29 1jvn s ILE 128 CO 0.29 0.18 1.60 -2.65 0.00 0.00 0.00 174.94 174.36 1jvn n PRO 129 N 2.77 2.64 -3.88 2.79 -0.02 -1.26 -4.66 135.00 133.39 1jvn n PRO 129 Ca 0.05 0.94 -0.07 0.00 -2.02 0.00 0.00 63.50 62.40 1jvn n PRO 129 Cb 0.45 -2.72 -0.02 0.00 -0.02 0.00 0.00 33.50 31.18 1jvn n PRO 129 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1jvn s SER 130 N 0.57 -0.20 0.01 2.55 1.04 -1.26 -5.04 113.70 111.37 1jvn s SER 130 Ca 0.66 -0.70 0.25 0.00 0.48 0.00 0.00 55.95 56.64 1jvn s SER 130 Cb -0.51 0.72 0.57 0.00 0.10 0.00 0.00 66.02 66.90 1jvn s SER 130 CO 0.46 -1.35 1.46 -0.62 0.98 0.00 0.00 173.24 174.18 1jvn n GLU 131 N -0.46 0.02 -0.85 4.02 -0.58 -1.26 -4.25 120.64 117.29 1jvn n GLU 131 Ca -0.04 0.01 -0.06 0.00 -0.42 0.00 0.00 57.16 56.64 1jvn n GLU 131 Cb 0.59 -1.51 0.21 0.00 -0.57 0.00 0.00 31.44 30.16 1jvn n GLU 131 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1jvn n ASN 132 N -1.55 3.12 -4.79 1.62 4.13 -1.26 -5.02 115.26 111.51 1jvn n ASN 132 Ca 0.05 -3.59 -0.29 0.00 1.68 0.00 0.00 54.58 52.44 1jvn n ASN 132 Cb 0.34 -0.67 0.13 0.00 -1.54 0.00 0.00 39.78 38.05 1jvn n ASN 132 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1jvn s LEU 133 N -3.18 2.03 0.20 3.41 1.43 -1.26 -4.43 118.68 116.88 1jvn s LEU 133 Ca 0.47 0.96 -0.17 0.00 -1.03 0.00 0.00 54.13 54.37 1jvn s LEU 133 Cb 0.41 -3.29 0.02 0.00 0.03 0.00 0.00 46.19 43.37 1jvn s LEU 133 CO 0.04 -2.53 0.51 0.72 0.23 0.00 0.00 176.35 175.33 1jvn s PHE 134 N -3.29 -0.06 -1.36 0.29 -0.12 -1.26 -4.96 117.98 107.22 1jvn s PHE 134 Ca 0.64 -0.29 -0.12 0.00 -0.05 0.00 0.00 56.93 57.11 1jvn s PHE 134 Cb -0.15 0.37 0.10 0.00 -0.63 0.00 0.00 43.02 42.71 1jvn s PHE 134 CO 0.53 -0.92 0.55 1.19 -0.05 0.00 0.00 175.22 176.52 1jvn n PHE 135 N -0.34 -1.75 -0.98 3.49 3.01 -1.26 -1.44 117.46 118.19 1jvn n PHE 135 Ca -0.09 0.55 0.00 0.00 1.01 0.00 0.00 57.45 58.92 1jvn n PHE 135 Cb 0.62 -2.74 0.00 0.00 -0.01 0.00 0.00 39.48 37.35 1jvn n PHE 135 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1jvn n GLY 136 N -1.18 0.66 3.64 1.37 0.00 -1.26 -4.53 105.19 103.88 1jvn n GLY 136 Ca 0.02 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.57 1jvn n GLY 136 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jvn n LEU 137 N 0.00 3.30 -4.31 0.99 4.77 -0.52 -4.93 117.00 116.30 1jvn n LEU 137 Ca 0.00 0.79 -0.36 0.00 -0.03 0.00 0.00 56.01 56.41 1jvn n LEU 137 Cb 0.02 -1.39 -0.13 0.00 -2.33 0.00 0.00 43.42 39.59 1jvn n LEU 137 CO 0.00 -0.21 -0.34 -0.62 -1.33 0.00 0.00 177.39 174.90 1jvn s ASP 138 N 5.11 4.70 0.37 -1.43 -1.08 -1.26 -4.72 116.67 118.36 1jvn s ASP 138 Ca 0.96 -0.62 0.26 0.00 -0.52 0.00 0.00 52.55 52.63 1jvn s ASP 138 Cb -0.65 -1.79 1.31 0.00 -1.46 0.00 0.00 42.92 40.33 1jvn s ASP 138 CO 0.49 -0.11 1.78 -0.65 0.52 0.00 0.00 175.17 177.19 1jvn h PRO 139 N 8.15 0.00 -0.71 4.34 0.11 -1.92 -1.95 132.00 140.01 1jvn h PRO 139 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1jvn h PRO 139 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1jvn h PRO 139 CO 0.59 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.04 1jvn n TYR 140 N -2.40 1.21 -4.66 0.65 4.02 -1.26 -4.56 117.16 110.15 1jvn n TYR 140 Ca -0.01 -0.54 -0.31 0.00 -0.01 0.00 0.00 57.90 57.03 1jvn n TYR 140 Cb 0.09 -0.10 -0.09 0.00 -0.02 0.00 0.00 39.34 39.22 1jvn n TYR 140 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 1jvn s LYS 141 N -1.35 2.12 0.01 -0.72 1.02 -0.74 -4.88 119.74 115.20 1jvn s LYS 141 Ca 0.51 -2.27 0.05 0.00 0.02 0.00 0.00 55.97 54.28 1jvn s LYS 141 Cb 0.29 -1.60 -0.02 0.00 -0.52 0.00 0.00 37.83 35.98 1jvn s LYS 141 CO 0.30 -0.25 -0.17 1.03 -0.92 0.00 0.00 175.35 175.34 1jvn s ARG 142 N -3.83 1.29 0.12 1.68 1.81 -1.26 -4.63 118.95 114.13 1jvn s ARG 142 Ca 0.18 -0.69 0.09 0.00 -1.72 0.00 0.00 55.73 53.59 1jvn s ARG 142 Cb 0.04 -1.28 -0.04 0.00 -0.45 0.00 0.00 34.95 33.22 1jvn s ARG 142 CO 0.09 0.34 -0.23 0.71 -0.68 0.00 0.00 175.30 175.53 1jvn s TYR 143 N -0.55 2.02 -0.28 -0.53 1.51 -0.74 -4.79 117.35 113.99 1jvn s TYR 143 Ca 0.06 -0.40 -0.22 0.00 -1.01 0.00 0.00 57.07 55.50 1jvn s TYR 143 Cb -0.07 -1.09 -0.01 0.00 -0.11 0.00 0.00 41.96 40.68 1jvn s TYR 143 CO 0.00 0.28 0.69 -0.47 -1.11 0.00 0.00 175.55 174.95 1jvn s TYR 144 N -1.22 3.25 -0.05 2.71 5.04 -1.26 -1.92 117.35 123.90 1jvn s TYR 144 Ca 0.11 0.81 0.02 0.00 -2.44 0.00 0.00 57.07 55.57 1jvn s TYR 144 Cb -0.10 -2.99 -0.03 0.00 0.35 0.00 0.00 41.96 39.20 1jvn s TYR 144 CO 0.05 -0.42 -0.10 -0.06 -1.34 0.00 0.00 175.55 173.68 1jvn s PHE 145 N 2.68 2.83 -0.44 4.97 0.40 0.97 -1.41 117.98 127.98 1jvn s PHE 145 Ca 0.29 -0.06 0.05 0.00 -0.60 0.00 0.00 56.93 56.61 1jvn s PHE 145 Cb -0.15 -1.66 0.18 0.00 0.51 0.00 0.00 43.02 41.90 1jvn s PHE 145 CO 0.10 0.28 0.50 0.54 0.70 0.00 0.00 175.22 177.34 1jvn s VAL 146 N -0.81 -0.32 0.05 -0.44 0.11 -1.23 -0.85 120.40 116.92 1jvn s VAL 146 Ca 0.13 -1.67 -0.19 0.00 -2.93 0.00 0.00 61.98 57.32 1jvn s VAL 146 Cb -0.11 -0.64 0.04 0.00 -1.53 0.00 0.00 36.38 34.14 1jvn s VAL 146 CO 0.02 -0.63 0.43 -1.38 -3.33 0.00 0.00 175.10 170.21 1jvn s HIS 147 N 0.65 -0.28 -0.03 1.54 -3.43 -0.35 -4.95 115.29 108.44 1jvn s HIS 147 Ca 0.29 0.23 0.13 0.00 -0.80 0.00 0.00 55.06 54.90 1jvn s HIS 147 Cb -0.01 0.24 -0.20 0.00 -1.43 0.00 0.00 32.58 31.18 1jvn s HIS 147 CO -0.11 -0.60 0.27 0.43 -2.00 0.00 0.00 174.74 172.73 1jvn n SER 148 N 0.41 1.92 -4.48 7.38 7.64 -1.26 0.03 113.62 125.26 1jvn n SER 148 Ca -0.18 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.38 1jvn n SER 148 Cb 0.60 1.53 -0.13 0.00 -1.01 0.00 0.00 64.21 65.20 1jvn n SER 148 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1jvn s PHE 149 N -2.87 2.65 0.22 1.43 0.40 -1.26 -1.37 117.98 117.18 1jvn s PHE 149 Ca -0.05 -0.19 -0.17 0.00 -0.60 0.00 0.00 56.93 55.92 1jvn s PHE 149 Cb 0.08 -1.54 0.02 0.00 0.51 0.00 0.00 43.02 42.09 1jvn s PHE 149 CO 0.56 0.24 0.55 0.00 0.70 0.00 0.00 175.22 177.26 1jvn s ALA 150 N -0.86 -0.83 -1.00 5.36 0.00 -0.24 -4.94 121.76 119.25 1jvn s ALA 150 Ca 0.14 -0.38 -0.19 0.00 0.00 0.00 0.00 51.96 51.53 1jvn s ALA 150 Cb -0.11 0.90 0.12 0.00 0.00 0.00 0.00 23.12 24.03 1jvn s ALA 150 CO 0.04 -0.85 1.26 0.00 0.00 0.00 0.00 175.76 176.21 1jvn s ALA 151 N -3.91 3.30 -0.04 0.00 0.00 -1.26 -1.17 121.76 118.67 1jvn s ALA 151 Ca 0.12 -2.73 -0.30 0.00 0.00 0.00 0.00 51.96 49.05 1jvn s ALA 151 Cb -0.02 -4.19 -0.04 0.00 0.00 0.00 0.00 23.12 18.88 1jvn s ALA 151 CO 0.01 -3.11 1.21 0.42 0.00 0.00 0.00 175.76 174.29 1jvn s ILE 152 N 3.12 4.21 0.31 0.00 1.01 -1.26 -1.61 121.20 126.99 1jvn s ILE 152 Ca 0.38 1.55 0.02 0.00 0.00 0.00 0.00 60.65 62.60 1jvn s ILE 152 Cb -0.03 -4.00 -0.03 0.00 0.01 0.00 0.00 42.46 38.41 1jvn s ILE 152 CO -0.08 0.01 0.49 -0.76 0.00 0.00 0.00 174.94 174.60 1jvn s LEU 153 N 2.10 4.10 0.29 2.97 1.43 0.36 -4.98 118.68 124.96 1jvn s LEU 153 Ca 0.56 0.30 -0.11 0.00 -1.03 0.00 0.00 54.13 53.85 1jvn s LEU 153 Cb -0.25 -3.14 0.01 0.00 0.03 0.00 0.00 46.19 42.83 1jvn s LEU 153 CO 0.23 -0.24 0.52 0.54 0.23 0.00 0.00 176.35 177.63 1jvn s ASN 154 N -4.03 0.16 0.17 2.29 2.20 -1.26 -4.63 114.94 109.84 1jvn s ASN 154 Ca 0.38 -1.08 -0.16 0.00 -0.94 0.00 0.00 52.86 51.06 1jvn s ASN 154 Cb -0.09 0.64 0.12 0.00 -2.00 0.00 0.00 41.25 39.92 1jvn s ASN 154 CO 0.34 -1.26 1.67 0.28 -2.94 0.00 0.00 177.10 175.19 1jvn h SER 155 N 2.18 -0.31 -0.20 3.54 0.02 -1.99 -2.18 113.55 114.60 1jvn h SER 155 Ca -0.27 0.12 0.03 0.00 -0.84 0.00 0.00 61.79 60.83 1jvn h SER 155 Cb 1.25 0.23 -0.03 0.00 0.14 0.00 0.00 62.40 63.99 1jvn h SER 155 CO 0.36 -0.11 0.02 -0.08 -1.14 0.00 0.00 176.83 175.89 1jvn h GLU 156 N 0.04 0.09 -0.29 3.45 4.81 -1.99 -1.43 114.58 119.26 1jvn h GLU 156 Ca 0.21 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.41 1jvn h GLU 156 Cb 0.31 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 1jvn h GLU 156 CO -0.40 0.06 0.10 0.87 -0.73 0.00 0.00 179.01 178.91 1jvn h LYS 157 N 0.09 0.44 -0.24 1.92 1.57 -1.92 -0.76 116.57 117.67 1jvn h LYS 157 Ca 0.09 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1jvn h LYS 157 Cb 0.10 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1jvn h LYS 157 CO -0.14 0.48 0.11 0.87 -0.57 0.00 0.00 179.45 180.21 1jvn h LYS 158 N 0.32 0.33 -0.19 3.15 1.57 -1.29 -0.29 116.57 120.17 1jvn h LYS 158 Ca 0.10 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 1jvn h LYS 158 Cb 0.21 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1jvn h LYS 158 CO -0.01 0.26 -0.09 -0.22 -0.57 0.00 0.00 179.45 178.83 1jvn h LYS 159 N 0.33 0.40 -0.20 3.15 1.63 -0.82 -1.74 116.57 119.33 1jvn h LYS 159 Ca 0.09 -0.17 -0.10 0.00 -0.85 0.00 0.00 60.65 59.62 1jvn h LYS 159 Cb 0.05 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.65 1jvn h LYS 159 CO -0.01 0.70 -0.29 -0.91 -3.45 0.00 0.00 179.45 175.48 1jvn h ASN 160 N 0.10 0.39 -0.35 4.20 2.35 -0.56 -1.45 115.58 120.25 1jvn h ASN 160 Ca 0.04 -0.14 -0.08 0.00 -0.55 0.00 0.00 56.30 55.57 1jvn h ASN 160 Cb 0.57 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.82 1jvn h ASN 160 CO 0.03 0.68 -0.11 -0.07 -1.65 0.00 0.00 177.43 176.31 1jvn h LEU 161 N 0.34 0.71 -0.08 1.61 3.38 -1.00 -1.36 115.31 118.91 1jvn h LEU 161 Ca 0.05 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 1jvn h LEU 161 Cb 0.69 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1jvn h LEU 161 CO 0.05 0.92 0.03 -0.08 0.09 0.00 0.00 178.44 179.46 1jvn h GLU 162 N 0.48 0.11 0.00 1.13 4.57 -1.13 1.00 114.58 120.74 1jvn h GLU 162 Ca 0.09 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 1jvn h GLU 162 Cb 0.62 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.20 1jvn h GLU 162 CO 0.04 0.20 0.00 -0.91 -1.18 0.00 0.00 179.01 177.16 1jvn h ASN 163 N -0.01 0.00 -0.17 1.04 2.35 -1.25 -1.26 115.58 116.27 1jvn h ASN 163 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1jvn h ASN 163 Cb 0.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1jvn h ASN 163 CO -0.00 0.00 0.00 -0.67 -1.65 0.00 0.00 177.43 175.11 1jvn n ASP 164 N -3.00 2.17 0.00 5.81 2.03 -0.52 -4.94 116.55 118.10 1jvn n ASP 164 Ca -0.01 -1.77 0.00 0.00 0.52 0.00 0.00 54.79 53.54 1jvn n ASP 164 Cb 0.20 -0.11 0.00 0.00 -0.72 0.00 0.00 41.12 40.50 1jvn n ASP 164 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1jvn n GLY 165 N 1.24 0.53 3.73 0.27 0.00 -0.48 -5.04 105.19 105.44 1jvn n GLY 165 Ca 0.17 -0.51 -0.37 0.00 0.00 0.00 0.00 46.02 45.31 1jvn n GLY 165 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1jvn s TRP 166 N -2.00 3.49 -0.11 1.61 0.52 0.29 -4.64 118.94 118.10 1jvn s TRP 166 Ca 0.00 0.74 -0.14 0.00 0.02 0.00 0.00 56.10 56.72 1jvn s TRP 166 Cb 0.00 -2.43 -0.05 0.00 -1.15 0.00 0.00 33.47 29.84 1jvn s TRP 166 CO 0.00 0.22 0.34 0.15 0.02 0.00 0.00 176.95 177.68 1jvn s LYS 167 N 0.48 4.11 0.10 4.98 1.02 0.71 -4.10 119.74 127.04 1jvn s LYS 167 Ca 0.21 0.21 0.09 0.00 0.02 0.00 0.00 55.97 56.50 1jvn s LYS 167 Cb -0.14 -3.36 -0.04 0.00 -0.52 0.00 0.00 37.83 33.78 1jvn s LYS 167 CO 0.07 0.38 -0.23 0.42 -0.92 0.00 0.00 175.35 175.07 1jvn s ILE 168 N -0.02 1.93 -0.29 2.17 -1.09 -1.26 -1.19 121.20 121.46 1jvn s ILE 168 Ca 0.20 -1.57 -0.03 0.00 -2.23 0.00 0.00 60.65 57.01 1jvn s ILE 168 Cb -0.14 -1.72 0.03 0.00 -1.58 0.00 0.00 42.46 39.05 1jvn s ILE 168 CO 0.07 0.05 0.01 0.00 -1.23 0.00 0.00 174.94 173.84 1jvn s ALA 169 N -1.06 2.86 0.34 9.38 0.00 0.62 -4.70 121.76 129.20 1jvn s ALA 169 Ca 0.10 -1.60 -0.02 0.00 0.00 0.00 0.00 51.96 50.44 1jvn s ALA 169 Cb -0.10 -1.94 -0.04 0.00 0.00 0.00 0.00 23.12 21.04 1jvn s ALA 169 CO 0.04 -1.06 0.57 0.15 0.00 0.00 0.00 175.76 175.47 1jvn s LYS 170 N 1.35 3.53 0.06 0.00 1.02 -1.26 0.43 119.74 124.87 1jvn s LYS 170 Ca -0.01 -0.18 -0.11 0.00 0.02 0.00 0.00 55.97 55.69 1jvn s LYS 170 Cb -0.18 -2.63 0.01 0.00 -0.52 0.00 0.00 37.83 34.50 1jvn s LYS 170 CO -0.01 0.14 0.24 0.00 -0.92 0.00 0.00 175.35 174.80 1jvn s ALA 171 N -2.28 -0.44 -0.04 5.17 0.00 -0.47 0.12 121.76 123.82 1jvn s ALA 171 Ca 0.42 -0.30 0.02 0.00 0.00 0.00 0.00 51.96 52.10 1jvn s ALA 171 Cb -0.10 0.39 0.01 0.00 0.00 0.00 0.00 23.12 23.42 1jvn s ALA 171 CO 0.35 -0.45 -0.10 0.21 0.00 0.00 0.00 175.76 175.78 1jvn s LYS 172 N -3.09 1.20 -0.21 0.00 2.20 -1.26 -0.16 119.74 118.42 1jvn s LYS 172 Ca -0.01 -0.32 0.00 0.00 -0.36 0.00 0.00 55.97 55.28 1jvn s LYS 172 Cb 0.01 -1.08 0.05 0.00 -1.51 0.00 0.00 37.83 35.31 1jvn s LYS 172 CO -0.07 0.07 -0.06 -0.47 -0.36 0.00 0.00 175.35 174.46 1jvn s TYR 173 N 0.43 2.21 0.00 4.03 5.04 -0.27 -4.66 117.35 124.13 1jvn s TYR 173 Ca -0.08 -1.56 0.00 0.00 -2.44 0.00 0.00 57.07 52.99 1jvn s TYR 173 Cb -0.12 -1.52 0.00 0.00 0.35 0.00 0.00 41.96 40.68 1jvn s TYR 173 CO 0.01 -0.73 0.00 0.41 -1.34 0.00 0.00 175.55 173.90 1jvn n GLY 174 N 4.73 2.26 0.67 8.97 0.00 0.28 -2.12 105.19 119.98 1jvn n GLY 174 Ca -0.12 -0.36 0.08 0.00 0.00 0.00 0.00 46.02 45.61 1jvn n GLY 174 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1jvn n SER 175 N 7.65 2.47 -4.60 1.61 3.41 -1.26 -4.91 113.62 117.99 1jvn n SER 175 Ca 0.00 -1.71 -0.39 0.00 -0.26 0.00 0.00 58.87 56.51 1jvn n SER 175 Cb 0.00 -0.05 -0.09 0.00 -0.26 0.00 0.00 64.21 63.80 1jvn n SER 175 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1jvn s GLU 176 N -1.25 4.00 0.02 4.33 2.02 -0.90 -5.07 118.70 121.85 1jvn s GLU 176 Ca 0.21 -0.01 -0.20 0.00 0.02 0.00 0.00 54.97 54.98 1jvn s GLU 176 Cb 0.14 -3.66 -0.06 0.00 0.10 0.00 0.00 34.13 30.65 1jvn s GLU 176 CO 0.20 -0.27 0.58 -2.00 0.02 0.00 0.00 175.26 173.79 1jvn s GLU 177 N 2.03 4.27 0.25 1.61 2.12 -1.26 -1.11 118.70 126.61 1jvn s GLU 177 Ca 0.14 0.73 -0.06 0.00 0.36 0.00 0.00 54.97 56.14 1jvn s GLU 177 Cb -0.16 -3.30 -0.02 0.00 0.26 0.00 0.00 34.13 30.91 1jvn s GLU 177 CO 0.10 0.47 0.34 -0.59 -0.54 0.00 0.00 175.26 175.05 1jvn s PHE 178 N -0.55 0.83 -0.29 5.30 -0.12 0.78 -0.48 117.98 123.44 1jvn s PHE 178 Ca 0.30 -1.10 -0.27 0.00 -0.05 0.00 0.00 56.93 55.81 1jvn s PHE 178 Cb -0.19 -0.16 0.01 0.00 -0.63 0.00 0.00 43.02 42.05 1jvn s PHE 178 CO 0.18 -0.88 0.98 0.42 -0.05 0.00 0.00 175.22 175.86 1jvn s ILE 179 N -3.88 4.65 -0.04 -4.49 1.01 -0.64 -1.37 121.20 116.44 1jvn s ILE 179 Ca 0.31 1.68 0.08 0.00 0.00 0.00 0.00 60.65 62.71 1jvn s ILE 179 Cb 0.02 -4.30 -0.24 0.00 0.01 0.00 0.00 42.46 37.95 1jvn s ILE 179 CO 0.13 -0.31 0.66 0.00 0.00 0.00 0.00 174.94 175.42 1jvn h ALA 180 N 7.89 0.65 -2.16 9.38 0.00 -0.30 -3.43 119.26 131.29 1jvn h ALA 180 Ca -0.21 -1.40 0.05 0.00 0.00 0.00 0.00 54.91 53.35 1jvn h ALA 180 Cb 1.07 0.48 -0.17 0.00 0.00 0.00 0.00 17.79 19.17 1jvn h ALA 180 CO 0.97 1.49 0.40 0.00 0.00 0.00 0.00 179.25 182.11 1jvn s ALA 181 N -2.60 -1.80 0.14 0.00 0.00 -0.95 0.37 121.76 116.92 1jvn s ALA 181 Ca -0.08 1.14 0.05 0.00 0.00 0.00 0.00 51.96 53.07 1jvn s ALA 181 Cb 0.08 0.12 -0.04 0.00 0.00 0.00 0.00 23.12 23.28 1jvn s ALA 181 CO 0.82 -0.54 -0.11 0.14 0.00 0.00 0.00 175.76 176.06 1jvn s VAL 182 N -2.32 1.23 -0.26 0.00 -7.23 0.14 -0.27 120.40 111.68 1jvn s VAL 182 Ca -0.01 -1.92 -0.08 0.00 -1.81 0.00 0.00 61.98 58.16 1jvn s VAL 182 Cb -0.01 -1.71 0.11 0.00 0.56 0.00 0.00 36.38 35.34 1jvn s VAL 182 CO -0.03 -0.62 0.55 0.21 -0.31 0.00 0.00 175.10 174.89 1jvn s ASN 183 N -2.89 -0.75 -0.13 4.85 3.04 -0.33 -1.87 114.94 116.87 1jvn s ASN 183 Ca 0.13 1.29 -0.04 0.00 0.04 0.00 0.00 52.86 54.29 1jvn s ASN 183 Cb -0.01 1.88 0.06 0.00 -1.54 0.00 0.00 41.25 41.64 1jvn s ASN 183 CO 0.02 -0.23 0.21 -0.75 -3.04 0.00 0.00 177.10 173.31 1jvn s LYS 184 N 2.77 0.11 3.31 0.43 2.20 -0.52 -0.21 119.74 127.83 1jvn s LYS 184 Ca -0.03 0.55 0.00 0.00 -0.36 0.00 0.00 55.97 56.13 1jvn s LYS 184 Cb -0.12 -0.38 0.00 0.00 -1.51 0.00 0.00 37.83 35.81 1jvn s LYS 184 CO -0.16 -0.37 0.00 0.09 -0.36 0.00 0.00 175.35 174.55 1jvn n ASN 185 N 5.33 0.00 -0.24 1.43 3.02 -1.26 -0.54 115.26 123.00 1jvn n ASN 185 Ca -0.05 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.62 1jvn n ASN 185 Cb 0.50 0.00 0.30 0.00 -0.61 0.00 0.00 39.78 39.97 1jvn n ASN 185 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1jvn n ASN 186 N 8.41 1.08 -4.72 6.41 6.94 -1.26 -4.90 115.26 127.21 1jvn n ASN 186 Ca 0.00 -0.89 -0.38 0.00 -0.02 0.00 0.00 54.58 53.29 1jvn n ASN 186 Cb 0.00 0.21 -0.06 0.00 -2.36 0.00 0.00 39.78 37.57 1jvn n ASN 186 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1jvn s ILE 187 N -2.57 5.19 -0.00 1.53 1.01 0.30 -1.65 121.20 125.00 1jvn s ILE 187 Ca 0.22 0.93 0.02 0.00 0.00 0.00 0.00 60.65 61.81 1jvn s ILE 187 Cb 0.19 -3.81 -0.01 0.00 0.01 0.00 0.00 42.46 38.84 1jvn s ILE 187 CO 0.56 0.31 -0.05 0.12 0.00 0.00 0.00 174.94 175.88 1jvn s PHE 188 N 0.72 0.45 -0.13 3.97 5.36 -0.32 -1.43 117.98 126.60 1jvn s PHE 188 Ca 0.25 -0.11 -0.27 0.00 -0.96 0.00 0.00 56.93 55.84 1jvn s PHE 188 Cb -0.15 -0.29 0.07 0.00 -0.34 0.00 0.00 43.02 42.31 1jvn s PHE 188 CO 0.10 -0.01 0.65 0.00 -1.46 0.00 0.00 175.22 174.50 1jvn s ALA 189 N -0.20 -1.67 0.03 11.12 0.00 -0.78 -0.13 121.76 130.13 1jvn s ALA 189 Ca 0.01 1.49 0.07 0.00 0.00 0.00 0.00 51.96 53.53 1jvn s ALA 189 Cb -0.02 -0.44 -0.02 0.00 0.00 0.00 0.00 23.12 22.63 1jvn s ALA 189 CO -0.00 -0.34 -0.20 0.95 0.00 0.00 0.00 175.76 176.17 1jvn s THR 190 N -0.58 1.58 0.09 0.00 -4.23 0.13 -0.69 115.64 111.94 1jvn s THR 190 Ca -0.07 -1.08 0.07 0.00 -1.18 0.00 0.00 61.69 59.43 1jvn s THR 190 Cb -0.02 -1.36 -0.22 0.00 1.34 0.00 0.00 72.50 72.24 1jvn s THR 190 CO 0.06 0.25 1.16 -0.61 -0.54 0.00 0.00 174.62 174.94 1jvn h GLN 191 N 5.09 0.02 -7.20 3.99 5.75 -0.34 -3.38 115.11 119.03 1jvn h GLN 191 Ca -0.41 -0.03 -0.46 0.00 -0.15 0.00 0.00 58.65 57.60 1jvn h GLN 191 Cb 1.16 0.01 0.07 0.00 1.07 0.00 0.00 27.48 29.79 1jvn h GLN 191 CO 0.45 0.93 0.19 -0.59 -2.65 0.00 0.00 178.83 177.16 1jvn s PHE 192 N -2.69 3.03 -0.50 3.99 -0.12 -1.25 -4.78 117.98 115.66 1jvn s PHE 192 Ca -0.00 0.48 -0.14 0.00 -0.05 0.00 0.00 56.93 57.21 1jvn s PHE 192 Cb 0.09 -2.99 0.11 0.00 -0.63 0.00 0.00 43.02 39.60 1jvn s PHE 192 CO 0.82 -1.15 0.43 -1.01 -0.05 0.00 0.00 175.22 174.26 1jvn s HIS 193 N -3.11 3.29 0.42 3.49 3.76 -0.50 -4.93 115.29 117.70 1jvn s HIS 193 Ca 0.58 -1.34 0.11 0.00 -0.15 0.00 0.00 55.06 54.26 1jvn s HIS 193 Cb -0.11 -3.55 0.89 0.00 1.11 0.00 0.00 32.58 30.93 1jvn s HIS 193 CO 0.44 -0.96 1.97 -1.00 -0.85 0.00 0.00 174.74 174.35 1jvn h PRO 194 N 8.75 0.17 0.00 8.40 0.13 -1.87 -1.32 132.00 146.26 1jvn h PRO 194 Ca -0.28 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1jvn h PRO 194 Cb 1.10 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1jvn h PRO 194 CO 0.95 0.29 0.00 -0.85 -0.23 0.00 0.00 178.00 178.16 1jvn n GLU 195 N -4.33 0.00 -0.02 0.86 0.00 -1.26 -2.09 120.64 113.81 1jvn n GLU 195 Ca -0.01 0.19 0.04 0.00 0.00 0.00 0.00 57.16 57.38 1jvn n GLU 195 Cb 0.23 -1.51 0.04 0.00 0.00 0.00 0.00 31.44 30.20 1jvn n GLU 195 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1jvn n LYS 196 N -1.52 0.43 -0.98 3.44 4.76 -0.56 -4.46 118.16 119.27 1jvn n LYS 196 Ca 0.04 -1.06 -0.01 0.00 -2.87 0.00 0.00 58.31 54.42 1jvn n LYS 196 Cb 0.21 -1.14 0.35 0.00 -1.84 0.00 0.00 35.03 32.61 1jvn n LYS 196 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1jvn n SER 197 N 0.36 5.25 0.00 4.39 7.64 -0.80 -4.25 113.62 126.20 1jvn n SER 197 Ca 0.05 -3.11 0.00 0.00 1.01 0.00 0.00 58.87 56.82 1jvn n SER 197 Cb 0.20 -0.72 0.00 0.00 -1.01 0.00 0.00 64.21 62.68 1jvn n SER 197 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jvn n GLY 198 N 0.17 1.47 0.35 0.23 0.00 0.42 -2.36 105.19 105.47 1jvn n GLY 198 Ca 0.36 -0.58 -0.04 0.00 0.00 0.00 0.00 46.02 45.76 1jvn n GLY 198 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1jvn h LYS 199 N 0.00 1.16 -0.99 1.61 1.63 -1.88 -0.96 116.57 117.14 1jvn h LYS 199 Ca 0.00 -0.15 0.06 0.00 -0.85 0.00 0.00 60.65 59.70 1jvn h LYS 199 Cb 0.00 -0.22 -0.07 0.00 -0.60 0.00 0.00 32.23 31.35 1jvn h LYS 199 CO 0.00 0.88 0.64 0.00 -3.45 0.00 0.00 179.45 177.52 1jvn h ALA 200 N 1.29 1.37 -0.25 5.00 0.00 -1.88 -0.05 119.26 124.75 1jvn h ALA 200 Ca 0.28 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.99 1jvn h ALA 200 Cb 0.08 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 1jvn h ALA 200 CO -0.04 0.46 -0.54 0.78 0.00 0.00 0.00 179.25 179.90 1jvn h GLY 201 N 1.18 0.81 1.14 0.00 0.00 -0.99 -2.96 103.07 102.24 1jvn h GLY 201 Ca 0.42 -0.94 -0.02 0.00 0.00 0.00 0.00 47.33 46.79 1jvn h GLY 201 CO -0.16 0.84 0.43 1.41 0.00 0.00 0.00 176.54 179.06 1jvn h LEU 202 N 0.57 1.01 -0.95 3.11 3.38 -0.23 -2.31 115.31 119.89 1jvn h LEU 202 Ca 0.01 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1jvn h LEU 202 Cb 1.12 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.58 1jvn h LEU 202 CO 0.11 0.82 0.49 0.78 0.09 0.00 0.00 178.44 180.73 1jvn h ASN 203 N 1.13 1.10 -0.13 -0.43 2.35 -0.94 -0.34 115.58 118.31 1jvn h ASN 203 Ca 0.28 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.93 1jvn h ASN 203 Cb 0.04 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.13 1jvn h ASN 203 CO -0.04 0.87 0.05 0.58 -1.65 0.00 0.00 177.43 177.24 1jvn h VAL 204 N 1.23 1.16 -0.70 2.81 2.07 -1.28 0.12 116.25 121.67 1jvn h VAL 204 Ca 0.31 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 1jvn h VAL 204 Cb 0.02 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1jvn h VAL 204 CO -0.05 0.15 0.41 0.40 0.02 0.00 0.00 177.57 178.50 1jvn h ILE 205 N 0.05 1.20 -0.52 4.57 2.04 -1.17 -1.39 117.51 122.29 1jvn h ILE 205 Ca 0.04 -0.47 -0.09 0.00 1.00 0.00 0.00 64.86 65.35 1jvn h ILE 205 Cb 0.19 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 1jvn h ILE 205 CO -0.00 0.22 -0.04 -0.08 0.00 0.00 0.00 178.15 178.25 1jvn h GLU 206 N 0.95 0.90 0.00 2.37 4.81 -0.91 -1.22 114.58 121.49 1jvn h GLU 206 Ca 0.25 -0.28 -0.06 0.00 -0.13 0.00 0.00 59.36 59.14 1jvn h GLU 206 Cb -0.01 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 1jvn h GLU 206 CO -0.04 0.92 -0.29 -0.91 -0.73 0.00 0.00 179.01 177.96 1jvn h ASN 207 N 0.83 0.00 0.02 1.04 2.35 -0.33 -1.17 115.58 118.32 1jvn h ASN 207 Ca 0.15 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.84 1jvn h ASN 207 Cb 0.54 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.92 1jvn h ASN 207 CO 0.03 0.29 -0.22 0.15 -1.65 0.00 0.00 177.43 176.02 1jvn h PHE 208 N 0.00 0.18 -0.22 1.19 3.57 -0.89 0.37 116.94 121.14 1jvn h PHE 208 Ca -0.00 -0.12 -0.00 0.00 3.53 0.00 0.00 57.97 61.38 1jvn h PHE 208 Cb 0.69 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 1jvn h PHE 208 CO 0.00 1.00 0.12 -0.07 -2.23 0.00 0.00 178.31 177.13 1jvn h LEU 209 N -0.68 0.26 -2.44 0.59 3.38 -1.08 -1.04 115.31 114.30 1jvn h LEU 209 Ca -0.03 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1jvn h LEU 209 Cb 1.07 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1jvn h LEU 209 CO 0.04 0.21 0.00 0.29 0.09 0.00 0.00 178.44 179.08 1jvn n LYS 210 N -4.48 2.58 -3.96 1.13 5.02 -0.46 -4.99 118.16 113.00 1jvn n LYS 210 Ca 0.00 -2.40 -0.38 0.00 -2.02 0.00 0.00 58.31 53.51 1jvn n LYS 210 Cb 0.09 -1.53 0.01 0.00 -0.02 0.00 0.00 35.03 33.58 1jvn n LYS 210 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1jvn n GLN 211 N 1.56 -1.00 -4.16 1.97 1.13 -0.40 -4.98 117.38 111.50 1jvn n GLN 211 Ca 0.21 0.24 -0.16 0.00 -1.94 0.00 0.00 57.00 55.35 1jvn n GLN 211 Cb 0.62 -3.39 -0.13 0.00 0.11 0.00 0.00 30.24 27.45 1jvn n GLN 211 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 1jvn s GLN 212 N -6.87 0.61 -0.66 -1.09 -2.07 0.07 -5.04 119.66 104.61 1jvn s GLN 212 Ca 0.38 -0.63 0.05 0.00 -1.82 0.00 0.00 55.36 53.33 1jvn s GLN 212 Cb -0.18 -0.50 0.18 0.00 -1.09 0.00 0.00 33.01 31.42 1jvn s GLN 212 CO 0.93 0.11 0.51 0.43 -1.32 0.00 0.00 175.29 175.95 1jvn n SER 213 N 1.91 2.61 -4.73 12.60 7.64 -1.26 -4.25 113.62 128.14 1jvn n SER 213 Ca -0.19 -3.12 -0.36 0.00 1.01 0.00 0.00 58.87 56.20 1jvn n SER 213 Cb 0.55 -0.72 0.07 0.00 -1.01 0.00 0.00 64.21 63.10 1jvn n SER 213 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 1jvn s PRO 214 N -1.39 2.57 0.51 1.43 0.02 -1.26 -4.76 135.00 132.11 1jvn s PRO 214 Ca 0.28 1.99 -0.19 0.00 0.02 0.00 0.00 61.00 63.09 1jvn s PRO 214 Cb -0.00 -1.86 -0.08 0.00 0.02 0.00 0.00 34.50 32.58 1jvn s PRO 214 CO -0.16 -1.56 1.04 -1.25 -0.33 0.00 0.00 177.00 174.74 1jvn s PRO 215 N -3.44 3.72 0.24 5.54 0.04 -1.26 -4.19 135.00 135.64 1jvn s PRO 215 Ca 0.81 1.33 -0.30 0.00 0.04 0.00 0.00 61.00 62.88 1jvn s PRO 215 Cb -0.35 -2.08 -0.09 0.00 0.04 0.00 0.00 34.50 32.02 1jvn s PRO 215 CO 0.39 -0.50 1.20 0.96 0.04 0.00 0.00 177.00 179.10 1jvn s ILE 216 N -2.07 3.36 0.65 0.56 -4.36 -1.26 -4.94 121.20 113.14 1jvn s ILE 216 Ca 0.67 1.23 -0.17 0.00 -0.26 0.00 0.00 60.65 62.11 1jvn s ILE 216 Cb -0.16 -3.79 -0.03 0.00 1.25 0.00 0.00 42.46 39.74 1jvn s ILE 216 CO 0.23 0.24 0.97 -2.65 0.24 0.00 0.00 174.94 173.97 1jvn n PRO 217 N 1.86 0.76 -2.47 0.37 -0.02 -1.26 -4.81 135.00 129.43 1jvn n PRO 217 Ca 0.02 0.31 -0.40 0.00 -2.02 0.00 0.00 63.50 61.41 1jvn n PRO 217 Cb 0.44 -2.20 -0.02 0.00 -0.02 0.00 0.00 33.50 31.70 1jvn n PRO 217 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1jvn s ASN 218 N -1.40 6.44 0.31 2.55 3.84 -1.26 -4.95 114.94 120.47 1jvn s ASN 218 Ca 0.76 -2.17 -0.29 0.00 0.21 0.00 0.00 52.86 51.38 1jvn s ASN 218 Cb -0.39 -2.58 -0.10 0.00 -0.55 0.00 0.00 41.25 37.64 1jvn s ASN 218 CO 0.47 -1.58 1.15 -0.31 -2.79 0.00 0.00 177.10 174.04 1jvn s TYR 219 N 5.66 3.39 0.60 0.43 1.51 -1.26 -5.02 117.35 122.66 1jvn s TYR 219 Ca 0.56 1.62 -0.16 0.00 -1.01 0.00 0.00 57.07 58.08 1jvn s TYR 219 Cb 0.02 -3.38 -0.03 0.00 -0.11 0.00 0.00 41.96 38.47 1jvn s TYR 219 CO 0.07 -0.92 1.07 -1.54 -1.11 0.00 0.00 175.55 173.11 1jvn s SER 220 N -0.85 5.70 0.55 2.29 1.04 -1.26 -4.82 113.70 116.35 1jvn s SER 220 Ca 0.47 1.86 0.25 0.00 0.48 0.00 0.00 55.95 59.01 1jvn s SER 220 Cb -0.33 -2.54 1.46 0.00 0.10 0.00 0.00 66.02 64.71 1jvn s SER 220 CO 0.43 -1.22 2.04 0.00 0.98 0.00 0.00 173.24 175.47 1jvn h ALA 221 N 0.43 2.20 -0.14 5.32 0.00 -1.99 0.77 119.26 125.84 1jvn h ALA 221 Ca -0.47 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.26 1jvn h ALA 221 Cb 1.22 0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.05 1jvn h ALA 221 CO 0.57 -0.45 -0.57 0.93 0.00 0.00 0.00 179.25 179.72 1jvn h GLU 222 N 0.00 0.64 -0.51 0.00 4.39 -1.99 -2.03 114.58 115.07 1jvn h GLU 222 Ca 0.16 -0.50 -0.11 0.00 0.34 0.00 0.00 59.36 59.25 1jvn h GLU 222 Cb 0.72 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.45 1jvn h GLU 222 CO -0.00 1.12 -0.12 0.93 -1.16 0.00 0.00 179.01 179.78 1jvn h GLU 223 N 0.30 0.95 -0.27 2.33 5.08 -1.38 -2.24 114.58 119.35 1jvn h GLU 223 Ca -0.03 -0.35 -0.02 0.00 -1.00 0.00 0.00 59.36 57.96 1jvn h GLU 223 Cb 1.21 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 1jvn h GLU 223 CO 0.12 1.01 0.10 0.87 -1.00 0.00 0.00 179.01 180.11 1jvn h LYS 224 N 0.85 0.41 -0.20 2.33 1.57 -0.93 0.34 116.57 120.94 1jvn h LYS 224 Ca 0.13 -0.08 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1jvn h LYS 224 Cb 0.66 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 1jvn h LYS 224 CO 0.05 0.46 -0.01 1.49 -0.57 0.00 0.00 179.45 180.87 1jvn h GLU 225 N 0.28 0.30 0.00 3.15 4.57 -1.30 0.30 114.58 121.89 1jvn h GLU 225 Ca 0.09 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1jvn h GLU 225 Cb 0.21 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 1jvn h GLU 225 CO -0.00 0.34 -0.00 1.25 -1.18 0.00 0.00 179.01 179.41 1jvn h LEU 226 N 0.29 -0.01 0.00 1.64 5.85 -1.04 -3.36 115.31 118.68 1jvn h LEU 226 Ca 0.07 -0.80 0.00 0.00 0.84 0.00 0.00 57.88 57.99 1jvn h LEU 226 Cb 0.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.26 1jvn h LEU 226 CO 0.01 0.81 -0.21 -0.07 -0.34 0.00 0.00 178.44 178.63 1jvn h LEU 227 N -0.83 0.00-10.27 2.25 3.38 -0.19 -3.47 115.31 106.18 1jvn h LEU 227 Ca -0.00 -0.06 -0.51 0.00 0.09 0.00 0.00 57.88 57.40 1jvn h LEU 227 Cb 0.80 0.00 0.18 0.00 0.09 0.00 0.00 40.66 41.73 1jvn h LEU 227 CO 0.00 0.03 0.22 0.00 0.09 0.00 0.00 178.44 178.78 1jvn s MET 228 N -3.14 1.09 -0.23 1.13 0.23 0.10 -4.74 119.30 113.74 1jvn s MET 228 Ca 0.09 1.35 -0.20 0.00 -1.03 0.00 0.00 55.69 55.89 1jvn s MET 228 Cb 0.12 -1.75 -0.02 0.00 -1.53 0.00 0.00 34.83 31.64 1jvn s MET 228 CO 0.65 -2.51 0.62 1.21 -2.03 0.00 0.00 175.02 172.95 1jvn s ASN 229 N -2.86 6.60 0.00 -1.18 3.84 -1.26 -4.92 114.94 115.16 1jvn s ASN 229 Ca 0.65 0.74 0.24 0.00 0.21 0.00 0.00 52.86 54.70 1jvn s ASN 229 Cb -0.21 -2.34 0.60 0.00 -0.55 0.00 0.00 41.25 38.75 1jvn s ASN 229 CO 0.58 -0.33 1.49 -0.90 -2.79 0.00 0.00 177.10 175.15 1jvn n ASP 230 N 5.45 2.40 -2.27 -4.21 5.75 -1.26 -4.93 116.55 117.49 1jvn n ASP 230 Ca -0.01 -1.80 -0.20 0.00 -0.01 0.00 0.00 54.79 52.76 1jvn n ASP 230 Cb 0.49 -0.09 -0.01 0.00 -1.03 0.00 0.00 41.12 40.48 1jvn n ASP 230 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1jvn n TYR 231 N 0.83 -0.93 -2.75 2.11 4.02 -1.26 -4.99 117.16 114.19 1jvn n TYR 231 Ca 0.17 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.73 1jvn n TYR 231 Cb 0.47 -3.85 -0.06 0.00 -0.02 0.00 0.00 39.34 35.88 1jvn n TYR 231 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1jvn s SER 232 N -2.11 6.83 -1.46 7.72 1.04 -1.26 -3.66 113.70 120.79 1jvn s SER 232 Ca 0.00 1.60 -0.08 0.00 0.48 0.00 0.00 55.95 57.94 1jvn s SER 232 Cb 0.00 -2.51 0.06 0.00 0.10 0.00 0.00 66.02 63.67 1jvn s SER 232 CO 0.00 -0.40 0.83 -3.20 0.98 0.00 0.00 173.24 171.45 1jvn n ASN 233 N -0.86 -3.12 0.00 7.02 5.15 -1.26 -1.38 115.26 120.81 1jvn n ASN 233 Ca 0.06 -0.83 0.00 0.00 -0.60 0.00 0.00 54.58 53.21 1jvn n ASN 233 Cb 0.54 -3.78 0.00 0.00 -0.53 0.00 0.00 39.78 36.01 1jvn n ASN 233 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1jvn n TYR 234 N -4.51 0.00 0.00 1.20 4.02 -1.24 -1.20 117.16 115.42 1jvn n TYR 234 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.79 1jvn n TYR 234 Cb 0.59 -1.75 0.00 0.00 -0.02 0.00 0.00 39.34 38.15 1jvn n TYR 234 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1jvn n GLY 235 N 0.11 0.72 3.89 2.72 0.00 -0.48 -0.56 105.19 111.59 1jvn n GLY 235 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1jvn n GLY 235 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jvn s LEU 236 N 0.00 4.33 1.03 0.99 1.43 -0.34 -4.46 118.68 121.66 1jvn s LEU 236 Ca 0.00 0.34 -0.13 0.00 -1.03 0.00 0.00 54.13 53.31 1jvn s LEU 236 Cb 0.00 -2.52 0.20 0.00 0.03 0.00 0.00 46.19 43.90 1jvn s LEU 236 CO 0.00 0.28 1.10 0.42 0.23 0.00 0.00 176.35 178.38 1jvn s THR 237 N -1.28 1.95 -0.57 5.49 -4.23 -0.86 -4.56 115.64 111.59 1jvn s THR 237 Ca 0.26 0.00 -0.26 0.00 -1.18 0.00 0.00 61.69 60.50 1jvn s THR 237 Cb -0.12 -2.51 0.04 0.00 1.34 0.00 0.00 72.50 71.24 1jvn s THR 237 CO 0.17 0.00 1.07 -0.13 -0.54 0.00 0.00 174.62 175.19 1jvn s ARG 238 N -5.05 3.42 -0.14 3.99 1.81 0.48 -4.79 118.95 118.67 1jvn s ARG 238 Ca 0.66 -0.01 -0.29 0.00 -1.72 0.00 0.00 55.73 54.37 1jvn s ARG 238 Cb -0.17 -4.03 -0.03 0.00 -0.45 0.00 0.00 34.95 30.27 1jvn s ARG 238 CO 0.57 -1.59 1.42 0.50 -0.68 0.00 0.00 175.30 175.52 1jvn s ARG 239 N 4.47 4.17 -0.29 3.54 3.52 -1.26 -4.70 118.95 128.40 1jvn s ARG 239 Ca 0.37 1.81 -0.06 0.00 -0.13 0.00 0.00 55.73 57.71 1jvn s ARG 239 Cb -0.10 -3.86 0.01 0.00 -1.56 0.00 0.00 34.95 29.44 1jvn s ARG 239 CO 0.22 -0.82 0.07 0.42 -0.81 0.00 0.00 175.30 174.38 1jvn s ILE 240 N 3.85 3.91 -0.15 4.11 -1.09 -1.26 -1.14 121.20 129.44 1jvn s ILE 240 Ca 0.62 -0.68 -0.06 0.00 -2.23 0.00 0.00 60.65 58.30 1jvn s ILE 240 Cb -0.25 -3.00 -0.04 0.00 -1.58 0.00 0.00 42.46 37.58 1jvn s ILE 240 CO 0.21 0.10 0.06 -0.63 -1.23 0.00 0.00 174.94 173.45 1jvn s ILE 241 N 1.50 4.79 -0.19 2.92 1.01 0.33 -1.55 121.20 130.02 1jvn s ILE 241 Ca 0.03 -0.04 -0.06 0.00 0.00 0.00 0.00 60.65 60.57 1jvn s ILE 241 Cb -0.17 -3.11 -0.03 0.00 0.01 0.00 0.00 42.46 39.15 1jvn s ILE 241 CO 0.02 0.52 0.03 0.00 0.00 0.00 0.00 174.94 175.51 1jvn s ALA 242 N -0.17 3.21 -0.01 9.38 0.00 -0.05 -0.98 121.76 133.14 1jvn s ALA 242 Ca 0.07 -0.86 0.08 0.00 0.00 0.00 0.00 51.96 51.25 1jvn s ALA 242 Cb -0.12 -1.83 -0.02 0.00 0.00 0.00 0.00 23.12 21.14 1jvn s ALA 242 CO 0.01 0.03 -0.25 0.00 0.00 0.00 0.00 175.76 175.55 1jvn s LEU 244 N -0.70 2.29 0.12 0.00 2.34 -0.16 -4.37 118.68 118.20 1jvn s LEU 244 Ca 0.10 -0.60 -0.10 0.00 0.06 0.00 0.00 54.13 53.59 1jvn s LEU 244 Cb -0.10 -0.02 -0.06 0.00 -0.56 0.00 0.00 46.19 45.45 1jvn s LEU 244 CO -0.00 -0.29 0.46 -1.81 -1.06 0.00 0.00 176.35 173.64 1jvn s ASP 245 N -1.74 6.67 -0.34 1.48 1.01 -1.26 -0.54 116.67 121.95 1jvn s ASP 245 Ca -0.10 0.86 0.02 0.00 0.71 0.00 0.00 52.55 54.05 1jvn s ASP 245 Cb -0.07 -2.20 0.10 0.00 1.01 0.00 0.00 42.92 41.75 1jvn s ASP 245 CO -0.01 0.11 0.09 -0.69 0.21 0.00 0.00 175.17 174.87 1jvn s VAL 246 N -1.50 1.71 0.36 -1.27 1.01 -0.20 -4.09 120.40 116.42 1jvn s VAL 246 Ca 0.37 -2.04 0.08 0.00 0.00 0.00 0.00 61.98 60.39 1jvn s VAL 246 Cb -0.14 -2.27 -0.05 0.00 0.00 0.00 0.00 36.38 33.93 1jvn s VAL 246 CO 0.19 -0.65 0.12 -0.13 0.00 0.00 0.00 175.10 174.63 1jvn s ARG 247 N 1.10 2.25 -0.15 2.72 0.52 0.79 -1.22 118.95 124.95 1jvn s ARG 247 Ca 0.11 -1.70 -0.04 0.00 -0.52 0.00 0.00 55.73 53.59 1jvn s ARG 247 Cb -0.19 -2.05 -0.03 0.00 0.52 0.00 0.00 34.95 33.20 1jvn s ARG 247 CO -0.14 0.04 -0.03 0.95 0.02 0.00 0.00 175.30 176.14 1jvn s THR 248 N -2.51 3.96 0.45 0.02 -4.23 -1.26 0.30 115.64 112.38 1jvn s THR 248 Ca 0.38 -0.34 0.03 0.00 -1.18 0.00 0.00 61.69 60.59 1jvn s THR 248 Cb 0.00 -2.73 0.08 0.00 1.34 0.00 0.00 72.50 71.19 1jvn s THR 248 CO 0.22 0.50 0.62 -0.46 -0.54 0.00 0.00 174.62 174.96 1jvn n ASN 249 N 3.42 1.21 -0.25 3.99 0.23 0.42 -4.93 115.26 119.34 1jvn n ASN 249 Ca -0.17 -1.93 0.06 0.00 -0.53 0.00 0.00 54.58 52.00 1jvn n ASN 249 Cb 0.52 -0.37 0.18 0.00 -2.08 0.00 0.00 39.78 38.04 1jvn n ASN 249 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1jvn h ASP 250 N -0.16 -0.08 0.00 0.53 5.19 -1.94 0.19 116.42 120.14 1jvn h ASP 250 Ca -0.21 0.16 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 1jvn h ASP 250 Cb 0.85 0.24 0.00 0.00 0.18 0.00 0.00 39.33 40.60 1jvn h ASP 250 CO 0.26 -0.08 0.00 0.00 -3.12 0.00 0.00 179.24 176.29 1jvn n GLN 251 N -5.21 0.88 -1.00 3.56 6.02 -1.26 -4.85 117.38 115.51 1jvn n GLN 251 Ca 0.14 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 57.13 1jvn n GLN 251 Cb 0.48 -1.31 -0.00 0.00 1.02 0.00 0.00 30.24 30.43 1jvn n GLN 251 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1jvn n GLY 252 N 0.61 0.46 3.90 1.08 0.00 0.66 -5.03 105.19 106.87 1jvn n GLY 252 Ca 0.13 -0.07 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 1jvn n GLY 252 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1jvn s ASP 253 N -2.07 5.75 -0.21 1.61 1.11 -1.26 -4.72 116.67 116.88 1jvn s ASP 253 Ca 0.00 0.89 -0.15 0.00 0.18 0.00 0.00 52.55 53.48 1jvn s ASP 253 Cb 0.00 -1.92 -0.04 0.00 1.07 0.00 0.00 42.92 42.03 1jvn s ASP 253 CO 0.00 -1.00 0.36 -0.76 1.18 0.00 0.00 175.17 174.94 1jvn s LEU 254 N -5.03 4.15 0.30 1.23 1.02 -1.26 -0.44 118.68 118.65 1jvn s LEU 254 Ca 0.54 0.45 0.03 0.00 0.02 0.00 0.00 54.13 55.16 1jvn s LEU 254 Cb -0.11 -2.44 -0.06 0.00 0.02 0.00 0.00 46.19 43.60 1jvn s LEU 254 CO 0.47 -0.05 0.08 0.68 0.02 0.00 0.00 176.35 177.55 1jvn s VAL 255 N 1.25 0.89 -0.14 -1.59 -7.23 0.15 -4.41 120.40 109.32 1jvn s VAL 255 Ca 0.17 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.43 1jvn s VAL 255 Cb -0.14 -2.72 -0.15 0.00 0.56 0.00 0.00 36.38 33.93 1jvn s VAL 255 CO 0.07 0.00 -0.01 0.52 -0.31 0.00 0.00 175.10 175.37 1jvn n VAL 256 N -0.59 0.93 -4.20 1.32 0.31 -1.26 -0.15 118.33 114.69 1jvn n VAL 256 Ca -0.01 -0.51 -0.36 0.00 -0.01 0.00 0.00 64.34 63.45 1jvn n VAL 256 Cb 0.66 -0.78 -0.08 0.00 -0.91 0.00 0.00 33.84 32.74 1jvn n VAL 256 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1jvn s THR 257 N -2.33 4.73 0.60 2.52 2.01 -1.26 -4.60 115.64 117.31 1jvn s THR 257 Ca -0.11 -0.09 0.28 0.00 0.31 0.00 0.00 61.69 62.08 1jvn s THR 257 Cb 0.04 -3.02 0.37 0.00 0.01 0.00 0.00 72.50 69.91 1jvn s THR 257 CO 0.50 0.61 1.73 0.50 -0.69 0.00 0.00 174.62 177.27 1jvn h LYS 259 N 5.15 0.00 -0.23 4.92 3.64 -2.00 -2.98 116.57 125.07 1jvn h LYS 259 Ca -0.52 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 58.69 1jvn h LYS 259 Cb 1.20 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 32.87 1jvn h LYS 259 CO 0.56 0.00 -0.64 0.41 -2.27 0.00 0.00 179.45 177.51 1jvn n GLY 260 N -1.54 5.18 0.00 5.01 0.00 -1.26 -5.02 105.19 107.57 1jvn n GLY 260 Ca 0.11 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.46 1jvn n GLY 260 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jvn n ASP 261 N -0.89 0.00 -1.00 1.61 8.00 -1.13 -5.16 116.55 117.98 1jvn n ASP 261 Ca 0.25 0.00 0.10 0.00 0.71 0.00 0.00 54.79 55.86 1jvn n ASP 261 Cb 0.80 0.00 0.27 0.00 -0.02 0.00 0.00 41.12 42.17 1jvn n ASP 261 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jvn n LEU 276 N 0.00 2.94 -0.14 0.64 -0.00 -1.26 -5.00 117.00 114.19 1jvn n LEU 276 Ca 0.00 -1.36 -0.01 0.00 -0.00 0.00 0.00 56.01 54.64 1jvn n LEU 276 Cb 0.00 -0.29 0.25 0.00 -0.00 0.00 0.00 43.42 43.38 1jvn n LEU 276 CO 0.00 0.68 1.10 1.23 -0.00 0.00 0.00 177.39 180.40 1jvn h GLY 277 N 4.73 0.89 0.09 1.47 0.00 -2.00 -3.21 103.07 105.04 1jvn h GLY 277 Ca 0.00 -0.42 0.01 0.00 0.00 0.00 0.00 47.33 46.92 1jvn h GLY 277 CO 0.00 0.40 -0.37 0.50 0.00 0.00 0.00 176.54 177.07 1jvn h LYS 278 N 0.83 -0.51 -0.59 4.80 1.57 -1.99 0.43 116.57 121.11 1jvn h LYS 278 Ca 0.21 0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.95 1jvn h LYS 278 Cb 0.10 0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 1jvn h LYS 278 CO -0.03 -0.34 0.09 -1.00 -0.57 0.00 0.00 179.45 177.61 1jvn h PRO 279 N -0.53 0.94 -0.21 3.15 0.13 -1.82 -0.22 132.00 133.45 1jvn h PRO 279 Ca -0.01 -0.23 0.03 0.00 -0.87 0.00 0.00 66.00 64.92 1jvn h PRO 279 Cb 0.53 -0.12 -0.03 0.00 0.13 0.00 0.00 31.00 31.51 1jvn h PRO 279 CO -0.20 0.87 0.02 0.28 -0.23 0.00 0.00 178.00 178.75 1jvn h VAL 280 N 0.89 0.88 -0.17 1.56 2.07 -1.50 0.97 116.25 120.96 1jvn h VAL 280 Ca 0.18 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.62 1jvn h VAL 280 Cb 0.39 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1jvn h VAL 280 CO 0.01 0.02 -0.14 1.56 0.02 0.00 0.00 177.57 179.03 1jvn h GLN 281 N 0.10 0.27 -0.09 1.57 4.20 0.17 -1.17 115.11 120.15 1jvn h GLN 281 Ca 0.10 -0.07 -0.19 0.00 0.06 0.00 0.00 58.65 58.55 1jvn h GLN 281 Cb 0.11 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.85 1jvn h GLN 281 CO -0.14 0.42 -0.73 1.25 -0.67 0.00 0.00 178.83 178.95 1jvn h LEU 282 N 0.25 0.54 -0.47 1.46 5.85 -0.56 -1.08 115.31 121.31 1jvn h LEU 282 Ca 0.05 -0.35 -0.07 0.00 0.84 0.00 0.00 57.88 58.35 1jvn h LEU 282 Cb 0.41 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1jvn h LEU 282 CO 0.02 1.10 0.04 0.00 -0.34 0.00 0.00 178.44 179.26 1jvn h ALA 283 N 0.89 0.63 -0.61 1.25 0.00 -0.39 0.31 119.26 121.34 1jvn h ALA 283 Ca -0.03 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 1jvn h ALA 283 Cb 1.31 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1jvn h ALA 283 CO 0.13 0.39 0.08 1.96 0.00 0.00 0.00 179.25 181.81 1jvn h GLN 284 N 0.66 1.01 0.04 0.00 4.20 -1.15 -1.44 115.11 118.44 1jvn h GLN 284 Ca 0.14 -0.27 -0.00 0.00 0.06 0.00 0.00 58.65 58.58 1jvn h GLN 284 Cb 0.45 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.11 1jvn h GLN 284 CO 0.02 0.94 -0.02 -0.22 -0.67 0.00 0.00 178.83 178.88 1jvn h LYS 285 N 0.94 -0.06 -0.58 1.46 3.64 -0.86 -0.42 116.57 120.69 1jvn h LYS 285 Ca 0.19 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.67 1jvn h LYS 285 Cb 0.44 0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.19 1jvn h LYS 285 CO 0.01 0.10 0.15 1.88 -2.27 0.00 0.00 179.45 179.32 1jvn h TYR 286 N -0.20 0.24 -0.24 1.91 0.99 -0.72 0.17 116.97 119.10 1jvn h TYR 286 Ca -0.01 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.75 1jvn h TYR 286 Cb 0.18 -0.02 -0.01 0.00 1.00 0.00 0.00 36.73 37.88 1jvn h TYR 286 CO -0.03 0.00 0.12 -0.92 -0.00 0.00 0.00 178.16 177.34 1jvn h TYR 287 N 0.29 0.34 -0.13 4.88 3.20 -1.05 0.12 116.97 124.62 1jvn h TYR 287 Ca 0.30 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.12 1jvn h TYR 287 Cb 0.42 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 1jvn h TYR 287 CO -0.22 0.32 -0.10 1.96 -1.64 0.00 0.00 178.16 178.47 1jvn h GLN 288 N 0.27 0.19 -0.03 1.82 4.20 -0.37 -1.90 115.11 119.30 1jvn h GLN 288 Ca 0.08 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1jvn h GLN 288 Cb 0.10 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1jvn h GLN 288 CO -0.01 0.31 0.00 1.04 -0.67 0.00 0.00 178.83 179.50 1jvn n GLN 289 N -4.32 1.54 0.00 1.46 6.02 0.52 -4.92 117.38 117.68 1jvn n GLN 289 Ca -0.01 -0.78 0.00 0.00 -0.01 0.00 0.00 57.00 56.20 1jvn n GLN 289 Cb 0.24 -1.47 0.00 0.00 1.02 0.00 0.00 30.24 30.03 1jvn n GLN 289 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1jvn n GLY 290 N 1.13 1.30 3.72 1.08 0.00 -0.69 -1.82 105.19 109.92 1jvn n GLY 290 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1jvn n GLY 290 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jvn s ALA 291 N -2.00 3.76 -0.27 4.61 0.00 0.34 -4.79 121.76 123.41 1jvn s ALA 291 Ca 0.00 1.35 0.26 0.00 0.00 0.00 0.00 51.96 53.56 1jvn s ALA 291 Cb 0.00 -3.62 0.61 0.00 0.00 0.00 0.00 23.12 20.11 1jvn s ALA 291 CO 0.00 -0.79 1.71 -0.44 0.00 0.00 0.00 175.76 176.24 1jvn h ASP 292 N 6.89 0.00 -4.30 0.00 3.32 -1.62 -3.44 116.42 117.26 1jvn h ASP 292 Ca -0.43 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.58 1jvn h ASP 292 Cb 1.20 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.55 1jvn h ASP 292 CO 0.91 0.02 0.17 -0.70 -1.72 0.00 0.00 179.24 177.92 1jvn s GLU 293 N -3.33 0.90 -0.16 3.56 2.12 -1.22 -4.10 118.70 116.46 1jvn s GLU 293 Ca 0.05 0.73 0.01 0.00 0.36 0.00 0.00 54.97 56.13 1jvn s GLU 293 Cb 0.06 0.43 0.01 0.00 0.26 0.00 0.00 34.13 34.90 1jvn s GLU 293 CO 0.64 -0.17 -0.20 0.08 -0.54 0.00 0.00 175.26 175.07 1jvn s VAL 294 N -0.16 2.15 -0.14 3.70 1.01 -0.68 -0.87 120.40 125.40 1jvn s VAL 294 Ca -0.04 -0.93 -0.03 0.00 0.00 0.00 0.00 61.98 60.99 1jvn s VAL 294 Cb -0.03 -1.89 -0.02 0.00 0.00 0.00 0.00 36.38 34.43 1jvn s VAL 294 CO 0.04 0.54 -0.06 -0.89 0.00 0.00 0.00 175.10 174.73 1jvn s THR 295 N 1.08 3.71 -0.20 3.92 2.01 0.04 -0.98 115.64 125.22 1jvn s THR 295 Ca -0.00 -0.43 -0.05 0.00 0.31 0.00 0.00 61.69 61.52 1jvn s THR 295 Cb -0.14 -2.61 -0.02 0.00 0.01 0.00 0.00 72.50 69.74 1jvn s THR 295 CO -0.07 0.51 -0.00 -0.36 -0.69 0.00 0.00 174.62 174.00 1jvn s PHE 296 N 0.28 3.03 -0.63 4.92 0.40 0.72 -0.99 117.98 125.71 1jvn s PHE 296 Ca -0.05 -0.47 -0.16 0.00 -0.60 0.00 0.00 56.93 55.65 1jvn s PHE 296 Cb -0.14 -2.08 0.15 0.00 0.51 0.00 0.00 43.02 41.46 1jvn s PHE 296 CO 0.03 -0.25 0.61 -0.51 0.70 0.00 0.00 175.22 175.80 1jvn s LEU 297 N 1.00 6.26 -0.42 -0.37 1.02 0.30 -0.44 118.68 126.03 1jvn s LEU 297 Ca 0.02 -2.01 -0.28 0.00 0.02 0.00 0.00 54.13 51.87 1jvn s LEU 297 Cb -0.14 -2.22 -0.00 0.00 0.02 0.00 0.00 46.19 43.84 1jvn s LEU 297 CO 0.02 -0.81 1.57 0.21 0.02 0.00 0.00 176.35 177.36 1jvn s ASN 298 N 3.20 6.09 -0.28 2.29 3.04 0.17 -1.04 114.94 128.41 1jvn s ASN 298 Ca 0.08 0.89 0.14 0.00 0.04 0.00 0.00 52.86 54.01 1jvn s ASN 298 Cb -0.23 -2.54 0.48 0.00 -1.54 0.00 0.00 41.25 37.42 1jvn s ASN 298 CO -0.00 -1.63 1.16 2.30 -3.04 0.00 0.00 177.10 175.89 1jvn n ILE 299 N 7.18 2.02 -1.05 -5.21 -5.35 -0.36 -4.45 119.36 112.14 1jvn n ILE 299 Ca 0.18 -3.69 0.00 0.00 -0.27 0.00 0.00 62.75 58.97 1jvn n ILE 299 Cb 0.48 -0.14 0.00 0.00 -1.74 0.00 0.00 39.64 38.24 1jvn n ILE 299 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1jvn n THR 300 N -0.66 0.00 0.00 7.28 -2.24 -1.18 -4.38 114.28 113.10 1jvn n THR 300 Ca 0.29 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.07 1jvn n THR 300 Cb 0.90 -0.92 0.00 0.00 -2.10 0.00 0.00 70.33 68.21 1jvn n THR 300 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1jvn n ASP 304 N 0.00 0.00 -4.36 3.42 8.00 -1.26 -5.00 116.55 117.35 1jvn n ASP 304 Ca 0.00 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.13 1jvn n ASP 304 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 40.97 1jvn n ASP 304 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jvn n PRO 306 N 4.88 1.22 -0.19 0.00 -0.04 -1.26 -4.81 135.00 134.79 1jvn n PRO 306 Ca -0.15 0.46 -0.01 0.00 -0.04 0.00 0.00 63.50 63.76 1jvn n PRO 306 Cb 0.49 -2.37 0.07 0.00 -0.04 0.00 0.00 33.50 31.64 1jvn n PRO 306 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1jvn h LEU 307 N 0.84 -0.41 -1.35 1.53 5.85 -1.98 -1.15 115.31 118.65 1jvn h LEU 307 Ca -0.50 0.16 0.19 0.00 0.84 0.00 0.00 57.88 58.58 1jvn h LEU 307 Cb 1.34 0.31 -0.08 0.00 0.37 0.00 0.00 40.66 42.60 1jvn h LEU 307 CO 0.54 -0.15 0.60 0.11 -0.34 0.00 0.00 178.44 179.20 1jvn h LYS 308 N 0.05 0.53 -0.65 1.25 1.57 -2.04 -1.72 116.57 115.55 1jvn h LYS 308 Ca 0.29 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 1jvn h LYS 308 Cb 0.45 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1jvn h LYS 308 CO -0.55 0.35 0.00 -0.25 -0.57 0.00 0.00 179.45 178.43 1jvn n ASP 309 N -4.58 4.19 -4.66 0.86 8.00 -0.45 -4.97 116.55 114.93 1jvn n ASP 309 Ca 0.20 -2.30 -0.47 0.00 0.71 0.00 0.00 54.79 52.93 1jvn n ASP 309 Cb 0.64 -0.53 -0.04 0.00 -0.02 0.00 0.00 41.12 41.17 1jvn n ASP 309 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1jvn n THR 310 N 1.14 0.59 0.26 -3.53 -1.04 -0.65 -4.85 114.28 106.20 1jvn n THR 310 Ca 0.23 -0.14 0.15 0.00 -2.04 0.00 0.00 64.05 62.26 1jvn n THR 310 Cb 0.76 -1.98 0.85 0.00 -1.82 0.00 0.00 70.33 68.14 1jvn n THR 310 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1jvn h PRO 311 N 9.92 0.00 -0.29 -2.82 0.13 -1.92 -1.61 132.00 135.41 1jvn h PRO 311 Ca -0.48 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.62 1jvn h PRO 311 Cb 1.27 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.38 1jvn h PRO 311 CO 0.95 0.00 0.02 1.98 -0.23 0.00 0.00 178.00 180.72 1jvn h MET 312 N 0.00 0.44 -0.26 0.86 4.05 -1.99 -1.58 114.93 116.45 1jvn h MET 312 Ca 0.03 -0.08 -0.08 0.00 -0.28 0.00 0.00 59.70 59.30 1jvn h MET 312 Cb 0.16 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 1jvn h MET 312 CO -0.00 0.45 -0.16 -0.07 0.23 0.00 0.00 176.91 177.36 1jvn h LEU 313 N 0.42 0.45 -0.30 3.39 3.38 -1.66 -1.39 115.31 119.60 1jvn h LEU 313 Ca 0.10 -0.12 -0.20 0.00 0.09 0.00 0.00 57.88 57.74 1jvn h LEU 313 Cb 0.26 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1jvn h LEU 313 CO 0.00 0.63 -0.85 -0.08 0.09 0.00 0.00 178.44 178.24 1jvn h GLU 314 N 0.42 0.32 -0.33 1.13 4.57 -1.43 -0.96 114.58 118.29 1jvn h GLU 314 Ca 0.07 -0.31 -0.01 0.00 -1.18 0.00 0.00 59.36 57.93 1jvn h GLU 314 Cb 0.53 0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.19 1jvn h GLU 314 CO 0.03 1.00 0.17 0.28 -1.18 0.00 0.00 179.01 179.30 1jvn h VAL 315 N 0.19 1.16 -0.43 0.32 2.07 -0.90 0.16 116.25 118.83 1jvn h VAL 315 Ca -0.05 -0.44 -0.03 0.00 0.82 0.00 0.00 66.70 67.01 1jvn h VAL 315 Cb 1.46 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 1jvn h VAL 315 CO 0.14 0.16 0.16 -0.07 0.02 0.00 0.00 177.57 177.98 1jvn h LEU 316 N 0.41 0.59 -0.72 2.57 3.38 -1.20 0.74 115.31 121.08 1jvn h LEU 316 Ca 0.12 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 1jvn h LEU 316 Cb 0.11 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1jvn h LEU 316 CO -0.02 0.61 0.22 0.50 0.09 0.00 0.00 178.44 179.84 1jvn h LYS 317 N 0.54 1.13 -0.13 1.13 3.64 -0.47 0.18 116.57 122.60 1jvn h LYS 317 Ca 0.14 -0.25 -0.08 0.00 -1.27 0.00 0.00 60.65 59.19 1jvn h LYS 317 Cb 0.21 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1jvn h LYS 317 CO -0.01 0.97 -0.23 1.96 -2.27 0.00 0.00 179.45 179.87 1jvn h GLN 318 N 1.07 0.38 -0.73 1.90 1.08 -0.81 -3.20 115.11 114.80 1jvn h GLN 318 Ca 0.23 -0.24 0.04 0.00 -1.45 0.00 0.00 58.65 57.23 1jvn h GLN 318 Cb 0.32 0.03 -0.05 0.00 -0.05 0.00 0.00 27.48 27.73 1jvn h GLN 318 CO -0.01 0.83 0.46 0.00 -0.95 0.00 0.00 178.83 179.16 1jvn h ALA 319 N 0.55 0.97 0.00 3.87 0.00 -0.73 -1.91 119.26 122.00 1jvn h ALA 319 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1jvn h ALA 319 Cb 0.81 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1jvn h ALA 319 CO 0.05 0.23 0.00 0.00 0.00 0.00 0.00 179.25 179.53 1jvn n ALA 320 N -2.33 1.10 0.17 0.00 0.00 0.04 -1.08 120.51 118.42 1jvn n ALA 320 Ca 0.08 0.13 0.03 0.00 0.00 0.00 0.00 53.44 53.68 1jvn n ALA 320 Cb 0.10 -1.23 0.28 0.00 0.00 0.00 0.00 19.45 18.61 1jvn n ALA 320 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1jvn h LYS 321 N 0.00 0.00 0.00 0.00 1.57 -1.35 -3.39 116.57 113.40 1jvn h LYS 321 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1jvn h LYS 321 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1jvn h LYS 321 CO 0.00 0.46 -0.41 0.25 -0.57 0.00 0.00 179.45 179.17 1jvn n THR 322 N -3.67 0.00 -2.85 -0.16 -2.24 -0.97 -4.87 114.28 99.52 1jvn n THR 322 Ca -0.01 -0.01 -0.43 0.00 -2.27 0.00 0.00 64.05 61.33 1jvn n THR 322 Cb 0.54 0.27 -0.04 0.00 -2.10 0.00 0.00 70.33 68.99 1jvn n THR 322 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1jvn s VAL 323 N -0.85 4.34 -0.63 2.28 1.01 -0.24 -4.90 120.40 121.40 1jvn s VAL 323 Ca 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 61.98 61.78 1jvn s VAL 323 Cb 0.00 -4.64 0.27 0.00 0.00 0.00 0.00 36.38 32.01 1jvn s VAL 323 CO 0.00 -1.36 2.25 0.49 0.00 0.00 0.00 175.10 176.48 1jvn n PHE 324 N 7.66 2.45 -4.19 5.22 3.01 -1.26 -4.67 117.46 125.67 1jvn n PHE 324 Ca -0.02 -2.31 -0.11 0.00 1.01 0.00 0.00 57.45 56.02 1jvn n PHE 324 Cb 0.46 -1.27 -0.10 0.00 -0.01 0.00 0.00 39.48 38.56 1jvn n PHE 324 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 1jvn s VAL 325 N -3.86 0.50 0.36 -4.37 -7.23 -1.26 -0.44 120.40 104.09 1jvn s VAL 325 Ca 0.54 -1.93 -0.27 0.00 -1.81 0.00 0.00 61.98 58.50 1jvn s VAL 325 Cb 0.41 -1.94 -0.12 0.00 0.56 0.00 0.00 36.38 35.30 1jvn s VAL 325 CO -0.23 -0.62 1.27 -2.65 -0.31 0.00 0.00 175.10 172.55 1jvn n PRO 326 N -0.12 2.04 -4.63 4.82 -0.02 -1.26 -4.80 135.00 131.03 1jvn n PRO 326 Ca -0.08 0.72 -0.32 0.00 -2.02 0.00 0.00 63.50 61.79 1jvn n PRO 326 Cb 0.63 -2.31 -0.16 0.00 -0.02 0.00 0.00 33.50 31.63 1jvn n PRO 326 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1jvn s LEU 327 N -1.06 2.09 0.02 2.45 1.02 -1.26 -1.69 118.68 120.25 1jvn s LEU 327 Ca 0.57 -0.60 0.06 0.00 0.02 0.00 0.00 54.13 54.18 1jvn s LEU 327 Cb -0.56 -1.43 -0.03 0.00 0.02 0.00 0.00 46.19 44.19 1jvn s LEU 327 CO 0.61 0.07 -0.15 -0.89 0.02 0.00 0.00 176.35 176.02 1jvn s THR 328 N 0.85 3.04 -0.05 5.49 2.01 -0.16 0.66 115.64 127.48 1jvn s THR 328 Ca -0.06 -1.01 0.02 0.00 0.31 0.00 0.00 61.69 60.95 1jvn s THR 328 Cb -0.15 -2.28 0.01 0.00 0.01 0.00 0.00 72.50 70.09 1jvn s THR 328 CO -0.02 0.39 -0.11 0.54 -0.69 0.00 0.00 174.62 174.73 1jvn s VAL 329 N -0.91 1.02 -0.01 3.82 0.11 -0.78 -0.20 120.40 123.45 1jvn s VAL 329 Ca 0.15 -0.43 0.05 0.00 -2.93 0.00 0.00 61.98 58.82 1jvn s VAL 329 Cb -0.11 -0.93 -0.01 0.00 -1.53 0.00 0.00 36.38 33.80 1jvn s VAL 329 CO 0.05 0.32 -0.17 -0.83 -3.33 0.00 0.00 175.10 171.15 1jvn s GLY 330 N 0.55 0.83 0.00 6.54 0.00 0.42 -0.53 107.32 115.12 1jvn s GLY 330 Ca -0.11 -0.73 0.00 0.00 0.00 0.00 0.00 44.72 43.87 1jvn s GLY 330 CO 0.03 -0.62 0.00 0.61 0.00 0.00 0.00 173.10 173.12 1jvn n GLY 331 N 2.62 1.95 2.07 0.20 0.00 -1.25 0.43 105.19 111.21 1jvn n GLY 331 Ca -0.15 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.63 1jvn n GLY 331 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jvn n GLY 332 N 2.32 1.07 3.46 -0.02 0.00 -1.26 -4.69 105.19 106.06 1jvn n GLY 332 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1jvn n GLY 332 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jvn s ILE 333 N -3.25 4.71 0.38 -0.61 -1.09 -1.26 -4.89 121.20 115.18 1jvn s ILE 333 Ca 0.00 -1.70 -0.15 0.00 -2.23 0.00 0.00 60.65 56.57 1jvn s ILE 333 Cb 0.00 -4.83 0.06 0.00 -1.58 0.00 0.00 42.46 36.11 1jvn s ILE 333 CO 0.00 -1.57 0.79 2.29 -1.23 0.00 0.00 174.94 175.22 1jvn n LYS 334 N 6.61 1.10 -2.34 2.79 2.85 -1.26 -4.89 118.16 123.01 1jvn n LYS 334 Ca 0.27 -2.16 -0.42 0.00 -1.05 0.00 0.00 58.31 54.96 1jvn n LYS 334 Cb 0.48 2.70 -0.03 0.00 -0.65 0.00 0.00 35.03 37.53 1jvn n LYS 334 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1jvn s ASP 335 N -3.04 6.97 0.16 -5.58 1.01 -1.26 -3.67 116.67 111.26 1jvn s ASP 335 Ca 0.16 2.01 0.06 0.00 0.71 0.00 0.00 52.55 55.49 1jvn s ASP 335 Cb -0.05 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 1jvn s ASP 335 CO 0.11 -0.61 -0.12 0.27 0.21 0.00 0.00 175.17 175.04 1jvn s ILE 336 N 1.88 1.35 -0.33 0.77 -4.36 0.14 -4.91 121.20 115.74 1jvn s ILE 336 Ca 0.60 -2.02 -0.08 0.00 -0.26 0.00 0.00 60.65 58.89 1jvn s ILE 336 Cb -0.29 -1.82 0.02 0.00 1.25 0.00 0.00 42.46 41.62 1jvn s ILE 336 CO 0.26 -0.63 0.12 -0.69 0.24 0.00 0.00 174.94 174.24 1jvn s VAL 337 N -2.96 4.05 0.84 8.37 1.01 -1.26 -0.12 120.40 130.33 1jvn s VAL 337 Ca 0.16 -0.89 -0.11 0.00 0.00 0.00 0.00 61.98 61.15 1jvn s VAL 337 Cb -0.00 -3.20 0.10 0.00 0.00 0.00 0.00 36.38 33.27 1jvn s VAL 337 CO 0.03 -0.09 1.09 -0.62 0.00 0.00 0.00 175.10 175.52 1jvn s ASP 338 N 1.48 3.87 0.45 3.32 -1.08 0.12 -4.79 116.67 120.03 1jvn s ASP 338 Ca 0.01 1.72 0.25 0.00 -0.52 0.00 0.00 52.55 54.02 1jvn s ASP 338 Cb -0.18 -2.39 1.28 0.00 -1.46 0.00 0.00 42.92 40.17 1jvn s ASP 338 CO 0.04 -2.42 1.77 0.58 0.52 0.00 0.00 175.17 175.65 1jvn h VAL 339 N -1.40 0.45 -0.29 1.11 2.07 -1.88 0.96 116.25 117.27 1jvn h VAL 339 Ca -0.46 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1jvn h VAL 339 Cb 1.26 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1jvn h VAL 339 CO 0.52 0.04 0.00 -0.90 0.02 0.00 0.00 177.57 177.25 1jvn n ASP 340 N -4.49 1.71 0.00 0.57 5.68 -1.26 -4.90 116.55 113.85 1jvn n ASP 340 Ca 0.26 -1.92 0.00 0.00 -0.50 0.00 0.00 54.79 52.63 1jvn n ASP 340 Cb 1.05 -0.19 0.00 0.00 -1.14 0.00 0.00 41.12 40.84 1jvn n ASP 340 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1jvn n GLY 341 N 1.04 1.25 3.71 6.12 0.00 0.33 -5.02 105.19 112.63 1jvn n GLY 341 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1jvn n GLY 341 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jvn s THR 342 N -3.26 3.05 -0.50 2.61 2.01 -1.25 -4.62 115.64 113.69 1jvn s THR 342 Ca 0.00 0.68 -0.28 0.00 0.31 0.00 0.00 61.69 62.40 1jvn s THR 342 Cb 0.00 -3.44 0.03 0.00 0.01 0.00 0.00 72.50 69.10 1jvn s THR 342 CO 0.00 0.03 1.09 -0.54 -0.69 0.00 0.00 174.62 174.52 1jvn s LYS 343 N 1.62 3.63 -0.43 4.92 1.02 -1.26 0.10 119.74 129.34 1jvn s LYS 343 Ca 0.69 0.38 -0.08 0.00 0.02 0.00 0.00 55.97 56.98 1jvn s LYS 343 Cb -0.39 -3.94 0.09 0.00 -0.52 0.00 0.00 37.83 33.07 1jvn s LYS 343 CO 0.31 -1.40 0.26 0.42 -0.92 0.00 0.00 175.35 174.01 1jvn s ILE 344 N 4.36 3.98 0.78 2.17 1.01 0.83 -5.00 121.20 129.33 1jvn s ILE 344 Ca 0.44 -1.63 -0.12 0.00 0.00 0.00 0.00 60.65 59.34 1jvn s ILE 344 Cb -0.08 -3.53 0.06 0.00 0.01 0.00 0.00 42.46 38.92 1jvn s ILE 344 CO 0.29 -0.60 1.12 -2.16 0.00 0.00 0.00 174.94 173.60 1jvn s PRO 345 N 1.34 2.07 0.31 2.79 0.04 -1.26 0.27 135.00 140.57 1jvn s PRO 345 Ca 0.04 1.37 0.07 0.00 0.04 0.00 0.00 61.00 62.52 1jvn s PRO 345 Cb -0.24 -1.86 0.78 0.00 0.04 0.00 0.00 34.50 33.22 1jvn s PRO 345 CO -0.00 -1.81 1.76 0.00 0.04 0.00 0.00 177.00 176.99 1jvn h ALA 346 N -0.96 1.69 -0.39 8.56 0.00 -1.91 -1.29 119.26 124.96 1jvn h ALA 346 Ca -0.45 0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.60 1jvn h ALA 346 Cb 1.25 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.96 1jvn h ALA 346 CO 0.49 -0.13 0.17 1.25 0.00 0.00 0.00 179.25 181.04 1jvn h LEU 347 N 0.69 0.23 -0.77 0.00 5.85 -1.90 0.16 115.31 119.57 1jvn h LEU 347 Ca 0.60 0.03 -0.12 0.00 0.84 0.00 0.00 57.88 59.23 1jvn h LEU 347 Cb 1.01 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 1jvn h LEU 347 CO -0.42 0.17 -0.34 -0.33 -0.34 0.00 0.00 178.44 177.18 1jvn h GLU 348 N 0.36 0.54 -0.38 1.25 5.08 -1.62 0.51 114.58 120.32 1jvn h GLU 348 Ca 0.17 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 1jvn h GLU 348 Cb 0.11 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1jvn h GLU 348 CO -0.15 0.81 -0.01 0.28 -1.00 0.00 0.00 179.01 178.95 1jvn h VAL 349 N 0.46 1.26 -0.64 3.13 2.07 -0.86 -2.06 116.25 119.61 1jvn h VAL 349 Ca 0.05 -1.01 -0.06 0.00 0.82 0.00 0.00 66.70 66.50 1jvn h VAL 349 Cb 0.82 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 1jvn h VAL 349 CO 0.07 0.34 0.16 0.00 0.02 0.00 0.00 177.57 178.16 1jvn h ALA 350 N 0.87 0.84 -0.59 1.67 0.00 -0.51 -2.42 119.26 119.12 1jvn h ALA 350 Ca 0.11 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1jvn h ALA 350 Cb 0.48 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1jvn h ALA 350 CO 0.02 0.55 0.39 0.77 0.00 0.00 0.00 179.25 180.98 1jvn h SER 351 N 0.94 0.68 -0.18 0.00 0.02 -0.72 0.54 113.55 114.83 1jvn h SER 351 Ca 0.20 -0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.07 1jvn h SER 351 Cb 0.35 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.72 1jvn h SER 351 CO 0.00 0.49 -0.13 0.25 -1.14 0.00 0.00 176.83 176.30 1jvn h LEU 352 N 0.80 0.43 -0.80 5.07 5.85 -1.02 -1.41 115.31 124.22 1jvn h LEU 352 Ca 0.22 -0.44 -0.02 0.00 0.84 0.00 0.00 57.88 58.47 1jvn h LEU 352 Cb -0.09 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.78 1jvn h LEU 352 CO -0.05 0.79 0.42 1.88 -0.34 0.00 0.00 178.44 181.14 1jvn h TYR 353 N 0.09 1.12 -0.20 1.25 -1.99 -0.95 -1.16 116.97 115.13 1jvn h TYR 353 Ca 0.04 -0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 1jvn h TYR 353 Cb 0.64 -0.36 -0.01 0.00 2.00 0.00 0.00 36.73 39.01 1jvn h TYR 353 CO 0.07 0.80 0.10 0.74 -0.00 0.00 0.00 178.16 179.87 1jvn h PHE 354 N 1.12 0.29 0.00 4.88 0.05 -0.84 -0.83 116.94 121.61 1jvn h PHE 354 Ca 0.28 -0.01 -0.00 0.00 3.82 0.00 0.00 57.97 62.06 1jvn h PHE 354 Cb 0.06 -0.09 -0.00 0.00 2.00 0.00 0.00 35.95 37.92 1jvn h PHE 354 CO 0.01 0.30 -0.00 0.00 -0.18 0.00 0.00 178.31 178.43 1jvn h ARG 355 N 0.20 0.00 -0.00 1.51 3.08 -1.00 -1.40 114.38 116.78 1jvn h ARG 355 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1jvn h ARG 355 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1jvn h ARG 355 CO -0.01 0.00 -0.34 0.43 -1.07 0.00 0.00 179.97 178.99 1jvn n SER 356 N -3.10 0.39 0.00 7.04 7.64 -0.46 -4.64 113.62 120.49 1jvn n SER 356 Ca -0.01 -0.09 0.00 0.00 1.01 0.00 0.00 58.87 59.78 1jvn n SER 356 Cb 0.21 0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.44 1jvn n SER 356 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jvn n GLY 357 N 1.48 0.81 3.81 0.23 0.00 -0.54 -1.91 105.19 109.07 1jvn n GLY 357 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 1jvn n GLY 357 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jvn s ALA 358 N -1.21 2.97 -0.06 4.61 0.00 -0.37 -4.66 121.76 123.06 1jvn s ALA 358 Ca 0.00 0.49 0.07 0.00 0.00 0.00 0.00 51.96 52.53 1jvn s ALA 358 Cb 0.00 -3.19 -0.11 0.00 0.00 0.00 0.00 23.12 19.82 1jvn s ALA 358 CO 0.00 -0.06 0.08 -0.25 0.00 0.00 0.00 175.76 175.53 1jvn n ASP 359 N -0.74 3.06 -3.89 0.00 8.00 0.21 -4.27 116.55 118.92 1jvn n ASP 359 Ca 0.08 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.47 1jvn n ASP 359 Cb 0.53 0.92 -0.11 0.00 -0.02 0.00 0.00 41.12 42.44 1jvn n ASP 359 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1jvn s LYS 360 N -2.32 0.32 -0.01 -1.24 1.02 -1.05 -4.67 119.74 111.79 1jvn s LYS 360 Ca -0.04 -0.31 0.06 0.00 0.02 0.00 0.00 55.97 55.71 1jvn s LYS 360 Cb 0.03 0.13 -0.03 0.00 -0.52 0.00 0.00 37.83 37.45 1jvn s LYS 360 CO 0.33 -0.06 -0.19 0.14 -0.92 0.00 0.00 175.35 174.64 1jvn s VAL 361 N -0.98 2.64 -0.18 3.17 -7.23 -0.53 -1.86 120.40 115.43 1jvn s VAL 361 Ca -0.11 -1.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.98 1jvn s VAL 361 Cb -0.06 -2.02 -0.04 0.00 0.56 0.00 0.00 36.38 34.81 1jvn s VAL 361 CO 0.00 0.51 0.09 -0.55 -0.31 0.00 0.00 175.10 174.84 1jvn s SER 362 N -0.92 5.88 -0.19 4.85 0.15 0.31 -1.41 113.70 122.37 1jvn s SER 362 Ca 0.12 0.16 -0.05 0.00 0.70 0.00 0.00 55.95 56.88 1jvn s SER 362 Cb -0.10 -2.00 -0.03 0.00 -1.71 0.00 0.00 66.02 62.18 1jvn s SER 362 CO 0.01 0.20 0.00 -0.63 1.20 0.00 0.00 173.24 174.03 1jvn s ILE 363 N 0.25 4.06 0.00 6.45 -1.09 0.75 -3.84 121.20 127.78 1jvn s ILE 363 Ca 0.06 -0.28 0.00 0.00 -2.23 0.00 0.00 60.65 58.20 1jvn s ILE 363 Cb -0.12 -2.83 0.00 0.00 -1.58 0.00 0.00 42.46 37.93 1jvn s ILE 363 CO -0.00 0.44 0.00 0.61 -1.23 0.00 0.00 174.94 174.75 1jvn n GLY 364 N 4.07 0.11 0.22 6.18 0.00 -1.26 -0.82 105.19 113.69 1jvn n GLY 364 Ca -0.17 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.84 1jvn n GLY 364 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1jvn h THR 365 N 0.00 0.73 0.00 2.61 2.02 -1.90 -2.10 112.91 114.26 1jvn h THR 365 Ca 0.00 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.07 1jvn h THR 365 Cb 0.00 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 66.79 1jvn h THR 365 CO 0.00 0.06 0.00 0.44 0.37 0.00 0.00 175.52 176.39 1jvn h ASP 366 N 0.32 0.00 -0.28 4.18 5.19 -1.94 -2.26 116.42 121.62 1jvn h ASP 366 Ca 0.29 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 56.57 1jvn h ASP 366 Cb 0.38 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.88 1jvn h ASP 366 CO -0.33 0.00 -0.29 0.00 -3.12 0.00 0.00 179.24 175.50 1jvn h ALA 367 N 2.01 0.79 -0.31 3.45 0.00 -1.64 0.15 119.26 123.69 1jvn h ALA 367 Ca 0.00 -0.41 -0.08 0.00 0.00 0.00 0.00 54.91 54.42 1jvn h ALA 367 Cb 0.26 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1jvn h ALA 367 CO 0.00 0.65 -0.13 0.28 0.00 0.00 0.00 179.25 180.04 1jvn h VAL 368 N 0.67 1.29 -0.53 0.00 2.07 -1.45 -0.88 116.25 117.42 1jvn h VAL 368 Ca 0.08 -1.23 -0.03 0.00 0.82 0.00 0.00 66.70 66.34 1jvn h VAL 368 Cb 0.83 1.43 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 1jvn h VAL 368 CO 0.07 0.39 0.22 1.88 0.02 0.00 0.00 177.57 180.15 1jvn h TYR 369 N 0.40 0.81 -0.82 1.57 0.99 -1.38 -0.79 116.97 117.76 1jvn h TYR 369 Ca 0.07 -0.06 -0.03 0.00 2.00 0.00 0.00 58.73 60.71 1jvn h TYR 369 Cb 0.65 -0.24 -0.04 0.00 1.00 0.00 0.00 36.73 38.10 1jvn h TYR 369 CO 0.06 0.66 0.37 0.00 -0.00 0.00 0.00 178.16 179.25 1jvn h ALA 370 N 1.06 1.06 -0.41 3.88 0.00 -0.59 -0.93 119.26 123.32 1jvn h ALA 370 Ca 0.18 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 1jvn h ALA 370 Cb 0.19 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1jvn h ALA 370 CO -0.02 0.64 -0.23 0.00 0.00 0.00 0.00 179.25 179.64 1jvn h ALA 371 N 1.20 0.59 -0.57 0.00 0.00 -0.93 -0.35 119.26 119.20 1jvn h ALA 371 Ca 0.28 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1jvn h ALA 371 Cb 0.15 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1jvn h ALA 371 CO -0.03 0.58 0.30 0.93 0.00 0.00 0.00 179.25 181.03 1jvn h GLU 372 N 0.71 0.80 -0.55 0.00 5.08 -0.84 -2.27 114.58 117.52 1jvn h GLU 372 Ca 0.09 -0.10 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 1jvn h GLU 372 Cb 0.81 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.89 1jvn h GLU 372 CO 0.07 0.63 -0.08 -0.22 -1.00 0.00 0.00 179.01 178.40 1jvn h LYS 373 N 0.77 1.03 -0.25 2.33 3.64 -1.10 -2.59 116.57 120.39 1jvn h LYS 373 Ca 0.20 -0.37 0.06 0.00 -1.27 0.00 0.00 60.65 59.27 1jvn h LYS 373 Cb 0.07 -0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 31.76 1jvn h LYS 373 CO -0.03 1.06 -0.18 -0.92 -2.27 0.00 0.00 179.45 177.10 1jvn h TYR 374 N 0.90 -0.47 0.00 1.91 3.20 -0.64 -0.14 116.97 121.74 1jvn h TYR 374 Ca 0.14 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.97 1jvn h TYR 374 Cb 0.65 0.25 -0.01 0.00 1.54 0.00 0.00 36.73 39.16 1jvn h TYR 374 CO 0.05 -0.26 -0.37 1.88 -1.64 0.00 0.00 178.16 177.82 1jvn h TYR 375 N -0.17 0.00 -0.35 -3.82 -1.99 -1.38 -0.46 116.97 108.80 1jvn h TYR 375 Ca 0.14 0.00 -0.13 0.00 2.00 0.00 0.00 58.73 60.74 1jvn h TYR 375 Cb 0.39 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.11 1jvn h TYR 375 CO -0.35 0.37 -0.27 0.93 -0.00 0.00 0.00 178.16 178.83 1jvn h GLU 376 N 0.00 0.80 0.00 4.88 5.08 -0.93 -2.81 114.58 121.61 1jvn h GLU 376 Ca -0.00 -0.40 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 1jvn h GLU 376 Cb 0.75 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1jvn h GLU 376 CO 0.05 1.03 0.00 1.28 -1.00 0.00 0.00 179.01 180.36 1jvn n LEU 377 N -4.21 0.00 -1.55 1.33 4.77 -0.15 -4.85 117.00 112.34 1jvn n LEU 377 Ca -0.03 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.91 1jvn n LEU 377 Cb 0.47 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.58 1jvn n LEU 377 CO 0.46 0.00 0.03 0.61 -1.33 0.00 0.00 177.39 177.16 1jvn n GLY 378 N 0.36 0.30 3.01 -0.72 0.00 -1.06 -4.15 105.19 102.92 1jvn n GLY 378 Ca 0.01 -0.35 -0.13 0.00 0.00 0.00 0.00 46.02 45.54 1jvn n GLY 378 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jvn n ASN 379 N -1.20 -4.28 -3.68 1.61 3.02 -0.25 -5.01 115.26 105.46 1jvn n ASN 379 Ca -0.06 -0.57 -0.13 0.00 -0.03 0.00 0.00 54.58 53.80 1jvn n ASN 379 Cb 0.54 -4.45 -0.07 0.00 -0.61 0.00 0.00 39.78 35.19 1jvn n ASN 379 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1jvn s ARG 380 N -4.59 0.89 -0.02 3.52 1.81 -0.77 -5.01 118.95 114.79 1jvn s ARG 380 Ca 0.22 -0.38 0.02 0.00 -1.72 0.00 0.00 55.73 53.88 1jvn s ARG 380 Cb -0.03 0.40 -0.03 0.00 -0.45 0.00 0.00 34.95 34.83 1jvn s ARG 380 CO 0.62 -0.30 -0.05 0.20 -0.68 0.00 0.00 175.30 175.09 1jvn s GLY 381 N -1.99 1.77 0.00 -3.53 0.00 -1.26 -4.10 107.32 98.22 1jvn s GLY 381 Ca -0.06 -0.97 0.24 0.00 0.00 0.00 0.00 44.72 43.93 1jvn s GLY 381 CO -0.02 -0.81 1.40 2.09 0.00 0.00 0.00 173.10 175.76 1jvn n ASP 382 N 1.69 2.88 -0.02 1.64 5.68 -1.26 -4.94 116.55 122.21 1jvn n ASP 382 Ca -0.16 -1.91 -0.00 0.00 -0.50 0.00 0.00 54.79 52.22 1jvn n ASP 382 Cb 0.53 -0.12 -0.00 0.00 -1.14 0.00 0.00 41.12 40.39 1jvn n ASP 382 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1jvn n GLY 383 N 1.37 0.47 0.35 6.12 0.00 -1.26 -4.91 105.19 107.33 1jvn n GLY 383 Ca 0.17 -0.24 0.10 0.00 0.00 0.00 0.00 46.02 46.04 1jvn n GLY 383 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jvn n THR 384 N -2.94 0.00 -2.85 2.61 -2.24 -1.26 -4.50 114.28 103.10 1jvn n THR 384 Ca -0.00 -0.24 -0.35 0.00 -2.27 0.00 0.00 64.05 61.19 1jvn n THR 384 Cb 0.03 1.18 -0.07 0.00 -2.10 0.00 0.00 70.33 69.38 1jvn n THR 384 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1jvn s SER 385 N -2.36 7.09 0.43 3.42 1.04 -1.26 -4.85 113.70 117.21 1jvn s SER 385 Ca 0.14 1.69 0.13 0.00 0.48 0.00 0.00 55.95 58.40 1jvn s SER 385 Cb 0.16 -2.53 1.00 0.00 0.10 0.00 0.00 66.02 64.74 1jvn s SER 385 CO 0.56 -0.21 1.98 -0.65 0.98 0.00 0.00 173.24 175.90 1jvn h PRO 386 N 2.53 0.43 -0.02 4.02 0.11 -1.94 0.29 132.00 137.42 1jvn h PRO 386 Ca -0.48 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 1jvn h PRO 386 Cb 1.18 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1jvn h PRO 386 CO 0.63 0.29 0.01 0.82 -0.21 0.00 0.00 178.00 179.54 1jvn h ILE 387 N 0.44 1.04 0.30 4.15 2.04 -1.91 -1.54 117.51 122.03 1jvn h ILE 387 Ca 0.28 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 66.02 1jvn h ILE 387 Cb 0.51 1.08 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1jvn h ILE 387 CO -0.08 0.03 -0.14 -0.33 0.00 0.00 0.00 178.15 177.63 1jvn h GLU 388 N -0.02 -0.38 -0.67 2.37 5.08 -0.75 -1.50 114.58 118.70 1jvn h GLU 388 Ca 0.01 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1jvn h GLU 388 Cb 0.04 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 1jvn h GLU 388 CO -0.00 -0.12 0.37 1.79 -1.00 0.00 0.00 179.01 180.05 1jvn h THR 389 N -0.61 1.21 -0.15 1.13 1.35 -0.62 -1.34 112.91 113.87 1jvn h THR 389 Ca -0.04 -0.51 -0.17 0.00 -0.55 0.00 0.00 66.41 65.13 1jvn h THR 389 Cb 0.44 0.33 0.01 0.00 -1.73 0.00 0.00 68.15 67.19 1jvn h THR 389 CO 0.07 0.23 -0.57 0.40 -0.25 0.00 0.00 175.52 175.39 1jvn h ILE 390 N 0.92 1.32 -0.13 6.82 2.04 -1.35 -3.13 117.51 124.00 1jvn h ILE 390 Ca 0.24 -1.83 -0.10 0.00 1.00 0.00 0.00 64.86 64.16 1jvn h ILE 390 Cb 0.03 2.03 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 1jvn h ILE 390 CO -0.04 0.57 -0.38 0.77 0.00 0.00 0.00 178.15 179.07 1jvn h SER 391 N 0.33 0.29 0.28 1.72 4.64 -1.18 0.11 113.55 119.75 1jvn h SER 391 Ca -0.03 -0.12 -0.10 0.00 -0.47 0.00 0.00 61.79 61.08 1jvn h SER 391 Cb 1.20 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 1jvn h SER 391 CO 0.12 0.65 -0.39 0.11 -0.87 0.00 0.00 176.83 176.45 1jvn h LYS 392 N 0.24 0.15 0.08 4.77 1.57 -1.30 0.59 116.57 122.68 1jvn h LYS 392 Ca 0.03 -0.07 -0.30 0.00 -1.87 0.00 0.00 60.65 58.44 1jvn h LYS 392 Cb 0.78 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.07 1jvn h LYS 392 CO 0.06 0.53 -1.61 0.00 -0.57 0.00 0.00 179.45 177.86 1jvn h ALA 393 N 1.47 0.31 -0.15 3.86 0.00 -1.45 -3.41 119.26 119.88 1jvn h ALA 393 Ca 0.01 -1.25 0.00 0.00 0.00 0.00 0.00 54.91 53.67 1jvn h ALA 393 Cb 0.76 0.65 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1jvn h ALA 393 CO 0.06 0.99 0.00 0.66 0.00 0.00 0.00 179.25 180.96 1jvn n TYR 394 N -3.90 0.19 0.00 0.00 4.02 0.38 -1.82 117.16 116.03 1jvn n TYR 394 Ca -0.30 -0.16 0.00 0.00 -0.01 0.00 0.00 57.90 57.43 1jvn n TYR 394 Cb 0.90 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 40.21 1jvn n TYR 394 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1jvn n GLY 395 N 0.79 -1.33 0.34 2.72 0.00 0.20 -3.99 105.19 103.91 1jvn n GLY 395 Ca 0.10 -1.56 0.09 0.00 0.00 0.00 0.00 46.02 44.66 1jvn n GLY 395 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jvn h ALA 396 N 0.00 1.93 0.00 4.61 0.00 -1.72 -2.13 119.26 121.95 1jvn h ALA 396 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1jvn h ALA 396 Cb 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1jvn h ALA 396 CO 0.00 -0.02 0.00 -0.56 0.00 0.00 0.00 179.25 178.67 1jvn h GLN 397 N 0.43 0.00 -0.01 0.00 -0.00 -1.86 -0.49 115.11 113.18 1jvn h GLN 397 Ca 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.88 1jvn h GLN 397 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.82 1jvn h GLN 397 CO -0.06 0.00 -0.31 0.00 -0.00 0.00 0.00 178.83 178.46 1jvn n ALA 398 N -2.00 3.19 -3.71 0.06 0.00 -0.80 -4.84 120.51 112.41 1jvn n ALA 398 Ca -0.03 -0.44 -0.33 0.00 0.00 0.00 0.00 53.44 52.64 1jvn n ALA 398 Cb 0.06 -1.08 -0.16 0.00 0.00 0.00 0.00 19.45 18.28 1jvn n ALA 398 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1jvn s VAL 399 N -2.52 2.27 -0.01 0.00 1.01 -0.50 -1.45 120.40 119.21 1jvn s VAL 399 Ca 0.23 -0.90 0.07 0.00 0.00 0.00 0.00 61.98 61.38 1jvn s VAL 399 Cb 0.19 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.61 1jvn s VAL 399 CO 0.54 0.53 -0.20 -0.69 0.00 0.00 0.00 175.10 175.28 1jvn s VAL 400 N 0.95 2.56 -0.23 2.92 1.01 -0.50 -1.33 120.40 125.79 1jvn s VAL 400 Ca -0.03 -1.04 -0.05 0.00 0.00 0.00 0.00 61.98 60.86 1jvn s VAL 400 Cb -0.15 -1.99 -0.01 0.00 0.00 0.00 0.00 36.38 34.23 1jvn s VAL 400 CO -0.04 0.50 -0.01 -0.63 0.00 0.00 0.00 175.10 174.92 1jvn s ILE 401 N -0.75 3.59 -0.33 2.22 -1.09 -0.27 -0.18 121.20 124.40 1jvn s ILE 401 Ca 0.12 -0.45 -0.20 0.00 -2.23 0.00 0.00 60.65 57.88 1jvn s ILE 401 Cb -0.10 -2.67 -0.00 0.00 -1.58 0.00 0.00 42.46 38.11 1jvn s ILE 401 CO 0.01 0.38 0.61 -0.55 -1.23 0.00 0.00 174.94 174.16 1jvn s SER 402 N 1.50 6.44 -0.15 3.58 0.15 -0.00 0.05 113.70 125.28 1jvn s SER 402 Ca 0.06 0.25 -0.04 0.00 0.70 0.00 0.00 55.95 56.92 1jvn s SER 402 Cb -0.15 -2.32 -0.03 0.00 -1.71 0.00 0.00 66.02 61.81 1jvn s SER 402 CO -0.02 -0.52 -0.00 -0.69 1.20 0.00 0.00 173.24 173.21 1jvn s VAL 403 N 2.62 4.22 -0.57 4.45 1.01 -0.68 -4.47 120.40 126.97 1jvn s VAL 403 Ca 0.24 -0.25 0.06 0.00 0.00 0.00 0.00 61.98 62.03 1jvn s VAL 403 Cb -0.15 -2.85 0.29 0.00 0.00 0.00 0.00 36.38 33.67 1jvn s VAL 403 CO 0.13 0.51 0.79 0.47 0.00 0.00 0.00 175.10 177.00 1jvn n ASP 404 N 3.23 3.42 -4.65 3.32 8.00 -1.26 -1.87 116.55 126.74 1jvn n ASP 404 Ca -0.17 -3.42 -0.29 0.00 0.71 0.00 0.00 54.79 51.62 1jvn n ASP 404 Cb 0.53 -0.63 0.12 0.00 -0.02 0.00 0.00 41.12 41.12 1jvn n ASP 404 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1jvn s PRO 405 N -2.67 1.45 -0.14 -0.24 0.04 -1.26 -3.42 135.00 128.76 1jvn s PRO 405 Ca 0.42 -0.02 -0.06 0.00 0.04 0.00 0.00 61.00 61.38 1jvn s PRO 405 Cb 0.21 -1.90 0.06 0.00 0.04 0.00 0.00 34.50 32.90 1jvn s PRO 405 CO -0.07 -1.93 0.32 0.21 0.04 0.00 0.00 177.00 175.57 1jvn s LYS 406 N -5.64 0.26 0.26 4.56 2.20 -0.02 -3.13 119.74 118.24 1jvn s LYS 406 Ca 0.66 0.70 -0.30 0.00 -0.36 0.00 0.00 55.97 56.67 1jvn s LYS 406 Cb -0.09 -0.03 -0.11 0.00 -1.51 0.00 0.00 37.83 36.09 1jvn s LYS 406 CO 0.51 -0.20 1.56 0.50 -0.36 0.00 0.00 175.35 177.36 1jvn s ARG 407 N 1.67 4.17 -0.15 4.03 3.52 -1.26 -0.35 118.95 130.57 1jvn s ARG 407 Ca -0.07 2.49 -0.01 0.00 -0.13 0.00 0.00 55.73 58.02 1jvn s ARG 407 Cb -0.10 -3.06 0.04 0.00 -1.56 0.00 0.00 34.95 30.27 1jvn s ARG 407 CO -0.10 -0.59 -0.05 0.08 -0.81 0.00 0.00 175.30 173.83 1jvn s VAL 408 N 0.18 1.04 0.25 7.11 1.01 0.97 -4.88 120.40 126.08 1jvn s VAL 408 Ca 0.64 -0.53 -0.23 0.00 0.00 0.00 0.00 61.98 61.86 1jvn s VAL 408 Cb -0.46 -1.19 -0.09 0.00 0.00 0.00 0.00 36.38 34.64 1jvn s VAL 408 CO 0.44 0.17 0.82 -0.31 0.00 0.00 0.00 175.10 176.22 1jvn s TYR 409 N 1.67 3.71 0.03 5.22 1.51 -1.26 -1.39 117.35 126.85 1jvn s TYR 409 Ca 0.02 1.59 -0.08 0.00 -1.01 0.00 0.00 57.07 57.59 1jvn s TYR 409 Cb -0.15 -2.77 -0.00 0.00 -0.11 0.00 0.00 41.96 38.93 1jvn s TYR 409 CO -0.08 0.32 0.15 0.14 -1.11 0.00 0.00 175.55 174.97 1jvn s VAL 410 N -1.49 0.11 0.14 0.71 -7.23 -0.44 -4.98 120.40 107.21 1jvn s VAL 410 Ca 0.45 -0.89 -0.13 0.00 -1.81 0.00 0.00 61.98 59.59 1jvn s VAL 410 Cb -0.19 -0.77 -0.00 0.00 0.56 0.00 0.00 36.38 35.98 1jvn s VAL 410 CO 0.23 -0.49 1.58 0.78 -0.31 0.00 0.00 175.10 176.89 1jvn h ASN 411 N 3.75 0.79 -5.28 4.85 -0.26 -1.95 -3.11 115.58 114.37 1jvn h ASN 411 Ca -0.32 -0.32 -0.12 0.00 -0.56 0.00 0.00 56.30 54.98 1jvn h ASN 411 Cb 1.19 -0.21 -0.07 0.00 -1.06 0.00 0.00 38.32 38.17 1jvn h ASN 411 CO 0.47 0.92 -0.05 -0.94 -1.06 0.00 0.00 177.43 176.76 1jvn s SER 412 N -6.32 0.27 0.54 5.81 1.04 -1.26 -4.49 113.70 109.29 1jvn s SER 412 Ca -0.13 -1.15 0.36 0.00 0.48 0.00 0.00 55.95 55.51 1jvn s SER 412 Cb 0.11 0.67 1.75 0.00 0.10 0.00 0.00 66.02 68.65 1jvn s SER 412 CO 0.81 -1.31 2.08 -0.61 0.98 0.00 0.00 173.24 175.19 1jvn h GLN 413 N 2.14 0.00 0.00 4.02 5.75 -1.91 -1.98 115.11 123.13 1jvn h GLN 413 Ca -0.28 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.18 1jvn h GLN 413 Cb 1.25 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.79 1jvn h GLN 413 CO 0.37 0.00 -0.22 0.00 -2.65 0.00 0.00 178.83 176.33 1jvn h ALA 414 N 2.03 1.13 0.00 3.38 0.00 -1.97 -2.94 119.26 120.90 1jvn h ALA 414 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1jvn h ALA 414 Cb 0.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1jvn h ALA 414 CO 0.00 0.28 0.00 -0.25 0.00 0.00 0.00 179.25 179.28 1jvn n ASP 415 N -3.55 0.17 -3.76 0.00 8.00 -0.74 -4.86 116.55 111.81 1jvn n ASP 415 Ca -0.01 0.52 -0.13 0.00 0.71 0.00 0.00 54.79 55.89 1jvn n ASP 415 Cb 0.37 -0.57 -0.08 0.00 -0.02 0.00 0.00 41.12 40.82 1jvn n ASP 415 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1jvn s THR 416 N -3.04 0.07 0.00 -3.53 -1.32 -1.11 -5.03 115.64 101.68 1jvn s THR 416 Ca 0.11 -0.56 0.15 0.00 -1.21 0.00 0.00 61.69 60.18 1jvn s THR 416 Cb 0.15 -0.75 0.04 0.00 -1.51 0.00 0.00 72.50 70.42 1jvn s THR 416 CO 0.45 -0.31 1.51 0.07 -2.21 0.00 0.00 174.62 174.14 1jvn h LYS 417 N 3.59 0.00 -7.01 7.08 2.10 -1.89 -3.46 116.57 116.98 1jvn h LYS 417 Ca -0.30 0.00 -0.46 0.00 -2.00 0.00 0.00 60.65 57.89 1jvn h LYS 417 Cb 1.19 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1jvn h LYS 417 CO 0.42 0.55 0.36 -0.80 -2.00 0.00 0.00 179.45 177.99 1jvn s ASN 418 N -6.51 6.86 0.13 7.07 0.01 -1.26 -5.00 114.94 116.24 1jvn s ASN 418 Ca 0.02 1.83 -0.31 0.00 -0.71 0.00 0.00 52.86 53.69 1jvn s ASN 418 Cb 0.09 -2.56 -0.09 0.00 0.41 0.00 0.00 41.25 39.10 1jvn s ASN 418 CO 0.74 -0.42 1.59 -0.75 -1.51 0.00 0.00 177.10 176.75 1jvn s LYS 419 N -2.84 4.22 0.37 -0.60 2.47 -1.26 -5.01 119.74 117.09 1jvn s LYS 419 Ca 0.60 2.33 0.08 0.00 -1.56 0.00 0.00 55.97 57.42 1jvn s LYS 419 Cb -0.15 -3.31 -0.06 0.00 -1.46 0.00 0.00 37.83 32.85 1jvn s LYS 419 CO 0.19 -0.64 0.02 0.14 0.16 0.00 0.00 175.35 175.23 1jvn s VAL 420 N 1.65 2.33 0.06 4.02 -7.23 -1.26 -4.62 120.40 115.35 1jvn s VAL 420 Ca 0.71 -1.97 0.00 0.00 -1.81 0.00 0.00 61.98 58.91 1jvn s VAL 420 Cb -0.42 -2.86 -0.04 0.00 0.56 0.00 0.00 36.38 33.62 1jvn s VAL 420 CO 0.31 -0.11 -0.04 0.72 -0.31 0.00 0.00 175.10 175.67 1jvn s PHE 421 N -2.60 0.64 -0.12 2.82 -0.12 -0.57 -4.95 117.98 113.07 1jvn s PHE 421 Ca 0.36 -0.95 -0.25 0.00 -0.05 0.00 0.00 56.93 56.03 1jvn s PHE 421 Cb 0.04 -0.42 -0.02 0.00 -0.63 0.00 0.00 43.02 41.99 1jvn s PHE 421 CO 0.19 -0.27 0.82 -2.00 -0.05 0.00 0.00 175.22 173.91 1jvn s GLU 422 N -3.59 4.37 0.10 1.99 2.12 -1.26 -1.80 118.70 120.63 1jvn s GLU 422 Ca 0.06 1.04 0.02 0.00 0.36 0.00 0.00 54.97 56.45 1jvn s GLU 422 Cb 0.05 -3.53 -0.04 0.00 0.26 0.00 0.00 34.13 30.87 1jvn s GLU 422 CO -0.07 -0.19 0.18 -0.08 -0.54 0.00 0.00 175.26 174.56 1jvn s THR 423 N 1.66 5.03 -0.26 -1.70 -1.32 -0.08 -5.00 115.64 113.98 1jvn s THR 423 Ca 0.40 -0.64 0.27 0.00 -1.21 0.00 0.00 61.69 60.50 1jvn s THR 423 Cb -0.17 -3.49 0.36 0.00 -1.51 0.00 0.00 72.50 67.68 1jvn s THR 423 CO 0.16 0.05 1.74 -0.08 -2.21 0.00 0.00 174.62 174.28 1jvn h GLU 424 N 2.84 0.00 -4.43 7.08 4.81 -1.97 -3.42 114.58 119.50 1jvn h GLU 424 Ca -0.47 0.00 -0.71 0.00 -0.13 0.00 0.00 59.36 58.05 1jvn h GLU 424 Cb 1.17 0.00 -0.31 0.00 0.63 0.00 0.00 28.75 30.25 1jvn h GLU 424 CO 0.70 0.00 -0.48 0.71 -0.73 0.00 0.00 179.01 179.21 1jvn s TYR 425 N -3.36 3.44 0.59 0.92 4.12 -1.26 -5.08 117.35 116.72 1jvn s TYR 425 Ca 0.05 -1.95 -0.20 0.00 0.02 0.00 0.00 57.07 55.00 1jvn s TYR 425 Cb 0.07 -3.18 -0.03 0.00 -1.52 0.00 0.00 41.96 37.30 1jvn s TYR 425 CO 0.62 -0.94 1.28 -2.14 0.02 0.00 0.00 175.55 174.40 1jvn s PRO 426 N 1.30 2.90 1.03 -1.71 0.02 -1.26 -4.93 135.00 132.35 1jvn s PRO 426 Ca 0.05 2.03 -0.17 0.00 0.02 0.00 0.00 61.00 62.93 1jvn s PRO 426 Cb -0.24 -2.01 0.25 0.00 0.02 0.00 0.00 34.50 32.52 1jvn s PRO 426 CO -0.01 -1.32 1.06 0.41 -0.33 0.00 0.00 177.00 176.81 1jvn n GLY 427 N 0.72 -2.32 0.27 0.52 0.00 0.14 -4.85 105.19 99.68 1jvn n GLY 427 Ca 0.13 -1.56 0.13 0.00 0.00 0.00 0.00 46.02 44.72 1jvn n GLY 427 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1jvn h PRO 428 N 0.00 0.00 -0.11 1.61 0.11 -1.95 -2.21 132.00 129.45 1jvn h PRO 428 Ca -0.38 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.72 1jvn h PRO 428 Cb 1.11 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1jvn h PRO 428 CO 0.25 0.10 -0.06 0.09 -0.21 0.00 0.00 178.00 178.18 1jvn n ASN 429 N -3.65 2.76 0.00 -2.05 3.02 -1.26 -4.94 115.26 109.14 1jvn n ASN 429 Ca -0.02 -3.21 0.00 0.00 -0.03 0.00 0.00 54.58 51.32 1jvn n ASN 429 Cb 0.22 -0.49 0.00 0.00 -0.61 0.00 0.00 39.78 38.89 1jvn n ASN 429 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jvn n GLY 430 N -1.10 0.72 3.68 7.41 0.00 -0.83 -5.02 105.19 110.05 1jvn n GLY 430 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 1jvn n GLY 430 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jvn n GLU 431 N -2.47 2.78 0.00 1.61 4.71 -1.26 -4.51 120.64 121.49 1jvn n GLU 431 Ca 0.00 1.01 0.12 0.00 -0.01 0.00 0.00 57.16 58.28 1jvn n GLU 431 Cb 0.00 -2.92 0.14 0.00 -1.01 0.00 0.00 31.44 27.65 1jvn n GLU 431 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1jvn n LYS 432 N 6.15 0.47 -4.39 3.49 5.02 -1.26 0.29 118.16 127.92 1jvn n LYS 432 Ca 0.19 -0.33 -0.27 0.00 -2.02 0.00 0.00 58.31 55.87 1jvn n LYS 432 Cb 0.38 -1.49 -0.12 0.00 -0.02 0.00 0.00 35.03 33.77 1jvn n LYS 432 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1jvn s TYR 433 N -2.76 2.24 0.09 2.13 1.51 -1.17 -0.90 117.35 118.48 1jvn s TYR 433 Ca 0.15 -0.38 -0.20 0.00 -1.01 0.00 0.00 57.07 55.63 1jvn s TYR 433 Cb 0.18 -1.17 0.05 0.00 -0.11 0.00 0.00 41.96 40.91 1jvn s TYR 433 CO 0.67 0.39 0.49 0.00 -1.11 0.00 0.00 175.55 176.00 1jvn s TRP 435 N -3.09 1.24 -0.30 0.00 1.48 -0.48 -1.52 118.94 116.26 1jvn s TRP 435 Ca -0.02 -0.90 -0.05 0.00 -1.06 0.00 0.00 56.10 54.08 1jvn s TRP 435 Cb 0.00 -0.68 0.03 0.00 -1.16 0.00 0.00 33.47 31.66 1jvn s TRP 435 CO -0.07 -0.07 0.05 0.71 -4.06 0.00 0.00 176.95 173.51 1jvn s TYR 436 N -3.50 3.19 0.08 1.66 1.51 -1.26 -0.02 117.35 119.01 1jvn s TYR 436 Ca 0.20 -1.41 -0.30 0.00 -1.01 0.00 0.00 57.07 54.55 1jvn s TYR 436 Cb 0.05 -2.20 -0.05 0.00 -0.11 0.00 0.00 41.96 39.65 1jvn s TYR 436 CO 0.02 -0.70 1.05 -1.14 -1.11 0.00 0.00 175.55 173.67 1jvn s GLN 437 N 1.39 4.57 0.10 -0.62 0.74 0.52 -0.40 119.66 125.96 1jvn s GLN 437 Ca -0.01 1.57 -0.18 0.00 0.05 0.00 0.00 55.36 56.79 1jvn s GLN 437 Cb -0.18 -3.37 -0.07 0.00 1.10 0.00 0.00 33.01 30.48 1jvn s GLN 437 CO 0.01 -0.01 0.58 0.00 -0.55 0.00 0.00 175.29 175.32 1jvn s THR 439 N -1.24 3.29 0.40 0.00 -4.23 -1.22 -0.26 115.64 112.38 1jvn s THR 439 Ca 0.32 -1.91 0.04 0.00 -1.18 0.00 0.00 61.69 58.97 1jvn s THR 439 Cb -0.18 -2.73 -0.02 0.00 1.34 0.00 0.00 72.50 70.90 1jvn s THR 439 CO 0.19 -0.32 0.15 0.27 -0.54 0.00 0.00 174.62 174.38 1jvn s ILE 440 N -2.21 0.49 -1.01 2.99 -4.36 0.11 -4.58 121.20 112.63 1jvn s ILE 440 Ca 0.30 -2.00 -0.15 0.00 -0.26 0.00 0.00 60.65 58.54 1jvn s ILE 440 Cb -0.07 -2.36 0.01 0.00 1.25 0.00 0.00 42.46 41.29 1jvn s ILE 440 CO 0.18 0.00 0.70 0.29 0.24 0.00 0.00 174.94 176.35 1jvn n LYS 441 N -0.87 -1.11 -2.72 0.37 5.02 -1.26 -1.89 118.16 115.70 1jvn n LYS 441 Ca -0.04 0.60 -0.19 0.00 -2.02 0.00 0.00 58.31 56.66 1jvn n LYS 441 Cb 0.65 -3.39 0.00 0.00 -0.02 0.00 0.00 35.03 32.27 1jvn n LYS 441 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1jvn n GLY 442 N -1.78 -0.50 2.05 0.72 0.00 -1.26 -1.91 105.19 102.51 1jvn n GLY 442 Ca -0.16 0.05 -0.00 0.00 0.00 0.00 0.00 46.02 45.91 1jvn n GLY 442 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jvn n GLY 443 N -1.10 0.47 0.13 -0.02 0.00 -0.79 -4.94 105.19 98.94 1jvn n GLY 443 Ca -0.15 -0.11 0.12 0.00 0.00 0.00 0.00 46.02 45.89 1jvn n GLY 443 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1jvn h ARG 444 N 0.85 0.00 -3.65 1.61 3.08 -1.02 -3.46 114.38 111.79 1jvn h ARG 444 Ca -0.00 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.72 1jvn h ARG 444 Cb 0.06 0.00 -0.34 0.00 0.08 0.00 0.00 29.97 29.77 1jvn h ARG 444 CO 0.00 0.00 -0.74 -2.00 -1.07 0.00 0.00 179.97 176.16 1jvn s GLU 445 N -3.20 0.20 0.33 0.04 2.12 -1.14 -5.03 118.70 112.01 1jvn s GLU 445 Ca 0.06 0.12 0.01 0.00 0.36 0.00 0.00 54.97 55.52 1jvn s GLU 445 Cb 0.10 -0.42 -0.03 0.00 0.26 0.00 0.00 34.13 34.04 1jvn s GLU 445 CO 0.69 -0.15 0.52 -1.54 -0.54 0.00 0.00 175.26 174.25 1jvn s SER 446 N 1.07 6.30 0.10 -1.70 1.04 -1.26 0.05 113.70 119.30 1jvn s SER 446 Ca -0.09 0.41 0.03 0.00 0.48 0.00 0.00 55.95 56.78 1jvn s SER 446 Cb -0.13 -2.01 -0.04 0.00 0.10 0.00 0.00 66.02 63.94 1jvn s SER 446 CO -0.02 -0.26 -0.09 -0.13 0.98 0.00 0.00 173.24 173.71 1jvn s ARG 447 N -4.25 0.86 -1.41 4.02 1.81 0.64 -4.91 118.95 115.71 1jvn s ARG 447 Ca 0.39 -1.21 -0.08 0.00 -1.72 0.00 0.00 55.73 53.11 1jvn s ARG 447 Cb -0.10 -0.48 0.07 0.00 -0.45 0.00 0.00 34.95 33.99 1jvn s ARG 447 CO 0.35 0.06 2.41 -3.47 -0.68 0.00 0.00 175.30 173.97 1jvn n ASP 448 N 0.39 7.18 -3.75 0.23 2.03 -1.26 -4.05 116.55 117.31 1jvn n ASP 448 Ca -0.15 -2.96 -0.15 0.00 0.52 0.00 0.00 54.79 52.06 1jvn n ASP 448 Cb 0.58 -1.47 -0.15 0.00 -0.72 0.00 0.00 41.12 39.36 1jvn n ASP 448 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1jvn s LEU 449 N -0.66 0.85 0.50 -2.67 2.96 -1.26 -5.02 118.68 113.37 1jvn s LEU 449 Ca 0.54 0.16 -0.05 0.00 -0.22 0.00 0.00 54.13 54.57 1jvn s LEU 449 Cb 0.16 0.12 -0.02 0.00 0.50 0.00 0.00 46.19 46.95 1jvn s LEU 449 CO -0.06 -0.15 0.79 -0.83 -1.32 0.00 0.00 176.35 174.78 1jvn s GLY 450 N 1.20 1.52 0.38 7.98 0.00 -1.26 -0.49 107.32 116.65 1jvn s GLY 450 Ca -0.08 -0.62 0.11 0.00 0.00 0.00 0.00 44.72 44.12 1jvn s GLY 450 CO -0.04 -0.43 1.88 -0.24 0.00 0.00 0.00 173.10 174.26 1jvn h VAL 451 N 0.16 1.21 0.34 1.40 3.04 -1.08 0.74 116.25 122.06 1jvn h VAL 451 Ca -0.47 -0.96 -0.01 0.00 -1.01 0.00 0.00 66.70 64.26 1jvn h VAL 451 Cb 1.22 1.40 -0.01 0.00 -2.01 0.00 0.00 31.29 31.89 1jvn h VAL 451 CO 0.61 0.29 -0.24 -0.25 -1.01 0.00 0.00 177.57 176.97 1jvn h TRP 452 N 0.13 -0.62 -0.52 3.17 2.91 -1.90 0.16 115.95 119.28 1jvn h TRP 452 Ca 0.02 -0.00 -0.04 0.00 1.13 0.00 0.00 58.89 59.99 1jvn h TRP 452 Cb 0.48 0.23 -0.02 0.00 -0.51 0.00 0.00 29.16 29.34 1jvn h TRP 452 CO 0.00 -0.36 0.15 0.93 -1.03 0.00 0.00 178.44 178.14 1jvn h GLU 453 N -0.57 0.82 0.40 2.65 3.07 -1.85 -2.64 114.58 116.47 1jvn h GLU 453 Ca -0.03 -0.18 -0.02 0.00 -0.50 0.00 0.00 59.36 58.63 1jvn h GLU 453 Cb 0.48 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 28.28 1jvn h GLU 453 CO 0.01 0.77 -0.19 1.25 -1.40 0.00 0.00 179.01 179.45 1jvn h LEU 454 N 0.72 -0.45 -0.72 1.33 5.85 -0.68 -2.22 115.31 119.15 1jvn h LEU 454 Ca 0.17 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.85 1jvn h LEU 454 Cb 0.29 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 1jvn h LEU 454 CO -0.00 -0.29 0.34 0.71 -0.34 0.00 0.00 178.44 178.86 1jvn h THR 455 N -0.58 1.24 -0.43 1.05 1.35 -1.01 -1.54 112.91 112.98 1jvn h THR 455 Ca -0.05 -0.67 -0.06 0.00 -0.55 0.00 0.00 66.41 65.08 1jvn h THR 455 Cb 0.44 0.35 -0.02 0.00 -1.73 0.00 0.00 68.15 67.18 1jvn h THR 455 CO 0.09 0.28 0.02 0.03 -0.25 0.00 0.00 175.52 175.69 1jvn h ARG 456 N 1.01 0.69 0.22 4.72 3.08 -1.47 0.39 114.38 123.02 1jvn h ARG 456 Ca 0.25 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1jvn h ARG 456 Cb 0.12 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1jvn h ARG 456 CO -0.03 0.69 -0.11 0.00 -1.07 0.00 0.00 179.97 179.45 1jvn h ALA 457 N 1.37 -0.30 -0.64 0.04 0.00 -1.15 -2.40 119.26 116.18 1jvn h ALA 457 Ca 0.14 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.89 1jvn h ALA 457 Cb 0.37 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1jvn h ALA 457 CO 0.01 -0.45 0.42 0.00 0.00 0.00 0.00 179.25 179.23 1jvn h GLU 459 N 0.71 0.57 -0.53 0.00 4.81 -0.94 -0.30 114.58 118.90 1jvn h GLU 459 Ca 0.26 -0.12 -0.06 0.00 -0.13 0.00 0.00 59.36 59.32 1jvn h GLU 459 Cb 0.16 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 1jvn h GLU 459 CO -0.08 0.58 0.11 0.00 -0.73 0.00 0.00 179.01 178.89 1jvn h ALA 460 N 0.96 1.18 0.00 2.92 0.00 -0.64 -2.24 119.26 121.44 1jvn h ALA 460 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1jvn h ALA 460 Cb 0.25 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1jvn h ALA 460 CO -0.00 0.55 0.00 1.28 0.00 0.00 0.00 179.25 181.08 1jvn n LEU 461 N -4.26 0.04 0.00 0.00 4.77 0.24 -4.88 117.00 112.91 1jvn n LEU 461 Ca 0.04 0.51 0.00 0.00 -0.03 0.00 0.00 56.01 56.52 1jvn n LEU 461 Cb 0.24 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 1jvn n LEU 461 CO 0.40 -0.18 0.00 0.61 -1.33 0.00 0.00 177.39 176.89 1jvn n GLY 462 N 0.49 1.17 3.77 -0.72 0.00 -0.84 -3.57 105.19 105.48 1jvn n GLY 462 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1jvn n GLY 462 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jvn s ALA 463 N -2.00 3.06 -0.96 4.61 0.00 -0.18 -4.13 121.76 122.17 1jvn s ALA 463 Ca 0.00 1.06 0.11 0.00 0.00 0.00 0.00 51.96 53.13 1jvn s ALA 463 Cb 0.00 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 1jvn s ALA 463 CO 0.00 -0.75 0.65 0.41 0.00 0.00 0.00 175.76 176.07 1jvn n GLY 464 N 0.58 -0.12 3.50 0.00 0.00 -0.31 -4.65 105.19 104.19 1jvn n GLY 464 Ca 0.06 -0.32 -0.17 0.00 0.00 0.00 0.00 46.02 45.60 1jvn n GLY 464 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jvn s GLU 465 N -1.52 0.95 -0.18 1.61 2.12 -1.05 -3.96 118.70 116.67 1jvn s GLU 465 Ca 0.09 0.37 -0.01 0.00 0.36 0.00 0.00 54.97 55.78 1jvn s GLU 465 Cb 0.09 0.45 0.00 0.00 0.26 0.00 0.00 34.13 34.93 1jvn s GLU 465 CO 0.30 -0.26 -0.12 0.42 -0.54 0.00 0.00 175.26 175.06 1jvn s ILE 466 N -0.83 2.80 -0.75 -3.70 -1.09 0.29 -1.11 121.20 116.81 1jvn s ILE 466 Ca -0.09 -0.70 -0.18 0.00 -2.23 0.00 0.00 60.65 57.45 1jvn s ILE 466 Cb -0.02 -2.22 0.14 0.00 -1.58 0.00 0.00 42.46 38.78 1jvn s ILE 466 CO 0.07 0.49 0.85 -0.22 -1.23 0.00 0.00 174.94 174.90 1jvn s LEU 467 N 1.14 5.58 -0.73 2.97 2.96 0.11 0.32 118.68 131.03 1jvn s LEU 467 Ca 0.01 -1.89 -0.22 0.00 -0.22 0.00 0.00 54.13 51.81 1jvn s LEU 467 Cb -0.14 -2.31 0.08 0.00 0.50 0.00 0.00 46.19 44.31 1jvn s LEU 467 CO -0.04 -0.99 1.04 -0.22 -1.32 0.00 0.00 176.35 174.83 1jvn s LEU 468 N 2.14 4.36 0.65 -0.68 2.96 0.00 -1.68 118.68 126.44 1jvn s LEU 468 Ca 0.19 -1.16 -0.02 0.00 -0.22 0.00 0.00 54.13 52.92 1jvn s LEU 468 Cb -0.15 -2.43 0.07 0.00 0.50 0.00 0.00 46.19 44.17 1jvn s LEU 468 CO -0.02 -1.41 0.92 0.20 -1.32 0.00 0.00 176.35 174.72 1jvn s ASN 469 N 3.75 4.85 -0.26 3.68 0.01 -0.78 -1.20 114.94 124.98 1jvn s ASN 469 Ca 0.26 0.09 -0.01 0.00 -0.71 0.00 0.00 52.86 52.49 1jvn s ASN 469 Cb -0.13 -0.76 0.14 0.00 0.41 0.00 0.00 41.25 40.90 1jvn s ASN 469 CO 0.06 -1.50 0.35 0.00 -1.51 0.00 0.00 177.10 174.50 1jvn h ILE 471 N 6.21 0.54 0.00 0.00 2.04 -1.84 -0.41 117.51 124.06 1jvn h ILE 471 Ca -0.15 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1jvn h ILE 471 Cb 1.13 0.27 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1jvn h ILE 471 CO 0.29 0.05 0.00 0.47 0.00 0.00 0.00 178.15 178.95 1jvn n ASP 472 N -5.16 0.26 -0.08 1.72 8.00 -1.26 -2.59 116.55 117.44 1jvn n ASP 472 Ca 0.12 0.56 0.05 0.00 0.71 0.00 0.00 54.79 56.23 1jvn n ASP 472 Cb 0.41 -0.62 -0.04 0.00 -0.02 0.00 0.00 41.12 40.85 1jvn n ASP 472 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1jvn n LYS 473 N -1.79 3.17 -1.88 -1.24 4.76 -0.31 -4.90 118.16 115.98 1jvn n LYS 473 Ca 0.03 -0.22 -0.42 0.00 -2.87 0.00 0.00 58.31 54.83 1jvn n LYS 473 Cb 0.19 -1.01 -0.03 0.00 -1.84 0.00 0.00 35.03 32.35 1jvn n LYS 473 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1jvn s ASP 474 N -1.73 6.55 0.00 4.39 -1.08 -0.38 -2.06 116.67 122.36 1jvn s ASP 474 Ca 0.05 2.59 0.00 0.00 -0.52 0.00 0.00 52.55 54.68 1jvn s ASP 474 Cb 0.08 -2.57 0.00 0.00 -1.46 0.00 0.00 42.92 38.96 1jvn s ASP 474 CO 0.35 -0.90 0.00 0.61 0.52 0.00 0.00 175.17 175.75 1jvn n GLY 475 N 3.98 0.82 0.18 2.66 0.00 -1.26 -4.88 105.19 106.69 1jvn n GLY 475 Ca 0.16 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.24 1jvn n GLY 475 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1jvn h SER 476 N 0.00 0.00 -2.47 1.61 4.64 -1.76 -3.47 113.55 112.10 1jvn h SER 476 Ca 0.00 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.01 1jvn h SER 476 Cb 0.00 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.02 1jvn h SER 476 CO 0.00 0.35 -0.34 0.59 -0.87 0.00 0.00 176.83 176.56 1jvn n ASN 477 N -3.35 -4.32 -0.93 4.97 3.02 -1.21 -4.81 115.26 108.63 1jvn n ASN 477 Ca 0.01 0.24 0.11 0.00 -0.03 0.00 0.00 54.58 54.91 1jvn n ASN 477 Cb 0.57 -3.78 0.11 0.00 -0.61 0.00 0.00 39.78 36.06 1jvn n ASN 477 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1jvn n SER 478 N -1.34 2.96 0.00 6.41 2.88 -0.84 -4.34 113.62 119.35 1jvn n SER 478 Ca -0.17 -1.94 0.00 0.00 -1.33 0.00 0.00 58.87 55.43 1jvn n SER 478 Cb 0.57 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 1jvn n SER 478 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1jvn n GLY 479 N 1.29 1.17 3.85 0.46 0.00 0.29 -5.01 105.19 107.24 1jvn n GLY 479 Ca 0.14 -2.04 -0.32 0.00 0.00 0.00 0.00 46.02 43.80 1jvn n GLY 479 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jvn s TYR 480 N -1.75 3.50 -0.78 1.61 2.02 -1.26 -4.27 117.35 116.42 1jvn s TYR 480 Ca 0.00 1.42 -0.24 0.00 -0.37 0.00 0.00 57.07 57.87 1jvn s TYR 480 Cb 0.00 -2.77 0.05 0.00 -0.40 0.00 0.00 41.96 38.84 1jvn s TYR 480 CO 0.00 -0.44 1.20 0.34 -1.57 0.00 0.00 175.55 175.08 1jvn s ASP 481 N -3.35 6.25 0.22 2.29 -1.08 -1.26 -4.90 116.67 114.85 1jvn s ASP 481 Ca 0.58 -0.89 -0.09 0.00 -0.52 0.00 0.00 52.55 51.63 1jvn s ASP 481 Cb -0.10 -2.51 0.19 0.00 -1.46 0.00 0.00 42.92 39.04 1jvn s ASP 481 CO 0.37 -1.61 1.88 -0.07 0.52 0.00 0.00 175.17 176.26 1jvn h LEU 482 N 12.30 0.99 -0.95 -1.34 3.38 -2.00 -2.57 115.31 125.12 1jvn h LEU 482 Ca -0.17 -0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.64 1jvn h LEU 482 Cb 1.05 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1jvn h LEU 482 CO 1.26 0.74 -0.47 -0.33 0.09 0.00 0.00 178.44 179.74 1jvn h GLU 483 N 1.14 0.13 -0.36 1.13 5.08 -1.99 -2.25 114.58 117.47 1jvn h GLU 483 Ca 0.30 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.56 1jvn h GLU 483 Cb -0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1jvn h GLU 483 CO -0.06 0.57 0.09 1.25 -1.00 0.00 0.00 179.01 179.86 1jvn h LEU 484 N 0.11 0.54 -0.17 1.33 5.85 -1.91 0.63 115.31 121.69 1jvn h LEU 484 Ca 0.00 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.51 1jvn h LEU 484 Cb 0.87 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 1jvn h LEU 484 CO 0.07 0.63 0.06 0.40 -0.34 0.00 0.00 178.44 179.26 1jvn h ILE 485 N 0.43 0.97 -0.29 4.05 2.04 -1.28 -1.33 117.51 122.10 1jvn h ILE 485 Ca 0.11 -0.05 -0.06 0.00 1.00 0.00 0.00 64.86 65.86 1jvn h ILE 485 Cb 0.29 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 1jvn h ILE 485 CO 0.00 0.03 -0.09 -0.33 0.00 0.00 0.00 178.15 177.75 1jvn h GLU 486 N 0.15 0.48 -0.35 2.37 4.39 -1.26 0.01 114.58 120.36 1jvn h GLU 486 Ca 0.07 -0.12 -0.03 0.00 0.34 0.00 0.00 59.36 59.61 1jvn h GLU 486 Cb 0.03 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 1jvn h GLU 486 CO -0.07 0.57 0.10 1.25 -1.16 0.00 0.00 179.01 179.71 1jvn h HIS 487 N 0.45 0.58 -0.12 4.33 2.76 -0.44 -1.40 115.15 121.30 1jvn h HIS 487 Ca 0.09 -0.06 -0.18 0.00 -2.20 0.00 0.00 60.37 58.01 1jvn h HIS 487 Cb 0.44 -0.17 -0.00 0.00 1.55 0.00 0.00 27.41 29.23 1jvn h HIS 487 CO 0.01 0.57 -0.68 0.28 -1.30 0.00 0.00 177.93 176.82 1jvn h VAL 488 N 0.42 1.35 0.00 5.26 2.07 -1.01 -2.47 116.25 121.88 1jvn h VAL 488 Ca 0.11 -2.01 -0.03 0.00 0.82 0.00 0.00 66.70 65.59 1jvn h VAL 488 Cb 0.27 1.99 -0.00 0.00 -1.52 0.00 0.00 31.29 32.03 1jvn h VAL 488 CO -0.00 0.61 -0.15 0.11 0.02 0.00 0.00 177.57 178.16 1jvn h LYS 489 N 0.34 0.00 0.03 1.57 1.79 -0.86 -1.18 116.57 118.27 1jvn h LYS 489 Ca -0.02 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.23 1jvn h LYS 489 Cb 1.24 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.88 1jvn h LYS 489 CO 0.12 0.15 -0.98 -0.44 -1.08 0.00 0.00 179.45 177.22 1jvn h ASP 490 N 0.00 0.24 -0.07 0.86 3.32 -1.04 -3.36 116.42 116.38 1jvn h ASP 490 Ca -0.00 -0.22 -0.08 0.00 0.02 0.00 0.00 57.03 56.75 1jvn h ASP 490 Cb 0.38 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.85 1jvn h ASP 490 CO 0.02 1.08 -0.27 0.00 -1.72 0.00 0.00 179.24 178.36 1jvn h ALA 491 N 0.89 0.13 -1.79 3.45 0.00 -0.79 -3.48 119.26 117.67 1jvn h ALA 491 Ca -0.06 -0.42 -0.58 0.00 0.00 0.00 0.00 54.91 53.86 1jvn h ALA 491 Cb 1.66 -0.01 -0.13 0.00 0.00 0.00 0.00 17.79 19.30 1jvn h ALA 491 CO 0.15 0.14 -0.60 0.14 0.00 0.00 0.00 179.25 179.08 1jvn s VAL 492 N -3.72 1.74 -0.19 0.00 -7.23 -0.61 -4.77 120.40 105.64 1jvn s VAL 492 Ca -0.14 -2.00 0.16 0.00 -1.81 0.00 0.00 61.98 58.18 1jvn s VAL 492 Cb 0.03 -2.93 0.49 0.00 0.56 0.00 0.00 36.38 34.54 1jvn s VAL 492 CO 0.76 -0.01 1.38 0.29 -0.31 0.00 0.00 175.10 177.22 1jvn n LYS 493 N -0.87 2.53 -4.27 4.82 5.02 -1.26 -4.77 118.16 119.36 1jvn n LYS 493 Ca -0.04 -2.85 -0.26 0.00 -2.02 0.00 0.00 58.31 53.14 1jvn n LYS 493 Cb 0.67 -1.79 -0.09 0.00 -0.02 0.00 0.00 35.03 33.80 1jvn n LYS 493 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1jvn s ILE 494 N -2.89 3.39 0.21 -0.18 -4.36 -1.26 -2.40 121.20 113.69 1jvn s ILE 494 Ca 0.41 -1.62 -0.32 0.00 -0.26 0.00 0.00 60.65 58.85 1jvn s ILE 494 Cb 0.34 -2.70 -0.13 0.00 1.25 0.00 0.00 42.46 41.22 1jvn s ILE 494 CO 0.07 -0.15 1.63 -2.65 0.24 0.00 0.00 174.94 174.08 1jvn n PRO 495 N -0.14 2.49 -4.30 0.37 -0.02 -1.25 -4.79 135.00 127.36 1jvn n PRO 495 Ca -0.10 0.90 -0.34 0.00 -2.02 0.00 0.00 63.50 61.94 1jvn n PRO 495 Cb 0.56 -2.69 -0.14 0.00 -0.02 0.00 0.00 33.50 31.20 1jvn n PRO 495 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1jvn s VAL 496 N 0.83 3.05 -0.20 -1.45 1.01 -1.26 -0.55 120.40 121.83 1jvn s VAL 496 Ca 0.74 -0.63 -0.14 0.00 0.00 0.00 0.00 61.98 61.96 1jvn s VAL 496 Cb -0.58 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 1jvn s VAL 496 CO 0.38 0.48 0.31 -0.63 0.00 0.00 0.00 175.10 175.64 1jvn s ILE 497 N 0.98 5.27 -0.29 2.22 1.01 0.15 -0.61 121.20 129.93 1jvn s ILE 497 Ca -0.01 0.54 -0.27 0.00 0.00 0.00 0.00 60.65 60.91 1jvn s ILE 497 Cb -0.15 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 38.68 1jvn s ILE 497 CO -0.01 0.31 0.96 0.00 0.00 0.00 0.00 174.94 176.20 1jvn s ALA 498 N 1.04 3.57 0.20 9.38 0.00 0.62 -0.82 121.76 135.75 1jvn s ALA 498 Ca 0.16 -0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.05 1jvn s ALA 498 Cb -0.14 -3.50 -0.05 0.00 0.00 0.00 0.00 23.12 19.43 1jvn s ALA 498 CO 0.06 -1.24 -0.05 0.45 0.00 0.00 0.00 175.76 174.98 1jvn s SER 499 N 1.50 1.89 0.07 0.00 0.15 -0.35 -0.87 113.70 116.10 1jvn s SER 499 Ca 0.40 -1.13 0.00 0.00 0.70 0.00 0.00 55.95 55.92 1jvn s SER 499 Cb -0.14 -0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.16 1jvn s SER 499 CO 0.11 -0.42 0.00 -1.20 1.20 0.00 0.00 173.24 172.93 1jvn n SER 500 N -0.34 -4.28 0.00 5.45 7.64 -1.26 -3.97 113.62 116.86 1jvn n SER 500 Ca -0.07 0.45 0.00 0.00 1.01 0.00 0.00 58.87 60.26 1jvn n SER 500 Cb 0.62 -2.29 0.00 0.00 -1.01 0.00 0.00 64.21 61.54 1jvn n SER 500 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jvn n GLY 501 N 0.60 2.66 3.69 0.23 0.00 -0.87 -4.15 105.19 107.35 1jvn n GLY 501 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1jvn n GLY 501 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jvn s ALA 502 N -2.58 3.72 0.00 4.61 0.00 -1.26 0.11 121.76 126.36 1jvn s ALA 502 Ca 0.00 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.27 1jvn s ALA 502 Cb 0.00 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.41 1jvn s ALA 502 CO 0.00 -1.10 0.00 0.41 0.00 0.00 0.00 175.76 175.07 1jvn n GLY 503 N 4.04 0.00 3.25 0.00 0.00 -1.26 -4.57 105.19 106.65 1jvn n GLY 503 Ca 0.16 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.04 1jvn n GLY 503 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1jvn s VAL 504 N -1.44 0.97 0.55 1.61 -7.23 -1.26 -4.86 120.40 108.73 1jvn s VAL 504 Ca 0.00 -2.02 0.23 0.00 -1.81 0.00 0.00 61.98 58.38 1jvn s VAL 504 Cb 0.00 -1.99 0.34 0.00 0.56 0.00 0.00 36.38 35.29 1jvn s VAL 504 CO 0.00 -0.61 2.10 -0.65 -0.31 0.00 0.00 175.10 175.62 1jvn h PRO 505 N 2.72 0.00 0.00 4.82 0.11 -1.93 -1.46 132.00 136.26 1jvn h PRO 505 Ca -0.37 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.73 1jvn h PRO 505 Cb 1.20 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1jvn h PRO 505 CO 0.64 0.00 -0.06 0.93 -0.21 0.00 0.00 178.00 179.30 1jvn h GLU 506 N 0.00 0.00 -0.19 1.05 3.07 -1.96 -1.61 114.58 114.94 1jvn h GLU 506 Ca 0.10 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 58.84 1jvn h GLU 506 Cb 0.44 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.34 1jvn h GLU 506 CO -0.00 0.06 -0.41 0.45 -1.40 0.00 0.00 179.01 177.71 1jvn h HIS 507 N 0.00 0.51 -0.14 4.33 3.86 -1.68 -1.21 115.15 120.81 1jvn h HIS 507 Ca -0.00 -0.14 -0.20 0.00 -1.16 0.00 0.00 60.37 58.87 1jvn h HIS 507 Cb 0.13 -0.11 0.01 0.00 1.06 0.00 0.00 27.41 28.50 1jvn h HIS 507 CO 0.00 0.77 -0.67 0.74 0.86 0.00 0.00 177.93 179.63 1jvn h PHE 508 N 0.36 0.95 -0.33 2.45 -1.00 -1.42 -2.22 116.94 115.73 1jvn h PHE 508 Ca 0.03 -0.42 0.00 0.00 2.81 0.00 0.00 57.97 60.40 1jvn h PHE 508 Cb 0.87 -0.15 -0.02 0.00 3.61 0.00 0.00 35.95 40.26 1jvn h PHE 508 CO 0.03 1.23 0.21 1.49 -1.61 0.00 0.00 178.31 179.66 1jvn h GLU 509 N 0.40 0.43 -0.39 1.51 4.81 -1.33 -0.85 114.58 119.16 1jvn h GLU 509 Ca -0.04 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.18 1jvn h GLU 509 Cb 1.31 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.56 1jvn h GLU 509 CO 0.14 0.31 0.20 1.49 -0.73 0.00 0.00 179.01 180.42 1jvn h GLU 510 N 0.43 0.40 -0.59 1.92 4.81 -1.22 0.03 114.58 120.36 1jvn h GLU 510 Ca 0.12 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 1jvn h GLU 510 Cb -0.03 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 1jvn h GLU 510 CO -0.02 0.26 0.13 0.00 -0.73 0.00 0.00 179.01 178.65 1jvn h ALA 511 N 1.20 0.78 0.00 2.92 0.00 -1.10 0.27 119.26 123.34 1jvn h ALA 511 Ca 0.17 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1jvn h ALA 511 Cb 0.06 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1jvn h ALA 511 CO -0.11 0.50 -0.28 0.74 0.00 0.00 0.00 179.25 180.10 1jvn h PHE 512 N 0.87 0.00 0.00 0.00 0.04 -0.86 -2.44 116.94 114.55 1jvn h PHE 512 Ca 0.18 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.74 1jvn h PHE 512 Cb 0.37 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.48 1jvn h PHE 512 CO 0.03 0.28 -2.05 1.28 -0.60 0.00 0.00 178.31 177.25 1jvn n LEU 513 N -3.33 0.00 -0.00 1.54 4.77 -0.03 -4.62 117.00 115.32 1jvn n LEU 513 Ca 0.01 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.08 1jvn n LEU 513 Cb 0.51 0.30 -0.12 0.00 -2.33 0.00 0.00 43.42 41.78 1jvn n LEU 513 CO 0.35 0.30 -0.26 0.29 -1.33 0.00 0.00 177.39 176.74 1jvn n LYS 514 N -2.48 0.88 -4.42 3.23 5.02 0.93 -5.00 118.16 116.32 1jvn n LYS 514 Ca -0.20 -0.05 -0.21 0.00 -2.02 0.00 0.00 58.31 55.82 1jvn n LYS 514 Cb 0.88 -1.38 -0.10 0.00 -0.02 0.00 0.00 35.03 34.41 1jvn n LYS 514 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1jvn s THR 515 N -2.90 0.91 -0.42 -0.18 -4.23 -0.92 -5.03 115.64 102.88 1jvn s THR 515 Ca 0.02 -2.00 0.11 0.00 -1.18 0.00 0.00 61.69 58.64 1jvn s THR 515 Cb 0.13 -2.68 0.63 0.00 1.34 0.00 0.00 72.50 71.93 1jvn s THR 515 CO 0.75 0.00 1.47 0.54 -0.54 0.00 0.00 174.62 176.85 1jvn n ARG 516 N -0.67 3.99 -1.63 3.99 1.74 -1.26 -4.60 116.66 118.23 1jvn n ARG 516 Ca -0.02 -2.44 -0.46 0.00 -0.77 0.00 0.00 57.85 54.16 1jvn n ARG 516 Cb 0.66 -2.10 -0.03 0.00 -1.02 0.00 0.00 32.46 29.98 1jvn n ARG 516 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1jvn n ALA 517 N 0.46 0.28 1.16 7.54 0.00 -1.26 -4.89 120.51 123.81 1jvn n ALA 517 Ca 0.22 0.43 0.12 0.00 0.00 0.00 0.00 53.44 54.21 1jvn n ALA 517 Cb 1.00 -2.16 0.25 0.00 0.00 0.00 0.00 19.45 18.54 1jvn n ALA 517 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1jvn n ASP 518 N 1.95 1.36 -3.60 0.00 8.00 0.22 -4.84 116.55 119.64 1jvn n ASP 518 Ca 0.12 -1.11 -0.04 0.00 0.71 0.00 0.00 54.79 54.48 1jvn n ASP 518 Cb 0.29 0.25 -0.02 0.00 -0.02 0.00 0.00 41.12 41.62 1jvn n ASP 518 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jvn s ALA 519 N -2.49 -2.09 -0.03 2.24 0.00 -1.20 -4.47 121.76 113.72 1jvn s ALA 519 Ca 0.22 1.62 0.03 0.00 0.00 0.00 0.00 51.96 53.83 1jvn s ALA 519 Cb 0.19 -0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.17 1jvn s ALA 519 CO 0.54 -0.60 -0.10 0.00 0.00 0.00 0.00 175.76 175.59 1jvn s LEU 521 N 0.19 2.95 0.05 0.00 0.20 -0.05 -0.51 118.68 121.52 1jvn s LEU 521 Ca -0.04 -0.13 0.06 0.00 0.69 0.00 0.00 54.13 54.72 1jvn s LEU 521 Cb -0.09 -1.64 -0.03 0.00 -0.43 0.00 0.00 46.19 44.00 1jvn s LEU 521 CO 0.01 0.34 -0.17 -0.83 -0.29 0.00 0.00 176.35 175.41 1jvn s GLY 522 N -0.87 0.95 0.00 7.98 0.00 -0.15 -4.57 107.32 110.65 1jvn s GLY 522 Ca 0.13 -0.97 0.00 0.00 0.00 0.00 0.00 44.72 43.88 1jvn s GLY 522 CO 0.02 -0.94 0.00 0.00 0.00 0.00 0.00 173.10 172.18 1jvn n ALA 523 N 1.69 1.29 -0.29 3.20 0.00 -1.26 -0.73 120.51 124.41 1jvn n ALA 523 Ca -0.18 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.35 1jvn n ALA 523 Cb 0.54 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.31 1jvn n ALA 523 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1jvn h GLY 524 N 0.00 1.30 1.82 0.00 0.00 -1.89 -1.51 103.07 102.78 1jvn h GLY 524 Ca 0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 46.96 1jvn h GLY 524 CO 0.00 0.15 0.00 0.00 0.00 0.00 0.00 176.54 176.70 1jvn h MET 525 N 0.82 0.23 0.07 4.80 -0.00 -1.89 0.18 114.93 119.14 1jvn h MET 525 Ca 0.44 -0.03 -0.29 0.00 -0.00 0.00 0.00 59.70 59.82 1jvn h MET 525 Cb 0.54 -0.04 -0.02 0.00 -0.00 0.00 0.00 31.60 32.07 1jvn h MET 525 CO -0.20 0.25 -1.50 0.74 -0.00 0.00 0.00 176.91 176.21 1jvn h PHE 526 N 0.23 0.26 -0.06 -0.10 0.04 -1.55 -2.65 116.94 113.11 1jvn h PHE 526 Ca 0.06 -0.19 -0.17 0.00 2.80 0.00 0.00 57.97 60.47 1jvn h PHE 526 Cb 0.16 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 1jvn h PHE 526 CO 0.00 1.24 -0.71 1.25 -0.60 0.00 0.00 178.31 179.49 1jvn h HIS 527 N 0.04 0.42 -0.00 -0.55 2.76 -0.75 -3.15 115.15 113.92 1jvn h HIS 527 Ca -0.22 -0.18 0.00 0.00 -2.20 0.00 0.00 60.37 57.77 1jvn h HIS 527 Cb 1.97 -0.06 0.00 0.00 1.55 0.00 0.00 27.41 30.86 1jvn h HIS 527 CO 0.04 0.92 -0.10 0.54 -1.30 0.00 0.00 177.93 178.02 1jvn n ARG 528 N -3.82 0.39 -1.00 5.26 1.74 0.60 -4.93 116.66 114.91 1jvn n ARG 528 Ca -0.03 -0.10 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 1jvn n ARG 528 Cb 0.69 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.64 1jvn n ARG 528 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jvn n GLY 529 N 1.35 0.68 0.30 -0.13 0.00 -1.19 -4.91 105.19 101.30 1jvn n GLY 529 Ca 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.14 1jvn n GLY 529 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1jvn h GLU 530 N 1.74 0.67 -3.14 1.61 5.08 -1.80 -3.45 114.58 115.30 1jvn h GLU 530 Ca 0.00 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.18 1jvn h GLU 530 Cb 0.00 -0.12 -0.16 0.00 0.50 0.00 0.00 28.75 28.98 1jvn h GLU 530 CO 0.00 0.59 -0.10 -0.06 -1.00 0.00 0.00 179.01 178.44 1jvn s PHE 531 N -5.23 -0.24 0.39 4.33 0.40 -1.02 -5.08 117.98 111.52 1jvn s PHE 531 Ca -0.09 0.12 0.08 0.00 -0.60 0.00 0.00 56.93 56.44 1jvn s PHE 531 Cb 0.16 0.22 -0.03 0.00 0.51 0.00 0.00 43.02 43.88 1jvn s PHE 531 CO 0.77 -0.60 0.26 0.95 0.70 0.00 0.00 175.22 177.30 1jvn s THR 532 N -2.84 2.76 0.29 0.64 -4.23 -1.26 -4.00 115.64 107.00 1jvn s THR 532 Ca -0.03 -1.51 -0.01 0.00 -1.18 0.00 0.00 61.69 58.96 1jvn s THR 532 Cb -0.00 -3.02 0.15 0.00 1.34 0.00 0.00 72.50 70.97 1jvn s THR 532 CO -0.05 -0.06 1.83 0.58 -0.54 0.00 0.00 174.62 176.37 1jvn h VAL 533 N 1.27 1.22 -0.14 2.29 2.07 -1.91 -1.73 116.25 119.33 1jvn h VAL 533 Ca -0.43 -0.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.23 1jvn h VAL 533 Cb 1.26 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 1jvn h VAL 533 CO 0.62 0.30 -0.08 0.78 0.02 0.00 0.00 177.57 179.21 1jvn h ASN 534 N 0.76 0.19 -0.51 0.57 -0.26 -1.67 0.11 115.58 114.78 1jvn h ASN 534 Ca 0.16 -0.03 -0.08 0.00 -0.56 0.00 0.00 56.30 55.79 1jvn h ASN 534 Cb 0.31 -0.05 -0.02 0.00 -1.06 0.00 0.00 38.32 37.50 1jvn h ASN 534 CO 0.00 0.31 -0.00 0.44 -1.06 0.00 0.00 177.43 177.12 1jvn h ASP 535 N 0.20 0.88 -0.16 5.81 3.32 -1.63 0.16 116.42 125.00 1jvn h ASP 535 Ca 0.05 -0.31 -0.02 0.00 0.02 0.00 0.00 57.03 56.76 1jvn h ASP 535 Cb 0.28 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1jvn h ASP 535 CO 0.01 0.97 0.01 0.58 -1.72 0.00 0.00 179.24 179.10 1jvn h VAL 536 N 0.76 1.24 -0.30 -1.35 2.07 -1.08 -2.52 116.25 115.06 1jvn h VAL 536 Ca 0.14 -0.78 -0.00 0.00 0.82 0.00 0.00 66.70 66.88 1jvn h VAL 536 Cb 0.52 1.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1jvn h VAL 536 CO 0.03 0.23 0.17 0.11 0.02 0.00 0.00 177.57 178.13 1jvn h LYS 537 N 0.04 0.42 -0.95 1.57 1.57 -0.64 -0.86 116.57 117.72 1jvn h LYS 537 Ca 0.05 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1jvn h LYS 537 Cb 0.34 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.51 1jvn h LYS 537 CO 0.01 0.35 0.62 0.93 -0.57 0.00 0.00 179.45 180.78 1jvn h GLU 538 N 0.38 1.14 -0.52 3.15 4.39 -0.68 0.32 114.58 122.76 1jvn h GLU 538 Ca 0.11 -0.07 -0.09 0.00 0.34 0.00 0.00 59.36 59.65 1jvn h GLU 538 Cb 0.05 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 28.42 1jvn h GLU 538 CO -0.02 0.75 -0.03 -0.92 -1.16 0.00 0.00 179.01 177.63 1jvn h TYR 539 N 1.17 1.03 -0.21 4.33 3.20 -1.11 -2.12 116.97 123.27 1jvn h TYR 539 Ca 0.39 -0.19 -0.13 0.00 3.14 0.00 0.00 58.73 61.94 1jvn h TYR 539 Cb 0.05 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 1jvn h TYR 539 CO -0.01 0.96 -0.41 -0.07 -1.64 0.00 0.00 178.16 176.99 1jvn h LEU 540 N 0.81 0.52 -0.71 2.82 3.38 -0.44 -3.07 115.31 118.63 1jvn h LEU 540 Ca 0.14 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1jvn h LEU 540 Cb 0.57 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1jvn h LEU 540 CO 0.03 0.88 0.32 0.25 0.09 0.00 0.00 178.44 180.01 1jvn h LEU 541 N 0.41 0.94 0.00 1.67 5.85 -0.20 -1.73 115.31 122.25 1jvn h LEU 541 Ca 0.03 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1jvn h LEU 541 Cb 0.90 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.69 1jvn h LEU 541 CO 0.08 0.83 0.00 -1.84 -0.34 0.00 0.00 178.44 177.17 1jvn n GLU 542 N -4.41 0.43 -0.46 1.25 0.28 -0.81 -2.44 120.64 114.48 1jvn n GLU 542 Ca 0.06 0.03 0.08 0.00 -0.16 0.00 0.00 57.16 57.17 1jvn n GLU 542 Cb 0.15 -1.50 0.27 0.00 1.43 0.00 0.00 31.44 31.79 1jvn n GLU 542 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1jvn n HIS 543 N -1.25 1.07 -0.85 -1.84 8.25 -0.73 -4.97 115.22 114.91 1jvn n HIS 543 Ca 0.13 -0.68 0.00 0.00 -0.26 0.00 0.00 57.72 56.92 1jvn n HIS 543 Cb 0.19 -0.23 0.00 0.00 1.12 0.00 0.00 29.99 31.08 1jvn n HIS 543 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jvn n GLY 544 N 0.39 0.72 3.87 -1.41 0.00 -1.02 -5.05 105.19 102.68 1jvn n GLY 544 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 1jvn n GLY 544 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jvn s LEU 545 N 0.00 4.11 -0.20 0.99 1.43 -0.76 -5.03 118.68 119.22 1jvn s LEU 545 Ca 0.00 1.06 -0.17 0.00 -1.03 0.00 0.00 54.13 53.99 1jvn s LEU 545 Cb 0.00 -3.84 -0.04 0.00 0.03 0.00 0.00 46.19 42.34 1jvn s LEU 545 CO 0.00 -0.14 0.46 -0.54 0.23 0.00 0.00 176.35 176.36 1jvn s LYS 546 N -2.93 4.18 0.05 1.70 -0.14 -1.26 -4.23 119.74 117.10 1jvn s LYS 546 Ca 0.50 0.30 0.01 0.00 -1.36 0.00 0.00 55.97 55.43 1jvn s LYS 546 Cb -0.11 -3.55 -0.03 0.00 -1.68 0.00 0.00 37.83 32.46 1jvn s LYS 546 CO 0.20 -0.10 -0.06 0.14 -0.76 0.00 0.00 175.35 174.77 1jvn s VAL 547 N 1.49 0.46 0.02 3.17 -7.23 -1.26 -0.39 120.40 116.65 1jvn s VAL 547 Ca 0.21 -1.22 -0.30 0.00 -1.81 0.00 0.00 61.98 58.86 1jvn s VAL 547 Cb -0.15 -0.76 -0.05 0.00 0.56 0.00 0.00 36.38 35.98 1jvn s VAL 547 CO 0.09 -0.52 1.31 -0.60 -0.31 0.00 0.00 175.10 175.07 1jvn s ARG 548 N -2.05 4.33 -0.36 4.82 3.52 -1.26 -4.98 118.95 122.98 1jvn s ARG 548 Ca -0.07 1.87 0.01 0.00 -0.13 0.00 0.00 55.73 57.41 1jvn s ARG 548 Cb -0.07 -3.48 0.11 0.00 -1.56 0.00 0.00 34.95 29.96 1jvn s ARG 548 CO -0.01 -0.46 0.14 -1.64 -0.81 0.00 0.00 175.30 172.52 1jvn s MET 549 N 1.90 1.01 -0.01 5.12 -1.94 -1.26 -5.04 119.30 119.07 1jvn s MET 549 Ca 0.61 -1.50 -0.00 0.00 -1.71 0.00 0.00 55.69 53.09 1jvn s MET 549 Cb -0.30 -2.26 0.01 0.00 2.01 0.00 0.00 34.83 34.28 1jvn s MET 549 CO 0.27 -1.04 0.02 0.34 -0.01 0.00 0.00 175.02 174.59 1jvn s ASP 550 N 1.09 -0.00 0.04 3.03 2.15 -1.26 -5.00 116.67 116.72 1jvn s ASP 550 Ca 0.13 0.03 -0.05 0.00 0.43 0.00 0.00 52.55 53.09 1jvn s ASP 550 Cb -0.20 0.01 -0.01 0.00 -0.30 0.00 0.00 42.92 42.42 1jvn s ASP 550 CO -0.14 -0.03 0.10 -0.70 -0.17 0.00 0.00 175.17 174.22 1jvn s GLU 551 N 0.23 0.59 0.00 4.34 2.12 -1.26 -4.87 118.70 119.84 1jvn s GLU 551 Ca -0.02 -0.75 0.25 0.00 0.36 0.00 0.00 54.97 54.81 1jvn s GLU 551 Cb -0.03 0.23 0.48 0.00 0.26 0.00 0.00 34.13 35.08 1jvn s GLU 551 CO -0.01 -0.15 1.42 0.39 -0.54 0.00 0.00 175.26 176.38