#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 -4.94 113.62 112.45 1jvn n SER -2 Ca 0.00 -0.30 0.12 0.00 -0.26 0.00 0.00 58.87 58.43 1jvn n SER -2 Cb 0.00 0.00 0.53 0.00 -0.26 0.00 0.00 64.21 64.48 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 0.01 -3.65 7.33 -0.00 -1.26 -4.77 115.22 112.88 1jvn n HIS -1 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.58 1jvn n HIS -1 Cb 0.08 -0.51 -0.08 0.00 -0.00 0.00 0.00 29.99 29.48 1jvn n HIS -1 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1jvn s MET 1 N -3.00 0.79 0.19 -1.40 0.00 -1.26 -5.13 119.30 109.48 1jvn s MET 1 Ca 0.12 0.40 -0.32 0.00 0.00 0.00 0.00 55.69 55.90 1jvn s MET 1 Cb 0.16 0.37 -0.11 0.00 0.00 0.00 0.00 34.83 35.25 1jvn s MET 1 CO 0.46 -0.18 1.68 -1.25 0.00 0.00 0.00 175.02 175.73 1jvn s PRO 2 N -0.53 4.15 0.09 3.16 0.04 -1.26 -4.56 135.00 136.09 1jvn s PRO 2 Ca -0.06 2.54 -0.21 0.00 0.04 0.00 0.00 61.00 63.31 1jvn s PRO 2 Cb -0.03 -3.13 -0.07 0.00 0.04 0.00 0.00 34.50 31.31 1jvn s PRO 2 CO 0.04 -0.72 0.61 0.08 0.04 0.00 0.00 177.00 177.06 1jvn s VAL 3 N 1.26 4.66 -0.17 -0.36 1.01 -1.26 -2.63 120.40 122.90 1jvn s VAL 3 Ca 0.74 1.32 0.01 0.00 0.00 0.00 0.00 61.98 64.04 1jvn s VAL 3 Cb -0.48 -3.95 0.01 0.00 0.00 0.00 0.00 36.38 31.97 1jvn s VAL 3 CO 0.32 0.55 -0.18 -0.69 0.00 0.00 0.00 175.10 175.09 1jvn s VAL 4 N -1.12 2.25 -0.11 2.92 1.01 0.02 -4.26 120.40 121.11 1jvn s VAL 4 Ca 0.30 -0.89 -0.21 0.00 0.00 0.00 0.00 61.98 61.18 1jvn s VAL 4 Cb -0.20 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.20 1jvn s VAL 4 CO 0.21 0.53 0.62 -1.00 0.00 0.00 0.00 175.10 175.46 1jvn s HIS 5 N 1.18 3.51 -0.22 5.22 3.76 0.80 -1.41 115.29 128.13 1jvn s HIS 5 Ca 0.02 1.08 0.02 0.00 -0.15 0.00 0.00 55.06 56.03 1jvn s HIS 5 Cb -0.14 -2.73 0.04 0.00 1.11 0.00 0.00 32.58 30.86 1jvn s HIS 5 CO -0.09 0.05 -0.15 0.08 -0.85 0.00 0.00 174.74 173.78 1jvn s VAL 6 N 1.01 2.18 0.04 -0.90 1.01 -0.14 -0.41 120.40 123.19 1jvn s VAL 6 Ca 0.32 -1.27 -0.30 0.00 0.00 0.00 0.00 61.98 60.73 1jvn s VAL 6 Cb -0.17 -2.10 -0.07 0.00 0.00 0.00 0.00 36.38 34.05 1jvn s VAL 6 CO 0.14 0.25 1.47 -0.63 0.00 0.00 0.00 175.10 176.33 1jvn s ILE 7 N 1.21 3.45 -0.28 2.22 1.01 -0.65 -0.31 121.20 127.84 1jvn s ILE 7 Ca -0.02 0.89 0.02 0.00 0.00 0.00 0.00 60.65 61.54 1jvn s ILE 7 Cb -0.17 -3.57 0.08 0.00 0.01 0.00 0.00 42.46 38.81 1jvn s ILE 7 CO -0.09 0.01 -0.02 -0.62 0.00 0.00 0.00 174.94 174.22 1jvn s ASP 8 N 1.91 4.29 0.00 3.58 2.15 0.64 -4.33 116.67 124.92 1jvn s ASP 8 Ca 0.67 -1.57 0.12 0.00 0.43 0.00 0.00 52.55 52.20 1jvn s ASP 8 Cb -0.35 -1.37 0.44 0.00 -0.30 0.00 0.00 42.92 41.35 1jvn s ASP 8 CO 0.29 -0.29 1.33 1.33 -0.17 0.00 0.00 175.17 177.66 1jvn n VAL 9 N 4.51 0.28 -3.65 1.11 0.24 -1.26 -4.10 118.33 115.46 1jvn n VAL 9 Ca -0.07 -0.32 -0.21 0.00 -2.04 0.00 0.00 64.34 61.71 1jvn n VAL 9 Cb 0.43 0.18 0.04 0.00 -1.47 0.00 0.00 33.84 33.02 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 0.19 -4.97 -3.68 7.34 1.02 -1.26 -5.01 120.64 114.26 1jvn n GLU 10 Ca 0.11 0.65 -0.11 0.00 -0.02 0.00 0.00 57.16 57.80 1jvn n GLU 10 Cb 0.24 -5.26 -0.11 0.00 -0.02 0.00 0.00 31.44 26.29 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 -4.32 -0.26 0.00 1.62 0.15 -1.26 -5.12 113.70 104.51 1jvn s SER 11 Ca 0.02 0.81 0.00 0.00 0.70 0.00 0.00 55.95 57.49 1jvn s SER 11 Cb -0.01 0.86 0.00 0.00 -1.71 0.00 0.00 66.02 65.17 1jvn s SER 11 CO 0.80 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.64 1jvn n GLY 12 N 4.75 -2.99 3.60 9.45 0.00 -1.26 -4.77 105.19 113.96 1jvn n GLY 12 Ca -0.17 -1.81 -0.43 0.00 0.00 0.00 0.00 46.02 43.61 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 -1.72 6.56 0.00 1.61 2.47 -1.16 -3.84 114.94 118.86 1jvn s ASN 13 Ca 0.00 0.60 0.06 0.00 0.42 0.00 0.00 52.86 53.94 1jvn s ASN 13 Cb 0.00 -2.55 0.05 0.00 -1.45 0.00 0.00 41.25 37.31 1jvn s ASN 13 CO 0.00 -1.29 0.72 -0.11 -3.72 0.00 0.00 177.10 172.70 1jvn n LEU 14 N 8.07 1.55 0.01 3.21 7.94 -1.26 -4.66 117.00 131.87 1jvn n LEU 14 Ca 0.13 -1.07 -0.12 0.00 -1.11 0.00 0.00 56.01 53.84 1jvn n LEU 14 Cb 0.49 -0.01 -0.08 0.00 0.53 0.00 0.00 43.42 44.35 1jvn n LEU 14 CO 0.71 0.33 0.77 1.56 -1.11 0.00 0.00 177.39 179.65 1jvn h GLN 15 N 1.13 0.01 -0.19 1.96 1.08 -1.87 -2.07 115.11 115.15 1jvn h GLN 15 Ca 0.00 -0.00 0.02 0.00 -1.45 0.00 0.00 58.65 57.22 1jvn h GLN 15 Cb 0.27 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.67 1jvn h GLN 15 CO 0.00 0.22 0.04 0.77 -0.95 0.00 0.00 178.83 178.92 1jvn h SER 16 N -0.21 0.02 -0.13 1.46 0.02 -1.83 0.13 113.55 113.01 1jvn h SER 16 Ca 0.00 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 1jvn h SER 16 Cb 0.22 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 1jvn h SER 16 CO -0.00 0.04 0.05 0.25 -1.14 0.00 0.00 176.83 176.03 1jvn h LEU 17 N 0.12 0.19 -0.42 5.07 5.85 -1.85 0.12 115.31 124.39 1jvn h LEU 17 Ca 0.09 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.61 1jvn h LEU 17 Cb 0.08 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1jvn h LEU 17 CO -0.11 0.31 0.20 0.71 -0.34 0.00 0.00 178.44 179.21 1jvn h THR 18 N 0.05 1.18 -0.29 1.05 1.35 -1.26 -1.07 112.91 113.92 1jvn h THR 18 Ca 0.04 -0.51 -0.05 0.00 -0.55 0.00 0.00 66.41 65.35 1jvn h THR 18 Cb 0.19 0.74 -0.02 0.00 -1.73 0.00 0.00 68.15 67.33 1jvn h THR 18 CO -0.00 0.19 -0.02 0.78 -0.25 0.00 0.00 175.52 176.22 1jvn h ASN 19 N 0.54 0.42 -0.19 5.36 2.35 -0.62 -0.93 115.58 122.51 1jvn h ASN 19 Ca 0.14 -0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 55.78 1jvn h ASN 19 Cb 0.12 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1jvn h ASN 19 CO -0.02 0.51 -0.01 0.00 -1.65 0.00 0.00 177.43 176.26 1jvn h ALA 20 N 1.55 0.26 -0.40 -0.83 0.00 -0.27 -0.23 119.26 119.34 1jvn h ALA 20 Ca 0.09 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1jvn h ALA 20 Cb 0.32 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1jvn h ALA 20 CO 0.01 -0.01 0.19 0.82 0.00 0.00 0.00 179.25 180.25 1jvn h ILE 21 N 0.09 1.18 -0.70 0.00 2.04 -0.90 -2.33 117.51 116.88 1jvn h ILE 21 Ca 0.05 -0.51 -0.06 0.00 1.00 0.00 0.00 64.86 65.34 1jvn h ILE 21 Cb 0.41 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 1jvn h ILE 21 CO 0.01 0.19 0.19 -0.33 0.00 0.00 0.00 178.15 178.21 1jvn h GLU 22 N 0.50 1.11 0.00 2.37 5.08 -1.14 -2.14 114.58 120.36 1jvn h GLU 22 Ca 0.14 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1jvn h GLU 22 Cb 0.13 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 1jvn h GLU 22 CO -0.02 0.96 -0.01 1.25 -1.00 0.00 0.00 179.01 180.20 1jvn h HIS 23 N 1.05 0.00 -0.07 4.33 2.76 -0.77 -0.32 115.15 122.13 1jvn h HIS 23 Ca 0.22 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.39 1jvn h HIS 23 Cb 0.34 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.30 1jvn h HIS 23 CO 0.03 0.01 0.00 1.28 -1.30 0.00 0.00 177.93 177.95 1jvn n LEU 24 N -4.15 1.10 0.00 0.26 4.77 -0.84 -4.91 117.00 113.23 1jvn n LEU 24 Ca -0.03 -0.42 0.00 0.00 -0.03 0.00 0.00 56.01 55.53 1jvn n LEU 24 Cb 0.09 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1jvn n LEU 24 CO 0.31 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1jvn n GLY 25 N 1.07 0.85 3.57 -0.72 0.00 -0.13 -5.09 105.19 104.74 1jvn n GLY 25 Ca 0.18 -0.49 -0.23 0.00 0.00 0.00 0.00 46.02 45.47 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 2.53 -0.14 1.61 1.51 -0.98 -4.58 117.35 115.30 1jvn s TYR 26 Ca 0.00 -0.27 -0.06 0.00 -1.01 0.00 0.00 57.07 55.73 1jvn s TYR 26 Cb 0.00 -1.11 -0.04 0.00 -0.11 0.00 0.00 41.96 40.70 1jvn s TYR 26 CO 0.00 0.66 0.09 -2.00 -1.11 0.00 0.00 175.55 173.19 1jvn s GLU 27 N -3.60 3.59 -0.13 -0.62 2.12 -1.08 -3.78 118.70 115.20 1jvn s GLU 27 Ca 0.31 -0.26 -0.10 0.00 0.36 0.00 0.00 54.97 55.28 1jvn s GLU 27 Cb -0.06 -3.14 -0.05 0.00 0.26 0.00 0.00 34.13 31.14 1jvn s GLU 27 CO 0.18 0.56 0.20 0.08 -0.54 0.00 0.00 175.26 175.73 1jvn s VAL 28 N -0.43 5.39 -0.23 3.70 1.01 -1.26 -0.80 120.40 127.78 1jvn s VAL 28 Ca 0.10 0.34 0.01 0.00 0.00 0.00 0.00 61.98 62.43 1jvn s VAL 28 Cb -0.12 -3.49 0.05 0.00 0.00 0.00 0.00 36.38 32.82 1jvn s VAL 28 CO 0.02 0.53 -0.09 -1.58 0.00 0.00 0.00 175.10 173.98 1jvn s GLN 29 N -0.42 1.93 0.11 2.72 2.00 -0.50 -4.94 119.66 120.57 1jvn s GLN 29 Ca 0.14 -1.02 -0.30 0.00 -2.00 0.00 0.00 55.36 52.18 1jvn s GLN 29 Cb -0.12 -2.60 -0.06 0.00 0.80 0.00 0.00 33.01 31.02 1jvn s GLN 29 CO 0.03 -0.53 1.01 -0.51 -0.50 0.00 0.00 175.29 174.80 1jvn s LEU 30 N 1.32 4.47 -0.41 3.68 1.43 -1.26 -0.96 118.68 126.94 1jvn s LEU 30 Ca -0.05 1.86 0.02 0.00 -1.03 0.00 0.00 54.13 54.94 1jvn s LEU 30 Cb -0.18 -3.59 0.11 0.00 0.03 0.00 0.00 46.19 42.56 1jvn s LEU 30 CO -0.07 -0.16 0.16 -0.69 0.23 0.00 0.00 176.35 175.82 1jvn s VAL 31 N 0.14 2.66 -0.20 -1.59 1.01 0.57 -4.90 120.40 118.10 1jvn s VAL 31 Ca 0.49 -2.55 0.22 0.00 0.00 0.00 0.00 61.98 60.14 1jvn s VAL 31 Cb -0.25 -2.88 -0.06 0.00 0.00 0.00 0.00 36.38 33.19 1jvn s VAL 31 CO 0.31 -0.68 0.94 0.29 0.00 0.00 0.00 175.10 175.96 1jvn n LYS 32 N 4.01 0.61 -3.86 2.72 5.02 -1.26 -0.26 118.16 125.15 1jvn n LYS 32 Ca 0.03 0.07 -0.11 0.00 -2.02 0.00 0.00 58.31 56.28 1jvn n LYS 32 Cb 0.39 -1.78 -0.10 0.00 -0.02 0.00 0.00 35.03 33.52 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 -5.24 -0.01 0.09 4.39 0.15 -1.26 -4.85 113.70 106.97 1jvn s SER 33 Ca -0.02 -0.11 0.07 0.00 0.70 0.00 0.00 55.95 56.59 1jvn s SER 33 Cb 0.10 0.23 0.38 0.00 -1.71 0.00 0.00 66.02 65.02 1jvn s SER 33 CO 0.81 -0.32 1.23 -2.65 1.20 0.00 0.00 173.24 173.51 1jvn n PRO 34 N 1.72 0.04 0.19 5.44 -0.02 -1.26 -0.04 135.00 141.07 1jvn n PRO 34 Ca -0.21 0.51 0.13 0.00 -2.02 0.00 0.00 63.50 61.91 1jvn n PRO 34 Cb 0.56 -1.63 0.31 0.00 -0.02 0.00 0.00 33.50 32.72 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 -1.96 -3.25 116.57 112.42 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 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1jvn h LYS 35 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.63 1jvn n ASP 36 N -2.80 0.00 -3.59 0.86 8.00 0.95 -4.84 116.55 115.12 1jvn n ASP 36 Ca 0.04 -0.23 -0.16 0.00 0.71 0.00 0.00 54.79 55.15 1jvn n ASP 36 Cb 0.46 -0.22 -0.07 0.00 -0.02 0.00 0.00 41.12 41.27 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 -2.45 -0.50 0.11 1.24 -0.00 -1.23 -4.89 117.98 110.26 1jvn s PHE 37 Ca 0.27 0.81 0.10 0.00 -0.00 0.00 0.00 56.93 58.10 1jvn s PHE 37 Cb 0.17 0.31 -0.04 0.00 -0.00 0.00 0.00 43.02 43.47 1jvn s PHE 37 CO 0.36 -0.55 -0.24 0.54 -0.00 0.00 0.00 175.22 175.33 1jvn s ASN 38 N -1.32 2.97 0.11 1.98 2.20 -1.26 -4.93 114.94 114.69 1jvn s ASN 38 Ca -0.11 -0.70 -0.30 0.00 -0.94 0.00 0.00 52.86 50.81 1jvn s ASN 38 Cb -0.02 -0.20 -0.09 0.00 -2.00 0.00 0.00 41.25 38.95 1jvn s ASN 38 CO 0.07 0.14 1.60 0.40 -2.94 0.00 0.00 177.10 176.37 1jvn h ILE 39 N 4.01 0.22 -0.66 0.54 1.08 -1.94 -2.88 117.51 117.88 1jvn h ILE 39 Ca -0.48 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.13 1jvn h ILE 39 Cb 1.17 0.22 -0.04 0.00 -3.07 0.00 0.00 36.82 35.10 1jvn h ILE 39 CO 0.40 0.00 0.45 0.77 -0.69 0.00 0.00 178.15 179.08 1jvn h SER 40 N -0.60 0.27 -0.36 1.72 4.64 -2.00 -2.03 113.55 115.19 1jvn h SER 40 Ca 0.03 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1jvn h SER 40 Cb 0.64 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1jvn h SER 40 CO -0.23 0.15 0.00 0.61 -0.87 0.00 0.00 176.83 176.48 1jvn n GLY 41 N -1.56 1.22 3.37 -0.77 0.00 -1.11 -4.84 105.19 101.50 1jvn n GLY 41 Ca 0.12 -0.60 -0.35 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.53 3.60 -0.03 2.61 2.01 -0.76 -4.94 115.64 116.59 1jvn s THR 42 Ca 0.36 -0.43 0.10 0.00 0.31 0.00 0.00 61.69 62.03 1jvn s THR 42 Cb 0.20 -2.63 -0.14 0.00 0.01 0.00 0.00 72.50 69.94 1jvn s THR 42 CO 0.28 0.43 0.17 -1.54 -0.69 0.00 0.00 174.62 173.27 1jvn n SER 43 N 4.53 2.71 -3.67 3.53 3.41 -1.26 -4.94 113.62 117.92 1jvn n SER 43 Ca -0.18 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.21 1jvn n SER 43 Cb 0.51 1.26 -0.18 0.00 -0.26 0.00 0.00 64.21 65.55 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 -2.57 0.11 -0.06 4.33 1.81 -1.26 -4.12 118.95 117.20 1jvn s ARG 44 Ca -0.04 0.15 0.05 0.00 -1.72 0.00 0.00 55.73 54.18 1jvn s ARG 44 Cb 0.05 -1.06 -0.01 0.00 -0.45 0.00 0.00 34.95 33.48 1jvn s ARG 44 CO 0.41 -0.44 -0.22 -1.17 -0.68 0.00 0.00 175.30 173.19 1jvn s LEU 45 N 2.11 2.23 -0.07 2.53 2.96 -0.89 -0.14 118.68 127.40 1jvn s LEU 45 Ca 0.04 -0.44 0.03 0.00 -0.22 0.00 0.00 54.13 53.54 1jvn s LEU 45 Cb -0.14 -1.42 0.01 0.00 0.50 0.00 0.00 46.19 45.14 1jvn s LEU 45 CO -0.05 0.26 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.44 1jvn s ILE 46 N -0.26 1.50 -0.81 6.68 1.01 0.46 -0.86 121.20 128.91 1jvn s ILE 46 Ca -0.00 -0.70 0.02 0.00 0.00 0.00 0.00 60.65 59.96 1jvn s ILE 46 Cb -0.13 -1.32 0.23 0.00 0.01 0.00 0.00 42.46 41.25 1jvn s ILE 46 CO 0.03 0.43 0.80 -0.11 0.00 0.00 0.00 174.94 176.09 1jvn n LEU 47 N 3.59 4.11 -4.77 2.97 7.94 0.18 -1.63 117.00 129.39 1jvn n LEU 47 Ca -0.21 -5.24 -0.35 0.00 -1.11 0.00 0.00 56.01 49.09 1jvn n LEU 47 Cb 0.52 -0.94 0.01 0.00 0.53 0.00 0.00 43.42 43.55 1jvn n LEU 47 CO 0.26 1.75 0.81 -2.16 -1.11 0.00 0.00 177.39 176.94 1jvn s PRO 48 N -1.86 3.25 -0.23 1.96 0.04 -1.26 -2.75 135.00 134.15 1jvn s PRO 48 Ca 0.31 1.70 -0.23 0.00 0.04 0.00 0.00 61.00 62.81 1jvn s PRO 48 Cb 0.01 -2.00 0.06 0.00 0.04 0.00 0.00 34.50 32.61 1jvn s PRO 48 CO -0.08 -0.95 0.65 0.20 0.04 0.00 0.00 177.00 176.86 1jvn s GLY 49 N -1.68 -0.49 0.03 0.56 0.00 -1.08 -4.67 107.32 99.99 1jvn s GLY 49 Ca 0.74 1.80 -0.03 0.00 0.00 0.00 0.00 44.72 47.23 1jvn s GLY 49 CO 0.29 1.54 0.04 -1.34 0.00 0.00 0.00 173.10 173.64 1jvn s VAL 50 N 0.26 0.13 0.00 1.40 -7.23 -1.26 -3.08 120.40 110.61 1jvn s VAL 50 Ca -0.01 -1.08 0.00 0.00 -1.81 0.00 0.00 61.98 59.09 1jvn s VAL 50 Cb -0.04 -0.71 0.00 0.00 0.56 0.00 0.00 36.38 36.18 1jvn s VAL 50 CO 0.01 -0.59 0.00 0.61 -0.31 0.00 0.00 175.10 174.82 1jvn n GLY 51 N 1.04 -2.39 3.50 2.32 0.00 -1.26 -4.70 105.19 103.70 1jvn n GLY 51 Ca -0.20 -1.68 -0.53 0.00 0.00 0.00 0.00 46.02 43.61 1jvn n GLY 51 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1jvn n ASN 52 N 0.11 0.07 0.16 1.61 2.85 -0.97 -4.82 115.26 114.28 1jvn n ASN 52 Ca 0.00 1.15 -0.14 0.00 -0.11 0.00 0.00 54.58 55.47 1jvn n ASN 52 Cb 0.00 -1.02 -0.07 0.00 1.24 0.00 0.00 39.78 39.93 1jvn n ASN 52 CO 0.00 0.00 0.00 0.22 -2.11 0.00 0.00 177.26 175.37 1jvn h TYR 53 N 2.57 -0.90 -0.94 1.20 3.20 -1.91 -1.95 116.97 118.24 1jvn h TYR 53 Ca -0.42 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.47 1jvn h TYR 53 Cb 1.41 0.37 -0.05 0.00 1.54 0.00 0.00 36.73 40.00 1jvn h TYR 53 CO 0.52 -0.46 0.62 0.78 -1.64 0.00 0.00 178.16 177.99 1jvn h GLY 54 N -0.63 1.32 0.73 1.82 0.00 -1.90 0.16 103.07 104.58 1jvn h GLY 54 Ca 0.00 -0.49 0.09 0.00 0.00 0.00 0.00 47.33 46.93 1jvn h GLY 54 CO -0.13 0.48 0.58 0.84 0.00 0.00 0.00 176.54 178.32 1jvn h HIS 55 N 1.28 0.98 0.00 5.60 -0.00 -1.81 0.14 115.15 121.33 1jvn h HIS 55 Ca 0.35 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.73 1jvn h HIS 55 Cb -0.15 -0.32 -0.00 0.00 -0.00 0.00 0.00 27.41 26.94 1jvn h HIS 55 CO -0.01 0.46 -0.11 0.35 -0.00 0.00 0.00 177.93 178.62 1jvn h PHE 56 N 0.91 0.00 -0.96 5.26 3.57 -0.80 -3.27 116.94 121.65 1jvn h PHE 56 Ca 0.41 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.92 1jvn h PHE 56 Cb 0.38 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.07 1jvn h PHE 56 CO -0.00 0.38 0.63 0.28 -2.23 0.00 0.00 178.31 177.36 1jvn h VAL 57 N -1.00 1.25 -0.37 1.41 2.07 -0.92 0.86 116.25 119.55 1jvn h VAL 57 Ca -0.02 -0.47 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 1jvn h VAL 57 Cb 0.41 -0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 1jvn h VAL 57 CO -0.01 0.25 0.17 0.44 0.02 0.00 0.00 177.57 178.44 1jvn h ASP 58 N 1.31 0.48 0.08 0.57 3.32 -0.92 -0.06 116.42 121.21 1jvn h ASP 58 Ca 0.35 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 1jvn h ASP 58 Cb -0.13 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.29 1jvn h ASP 58 CO -0.07 0.48 -0.04 -1.13 -1.72 0.00 0.00 179.24 176.75 1jvn h ASN 59 N 0.45 -0.09 -0.41 6.45 -0.73 -1.51 0.75 115.58 120.48 1jvn h ASN 59 Ca 0.13 -0.02 0.05 0.00 1.87 0.00 0.00 56.30 58.32 1jvn h ASN 59 Cb 0.13 0.02 -0.04 0.00 0.27 0.00 0.00 38.32 38.70 1jvn h ASN 59 CO -0.02 -0.04 0.16 0.25 -0.37 0.00 0.00 177.43 177.41 1jvn h LEU 60 N -0.14 0.19 -0.34 0.34 5.85 -0.62 -1.85 115.31 118.73 1jvn h LEU 60 Ca -0.01 0.04 -0.19 0.00 0.84 0.00 0.00 57.88 58.56 1jvn h LEU 60 Cb 0.11 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1jvn h LEU 60 CO 0.02 0.14 -0.83 -0.26 -0.34 0.00 0.00 178.44 177.17 1jvn h PHE 61 N 0.33 0.29 -0.63 1.25 -1.00 -0.93 -2.58 116.94 113.68 1jvn h PHE 61 Ca 0.19 -0.15 -0.03 0.00 2.81 0.00 0.00 57.97 60.78 1jvn h PHE 61 Cb 0.16 -0.04 -0.03 0.00 3.61 0.00 0.00 35.95 39.65 1jvn h PHE 61 CO -0.14 0.94 0.27 -0.91 -1.61 0.00 0.00 178.31 176.86 1jvn h ASN 62 N 0.12 0.83 0.24 2.17 2.35 -0.59 -1.08 115.58 119.63 1jvn h ASN 62 Ca -0.04 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.61 1jvn h ASN 62 Cb 1.44 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 39.59 1jvn h ASN 62 CO 0.13 0.74 0.00 0.54 -1.65 0.00 0.00 177.43 177.18 1jvn n ARG 63 N -4.32 0.53 -2.01 0.81 1.74 -0.72 -4.90 116.66 107.79 1jvn n ARG 63 Ca 0.06 0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 1jvn n ARG 63 Cb 0.16 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.10 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 0.64 0.41 0.11 -0.13 0.00 -0.41 -4.40 105.19 101.41 1jvn n GLY 64 Ca 0.14 -0.87 0.12 0.00 0.00 0.00 0.00 46.02 45.41 1jvn n GLY 64 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1jvn h PHE 65 N 0.00 0.00 0.10 1.61 -1.00 -1.62 -3.40 116.94 112.63 1jvn h PHE 65 Ca 0.00 0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.79 1jvn h PHE 65 Cb 0.99 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.51 1jvn h PHE 65 CO 0.00 0.00 -0.51 1.49 -1.61 0.00 0.00 178.31 177.68 1jvn h GLU 66 N 0.00 -0.69 0.06 1.51 4.81 -1.84 -0.44 114.58 117.99 1jvn h GLU 66 Ca 0.00 0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1jvn h GLU 66 Cb 0.84 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.36 1jvn h GLU 66 CO 0.00 -0.46 -0.13 0.87 -0.73 0.00 0.00 179.01 178.56 1jvn h LYS 67 N -0.72 -0.24 -0.02 1.92 1.57 -1.98 -0.52 116.57 116.57 1jvn h LYS 67 Ca -0.00 0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1jvn h LYS 67 Cb 0.73 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.09 1jvn h LYS 67 CO -0.29 -0.16 0.02 -1.00 -0.57 0.00 0.00 179.45 177.45 1jvn h PRO 68 N -0.25 0.00 -0.06 3.15 0.13 -1.76 0.23 132.00 133.44 1jvn h PRO 68 Ca 0.03 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.01 1jvn h PRO 68 Cb 0.28 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.42 1jvn h PRO 68 CO -0.08 0.00 -0.54 0.82 -0.23 0.00 0.00 178.00 177.97 1jvn h ILE 69 N 0.00 1.39 -0.46 -3.56 2.04 -0.43 -1.83 117.51 114.66 1jvn h ILE 69 Ca 0.01 -1.93 -0.06 0.00 1.00 0.00 0.00 64.86 63.88 1jvn h ILE 69 Cb 0.04 2.37 -0.02 0.00 -0.74 0.00 0.00 36.82 38.48 1jvn h ILE 69 CO -0.00 0.57 0.04 0.03 0.00 0.00 0.00 178.15 178.79 1jvn h ARG 70 N 0.01 0.78 -0.64 2.37 3.08 -0.51 -0.92 114.38 118.56 1jvn h ARG 70 Ca -0.05 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 59.75 1jvn h ARG 70 Cb 1.21 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 31.15 1jvn h ARG 70 CO 0.11 0.82 0.33 0.93 -1.07 0.00 0.00 179.97 181.09 1jvn h GLU 71 N 0.64 0.91 -0.67 0.04 5.08 -0.63 0.81 114.58 120.75 1jvn h GLU 71 Ca 0.13 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 1jvn h GLU 71 Cb 0.44 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 1jvn h GLU 71 CO 0.02 0.71 0.21 -0.92 -1.00 0.00 0.00 179.01 178.03 1jvn h TYR 72 N 0.88 1.08 -0.67 4.33 3.20 -1.17 -1.38 116.97 123.23 1jvn h TYR 72 Ca 0.22 -0.11 -0.07 0.00 3.14 0.00 0.00 58.73 61.91 1jvn h TYR 72 Cb 0.08 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 38.01 1jvn h TYR 72 CO -0.00 0.87 0.13 0.82 -1.64 0.00 0.00 178.16 178.33 1jvn h ILE 73 N 0.97 1.26 0.00 1.81 2.04 -0.65 -2.41 117.51 120.53 1jvn h ILE 73 Ca 0.22 -1.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 1jvn h ILE 73 Cb 0.29 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 1jvn h ILE 73 CO -0.01 0.38 -0.06 -0.33 0.00 0.00 0.00 178.15 178.13 1jvn h GLU 74 N 1.02 0.00 0.00 2.37 5.08 -0.43 -1.99 114.58 120.63 1jvn h GLU 74 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1jvn h GLU 74 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1jvn h GLU 74 CO 0.01 0.06 0.00 -1.13 -1.00 0.00 0.00 179.01 176.95 1jvn n SER 75 N -3.19 0.72 0.00 1.42 3.41 -0.56 -4.89 113.62 110.53 1jvn n SER 75 Ca 0.00 0.66 0.00 0.00 -0.26 0.00 0.00 58.87 59.28 1jvn n SER 75 Cb 0.32 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 63.45 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 0.15 0.71 3.88 5.00 0.00 -0.75 -5.05 105.19 109.13 1jvn n GLY 76 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.12 3.78 0.17 1.61 1.02 -1.25 -4.71 119.74 120.23 1jvn s LYS 77 Ca 0.00 0.39 -0.32 0.00 0.02 0.00 0.00 55.97 56.06 1jvn s LYS 77 Cb 0.00 -2.46 -0.11 0.00 -0.52 0.00 0.00 37.83 34.74 1jvn s LYS 77 CO 0.00 0.05 1.76 -2.14 -0.92 0.00 0.00 175.35 174.10 1jvn s PRO 78 N -3.64 4.14 -0.02 -1.68 0.02 -1.26 -4.76 135.00 127.80 1jvn s PRO 78 Ca 0.50 2.58 0.03 0.00 0.02 0.00 0.00 61.00 64.13 1jvn s PRO 78 Cb -0.10 -3.30 -0.00 0.00 0.02 0.00 0.00 34.50 31.11 1jvn s PRO 78 CO 0.29 -0.78 -0.09 -1.50 -0.33 0.00 0.00 177.00 174.59 1jvn s ILE 79 N 1.84 0.77 -0.10 2.83 2.07 -0.82 -2.10 121.20 125.69 1jvn s ILE 79 Ca 0.77 -0.38 0.01 0.00 -1.41 0.00 0.00 60.65 59.64 1jvn s ILE 79 Cb -0.48 -0.67 0.02 0.00 0.13 0.00 0.00 42.46 41.46 1jvn s ILE 79 CO 0.34 0.23 -0.12 -0.32 -1.91 0.00 0.00 174.94 173.16 1jvn s MET 80 N -0.00 1.85 -0.04 3.50 -2.45 -0.04 -1.39 119.30 120.73 1jvn s MET 80 Ca 0.00 -0.42 -0.02 0.00 -1.25 0.00 0.00 55.69 54.00 1jvn s MET 80 Cb -0.06 -1.67 -0.04 0.00 1.25 0.00 0.00 34.83 34.30 1jvn s MET 80 CO 0.00 -0.12 0.09 0.20 1.05 0.00 0.00 175.02 176.24 1jvn s GLY 81 N 1.19 2.04 -0.04 2.11 0.00 -0.07 0.48 107.32 113.03 1jvn s GLY 81 Ca -0.04 -0.80 0.06 0.00 0.00 0.00 0.00 44.72 43.94 1jvn s GLY 81 CO -0.03 -0.64 0.96 1.39 0.00 0.00 0.00 173.10 174.78 1jvn n ILE 82 N 1.44 0.93 0.00 0.90 5.41 -1.11 -0.95 119.36 125.98 1jvn n ILE 82 Ca -0.15 -1.05 0.00 0.00 1.00 0.00 0.00 62.75 62.55 1jvn n ILE 82 Cb 0.53 0.36 0.00 0.00 -0.71 0.00 0.00 39.64 39.82 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 -0.62 0.00 0.18 1.39 0.31 -1.18 -2.62 118.33 115.79 1jvn n VAL 84 Ca 0.05 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.40 1jvn n VAL 84 Cb 0.49 0.00 0.35 0.00 -0.91 0.00 0.00 33.84 33.78 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 0.01 0.50 2.92 0.00 -1.77 -0.06 103.07 104.68 1jvn h GLY 85 Ca 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 47.33 47.20 1jvn h GLY 85 CO 0.00 0.01 -0.52 -2.00 0.00 0.00 0.00 176.54 174.03 1jvn h LEU 86 N 0.01 0.33 -2.16 3.11 6.46 -1.77 -3.32 115.31 117.97 1jvn h LEU 86 Ca -0.00 -0.92 -0.01 0.00 -0.12 0.00 0.00 57.88 56.83 1jvn h LEU 86 Cb 0.66 -0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 40.49 1jvn h LEU 86 CO 0.05 1.22 -0.04 1.56 -0.62 0.00 0.00 178.44 180.61 1jvn h GLN 87 N -0.51 0.00 0.00 1.25 4.20 -1.87 -1.40 115.11 116.78 1jvn h GLN 87 Ca -0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1jvn h GLN 87 Cb 1.36 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.14 1jvn h GLN 87 CO 0.10 0.04 0.00 0.00 -0.67 0.00 0.00 178.83 178.29 1jvn h ALA 88 N 1.96 1.00 0.00 3.87 0.00 -1.10 -2.09 119.26 122.91 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 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1jvn h ALA 88 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 179.25 179.18 1jvn h LEU 89 N 0.00 0.00 0.00 0.00 3.38 -1.41 0.37 115.31 117.66 1jvn h LEU 89 Ca 0.00 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.53 1jvn h LEU 89 Cb 0.31 0.00 0.12 0.00 0.09 0.00 0.00 40.66 41.18 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 -2.49 -3.38 0.22 1.13 3.01 -0.79 0.59 117.46 115.76 1jvn n PHE 90 Ca 0.05 -1.48 0.09 0.00 1.01 0.00 0.00 57.45 57.11 1jvn n PHE 90 Cb 0.45 -0.83 0.51 0.00 -0.01 0.00 0.00 39.48 39.60 1jvn n PHE 90 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1jvn h ALA 91 N -1.10 1.18 0.00 4.37 0.00 -1.17 -1.94 119.26 120.60 1jvn h ALA 91 Ca -0.36 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1jvn h ALA 91 Cb 1.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1jvn h ALA 91 CO 0.33 0.31 0.00 0.41 0.00 0.00 0.00 179.25 180.30 1jvn n GLY 92 N -0.25 -0.84 3.14 0.00 0.00 -1.26 -2.44 105.19 103.55 1jvn n GLY 92 Ca -0.01 -1.20 -0.13 0.00 0.00 0.00 0.00 46.02 44.68 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 -0.28 0.23 1.61 0.15 -1.26 -1.57 113.70 108.58 1jvn s SER 93 Ca 0.00 0.55 0.17 0.00 0.70 0.00 0.00 55.95 57.36 1jvn s SER 93 Cb 0.00 0.53 0.87 0.00 -1.71 0.00 0.00 66.02 65.71 1jvn s SER 93 CO 0.00 -0.11 1.52 0.52 1.20 0.00 0.00 173.24 176.37 1jvn n VAL 94 N 3.18 1.22 -0.09 4.45 0.31 -0.14 -1.28 118.33 125.98 1jvn n VAL 94 Ca -0.15 0.61 -0.12 0.00 -0.01 0.00 0.00 64.34 64.67 1jvn n VAL 94 Cb 0.57 -1.59 0.01 0.00 -0.91 0.00 0.00 33.84 31.93 1jvn n VAL 94 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1jvn h GLU 95 N 0.00 0.84 -2.75 5.55 4.81 -1.96 -3.35 114.58 117.72 1jvn h GLU 95 Ca 0.00 -0.44 -0.60 0.00 -0.13 0.00 0.00 59.36 58.19 1jvn h GLU 95 Cb 0.05 0.01 -0.40 0.00 0.63 0.00 0.00 28.75 29.05 1jvn h GLU 95 CO 0.00 1.08 -0.79 -1.12 -0.73 0.00 0.00 179.01 177.45 1jvn s SER 96 N -6.85 3.10 0.48 1.04 0.01 -0.41 -4.91 113.70 106.16 1jvn s SER 96 Ca -0.10 -3.16 0.19 0.00 1.31 0.00 0.00 55.95 54.19 1jvn s SER 96 Cb 0.11 -0.95 1.20 0.00 0.21 0.00 0.00 66.02 66.60 1jvn s SER 96 CO 0.87 -0.17 1.99 -0.65 0.41 0.00 0.00 173.24 175.68 1jvn h PRO 97 N 5.90 0.20 0.00 12.44 0.11 -1.68 -1.51 132.00 147.47 1jvn h PRO 97 Ca 0.15 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1jvn h PRO 97 Cb 0.87 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.93 1jvn h PRO 97 CO 0.50 0.13 -0.57 1.63 -0.21 0.00 0.00 178.00 179.49 1jvn n LYS 98 N -4.44 0.24 -1.85 1.05 5.02 -1.26 -4.90 118.16 112.02 1jvn n LYS 98 Ca 0.09 0.07 -0.32 0.00 -2.02 0.00 0.00 58.31 56.14 1jvn n LYS 98 Cb 0.46 -1.65 0.03 0.00 -0.02 0.00 0.00 35.03 33.85 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 -4.00 5.52 0.47 4.39 0.01 -0.57 -5.07 113.70 114.46 1jvn s SER 99 Ca 0.07 1.79 0.05 0.00 1.31 0.00 0.00 55.95 59.18 1jvn s SER 99 Cb 0.14 -2.53 -0.02 0.00 0.21 0.00 0.00 66.02 63.83 1jvn s SER 99 CO 0.71 -1.34 0.21 0.28 0.41 0.00 0.00 173.24 173.50 1jvn s THR 100 N -2.61 1.86 0.34 1.44 -1.32 -1.26 -4.63 115.64 109.46 1jvn s THR 100 Ca 0.62 -1.70 0.04 0.00 -1.21 0.00 0.00 61.69 59.44 1jvn s THR 100 Cb -0.16 -2.56 -0.03 0.00 -1.51 0.00 0.00 72.50 68.24 1jvn s THR 100 CO 0.43 0.00 0.16 -0.83 -2.21 0.00 0.00 174.62 172.17 1jvn s GLY 101 N -4.01 2.26 0.35 6.08 0.00 -1.02 -4.74 107.32 106.25 1jvn s GLY 101 Ca 0.31 -1.64 0.27 0.00 0.00 0.00 0.00 44.72 43.66 1jvn s GLY 101 CO 0.18 -1.67 1.80 1.41 0.00 0.00 0.00 173.10 174.82 1jvn h LEU 102 N 2.06 0.00 1.94 0.66 3.38 -0.10 -3.46 115.31 119.79 1jvn h LEU 102 Ca -0.34 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.22 1jvn h LEU 102 Cb 1.25 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.03 1jvn h LEU 102 CO 0.53 0.00 -0.57 -3.20 0.09 0.00 0.00 178.44 175.29 1jvn n ASN 103 N -2.48 -6.03 0.12 -0.43 5.15 -0.74 -4.89 115.26 105.96 1jvn n ASN 103 Ca 0.01 -0.16 -0.02 0.00 -0.60 0.00 0.00 54.58 53.81 1jvn n ASN 103 Cb 0.21 -4.93 0.18 0.00 -0.53 0.00 0.00 39.78 34.71 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 -0.73 0.13 -3.52 1.20 -1.99 -0.10 -3.39 116.97 108.58 1jvn h TYR 104 Ca -0.51 -0.05 -0.67 0.00 2.00 0.00 0.00 58.73 59.50 1jvn h TYR 104 Cb 1.37 -0.03 -0.31 0.00 2.00 0.00 0.00 36.73 39.76 1jvn h TYR 104 CO 0.54 0.64 -0.73 0.42 -0.00 0.00 0.00 178.16 179.02 1jvn s ILE 105 N -3.80 2.98 -1.56 -2.88 1.01 -0.85 -5.03 121.20 111.07 1jvn s ILE 105 Ca -0.03 -0.99 -0.10 0.00 0.00 0.00 0.00 60.65 59.53 1jvn s ILE 105 Cb 0.13 -2.52 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 1jvn s ILE 105 CO 0.77 0.19 2.76 -0.90 0.00 0.00 0.00 174.94 177.76 1jvn n ASP 106 N 4.69 7.88 -3.48 3.58 5.75 -1.26 -1.83 116.55 131.87 1jvn n ASP 106 Ca -0.16 -2.69 -0.14 0.00 -0.01 0.00 0.00 54.79 51.78 1jvn n ASP 106 Cb 0.47 -1.55 -0.04 0.00 -1.03 0.00 0.00 41.12 38.97 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 1.89 -0.58 0.19 2.11 -0.12 -1.26 -4.89 117.98 115.32 1jvn s PHE 107 Ca 0.64 0.71 0.01 0.00 -0.05 0.00 0.00 56.93 58.24 1jvn s PHE 107 Cb 0.17 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 43.01 1jvn s PHE 107 CO -0.07 -0.70 0.35 0.15 -0.05 0.00 0.00 175.22 174.90 1jvn s LYS 108 N -2.41 3.48 0.29 1.99 1.02 -1.26 -2.74 119.74 120.11 1jvn s LYS 108 Ca -0.04 -0.47 -0.29 0.00 0.02 0.00 0.00 55.97 55.18 1jvn s LYS 108 Cb -0.01 -2.89 -0.10 0.00 -0.52 0.00 0.00 37.83 34.32 1jvn s LYS 108 CO -0.02 0.45 1.14 -0.51 -0.92 0.00 0.00 175.35 175.49 1jvn s LEU 109 N -3.35 4.52 0.34 3.17 1.02 -0.61 -4.82 118.68 118.96 1jvn s LEU 109 Ca 0.37 2.36 0.07 0.00 0.02 0.00 0.00 54.13 56.95 1jvn s LEU 109 Cb -0.11 -3.64 -0.07 0.00 0.02 0.00 0.00 46.19 42.39 1jvn s LEU 109 CO 0.29 -0.23 -0.03 -0.94 0.02 0.00 0.00 176.35 175.46 1jvn s SER 110 N -0.80 3.31 0.26 2.29 1.04 -0.10 -0.97 113.70 118.73 1jvn s SER 110 Ca 0.46 -1.28 -0.25 0.00 0.48 0.00 0.00 55.95 55.36 1jvn s SER 110 Cb -0.34 -0.28 -0.09 0.00 0.10 0.00 0.00 66.02 65.42 1jvn s SER 110 CO 0.43 -0.38 0.85 -0.60 0.98 0.00 0.00 173.24 174.53 1jvn s ARG 111 N -3.72 4.52 0.55 4.02 3.52 -1.26 -0.66 118.95 125.93 1jvn s ARG 111 Ca 0.33 1.19 -0.21 0.00 -0.13 0.00 0.00 55.73 56.92 1jvn s ARG 111 Cb 0.06 -2.96 -0.05 0.00 -1.56 0.00 0.00 34.95 30.44 1jvn s ARG 111 CO 0.16 0.39 1.26 -0.06 -0.81 0.00 0.00 175.30 176.24 1jvn s PHE 112 N -1.45 2.43 -0.39 5.12 2.99 -0.49 -4.92 117.98 121.26 1jvn s PHE 112 Ca 0.44 1.47 -0.28 0.00 0.00 0.00 0.00 56.93 58.56 1jvn s PHE 112 Cb -0.20 -3.59 -0.01 0.00 0.00 0.00 0.00 43.02 39.23 1jvn s PHE 112 CO 0.24 -2.36 1.64 0.34 -0.00 0.00 0.00 175.22 175.08 1jvn s ASP 113 N -1.31 6.03 0.00 1.36 3.68 -1.26 -4.88 116.67 120.29 1jvn s ASP 113 Ca 0.73 1.00 0.22 0.00 2.13 0.00 0.00 52.55 56.64 1jvn s ASP 113 Cb -0.34 -2.53 0.98 0.00 -1.45 0.00 0.00 42.92 39.58 1jvn s ASP 113 CO 0.39 -1.65 1.67 -0.90 0.13 0.00 0.00 175.17 174.81 1jvn n ASP 114 N 9.86 1.07 0.22 -0.34 5.68 -1.26 -3.81 116.55 127.96 1jvn n ASP 114 Ca 0.20 -1.55 0.11 0.00 -0.50 0.00 0.00 54.79 53.06 1jvn n ASP 114 Cb 0.48 -0.05 0.29 0.00 -1.14 0.00 0.00 41.12 40.70 1jvn n ASP 114 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1jvn h SER 115 N 1.48 0.00 0.00 -1.12 4.64 -1.99 -3.32 113.55 113.23 1jvn h SER 115 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1jvn h SER 115 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1jvn h SER 115 CO 0.00 0.10 -1.19 -1.84 -0.87 0.00 0.00 176.83 173.04 1jvn n GLU 116 N -3.15 1.23 -3.61 4.77 0.28 -1.25 -5.07 120.64 113.84 1jvn n GLU 116 Ca 0.02 -0.07 -0.11 0.00 -0.16 0.00 0.00 57.16 56.85 1jvn n GLU 116 Cb 0.50 -1.16 -0.03 0.00 1.43 0.00 0.00 31.44 32.18 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 -2.48 1.28 0.30 3.44 -2.85 -1.25 -5.05 119.74 113.13 1jvn s LYS 117 Ca -0.02 -0.69 -0.29 0.00 -1.00 0.00 0.00 55.97 53.97 1jvn s LYS 117 Cb 0.07 0.54 -0.10 0.00 -2.06 0.00 0.00 37.83 36.27 1jvn s LYS 117 CO 0.40 -0.54 1.38 -2.14 0.10 0.00 0.00 175.35 174.56 1jvn s PRO 118 N -3.81 4.29 -0.08 1.78 0.02 -1.25 -4.34 135.00 131.60 1jvn s PRO 118 Ca 0.05 2.30 0.03 0.00 0.02 0.00 0.00 61.00 63.40 1jvn s PRO 118 Cb -0.00 -3.07 0.01 0.00 0.02 0.00 0.00 34.50 31.45 1jvn s PRO 118 CO -0.08 -0.33 -0.18 0.08 -0.33 0.00 0.00 177.00 176.16 1jvn s VAL 119 N -0.68 1.60 0.66 3.83 1.01 -1.21 -4.19 120.40 121.43 1jvn s VAL 119 Ca 0.54 -0.76 -0.14 0.00 0.00 0.00 0.00 61.98 61.62 1jvn s VAL 119 Cb -0.41 -1.41 -0.00 0.00 0.00 0.00 0.00 36.38 34.55 1jvn s VAL 119 CO 0.50 0.46 1.08 -2.16 0.00 0.00 0.00 175.10 174.98 1jvn s PRO 120 N 0.47 2.94 0.01 2.72 0.04 -1.26 -4.51 135.00 135.41 1jvn s PRO 120 Ca -0.16 1.20 -0.30 0.00 0.04 0.00 0.00 61.00 61.77 1jvn s PRO 120 Cb -0.17 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.33 1jvn s PRO 120 CO 0.06 -1.12 1.49 -2.00 0.04 0.00 0.00 177.00 175.47 1jvn s GLU 121 N -4.41 4.25 -0.19 4.56 2.12 0.11 -4.78 118.70 120.35 1jvn s GLU 121 Ca 0.63 2.08 -0.02 0.00 0.36 0.00 0.00 54.97 58.01 1jvn s GLU 121 Cb -0.17 -3.61 0.06 0.00 0.26 0.00 0.00 34.13 30.67 1jvn s GLU 121 CO 0.45 -0.64 0.03 0.42 -0.54 0.00 0.00 175.26 174.97 1jvn s ILE 122 N 2.60 0.60 -5.00 -3.70 1.01 -1.26 -1.53 121.20 113.92 1jvn s ILE 122 Ca 0.67 -0.57 0.00 0.00 0.00 0.00 0.00 60.65 60.75 1jvn s ILE 122 Cb -0.34 -1.07 0.00 0.00 0.01 0.00 0.00 42.46 41.07 1jvn s ILE 122 CO 0.28 -0.17 0.00 0.61 0.00 0.00 0.00 174.94 175.66 1jvn n GLY 123 N 5.02 -0.36 3.40 6.18 0.00 -0.13 -5.02 105.19 114.29 1jvn n GLY 123 Ca -0.09 -1.48 -0.42 0.00 0.00 0.00 0.00 46.02 44.03 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 -2.69 3.25 0.54 1.61 0.52 -1.26 0.05 118.94 120.97 1jvn s TRP 124 Ca 0.00 -0.86 0.04 0.00 0.02 0.00 0.00 56.10 55.31 1jvn s TRP 124 Cb 0.00 -2.69 0.03 0.00 -1.15 0.00 0.00 33.47 29.65 1jvn s TRP 124 CO 0.00 -0.67 0.32 1.21 0.02 0.00 0.00 176.95 177.82 1jvn s ASN 125 N 1.87 4.52 0.16 2.95 3.84 -0.71 -2.07 114.94 125.49 1jvn s ASN 125 Ca 0.04 -1.34 0.04 0.00 0.21 0.00 0.00 52.86 51.81 1jvn s ASN 125 Cb -0.20 0.46 -0.05 0.00 -0.55 0.00 0.00 41.25 40.91 1jvn s ASN 125 CO 0.08 -1.06 -0.09 -0.94 -2.79 0.00 0.00 177.10 172.30 1jvn s SER 126 N -4.20 1.83 0.04 -4.21 1.04 -1.26 -1.61 113.70 105.33 1jvn s SER 126 Ca 0.27 -1.04 -0.24 0.00 0.48 0.00 0.00 55.95 55.42 1jvn s SER 126 Cb -0.01 -0.01 -0.06 0.00 0.10 0.00 0.00 66.02 66.04 1jvn s SER 126 CO 0.17 -0.35 0.73 0.00 0.98 0.00 0.00 173.24 174.76 1jvn s ILE 128 N -0.12 3.02 0.26 0.00 1.01 0.15 -4.22 121.20 121.30 1jvn s ILE 128 Ca 0.37 0.86 -0.31 0.00 0.00 0.00 0.00 60.65 61.57 1jvn s ILE 128 Cb -0.20 -3.55 -0.12 0.00 0.01 0.00 0.00 42.46 38.60 1jvn s ILE 128 CO 0.22 0.14 1.64 -2.65 0.00 0.00 0.00 174.94 174.29 1jvn n PRO 129 N 2.30 2.70 -3.82 2.79 -0.02 -1.26 -4.66 135.00 133.03 1jvn n PRO 129 Ca 0.05 0.96 -0.09 0.00 -2.02 0.00 0.00 63.50 62.40 1jvn n PRO 129 Cb 0.42 -2.77 -0.04 0.00 -0.02 0.00 0.00 33.50 31.09 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 0.73 -0.18 0.00 2.55 1.04 -1.26 -5.04 113.70 111.54 1jvn s SER 130 Ca 0.68 -0.62 0.30 0.00 0.48 0.00 0.00 55.95 56.80 1jvn s SER 130 Cb -0.51 0.56 1.54 0.00 0.10 0.00 0.00 66.02 67.71 1jvn s SER 130 CO 0.43 -1.05 2.02 -0.62 0.98 0.00 0.00 173.24 174.99 1jvn n GLU 131 N -0.33 1.17 -0.75 4.02 -0.58 -1.26 -4.12 120.64 118.79 1jvn n GLU 131 Ca -0.08 -0.35 0.05 0.00 -0.42 0.00 0.00 57.16 56.36 1jvn n GLU 131 Cb 0.62 -1.49 0.09 0.00 -0.57 0.00 0.00 31.44 30.09 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 -0.61 1.23 -4.60 1.62 3.02 -1.26 -5.06 115.26 109.60 1jvn n ASN 132 Ca 0.21 -2.73 -0.29 0.00 -0.03 0.00 0.00 54.58 51.74 1jvn n ASN 132 Cb 0.21 -0.36 0.20 0.00 -0.61 0.00 0.00 39.78 39.22 1jvn n ASN 132 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1jvn s LEU 133 N -1.44 1.65 0.19 3.41 1.43 -1.26 -4.68 118.68 117.99 1jvn s LEU 133 Ca 0.27 1.60 -0.11 0.00 -1.03 0.00 0.00 54.13 54.86 1jvn s LEU 133 Cb 0.27 -3.75 -0.00 0.00 0.03 0.00 0.00 46.19 42.74 1jvn s LEU 133 CO -0.07 -3.49 0.37 0.72 0.23 0.00 0.00 176.35 174.11 1jvn s PHE 134 N -2.67 0.36 -1.73 0.29 -0.12 -1.26 -4.94 117.98 107.90 1jvn s PHE 134 Ca 0.66 -0.71 -0.18 0.00 -0.05 0.00 0.00 56.93 56.65 1jvn s PHE 134 Cb -0.22 0.05 0.16 0.00 -0.63 0.00 0.00 43.02 42.38 1jvn s PHE 134 CO 0.61 -0.82 0.72 1.19 -0.05 0.00 0.00 175.22 176.86 1jvn n PHE 135 N -0.28 -1.61 -0.88 3.49 3.01 -1.26 -1.45 117.46 118.48 1jvn n PHE 135 Ca -0.05 0.77 0.00 0.00 1.01 0.00 0.00 57.45 59.18 1jvn n PHE 135 Cb 0.63 -2.76 0.00 0.00 -0.01 0.00 0.00 39.48 37.34 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 -1.39 0.57 3.70 1.37 0.00 -1.26 -4.58 105.19 103.61 1jvn n GLY 136 Ca 0.06 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.53 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 2.67 -4.25 0.99 4.77 -0.53 -4.92 117.00 115.73 1jvn n LEU 137 Ca 0.00 1.05 -0.35 0.00 -0.03 0.00 0.00 56.01 56.68 1jvn n LEU 137 Cb 0.05 -1.20 -0.14 0.00 -2.33 0.00 0.00 43.42 39.80 1jvn n LEU 137 CO 0.00 -0.33 -0.37 -0.62 -1.33 0.00 0.00 177.39 174.73 1jvn s ASP 138 N 3.66 4.49 0.47 -1.43 -1.08 -1.26 -4.74 116.67 116.78 1jvn s ASP 138 Ca 0.97 -0.75 0.32 0.00 -0.52 0.00 0.00 52.55 52.57 1jvn s ASP 138 Cb -0.97 -1.73 1.70 0.00 -1.46 0.00 0.00 42.92 40.47 1jvn s ASP 138 CO 0.62 -0.12 1.98 -0.65 0.52 0.00 0.00 175.17 177.51 1jvn h PRO 139 N 8.08 0.00 -0.59 4.34 0.11 -1.92 -1.88 132.00 140.14 1jvn h PRO 139 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1jvn h PRO 139 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 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 -2.64 0.79 -4.36 0.65 4.02 -1.26 -4.57 117.16 109.78 1jvn n TYR 140 Ca -0.02 -0.39 -0.28 0.00 -0.01 0.00 0.00 57.90 57.20 1jvn n TYR 140 Cb 0.07 0.00 -0.07 0.00 -0.02 0.00 0.00 39.34 39.32 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 -1.21 2.16 0.06 -0.72 1.02 -0.71 -4.85 119.74 115.48 1jvn s LYS 141 Ca 0.45 -2.06 0.08 0.00 0.02 0.00 0.00 55.97 54.45 1jvn s LYS 141 Cb 0.24 -1.81 -0.03 0.00 -0.52 0.00 0.00 37.83 35.72 1jvn s LYS 141 CO 0.33 -0.22 -0.21 1.03 -0.92 0.00 0.00 175.35 175.35 1jvn s ARG 142 N -3.90 1.37 0.09 1.68 1.81 -1.26 -4.64 118.95 114.10 1jvn s ARG 142 Ca 0.30 -1.01 0.08 0.00 -1.72 0.00 0.00 55.73 53.38 1jvn s ARG 142 Cb 0.04 -1.53 -0.03 0.00 -0.45 0.00 0.00 34.95 32.98 1jvn s ARG 142 CO 0.17 0.38 -0.20 0.71 -0.68 0.00 0.00 175.30 175.68 1jvn s TYR 143 N -0.88 1.75 -0.31 -0.53 1.51 -0.63 -4.80 117.35 113.45 1jvn s TYR 143 Ca 0.08 -0.41 -0.23 0.00 -1.01 0.00 0.00 57.07 55.50 1jvn s TYR 143 Cb -0.09 -0.97 -0.00 0.00 -0.11 0.00 0.00 41.96 40.79 1jvn s TYR 143 CO 0.02 0.18 0.75 -0.47 -1.11 0.00 0.00 175.55 174.93 1jvn s TYR 144 N -1.12 3.20 -0.06 2.71 5.04 -1.26 -1.74 117.35 124.12 1jvn s TYR 144 Ca 0.06 0.74 0.01 0.00 -2.44 0.00 0.00 57.07 55.43 1jvn s TYR 144 Cb -0.10 -3.18 -0.03 0.00 0.35 0.00 0.00 41.96 39.00 1jvn s TYR 144 CO 0.04 -0.56 -0.05 -0.06 -1.34 0.00 0.00 175.55 173.58 1jvn s PHE 145 N 2.89 2.99 -0.37 4.97 0.40 0.11 -1.40 117.98 127.58 1jvn s PHE 145 Ca 0.31 0.06 0.04 0.00 -0.60 0.00 0.00 56.93 56.73 1jvn s PHE 145 Cb -0.14 -1.71 0.16 0.00 0.51 0.00 0.00 43.02 41.84 1jvn s PHE 145 CO 0.13 0.38 0.43 0.54 0.70 0.00 0.00 175.22 177.39 1jvn s VAL 146 N -0.87 -0.49 -0.01 -0.44 0.11 -1.24 -0.96 120.40 116.49 1jvn s VAL 146 Ca 0.14 -0.72 -0.28 0.00 -2.93 0.00 0.00 61.98 58.19 1jvn s VAL 146 Cb -0.11 -0.59 0.10 0.00 -1.53 0.00 0.00 36.38 34.25 1jvn s VAL 146 CO 0.03 -0.44 0.83 -1.38 -3.33 0.00 0.00 175.10 170.82 1jvn s HIS 147 N 1.65 -0.42 -0.08 1.54 -3.43 -0.58 -5.00 115.29 108.96 1jvn s HIS 147 Ca 0.16 0.43 0.14 0.00 -0.80 0.00 0.00 55.06 54.99 1jvn s HIS 147 Cb -0.13 0.51 -0.21 0.00 -1.43 0.00 0.00 32.58 31.32 1jvn s HIS 147 CO -0.08 -0.57 0.19 0.43 -2.00 0.00 0.00 174.74 172.72 1jvn n SER 148 N 0.07 1.40 -4.59 7.38 7.64 -1.26 0.04 113.62 124.29 1jvn n SER 148 Ca -0.12 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.45 1jvn n SER 148 Cb 0.61 1.28 -0.10 0.00 -1.01 0.00 0.00 64.21 64.99 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 -2.71 2.84 0.22 1.43 0.40 -1.26 -1.40 117.98 117.49 1jvn s PHE 149 Ca -0.07 -0.08 -0.19 0.00 -0.60 0.00 0.00 56.93 55.99 1jvn s PHE 149 Cb 0.07 -1.54 0.03 0.00 0.51 0.00 0.00 43.02 42.09 1jvn s PHE 149 CO 0.63 0.40 0.58 0.00 0.70 0.00 0.00 175.22 177.52 1jvn s ALA 150 N -1.10 -1.05 -1.06 5.36 0.00 0.17 -4.94 121.76 119.13 1jvn s ALA 150 Ca 0.19 -0.20 -0.17 0.00 0.00 0.00 0.00 51.96 51.78 1jvn s ALA 150 Cb -0.11 0.87 0.13 0.00 0.00 0.00 0.00 23.12 24.01 1jvn s ALA 150 CO 0.11 -0.86 1.32 0.00 0.00 0.00 0.00 175.76 176.32 1jvn s ALA 151 N -3.88 3.51 -0.06 0.00 0.00 -1.26 -0.92 121.76 119.15 1jvn s ALA 151 Ca 0.10 -2.93 -0.30 0.00 0.00 0.00 0.00 51.96 48.83 1jvn s ALA 151 Cb -0.02 -4.18 -0.03 0.00 0.00 0.00 0.00 23.12 18.89 1jvn s ALA 151 CO -0.01 -3.01 1.25 0.42 0.00 0.00 0.00 175.76 174.42 1jvn s ILE 152 N 2.69 4.15 0.27 0.00 1.01 -1.26 -1.51 121.20 126.54 1jvn s ILE 152 Ca 0.39 1.48 -0.01 0.00 0.00 0.00 0.00 60.65 62.51 1jvn s ILE 152 Cb -0.03 -3.95 -0.04 0.00 0.01 0.00 0.00 42.46 38.45 1jvn s ILE 152 CO -0.05 -0.02 0.48 -0.76 0.00 0.00 0.00 174.94 174.59 1jvn s LEU 153 N 2.42 4.12 0.22 2.97 1.43 1.00 -4.97 118.68 125.87 1jvn s LEU 153 Ca 0.57 0.48 -0.05 0.00 -1.03 0.00 0.00 54.13 54.10 1jvn s LEU 153 Cb -0.26 -3.29 -0.03 0.00 0.03 0.00 0.00 46.19 42.65 1jvn s LEU 153 CO 0.22 -0.17 0.27 0.54 0.23 0.00 0.00 176.35 177.44 1jvn s ASN 154 N -3.49 0.08 0.22 2.29 2.20 -1.26 -4.55 114.94 110.43 1jvn s ASN 154 Ca 0.40 -1.22 -0.10 0.00 -0.94 0.00 0.00 52.86 51.00 1jvn s ASN 154 Cb -0.10 0.46 0.31 0.00 -2.00 0.00 0.00 41.25 39.91 1jvn s ASN 154 CO 0.32 -0.96 1.67 -1.28 -2.94 0.00 0.00 177.10 173.90 1jvn h SER 155 N 2.47 -0.24 -0.11 3.54 0.87 -2.00 -2.44 113.55 115.65 1jvn h SER 155 Ca -0.32 0.15 -0.00 0.00 -1.23 0.00 0.00 61.79 60.39 1jvn h SER 155 Cb 1.25 0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 63.46 1jvn h SER 155 CO 0.46 -0.10 0.06 -0.08 -0.53 0.00 0.00 176.83 176.64 1jvn h GLU 156 N 0.13 0.15 -0.29 2.24 4.81 -1.99 -2.39 114.58 117.25 1jvn h GLU 156 Ca 0.33 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.54 1jvn h GLU 156 Cb 0.53 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 1jvn h GLU 156 CO -0.52 0.17 0.17 0.87 -0.73 0.00 0.00 179.01 178.96 1jvn h LYS 157 N 0.10 0.39 0.00 1.92 1.57 -1.90 -0.80 116.57 117.84 1jvn h LYS 157 Ca 0.04 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1jvn h LYS 157 Cb 0.06 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 1jvn h LYS 157 CO -0.01 0.32 -0.14 1.57 -0.57 0.00 0.00 179.45 180.63 1jvn h LYS 158 N 0.36 0.00 0.11 3.15 2.10 -1.44 -1.44 116.57 119.41 1jvn h LYS 158 Ca 0.10 0.00 -0.28 0.00 -2.00 0.00 0.00 60.65 58.47 1jvn h LYS 158 Cb 0.04 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.39 1jvn h LYS 158 CO -0.02 0.14 -1.21 0.87 -2.00 0.00 0.00 179.45 177.23 1jvn h LYS 159 N 0.00 0.52 -0.57 0.07 1.57 -1.12 -1.84 116.57 115.19 1jvn h LYS 159 Ca -0.00 -0.70 -0.08 0.00 -1.87 0.00 0.00 60.65 58.00 1jvn h LYS 159 Cb 0.60 0.23 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 1jvn h LYS 159 CO 0.02 1.31 0.06 -0.91 -0.57 0.00 0.00 179.45 179.35 1jvn h ASN 160 N 0.22 0.94 -0.78 0.86 2.35 -0.92 -0.49 115.58 117.76 1jvn h ASN 160 Ca -0.16 -0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 55.29 1jvn h ASN 160 Cb 1.88 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 39.97 1jvn h ASN 160 CO 0.22 0.99 0.42 -0.07 -1.65 0.00 0.00 177.43 177.33 1jvn h LEU 161 N 0.87 0.99 -0.10 1.61 3.38 -1.27 0.48 115.31 121.27 1jvn h LEU 161 Ca 0.17 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1jvn h LEU 161 Cb 0.47 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1jvn h LEU 161 CO 0.02 0.81 0.03 -0.08 0.09 0.00 0.00 178.44 179.31 1jvn h GLU 162 N 1.09 0.16 0.00 1.13 4.57 -1.06 0.59 114.58 121.05 1jvn h GLU 162 Ca 0.27 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.39 1jvn h GLU 162 Cb 0.05 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 28.62 1jvn h GLU 162 CO -0.04 0.33 -0.12 -0.91 -1.18 0.00 0.00 179.01 177.09 1jvn h ASN 163 N -0.04 0.00 1.16 1.04 2.35 -0.78 -0.72 115.58 118.60 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 0.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.61 1jvn h ASN 163 CO -0.00 0.12 0.00 0.47 -1.65 0.00 0.00 177.43 176.37 1jvn n ASP 164 N -3.83 0.57 0.00 5.81 9.92 0.13 -4.91 116.55 124.23 1jvn n ASP 164 Ca -0.02 0.57 0.00 0.00 -0.53 0.00 0.00 54.79 54.81 1jvn n ASP 164 Cb 0.22 -0.72 0.00 0.00 -0.64 0.00 0.00 41.12 39.98 1jvn n ASP 164 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1jvn n GLY 165 N 0.98 0.84 3.72 0.44 0.00 -0.27 -5.06 105.19 105.84 1jvn n GLY 165 Ca 0.05 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 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 3.60 -0.19 1.61 0.52 0.16 -4.71 118.94 117.93 1jvn s TRP 166 Ca 0.00 1.26 -0.18 0.00 0.02 0.00 0.00 56.10 57.20 1jvn s TRP 166 Cb 0.00 -2.78 -0.04 0.00 -1.15 0.00 0.00 33.47 29.50 1jvn s TRP 166 CO 0.00 0.13 0.48 0.15 0.02 0.00 0.00 176.95 177.73 1jvn s LYS 167 N 0.63 4.21 -0.06 4.98 1.02 0.11 -4.13 119.74 126.50 1jvn s LYS 167 Ca 0.37 0.36 0.05 0.00 0.02 0.00 0.00 55.97 56.77 1jvn s LYS 167 Cb -0.18 -3.54 -0.02 0.00 -0.52 0.00 0.00 37.83 33.58 1jvn s LYS 167 CO 0.18 -0.07 -0.21 0.42 -0.92 0.00 0.00 175.35 174.75 1jvn s ILE 168 N 1.40 2.44 -0.40 2.17 -1.09 -1.26 -1.43 121.20 123.03 1jvn s ILE 168 Ca 0.23 -0.93 -0.13 0.00 -2.23 0.00 0.00 60.65 57.59 1jvn s ILE 168 Cb -0.15 -1.92 0.04 0.00 -1.58 0.00 0.00 42.46 38.85 1jvn s ILE 168 CO 0.09 0.57 0.27 0.00 -1.23 0.00 0.00 174.94 174.64 1jvn s ALA 169 N -0.35 3.38 0.39 9.38 0.00 0.47 -4.83 121.76 130.19 1jvn s ALA 169 Ca 0.02 -1.82 -0.02 0.00 0.00 0.00 0.00 51.96 50.14 1jvn s ALA 169 Cb -0.12 -2.75 -0.04 0.00 0.00 0.00 0.00 23.12 20.20 1jvn s ALA 169 CO 0.02 -1.49 0.63 0.15 0.00 0.00 0.00 175.76 175.07 1jvn s LYS 170 N 1.59 3.52 0.06 0.00 1.02 -1.26 -0.11 119.74 124.57 1jvn s LYS 170 Ca 0.03 -0.11 -0.05 0.00 0.02 0.00 0.00 55.97 55.86 1jvn s LYS 170 Cb -0.20 -2.56 -0.02 0.00 -0.52 0.00 0.00 37.83 34.53 1jvn s LYS 170 CO 0.07 0.04 0.08 0.00 -0.92 0.00 0.00 175.35 174.62 1jvn s ALA 171 N -2.43 0.10 -0.02 5.17 0.00 -0.25 0.35 121.76 124.68 1jvn s ALA 171 Ca 0.43 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.58 1jvn s ALA 171 Cb -0.10 0.35 0.00 0.00 0.00 0.00 0.00 23.12 23.37 1jvn s ALA 171 CO 0.38 -0.41 -0.10 0.21 0.00 0.00 0.00 175.76 175.84 1jvn s LYS 172 N -3.60 1.04 -0.17 0.00 2.20 -1.26 -0.32 119.74 117.64 1jvn s LYS 172 Ca 0.04 -0.36 -0.02 0.00 -0.36 0.00 0.00 55.97 55.27 1jvn s LYS 172 Cb 0.05 -0.97 0.05 0.00 -1.51 0.00 0.00 37.83 35.45 1jvn s LYS 172 CO -0.09 0.15 -0.01 -0.47 -0.36 0.00 0.00 175.35 174.58 1jvn s TYR 173 N 0.09 1.28 0.00 4.03 5.04 0.10 -4.70 117.35 123.18 1jvn s TYR 173 Ca -0.02 -0.87 0.00 0.00 -2.44 0.00 0.00 57.07 53.74 1jvn s TYR 173 Cb -0.08 -1.12 0.00 0.00 0.35 0.00 0.00 41.96 41.11 1jvn s TYR 173 CO 0.00 -0.57 0.00 0.41 -1.34 0.00 0.00 175.55 174.05 1jvn n GLY 174 N 4.98 2.22 0.73 8.97 0.00 0.11 -2.05 105.19 120.16 1jvn n GLY 174 Ca -0.10 -0.35 0.11 0.00 0.00 0.00 0.00 46.02 45.68 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 6.96 2.51 -4.73 1.61 3.41 -1.26 -4.93 113.62 117.19 1jvn n SER 175 Ca 0.00 -1.76 -0.37 0.00 -0.26 0.00 0.00 58.87 56.48 1jvn n SER 175 Cb 0.00 0.17 -0.07 0.00 -0.26 0.00 0.00 64.21 64.06 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 -2.01 4.28 -0.11 4.33 2.02 -0.87 -5.08 118.70 121.26 1jvn s GLU 176 Ca 0.23 0.23 -0.11 0.00 0.02 0.00 0.00 54.97 55.34 1jvn s GLU 176 Cb 0.18 -3.43 -0.05 0.00 0.10 0.00 0.00 34.13 30.94 1jvn s GLU 176 CO 0.37 0.22 0.25 -2.00 0.02 0.00 0.00 175.26 174.11 1jvn s GLU 177 N 0.50 3.86 0.19 1.61 2.12 -1.26 -0.73 118.70 125.00 1jvn s GLU 177 Ca 0.20 0.06 -0.07 0.00 0.36 0.00 0.00 54.97 55.52 1jvn s GLU 177 Cb -0.14 -3.29 -0.02 0.00 0.26 0.00 0.00 34.13 30.95 1jvn s GLU 177 CO 0.06 0.56 0.26 -0.59 -0.54 0.00 0.00 175.26 175.02 1jvn s PHE 178 N -0.48 0.65 -0.35 5.30 -0.12 0.57 -0.00 117.98 123.54 1jvn s PHE 178 Ca 0.17 -0.97 -0.29 0.00 -0.05 0.00 0.00 56.93 55.79 1jvn s PHE 178 Cb -0.13 -0.18 0.02 0.00 -0.63 0.00 0.00 43.02 42.10 1jvn s PHE 178 CO 0.06 -0.74 1.10 0.42 -0.05 0.00 0.00 175.22 176.01 1jvn s ILE 179 N -4.04 4.42 -0.01 -4.49 1.01 -0.57 -1.09 121.20 116.42 1jvn s ILE 179 Ca 0.25 1.60 0.00 0.00 0.00 0.00 0.00 60.65 62.50 1jvn s ILE 179 Cb 0.04 -4.44 -0.26 0.00 0.01 0.00 0.00 42.46 37.80 1jvn s ILE 179 CO 0.06 -0.60 0.79 0.00 0.00 0.00 0.00 174.94 175.19 1jvn h ALA 180 N 8.42 0.40 -2.56 9.38 0.00 -0.80 -3.42 119.26 130.69 1jvn h ALA 180 Ca -0.21 -1.20 0.01 0.00 0.00 0.00 0.00 54.91 53.50 1jvn h ALA 180 Cb 1.06 0.34 -0.15 0.00 0.00 0.00 0.00 17.79 19.05 1jvn h ALA 180 CO 1.06 1.26 0.29 0.00 0.00 0.00 0.00 179.25 181.86 1jvn s ALA 181 N -2.61 -1.70 0.12 0.00 0.00 -0.95 0.60 121.76 117.21 1jvn s ALA 181 Ca -0.09 0.83 0.04 0.00 0.00 0.00 0.00 51.96 52.74 1jvn s ALA 181 Cb 0.07 0.51 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 1jvn s ALA 181 CO 0.83 -0.65 -0.10 0.14 0.00 0.00 0.00 175.76 175.99 1jvn s VAL 182 N -2.96 1.03 -0.27 0.00 -7.23 -0.21 -0.40 120.40 110.37 1jvn s VAL 182 Ca -0.01 -1.88 -0.11 0.00 -1.81 0.00 0.00 61.98 58.17 1jvn s VAL 182 Cb -0.01 -1.64 0.10 0.00 0.56 0.00 0.00 36.38 35.39 1jvn s VAL 182 CO -0.07 -0.68 0.60 0.21 -0.31 0.00 0.00 175.10 174.85 1jvn s ASN 183 N -2.86 -0.89 -0.22 4.85 3.04 -0.51 -2.03 114.94 116.32 1jvn s ASN 183 Ca 0.12 1.40 -0.06 0.00 0.04 0.00 0.00 52.86 54.36 1jvn s ASN 183 Cb 0.01 1.72 0.11 0.00 -1.54 0.00 0.00 41.25 41.54 1jvn s ASN 183 CO -0.00 -0.23 0.43 -0.75 -3.04 0.00 0.00 177.10 173.52 1jvn s LYS 184 N 2.31 0.36 4.73 0.43 2.20 -0.58 0.06 119.74 129.25 1jvn s LYS 184 Ca -0.07 0.96 0.00 0.00 -0.36 0.00 0.00 55.97 56.50 1jvn s LYS 184 Cb -0.09 0.21 0.00 0.00 -1.51 0.00 0.00 37.83 36.44 1jvn s LYS 184 CO -0.18 -0.34 0.00 0.09 -0.36 0.00 0.00 175.35 174.56 1jvn n ASN 185 N 5.39 0.00 -0.17 1.43 3.02 -1.26 -1.22 115.26 122.45 1jvn n ASN 185 Ca -0.07 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.60 1jvn n ASN 185 Cb 0.50 0.00 0.35 0.00 -0.61 0.00 0.00 39.78 40.02 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 8.32 0.84 -4.69 6.41 6.94 -1.26 -4.88 115.26 126.94 1jvn n ASN 186 Ca 0.00 -0.68 -0.39 0.00 -0.02 0.00 0.00 54.58 53.49 1jvn n ASN 186 Cb 0.00 0.15 -0.06 0.00 -2.36 0.00 0.00 39.78 37.51 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 -2.64 5.12 -0.01 1.53 1.01 -0.36 -1.94 121.20 123.91 1jvn s ILE 187 Ca 0.21 1.01 0.02 0.00 0.00 0.00 0.00 60.65 61.90 1jvn s ILE 187 Cb 0.19 -3.86 -0.01 0.00 0.01 0.00 0.00 42.46 38.79 1jvn s ILE 187 CO 0.57 0.23 -0.08 0.12 0.00 0.00 0.00 174.94 175.78 1jvn s PHE 188 N 1.23 0.70 -0.13 3.97 5.36 -0.49 -1.52 117.98 127.10 1jvn s PHE 188 Ca 0.26 -0.13 -0.23 0.00 -0.96 0.00 0.00 56.93 55.87 1jvn s PHE 188 Cb -0.15 -0.45 0.06 0.00 -0.34 0.00 0.00 43.02 42.13 1jvn s PHE 188 CO 0.11 -0.01 0.58 0.00 -1.46 0.00 0.00 175.22 174.43 1jvn s ALA 189 N -0.17 -1.46 -0.02 11.12 0.00 -0.86 -0.89 121.76 129.48 1jvn s ALA 189 Ca 0.03 1.32 0.06 0.00 0.00 0.00 0.00 51.96 53.37 1jvn s ALA 189 Cb -0.03 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.62 1jvn s ALA 189 CO -0.00 -0.31 -0.19 0.95 0.00 0.00 0.00 175.76 176.21 1jvn s THR 190 N -0.49 1.50 0.05 0.00 -4.23 -0.13 -1.05 115.64 111.29 1jvn s THR 190 Ca -0.06 -0.80 0.12 0.00 -1.18 0.00 0.00 61.69 59.76 1jvn s THR 190 Cb -0.03 -1.25 -0.05 0.00 1.34 0.00 0.00 72.50 72.51 1jvn s THR 190 CO 0.05 0.42 1.43 -0.61 -0.54 0.00 0.00 174.62 175.37 1jvn h GLN 191 N 5.76 0.00 -7.06 3.99 5.75 -0.09 -3.39 115.11 120.07 1jvn h GLN 191 Ca -0.37 0.00 -0.46 0.00 -0.15 0.00 0.00 58.65 57.67 1jvn h GLN 191 Cb 1.15 0.00 0.06 0.00 1.07 0.00 0.00 27.48 29.75 1jvn h GLN 191 CO 0.48 0.71 0.12 -0.59 -2.65 0.00 0.00 178.83 176.90 1jvn s PHE 192 N -3.01 3.13 -0.49 3.99 -0.12 -1.26 -4.75 117.98 115.46 1jvn s PHE 192 Ca 0.02 0.46 -0.16 0.00 -0.05 0.00 0.00 56.93 57.20 1jvn s PHE 192 Cb 0.10 -2.77 0.08 0.00 -0.63 0.00 0.00 43.02 39.80 1jvn s PHE 192 CO 0.77 -0.88 0.45 -1.01 -0.05 0.00 0.00 175.22 174.50 1jvn s HIS 193 N -2.95 3.21 0.35 3.49 3.76 -0.49 -4.94 115.29 117.72 1jvn s HIS 193 Ca 0.55 -0.96 0.05 0.00 -0.15 0.00 0.00 55.06 54.55 1jvn s HIS 193 Cb -0.10 -3.37 0.64 0.00 1.11 0.00 0.00 32.58 30.85 1jvn s HIS 193 CO 0.43 -0.89 1.88 -1.00 -0.85 0.00 0.00 174.74 174.32 1jvn h PRO 194 N 8.83 0.48 0.00 8.40 0.13 -1.87 -2.02 132.00 145.94 1jvn h PRO 194 Ca -0.29 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1jvn h PRO 194 Cb 1.11 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1jvn h PRO 194 CO 0.93 0.52 0.00 -0.85 -0.23 0.00 0.00 178.00 178.37 1jvn n GLU 195 N -4.28 0.19 -0.05 0.86 0.00 -1.26 -1.89 120.64 114.20 1jvn n GLU 195 Ca 0.01 0.43 0.05 0.00 0.00 0.00 0.00 57.16 57.65 1jvn n GLU 195 Cb 0.25 -1.86 0.07 0.00 0.00 0.00 0.00 31.44 29.90 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 -2.21 1.18 -0.97 3.44 4.76 -0.82 -4.36 118.16 119.17 1jvn n LYS 196 Ca 0.02 -1.38 -0.09 0.00 -2.87 0.00 0.00 58.31 53.99 1jvn n LYS 196 Cb 0.22 -1.21 0.25 0.00 -1.84 0.00 0.00 35.03 32.45 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 0.53 3.99 0.00 4.39 7.64 -0.79 -4.30 113.62 125.07 1jvn n SER 197 Ca 0.07 -3.41 0.00 0.00 1.01 0.00 0.00 58.87 56.54 1jvn n SER 197 Cb 0.30 -0.73 0.00 0.00 -1.01 0.00 0.00 64.21 62.78 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 -0.64 1.54 0.31 0.23 0.00 -0.07 -1.97 105.19 104.59 1jvn n GLY 198 Ca 0.42 -0.53 -0.03 0.00 0.00 0.00 0.00 46.02 45.88 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 1.04 -0.79 1.61 1.63 -1.88 -0.44 116.57 117.74 1jvn h LYS 199 Ca 0.00 -0.06 0.08 0.00 -0.85 0.00 0.00 60.65 59.81 1jvn h LYS 199 Cb 0.00 -0.23 -0.05 0.00 -0.60 0.00 0.00 32.23 31.34 1jvn h LYS 199 CO 0.00 0.69 0.51 0.00 -3.45 0.00 0.00 179.45 177.20 1jvn h ALA 200 N 1.32 1.69 -0.06 5.00 0.00 -1.87 0.63 119.26 125.96 1jvn h ALA 200 Ca 0.31 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.97 1jvn h ALA 200 Cb -0.07 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 17.54 1jvn h ALA 200 CO -0.08 0.17 -0.89 0.78 0.00 0.00 0.00 179.25 179.22 1jvn h GLY 201 N 0.79 0.80 0.90 0.00 0.00 -0.64 -3.03 103.07 101.89 1jvn h GLY 201 Ca 0.35 -1.27 0.03 0.00 0.00 0.00 0.00 47.33 46.44 1jvn h GLY 201 CO -0.13 1.13 0.64 1.41 0.00 0.00 0.00 176.54 179.59 1jvn h LEU 202 N 0.41 1.08 -0.96 3.11 3.38 -0.11 -2.00 115.31 120.22 1jvn h LEU 202 Ca -0.09 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.88 1jvn h LEU 202 Cb 1.54 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.99 1jvn h LEU 202 CO 0.18 0.74 0.64 0.78 0.09 0.00 0.00 178.44 180.87 1jvn h ASN 203 N 1.25 1.10 -0.48 -0.43 2.35 -0.90 -0.22 115.58 118.26 1jvn h ASN 203 Ca 0.39 -0.03 -0.07 0.00 -0.55 0.00 0.00 56.30 56.04 1jvn h ASN 203 Cb -0.02 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.06 1jvn h ASN 203 CO -0.12 0.79 0.03 0.58 -1.65 0.00 0.00 177.43 177.06 1jvn h VAL 204 N 1.30 1.26 -0.21 2.81 2.07 -1.26 0.11 116.25 122.33 1jvn h VAL 204 Ca 0.36 -1.01 -0.02 0.00 0.82 0.00 0.00 66.70 66.84 1jvn h VAL 204 Cb -0.14 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1jvn h VAL 204 CO -0.08 0.35 0.04 0.40 0.02 0.00 0.00 177.57 178.31 1jvn h ILE 205 N 0.69 1.22 -0.79 4.57 2.04 -1.08 -1.36 117.51 122.79 1jvn h ILE 205 Ca 0.14 -0.72 0.01 0.00 1.00 0.00 0.00 64.86 65.29 1jvn h ILE 205 Cb 0.47 1.29 -0.04 0.00 -0.74 0.00 0.00 36.82 37.79 1jvn h ILE 205 CO 0.02 0.22 0.51 -0.08 0.00 0.00 0.00 178.15 178.83 1jvn h GLU 206 N 0.15 1.05 -0.54 2.37 4.81 -0.94 -0.46 114.58 121.03 1jvn h GLU 206 Ca 0.07 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1jvn h GLU 206 Cb 0.30 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 1jvn h GLU 206 CO 0.00 0.70 0.16 -0.91 -0.73 0.00 0.00 179.01 178.24 1jvn h ASN 207 N 1.07 0.74 -0.05 1.04 2.35 -0.56 -0.34 115.58 119.83 1jvn h ASN 207 Ca 0.29 -0.12 -0.02 0.00 -0.55 0.00 0.00 56.30 55.91 1jvn h ASN 207 Cb -0.11 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.07 1jvn h ASN 207 CO -0.06 0.71 -0.03 0.15 -1.65 0.00 0.00 177.43 176.54 1jvn h PHE 208 N 0.78 0.12 -0.71 1.19 3.57 -0.67 0.09 116.94 121.32 1jvn h PHE 208 Ca 0.18 -0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.67 1jvn h PHE 208 Cb 0.24 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.92 1jvn h PHE 208 CO 0.01 0.53 0.47 -0.07 -2.23 0.00 0.00 178.31 177.02 1jvn h LEU 209 N -0.32 0.76 -1.74 0.59 3.38 -0.85 -1.36 115.31 115.76 1jvn h LEU 209 Ca 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1jvn h LEU 209 Cb 0.50 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1jvn h LEU 209 CO 0.01 0.53 0.00 0.29 0.09 0.00 0.00 178.44 179.36 1jvn n LYS 210 N -4.45 2.14 -3.79 1.13 5.02 -0.16 -4.98 118.16 113.07 1jvn n LYS 210 Ca 0.08 -1.72 -0.33 0.00 -2.02 0.00 0.00 58.31 54.32 1jvn n LYS 210 Cb 0.10 -1.46 0.02 0.00 -0.02 0.00 0.00 35.03 33.68 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 0.95 -0.96 -4.01 1.97 1.13 -0.50 -5.00 117.38 110.96 1jvn n GLN 211 Ca 0.18 0.47 -0.12 0.00 -1.94 0.00 0.00 57.00 55.58 1jvn n GLN 211 Cb 0.48 -3.31 -0.13 0.00 0.11 0.00 0.00 30.24 27.40 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 -6.02 0.30 -0.72 -1.09 -2.07 -0.10 -5.04 119.66 104.92 1jvn s GLN 212 Ca 0.34 -0.37 0.04 0.00 -1.82 0.00 0.00 55.36 53.56 1jvn s GLN 212 Cb -0.15 -0.13 0.19 0.00 -1.09 0.00 0.00 33.01 31.82 1jvn s GLN 212 CO 0.90 0.02 0.57 0.43 -1.32 0.00 0.00 175.29 175.89 1jvn n SER 213 N 2.31 3.27 -4.74 12.60 7.64 -1.26 -4.21 113.62 129.23 1jvn n SER 213 Ca -0.18 -3.24 -0.42 0.00 1.01 0.00 0.00 58.87 56.04 1jvn n SER 213 Cb 0.57 -0.78 -0.01 0.00 -1.01 0.00 0.00 64.21 62.98 1jvn n SER 213 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1jvn n PRO 214 N 1.82 2.50 -1.99 1.43 -0.04 -1.26 -4.69 135.00 132.77 1jvn n PRO 214 Ca 0.22 0.88 -0.38 0.00 -0.04 0.00 0.00 63.50 64.17 1jvn n PRO 214 Cb 0.36 -2.59 0.01 0.00 -0.04 0.00 0.00 33.50 31.25 1jvn n PRO 214 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1jvn s PRO 215 N -1.36 3.54 0.56 0.54 0.04 -1.26 -4.08 135.00 132.97 1jvn s PRO 215 Ca 0.59 2.08 -0.17 0.00 0.04 0.00 0.00 61.00 63.54 1jvn s PRO 215 Cb -0.52 -2.43 -0.05 0.00 0.04 0.00 0.00 34.50 31.54 1jvn s PRO 215 CO 0.57 -0.82 1.06 0.96 0.04 0.00 0.00 177.00 178.80 1jvn s ILE 216 N -1.37 3.76 0.58 0.56 -4.36 -1.26 -4.96 121.20 114.15 1jvn s ILE 216 Ca 0.65 0.93 -0.20 0.00 -0.26 0.00 0.00 60.65 61.77 1jvn s ILE 216 Cb -0.36 -3.40 -0.05 0.00 1.25 0.00 0.00 42.46 39.90 1jvn s ILE 216 CO 0.44 -0.40 1.14 -2.65 0.24 0.00 0.00 174.94 173.72 1jvn n PRO 217 N -1.65 1.21 -2.09 0.37 -0.02 -1.26 -4.82 135.00 126.74 1jvn n PRO 217 Ca 0.09 0.46 -0.38 0.00 -2.02 0.00 0.00 63.50 61.65 1jvn n PRO 217 Cb 0.53 -2.34 -0.03 0.00 -0.02 0.00 0.00 33.50 31.63 1jvn n PRO 217 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1jvn n ASN 218 N -0.93 3.80 -4.77 2.55 2.85 -1.26 -4.94 115.26 112.56 1jvn n ASN 218 Ca 0.13 -2.80 -0.39 0.00 -0.11 0.00 0.00 54.58 51.41 1jvn n ASN 218 Cb 0.46 -1.65 -0.02 0.00 1.24 0.00 0.00 39.78 39.81 1jvn n ASN 218 CO 0.00 0.00 0.00 -0.31 -2.11 0.00 0.00 177.26 174.84 1jvn s TYR 219 N 6.68 3.03 0.67 1.20 1.51 -1.26 -5.02 117.35 124.17 1jvn s TYR 219 Ca 0.59 1.52 -0.12 0.00 -1.01 0.00 0.00 57.07 58.05 1jvn s TYR 219 Cb 0.05 -3.47 -0.01 0.00 -0.11 0.00 0.00 41.96 38.42 1jvn s TYR 219 CO 0.08 -1.50 1.06 -1.54 -1.11 0.00 0.00 175.55 172.54 1jvn s SER 220 N -0.98 5.53 0.56 2.29 1.04 -1.26 -4.82 113.70 116.06 1jvn s SER 220 Ca 0.56 1.64 0.24 0.00 0.48 0.00 0.00 55.95 58.87 1jvn s SER 220 Cb -0.33 -2.50 1.58 0.00 0.10 0.00 0.00 66.02 64.87 1jvn s SER 220 CO 0.42 -1.34 2.18 0.00 0.98 0.00 0.00 173.24 175.48 1jvn h ALA 221 N -0.44 1.79 -0.06 5.32 0.00 -1.99 0.35 119.26 124.22 1jvn h ALA 221 Ca -0.44 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.40 1jvn h ALA 221 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1jvn h ALA 221 CO 0.57 -0.08 -0.22 0.93 0.00 0.00 0.00 179.25 180.46 1jvn h GLU 222 N 0.00 0.26 -0.48 0.00 4.39 -1.99 -2.37 114.58 114.39 1jvn h GLU 222 Ca 0.03 -0.20 -0.02 0.00 0.34 0.00 0.00 59.36 59.51 1jvn h GLU 222 Cb 0.12 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 1jvn h GLU 222 CO -0.00 0.83 0.22 0.93 -1.16 0.00 0.00 179.01 179.83 1jvn h GLU 223 N -0.25 0.69 -0.33 2.33 5.08 -1.69 -1.79 114.58 118.63 1jvn h GLU 223 Ca -0.01 -0.11 0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1jvn h GLU 223 Cb 0.85 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.95 1jvn h GLU 223 CO 0.05 0.59 0.17 0.87 -1.00 0.00 0.00 179.01 179.69 1jvn h LYS 224 N 0.63 0.35 -0.31 2.33 1.57 -1.01 0.70 116.57 120.82 1jvn h LYS 224 Ca 0.16 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.88 1jvn h LYS 224 Cb 0.13 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1jvn h LYS 224 CO -0.02 0.23 0.03 1.49 -0.57 0.00 0.00 179.45 180.61 1jvn h GLU 225 N 0.36 0.47 0.01 3.15 4.57 -1.28 0.26 114.58 122.11 1jvn h GLU 225 Ca 0.13 -0.09 -0.06 0.00 -1.18 0.00 0.00 59.36 58.17 1jvn h GLU 225 Cb 0.03 -0.08 0.01 0.00 -0.16 0.00 0.00 28.75 28.55 1jvn h GLU 225 CO -0.08 0.48 -0.24 1.25 -1.18 0.00 0.00 179.01 179.24 1jvn h LEU 226 N 0.46 0.19 0.00 1.64 5.85 -0.71 -3.36 115.31 119.38 1jvn h LEU 226 Ca 0.10 -0.81 0.00 0.00 0.84 0.00 0.00 57.88 58.01 1jvn h LEU 226 Cb 0.26 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.23 1jvn h LEU 226 CO 0.00 0.98 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.85 1jvn h LEU 227 N -0.57 0.00-10.23 2.25 3.38 0.53 -3.47 115.31 107.20 1jvn h LEU 227 Ca -0.03 -0.01 -0.53 0.00 0.09 0.00 0.00 57.88 57.40 1jvn h LEU 227 Cb 1.03 0.00 0.17 0.00 0.09 0.00 0.00 40.66 41.95 1jvn h LEU 227 CO 0.05 0.00 0.31 0.00 0.09 0.00 0.00 178.44 178.89 1jvn s MET 228 N -3.21 1.67 -0.18 1.13 0.23 0.89 -4.74 119.30 115.08 1jvn s MET 228 Ca 0.06 1.61 -0.24 0.00 -1.03 0.00 0.00 55.69 56.09 1jvn s MET 228 Cb 0.07 -1.79 -0.01 0.00 -1.53 0.00 0.00 34.83 31.56 1jvn s MET 228 CO 0.68 -2.16 0.80 1.21 -2.03 0.00 0.00 175.02 173.52 1jvn s ASN 229 N -2.45 6.90 0.00 -1.18 3.84 -1.26 -4.91 114.94 115.88 1jvn s ASN 229 Ca 0.70 1.11 0.24 0.00 0.21 0.00 0.00 52.86 55.12 1jvn s ASN 229 Cb -0.25 -2.44 0.34 0.00 -0.55 0.00 0.00 41.25 38.35 1jvn s ASN 229 CO 0.52 -0.39 1.32 -0.90 -2.79 0.00 0.00 177.10 174.85 1jvn n ASP 230 N 5.30 1.92 -1.07 -4.21 5.75 -1.26 -4.92 116.55 118.06 1jvn n ASP 230 Ca 0.04 -1.46 -0.11 0.00 -0.01 0.00 0.00 54.79 53.25 1jvn n ASP 230 Cb 0.49 0.24 -0.02 0.00 -1.03 0.00 0.00 41.12 40.80 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 0.12 -0.30 -2.64 2.11 4.02 -1.26 -4.98 117.16 114.23 1jvn n TYR 231 Ca 0.12 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.64 1jvn n TYR 231 Cb 0.45 -2.34 -0.05 0.00 -0.02 0.00 0.00 39.34 37.38 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 -2.67 7.07 -1.38 7.72 1.04 -1.26 -3.31 113.70 120.91 1jvn s SER 232 Ca 0.00 1.97 -0.08 0.00 0.48 0.00 0.00 55.95 58.32 1jvn s SER 232 Cb 0.00 -2.59 0.03 0.00 0.10 0.00 0.00 66.02 63.56 1jvn s SER 232 CO 0.00 -0.27 1.06 -3.20 0.98 0.00 0.00 173.24 171.81 1jvn n ASN 233 N 0.33 -4.84 0.00 7.02 5.15 -1.26 -1.84 115.26 119.82 1jvn n ASN 233 Ca 0.03 -0.64 0.00 0.00 -0.60 0.00 0.00 54.58 53.37 1jvn n ASN 233 Cb 0.49 -4.65 0.00 0.00 -0.53 0.00 0.00 39.78 35.10 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 -4.73 0.00 0.00 1.20 4.02 -1.21 -1.82 117.16 114.62 1jvn n TYR 234 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.84 1jvn n TYR 234 Cb 0.58 -1.13 0.00 0.00 -0.02 0.00 0.00 39.34 38.77 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 -1.48 0.86 3.87 2.72 0.00 -0.77 -0.71 105.19 109.69 1jvn n GLY 235 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 4.24 0.87 0.99 1.43 -0.76 -4.46 118.68 121.00 1jvn s LEU 236 Ca 0.00 0.28 -0.12 0.00 -1.03 0.00 0.00 54.13 53.26 1jvn s LEU 236 Cb 0.00 -2.58 0.11 0.00 0.03 0.00 0.00 46.19 43.75 1jvn s LEU 236 CO 0.00 0.25 1.11 0.42 0.23 0.00 0.00 176.35 178.35 1jvn s THR 237 N -1.32 2.59 -0.61 5.49 -4.23 -0.88 -4.58 115.64 112.09 1jvn s THR 237 Ca 0.27 0.19 -0.28 0.00 -1.18 0.00 0.00 61.69 60.70 1jvn s THR 237 Cb -0.13 -2.85 0.03 0.00 1.34 0.00 0.00 72.50 70.89 1jvn s THR 237 CO 0.19 -0.25 1.25 -0.13 -0.54 0.00 0.00 174.62 175.14 1jvn s ARG 238 N -5.12 3.42 -0.18 3.99 1.81 0.63 -4.78 118.95 118.73 1jvn s ARG 238 Ca 0.63 0.19 -0.29 0.00 -1.72 0.00 0.00 55.73 54.54 1jvn s ARG 238 Cb -0.16 -4.06 -0.02 0.00 -0.45 0.00 0.00 34.95 30.26 1jvn s ARG 238 CO 0.55 -1.81 1.37 0.50 -0.68 0.00 0.00 175.30 175.23 1jvn s ARG 239 N 5.19 4.11 -0.30 3.54 3.52 -1.26 -4.70 118.95 129.06 1jvn s ARG 239 Ca 0.43 1.67 -0.08 0.00 -0.13 0.00 0.00 55.73 57.62 1jvn s ARG 239 Cb -0.08 -3.85 0.00 0.00 -1.56 0.00 0.00 34.95 29.46 1jvn s ARG 239 CO 0.23 -0.87 0.11 0.42 -0.81 0.00 0.00 175.30 174.38 1jvn s ILE 240 N 3.95 4.22 -0.15 4.11 -1.09 -1.26 -1.23 121.20 129.74 1jvn s ILE 240 Ca 0.60 -0.59 -0.06 0.00 -2.23 0.00 0.00 60.65 58.37 1jvn s ILE 240 Cb -0.23 -3.16 -0.04 0.00 -1.58 0.00 0.00 42.46 37.45 1jvn s ILE 240 CO 0.20 0.07 0.07 -0.63 -1.23 0.00 0.00 174.94 173.43 1jvn s ILE 241 N 1.54 4.90 -0.19 2.92 1.01 0.38 -1.66 121.20 130.10 1jvn s ILE 241 Ca 0.03 -0.01 -0.07 0.00 0.00 0.00 0.00 60.65 60.61 1jvn s ILE 241 Cb -0.17 -3.17 -0.04 0.00 0.01 0.00 0.00 42.46 39.10 1jvn s ILE 241 CO 0.04 0.52 0.05 0.00 0.00 0.00 0.00 174.94 175.55 1jvn s ALA 242 N -0.18 3.30 0.03 9.38 0.00 -0.40 -0.31 121.76 133.58 1jvn s ALA 242 Ca 0.08 -0.84 0.09 0.00 0.00 0.00 0.00 51.96 51.29 1jvn s ALA 242 Cb -0.12 -1.91 -0.03 0.00 0.00 0.00 0.00 23.12 21.07 1jvn s ALA 242 CO 0.01 0.04 -0.26 0.00 0.00 0.00 0.00 175.76 175.55 1jvn s LEU 244 N -1.05 1.86 0.22 0.00 2.34 -0.38 -4.41 118.68 117.26 1jvn s LEU 244 Ca 0.11 -0.39 -0.08 0.00 0.06 0.00 0.00 54.13 53.83 1jvn s LEU 244 Cb -0.10 0.46 -0.06 0.00 -0.56 0.00 0.00 46.19 45.92 1jvn s LEU 244 CO 0.01 -0.38 0.51 -1.81 -1.06 0.00 0.00 176.35 173.62 1jvn s ASP 245 N -1.60 6.56 -0.33 1.48 1.01 -1.26 -0.61 116.67 121.92 1jvn s ASP 245 Ca -0.13 0.80 0.01 0.00 0.71 0.00 0.00 52.55 53.95 1jvn s ASP 245 Cb -0.07 -2.18 0.10 0.00 1.01 0.00 0.00 42.92 41.79 1jvn s ASP 245 CO -0.01 -0.06 0.09 -0.69 0.21 0.00 0.00 175.17 174.71 1jvn s VAL 246 N -1.83 1.44 0.33 -1.27 1.01 -0.27 -4.20 120.40 115.62 1jvn s VAL 246 Ca 0.45 -1.83 0.08 0.00 0.00 0.00 0.00 61.98 60.68 1jvn s VAL 246 Cb -0.11 -2.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 1jvn s VAL 246 CO 0.24 -0.66 0.17 -0.13 0.00 0.00 0.00 175.10 174.71 1jvn s ARG 247 N 1.27 2.48 -0.17 2.72 0.52 0.14 -1.26 118.95 124.65 1jvn s ARG 247 Ca 0.11 -1.45 -0.04 0.00 -0.52 0.00 0.00 55.73 53.82 1jvn s ARG 247 Cb -0.18 -2.26 -0.03 0.00 0.52 0.00 0.00 34.95 33.00 1jvn s ARG 247 CO -0.17 0.14 -0.02 0.99 0.02 0.00 0.00 175.30 176.26 1jvn s THR 248 N -2.37 4.01 0.14 0.02 2.01 -1.26 0.04 115.64 118.23 1jvn s THR 248 Ca 0.38 -0.31 0.00 0.00 0.31 0.00 0.00 61.69 62.07 1jvn s THR 248 Cb -0.04 -2.78 0.03 0.00 0.01 0.00 0.00 72.50 69.72 1jvn s THR 248 CO 0.23 0.47 0.20 -0.46 -0.69 0.00 0.00 174.62 174.37 1jvn n ASN 249 N 3.71 0.31 -0.24 3.53 6.94 0.11 -4.94 115.26 124.69 1jvn n ASN 249 Ca -0.17 -1.25 -0.02 0.00 -0.02 0.00 0.00 54.58 53.11 1jvn n ASN 249 Cb 0.52 -0.12 0.09 0.00 -2.36 0.00 0.00 39.78 37.91 1jvn n ASN 249 CO 0.00 0.00 0.00 -0.78 -1.03 0.00 0.00 177.26 175.45 1jvn h ASP 250 N -0.09 0.62 0.00 0.53 3.58 -1.93 -1.17 116.42 117.97 1jvn h ASP 250 Ca -0.07 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.40 1jvn h ASP 250 Cb 0.25 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.19 1jvn h ASP 250 CO 0.07 0.41 0.00 0.00 -2.88 0.00 0.00 179.24 176.85 1jvn n GLN 251 N -4.74 0.94 -0.99 0.28 6.02 -1.26 -4.85 117.38 112.77 1jvn n GLN 251 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.07 1jvn n GLN 251 Cb 0.14 -1.21 0.00 0.00 1.02 0.00 0.00 30.24 30.19 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 0.47 3.89 1.08 0.00 -0.44 -5.03 105.19 105.77 1jvn n GLY 252 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.08 6.08 -0.23 1.61 1.01 -1.26 -4.72 116.67 117.08 1jvn s ASP 253 Ca 0.00 1.13 -0.17 0.00 0.71 0.00 0.00 52.55 54.22 1jvn s ASP 253 Cb 0.00 -2.24 -0.03 0.00 1.01 0.00 0.00 42.92 41.65 1jvn s ASP 253 CO 0.00 -0.84 0.46 -0.76 0.21 0.00 0.00 175.17 174.24 1jvn s LEU 254 N -5.02 4.10 0.34 1.23 1.02 -1.26 -0.71 118.68 118.38 1jvn s LEU 254 Ca 0.53 0.53 0.04 0.00 0.02 0.00 0.00 54.13 55.24 1jvn s LEU 254 Cb -0.11 -2.60 -0.06 0.00 0.02 0.00 0.00 46.19 43.45 1jvn s LEU 254 CO 0.49 -0.18 0.06 0.68 0.02 0.00 0.00 176.35 177.42 1jvn s VAL 255 N 1.80 1.19 -0.13 -1.59 -7.23 0.11 -4.44 120.40 110.10 1jvn s VAL 255 Ca 0.20 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.45 1jvn s VAL 255 Cb -0.15 -2.77 -0.13 0.00 0.56 0.00 0.00 36.38 33.89 1jvn s VAL 255 CO 0.09 0.00 -0.03 0.52 -0.31 0.00 0.00 175.10 175.37 1jvn n VAL 256 N -0.72 0.85 -4.61 1.32 0.31 -1.26 0.29 118.33 114.51 1jvn n VAL 256 Ca -0.03 -0.45 -0.34 0.00 -0.01 0.00 0.00 64.34 63.52 1jvn n VAL 256 Cb 0.67 -0.82 -0.12 0.00 -0.91 0.00 0.00 33.84 32.66 1jvn n VAL 256 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1jvn s THR 257 N -2.30 3.69 0.42 2.52 -1.32 -1.26 -4.56 115.64 112.82 1jvn s THR 257 Ca -0.12 -0.47 0.37 0.00 -1.21 0.00 0.00 61.69 60.26 1jvn s THR 257 Cb 0.04 -2.52 0.55 0.00 -1.51 0.00 0.00 72.50 69.06 1jvn s THR 257 CO 0.44 0.58 1.16 1.17 -2.21 0.00 0.00 174.62 175.76 1jvn n LYS 259 N 2.48 0.00 -0.00 7.08 4.81 -1.26 -3.02 118.16 128.25 1jvn n LYS 259 Ca -0.18 0.81 0.01 0.00 -0.87 0.00 0.00 58.31 58.07 1jvn n LYS 259 Cb 0.53 -1.87 -0.01 0.00 0.02 0.00 0.00 35.03 33.70 1jvn n LYS 259 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1jvn n GLY 260 N -1.68 0.20 0.00 3.14 0.00 -1.26 -4.97 105.19 100.63 1jvn n GLY 260 Ca 0.33 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1jvn n GLY 260 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1jvn n ASP 261 N -1.40 0.00 -0.83 1.61 3.85 -1.17 -4.98 116.55 113.63 1jvn n ASP 261 Ca -0.00 0.00 0.09 0.00 -0.71 0.00 0.00 54.79 54.17 1jvn n ASP 261 Cb 0.04 0.00 0.25 0.00 -1.35 0.00 0.00 41.12 40.06 1jvn n ASP 261 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1jvn n LEU 276 N 0.00 2.44 -0.36 -2.12 -0.00 -1.26 -4.96 117.00 110.74 1jvn n LEU 276 Ca 0.00 -1.15 -0.02 0.00 -0.00 0.00 0.00 56.01 54.84 1jvn n LEU 276 Cb 0.00 -0.25 0.11 0.00 -0.00 0.00 0.00 43.42 43.28 1jvn n LEU 276 CO 0.00 0.57 1.28 1.23 -0.00 0.00 0.00 177.39 180.48 1jvn h GLY 277 N 4.92 1.38 0.16 1.47 0.00 -2.00 -3.24 103.07 105.76 1jvn h GLY 277 Ca 0.00 -0.51 0.04 0.00 0.00 0.00 0.00 47.33 46.86 1jvn h GLY 277 CO 0.00 0.48 -0.38 0.50 0.00 0.00 0.00 176.54 177.14 1jvn h LYS 278 N 1.30 -0.50 -0.28 4.80 1.57 -1.99 0.43 116.57 121.90 1jvn h LYS 278 Ca 0.36 0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 59.13 1jvn h LYS 278 Cb -0.12 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1jvn h LYS 278 CO -0.09 -0.33 -0.02 -1.00 -0.57 0.00 0.00 179.45 177.45 1jvn h PRO 279 N -0.51 0.43 -0.10 3.15 0.13 -1.79 -1.87 132.00 131.43 1jvn h PRO 279 Ca 0.06 -0.09 -0.03 0.00 -0.87 0.00 0.00 66.00 65.08 1jvn h PRO 279 Cb 0.62 -0.07 -0.00 0.00 0.13 0.00 0.00 31.00 31.68 1jvn h PRO 279 CO -0.33 0.48 -0.05 0.28 -0.23 0.00 0.00 178.00 178.15 1jvn h VAL 280 N 0.42 1.32 0.00 1.56 2.07 -1.42 -2.44 116.25 117.77 1jvn h VAL 280 Ca 0.09 -1.08 -0.06 0.00 0.82 0.00 0.00 66.70 66.47 1jvn h VAL 280 Cb 0.31 1.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.91 1jvn h VAL 280 CO 0.01 0.31 -0.27 1.56 0.02 0.00 0.00 177.57 179.20 1jvn h GLN 281 N -0.16 0.00 0.06 1.57 4.20 -0.04 -1.81 115.11 118.93 1jvn h GLN 281 Ca 0.02 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.49 1jvn h GLN 281 Cb 0.51 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.29 1jvn h GLN 281 CO 0.02 0.27 -1.06 1.25 -0.67 0.00 0.00 178.83 178.63 1jvn h LEU 282 N 0.00 0.41 -0.58 1.46 5.85 -1.34 -1.88 115.31 119.24 1jvn h LEU 282 Ca -0.00 -0.38 -0.11 0.00 0.84 0.00 0.00 57.88 58.23 1jvn h LEU 282 Cb 0.63 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.51 1jvn h LEU 282 CO 0.04 1.23 -0.06 0.00 -0.34 0.00 0.00 178.44 179.30 1jvn h ALA 283 N 0.73 0.78 -0.53 1.25 0.00 -1.14 -0.27 119.26 120.07 1jvn h ALA 283 Ca -0.09 -0.34 -0.11 0.00 0.00 0.00 0.00 54.91 54.37 1jvn h ALA 283 Cb 1.74 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.31 1jvn h ALA 283 CO 0.17 0.67 -0.09 1.96 0.00 0.00 0.00 179.25 181.96 1jvn h GLN 284 N 0.95 0.99 -0.23 0.00 4.20 -1.34 -1.60 115.11 118.08 1jvn h GLN 284 Ca 0.16 -0.35 -0.02 0.00 0.06 0.00 0.00 58.65 58.50 1jvn h GLN 284 Cb 0.63 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 1jvn h GLN 284 CO 0.04 1.03 0.09 -0.22 -0.67 0.00 0.00 178.83 179.10 1jvn h LYS 285 N 0.89 0.35 -0.34 1.46 3.64 -1.09 0.48 116.57 121.96 1jvn h LYS 285 Ca 0.14 -0.07 0.06 0.00 -1.27 0.00 0.00 60.65 59.52 1jvn h LYS 285 Cb 0.65 -0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 32.36 1jvn h LYS 285 CO 0.04 0.41 -0.00 1.88 -2.27 0.00 0.00 179.45 179.52 1jvn h TYR 286 N 0.22 -0.02 0.04 1.91 0.99 -0.85 0.17 116.97 119.42 1jvn h TYR 286 Ca 0.08 0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.83 1jvn h TYR 286 Cb 0.20 0.06 0.00 0.00 1.00 0.00 0.00 36.73 37.99 1jvn h TYR 286 CO -0.00 -0.06 -0.02 -0.92 -0.00 0.00 0.00 178.16 177.15 1jvn h TYR 287 N 0.09 -0.04 -0.03 4.88 3.20 -1.11 -1.19 116.97 122.78 1jvn h TYR 287 Ca 0.17 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.04 1jvn h TYR 287 Cb 0.23 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.51 1jvn h TYR 287 CO -0.24 -0.00 0.04 1.96 -1.64 0.00 0.00 178.16 178.28 1jvn h GLN 288 N -0.07 0.00 -0.64 1.82 4.20 -0.49 -1.76 115.11 118.16 1jvn h GLN 288 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1jvn h GLN 288 Cb 0.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1jvn h GLN 288 CO 0.01 0.00 0.00 1.04 -0.67 0.00 0.00 178.83 179.21 1jvn n GLN 289 N -3.62 2.84 -0.04 1.46 6.02 0.01 -4.95 117.38 119.11 1jvn n GLN 289 Ca -0.02 -2.39 0.00 0.00 -0.01 0.00 0.00 57.00 54.58 1jvn n GLN 289 Cb 0.13 -1.62 0.00 0.00 1.02 0.00 0.00 30.24 29.76 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 1.34 0.85 3.72 1.08 0.00 -0.66 -1.10 105.19 110.41 1jvn n GLY 290 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.02 3.82 -0.62 4.61 0.00 -0.52 -4.78 121.76 122.25 1jvn s ALA 291 Ca 0.00 1.45 0.25 0.00 0.00 0.00 0.00 51.96 53.66 1jvn s ALA 291 Cb 0.00 -3.64 0.59 0.00 0.00 0.00 0.00 23.12 20.06 1jvn s ALA 291 CO 0.00 -0.83 1.63 -0.44 0.00 0.00 0.00 175.76 176.12 1jvn h ASP 292 N 6.59 0.00 -4.88 0.00 3.32 -1.66 -3.44 116.42 116.35 1jvn h ASP 292 Ca -0.43 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 56.55 1jvn h ASP 292 Cb 1.20 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.56 1jvn h ASP 292 CO 0.91 0.02 0.24 -1.61 -1.72 0.00 0.00 179.24 177.08 1jvn s GLU 293 N -3.15 0.99 -0.14 3.56 2.02 -1.24 -4.18 118.70 116.56 1jvn s GLU 293 Ca 0.09 0.24 -0.00 0.00 0.02 0.00 0.00 54.97 55.32 1jvn s GLU 293 Cb 0.11 0.47 0.03 0.00 0.10 0.00 0.00 34.13 34.83 1jvn s GLU 293 CO 0.64 -0.31 -0.10 0.08 0.02 0.00 0.00 175.26 175.59 1jvn s VAL 294 N -1.19 1.29 -0.17 2.63 1.01 -0.75 -1.28 120.40 121.94 1jvn s VAL 294 Ca -0.10 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.28 1jvn s VAL 294 Cb -0.00 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 1jvn s VAL 294 CO 0.09 0.34 0.05 -0.89 0.00 0.00 0.00 175.10 174.68 1jvn s THR 295 N 1.59 4.65 -0.20 3.92 2.01 0.30 -1.01 115.64 126.88 1jvn s THR 295 Ca 0.04 -0.09 -0.05 0.00 0.31 0.00 0.00 61.69 61.90 1jvn s THR 295 Cb -0.13 -3.08 -0.02 0.00 0.01 0.00 0.00 72.50 69.28 1jvn s THR 295 CO -0.09 0.48 -0.01 -0.36 -0.69 0.00 0.00 174.62 173.95 1jvn s PHE 296 N 0.26 3.02 -0.60 4.92 0.40 0.13 -1.25 117.98 124.85 1jvn s PHE 296 Ca 0.03 -0.56 -0.16 0.00 -0.60 0.00 0.00 56.93 55.64 1jvn s PHE 296 Cb -0.13 -2.09 0.14 0.00 0.51 0.00 0.00 43.02 41.46 1jvn s PHE 296 CO 0.01 -0.31 0.57 -0.51 0.70 0.00 0.00 175.22 175.68 1jvn s LEU 297 N 1.11 6.21 -0.53 -0.37 1.43 0.23 -0.58 118.68 126.18 1jvn s LEU 297 Ca 0.02 -1.93 -0.27 0.00 -1.03 0.00 0.00 54.13 50.92 1jvn s LEU 297 Cb -0.14 -2.22 -0.01 0.00 0.03 0.00 0.00 46.19 43.85 1jvn s LEU 297 CO 0.01 -0.83 1.67 0.21 0.23 0.00 0.00 176.35 177.64 1jvn s ASN 298 N 3.34 5.73 -0.35 2.29 3.04 0.19 -1.11 114.94 128.08 1jvn s ASN 298 Ca 0.07 0.51 0.10 0.00 0.04 0.00 0.00 52.86 53.58 1jvn s ASN 298 Cb -0.26 -2.54 0.45 0.00 -1.54 0.00 0.00 41.25 37.37 1jvn s ASN 298 CO 0.01 -1.98 1.11 2.30 -3.04 0.00 0.00 177.10 175.50 1jvn n ILE 299 N 7.11 2.05 -1.56 -5.21 -5.35 -0.39 -4.43 119.36 111.58 1jvn n ILE 299 Ca 0.18 -4.12 0.00 0.00 -0.27 0.00 0.00 62.75 58.53 1jvn n ILE 299 Cb 0.50 -0.56 0.00 0.00 -1.74 0.00 0.00 39.64 37.84 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 -0.50 0.00 0.00 7.28 -2.24 -1.18 -4.30 114.28 113.33 1jvn n THR 300 Ca 0.31 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.09 1jvn n THR 300 Cb 0.81 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 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 -4.68 3.42 8.00 -1.26 -4.99 116.55 117.04 1jvn n ASP 304 Ca 0.00 0.00 -0.36 0.00 0.71 0.00 0.00 54.79 55.14 1jvn n ASP 304 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.01 1jvn n ASP 304 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jvn s PRO 306 N 0.93 2.77 0.11 0.00 0.02 -1.26 -4.72 135.00 132.85 1jvn s PRO 306 Ca 0.10 1.97 -0.30 0.00 0.02 0.00 0.00 61.00 62.79 1jvn s PRO 306 Cb -0.13 -1.90 -0.09 0.00 0.02 0.00 0.00 34.50 32.40 1jvn s PRO 306 CO 0.04 -1.41 1.60 1.25 -0.33 0.00 0.00 177.00 178.15 1jvn h LEU 307 N 0.74 -1.15 -1.76 -5.54 5.85 -1.98 -1.32 115.31 110.16 1jvn h LEU 307 Ca -0.51 0.13 0.53 0.00 0.84 0.00 0.00 57.88 58.87 1jvn h LEU 307 Cb 1.32 0.44 -0.10 0.00 0.37 0.00 0.00 40.66 42.68 1jvn h LEU 307 CO 0.54 -0.46 1.20 0.11 -0.34 0.00 0.00 178.44 179.49 1jvn h LYS 308 N -0.61 0.01 -0.66 1.25 1.57 -2.04 0.98 116.57 117.08 1jvn h LYS 308 Ca 0.03 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1jvn h LYS 308 Cb 0.65 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 1jvn h LYS 308 CO -0.24 0.01 0.00 -0.25 -0.57 0.00 0.00 179.45 178.39 1jvn n ASP 309 N -4.26 4.41 -4.63 0.86 8.00 -0.51 -4.94 116.55 115.49 1jvn n ASP 309 Ca 0.42 -2.29 -0.43 0.00 0.71 0.00 0.00 54.79 53.20 1jvn n ASP 309 Cb 1.81 -0.53 -0.03 0.00 -0.02 0.00 0.00 41.12 42.35 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 1.24 0.53 0.24 -3.53 -1.04 0.34 -4.81 114.28 107.25 1jvn n THR 310 Ca 0.25 -0.31 0.15 0.00 -2.04 0.00 0.00 64.05 62.10 1jvn n THR 310 Cb 0.78 -2.42 0.80 0.00 -1.82 0.00 0.00 70.33 67.67 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 12.93 0.00 0.00 -2.82 0.13 -1.92 -0.33 132.00 139.99 1jvn h PRO 311 Ca -0.45 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.59 1jvn h PRO 311 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 1jvn h PRO 311 CO 0.95 0.00 -0.42 1.98 -0.23 0.00 0.00 178.00 180.28 1jvn h MET 312 N 0.00 0.00 0.00 0.86 4.05 -1.97 -1.95 114.93 115.92 1jvn h MET 312 Ca 0.00 0.00 -0.08 0.00 -0.28 0.00 0.00 59.70 59.34 1jvn h MET 312 Cb 0.12 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 30.91 1jvn h MET 312 CO 0.00 0.42 -0.37 -0.07 0.23 0.00 0.00 176.91 177.12 1jvn h LEU 313 N 0.00 0.00 -0.07 3.39 3.38 -1.42 -2.20 115.31 118.38 1jvn h LEU 313 Ca -0.00 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.74 1jvn h LEU 313 Cb 0.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1jvn h LEU 313 CO 0.05 0.37 -1.02 -0.08 0.09 0.00 0.00 178.44 177.86 1jvn h GLU 314 N 0.00 0.13 -0.55 1.13 4.57 -1.45 -1.75 114.58 116.66 1jvn h GLU 314 Ca -0.00 -0.19 -0.05 0.00 -1.18 0.00 0.00 59.36 57.94 1jvn h GLU 314 Cb 0.82 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.45 1jvn h GLU 314 CO 0.05 1.03 0.13 0.28 -1.18 0.00 0.00 179.01 179.32 1jvn h VAL 315 N 0.05 1.25 -0.24 0.32 2.07 -1.04 -0.64 116.25 118.02 1jvn h VAL 315 Ca -0.05 -0.89 -0.04 0.00 0.82 0.00 0.00 66.70 66.54 1jvn h VAL 315 Cb 1.73 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 32.26 1jvn h VAL 315 CO 0.15 0.33 -0.01 -0.07 0.02 0.00 0.00 177.57 177.98 1jvn h LEU 316 N 0.78 0.42 -0.72 2.57 3.38 -1.37 0.22 115.31 120.59 1jvn h LEU 316 Ca 0.17 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1jvn h LEU 316 Cb 0.35 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 1jvn h LEU 316 CO 0.00 0.64 0.36 0.50 0.09 0.00 0.00 178.44 180.04 1jvn h LYS 317 N 0.20 1.02 -0.19 1.13 3.64 -0.51 0.23 116.57 122.08 1jvn h LYS 317 Ca 0.07 -0.14 -0.17 0.00 -1.27 0.00 0.00 60.65 59.14 1jvn h LYS 317 Cb 0.43 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1jvn h LYS 317 CO 0.01 0.79 -0.54 1.96 -2.27 0.00 0.00 179.45 179.40 1jvn h GLN 318 N 1.00 0.70 -0.53 1.90 1.08 -1.07 -3.18 115.11 115.00 1jvn h GLN 318 Ca 0.25 -0.50 -0.01 0.00 -1.45 0.00 0.00 58.65 56.94 1jvn h GLN 318 Cb 0.09 0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.57 1jvn h GLN 318 CO -0.03 1.12 0.30 0.00 -0.95 0.00 0.00 178.83 179.27 1jvn h ALA 319 N 0.58 0.68 0.00 3.87 0.00 -0.79 -2.62 119.26 120.98 1jvn h ALA 319 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1jvn h ALA 319 Cb 1.16 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1jvn h ALA 319 CO 0.12 0.19 0.00 0.00 0.00 0.00 0.00 179.25 179.55 1jvn n ALA 320 N -2.28 1.08 0.14 0.00 0.00 0.05 -1.49 120.51 118.01 1jvn n ALA 320 Ca 0.03 0.12 -0.01 0.00 0.00 0.00 0.00 53.44 53.58 1jvn n ALA 320 Cb 0.07 -1.20 0.21 0.00 0.00 0.00 0.00 19.45 18.53 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 0.04 0.00 0.00 1.57 -1.45 -3.39 116.57 113.34 1jvn h LYS 321 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1jvn h LYS 321 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1jvn h LYS 321 CO 0.00 0.58 -0.45 0.25 -0.57 0.00 0.00 179.45 179.26 1jvn n THR 322 N -3.89 0.00 -2.91 -0.16 -2.24 -1.01 -4.84 114.28 99.22 1jvn n THR 322 Ca -0.01 -0.06 -0.43 0.00 -2.27 0.00 0.00 64.05 61.28 1jvn n THR 322 Cb 0.56 0.43 -0.04 0.00 -2.10 0.00 0.00 70.33 69.18 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 -1.01 4.45 -0.82 2.28 1.01 -0.55 -4.92 120.40 120.84 1jvn s VAL 323 Ca 0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 61.98 61.65 1jvn s VAL 323 Cb 0.00 -4.59 0.23 0.00 0.00 0.00 0.00 36.38 32.02 1jvn s VAL 323 CO 0.00 -1.27 2.26 0.49 0.00 0.00 0.00 175.10 176.58 1jvn n PHE 324 N 7.33 2.48 -4.11 5.22 3.01 -1.26 -4.67 117.46 125.46 1jvn n PHE 324 Ca -0.04 -2.31 -0.08 0.00 1.01 0.00 0.00 57.45 56.04 1jvn n PHE 324 Cb 0.45 -1.32 -0.10 0.00 -0.01 0.00 0.00 39.48 38.50 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 -3.64 0.21 0.32 -4.37 -7.23 -1.26 -0.89 120.40 103.53 1jvn s VAL 325 Ca 0.52 -1.84 -0.29 0.00 -1.81 0.00 0.00 61.98 58.55 1jvn s VAL 325 Cb 0.35 -1.68 -0.12 0.00 0.56 0.00 0.00 36.38 35.49 1jvn s VAL 325 CO -0.27 -0.84 1.52 -2.65 -0.31 0.00 0.00 175.10 172.54 1jvn n PRO 326 N 0.04 2.57 -4.91 4.82 -0.02 -1.26 -4.85 135.00 131.39 1jvn n PRO 326 Ca -0.11 0.91 -0.33 0.00 -2.02 0.00 0.00 63.50 61.95 1jvn n PRO 326 Cb 0.62 -2.64 -0.15 0.00 -0.02 0.00 0.00 33.50 31.31 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 -0.91 2.57 0.02 2.45 1.43 -1.26 -1.82 118.68 121.17 1jvn s LEU 327 Ca 0.61 -0.35 0.08 0.00 -1.03 0.00 0.00 54.13 53.44 1jvn s LEU 327 Cb -0.51 -1.55 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 1jvn s LEU 327 CO 0.54 0.21 -0.25 -0.89 0.23 0.00 0.00 176.35 176.19 1jvn s THR 328 N 0.06 2.21 -0.04 5.49 2.01 -0.18 0.24 115.64 125.43 1jvn s THR 328 Ca -0.06 -1.26 0.03 0.00 0.31 0.00 0.00 61.69 60.70 1jvn s THR 328 Cb -0.15 -1.84 0.01 0.00 0.01 0.00 0.00 72.50 70.53 1jvn s THR 328 CO 0.05 0.44 -0.12 0.54 -0.69 0.00 0.00 174.62 174.83 1jvn s VAL 329 N -0.76 1.05 -0.01 3.82 0.11 -0.68 0.18 120.40 124.11 1jvn s VAL 329 Ca 0.11 -0.48 0.04 0.00 -2.93 0.00 0.00 61.98 58.72 1jvn s VAL 329 Cb -0.10 -0.94 -0.01 0.00 -1.53 0.00 0.00 36.38 33.80 1jvn s VAL 329 CO 0.01 0.32 -0.12 -0.83 -3.33 0.00 0.00 175.10 171.15 1jvn s GLY 330 N 0.33 0.62 0.00 6.54 0.00 0.26 0.05 107.32 115.11 1jvn s GLY 330 Ca -0.07 -0.53 0.00 0.00 0.00 0.00 0.00 44.72 44.12 1jvn s GLY 330 CO 0.02 -0.43 0.00 0.61 0.00 0.00 0.00 173.10 173.30 1jvn n GLY 331 N 2.80 2.18 2.05 0.20 0.00 -1.25 0.56 105.19 111.74 1jvn n GLY 331 Ca -0.14 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.71 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 1.83 0.74 3.42 -0.02 0.00 -1.26 -4.68 105.19 105.22 1jvn n GLY 332 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.78 5.13 0.35 -0.61 -1.09 -1.26 -4.91 121.20 116.03 1jvn s ILE 333 Ca 0.00 -2.28 -0.16 0.00 -2.23 0.00 0.00 60.65 55.98 1jvn s ILE 333 Cb 0.00 -4.74 0.04 0.00 -1.58 0.00 0.00 42.46 36.18 1jvn s ILE 333 CO 0.00 -1.42 0.75 -1.59 -1.23 0.00 0.00 174.94 171.45 1jvn s LYS 334 N 1.43 2.08 -0.01 2.79 -2.85 -1.26 -4.90 119.74 117.01 1jvn s LYS 334 Ca 0.33 -1.33 -0.30 0.00 -1.00 0.00 0.00 55.97 53.67 1jvn s LYS 334 Cb -0.06 0.61 -0.06 0.00 -2.06 0.00 0.00 37.83 36.26 1jvn s LYS 334 CO -0.06 -0.96 1.55 -0.51 0.10 0.00 0.00 175.35 175.47 1jvn s ASP 335 N -3.04 6.72 0.19 0.03 1.01 -1.26 -3.76 116.67 116.56 1jvn s ASP 335 Ca 0.15 2.23 0.06 0.00 0.71 0.00 0.00 52.55 55.70 1jvn s ASP 335 Cb -0.05 -2.55 -0.05 0.00 1.01 0.00 0.00 42.92 41.28 1jvn s ASP 335 CO 0.11 -0.84 -0.10 0.27 0.21 0.00 0.00 175.17 174.82 1jvn s ILE 336 N 3.14 1.37 -0.24 0.77 -4.36 0.92 -4.91 121.20 117.89 1jvn s ILE 336 Ca 0.69 -2.11 -0.01 0.00 -0.26 0.00 0.00 60.65 58.96 1jvn s ILE 336 Cb -0.34 -2.03 0.02 0.00 1.25 0.00 0.00 42.46 41.37 1jvn s ILE 336 CO 0.28 -0.61 -0.09 -0.69 0.24 0.00 0.00 174.94 174.08 1jvn s VAL 337 N -3.20 2.73 1.05 8.37 1.01 -1.26 -1.46 120.40 127.63 1jvn s VAL 337 Ca 0.21 -1.01 -0.12 0.00 0.00 0.00 0.00 61.98 61.06 1jvn s VAL 337 Cb 0.02 -2.35 0.22 0.00 0.00 0.00 0.00 36.38 34.27 1jvn s VAL 337 CO 0.05 0.26 1.07 -0.62 0.00 0.00 0.00 175.10 175.85 1jvn s ASP 338 N 1.31 1.95 0.42 3.32 -1.08 -0.70 -4.81 116.67 117.09 1jvn s ASP 338 Ca 0.01 1.56 0.15 0.00 -0.52 0.00 0.00 52.55 53.75 1jvn s ASP 338 Cb -0.16 -2.25 1.03 0.00 -1.46 0.00 0.00 42.92 40.08 1jvn s ASP 338 CO -0.06 -3.60 1.91 0.58 0.52 0.00 0.00 175.17 174.52 1jvn h VAL 339 N -2.21 0.79 -0.40 1.11 2.07 -1.90 0.69 116.25 116.40 1jvn h VAL 339 Ca -0.56 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 66.81 1jvn h VAL 339 Cb 1.31 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1jvn h VAL 339 CO 0.51 0.08 0.00 -0.90 0.02 0.00 0.00 177.57 177.28 1jvn n ASP 340 N -4.49 3.17 0.00 0.57 5.68 -1.26 -4.90 116.55 115.33 1jvn n ASP 340 Ca 0.15 -2.30 0.00 0.00 -0.50 0.00 0.00 54.79 52.14 1jvn n ASP 340 Cb 0.54 -0.47 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 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 0.77 0.81 3.68 6.12 0.00 0.23 -4.98 105.19 111.82 1jvn n GLY 341 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.30 3.17 -0.46 2.61 2.01 -1.26 -4.72 115.64 113.70 1jvn s THR 342 Ca 0.00 0.48 -0.28 0.00 0.31 0.00 0.00 61.69 62.20 1jvn s THR 342 Cb 0.00 -3.31 0.03 0.00 0.01 0.00 0.00 72.50 69.23 1jvn s THR 342 CO 0.00 -0.02 1.08 -0.54 -0.69 0.00 0.00 174.62 174.45 1jvn s LYS 343 N 3.20 3.70 -0.35 4.92 1.02 -1.26 -1.71 119.74 129.26 1jvn s LYS 343 Ca 0.76 0.50 -0.03 0.00 0.02 0.00 0.00 55.97 57.22 1jvn s LYS 343 Cb -0.39 -3.90 0.08 0.00 -0.52 0.00 0.00 37.83 33.10 1jvn s LYS 343 CO 0.33 -1.30 0.10 0.42 -0.92 0.00 0.00 175.35 173.97 1jvn s ILE 344 N 4.22 3.19 0.79 2.17 1.01 -0.54 -5.03 121.20 127.00 1jvn s ILE 344 Ca 0.45 -1.66 -0.13 0.00 0.00 0.00 0.00 60.65 59.31 1jvn s ILE 344 Cb -0.08 -3.00 0.07 0.00 0.01 0.00 0.00 42.46 39.46 1jvn s ILE 344 CO 0.29 -0.38 1.17 -2.84 0.00 0.00 0.00 174.94 173.18 1jvn s PRO 345 N 1.21 1.87 0.27 2.79 0.02 -1.26 -0.06 135.00 139.84 1jvn s PRO 345 Ca 0.01 1.59 -0.01 0.00 0.02 0.00 0.00 61.00 62.62 1jvn s PRO 345 Cb -0.21 -1.82 0.51 0.00 0.02 0.00 0.00 34.50 33.00 1jvn s PRO 345 CO -0.02 -2.00 1.82 0.00 -0.33 0.00 0.00 177.00 176.46 1jvn h ALA 346 N -0.86 1.40 -0.46 -1.55 0.00 -1.91 -0.14 119.26 115.74 1jvn h ALA 346 Ca -0.46 0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.51 1jvn h ALA 346 Cb 1.27 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1jvn h ALA 346 CO 0.48 0.16 0.26 1.25 0.00 0.00 0.00 179.25 181.39 1jvn h LEU 347 N 0.90 0.40 -0.69 0.00 5.85 -1.91 0.14 115.31 120.02 1jvn h LEU 347 Ca 0.47 0.01 -0.13 0.00 0.84 0.00 0.00 57.88 59.06 1jvn h LEU 347 Cb 0.47 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 1jvn h LEU 347 CO -0.27 0.29 -0.43 -0.33 -0.34 0.00 0.00 178.44 177.36 1jvn h GLU 348 N 0.52 0.51 -0.38 1.25 5.08 -1.71 -0.22 114.58 119.62 1jvn h GLU 348 Ca 0.19 -0.27 -0.08 0.00 -1.00 0.00 0.00 59.36 58.20 1jvn h GLU 348 Cb 0.05 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1jvn h GLU 348 CO -0.10 0.85 -0.08 0.28 -1.00 0.00 0.00 179.01 178.96 1jvn h VAL 349 N 0.42 1.27 -0.34 3.13 2.07 -0.64 -2.08 116.25 120.08 1jvn h VAL 349 Ca 0.03 -1.14 -0.03 0.00 0.82 0.00 0.00 66.70 66.38 1jvn h VAL 349 Cb 0.92 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.91 1jvn h VAL 349 CO 0.08 0.38 0.11 0.00 0.02 0.00 0.00 177.57 178.16 1jvn h ALA 350 N 0.84 0.45 -0.74 1.67 0.00 -0.59 -2.22 119.26 118.67 1jvn h ALA 350 Ca 0.10 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.92 1jvn h ALA 350 Cb 0.58 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 1jvn h ALA 350 CO 0.03 0.09 0.49 0.77 0.00 0.00 0.00 179.25 180.63 1jvn h SER 351 N 0.41 0.68 -0.36 0.00 0.02 -0.93 0.12 113.55 113.48 1jvn h SER 351 Ca 0.11 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.92 1jvn h SER 351 Cb 0.25 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 1jvn h SER 351 CO -0.00 0.44 -0.33 0.25 -1.14 0.00 0.00 176.83 176.05 1jvn h LEU 352 N 0.78 0.92 -0.63 5.07 5.85 -1.07 -0.61 115.31 125.60 1jvn h LEU 352 Ca 0.32 -0.46 -0.12 0.00 0.84 0.00 0.00 57.88 58.46 1jvn h LEU 352 Cb 0.26 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 1jvn h LEU 352 CO -0.11 1.18 -0.21 1.88 -0.34 0.00 0.00 178.44 180.85 1jvn h TYR 353 N 0.66 0.97 -0.05 1.25 -1.99 -0.74 -1.60 116.97 115.48 1jvn h TYR 353 Ca 0.06 -0.22 -0.00 0.00 2.00 0.00 0.00 58.73 60.57 1jvn h TYR 353 Cb 0.91 -0.23 -0.00 0.00 2.00 0.00 0.00 36.73 39.41 1jvn h TYR 353 CO 0.07 0.98 0.02 0.74 -0.00 0.00 0.00 178.16 179.97 1jvn h PHE 354 N 0.74 0.07 0.00 4.88 0.05 -0.67 -1.00 116.94 121.01 1jvn h PHE 354 Ca 0.10 -0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.89 1jvn h PHE 354 Cb 0.74 -0.02 0.00 0.00 2.00 0.00 0.00 35.95 38.67 1jvn h PHE 354 CO 0.04 0.18 0.00 0.00 -0.18 0.00 0.00 178.31 178.36 1jvn h ARG 355 N -0.06 0.00 0.00 1.51 3.08 -1.03 -1.59 114.38 116.29 1jvn h ARG 355 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1jvn h ARG 355 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 1jvn h ARG 355 CO -0.00 0.00 -0.41 0.43 -1.07 0.00 0.00 179.97 178.92 1jvn n SER 356 N -3.04 0.56 0.00 7.04 7.64 -0.61 -4.66 113.62 120.54 1jvn n SER 356 Ca -0.01 0.14 0.00 0.00 1.01 0.00 0.00 58.87 60.01 1jvn n SER 356 Cb 0.20 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 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 1.40 0.58 3.82 0.23 0.00 -0.61 -1.80 105.19 108.81 1jvn n GLY 357 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.76 3.03 -0.02 4.61 0.00 -0.43 -4.65 121.76 123.54 1jvn s ALA 358 Ca 0.00 0.43 0.08 0.00 0.00 0.00 0.00 51.96 52.47 1jvn s ALA 358 Cb 0.00 -3.16 -0.13 0.00 0.00 0.00 0.00 23.12 19.83 1jvn s ALA 358 CO 0.00 0.09 0.16 -0.25 0.00 0.00 0.00 175.76 175.76 1jvn n ASP 359 N -0.61 3.01 -3.80 0.00 8.00 0.14 -4.28 116.55 119.00 1jvn n ASP 359 Ca 0.07 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.45 1jvn n ASP 359 Cb 0.54 1.28 -0.10 0.00 -0.02 0.00 0.00 41.12 42.81 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 -2.54 0.43 -0.01 -1.24 1.02 -1.04 -4.65 119.74 111.72 1jvn s LYS 360 Ca -0.03 0.04 0.05 0.00 0.02 0.00 0.00 55.97 56.04 1jvn s LYS 360 Cb 0.05 0.20 -0.03 0.00 -0.52 0.00 0.00 37.83 37.53 1jvn s LYS 360 CO 0.36 -0.09 -0.15 0.14 -0.92 0.00 0.00 175.35 174.68 1jvn s VAL 361 N -0.60 3.00 -0.20 3.17 -7.23 -0.56 -1.69 120.40 116.28 1jvn s VAL 361 Ca -0.07 -0.91 -0.08 0.00 -1.81 0.00 0.00 61.98 59.11 1jvn s VAL 361 Cb -0.04 -2.22 -0.04 0.00 0.56 0.00 0.00 36.38 34.64 1jvn s VAL 361 CO 0.02 0.48 0.08 -0.55 -0.31 0.00 0.00 175.10 174.81 1jvn s SER 362 N -1.06 5.60 -0.20 4.85 0.15 0.11 -1.61 113.70 121.53 1jvn s SER 362 Ca 0.13 0.03 -0.07 0.00 0.70 0.00 0.00 55.95 56.74 1jvn s SER 362 Cb -0.11 -1.98 -0.04 0.00 -1.71 0.00 0.00 66.02 62.19 1jvn s SER 362 CO 0.03 0.12 0.06 -0.63 1.20 0.00 0.00 173.24 174.01 1jvn s ILE 363 N 0.72 4.51 0.00 6.45 -1.09 0.42 -3.81 121.20 128.40 1jvn s ILE 363 Ca 0.04 -0.12 0.00 0.00 -2.23 0.00 0.00 60.65 58.34 1jvn s ILE 363 Cb -0.13 -3.06 0.00 0.00 -1.58 0.00 0.00 42.46 37.69 1jvn s ILE 363 CO 0.02 0.42 0.00 0.61 -1.23 0.00 0.00 174.94 174.75 1jvn n GLY 364 N 4.07 0.13 0.20 6.18 0.00 -1.26 -0.49 105.19 114.01 1jvn n GLY 364 Ca -0.16 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.83 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 0.69 0.00 2.61 2.02 -1.90 -1.93 112.91 114.40 1jvn h THR 365 Ca 0.00 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 1jvn h THR 365 Cb 0.00 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 66.88 1jvn h THR 365 CO 0.00 0.04 -0.01 0.44 0.37 0.00 0.00 175.52 176.36 1jvn h ASP 366 N 0.20 0.00 -0.27 4.18 5.19 -1.95 -1.64 116.42 122.14 1jvn h ASP 366 Ca 0.25 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 56.54 1jvn h ASP 366 Cb 0.35 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.84 1jvn h ASP 366 CO -0.35 0.01 -0.24 0.00 -3.12 0.00 0.00 179.24 175.54 1jvn h ALA 367 N 1.99 0.88 -0.32 3.45 0.00 -1.62 0.81 119.26 124.45 1jvn h ALA 367 Ca -0.00 -0.38 -0.12 0.00 0.00 0.00 0.00 54.91 54.41 1jvn h ALA 367 Cb 0.12 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1jvn h ALA 367 CO 0.00 0.63 -0.27 0.28 0.00 0.00 0.00 179.25 179.89 1jvn h VAL 368 N 0.65 1.29 -0.65 0.00 2.07 -1.36 -0.76 116.25 117.49 1jvn h VAL 368 Ca 0.09 -1.42 -0.03 0.00 0.82 0.00 0.00 66.70 66.15 1jvn h VAL 368 Cb 0.75 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 1jvn h VAL 368 CO 0.06 0.46 0.28 1.88 0.02 0.00 0.00 177.57 180.27 1jvn h TYR 369 N 0.51 0.97 -0.56 1.57 0.99 -1.35 -0.94 116.97 118.16 1jvn h TYR 369 Ca 0.06 -0.06 -0.05 0.00 2.00 0.00 0.00 58.73 60.67 1jvn h TYR 369 Cb 0.83 -0.29 -0.02 0.00 1.00 0.00 0.00 36.73 38.25 1jvn h TYR 369 CO 0.07 0.75 0.15 0.00 -0.00 0.00 0.00 178.16 179.12 1jvn h ALA 370 N 1.12 0.73 -0.54 3.88 0.00 -0.74 -1.41 119.26 122.31 1jvn h ALA 370 Ca 0.22 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1jvn h ALA 370 Cb 0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1jvn h ALA 370 CO -0.02 0.42 -0.12 0.00 0.00 0.00 0.00 179.25 179.53 1jvn h ALA 371 N 1.03 0.74 -0.32 0.00 0.00 -0.89 0.11 119.26 119.93 1jvn h ALA 371 Ca 0.18 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1jvn h ALA 371 Cb 0.32 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1jvn h ALA 371 CO -0.00 0.66 0.06 0.93 0.00 0.00 0.00 179.25 180.90 1jvn h GLU 372 N 0.91 0.53 -0.76 0.00 5.08 -1.06 -2.50 114.58 116.78 1jvn h GLU 372 Ca 0.14 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1jvn h GLU 372 Cb 0.69 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 1jvn h GLU 372 CO 0.05 0.62 0.26 -0.22 -1.00 0.00 0.00 179.01 178.71 1jvn h LYS 373 N 0.36 1.17 -0.46 2.33 3.64 -1.16 -2.38 116.57 120.08 1jvn h LYS 373 Ca 0.10 -0.24 0.08 0.00 -1.27 0.00 0.00 60.65 59.32 1jvn h LYS 373 Cb 0.34 -0.18 -0.07 0.00 -0.41 0.00 0.00 32.23 31.92 1jvn h LYS 373 CO 0.01 0.98 0.05 -0.92 -2.27 0.00 0.00 179.45 177.30 1jvn h TYR 374 N 1.13 0.07 -0.04 1.91 3.20 -0.46 -0.77 116.97 122.01 1jvn h TYR 374 Ca 0.25 0.03 -0.15 0.00 3.14 0.00 0.00 58.73 62.00 1jvn h TYR 374 Cb 0.28 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 1jvn h TYR 374 CO 0.02 -0.04 -0.66 1.88 -1.64 0.00 0.00 178.16 177.72 1jvn h TYR 375 N 0.18 0.21 -0.32 -3.82 -1.99 -1.32 0.79 116.97 110.70 1jvn h TYR 375 Ca 0.23 -0.09 -0.02 0.00 2.00 0.00 0.00 58.73 60.85 1jvn h TYR 375 Cb 0.31 -0.03 -0.01 0.00 2.00 0.00 0.00 36.73 38.99 1jvn h TYR 375 CO -0.25 0.77 0.13 0.93 -0.00 0.00 0.00 178.16 179.75 1jvn h GLU 376 N 0.11 0.48 0.00 4.88 5.08 -0.89 -2.57 114.58 121.67 1jvn h GLU 376 Ca -0.01 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1jvn h GLU 376 Cb 1.18 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1jvn h GLU 376 CO 0.10 0.48 0.00 1.28 -1.00 0.00 0.00 179.01 179.86 1jvn n LEU 377 N -4.72 0.00 -0.54 1.33 4.77 -0.35 -4.84 117.00 112.65 1jvn n LEU 377 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 1jvn n LEU 377 Cb 0.13 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1jvn n LEU 377 CO 0.36 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 1jvn n GLY 378 N 0.33 0.80 2.89 -0.72 0.00 -0.97 -4.29 105.19 103.23 1jvn n GLY 378 Ca 0.11 -0.49 -0.14 0.00 0.00 0.00 0.00 46.02 45.49 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 0.53 -2.54 -4.04 1.61 4.13 0.22 -5.01 115.26 110.17 1jvn n ASN 379 Ca 0.00 -0.46 -0.08 0.00 1.68 0.00 0.00 54.58 55.72 1jvn n ASN 379 Cb 0.40 -4.01 -0.10 0.00 -1.54 0.00 0.00 39.78 34.53 1jvn n ASN 379 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1jvn s ARG 380 N -5.18 0.51 0.15 3.52 1.81 -0.90 -5.02 118.95 113.84 1jvn s ARG 380 Ca 0.07 -0.98 0.08 0.00 -1.72 0.00 0.00 55.73 53.18 1jvn s ARG 380 Cb -0.03 0.18 -0.04 0.00 -0.45 0.00 0.00 34.95 34.61 1jvn s ARG 380 CO 0.56 -0.10 -0.08 0.20 -0.68 0.00 0.00 175.30 175.20 1jvn s GLY 381 N -2.38 1.76 0.00 -3.53 0.00 -1.26 -4.23 107.32 97.67 1jvn s GLY 381 Ca -0.01 -1.36 0.20 0.00 0.00 0.00 0.00 44.72 43.55 1jvn s GLY 381 CO -0.07 -1.36 1.44 2.09 0.00 0.00 0.00 173.10 175.21 1jvn n ASP 382 N 0.31 3.63 -0.31 1.64 5.68 -1.26 -4.95 116.55 121.29 1jvn n ASP 382 Ca -0.12 -1.99 -0.04 0.00 -0.50 0.00 0.00 54.79 52.15 1jvn n ASP 382 Cb 0.54 -0.39 -0.02 0.00 -1.14 0.00 0.00 41.12 40.11 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 0.64 0.01 6.12 0.00 -1.26 -4.89 105.19 107.18 1jvn n GLY 383 Ca 0.21 -0.30 0.09 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.66 0.00 -2.16 2.61 -2.24 -1.26 -4.51 114.28 104.06 1jvn n THR 384 Ca -0.04 -0.32 -0.37 0.00 -2.27 0.00 0.00 64.05 61.06 1jvn n THR 384 Cb 0.24 0.37 0.01 0.00 -2.10 0.00 0.00 70.33 68.84 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 -3.73 5.81 0.53 3.42 1.04 -1.26 -4.81 113.70 114.70 1jvn s SER 385 Ca -0.02 2.35 0.19 0.00 0.48 0.00 0.00 55.95 58.95 1jvn s SER 385 Cb 0.13 -2.60 1.37 0.00 0.10 0.00 0.00 66.02 65.01 1jvn s SER 385 CO 0.78 -1.17 2.15 -0.65 0.98 0.00 0.00 173.24 175.34 1jvn h PRO 386 N 1.62 0.00 -0.31 4.02 0.11 -1.94 0.10 132.00 135.60 1jvn h PRO 386 Ca -0.50 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 1jvn h PRO 386 Cb 1.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1jvn h PRO 386 CO 0.58 0.00 0.11 0.82 -0.21 0.00 0.00 178.00 179.31 1jvn h ILE 387 N 0.00 1.19 -0.03 4.15 2.04 -1.90 -1.54 117.51 121.42 1jvn h ILE 387 Ca 0.03 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.28 1jvn h ILE 387 Cb 0.11 1.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.19 1jvn h ILE 387 CO -0.00 0.21 -0.01 -0.33 0.00 0.00 0.00 178.15 178.01 1jvn h GLU 388 N 0.35 0.06 -0.40 2.37 5.08 -1.15 -2.41 114.58 118.48 1jvn h GLU 388 Ca 0.10 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.40 1jvn h GLU 388 Cb 0.21 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1jvn h GLU 388 CO -0.01 0.44 0.09 1.79 -1.00 0.00 0.00 179.01 180.33 1jvn h THR 389 N -0.33 1.23 -0.21 1.13 1.35 -1.09 -1.58 112.91 113.41 1jvn h THR 389 Ca 0.01 -0.79 -0.16 0.00 -0.55 0.00 0.00 66.41 64.91 1jvn h THR 389 Cb 0.43 0.99 -0.01 0.00 -1.73 0.00 0.00 68.15 67.83 1jvn h THR 389 CO 0.00 0.27 -0.53 0.40 -0.25 0.00 0.00 175.52 175.41 1jvn h ILE 390 N 0.50 1.31 -0.01 6.82 2.04 -1.38 -3.08 117.51 123.72 1jvn h ILE 390 Ca 0.12 -1.76 -0.17 0.00 1.00 0.00 0.00 64.86 64.05 1jvn h ILE 390 Cb 0.32 1.72 -0.02 0.00 -0.74 0.00 0.00 36.82 38.10 1jvn h ILE 390 CO 0.00 0.55 -0.79 0.77 0.00 0.00 0.00 178.15 178.69 1jvn h SER 391 N 0.48 0.15 -0.18 1.72 4.64 -1.43 -0.70 113.55 118.23 1jvn h SER 391 Ca 0.01 -0.11 -0.09 0.00 -0.47 0.00 0.00 61.79 61.13 1jvn h SER 391 Cb 1.09 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 63.12 1jvn h SER 391 CO 0.10 0.88 -0.18 0.11 -0.87 0.00 0.00 176.83 176.87 1jvn h LYS 392 N 0.07 0.60 0.07 4.77 1.57 -1.29 0.48 116.57 122.84 1jvn h LYS 392 Ca -0.02 -0.21 -0.21 0.00 -1.87 0.00 0.00 60.65 58.33 1jvn h LYS 392 Cb 1.38 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.64 1jvn h LYS 392 CO 0.11 0.75 -1.09 0.00 -0.57 0.00 0.00 179.45 178.65 1jvn h ALA 393 N 1.26 0.15 -0.02 3.86 0.00 -1.54 -3.41 119.26 119.56 1jvn h ALA 393 Ca 0.09 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 54.01 1jvn h ALA 393 Cb 0.62 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1jvn h ALA 393 CO 0.04 0.63 -0.06 0.66 0.00 0.00 0.00 179.25 180.52 1jvn n TYR 394 N -4.18 0.00 0.00 0.00 4.02 -0.27 -2.30 117.16 114.43 1jvn n TYR 394 Ca -0.23 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.66 1jvn n TYR 394 Cb 0.77 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.09 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 1.03 -0.49 0.24 2.72 0.00 0.17 -4.09 105.19 104.78 1jvn n GLY 395 Ca 0.10 -1.66 0.05 0.00 0.00 0.00 0.00 46.02 44.51 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 1.75 0.00 4.61 0.00 -1.72 -2.73 119.26 121.17 1jvn h ALA 396 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1jvn h ALA 396 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1jvn h ALA 396 CO 0.00 0.19 0.00 -0.56 0.00 0.00 0.00 179.25 178.88 1jvn h GLN 397 N 0.09 0.00 -0.01 0.00 -0.00 -1.86 -0.46 115.11 112.87 1jvn h GLN 397 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.67 1jvn h GLN 397 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.69 1jvn h GLN 397 CO 0.01 0.00 -0.20 0.00 -0.00 0.00 0.00 178.83 178.64 1jvn n ALA 398 N -1.99 2.97 -3.85 0.06 0.00 -1.03 -4.85 120.51 111.82 1jvn n ALA 398 Ca -0.02 -0.46 -0.30 0.00 0.00 0.00 0.00 53.44 52.65 1jvn n ALA 398 Cb 0.09 -1.08 -0.16 0.00 0.00 0.00 0.00 19.45 18.29 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 -2.34 1.69 0.00 0.00 1.01 -0.60 -1.50 120.40 118.66 1jvn s VAL 399 Ca 0.27 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 61.60 1jvn s VAL 399 Cb 0.20 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 35.01 1jvn s VAL 399 CO 0.46 0.48 -0.25 0.54 0.00 0.00 0.00 175.10 176.33 1jvn s VAL 400 N 1.18 2.02 -0.22 2.92 0.11 -0.63 -1.10 120.40 124.68 1jvn s VAL 400 Ca -0.01 -1.18 -0.08 0.00 -2.93 0.00 0.00 61.98 57.79 1jvn s VAL 400 Cb -0.14 -1.70 -0.04 0.00 -1.53 0.00 0.00 36.38 32.98 1jvn s VAL 400 CO -0.06 0.49 0.08 -0.63 -3.33 0.00 0.00 175.10 171.65 1jvn s ILE 401 N -0.66 4.64 -0.37 7.04 -1.09 0.24 -0.44 121.20 130.55 1jvn s ILE 401 Ca 0.10 -0.07 -0.20 0.00 -2.23 0.00 0.00 60.65 58.25 1jvn s ILE 401 Cb -0.10 -3.14 0.00 0.00 -1.58 0.00 0.00 42.46 37.65 1jvn s ILE 401 CO 0.00 0.38 0.60 -0.55 -1.23 0.00 0.00 174.94 174.14 1jvn s SER 402 N 1.05 6.37 -0.10 3.58 0.15 0.36 0.43 113.70 125.54 1jvn s SER 402 Ca 0.04 -0.01 -0.01 0.00 0.70 0.00 0.00 55.95 56.67 1jvn s SER 402 Cb -0.14 -2.31 -0.03 0.00 -1.71 0.00 0.00 66.02 61.84 1jvn s SER 402 CO 0.03 -0.59 -0.05 -0.69 1.20 0.00 0.00 173.24 173.14 1jvn s VAL 403 N 2.62 3.85 -0.64 4.45 1.01 -0.48 -4.46 120.40 126.75 1jvn s VAL 403 Ca 0.22 -0.41 0.06 0.00 0.00 0.00 0.00 61.98 61.85 1jvn s VAL 403 Cb -0.15 -2.61 0.22 0.00 0.00 0.00 0.00 36.38 33.84 1jvn s VAL 403 CO 0.15 0.57 0.62 0.47 0.00 0.00 0.00 175.10 176.91 1jvn n ASP 404 N 2.58 3.04 -4.80 3.32 8.00 -1.26 -1.82 116.55 125.61 1jvn n ASP 404 Ca -0.18 -3.26 -0.32 0.00 0.71 0.00 0.00 54.79 51.74 1jvn n ASP 404 Cb 0.53 -0.70 0.03 0.00 -0.02 0.00 0.00 41.12 40.97 1jvn n ASP 404 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 1jvn s PRO 405 N -1.90 3.05 -0.03 -0.24 0.02 -1.25 -3.01 135.00 131.64 1jvn s PRO 405 Ca 0.34 1.18 -0.00 0.00 0.02 0.00 0.00 61.00 62.54 1jvn s PRO 405 Cb 0.08 -2.00 0.03 0.00 0.02 0.00 0.00 34.50 32.63 1jvn s PRO 405 CO -0.09 -1.03 0.02 0.15 -0.33 0.00 0.00 177.00 175.72 1jvn s LYS 406 N -4.35 0.18 0.26 5.54 1.02 0.12 -3.93 119.74 118.58 1jvn s LYS 406 Ca 0.63 0.16 -0.30 0.00 0.02 0.00 0.00 55.97 56.48 1jvn s LYS 406 Cb -0.17 -0.48 -0.10 0.00 -0.52 0.00 0.00 37.83 36.57 1jvn s LYS 406 CO 0.43 -0.19 1.43 0.50 -0.92 0.00 0.00 175.35 176.60 1jvn s ARG 407 N 1.33 4.27 -0.12 1.68 3.52 -1.26 0.40 118.95 128.77 1jvn s ARG 407 Ca -0.06 2.31 -0.01 0.00 -0.13 0.00 0.00 55.73 57.84 1jvn s ARG 407 Cb -0.13 -3.10 0.03 0.00 -1.56 0.00 0.00 34.95 30.19 1jvn s ARG 407 CO -0.03 -0.40 -0.04 0.08 -0.81 0.00 0.00 175.30 174.11 1jvn s VAL 408 N -0.19 0.80 0.32 7.11 1.01 0.95 -4.87 120.40 125.53 1jvn s VAL 408 Ca 0.58 -0.24 -0.18 0.00 0.00 0.00 0.00 61.98 62.13 1jvn s VAL 408 Cb -0.42 -0.93 -0.09 0.00 0.00 0.00 0.00 36.38 34.94 1jvn s VAL 408 CO 0.45 0.25 0.79 -0.31 0.00 0.00 0.00 175.10 176.29 1jvn s TYR 409 N 1.79 3.47 0.01 5.22 1.51 -1.26 -1.10 117.35 126.98 1jvn s TYR 409 Ca 0.04 1.40 -0.14 0.00 -1.01 0.00 0.00 57.07 57.35 1jvn s TYR 409 Cb -0.13 -2.66 0.02 0.00 -0.11 0.00 0.00 41.96 39.08 1jvn s TYR 409 CO -0.07 0.13 0.31 0.14 -1.11 0.00 0.00 175.55 174.95 1jvn s VAL 410 N -1.86 0.07 0.22 0.71 -7.23 -0.64 -4.97 120.40 106.70 1jvn s VAL 410 Ca 0.52 -0.55 -0.06 0.00 -1.81 0.00 0.00 61.98 60.07 1jvn s VAL 410 Cb -0.13 -0.74 0.11 0.00 0.56 0.00 0.00 36.38 36.19 1jvn s VAL 410 CO 0.18 -0.30 1.72 0.78 -0.31 0.00 0.00 175.10 177.17 1jvn h ASN 411 N 3.62 0.99 -5.01 4.85 2.35 -1.95 -3.11 115.58 117.31 1jvn h ASN 411 Ca -0.30 -0.23 0.02 0.00 -0.55 0.00 0.00 56.30 55.24 1jvn h ASN 411 Cb 1.18 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 39.27 1jvn h ASN 411 CO 0.42 0.98 0.24 -0.94 -1.65 0.00 0.00 177.43 176.49 1jvn s SER 412 N -6.53 -0.10 0.36 5.81 1.04 -1.26 -4.52 113.70 108.50 1jvn s SER 412 Ca -0.11 -0.91 0.26 0.00 0.48 0.00 0.00 55.95 55.67 1jvn s SER 412 Cb 0.15 0.79 1.31 0.00 0.10 0.00 0.00 66.02 68.37 1jvn s SER 412 CO 0.84 -1.53 1.78 -0.61 0.98 0.00 0.00 173.24 174.70 1jvn h GLN 413 N 2.00 0.00 0.00 4.02 5.75 -1.91 -1.86 115.11 123.12 1jvn h GLN 413 Ca -0.26 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.24 1jvn h GLN 413 Cb 1.25 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.80 1jvn h GLN 413 CO 0.33 0.00 0.00 0.00 -2.65 0.00 0.00 178.83 176.51 1jvn h ALA 414 N 2.06 1.00 -0.00 3.38 0.00 -1.97 -3.12 119.26 120.61 1jvn h ALA 414 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1jvn h ALA 414 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1jvn h ALA 414 CO 0.00 0.00 -0.17 -0.25 0.00 0.00 0.00 179.25 178.83 1jvn n ASP 415 N -2.94 0.45 -3.71 0.00 8.00 -0.70 -4.91 116.55 112.74 1jvn n ASP 415 Ca 0.02 -0.37 -0.12 0.00 0.71 0.00 0.00 54.79 55.02 1jvn n ASP 415 Cb 0.37 -0.07 -0.07 0.00 -0.02 0.00 0.00 41.12 41.33 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 -2.65 0.07 -0.13 -3.53 -1.32 -1.18 -5.03 115.64 101.87 1jvn s THR 416 Ca 0.23 -0.55 0.15 0.00 -1.21 0.00 0.00 61.69 60.31 1jvn s THR 416 Cb 0.19 -0.93 0.07 0.00 -1.51 0.00 0.00 72.50 70.32 1jvn s THR 416 CO 0.53 -0.30 1.46 0.07 -2.21 0.00 0.00 174.62 174.17 1jvn h LYS 417 N 3.14 0.00 -6.94 7.08 2.10 -1.91 -3.46 116.57 116.58 1jvn h LYS 417 Ca -0.31 0.00 -0.47 0.00 -2.00 0.00 0.00 60.65 57.87 1jvn h LYS 417 Cb 1.20 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.52 1jvn h LYS 417 CO 0.44 0.50 0.36 -0.80 -2.00 0.00 0.00 179.45 177.95 1jvn s ASN 418 N -6.46 7.10 0.14 7.07 0.01 -1.26 -5.00 114.94 116.54 1jvn s ASN 418 Ca 0.04 1.86 -0.31 0.00 -0.71 0.00 0.00 52.86 53.73 1jvn s ASN 418 Cb 0.08 -2.57 -0.10 0.00 0.41 0.00 0.00 41.25 39.07 1jvn s ASN 418 CO 0.74 -0.24 1.67 -0.75 -1.51 0.00 0.00 177.10 177.01 1jvn s LYS 419 N -2.41 4.18 0.35 -0.60 2.47 -1.26 -4.99 119.74 117.48 1jvn s LYS 419 Ca 0.55 2.44 0.09 0.00 -1.56 0.00 0.00 55.97 57.49 1jvn s LYS 419 Cb -0.17 -3.34 -0.06 0.00 -1.46 0.00 0.00 37.83 32.80 1jvn s LYS 419 CO 0.22 -0.71 0.02 0.14 0.16 0.00 0.00 175.35 175.19 1jvn s VAL 420 N 1.86 2.52 0.04 4.02 -7.23 -1.26 -4.61 120.40 115.73 1jvn s VAL 420 Ca 0.74 -1.96 0.01 0.00 -1.81 0.00 0.00 61.98 58.96 1jvn s VAL 420 Cb -0.44 -2.83 -0.03 0.00 0.56 0.00 0.00 36.38 33.65 1jvn s VAL 420 CO 0.33 -0.16 -0.05 0.72 -0.31 0.00 0.00 175.10 175.63 1jvn s PHE 421 N -2.55 0.48 -0.11 2.82 -0.12 -0.64 -4.95 117.98 112.91 1jvn s PHE 421 Ca 0.35 -0.66 -0.30 0.00 -0.05 0.00 0.00 56.93 56.28 1jvn s PHE 421 Cb 0.01 -0.31 -0.02 0.00 -0.63 0.00 0.00 43.02 42.07 1jvn s PHE 421 CO 0.19 -0.19 1.13 -2.00 -0.05 0.00 0.00 175.22 174.30 1jvn s GLU 422 N -2.17 4.34 0.14 1.99 2.12 -1.26 -2.12 118.70 121.74 1jvn s GLU 422 Ca -0.08 1.54 0.03 0.00 0.36 0.00 0.00 54.97 56.83 1jvn s GLU 422 Cb -0.05 -3.60 -0.04 0.00 0.26 0.00 0.00 34.13 30.70 1jvn s GLU 422 CO -0.03 -0.48 0.21 -0.08 -0.54 0.00 0.00 175.26 174.35 1jvn s THR 423 N 2.51 4.98 -0.42 -1.70 -1.32 -0.05 -5.00 115.64 114.64 1jvn s THR 423 Ca 0.52 -0.80 0.25 0.00 -1.21 0.00 0.00 61.69 60.44 1jvn s THR 423 Cb -0.21 -3.53 0.34 0.00 -1.51 0.00 0.00 72.50 67.59 1jvn s THR 423 CO 0.17 -0.06 1.68 -0.08 -2.21 0.00 0.00 174.62 174.12 1jvn h GLU 424 N 2.42 0.00 -3.76 7.08 4.81 -1.96 -3.40 114.58 119.77 1jvn h GLU 424 Ca -0.48 0.00 -0.71 0.00 -0.13 0.00 0.00 59.36 58.05 1jvn h GLU 424 Cb 1.19 0.00 -0.34 0.00 0.63 0.00 0.00 28.75 30.23 1jvn h GLU 424 CO 0.67 0.00 -0.34 0.71 -0.73 0.00 0.00 179.01 179.32 1jvn s TYR 425 N -3.25 3.46 0.73 0.92 1.51 -1.26 -5.08 117.35 114.40 1jvn s TYR 425 Ca 0.07 -2.56 -0.15 0.00 -1.01 0.00 0.00 57.07 53.42 1jvn s TYR 425 Cb 0.06 -3.28 0.04 0.00 -0.11 0.00 0.00 41.96 38.67 1jvn s TYR 425 CO 0.64 -0.88 1.22 -1.25 -1.11 0.00 0.00 175.55 174.17 1jvn s PRO 426 N 0.18 2.09 0.24 -1.71 0.04 -1.26 -4.97 135.00 129.60 1jvn s PRO 426 Ca 0.15 1.80 -0.04 0.00 0.04 0.00 0.00 61.00 62.96 1jvn s PRO 426 Cb -0.20 -1.82 0.05 0.00 0.04 0.00 0.00 34.50 32.57 1jvn s PRO 426 CO -0.04 -1.88 0.31 0.41 0.04 0.00 0.00 177.00 175.84 1jvn n GLY 427 N 0.49 -1.31 0.22 0.56 0.00 0.21 -4.83 105.19 100.52 1jvn n GLY 427 Ca 0.14 -1.66 -0.09 0.00 0.00 0.00 0.00 46.02 44.41 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 0.69 -0.73 1.61 0.11 -1.95 -0.64 132.00 131.09 1jvn h PRO 428 Ca -0.10 -0.14 -0.04 0.00 0.11 0.00 0.00 66.00 65.83 1jvn h PRO 428 Cb 0.28 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.27 1jvn h PRO 428 CO 0.07 0.66 0.05 0.09 -0.21 0.00 0.00 178.00 178.66 1jvn n ASN 429 N -4.56 4.37 0.00 -2.05 3.02 -1.26 -4.87 115.26 109.90 1jvn n ASN 429 Ca 0.01 -2.73 0.00 0.00 -0.03 0.00 0.00 54.58 51.83 1jvn n ASN 429 Cb 0.18 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 38.70 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 0.34 0.59 3.69 7.41 0.00 -0.25 -5.01 105.19 111.96 1jvn n GLY 430 Ca 0.23 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.81 2.54 0.00 1.61 4.71 -1.25 -4.47 120.64 120.97 1jvn n GLU 431 Ca 0.00 0.92 0.11 0.00 -0.01 0.00 0.00 57.16 58.18 1jvn n GLU 431 Cb 0.00 -2.75 0.08 0.00 -1.01 0.00 0.00 31.44 27.76 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 4.27 0.52 -4.41 3.49 5.02 -1.26 0.68 118.16 126.47 1jvn n LYS 432 Ca 0.17 -0.39 -0.22 0.00 -2.02 0.00 0.00 58.31 55.85 1jvn n LYS 432 Cb 0.33 -1.49 -0.10 0.00 -0.02 0.00 0.00 35.03 33.75 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 -2.75 2.05 0.14 2.13 1.51 -1.18 -0.87 117.35 118.38 1jvn s TYR 433 Ca 0.15 -0.43 -0.23 0.00 -1.01 0.00 0.00 57.07 55.55 1jvn s TYR 433 Cb 0.18 -0.93 0.07 0.00 -0.11 0.00 0.00 41.96 41.17 1jvn s TYR 433 CO 0.68 0.55 0.59 0.00 -1.11 0.00 0.00 175.55 176.26 1jvn s TRP 435 N -3.57 1.19 -0.26 0.00 1.48 -0.26 -1.61 118.94 115.91 1jvn s TRP 435 Ca 0.00 -0.87 -0.05 0.00 -1.06 0.00 0.00 56.10 54.12 1jvn s TRP 435 Cb -0.01 -0.65 0.00 0.00 -1.16 0.00 0.00 33.47 31.65 1jvn s TRP 435 CO -0.11 -0.06 0.02 0.71 -4.06 0.00 0.00 176.95 173.45 1jvn s TYR 436 N -3.49 3.06 0.06 1.66 1.51 -1.26 -0.03 117.35 118.87 1jvn s TYR 436 Ca 0.18 -0.97 -0.28 0.00 -1.01 0.00 0.00 57.07 55.00 1jvn s TYR 436 Cb 0.04 -2.17 -0.05 0.00 -0.11 0.00 0.00 41.96 39.67 1jvn s TYR 436 CO 0.01 -0.56 0.88 -1.14 -1.11 0.00 0.00 175.55 173.64 1jvn s GLN 437 N 1.48 4.60 -0.03 -0.62 0.74 0.16 -0.21 119.66 125.78 1jvn s GLN 437 Ca 0.04 1.29 -0.13 0.00 0.05 0.00 0.00 55.36 56.60 1jvn s GLN 437 Cb -0.16 -3.39 -0.05 0.00 1.10 0.00 0.00 33.01 30.51 1jvn s GLN 437 CO -0.00 0.19 0.35 0.00 -0.55 0.00 0.00 175.29 175.28 1jvn s THR 439 N -1.00 3.66 0.41 0.00 -4.23 -1.16 -1.44 115.64 111.88 1jvn s THR 439 Ca 0.22 -1.72 0.04 0.00 -1.18 0.00 0.00 61.69 59.05 1jvn s THR 439 Cb -0.16 -3.03 -0.02 0.00 1.34 0.00 0.00 72.50 70.63 1jvn s THR 439 CO 0.11 -0.33 0.16 2.30 -0.54 0.00 0.00 174.62 176.32 1jvn n ILE 440 N -1.03 0.00 -3.79 2.99 -5.35 0.62 -4.61 119.36 108.19 1jvn n ILE 440 Ca -0.06 -2.41 -0.33 0.00 -0.27 0.00 0.00 62.75 59.68 1jvn n ILE 440 Cb 0.59 0.90 0.02 0.00 -1.74 0.00 0.00 39.64 39.41 1jvn n ILE 440 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1jvn n LYS 441 N -0.90 -0.97 -2.08 6.28 5.02 -1.26 -1.46 118.16 122.79 1jvn n LYS 441 Ca -0.05 0.48 -0.20 0.00 -2.02 0.00 0.00 58.31 56.52 1jvn n LYS 441 Cb 0.62 -3.30 -0.04 0.00 -0.02 0.00 0.00 35.03 32.29 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 -1.82 0.43 2.09 0.72 0.00 -1.26 -2.13 105.19 103.23 1jvn n GLY 442 Ca -0.14 -0.04 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.83 0.51 0.13 -0.02 0.00 -0.53 -4.94 105.19 99.50 1jvn n GLY 443 Ca -0.22 -0.50 0.03 0.00 0.00 0.00 0.00 46.02 45.33 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 0.43 0.00 -4.79 1.61 3.08 -0.96 -3.46 114.38 110.29 1jvn h ARG 444 Ca -0.03 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.47 1jvn h ARG 444 Cb 0.14 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 29.86 1jvn h ARG 444 CO 0.04 0.34 -0.83 -2.00 -1.07 0.00 0.00 179.97 176.45 1jvn s GLU 445 N -3.01 2.02 0.38 0.04 2.12 -1.14 -5.02 118.70 114.10 1jvn s GLU 445 Ca 0.01 -0.54 -0.04 0.00 0.36 0.00 0.00 54.97 54.77 1jvn s GLU 445 Cb 0.08 -1.62 -0.04 0.00 0.26 0.00 0.00 34.13 32.80 1jvn s GLU 445 CO 0.77 0.08 0.65 -1.12 -0.54 0.00 0.00 175.26 175.10 1jvn s SER 446 N 0.53 6.34 0.05 -1.70 0.01 -1.26 -0.27 113.70 117.40 1jvn s SER 446 Ca -0.15 0.73 0.02 0.00 1.31 0.00 0.00 55.95 57.87 1jvn s SER 446 Cb -0.16 -2.16 -0.03 0.00 0.21 0.00 0.00 66.02 63.89 1jvn s SER 446 CO 0.05 -0.37 -0.07 -0.13 0.41 0.00 0.00 173.24 173.12 1jvn s ARG 447 N -4.22 0.58 -1.34 12.44 1.81 -0.52 -4.91 118.95 122.79 1jvn s ARG 447 Ca 0.44 -0.87 -0.11 0.00 -1.72 0.00 0.00 55.73 53.47 1jvn s ARG 447 Cb -0.10 -0.24 0.12 0.00 -0.45 0.00 0.00 34.95 34.28 1jvn s ARG 447 CO 0.37 0.03 1.99 -3.47 -0.68 0.00 0.00 175.30 173.53 1jvn n ASP 448 N 1.15 4.68 -3.70 0.23 2.03 -1.26 -4.19 116.55 115.50 1jvn n ASP 448 Ca -0.21 -3.02 -0.12 0.00 0.52 0.00 0.00 54.79 51.97 1jvn n ASP 448 Cb 0.56 -1.54 -0.12 0.00 -0.72 0.00 0.00 41.12 39.29 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 0.70 0.02 0.60 -2.67 2.96 -1.26 -5.05 118.68 113.98 1jvn s LEU 449 Ca 0.42 0.66 -0.07 0.00 -0.22 0.00 0.00 54.13 54.92 1jvn s LEU 449 Cb 0.11 0.90 -0.00 0.00 0.50 0.00 0.00 46.19 47.70 1jvn s LEU 449 CO -0.03 -0.20 0.93 -0.83 -1.32 0.00 0.00 176.35 174.91 1jvn s GLY 450 N 1.73 1.60 0.35 7.98 0.00 -1.26 -1.18 107.32 116.53 1jvn s GLY 450 Ca -0.06 -0.54 0.11 0.00 0.00 0.00 0.00 44.72 44.24 1jvn s GLY 450 CO -0.10 -0.26 1.78 -0.24 0.00 0.00 0.00 173.10 174.28 1jvn h VAL 451 N -0.21 1.29 0.23 1.40 3.04 -0.94 -0.52 116.25 120.55 1jvn h VAL 451 Ca -0.45 -1.40 -0.01 0.00 -1.01 0.00 0.00 66.70 63.82 1jvn h VAL 451 Cb 1.24 1.72 0.00 0.00 -2.01 0.00 0.00 31.29 32.25 1jvn h VAL 451 CO 0.62 0.41 -0.11 -0.25 -1.01 0.00 0.00 177.57 177.22 1jvn h TRP 452 N 0.05 -0.29 -0.48 3.17 2.91 -1.91 -0.51 115.95 118.89 1jvn h TRP 452 Ca 0.00 -0.01 -0.08 0.00 1.13 0.00 0.00 58.89 59.94 1jvn h TRP 452 Cb 0.73 0.10 -0.02 0.00 -0.51 0.00 0.00 29.16 29.46 1jvn h TRP 452 CO 0.00 -0.17 -0.01 0.93 -1.03 0.00 0.00 178.44 178.16 1jvn h GLU 453 N -0.33 0.86 -0.05 2.65 3.07 -1.89 -2.60 114.58 116.28 1jvn h GLU 453 Ca -0.03 -0.28 -0.00 0.00 -0.50 0.00 0.00 59.36 58.55 1jvn h GLU 453 Cb 0.25 -0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 28.08 1jvn h GLU 453 CO 0.05 0.91 0.03 1.25 -1.40 0.00 0.00 179.01 179.85 1jvn h LEU 454 N 0.71 0.07 -0.56 1.33 5.85 -0.98 -2.17 115.31 119.56 1jvn h LEU 454 Ca 0.13 -0.08 -0.12 0.00 0.84 0.00 0.00 57.88 58.65 1jvn h LEU 454 Cb 0.53 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 1jvn h LEU 454 CO 0.03 0.13 -0.16 0.71 -0.34 0.00 0.00 178.44 178.80 1jvn h THR 455 N -0.00 1.27 -0.69 1.05 1.35 -1.12 -1.71 112.91 113.05 1jvn h THR 455 Ca 0.02 -1.32 -0.07 0.00 -0.55 0.00 0.00 66.41 64.49 1jvn h THR 455 Cb 0.08 1.05 -0.03 0.00 -1.73 0.00 0.00 68.15 67.52 1jvn h THR 455 CO -0.00 0.46 0.15 0.03 -0.25 0.00 0.00 175.52 175.91 1jvn h ARG 456 N 0.86 1.12 -0.14 4.72 3.08 -1.45 -0.51 114.38 122.06 1jvn h ARG 456 Ca 0.12 -0.28 -0.03 0.00 0.07 0.00 0.00 59.98 59.87 1jvn h ARG 456 Cb 0.73 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.63 1jvn h ARG 456 CO 0.06 1.00 -0.03 0.00 -1.07 0.00 0.00 179.97 179.92 1jvn h ALA 457 N 1.07 0.19 -0.31 0.04 0.00 -1.31 -1.58 119.26 117.37 1jvn h ALA 457 Ca 0.21 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1jvn h ALA 457 Cb 0.39 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1jvn h ALA 457 CO 0.01 -0.06 0.12 0.00 0.00 0.00 0.00 179.25 179.32 1jvn h GLU 459 N 0.43 0.68 -0.01 0.00 4.81 -0.97 0.34 114.58 119.87 1jvn h GLU 459 Ca 0.11 -0.35 -0.07 0.00 -0.13 0.00 0.00 59.36 58.92 1jvn h GLU 459 Cb 0.10 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 1jvn h GLU 459 CO -0.01 0.95 -0.33 0.00 -0.73 0.00 0.00 179.01 178.89 1jvn h ALA 460 N 0.72 1.43 -0.00 2.92 0.00 -0.49 -2.32 119.26 121.52 1jvn h ALA 460 Ca 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1jvn h ALA 460 Cb 0.81 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1jvn h ALA 460 CO 0.06 0.43 -0.00 1.28 0.00 0.00 0.00 179.25 181.02 1jvn n LEU 461 N -4.14 0.01 0.00 0.00 4.77 0.03 -4.91 117.00 112.77 1jvn n LEU 461 Ca -0.02 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.21 1jvn n LEU 461 Cb 0.38 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1jvn n LEU 461 CO 0.38 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 1jvn n GLY 462 N 1.25 1.15 3.77 -0.72 0.00 -0.87 -3.56 105.19 106.21 1jvn n GLY 462 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 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 3.17 -0.77 4.61 0.00 0.08 -4.15 121.76 122.70 1jvn s ALA 463 Ca 0.00 1.08 0.14 0.00 0.00 0.00 0.00 51.96 53.18 1jvn s ALA 463 Cb 0.00 -3.43 -0.13 0.00 0.00 0.00 0.00 23.12 19.56 1jvn s ALA 463 CO 0.00 -0.68 0.63 0.41 0.00 0.00 0.00 175.76 176.12 1jvn n GLY 464 N 0.65 -0.29 3.52 0.00 0.00 -0.26 -4.65 105.19 104.16 1jvn n GLY 464 Ca 0.04 -0.40 -0.17 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.25 0.98 -0.19 1.61 2.12 -1.02 -3.83 118.70 116.12 1jvn s GLU 465 Ca 0.06 0.39 -0.02 0.00 0.36 0.00 0.00 54.97 55.77 1jvn s GLU 465 Cb 0.11 0.47 -0.00 0.00 0.26 0.00 0.00 34.13 34.96 1jvn s GLU 465 CO 0.55 -0.27 -0.10 0.42 -0.54 0.00 0.00 175.26 175.31 1jvn s ILE 466 N -0.86 2.97 -0.66 -3.70 -1.09 0.39 -0.60 121.20 117.65 1jvn s ILE 466 Ca -0.09 -0.65 -0.19 0.00 -2.23 0.00 0.00 60.65 57.50 1jvn s ILE 466 Cb -0.01 -2.30 0.12 0.00 -1.58 0.00 0.00 42.46 38.68 1jvn s ILE 466 CO 0.08 0.48 0.79 -0.22 -1.23 0.00 0.00 174.94 174.83 1jvn s LEU 467 N 1.15 5.39 -0.80 2.97 2.96 0.17 0.13 118.68 130.65 1jvn s LEU 467 Ca 0.01 -1.59 -0.20 0.00 -0.22 0.00 0.00 54.13 52.13 1jvn s LEU 467 Cb -0.14 -2.32 0.11 0.00 0.50 0.00 0.00 46.19 44.34 1jvn s LEU 467 CO -0.03 -1.09 1.02 -0.22 -1.32 0.00 0.00 176.35 174.71 1jvn s LEU 468 N 2.57 4.88 0.25 -0.68 2.96 0.09 -1.38 118.68 127.37 1jvn s LEU 468 Ca 0.16 -1.62 -0.21 0.00 -0.22 0.00 0.00 54.13 52.25 1jvn s LEU 468 Cb -0.20 -2.39 -0.09 0.00 0.50 0.00 0.00 46.19 44.01 1jvn s LEU 468 CO 0.03 -1.20 0.77 0.20 -1.32 0.00 0.00 176.35 174.83 1jvn s ASN 469 N 3.64 7.09 -0.66 3.68 0.01 -0.76 -1.23 114.94 126.71 1jvn s ASN 469 Ca 0.26 1.49 0.03 0.00 -0.71 0.00 0.00 52.86 53.94 1jvn s ASN 469 Cb -0.11 -2.45 0.16 0.00 0.41 0.00 0.00 41.25 39.26 1jvn s ASN 469 CO -0.01 -0.01 0.45 0.00 -1.51 0.00 0.00 177.10 176.02 1jvn n ILE 471 N 2.53 -0.51 0.00 0.00 5.41 -1.25 0.13 119.36 125.67 1jvn n ILE 471 Ca 0.14 2.16 0.00 0.00 1.00 0.00 0.00 62.75 66.05 1jvn n ILE 471 Cb 0.35 -2.71 0.00 0.00 -0.71 0.00 0.00 39.64 36.57 1jvn n ILE 471 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1jvn n ASP 472 N -4.69 0.00 -0.00 4.38 8.00 -1.26 0.72 116.55 123.70 1jvn n ASP 472 Ca 0.01 0.37 0.07 0.00 0.71 0.00 0.00 54.79 55.96 1jvn n ASP 472 Cb 0.19 -0.37 -0.09 0.00 -0.02 0.00 0.00 41.12 40.83 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 -1.37 1.74 -1.68 -1.24 4.76 0.12 -4.91 118.16 115.59 1jvn n LYS 473 Ca 0.00 -0.02 -0.46 0.00 -2.87 0.00 0.00 58.31 54.96 1jvn n LYS 473 Cb 0.05 -1.25 -0.04 0.00 -1.84 0.00 0.00 35.03 31.95 1jvn n LYS 473 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1jvn n ASP 474 N -1.44 3.38 0.00 4.39 -0.08 0.22 -1.43 116.55 121.59 1jvn n ASP 474 Ca 0.02 1.02 0.00 0.00 -1.51 0.00 0.00 54.79 54.33 1jvn n ASP 474 Cb 0.26 -1.42 0.00 0.00 2.34 0.00 0.00 41.12 42.30 1jvn n ASP 474 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1jvn n GLY 475 N 3.94 0.69 0.13 0.27 0.00 -1.26 -4.88 105.19 104.08 1jvn n GLY 475 Ca 0.19 0.00 0.02 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 -6.17 1.61 4.64 -1.55 -3.48 113.55 108.61 1jvn h SER 476 Ca 0.00 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.85 1jvn h SER 476 Cb 0.05 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.05 1jvn h SER 476 CO 0.00 0.51 -0.73 0.59 -0.87 0.00 0.00 176.83 176.33 1jvn n ASN 477 N -3.13 -4.25 -0.08 4.97 3.02 -1.20 -4.84 115.26 109.74 1jvn n ASN 477 Ca -0.01 -0.74 0.01 0.00 -0.03 0.00 0.00 54.58 53.82 1jvn n ASN 477 Cb 0.75 -3.44 0.02 0.00 -0.61 0.00 0.00 39.78 36.50 1jvn n ASN 477 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1jvn n SER 478 N -2.65 1.69 0.00 6.41 3.41 -0.66 -4.43 113.62 117.39 1jvn n SER 478 Ca 0.04 -1.58 0.00 0.00 -0.26 0.00 0.00 58.87 57.06 1jvn n SER 478 Cb 0.52 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 1jvn n SER 478 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jvn n GLY 479 N -0.16 1.38 3.90 5.00 0.00 0.14 -5.00 105.19 110.45 1jvn n GLY 479 Ca 0.01 -2.10 -0.29 0.00 0.00 0.00 0.00 46.02 43.65 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 -1.68 3.40 -0.81 1.61 2.02 -1.26 -4.34 117.35 116.29 1jvn s TYR 480 Ca 0.00 0.93 -0.24 0.00 -0.37 0.00 0.00 57.07 57.39 1jvn s TYR 480 Cb 0.00 -2.78 0.06 0.00 -0.40 0.00 0.00 41.96 38.84 1jvn s TYR 480 CO 0.00 -0.83 1.22 0.34 -1.57 0.00 0.00 175.55 174.71 1jvn s ASP 481 N -4.27 6.30 0.20 2.29 -1.08 -1.26 -4.89 116.67 113.96 1jvn s ASP 481 Ca 0.54 -1.03 -0.11 0.00 -0.52 0.00 0.00 52.55 51.44 1jvn s ASP 481 Cb -0.11 -2.51 0.17 0.00 -1.46 0.00 0.00 42.92 39.02 1jvn s ASP 481 CO 0.49 -1.56 1.83 -0.07 0.52 0.00 0.00 175.17 176.38 1jvn h LEU 482 N 12.23 0.64 -1.15 -1.34 3.38 -2.00 -2.36 115.31 124.71 1jvn h LEU 482 Ca -0.11 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 1jvn h LEU 482 Cb 1.04 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1jvn h LEU 482 CO 1.27 0.44 -0.26 -0.33 0.09 0.00 0.00 178.44 179.65 1jvn h GLU 483 N 0.77 0.26 -0.45 1.13 5.08 -1.99 -1.93 114.58 117.46 1jvn h GLU 483 Ca 0.26 -0.09 -0.08 0.00 -1.00 0.00 0.00 59.36 58.46 1jvn h GLU 483 Cb 0.04 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 1jvn h GLU 483 CO -0.11 0.51 -0.02 1.25 -1.00 0.00 0.00 179.01 179.65 1jvn h LEU 484 N 0.24 0.79 -0.10 1.33 5.85 -1.89 -0.31 115.31 121.23 1jvn h LEU 484 Ca 0.04 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.44 1jvn h LEU 484 Cb 0.60 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.41 1jvn h LEU 484 CO 0.04 0.92 0.07 0.40 -0.34 0.00 0.00 178.44 179.52 1jvn h ILE 485 N 0.65 1.03 -0.25 4.05 2.04 -1.14 -1.48 117.51 122.40 1jvn h ILE 485 Ca 0.13 -0.05 -0.05 0.00 1.00 0.00 0.00 64.86 65.88 1jvn h ILE 485 Cb 0.52 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 1jvn h ILE 485 CO 0.03 0.03 -0.08 -0.33 0.00 0.00 0.00 178.15 177.79 1jvn h GLU 486 N 0.13 0.40 -0.15 2.37 4.39 -1.24 -0.22 114.58 120.26 1jvn h GLU 486 Ca 0.04 -0.09 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 1jvn h GLU 486 Cb -0.01 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 1jvn h GLU 486 CO -0.01 0.49 0.01 1.25 -1.16 0.00 0.00 179.01 179.60 1jvn h HIS 487 N 0.38 0.29 -0.15 4.33 2.76 -0.75 -1.32 115.15 120.69 1jvn h HIS 487 Ca 0.08 -0.05 -0.12 0.00 -2.20 0.00 0.00 60.37 58.08 1jvn h HIS 487 Cb 0.38 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.25 1jvn h HIS 487 CO 0.01 0.47 -0.43 0.28 -1.30 0.00 0.00 177.93 176.95 1jvn h VAL 488 N 0.02 1.32 0.00 5.26 2.07 -1.06 -1.83 116.25 122.03 1jvn h VAL 488 Ca 0.05 -1.60 -0.07 0.00 0.82 0.00 0.00 66.70 65.89 1jvn h VAL 488 Cb 0.34 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 1jvn h VAL 488 CO 0.01 0.49 -0.34 0.11 0.02 0.00 0.00 177.57 177.85 1jvn h LYS 489 N 0.29 0.00 -0.01 1.57 1.79 -0.91 -1.50 116.57 117.80 1jvn h LYS 489 Ca 0.02 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.33 1jvn h LYS 489 Cb 0.89 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.52 1jvn h LYS 489 CO 0.07 0.34 -0.74 -0.44 -1.08 0.00 0.00 179.45 177.61 1jvn h ASP 490 N 0.00 0.12 0.21 0.86 3.32 -0.84 -3.35 116.42 116.75 1jvn h ASP 490 Ca -0.00 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 1jvn h ASP 490 Cb 0.63 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.15 1jvn h ASP 490 CO 0.04 0.81 -0.10 0.00 -1.72 0.00 0.00 179.24 178.28 1jvn h ALA 491 N 1.18 -0.28 -1.25 3.45 0.00 -0.49 -3.48 119.26 118.38 1jvn h ALA 491 Ca -0.02 -0.21 -0.60 0.00 0.00 0.00 0.00 54.91 54.08 1jvn h ALA 491 Cb 1.30 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 19.10 1jvn h ALA 491 CO 0.10 -0.39 -0.50 0.14 0.00 0.00 0.00 179.25 178.61 1jvn s VAL 492 N -3.80 1.94 -0.57 0.00 -7.23 -0.65 -4.80 120.40 105.30 1jvn s VAL 492 Ca -0.13 -1.80 0.11 0.00 -1.81 0.00 0.00 61.98 58.35 1jvn s VAL 492 Cb 0.01 -2.74 -0.11 0.00 0.56 0.00 0.00 36.38 34.10 1jvn s VAL 492 CO 0.49 0.00 0.49 0.29 -0.31 0.00 0.00 175.10 176.06 1jvn n LYS 493 N -1.24 3.24 -2.51 4.82 5.02 -1.26 -4.76 118.16 121.47 1jvn n LYS 493 Ca -0.05 -0.05 -0.30 0.00 -2.02 0.00 0.00 58.31 55.88 1jvn n LYS 493 Cb 0.66 -1.03 -0.02 0.00 -0.02 0.00 0.00 35.03 34.62 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 -2.00 4.75 0.31 -0.18 -4.36 -1.26 -3.30 121.20 115.16 1jvn s ILE 494 Ca 0.05 0.68 -0.30 0.00 -0.26 0.00 0.00 60.65 60.82 1jvn s ILE 494 Cb 0.08 -3.79 -0.12 0.00 1.25 0.00 0.00 42.46 39.88 1jvn s ILE 494 CO 0.44 -0.77 1.53 -2.65 0.24 0.00 0.00 174.94 173.73 1jvn n PRO 495 N -1.90 2.57 -4.42 0.37 -0.02 -1.25 -4.77 135.00 125.58 1jvn n PRO 495 Ca 0.03 0.91 -0.33 0.00 -2.02 0.00 0.00 63.50 62.09 1jvn n PRO 495 Cb 0.54 -2.65 -0.15 0.00 -0.02 0.00 0.00 33.50 31.22 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 -0.31 2.75 -0.22 -1.45 1.01 -1.26 -0.46 120.40 120.47 1jvn s VAL 496 Ca 0.62 -0.73 -0.13 0.00 0.00 0.00 0.00 61.98 61.74 1jvn s VAL 496 Cb -0.52 -2.18 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 1jvn s VAL 496 CO 0.53 0.50 0.25 -0.63 0.00 0.00 0.00 175.10 175.75 1jvn s ILE 497 N 0.91 5.30 -0.19 2.22 1.01 0.12 -0.53 121.20 130.04 1jvn s ILE 497 Ca -0.03 0.39 -0.26 0.00 0.00 0.00 0.00 60.65 60.75 1jvn s ILE 497 Cb -0.15 -3.59 -0.01 0.00 0.01 0.00 0.00 42.46 38.73 1jvn s ILE 497 CO -0.01 0.32 0.88 0.00 0.00 0.00 0.00 174.94 176.13 1jvn s ALA 498 N 1.03 3.57 0.11 9.38 0.00 0.68 -0.73 121.76 135.81 1jvn s ALA 498 Ca 0.12 0.04 0.03 0.00 0.00 0.00 0.00 51.96 52.15 1jvn s ALA 498 Cb -0.14 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 1jvn s ALA 498 CO 0.05 -0.78 -0.08 0.45 0.00 0.00 0.00 175.76 175.39 1jvn s SER 499 N 1.21 1.36 0.12 0.00 0.15 -0.36 -0.68 113.70 115.49 1jvn s SER 499 Ca 0.39 -0.96 0.00 0.00 0.70 0.00 0.00 55.95 56.08 1jvn s SER 499 Cb -0.16 0.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.20 1jvn s SER 499 CO 0.10 -0.38 0.00 -1.20 1.20 0.00 0.00 173.24 172.96 1jvn n SER 500 N 0.07 -5.57 0.00 5.45 7.64 -1.26 -2.57 113.62 117.38 1jvn n SER 500 Ca -0.13 0.69 0.00 0.00 1.01 0.00 0.00 58.87 60.44 1jvn n SER 500 Cb 0.60 -2.84 0.00 0.00 -1.01 0.00 0.00 64.21 60.96 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 0.76 2.10 3.69 0.23 0.00 -1.20 -4.30 105.19 106.47 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 -2.08 3.70 0.00 4.61 0.00 -1.26 0.27 121.76 127.00 1jvn s ALA 502 Ca 0.00 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.20 1jvn s ALA 502 Cb 0.00 -3.69 0.00 0.00 0.00 0.00 0.00 23.12 19.43 1jvn s ALA 502 CO 0.00 -1.07 0.00 0.41 0.00 0.00 0.00 175.76 175.10 1jvn n GLY 503 N 3.97 0.00 3.31 0.00 0.00 -1.26 -4.60 105.19 106.61 1jvn n GLY 503 Ca 0.16 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.64 1.09 0.47 1.61 -7.23 -1.26 -4.87 120.40 108.57 1jvn s VAL 504 Ca 0.00 -2.05 0.16 0.00 -1.81 0.00 0.00 61.98 58.28 1jvn s VAL 504 Cb 0.00 -2.21 0.32 0.00 0.56 0.00 0.00 36.38 35.04 1jvn s VAL 504 CO 0.00 -0.44 2.04 -0.65 -0.31 0.00 0.00 175.10 175.74 1jvn h PRO 505 N 2.55 0.23 -0.10 4.82 0.11 -1.93 -1.71 132.00 135.97 1jvn h PRO 505 Ca -0.38 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.75 1jvn h PRO 505 Cb 1.21 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1jvn h PRO 505 CO 0.64 0.15 0.08 0.93 -0.21 0.00 0.00 178.00 179.59 1jvn h GLU 506 N 0.24 0.00 -0.18 1.05 3.07 -1.96 -1.35 114.58 115.45 1jvn h GLU 506 Ca 0.18 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.96 1jvn h GLU 506 Cb 0.41 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 1jvn h GLU 506 CO -0.03 0.00 -0.26 0.45 -1.40 0.00 0.00 179.01 177.77 1jvn h HIS 507 N 0.00 0.36 -0.08 4.33 3.86 -1.73 0.51 115.15 122.40 1jvn h HIS 507 Ca 0.05 -0.07 -0.18 0.00 -1.16 0.00 0.00 60.37 59.01 1jvn h HIS 507 Cb 0.20 -0.09 0.01 0.00 1.06 0.00 0.00 27.41 28.59 1jvn h HIS 507 CO 0.00 0.57 -0.65 0.74 0.86 0.00 0.00 177.93 179.45 1jvn h PHE 508 N 0.29 0.81 -0.33 2.45 -1.00 -1.38 -2.21 116.94 115.58 1jvn h PHE 508 Ca 0.04 -0.38 0.00 0.00 2.81 0.00 0.00 57.97 60.44 1jvn h PHE 508 Cb 0.62 -0.11 -0.02 0.00 3.61 0.00 0.00 35.95 40.05 1jvn h PHE 508 CO 0.01 1.19 0.21 1.49 -1.61 0.00 0.00 178.31 179.60 1jvn h GLU 509 N 0.19 0.43 -0.80 1.51 4.81 -1.13 -0.04 114.58 119.56 1jvn h GLU 509 Ca -0.06 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.16 1jvn h GLU 509 Cb 1.31 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 30.55 1jvn h GLU 509 CO 0.13 0.30 0.52 1.49 -0.73 0.00 0.00 179.01 180.72 1jvn h GLU 510 N 0.44 1.01 -0.35 1.92 4.81 -0.92 0.79 114.58 122.27 1jvn h GLU 510 Ca 0.12 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.20 1jvn h GLU 510 Cb -0.04 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.10 1jvn h GLU 510 CO -0.03 0.67 -0.12 0.00 -0.73 0.00 0.00 179.01 178.80 1jvn h ALA 511 N 1.31 0.49 0.00 2.92 0.00 -0.96 0.10 119.26 123.12 1jvn h ALA 511 Ca 0.31 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1jvn h ALA 511 Cb -0.06 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1jvn h ALA 511 CO -0.09 0.37 -0.34 0.74 0.00 0.00 0.00 179.25 179.93 1jvn h PHE 512 N 0.49 0.00 0.00 0.00 0.04 -0.62 -2.54 116.94 114.31 1jvn h PHE 512 Ca 0.08 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.60 1jvn h PHE 512 Cb 0.64 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.75 1jvn h PHE 512 CO 0.05 0.34 -2.09 1.28 -0.60 0.00 0.00 178.31 177.30 1jvn n LEU 513 N -3.46 0.00 -0.00 1.54 4.77 0.23 -4.61 117.00 115.47 1jvn n LEU 513 Ca 0.00 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.08 1jvn n LEU 513 Cb 0.51 0.34 -0.14 0.00 -2.33 0.00 0.00 43.42 41.80 1jvn n LEU 513 CO 0.36 0.34 -0.31 0.29 -1.33 0.00 0.00 177.39 176.75 1jvn n LYS 514 N -2.53 0.24 -4.45 3.23 5.02 0.36 -5.00 118.16 115.03 1jvn n LYS 514 Ca -0.23 -0.07 -0.22 0.00 -2.02 0.00 0.00 58.31 55.77 1jvn n LYS 514 Cb 0.95 -1.51 -0.09 0.00 -0.02 0.00 0.00 35.03 34.35 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 -3.19 0.79 -0.33 -0.18 -4.23 -0.96 -5.04 115.64 102.50 1jvn s THR 515 Ca 0.02 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.64 1jvn s THR 515 Cb 0.15 -2.57 0.72 0.00 1.34 0.00 0.00 72.50 72.14 1jvn s THR 515 CO 0.88 0.00 1.71 0.54 -0.54 0.00 0.00 174.62 177.21 1jvn n ARG 516 N -0.73 3.94 -1.65 3.99 1.74 -1.26 -4.62 116.66 118.07 1jvn n ARG 516 Ca -0.03 -2.88 -0.46 0.00 -0.77 0.00 0.00 57.85 53.71 1jvn n ARG 516 Cb 0.66 -2.18 -0.03 0.00 -1.02 0.00 0.00 32.46 29.89 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 0.14 0.79 1.10 7.54 0.00 -1.26 -4.89 120.51 123.92 1jvn n ALA 517 Ca 0.34 0.42 0.12 0.00 0.00 0.00 0.00 53.44 54.32 1jvn n ALA 517 Cb 1.26 -2.24 0.25 0.00 0.00 0.00 0.00 19.45 18.72 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 2.23 0.87 -3.57 0.00 8.00 0.31 -4.84 116.55 119.54 1jvn n ASP 518 Ca 0.13 -0.67 -0.05 0.00 0.71 0.00 0.00 54.79 54.91 1jvn n ASP 518 Cb 0.30 0.29 -0.02 0.00 -0.02 0.00 0.00 41.12 41.67 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 -2.76 -2.00 -0.05 2.24 0.00 -1.17 -4.49 121.76 113.53 1jvn s ALA 519 Ca 0.17 1.33 0.02 0.00 0.00 0.00 0.00 51.96 53.48 1jvn s ALA 519 Cb 0.18 0.09 0.02 0.00 0.00 0.00 0.00 23.12 23.41 1jvn s ALA 519 CO 0.63 -0.66 -0.09 0.00 0.00 0.00 0.00 175.76 175.64 1jvn s LEU 521 N 0.69 3.40 0.06 0.00 0.20 0.14 -0.47 118.68 122.70 1jvn s LEU 521 Ca -0.12 -0.00 0.06 0.00 0.69 0.00 0.00 54.13 54.75 1jvn s LEU 521 Cb -0.15 -1.88 -0.03 0.00 -0.43 0.00 0.00 46.19 43.71 1jvn s LEU 521 CO 0.02 0.32 -0.16 -0.83 -0.29 0.00 0.00 176.35 175.40 1jvn s GLY 522 N -1.26 0.95 0.00 7.98 0.00 0.58 -4.50 107.32 111.07 1jvn s GLY 522 Ca 0.17 -1.00 0.00 0.00 0.00 0.00 0.00 44.72 43.88 1jvn s GLY 522 CO 0.07 -1.00 0.00 0.00 0.00 0.00 0.00 173.10 172.17 1jvn n ALA 523 N 1.49 1.31 -0.29 3.20 0.00 -1.26 -0.52 120.51 124.44 1jvn n ALA 523 Ca -0.19 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.31 1jvn n ALA 523 Cb 0.54 0.00 0.21 0.00 0.00 0.00 0.00 19.45 20.20 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 1.34 1.63 0.00 0.00 -1.90 -0.85 103.07 103.28 1jvn h GLY 524 Ca 0.00 -0.26 0.01 0.00 0.00 0.00 0.00 47.33 47.08 1jvn h GLY 524 CO 0.00 -0.01 0.25 0.00 0.00 0.00 0.00 176.54 176.78 1jvn h MET 525 N 0.64 0.47 0.11 4.80 -0.00 -1.90 0.19 114.93 119.24 1jvn h MET 525 Ca 0.45 -0.03 -0.29 0.00 -0.00 0.00 0.00 59.70 59.83 1jvn h MET 525 Cb 0.59 -0.11 -0.01 0.00 -0.00 0.00 0.00 31.60 32.08 1jvn h MET 525 CO -0.34 0.31 -1.40 0.74 -0.00 0.00 0.00 176.91 176.22 1jvn h PHE 526 N 0.49 0.42 -0.29 -0.10 0.04 -1.52 -2.93 116.94 113.04 1jvn h PHE 526 Ca 0.14 -0.31 -0.14 0.00 2.80 0.00 0.00 57.97 60.46 1jvn h PHE 526 Cb -0.04 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.09 1jvn h PHE 526 CO -0.00 1.31 -0.40 1.25 -0.60 0.00 0.00 178.31 179.86 1jvn h HIS 527 N 0.06 0.84 0.00 -0.55 2.76 -0.44 -3.01 115.15 114.82 1jvn h HIS 527 Ca -0.19 -0.25 0.00 0.00 -2.20 0.00 0.00 60.37 57.73 1jvn h HIS 527 Cb 1.98 -0.18 0.00 0.00 1.55 0.00 0.00 27.41 30.77 1jvn h HIS 527 CO 0.06 0.99 0.00 0.54 -1.30 0.00 0.00 177.93 178.22 1jvn n ARG 528 N -4.04 0.15 -0.89 5.26 1.74 0.59 -4.92 116.66 114.56 1jvn n ARG 528 Ca -0.02 0.18 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 1jvn n ARG 528 Cb 0.53 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 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 1.10 0.69 0.24 -0.13 0.00 -1.14 -4.92 105.19 101.04 1jvn n GLY 529 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.01 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 1.97 0.80 -3.90 1.61 5.08 -1.81 -3.44 114.58 114.89 1jvn h GLU 530 Ca 0.00 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.17 1jvn h GLU 530 Cb 0.00 -0.18 -0.19 0.00 0.50 0.00 0.00 28.75 28.88 1jvn h GLU 530 CO 0.00 0.53 -0.61 -0.06 -1.00 0.00 0.00 179.01 177.87 1jvn s PHE 531 N -6.14 0.26 0.38 4.33 0.40 -1.12 -5.09 117.98 111.00 1jvn s PHE 531 Ca -0.13 -0.56 0.08 0.00 -0.60 0.00 0.00 56.93 55.71 1jvn s PHE 531 Cb 0.13 -0.19 -0.02 0.00 0.51 0.00 0.00 43.02 43.45 1jvn s PHE 531 CO 0.76 -0.29 0.34 0.95 0.70 0.00 0.00 175.22 177.67 1jvn s THR 532 N -2.26 2.98 0.28 0.64 -4.23 -1.26 -4.06 115.64 107.73 1jvn s THR 532 Ca -0.08 -1.37 -0.01 0.00 -1.18 0.00 0.00 61.69 59.04 1jvn s THR 532 Cb -0.04 -3.06 0.16 0.00 1.34 0.00 0.00 72.50 70.90 1jvn s THR 532 CO -0.03 -0.07 1.83 0.58 -0.54 0.00 0.00 174.62 176.39 1jvn h VAL 533 N 1.13 1.22 0.00 2.29 2.07 -1.90 -2.03 116.25 119.04 1jvn h VAL 533 Ca -0.43 -0.80 -0.04 0.00 0.82 0.00 0.00 66.70 66.25 1jvn h VAL 533 Cb 1.26 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 1jvn h VAL 533 CO 0.58 0.30 -0.19 0.78 0.02 0.00 0.00 177.57 179.06 1jvn h ASN 534 N 0.81 0.00 -0.45 0.57 2.35 -1.42 0.08 115.58 117.51 1jvn h ASN 534 Ca 0.18 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.84 1jvn h ASN 534 Cb 0.28 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 1jvn h ASN 534 CO -0.00 0.19 -0.06 0.44 -1.65 0.00 0.00 177.43 176.35 1jvn h ASP 535 N 0.00 0.84 -0.30 5.81 3.32 -1.67 0.18 116.42 124.59 1jvn h ASP 535 Ca -0.00 -0.34 -0.05 0.00 0.02 0.00 0.00 57.03 56.66 1jvn h ASP 535 Cb 0.35 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1jvn h ASP 535 CO 0.02 0.98 -0.02 0.58 -1.72 0.00 0.00 179.24 179.08 1jvn h VAL 536 N 0.68 1.26 -0.32 -1.35 2.07 -1.23 -2.60 116.25 114.77 1jvn h VAL 536 Ca 0.12 -0.99 -0.01 0.00 0.82 0.00 0.00 66.70 66.64 1jvn h VAL 536 Cb 0.58 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1jvn h VAL 536 CO 0.03 0.32 0.15 0.11 0.02 0.00 0.00 177.57 178.20 1jvn h LYS 537 N 0.33 0.47 -0.90 1.57 1.57 -0.82 -1.02 116.57 117.78 1jvn h LYS 537 Ca 0.08 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 58.84 1jvn h LYS 537 Cb 0.47 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.64 1jvn h LYS 537 CO 0.02 0.44 0.57 0.93 -0.57 0.00 0.00 179.45 180.85 1jvn h GLU 538 N 0.39 1.05 -0.16 3.15 4.39 -0.63 0.15 114.58 122.91 1jvn h GLU 538 Ca 0.11 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 1jvn h GLU 538 Cb 0.13 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 1jvn h GLU 538 CO -0.01 0.69 0.05 -0.92 -1.16 0.00 0.00 179.01 177.66 1jvn h TYR 539 N 1.08 0.26 -0.65 4.33 3.20 -1.19 -1.29 116.97 122.70 1jvn h TYR 539 Ca 0.37 -0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.16 1jvn h TYR 539 Cb 0.08 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.25 1jvn h TYR 539 CO -0.02 0.37 0.17 -0.07 -1.64 0.00 0.00 178.16 176.97 1jvn h LEU 540 N 0.07 0.96 -0.13 2.82 3.38 -0.78 -2.45 115.31 119.18 1jvn h LEU 540 Ca 0.05 -0.18 0.01 0.00 0.09 0.00 0.00 57.88 57.85 1jvn h LEU 540 Cb 0.23 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1jvn h LEU 540 CO -0.00 0.92 0.05 0.25 0.09 0.00 0.00 178.44 179.75 1jvn h LEU 541 N 0.98 0.07 -2.19 1.67 5.85 -0.57 -1.11 115.31 120.00 1jvn h LEU 541 Ca 0.21 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.94 1jvn h LEU 541 Cb 0.32 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 1jvn h LEU 541 CO -0.00 0.06 -0.01 -0.08 -0.34 0.00 0.00 178.44 178.07 1jvn h GLU 542 N 0.12 0.00 -0.64 1.25 4.81 -1.03 -1.92 114.58 117.17 1jvn h GLU 542 Ca 0.06 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1jvn h GLU 542 Cb 0.02 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1jvn h GLU 542 CO -0.05 0.01 0.00 0.72 -0.73 0.00 0.00 179.01 178.96 1jvn n HIS 543 N -4.22 1.24 -0.64 0.92 8.25 -0.68 -4.93 115.22 115.16 1jvn n HIS 543 Ca -0.03 -0.47 0.00 0.00 -0.26 0.00 0.00 57.72 56.96 1jvn n HIS 543 Cb 0.09 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 30.95 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 0.80 0.82 3.85 -1.41 0.00 -0.72 -5.05 105.19 103.47 1jvn n GLY 544 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 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 4.06 -0.20 0.99 1.43 -0.51 -5.01 118.68 119.45 1jvn s LEU 545 Ca 0.00 1.30 -0.16 0.00 -1.03 0.00 0.00 54.13 54.24 1jvn s LEU 545 Cb 0.00 -4.09 -0.04 0.00 0.03 0.00 0.00 46.19 42.09 1jvn s LEU 545 CO 0.00 -0.21 0.43 -0.54 0.23 0.00 0.00 176.35 176.26 1jvn s LYS 546 N -2.96 4.19 0.05 1.70 -0.14 -1.26 -4.06 119.74 117.26 1jvn s LYS 546 Ca 0.54 0.26 0.02 0.00 -1.36 0.00 0.00 55.97 55.42 1jvn s LYS 546 Cb -0.10 -3.54 -0.03 0.00 -1.68 0.00 0.00 37.83 32.48 1jvn s LYS 546 CO 0.17 -0.05 -0.06 0.14 -0.76 0.00 0.00 175.35 174.79 1jvn s VAL 547 N 1.34 0.50 0.08 3.17 -7.23 -1.26 -0.26 120.40 116.73 1jvn s VAL 547 Ca 0.20 -1.33 -0.31 0.00 -1.81 0.00 0.00 61.98 58.73 1jvn s VAL 547 Cb -0.15 -0.91 -0.07 0.00 0.56 0.00 0.00 36.38 35.82 1jvn s VAL 547 CO 0.08 -0.57 1.29 -0.60 -0.31 0.00 0.00 175.10 175.00 1jvn s ARG 548 N -2.33 4.37 -0.36 4.82 3.52 -1.26 -4.98 118.95 122.72 1jvn s ARG 548 Ca -0.04 1.91 0.00 0.00 -0.13 0.00 0.00 55.73 57.48 1jvn s ARG 548 Cb -0.05 -3.32 0.12 0.00 -1.56 0.00 0.00 34.95 30.14 1jvn s ARG 548 CO -0.02 -0.36 0.16 -1.64 -0.81 0.00 0.00 175.30 172.64 1jvn s MET 549 N 1.19 0.91 -0.01 5.12 -1.94 -1.26 -5.06 119.30 118.25 1jvn s MET 549 Ca 0.62 -1.46 -0.01 0.00 -1.71 0.00 0.00 55.69 53.13 1jvn s MET 549 Cb -0.33 -2.04 0.01 0.00 2.01 0.00 0.00 34.83 34.48 1jvn s MET 549 CO 0.29 -1.08 0.03 0.34 -0.01 0.00 0.00 175.02 174.59 1jvn s ASP 550 N 1.07 -0.01 0.02 3.03 2.15 -1.26 -4.98 116.67 116.68 1jvn s ASP 550 Ca 0.14 0.05 -0.08 0.00 0.43 0.00 0.00 52.55 53.09 1jvn s ASP 550 Cb -0.21 0.03 0.00 0.00 -0.30 0.00 0.00 42.92 42.44 1jvn s ASP 550 CO -0.12 -0.03 0.15 -0.70 -0.17 0.00 0.00 175.17 174.30 1jvn s GLU 551 N 0.21 0.58 0.00 4.34 2.12 -1.26 -4.82 118.70 119.86 1jvn s GLU 551 Ca -0.02 -0.55 0.26 0.00 0.36 0.00 0.00 54.97 55.02 1jvn s GLU 551 Cb -0.02 0.24 0.58 0.00 0.26 0.00 0.00 34.13 35.19 1jvn s GLU 551 CO -0.01 -0.15 1.48 0.39 -0.54 0.00 0.00 175.26 176.43