#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jvv s ASP 2 N 0.00 4.15 0.33 6.12 -4.77 -1.26 -4.82 116.67 116.42 3jvv s ASP 2 Ca 0.00 0.03 0.02 0.00 -3.30 0.00 0.00 52.55 49.31 3jvv s ASP 2 Cb 0.00 -0.41 0.58 0.00 -1.09 0.00 0.00 42.92 42.01 3jvv s ASP 2 CO 0.00 -2.02 1.93 -0.29 0.70 0.00 0.00 175.17 175.49 3jvv h ILE 3 N -0.84 1.18 -0.33 2.11 6.09 -1.99 0.95 117.51 124.69 3jvv h ILE 3 Ca -0.41 -0.55 0.03 0.00 -1.37 0.00 0.00 64.86 62.56 3jvv h ILE 3 Cb 1.27 0.56 -0.03 0.00 0.47 0.00 0.00 36.82 39.09 3jvv h ILE 3 CO 0.45 0.22 0.13 0.74 -3.07 0.00 0.00 178.15 176.62 3jvv h THR 4 N 0.72 0.93 -0.22 2.19 2.02 -1.98 0.93 112.91 117.51 3jvv h THR 4 Ca 0.18 -0.10 -0.00 0.00 0.77 0.00 0.00 66.41 67.26 3jvv h THR 4 Cb 0.12 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 3jvv h THR 4 CO -0.02 0.05 0.13 -0.33 0.37 0.00 0.00 175.52 175.72 3jvv h GLU 5 N 0.28 0.30 -0.14 6.66 5.08 -1.66 0.15 114.58 125.26 3jvv h GLU 5 Ca 0.15 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.52 3jvv h GLU 5 Cb 0.10 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.24 3jvv h GLU 5 CO -0.13 0.26 -0.15 -0.07 -1.00 0.00 0.00 179.01 177.92 3jvv h LEU 6 N 0.26 -0.47 -0.41 1.33 3.38 -0.56 0.22 115.31 119.06 3jvv h LEU 6 Ca 0.08 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3jvv h LEU 6 Cb 0.04 0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3jvv h LEU 6 CO -0.01 -0.19 0.26 -0.07 0.09 0.00 0.00 178.44 178.51 3jvv h LEU 7 N -0.18 0.47 -0.61 1.67 3.38 -0.66 0.17 115.31 119.56 3jvv h LEU 7 Ca 0.10 -0.03 0.11 0.00 0.09 0.00 0.00 57.88 58.15 3jvv h LEU 7 Cb 0.32 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.87 3jvv h LEU 7 CO -0.25 0.36 0.17 0.00 0.09 0.00 0.00 178.44 178.82 3jvv h ALA 8 N 1.13 0.76 -0.09 1.53 0.00 -0.41 0.34 119.26 122.53 3jvv h ALA 8 Ca 0.15 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.18 3jvv h ALA 8 Cb -0.04 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3jvv h ALA 8 CO -0.03 -0.26 0.01 0.35 0.00 0.00 0.00 179.25 179.31 3jvv h PHE 9 N 0.32 0.01 -0.76 0.00 3.04 0.36 0.18 116.94 120.09 3jvv h PHE 9 Ca 0.32 0.01 0.11 0.00 3.98 0.00 0.00 57.97 62.39 3jvv h PHE 9 Cb 0.45 0.01 -0.08 0.00 2.56 0.00 0.00 35.95 38.89 3jvv h PHE 9 CO -0.21 -0.00 0.37 0.77 -2.02 0.00 0.00 178.31 177.21 3jvv h SER 10 N 0.04 0.45 0.00 0.41 0.02 0.35 0.19 113.55 115.01 3jvv h SER 10 Ca 0.04 0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 61.07 3jvv h SER 10 Cb 0.04 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.59 3jvv h SER 10 CO -0.06 0.23 -0.00 0.00 -1.14 0.00 0.00 176.83 175.85 3jvv h ALA 11 N 1.48 -0.00 -0.99 3.77 0.00 -0.50 0.51 119.26 123.53 3jvv h ALA 11 Ca 0.39 -0.06 0.21 0.00 0.00 0.00 0.00 54.91 55.45 3jvv h ALA 11 Cb 0.48 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.17 3jvv h ALA 11 CO -0.32 -0.44 0.62 -0.22 0.00 0.00 0.00 179.25 178.89 3jvv h LYS 12 N -0.12 0.62 -0.05 0.00 1.63 0.93 0.44 116.57 120.01 3jvv h LYS 12 Ca -0.00 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 3jvv h LYS 12 Cb 0.12 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 31.61 3jvv h LYS 12 CO 0.00 0.41 0.00 1.04 -3.45 0.00 0.00 179.45 177.45 3jvv n GLN 13 N -4.71 1.21 -2.96 1.90 1.13 0.51 -4.91 117.38 109.55 3jvv n GLN 13 Ca 0.23 -0.32 -0.22 0.00 -1.94 0.00 0.00 57.00 54.75 3jvv n GLN 13 Cb 0.65 -1.29 0.03 0.00 0.11 0.00 0.00 30.24 29.75 3jvv n GLN 13 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3jvv n GLY 14 N 0.86 -0.51 3.77 1.08 0.00 0.15 -4.98 105.19 105.56 3jvv n GLY 14 Ca 0.13 0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.88 3jvv n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jvv s ALA 15 N -3.17 3.28 0.13 4.61 0.00 0.12 -4.70 121.76 122.03 3jvv s ALA 15 Ca 0.28 0.55 0.06 0.00 0.00 0.00 0.00 51.96 52.84 3jvv s ALA 15 Cb -0.12 -3.18 -0.16 0.00 0.00 0.00 0.00 23.12 19.66 3jvv s ALA 15 CO 0.34 0.20 1.30 0.66 0.00 0.00 0.00 175.76 178.26 3jvv h SER 16 N 3.66 0.06 -3.89 0.00 4.64 -1.40 -3.44 113.55 113.19 3jvv h SER 16 Ca -0.46 -0.06 -0.21 0.00 -0.47 0.00 0.00 61.79 60.59 3jvv h SER 16 Cb 1.20 -0.02 -0.27 0.00 -0.31 0.00 0.00 62.40 63.00 3jvv h SER 16 CO 0.66 1.01 -0.67 -1.81 -0.87 0.00 0.00 176.83 175.15 3jvv s ASP 17 N -6.78 -0.02 -0.13 4.97 1.01 -1.24 -0.78 116.67 113.71 3jvv s ASP 17 Ca 0.00 0.03 0.00 0.00 0.71 0.00 0.00 52.55 53.29 3jvv s ASP 17 Cb 0.10 0.09 -0.01 0.00 1.01 0.00 0.00 42.92 44.11 3jvv s ASP 17 CO 0.82 -0.05 -0.13 -0.22 0.21 0.00 0.00 175.17 175.80 3jvv s LEU 18 N -0.14 2.70 -0.12 1.23 2.96 -0.36 -1.01 118.68 123.94 3jvv s LEU 18 Ca -0.02 -0.33 -0.01 0.00 -0.22 0.00 0.00 54.13 53.55 3jvv s LEU 18 Cb -0.01 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 45.05 3jvv s LEU 18 CO 0.00 0.17 -0.07 -1.00 -1.32 0.00 0.00 176.35 174.13 3jvv s HIS 19 N 0.31 2.94 -0.07 5.38 3.76 0.12 -0.82 115.29 126.91 3jvv s HIS 19 Ca -0.10 -0.27 0.02 0.00 -0.15 0.00 0.00 55.06 54.56 3jvv s HIS 19 Cb -0.16 -1.84 -0.03 0.00 1.11 0.00 0.00 32.58 31.66 3jvv s HIS 19 CO 0.06 0.05 -0.10 -0.51 -0.85 0.00 0.00 174.74 173.38 3jvv s LEU 20 N -0.05 2.96 -0.25 0.89 1.43 0.14 -2.00 118.68 121.80 3jvv s LEU 20 Ca -0.00 -0.12 -0.04 0.00 -1.03 0.00 0.00 54.13 52.95 3jvv s LEU 20 Cb -0.13 -1.63 0.14 0.00 0.03 0.00 0.00 46.19 44.59 3jvv s LEU 20 CO 0.03 0.34 0.44 -0.55 0.23 0.00 0.00 176.35 176.84 3jvv s SER 21 N -0.68 -0.26 0.02 2.29 0.15 -1.26 -0.93 113.70 113.03 3jvv s SER 21 Ca 0.10 0.58 -0.39 0.00 0.70 0.00 0.00 55.95 56.94 3jvv s SER 21 Cb -0.11 1.44 -0.19 0.00 -1.71 0.00 0.00 66.02 65.44 3jvv s SER 21 CO 0.01 -0.27 1.09 0.00 1.20 0.00 0.00 173.24 175.27 3jvv n ALA 22 N 5.39 -3.28 -0.43 5.45 0.00 -0.73 -1.22 120.51 125.69 3jvv n ALA 22 Ca -0.04 0.59 0.00 0.00 0.00 0.00 0.00 53.44 53.98 3jvv n ALA 22 Cb 0.50 -1.80 0.00 0.00 0.00 0.00 0.00 19.45 18.15 3jvv n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jvv n GLY 23 N 1.64 0.77 3.09 0.00 0.00 0.13 -4.65 105.19 106.16 3jvv n GLY 23 Ca 0.20 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.13 3jvv n GLY 23 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3jvv s LEU 24 N 0.00 2.43 0.78 0.99 1.43 -0.36 -4.78 118.68 119.18 3jvv s LEU 24 Ca 0.00 -0.87 -0.12 0.00 -1.03 0.00 0.00 54.13 52.12 3jvv s LEU 24 Cb 0.00 0.08 0.06 0.00 0.03 0.00 0.00 46.19 46.36 3jvv s LEU 24 CO 0.00 -0.47 1.11 -2.16 0.23 0.00 0.00 176.35 175.06 3jvv s PRO 25 N -3.23 2.21 0.50 1.29 0.04 -1.26 -0.08 135.00 134.47 3jvv s PRO 25 Ca 0.03 0.51 -0.23 0.00 0.04 0.00 0.00 61.00 61.34 3jvv s PRO 25 Cb 0.02 -1.94 -0.07 0.00 0.04 0.00 0.00 34.50 32.55 3jvv s PRO 25 CO -0.06 -1.50 1.22 -2.30 0.04 0.00 0.00 177.00 174.39 3jvv n PRO 26 N -3.33 1.59 -4.21 0.56 -0.02 -1.26 -4.77 135.00 123.56 3jvv n PRO 26 Ca 0.07 0.58 -0.20 0.00 -2.02 0.00 0.00 63.50 61.93 3jvv n PRO 26 Cb 0.57 -2.38 -0.12 0.00 -0.02 0.00 0.00 33.50 31.56 3jvv n PRO 26 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 3jvv s MET 27 N -2.53 0.91 0.02 -0.52 -1.94 -0.85 -0.81 119.30 113.58 3jvv s MET 27 Ca 0.68 -1.02 0.04 0.00 -1.71 0.00 0.00 55.69 53.68 3jvv s MET 27 Cb -0.46 -0.99 -0.02 0.00 2.01 0.00 0.00 34.83 35.37 3jvv s MET 27 CO 0.53 0.22 -0.13 0.96 -0.01 0.00 0.00 175.02 176.59 3jvv s ILE 28 N -1.26 1.02 -0.25 2.53 -4.36 0.29 0.10 121.20 119.28 3jvv s ILE 28 Ca 0.01 -0.79 -0.14 0.00 -0.26 0.00 0.00 60.65 59.46 3jvv s ILE 28 Cb -0.10 -0.90 -0.04 0.00 1.25 0.00 0.00 42.46 42.67 3jvv s ILE 28 CO 0.03 0.11 0.34 -0.60 0.24 0.00 0.00 174.94 175.06 3jvv s ARG 29 N -0.77 4.07 -0.05 0.37 3.52 -0.18 -0.62 118.95 125.27 3jvv s ARG 29 Ca 0.03 0.02 0.03 0.00 -0.13 0.00 0.00 55.73 55.68 3jvv s ARG 29 Cb -0.06 -3.60 0.00 0.00 -1.56 0.00 0.00 34.95 29.72 3jvv s ARG 29 CO 0.00 -0.15 -0.16 0.08 -0.81 0.00 0.00 175.30 174.26 3jvv s VAL 30 N 1.69 1.34 -1.23 7.11 1.01 -0.29 -1.01 120.40 129.02 3jvv s VAL 30 Ca 0.15 -0.64 -0.06 0.00 0.00 0.00 0.00 61.98 61.43 3jvv s VAL 30 Cb -0.15 -1.18 0.06 0.00 0.00 0.00 0.00 36.38 35.10 3jvv s VAL 30 CO 0.09 0.40 0.14 0.47 0.00 0.00 0.00 175.10 176.19 3jvv n ASP 31 N 3.41 0.07 0.00 3.32 8.00 -1.26 -0.99 116.55 129.10 3jvv n ASP 31 Ca -0.20 -0.95 0.00 0.00 0.71 0.00 0.00 54.79 54.36 3jvv n ASP 31 Cb 0.53 -1.18 0.00 0.00 -0.02 0.00 0.00 41.12 40.44 3jvv n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3jvv n GLY 32 N -1.79 2.89 3.77 0.44 0.00 -1.26 -5.03 105.19 104.21 3jvv n GLY 32 Ca -0.14 -0.21 -0.37 0.00 0.00 0.00 0.00 46.02 45.30 3jvv n GLY 32 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3jvv s ASP 33 N 0.61 6.53 -0.12 1.61 1.01 -0.16 -5.01 116.67 121.13 3jvv s ASP 33 Ca 0.00 0.62 -0.23 0.00 0.71 0.00 0.00 52.55 53.65 3jvv s ASP 33 Cb 0.00 -2.19 -0.03 0.00 1.01 0.00 0.00 42.92 41.71 3jvv s ASP 33 CO 0.00 0.18 0.72 -0.69 0.21 0.00 0.00 175.17 175.59 3jvv s VAL 34 N -0.05 5.00 0.04 -1.27 1.01 -1.26 -1.14 120.40 122.73 3jvv s VAL 34 Ca 0.18 1.43 -0.00 0.00 0.00 0.00 0.00 61.98 63.59 3jvv s VAL 34 Cb -0.14 -4.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 3jvv s VAL 34 CO 0.06 0.16 -0.04 -0.13 0.00 0.00 0.00 175.10 175.16 3jvv s ARG 35 N 1.39 0.51 0.19 2.72 0.52 0.20 -4.93 118.95 119.55 3jvv s ARG 35 Ca 0.36 -0.95 -0.30 0.00 -0.52 0.00 0.00 55.73 54.31 3jvv s ARG 35 Cb -0.17 0.08 -0.08 0.00 0.52 0.00 0.00 34.95 35.30 3jvv s ARG 35 CO 0.15 -0.06 1.20 1.03 0.02 0.00 0.00 175.30 177.63 3jvv s ARG 36 N -2.73 4.49 0.40 3.54 0.52 -1.26 -0.55 118.95 123.37 3jvv s ARG 36 Ca -0.03 1.88 -0.24 0.00 -0.52 0.00 0.00 55.73 56.82 3jvv s ARG 36 Cb -0.01 -3.24 -0.09 0.00 0.52 0.00 0.00 34.95 32.13 3jvv s ARG 36 CO -0.05 -0.08 1.04 0.42 0.02 0.00 0.00 175.30 176.65 3jvv s ILE 37 N -0.09 3.79 -0.89 1.52 1.01 0.01 -4.91 121.20 121.64 3jvv s ILE 37 Ca 0.53 1.33 -0.22 0.00 0.00 0.00 0.00 60.65 62.29 3jvv s ILE 37 Cb -0.33 -3.67 -0.13 0.00 0.01 0.00 0.00 42.46 38.34 3jvv s ILE 37 CO 0.37 -0.03 1.93 -3.20 0.00 0.00 0.00 174.94 174.01 3jvv n ASN 38 N -0.15 2.72 -4.17 3.58 5.15 -1.26 -4.72 115.26 116.41 3jvv n ASN 38 Ca 0.05 -2.69 -0.10 0.00 -0.60 0.00 0.00 54.58 51.24 3jvv n ASN 38 Cb 0.50 -1.28 -0.10 0.00 -0.53 0.00 0.00 39.78 38.37 3jvv n ASN 38 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3jvv s LEU 39 N 3.43 2.10 0.82 1.20 1.43 -1.26 -5.15 118.68 121.24 3jvv s LEU 39 Ca 0.60 -1.14 -0.12 0.00 -1.03 0.00 0.00 54.13 52.43 3jvv s LEU 39 Cb 0.11 0.13 0.09 0.00 0.03 0.00 0.00 46.19 46.55 3jvv s LEU 39 CO 0.12 -0.62 1.18 -2.84 0.23 0.00 0.00 176.35 174.41 3jvv s PRO 40 N -3.96 1.60 0.62 1.29 0.02 -1.26 -4.68 135.00 128.63 3jvv s PRO 40 Ca 0.19 1.65 -0.19 0.00 0.02 0.00 0.00 61.00 62.67 3jvv s PRO 40 Cb 0.07 -1.78 -0.02 0.00 0.02 0.00 0.00 34.50 32.78 3jvv s PRO 40 CO -0.01 -2.22 1.28 -2.30 -0.33 0.00 0.00 177.00 173.43 3jvv n PRO 41 N -3.47 1.25 -3.87 5.54 -0.02 -1.26 -4.18 135.00 128.99 3jvv n PRO 41 Ca 0.13 0.48 -0.36 0.00 -2.02 0.00 0.00 63.50 61.73 3jvv n PRO 41 Cb 0.51 -2.51 -0.11 0.00 -0.02 0.00 0.00 33.50 31.37 3jvv n PRO 41 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3jvv s LEU 42 N -3.89 3.68 0.50 2.45 1.43 0.88 -4.79 118.68 118.94 3jvv s LEU 42 Ca 0.79 -0.05 -0.06 0.00 -1.03 0.00 0.00 54.13 53.78 3jvv s LEU 42 Cb -0.39 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 43.83 3jvv s LEU 42 CO 0.43 0.06 0.81 -1.61 0.23 0.00 0.00 176.35 176.28 3jvv s GLU 43 N 1.04 3.53 0.30 1.70 0.41 -1.26 0.17 118.70 124.60 3jvv s GLU 43 Ca 0.04 0.25 -0.02 0.00 -0.41 0.00 0.00 54.97 54.83 3jvv s GLU 43 Cb -0.14 -2.34 0.65 0.00 -1.78 0.00 0.00 34.13 30.51 3jvv s GLU 43 CO 0.03 -0.25 1.57 1.25 -0.49 0.00 0.00 175.26 177.37 3jvv h HIS 44 N 0.16 -0.19 -0.57 1.61 -0.00 -1.91 0.34 115.15 114.59 3jvv h HIS 44 Ca -0.47 0.08 0.03 0.00 -0.00 0.00 0.00 60.37 60.01 3jvv h HIS 44 Cb 1.20 0.24 -0.04 0.00 -0.00 0.00 0.00 27.41 28.82 3jvv h HIS 44 CO 0.59 -0.42 0.34 0.87 -0.00 0.00 0.00 177.93 179.31 3jvv h LYS 45 N 0.01 0.65 0.05 5.26 1.79 -1.96 0.30 116.57 122.68 3jvv h LYS 45 Ca 0.55 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.98 3jvv h LYS 45 Cb 1.05 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.56 3jvv h LYS 45 CO -0.94 0.43 -0.03 1.96 -1.08 0.00 0.00 179.45 179.80 3jvv h GLN 46 N 0.67 -0.07 -0.58 3.15 4.20 -0.76 -0.29 115.11 121.44 3jvv h GLN 46 Ca 0.23 0.00 0.08 0.00 0.06 0.00 0.00 58.65 59.03 3jvv h GLN 46 Cb 0.04 0.02 -0.07 0.00 0.30 0.00 0.00 27.48 27.77 3jvv h GLN 46 CO -0.11 0.40 0.22 0.28 -0.67 0.00 0.00 178.83 178.95 3jvv h VAL 47 N -0.57 0.81 -0.15 -0.54 2.07 -1.06 0.73 116.25 117.53 3jvv h VAL 47 Ca -0.01 -0.14 0.01 0.00 0.82 0.00 0.00 66.70 67.38 3jvv h VAL 47 Cb 0.50 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 3jvv h VAL 47 CO 0.01 0.08 0.09 -0.74 0.02 0.00 0.00 177.57 177.03 3jvv h HIS 48 N 0.41 0.17 0.16 1.57 -0.00 -0.24 -1.57 115.15 115.66 3jvv h HIS 48 Ca 0.28 0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.67 3jvv h HIS 48 Cb 0.32 -0.05 -0.02 0.00 -0.00 0.00 0.00 27.41 27.66 3jvv h HIS 48 CO -0.16 0.10 -0.19 0.00 -0.00 0.00 0.00 177.93 177.68 3jvv h ALA 49 N 1.07 -0.37 -0.87 5.26 0.00 -0.41 0.40 119.26 124.34 3jvv h ALA 49 Ca 0.06 -0.05 0.23 0.00 0.00 0.00 0.00 54.91 55.15 3jvv h ALA 49 Cb -0.00 0.29 -0.14 0.00 0.00 0.00 0.00 17.79 17.94 3jvv h ALA 49 CO -0.03 -0.74 0.25 -0.07 0.00 0.00 0.00 179.25 178.67 3jvv h LEU 50 N -0.40 0.04 0.07 0.00 3.38 -0.50 0.49 115.31 118.39 3jvv h LEU 50 Ca 0.01 0.19 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 3jvv h LEU 50 Cb 0.39 0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.39 3jvv h LEU 50 CO -0.07 -0.13 -0.03 0.40 0.09 0.00 0.00 178.44 178.69 3jvv h ILE 51 N 0.23 1.22 -0.93 1.22 2.04 -0.84 -3.19 117.51 117.26 3jvv h ILE 51 Ca 0.55 -1.42 0.14 0.00 1.00 0.00 0.00 64.86 65.13 3jvv h ILE 51 Cb 1.09 2.08 -0.09 0.00 -0.74 0.00 0.00 36.82 39.16 3jvv h ILE 51 CO -0.63 0.33 0.55 0.22 0.00 0.00 0.00 178.15 178.61 3jvv h TYR 52 N -0.78 0.97 -0.60 1.37 5.03 0.86 -1.12 116.97 122.70 3jvv h TYR 52 Ca -0.01 0.03 -0.00 0.00 2.58 0.00 0.00 58.73 61.33 3jvv h TYR 52 Cb 0.61 -0.29 -0.03 0.00 1.55 0.00 0.00 36.73 38.57 3jvv h TYR 52 CO 0.13 0.31 0.37 -0.44 -1.32 0.00 0.00 178.16 177.21 3jvv h ASP 53 N 0.80 0.72 -0.40 -2.11 3.32 -0.13 -2.80 116.42 115.83 3jvv h ASP 53 Ca 0.49 -0.05 -0.11 0.00 0.02 0.00 0.00 57.03 57.38 3jvv h ASP 53 Cb 0.61 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 3jvv h ASP 53 CO -0.32 0.56 -0.19 0.40 -1.72 0.00 0.00 179.24 177.98 3jvv h ILE 54 N 0.82 1.28 -3.79 0.35 2.04 -1.24 -3.46 117.51 113.51 3jvv h ILE 54 Ca 0.22 -1.32 -0.57 0.00 1.00 0.00 0.00 64.86 64.19 3jvv h ILE 54 Cb -0.03 1.29 0.16 0.00 -0.74 0.00 0.00 36.82 37.49 3jvv h ILE 54 CO -0.04 0.44 0.30 0.23 0.00 0.00 0.00 178.15 179.08 3jvv n MET 55 N -4.25 1.03 -2.40 2.37 2.81 -0.55 -5.02 117.12 111.11 3jvv n MET 55 Ca -0.02 0.40 -0.24 0.00 -1.81 0.00 0.00 57.70 56.03 3jvv n MET 55 Cb 0.42 -2.33 0.08 0.00 -0.71 0.00 0.00 33.22 30.69 3jvv n MET 55 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3jvv s ASN 56 N -1.27 4.63 0.25 7.83 2.20 -1.26 -4.84 114.94 122.49 3jvv s ASN 56 Ca 0.78 0.07 -0.05 0.00 -0.94 0.00 0.00 52.86 52.72 3jvv s ASN 56 Cb -0.40 -0.64 0.29 0.00 -2.00 0.00 0.00 41.25 38.49 3jvv s ASN 56 CO 0.45 -1.67 1.87 0.44 -2.94 0.00 0.00 177.10 175.25 3jvv h ASP 57 N -0.50 1.04 -0.03 3.54 3.32 -1.96 0.31 116.42 122.14 3jvv h ASP 57 Ca -0.41 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 56.54 3jvv h ASP 57 Cb 1.29 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.57 3jvv h ASP 57 CO 0.50 0.84 0.01 0.50 -1.72 0.00 0.00 179.24 179.38 3jvv h LYS 58 N 1.16 0.04 -0.66 3.56 3.64 -1.99 -0.04 116.57 122.29 3jvv h LYS 58 Ca 0.29 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.74 3jvv h LYS 58 Cb 0.05 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.80 3jvv h LYS 58 CO -0.04 0.16 0.34 1.96 -2.27 0.00 0.00 179.45 179.59 3jvv h GLN 59 N -0.08 0.59 -0.59 1.90 4.20 -1.70 0.52 115.11 119.95 3jvv h GLN 59 Ca 0.01 -0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.74 3jvv h GLN 59 Cb 0.13 -0.13 -0.05 0.00 0.30 0.00 0.00 27.48 27.73 3jvv h GLN 59 CO -0.00 0.39 0.31 0.00 -0.67 0.00 0.00 178.83 178.86 3jvv h ARG 60 N 0.60 0.57 0.03 1.46 3.08 -0.21 0.21 114.38 120.12 3jvv h ARG 60 Ca 0.31 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 60.33 3jvv h ARG 60 Cb 0.27 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.19 3jvv h ARG 60 CO -0.23 0.38 -0.01 0.87 -1.07 0.00 0.00 179.97 179.91 3jvv h LYS 61 N 0.58 -0.04 -0.34 0.04 1.57 0.11 0.34 116.57 118.83 3jvv h LYS 61 Ca 0.26 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 59.12 3jvv h LYS 61 Cb 0.17 0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.40 3jvv h LYS 61 CO -0.17 0.27 -0.32 -0.44 -0.57 0.00 0.00 179.45 178.22 3jvv h ASP 62 N -0.35 -1.04 -0.24 0.86 3.32 0.12 0.89 116.42 119.99 3jvv h ASP 62 Ca -0.00 0.18 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 3jvv h ASP 62 Cb 0.33 0.48 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 3jvv h ASP 62 CO 0.01 -0.32 0.14 0.15 -1.72 0.00 0.00 179.24 177.49 3jvv h PHE 63 N -0.27 0.32 -0.69 4.55 3.04 -0.34 0.28 116.94 123.81 3jvv h PHE 63 Ca 0.16 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 62.06 3jvv h PHE 63 Cb 0.53 -0.10 -0.03 0.00 2.56 0.00 0.00 35.95 38.91 3jvv h PHE 63 CO -0.50 0.25 0.27 1.49 -2.02 0.00 0.00 178.31 177.80 3jvv h GLU 64 N 0.29 1.04 0.10 1.11 4.81 0.09 0.24 114.58 122.26 3jvv h GLU 64 Ca 0.08 -0.19 -0.35 0.00 -0.13 0.00 0.00 59.36 58.78 3jvv h GLU 64 Cb 0.03 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 3jvv h GLU 64 CO -0.02 0.86 -1.93 -0.85 -0.73 0.00 0.00 179.01 176.35 3jvv n GLU 65 N -4.37 0.73 0.00 1.92 0.28 0.27 -4.11 120.64 115.36 3jvv n GLU 65 Ca 0.05 0.27 0.13 0.00 -0.16 0.00 0.00 57.16 57.45 3jvv n GLU 65 Cb 0.18 -1.73 0.39 0.00 1.43 0.00 0.00 31.44 31.71 3jvv n GLU 65 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 3jvv n PHE 66 N -3.39 0.00 -0.32 -1.84 3.72 0.96 -4.95 117.46 111.64 3jvv n PHE 66 Ca -0.28 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.12 3jvv n PHE 66 Cb 1.05 -0.32 0.00 0.00 -0.94 0.00 0.00 39.48 39.26 3jvv n PHE 66 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3jvv n LEU 67 N -1.45 0.06 -3.52 4.37 4.77 0.84 -4.93 117.00 117.14 3jvv n LEU 67 Ca 0.07 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.91 3jvv n LEU 67 Cb 0.33 -0.14 -0.04 0.00 -2.33 0.00 0.00 43.42 41.24 3jvv n LEU 67 CO 0.32 -0.03 0.58 -1.83 -1.33 0.00 0.00 177.39 175.10 3jvv s GLU 68 N -0.06 0.91 0.21 3.23 -1.05 -1.21 -3.67 118.70 117.05 3jvv s GLU 68 Ca 0.00 0.03 -0.23 0.00 -0.15 0.00 0.00 54.97 54.61 3jvv s GLU 68 Cb 0.00 0.42 0.04 0.00 -0.44 0.00 0.00 34.13 34.16 3jvv s GLU 68 CO 0.00 -0.32 0.85 -0.08 0.95 0.00 0.00 175.26 176.66 3jvv s THR 69 N -1.85 0.00 0.03 1.83 -1.32 -0.03 -4.50 115.64 109.79 3jvv s THR 69 Ca -0.04 -0.80 0.06 0.00 -1.21 0.00 0.00 61.69 59.71 3jvv s THR 69 Cb -0.00 -1.98 -0.02 0.00 -1.51 0.00 0.00 72.50 68.99 3jvv s THR 69 CO 0.01 0.00 -0.19 -1.81 -2.21 0.00 0.00 174.62 170.42 3jvv s ASP 70 N -2.93 2.21 0.19 8.08 1.11 -1.26 -0.44 116.67 123.63 3jvv s ASP 70 Ca 0.12 -0.47 -0.23 0.00 0.18 0.00 0.00 52.55 52.14 3jvv s ASP 70 Cb -0.03 -0.19 0.05 0.00 1.07 0.00 0.00 42.92 43.82 3jvv s ASP 70 CO 0.04 0.14 0.80 0.72 1.18 0.00 0.00 175.17 178.05 3jvv s PHE 71 N -0.74 -0.24 0.10 4.23 -0.12 -0.25 -5.02 117.98 115.94 3jvv s PHE 71 Ca 0.06 -0.09 -0.00 0.00 -0.05 0.00 0.00 56.93 56.84 3jvv s PHE 71 Cb -0.08 0.65 -0.04 0.00 -0.63 0.00 0.00 43.02 42.91 3jvv s PHE 71 CO 0.01 -0.97 0.27 -1.54 -0.05 0.00 0.00 175.22 172.94 3jvv s SER 72 N -2.85 6.38 -0.01 1.98 1.04 -1.26 -0.29 113.70 118.68 3jvv s SER 72 Ca 0.09 0.30 -0.03 0.00 0.48 0.00 0.00 55.95 56.79 3jvv s SER 72 Cb -0.03 -1.97 0.00 0.00 0.10 0.00 0.00 66.02 64.12 3jvv s SER 72 CO 0.01 0.11 0.07 0.12 0.98 0.00 0.00 173.24 174.52 3jvv s PHE 73 N -1.62 0.00 -0.04 5.02 5.36 -0.66 -4.92 117.98 121.12 3jvv s PHE 73 Ca 0.36 0.00 0.05 0.00 -0.96 0.00 0.00 56.93 56.38 3jvv s PHE 73 Cb -0.12 -0.03 -0.01 0.00 -0.34 0.00 0.00 43.02 42.52 3jvv s PHE 73 CO 0.28 -0.12 -0.19 -2.00 -1.46 0.00 0.00 175.22 171.73 3jvv s GLU 74 N -0.52 1.84 -0.45 10.12 2.12 -1.26 -0.04 118.70 130.51 3jvv s GLU 74 Ca -0.06 -0.67 -0.04 0.00 0.36 0.00 0.00 54.97 54.56 3jvv s GLU 74 Cb -0.04 -1.63 0.12 0.00 0.26 0.00 0.00 34.13 32.84 3jvv s GLU 74 CO 0.00 0.31 0.26 0.08 -0.54 0.00 0.00 175.26 175.37 3jvv s VAL 75 N -0.11 3.55 0.01 3.70 1.01 -0.09 -5.01 120.40 123.44 3jvv s VAL 75 Ca -0.01 -2.10 -0.38 0.00 0.00 0.00 0.00 61.98 59.48 3jvv s VAL 75 Cb -0.11 -3.40 -0.18 0.00 0.00 0.00 0.00 36.38 32.70 3jvv s VAL 75 CO 0.02 -0.73 1.29 -2.65 0.00 0.00 0.00 175.10 173.03 3jvv n PRO 76 N 4.54 0.73 -0.45 2.72 -0.02 -1.26 -0.42 135.00 140.84 3jvv n PRO 76 Ca -0.02 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 3jvv n PRO 76 Cb 0.41 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 3jvv n PRO 76 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3jvv n GLY 77 N 2.38 1.96 0.83 -1.23 0.00 -1.26 -4.83 105.19 103.05 3jvv n GLY 77 Ca 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.22 3jvv n GLY 77 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3jvv n VAL 78 N -2.00 0.17 -3.75 1.61 0.31 0.44 -5.15 118.33 109.96 3jvv n VAL 78 Ca 0.00 0.12 -0.01 0.00 -0.01 0.00 0.00 64.34 64.45 3jvv n VAL 78 Cb 0.00 -1.17 -0.00 0.00 -0.91 0.00 0.00 33.84 31.76 3jvv n VAL 78 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3jvv s ALA 79 N -2.17 -1.99 0.17 3.52 0.00 -1.04 -5.03 121.76 115.21 3jvv s ALA 79 Ca -0.01 0.28 0.06 0.00 0.00 0.00 0.00 51.96 52.29 3jvv s ALA 79 Cb 0.00 0.57 -0.04 0.00 0.00 0.00 0.00 23.12 23.65 3jvv s ALA 79 CO 0.01 -1.07 0.09 1.03 0.00 0.00 0.00 175.76 175.82 3jvv s ARG 80 N -2.59 2.72 0.02 0.00 0.52 -1.26 -0.92 118.95 117.45 3jvv s ARG 80 Ca 0.17 -0.96 0.03 0.00 -0.52 0.00 0.00 55.73 54.44 3jvv s ARG 80 Cb 0.01 -2.54 -0.02 0.00 0.52 0.00 0.00 34.95 32.93 3jvv s ARG 80 CO -0.00 0.47 -0.09 -0.06 0.02 0.00 0.00 175.30 175.64 3jvv s PHE 81 N -1.76 0.76 -0.44 -0.53 0.08 0.94 -0.99 117.98 116.04 3jvv s PHE 81 Ca 0.30 -0.30 -0.22 0.00 0.12 0.00 0.00 56.93 56.82 3jvv s PHE 81 Cb -0.10 -0.46 0.02 0.00 -0.57 0.00 0.00 43.02 41.91 3jvv s PHE 81 CO 0.22 -0.02 0.75 1.03 -0.10 0.00 0.00 175.22 177.09 3jvv s ARG 82 N -0.89 3.40 -0.15 0.44 0.52 0.76 -1.66 118.95 121.37 3jvv s ARG 82 Ca -0.02 -0.14 -0.05 0.00 -0.52 0.00 0.00 55.73 54.99 3jvv s ARG 82 Cb -0.06 -3.93 -0.04 0.00 0.52 0.00 0.00 34.95 31.44 3jvv s ARG 82 CO 0.00 -1.07 0.03 0.08 0.02 0.00 0.00 175.30 174.37 3jvv s VAL 83 N 3.15 4.54 -0.05 3.52 1.01 0.60 -0.71 120.40 132.46 3jvv s VAL 83 Ca 0.28 -0.13 0.05 0.00 0.00 0.00 0.00 61.98 62.18 3jvv s VAL 83 Cb -0.13 -3.00 -0.01 0.00 0.00 0.00 0.00 36.38 33.25 3jvv s VAL 83 CO 0.21 0.51 -0.21 0.21 0.00 0.00 0.00 175.10 175.82 3jvv s ASN 84 N 0.03 2.56 -0.02 3.32 3.84 -0.01 -1.09 114.94 123.55 3jvv s ASN 84 Ca 0.04 -0.42 0.06 0.00 0.21 0.00 0.00 52.86 52.75 3jvv s ASN 84 Cb -0.13 -0.72 -0.01 0.00 -0.55 0.00 0.00 41.25 39.84 3jvv s ASN 84 CO 0.01 0.19 -0.21 0.00 -2.79 0.00 0.00 177.10 174.30 3jvv s ALA 85 N -0.03 1.80 0.35 1.71 0.00 0.42 -0.89 121.76 125.10 3jvv s ALA 85 Ca -0.04 -0.91 -0.17 0.00 0.00 0.00 0.00 51.96 50.84 3jvv s ALA 85 Cb -0.13 -0.49 0.06 0.00 0.00 0.00 0.00 23.12 22.57 3jvv s ALA 85 CO 0.03 0.41 0.86 -0.59 0.00 0.00 0.00 175.76 176.47 3jvv s PHE 86 N -0.39 0.13 0.11 0.00 -0.71 0.29 -0.85 117.98 116.56 3jvv s PHE 86 Ca 0.05 -0.77 0.09 0.00 -1.04 0.00 0.00 56.93 55.26 3jvv s PHE 86 Cb -0.09 0.82 -0.04 0.00 -1.21 0.00 0.00 43.02 42.50 3jvv s PHE 86 CO 0.00 -1.45 -0.22 -0.80 -1.34 0.00 0.00 175.22 171.41 3jvv s ASN 87 N -3.17 2.69 0.23 1.98 0.01 -1.24 0.19 114.94 115.62 3jvv s ASN 87 Ca 0.17 -0.70 -0.12 0.00 -0.71 0.00 0.00 52.86 51.51 3jvv s ASN 87 Cb -0.05 -0.15 -0.00 0.00 0.41 0.00 0.00 41.25 41.46 3jvv s ASN 87 CO 0.10 0.08 0.43 0.00 -1.51 0.00 0.00 177.10 176.21 3jvv s GLN 88 N -1.94 1.46 0.47 -0.60 1.03 0.11 -4.90 119.66 115.28 3jvv s GLN 88 Ca 0.08 -1.23 0.34 0.00 0.04 0.00 0.00 55.36 54.58 3jvv s GLN 88 Cb -0.10 0.45 1.47 0.00 0.03 0.00 0.00 33.01 34.86 3jvv s GLN 88 CO 0.05 -0.59 1.64 -0.97 -2.54 0.00 0.00 175.29 172.88 3jvv h ASN 89 N 2.31 0.19 0.37 12.60 -1.24 -1.98 0.69 115.58 128.53 3jvv h ASN 89 Ca -0.28 0.10 0.00 0.00 0.71 0.00 0.00 56.30 56.83 3jvv h ASN 89 Cb 1.25 0.08 0.00 0.00 0.73 0.00 0.00 38.32 40.38 3jvv h ASN 89 CO 0.38 -0.11 -0.93 0.54 -1.29 0.00 0.00 177.43 176.03 3jvv n ARG 90 N -4.50 0.19 0.00 6.67 1.74 -1.26 -5.07 116.66 114.42 3jvv n ARG 90 Ca 0.37 -0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 3jvv n ARG 90 Cb 1.48 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 31.36 3jvv n ARG 90 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3jvv n GLY 91 N 1.42 0.40 3.62 -0.13 0.00 0.24 -4.65 105.19 106.08 3jvv n GLY 91 Ca 0.03 -1.35 -0.30 0.00 0.00 0.00 0.00 46.02 44.40 3jvv n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jvv s ALA 92 N -1.00 0.77 0.19 4.61 0.00 -1.26 0.04 121.76 125.11 3jvv s ALA 92 Ca 0.00 0.18 -0.20 0.00 0.00 0.00 0.00 51.96 51.94 3jvv s ALA 92 Cb 0.00 -3.32 0.04 0.00 0.00 0.00 0.00 23.12 19.85 3jvv s ALA 92 CO 0.00 -3.07 0.57 0.20 0.00 0.00 0.00 175.76 173.46 3jvv s GLY 93 N -2.79 -0.31 0.07 0.00 0.00 0.13 -1.78 107.32 102.65 3jvv s GLY 93 Ca 0.67 0.05 -0.24 0.00 0.00 0.00 0.00 44.72 45.20 3jvv s GLY 93 CO 0.60 -0.08 0.57 0.00 0.00 0.00 0.00 173.10 174.18 3jvv s ALA 94 N -3.83 -1.47 -0.06 3.20 0.00 -0.10 -0.55 121.76 118.95 3jvv s ALA 94 Ca 0.06 0.65 -0.01 0.00 0.00 0.00 0.00 51.96 52.65 3jvv s ALA 94 Cb -0.01 0.50 0.03 0.00 0.00 0.00 0.00 23.12 23.63 3jvv s ALA 94 CO -0.06 -0.58 0.02 0.08 0.00 0.00 0.00 175.76 175.22 3jvv s VAL 95 N -2.74 0.25 -0.32 0.00 1.01 -0.07 0.25 120.40 118.78 3jvv s VAL 95 Ca -0.04 0.19 -0.05 0.00 0.00 0.00 0.00 61.98 62.08 3jvv s VAL 95 Cb -0.00 -0.42 0.03 0.00 0.00 0.00 0.00 36.38 35.99 3jvv s VAL 95 CO -0.04 0.23 0.07 -0.36 0.00 0.00 0.00 175.10 175.00 3jvv s PHE 96 N 1.93 3.22 -0.27 5.22 0.40 0.00 -0.83 117.98 127.65 3jvv s PHE 96 Ca 0.04 -1.43 -0.10 0.00 -0.60 0.00 0.00 56.93 54.84 3jvv s PHE 96 Cb -0.12 -2.23 -0.05 0.00 0.51 0.00 0.00 43.02 41.13 3jvv s PHE 96 CO -0.04 -0.71 0.16 1.03 0.70 0.00 0.00 175.22 176.35 3jvv s ARG 97 N 1.39 3.89 0.69 0.44 0.52 0.11 -1.23 118.95 124.76 3jvv s ARG 97 Ca -0.01 -0.35 -0.15 0.00 -0.52 0.00 0.00 55.73 54.69 3jvv s ARG 97 Cb -0.19 -3.58 0.02 0.00 0.52 0.00 0.00 34.95 31.72 3jvv s ARG 97 CO 0.02 -0.17 1.15 -0.08 0.02 0.00 0.00 175.30 176.24 3jvv s THR 98 N 1.68 2.82 -0.18 0.02 -1.32 0.04 -0.17 115.64 118.53 3jvv s THR 98 Ca 0.07 0.40 -0.05 0.00 -1.21 0.00 0.00 61.69 60.89 3jvv s THR 98 Cb -0.16 -2.93 -0.03 0.00 -1.51 0.00 0.00 72.50 67.87 3jvv s THR 98 CO 0.09 -0.22 0.01 -0.63 -2.21 0.00 0.00 174.62 171.65 3jvv s ILE 99 N -2.17 4.18 -0.23 5.08 1.01 -0.16 -4.78 121.20 124.14 3jvv s ILE 99 Ca 0.70 -0.25 -0.29 0.00 0.00 0.00 0.00 60.65 60.82 3jvv s ILE 99 Cb -0.24 -2.87 -0.03 0.00 0.01 0.00 0.00 42.46 39.32 3jvv s ILE 99 CO 0.43 0.46 1.76 -2.16 0.00 0.00 0.00 174.94 175.43 3jvv s PRO 100 N 0.60 3.63 -0.14 2.79 0.04 -1.26 -4.60 135.00 136.06 3jvv s PRO 100 Ca -0.00 1.73 -0.12 0.00 0.04 0.00 0.00 61.00 62.65 3jvv s PRO 100 Cb -0.14 -4.13 -0.10 0.00 0.04 0.00 0.00 34.50 30.18 3jvv s PRO 100 CO 0.02 -1.50 0.15 0.66 0.04 0.00 0.00 177.00 176.37 3jvv h SER 101 N 11.77 0.00 -2.85 6.66 4.64 -1.96 -3.36 113.55 128.44 3jvv h SER 101 Ca -0.36 -0.30 -0.53 0.00 -0.47 0.00 0.00 61.79 60.13 3jvv h SER 101 Cb 1.17 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.28 3jvv h SER 101 CO 1.00 0.84 0.86 -0.75 -0.87 0.00 0.00 176.83 177.91 3jvv s LYS 102 N -2.01 4.26 0.21 4.77 2.20 -1.26 -4.15 119.74 123.76 3jvv s LYS 102 Ca -0.13 2.15 -0.30 0.00 -0.36 0.00 0.00 55.97 57.33 3jvv s LYS 102 Cb 0.01 -3.46 -0.08 0.00 -1.51 0.00 0.00 37.83 32.79 3jvv s LYS 102 CO 0.30 -0.59 1.20 0.08 -0.36 0.00 0.00 175.35 175.98 3jvv s VAL 103 N 2.03 3.47 0.06 4.02 1.01 -1.26 -5.04 120.40 124.68 3jvv s VAL 103 Ca 0.68 1.28 0.04 0.00 0.00 0.00 0.00 61.98 63.98 3jvv s VAL 103 Cb -0.37 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 3jvv s VAL 103 CO 0.30 0.22 -0.02 -0.76 0.00 0.00 0.00 175.10 174.84 3jvv s LEU 104 N -0.50 3.37 0.47 3.92 1.43 -1.26 -5.09 118.68 121.02 3jvv s LEU 104 Ca 0.52 -0.16 -0.05 0.00 -1.03 0.00 0.00 54.13 53.41 3jvv s LEU 104 Cb -0.33 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.80 3jvv s LEU 104 CO 0.38 0.22 0.76 0.42 0.23 0.00 0.00 176.35 178.36 3jvv s THR 105 N -1.20 4.93 0.26 5.49 -4.23 -1.26 -4.03 115.64 115.60 3jvv s THR 105 Ca 0.22 0.14 -0.03 0.00 -1.18 0.00 0.00 61.69 60.84 3jvv s THR 105 Cb -0.11 -3.86 0.26 0.00 1.34 0.00 0.00 72.50 70.12 3jvv s THR 105 CO 0.14 -0.82 1.67 0.24 -0.54 0.00 0.00 174.62 175.31 3jvv h MET 106 N 0.28 0.25 -0.20 3.99 2.86 -1.89 -0.16 114.93 120.06 3jvv h MET 106 Ca -0.47 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.15 3jvv h MET 106 Cb 1.21 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.80 3jvv h MET 106 CO 0.62 0.16 0.10 1.49 1.06 0.00 0.00 176.91 180.34 3jvv h GLU 107 N 0.25 0.29 -0.38 1.72 4.81 -1.93 0.26 114.58 119.59 3jvv h GLU 107 Ca 0.46 -0.04 0.09 0.00 -0.13 0.00 0.00 59.36 59.73 3jvv h GLU 107 Cb 0.83 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 3jvv h GLU 107 CO -0.56 0.30 0.27 0.93 -0.73 0.00 0.00 179.01 179.22 3jvv h GLU 108 N 0.20 0.13 -0.14 1.92 5.08 -1.55 0.11 114.58 120.33 3jvv h GLU 108 Ca 0.07 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3jvv h GLU 108 Cb 0.11 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.33 3jvv h GLU 108 CO -0.01 0.09 0.00 1.28 -1.00 0.00 0.00 179.01 179.37 3jvv n LEU 109 N -4.46 2.25 -2.98 1.33 4.77 -0.21 -4.94 117.00 112.77 3jvv n LEU 109 Ca 0.06 -0.86 -0.21 0.00 -0.03 0.00 0.00 56.01 54.96 3jvv n LEU 109 Cb 0.36 -0.08 0.04 0.00 -2.33 0.00 0.00 43.42 41.42 3jvv n LEU 109 CO 0.35 0.43 0.05 0.61 -1.33 0.00 0.00 177.39 177.50 3jvv n GLY 110 N 1.26 -0.45 3.67 -0.72 0.00 0.38 -4.95 105.19 104.38 3jvv n GLY 110 Ca 0.17 0.11 -0.39 0.00 0.00 0.00 0.00 46.02 45.91 3jvv n GLY 110 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3jvv s MET 111 N -5.78 4.18 0.77 1.61 -1.94 0.71 -5.01 119.30 113.85 3jvv s MET 111 Ca 0.35 0.32 -0.06 0.00 -1.71 0.00 0.00 55.69 54.60 3jvv s MET 111 Cb -0.15 -3.55 0.13 0.00 2.01 0.00 0.00 34.83 33.27 3jvv s MET 111 CO 0.43 -0.10 1.07 0.20 -0.01 0.00 0.00 175.02 176.62 3jvv s GLY 112 N 1.11 1.76 0.51 -0.03 0.00 -1.26 -4.49 107.32 104.91 3jvv s GLY 112 Ca 0.22 -1.43 0.40 0.00 0.00 0.00 0.00 44.72 43.91 3jvv s GLY 112 CO 0.09 -0.85 1.63 0.83 0.00 0.00 0.00 173.10 174.80 3jvv h GLU 113 N -0.81 0.03 -0.96 2.90 4.39 -2.00 0.83 114.58 118.96 3jvv h GLU 113 Ca -0.40 -0.00 0.14 0.00 0.34 0.00 0.00 59.36 59.44 3jvv h GLU 113 Cb 1.27 -0.01 -0.09 0.00 -0.10 0.00 0.00 28.75 29.82 3jvv h GLU 113 CO 0.44 0.02 0.58 -0.24 -1.16 0.00 0.00 179.01 178.65 3jvv h VAL 114 N 0.04 0.83 -0.28 3.13 3.04 -1.94 0.29 116.25 121.36 3jvv h VAL 114 Ca 0.84 -0.29 -0.06 0.00 -1.01 0.00 0.00 66.70 66.18 3jvv h VAL 114 Cb 3.07 -0.10 -0.02 0.00 -2.01 0.00 0.00 31.29 32.23 3jvv h VAL 114 CO -0.18 0.16 -0.07 -0.26 -1.01 0.00 0.00 177.57 176.20 3jvv h PHE 115 N 0.85 0.47 -0.07 3.17 -1.00 -1.18 0.28 116.94 119.46 3jvv h PHE 115 Ca 0.51 -0.05 -0.02 0.00 2.81 0.00 0.00 57.97 61.21 3jvv h PHE 115 Cb 0.62 -0.13 -0.00 0.00 3.61 0.00 0.00 35.95 40.04 3jvv h PHE 115 CO -0.02 0.51 -0.03 0.87 -1.61 0.00 0.00 178.31 178.03 3jvv h LYS 116 N 0.42 0.14 -0.70 1.51 1.57 -0.64 0.21 116.57 119.08 3jvv h LYS 116 Ca 0.09 -0.06 0.11 0.00 -1.87 0.00 0.00 60.65 58.92 3jvv h LYS 116 Cb 0.39 -0.01 -0.08 0.00 0.08 0.00 0.00 32.23 32.61 3jvv h LYS 116 CO 0.02 0.50 0.30 0.00 -0.57 0.00 0.00 179.45 179.70 3jvv h ARG 117 N -0.23 0.47 -0.14 3.15 3.08 -0.52 0.56 114.38 120.75 3jvv h ARG 117 Ca 0.02 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 3jvv h ARG 117 Cb 0.46 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 3jvv h ARG 117 CO 0.01 0.31 0.05 0.28 -1.07 0.00 0.00 179.97 179.55 3jvv h VAL 118 N 0.49 1.18 -0.47 2.04 2.07 -0.74 -2.39 116.25 118.43 3jvv h VAL 118 Ca 0.36 -0.55 0.08 0.00 0.82 0.00 0.00 66.70 67.41 3jvv h VAL 118 Cb 0.47 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 3jvv h VAL 118 CO -0.33 0.17 0.32 0.28 0.02 0.00 0.00 177.57 178.02 3jvv h SER 119 N 0.05 0.26 1.38 0.57 0.02 0.54 -3.08 113.55 113.30 3jvv h SER 119 Ca 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3jvv h SER 119 Cb 0.22 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.70 3jvv h SER 119 CO -0.00 0.17 0.00 0.44 -1.14 0.00 0.00 176.83 176.30 3jvv h ASP 120 N 0.30 0.00 -2.72 3.07 3.32 0.61 -3.46 116.42 117.54 3jvv h ASP 120 Ca 0.21 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.67 3jvv h ASP 120 Cb 0.45 0.00 0.14 0.00 0.22 0.00 0.00 39.33 40.14 3jvv h ASP 120 CO -0.05 0.00 -0.11 1.33 -1.72 0.00 0.00 179.24 178.70 3jvv n VAL 121 N -3.05 2.21 0.49 -1.35 0.24 -1.17 -4.86 118.33 110.84 3jvv n VAL 121 Ca 0.02 -0.50 0.13 0.00 -2.04 0.00 0.00 64.34 61.95 3jvv n VAL 121 Cb 0.39 -0.85 0.40 0.00 -1.47 0.00 0.00 33.84 32.31 3jvv n VAL 121 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 3jvv h PRO 122 N 1.13 0.00 -1.86 7.34 0.13 -1.94 -3.48 132.00 133.33 3jvv h PRO 122 Ca -0.42 0.00 0.24 0.00 -0.87 0.00 0.00 66.00 64.95 3jvv h PRO 122 Cb 1.37 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.38 3jvv h PRO 122 CO 0.54 0.00 0.67 -0.98 -0.23 0.00 0.00 178.00 178.00 3jvv s ARG 123 N -3.20 0.72 0.00 0.86 1.70 -1.26 -4.41 118.95 113.36 3jvv s ARG 123 Ca 0.08 -0.37 0.00 0.00 -0.47 0.00 0.00 55.73 54.97 3jvv s ARG 123 Cb 0.10 0.26 0.00 0.00 -0.57 0.00 0.00 34.95 34.74 3jvv s ARG 123 CO 0.57 -0.33 0.00 0.41 -1.08 0.00 0.00 175.30 174.87 3jvv n GLY 124 N -0.40 0.14 3.21 3.88 0.00 -0.28 -4.86 105.19 106.89 3jvv n GLY 124 Ca -0.07 -2.25 -0.31 0.00 0.00 0.00 0.00 46.02 43.39 3jvv n GLY 124 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3jvv s LEU 125 N 0.00 2.03 -0.08 0.99 2.96 -0.16 -0.50 118.68 123.93 3jvv s LEU 125 Ca 0.00 -0.51 0.03 0.00 -0.22 0.00 0.00 54.13 53.43 3jvv s LEU 125 Cb 0.00 -1.32 0.01 0.00 0.50 0.00 0.00 46.19 45.38 3jvv s LEU 125 CO 0.00 0.18 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.36 3jvv s VAL 126 N 0.18 1.44 -0.14 1.68 1.01 -0.11 -0.18 120.40 124.27 3jvv s VAL 126 Ca -0.12 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.21 3jvv s VAL 126 Cb -0.16 -1.29 -0.00 0.00 0.00 0.00 0.00 36.38 34.93 3jvv s VAL 126 CO 0.06 0.42 -0.17 -0.76 0.00 0.00 0.00 175.10 174.66 3jvv s LEU 127 N 0.59 2.43 -0.20 3.92 1.43 -0.66 -1.11 118.68 125.07 3jvv s LEU 127 Ca -0.15 -0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 52.43 3jvv s LEU 127 Cb -0.16 -1.54 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 3jvv s LEU 127 CO 0.05 0.11 -0.03 -0.69 0.23 0.00 0.00 176.35 176.01 3jvv s VAL 128 N 0.69 3.59 0.25 -1.59 1.01 -0.40 -0.12 120.40 123.83 3jvv s VAL 128 Ca -0.08 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.49 3jvv s VAL 128 Cb -0.16 -2.62 -0.05 0.00 0.00 0.00 0.00 36.38 33.55 3jvv s VAL 128 CO 0.02 0.43 0.06 0.42 0.00 0.00 0.00 175.10 176.03 3jvv s THR 129 N 1.18 0.74 0.00 3.92 -4.23 0.12 -3.45 115.64 113.93 3jvv s THR 129 Ca 0.02 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.53 3jvv s THR 129 Cb -0.14 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.14 3jvv s THR 129 CO -0.00 -0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.58 3jvv n GLY 130 N -0.46 3.71 3.24 3.99 0.00 -0.24 -0.01 105.19 115.42 3jvv n GLY 130 Ca -0.02 -1.34 -0.28 0.00 0.00 0.00 0.00 46.02 44.38 3jvv n GLY 130 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3jvv n PRO 131 N -1.65 -3.93 -1.69 1.61 -0.04 -1.26 -4.32 135.00 123.72 3jvv n PRO 131 Ca 0.00 -1.16 -0.39 0.00 -0.04 0.00 0.00 63.50 61.91 3jvv n PRO 131 Cb 0.00 -1.89 0.04 0.00 -0.04 0.00 0.00 33.50 31.61 3jvv n PRO 131 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3jvv n THR 132 N -5.42 3.53 0.00 0.52 -2.24 -1.26 -2.57 114.28 106.83 3jvv n THR 132 Ca 0.10 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 3jvv n THR 132 Cb 0.55 -1.46 0.00 0.00 -2.10 0.00 0.00 70.33 67.32 3jvv n THR 132 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jvv n GLY 133 N 0.95 1.17 0.09 3.38 0.00 -1.26 -4.85 105.19 104.66 3jvv n GLY 133 Ca 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3jvv n GLY 133 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3jvv n SER 134 N 1.94 0.00 0.00 1.61 3.41 -1.06 -4.63 113.62 114.88 3jvv n SER 134 Ca 0.00 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 3jvv n SER 134 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3jvv n SER 134 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3jvv n GLY 135 N -0.92 1.74 0.24 5.00 0.00 -1.26 -3.97 105.19 106.02 3jvv n GLY 135 Ca 0.00 -0.12 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 3jvv n GLY 135 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3jvv h LYS 136 N 0.00 -0.51 -0.81 1.61 1.57 -1.91 -2.27 116.57 114.24 3jvv h LYS 136 Ca 0.00 0.03 0.18 0.00 -1.87 0.00 0.00 60.65 59.00 3jvv h LYS 136 Cb 0.13 0.12 -0.12 0.00 0.08 0.00 0.00 32.23 32.44 3jvv h LYS 136 CO 0.00 -0.21 0.28 0.77 -0.57 0.00 0.00 179.45 179.72 3jvv h SER 137 N -0.98 0.17 0.27 0.86 0.02 -1.95 0.94 113.55 112.88 3jvv h SER 137 Ca -0.05 0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 3jvv h SER 137 Cb 0.54 0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.25 3jvv h SER 137 CO 0.09 -0.01 -0.13 0.74 -1.14 0.00 0.00 176.83 176.38 3jvv h THR 138 N 0.34 0.74 -0.72 -2.27 2.02 -1.98 0.41 112.91 111.46 3jvv h THR 138 Ca 0.48 -0.02 0.07 0.00 0.77 0.00 0.00 66.41 67.71 3jvv h THR 138 Cb 0.85 0.75 -0.06 0.00 -1.74 0.00 0.00 68.15 67.95 3jvv h THR 138 CO -0.51 0.00 0.40 0.74 0.37 0.00 0.00 175.52 176.52 3jvv h THR 139 N -0.38 0.94 -0.40 3.16 2.02 -0.57 -0.96 112.91 116.71 3jvv h THR 139 Ca -0.04 -0.24 0.01 0.00 0.77 0.00 0.00 66.41 66.91 3jvv h THR 139 Cb 0.29 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 3jvv h THR 139 CO 0.06 0.13 0.26 -0.07 0.37 0.00 0.00 175.52 176.27 3jvv h LEU 140 N 0.70 0.44 -0.83 2.58 3.38 -0.50 -1.86 115.31 119.23 3jvv h LEU 140 Ca 0.33 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.36 3jvv h LEU 140 Cb 0.25 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.84 3jvv h LEU 140 CO -0.21 0.32 0.51 0.00 0.09 0.00 0.00 178.44 179.15 3jvv h ALA 141 N 1.16 1.15 -0.50 1.53 0.00 0.85 0.24 119.26 123.69 3jvv h ALA 141 Ca 0.15 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3jvv h ALA 141 Cb -0.05 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3jvv h ALA 141 CO -0.04 0.23 0.22 0.00 0.00 0.00 0.00 179.25 179.66 3jvv h ALA 142 N 1.40 0.65 -0.54 0.00 0.00 -0.98 0.34 119.26 120.13 3jvv h ALA 142 Ca 0.37 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.16 3jvv h ALA 142 Cb 0.19 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3jvv h ALA 142 CO -0.18 0.24 0.33 0.52 0.00 0.00 0.00 179.25 180.16 3jvv h MET 143 N 0.67 0.64 -0.36 0.00 2.07 -0.43 0.39 114.93 117.90 3jvv h MET 143 Ca 0.17 -0.04 -0.13 0.00 -2.07 0.00 0.00 59.70 57.63 3jvv h MET 143 Cb 0.16 -0.14 -0.01 0.00 -1.87 0.00 0.00 31.60 29.74 3jvv h MET 143 CO -0.02 0.42 -0.30 -0.07 1.07 0.00 0.00 176.91 178.02 3jvv h LEU 144 N 0.66 0.81 -0.51 1.22 3.38 -0.02 -1.92 115.31 118.94 3jvv h LEU 144 Ca 0.22 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 3jvv h LEU 144 Cb 0.01 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 3jvv h LEU 144 CO -0.09 1.05 0.30 -0.78 0.09 0.00 0.00 178.44 179.01 3jvv h ASP 145 N 0.66 0.62 -0.37 -0.43 3.58 0.21 0.30 116.42 120.99 3jvv h ASP 145 Ca 0.08 -0.06 0.05 0.00 0.42 0.00 0.00 57.03 57.51 3jvv h ASP 145 Cb 0.83 -0.16 -0.05 0.00 1.72 0.00 0.00 39.33 41.68 3jvv h ASP 145 CO 0.07 0.50 0.10 0.22 -2.88 0.00 0.00 179.24 177.25 3jvv h TYR 146 N 0.68 0.17 -0.88 0.28 3.20 -0.70 0.61 116.97 120.34 3jvv h TYR 146 Ca 0.18 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.08 3jvv h TYR 146 Cb 0.00 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.21 3jvv h TYR 146 CO -0.02 0.05 0.56 -0.07 -1.64 0.00 0.00 178.16 177.03 3jvv h LEU 147 N 0.23 1.03 -1.22 2.82 3.38 -0.79 -1.63 115.31 119.14 3jvv h LEU 147 Ca 0.17 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 3jvv h LEU 147 Cb 0.18 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 3jvv h LEU 147 CO -0.21 0.77 0.35 -1.13 0.09 0.00 0.00 178.44 178.32 3jvv h ASN 148 N 1.20 0.79 1.01 -0.43 -1.24 0.64 0.64 115.58 118.18 3jvv h ASN 148 Ca 0.32 -0.06 -0.04 0.00 0.71 0.00 0.00 56.30 57.23 3jvv h ASN 148 Cb -0.10 -0.20 -0.01 0.00 0.73 0.00 0.00 38.32 38.75 3jvv h ASN 148 CO -0.06 0.64 -0.19 0.78 -1.29 0.00 0.00 177.43 177.30 3jvv h ASN 149 N 0.90 0.00 0.00 1.15 2.35 0.91 -0.58 115.58 120.31 3jvv h ASN 149 Ca 0.23 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.97 3jvv h ASN 149 Cb 0.02 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.39 3jvv h ASN 149 CO -0.04 0.19 -1.06 0.35 -1.65 0.00 0.00 177.43 175.22 3jvv n THR 150 N -3.32 0.05 -4.44 2.81 -2.24 -0.57 -4.78 114.28 101.79 3jvv n THR 150 Ca 0.00 -0.04 -0.29 0.00 -2.27 0.00 0.00 64.05 61.45 3jvv n THR 150 Cb 0.43 -0.64 -0.12 0.00 -2.10 0.00 0.00 70.33 67.90 3jvv n THR 150 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3jvv s LYS 151 N -2.04 1.68 -1.20 -0.78 1.02 0.11 -5.03 119.74 113.51 3jvv s LYS 151 Ca -0.00 -1.21 -0.06 0.00 0.02 0.00 0.00 55.97 54.71 3jvv s LYS 151 Cb 0.00 -2.03 0.22 0.00 -0.52 0.00 0.00 37.83 35.50 3jvv s LYS 151 CO 0.04 0.48 1.84 0.66 -0.92 0.00 0.00 175.35 177.45 3jvv n TYR 152 N 1.02 2.62 -4.69 3.18 4.02 -1.26 -2.86 117.16 119.19 3jvv n TYR 152 Ca -0.17 -2.69 -0.31 0.00 -0.01 0.00 0.00 57.90 54.72 3jvv n TYR 152 Cb 0.53 -1.62 -0.09 0.00 -0.02 0.00 0.00 39.34 38.14 3jvv n TYR 152 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 3jvv s HIS 153 N -1.45 2.01 -0.30 -0.72 3.76 -1.26 -4.94 115.29 112.38 3jvv s HIS 153 Ca 0.39 -0.93 -0.06 0.00 -0.15 0.00 0.00 55.06 54.31 3jvv s HIS 153 Cb 0.11 -1.59 0.01 0.00 1.11 0.00 0.00 32.58 32.22 3jvv s HIS 153 CO 0.01 0.22 0.08 -1.58 -0.85 0.00 0.00 174.74 172.61 3jvv s HIS 154 N -2.89 3.16 -0.32 1.40 2.46 -1.26 -0.74 115.29 117.10 3jvv s HIS 154 Ca 0.15 -1.08 -0.13 0.00 0.47 0.00 0.00 55.06 54.47 3jvv s HIS 154 Cb 0.04 -2.25 -0.03 0.00 -0.13 0.00 0.00 32.58 30.22 3jvv s HIS 154 CO 0.08 -0.61 0.25 0.42 -2.47 0.00 0.00 174.74 172.41 3jvv s ILE 155 N 1.47 5.27 -0.12 0.89 1.01 0.13 -0.78 121.20 129.08 3jvv s ILE 155 Ca 0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 60.65 60.61 3jvv s ILE 155 Cb -0.17 -3.68 -0.03 0.00 0.01 0.00 0.00 42.46 38.59 3jvv s ILE 155 CO 0.02 0.06 -0.06 -0.22 0.00 0.00 0.00 174.94 174.74 3jvv s LEU 156 N 1.79 3.17 0.13 2.97 2.96 0.20 -0.06 118.68 129.83 3jvv s LEU 156 Ca 0.07 -0.10 0.08 0.00 -0.22 0.00 0.00 54.13 53.96 3jvv s LEU 156 Cb -0.17 -1.73 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 3jvv s LEU 156 CO 0.11 0.25 -0.18 0.42 -1.32 0.00 0.00 176.35 175.62 3jvv s THR 157 N -0.12 1.66 -0.08 3.68 -4.23 0.85 -1.37 115.64 116.04 3jvv s THR 157 Ca 0.02 -1.73 -0.01 0.00 -1.18 0.00 0.00 61.69 58.79 3jvv s THR 157 Cb -0.13 -1.66 0.03 0.00 1.34 0.00 0.00 72.50 72.08 3jvv s THR 157 CO 0.03 -0.25 -0.02 -0.63 -0.54 0.00 0.00 174.62 173.21 3jvv s ILE 158 N -1.74 0.52 0.02 2.99 1.01 -0.41 -0.16 121.20 123.43 3jvv s ILE 158 Ca 0.11 0.02 -0.06 0.00 0.00 0.00 0.00 60.65 60.72 3jvv s ILE 158 Cb -0.07 -0.64 -0.01 0.00 0.01 0.00 0.00 42.46 41.75 3jvv s ILE 158 CO 0.05 0.28 0.10 -1.61 0.00 0.00 0.00 174.94 173.76 3jvv s GLU 159 N 1.85 0.53 -0.39 2.79 2.02 -0.47 -0.75 118.70 124.28 3jvv s GLU 159 Ca 0.04 -0.62 0.03 0.00 0.02 0.00 0.00 54.97 54.44 3jvv s GLU 159 Cb -0.12 0.21 0.16 0.00 0.10 0.00 0.00 34.13 34.47 3jvv s GLU 159 CO -0.06 -0.13 0.30 0.34 0.02 0.00 0.00 175.26 175.74 3jvv s ASP 160 N -1.81 1.89 0.80 -0.19 2.15 -1.26 0.34 116.67 118.59 3jvv s ASP 160 Ca -0.09 -2.75 -0.05 0.00 0.43 0.00 0.00 52.55 50.08 3jvv s ASP 160 Cb -0.04 -0.39 0.13 0.00 -0.30 0.00 0.00 42.92 42.32 3jvv s ASP 160 CO -0.02 -0.22 0.86 -0.81 -0.17 0.00 0.00 175.17 174.81 3jvv n PRO 161 N 3.25 -0.38 -1.98 4.34 -0.04 -1.26 -5.05 135.00 133.89 3jvv n PRO 161 Ca 0.24 -1.83 -0.42 0.00 -0.04 0.00 0.00 63.50 61.45 3jvv n PRO 161 Cb 0.44 -0.73 -0.03 0.00 -0.04 0.00 0.00 33.50 33.15 3jvv n PRO 161 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3jvv s ILE 162 N -2.66 2.86 0.00 0.52 1.01 -1.26 -4.95 121.20 116.72 3jvv s ILE 162 Ca 0.53 0.55 0.00 0.00 0.00 0.00 0.00 60.65 61.73 3jvv s ILE 162 Cb -0.02 -3.35 0.00 0.00 0.01 0.00 0.00 42.46 39.09 3jvv s ILE 162 CO 0.36 0.03 0.00 -0.62 0.00 0.00 0.00 174.94 174.71 3jvv n GLU 163 N 4.37 0.00 -2.82 2.79 1.02 -1.26 -4.96 120.64 119.78 3jvv n GLU 163 Ca 0.14 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.88 3jvv n GLU 163 Cb 0.40 -0.19 -0.06 0.00 -0.02 0.00 0.00 31.44 31.57 3jvv n GLU 163 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 3jvv s PHE 164 N 0.00 3.94 -0.26 -0.32 0.08 -1.26 -4.75 117.98 115.41 3jvv s PHE 164 Ca 0.00 1.81 -0.07 0.00 0.12 0.00 0.00 56.93 58.79 3jvv s PHE 164 Cb 0.00 -2.92 -0.02 0.00 -0.57 0.00 0.00 43.02 39.51 3jvv s PHE 164 CO 0.00 0.45 0.08 0.08 -0.10 0.00 0.00 175.22 175.73 3jvv s VAL 165 N -1.04 4.28 0.25 -0.44 1.01 -1.26 -5.09 120.40 118.12 3jvv s VAL 165 Ca 0.40 -0.28 -0.03 0.00 0.00 0.00 0.00 61.98 62.07 3jvv s VAL 165 Cb -0.25 -3.05 -0.05 0.00 0.00 0.00 0.00 36.38 33.03 3jvv s VAL 165 CO 0.30 0.27 0.49 -1.00 0.00 0.00 0.00 175.10 175.16 3jvv s HIS 166 N 1.60 3.48 -0.11 5.22 3.76 -1.26 -4.79 115.29 123.19 3jvv s HIS 166 Ca 0.06 0.52 -0.02 0.00 -0.15 0.00 0.00 55.06 55.47 3jvv s HIS 166 Cb -0.16 -2.00 -0.03 0.00 1.11 0.00 0.00 32.58 31.50 3jvv s HIS 166 CO 0.04 0.26 -0.02 -2.00 -0.85 0.00 0.00 174.74 172.16 3jvv s GLU 167 N -3.45 3.19 -0.27 1.40 2.12 -1.26 -5.02 118.70 115.41 3jvv s GLU 167 Ca 0.42 -0.46 -0.28 0.00 0.36 0.00 0.00 54.97 55.00 3jvv s GLU 167 Cb -0.11 -2.81 -0.03 0.00 0.26 0.00 0.00 34.13 31.44 3jvv s GLU 167 CO 0.29 0.54 1.97 -1.12 -0.54 0.00 0.00 175.26 176.41 3jvv s SER 168 N -0.45 5.74 0.00 -1.70 0.01 -1.26 -4.90 113.70 111.14 3jvv s SER 168 Ca 0.08 1.59 0.00 0.00 1.31 0.00 0.00 55.95 58.93 3jvv s SER 168 Cb -0.12 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.59 3jvv s SER 168 CO 0.02 -1.78 0.00 0.29 0.41 0.00 0.00 173.24 172.18 3jvv n LYS 169 N 8.52 0.00 0.04 12.44 5.02 -1.26 -4.88 118.16 138.04 3jvv n LYS 169 Ca 0.26 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.48 3jvv n LYS 169 Cb 0.46 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.36 3jvv n LYS 169 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 3jvv h LYS 170 N 0.00 0.00 -6.52 1.97 1.57 -1.34 -3.45 116.57 108.79 3jvv h LYS 170 Ca 0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 3jvv h LYS 170 Cb 0.00 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 3jvv h LYS 170 CO 0.00 0.77 0.01 0.00 -0.57 0.00 0.00 179.45 179.66 3jvv s LEU 172 N -2.43 4.30 -0.22 0.00 2.96 0.08 -4.57 118.68 118.80 3jvv s LEU 172 Ca 0.46 1.79 -0.02 0.00 -0.22 0.00 0.00 54.13 56.13 3jvv s LEU 172 Cb -0.13 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.00 3jvv s LEU 172 CO 0.19 -0.50 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.95 3jvv s VAL 173 N 1.82 3.00 -0.20 1.68 1.01 -1.26 0.21 120.40 126.66 3jvv s VAL 173 Ca 0.55 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.85 3jvv s VAL 173 Cb -0.24 -2.37 0.02 0.00 0.00 0.00 0.00 36.38 33.79 3jvv s VAL 173 CO 0.23 0.41 -0.15 0.20 0.00 0.00 0.00 175.10 175.80 3jvv s ASN 174 N 1.41 3.60 -0.14 3.32 0.01 0.92 -4.88 114.94 119.18 3jvv s ASN 174 Ca 0.05 -0.72 -0.03 0.00 -0.71 0.00 0.00 52.86 51.46 3jvv s ASN 174 Cb -0.14 -1.55 -0.03 0.00 0.41 0.00 0.00 41.25 39.94 3jvv s ASN 174 CO -0.06 -0.04 -0.06 -1.10 -1.51 0.00 0.00 177.10 174.34 3jvv s GLN 175 N 1.30 3.53 -0.22 -0.60 -0.21 -1.26 -0.10 119.66 122.10 3jvv s GLN 175 Ca 0.03 -0.55 -0.01 0.00 0.02 0.00 0.00 55.36 54.85 3jvv s GLN 175 Cb -0.14 -2.83 0.02 0.00 1.00 0.00 0.00 33.01 31.06 3jvv s GLN 175 CO -0.10 0.28 -0.10 1.03 -2.12 0.00 0.00 175.29 174.29 3jvv s ARG 176 N 0.24 2.96 -0.25 2.91 0.52 0.77 -4.93 118.95 121.18 3jvv s ARG 176 Ca -0.04 -0.88 -0.23 0.00 -0.52 0.00 0.00 55.73 54.06 3jvv s ARG 176 Cb -0.14 -2.88 -0.01 0.00 0.52 0.00 0.00 34.95 32.44 3jvv s ARG 176 CO 0.03 -0.32 0.77 -2.00 0.02 0.00 0.00 175.30 173.81 3jvv s GLU 177 N 1.34 4.16 0.51 3.54 2.12 -1.26 -1.37 118.70 127.74 3jvv s GLU 177 Ca 0.02 0.82 -0.23 0.00 0.36 0.00 0.00 54.97 55.94 3jvv s GLU 177 Cb -0.15 -3.65 -0.06 0.00 0.26 0.00 0.00 34.13 30.53 3jvv s GLU 177 CO -0.07 -0.48 1.40 0.08 -0.54 0.00 0.00 175.26 175.65 3jvv s VAL 178 N 2.73 2.03 0.00 3.70 1.01 0.15 0.73 120.40 130.75 3jvv s VAL 178 Ca 0.32 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.32 3jvv s VAL 178 Cb -0.15 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.22 3jvv s VAL 178 CO 0.08 0.00 0.00 1.41 0.00 0.00 0.00 175.10 176.59 3jvv n HIS 179 N -0.70 0.00 -0.04 5.22 8.25 0.14 -4.62 115.22 123.48 3jvv n HIS 179 Ca 0.08 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.45 3jvv n HIS 179 Cb 0.43 -0.08 -0.03 0.00 1.12 0.00 0.00 29.99 31.43 3jvv n HIS 179 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 3jvv n ARG 180 N -1.27 0.23 0.02 -0.41 0.63 -0.83 -4.77 116.66 110.26 3jvv n ARG 180 Ca 0.00 0.10 0.11 0.00 -0.92 0.00 0.00 57.85 57.14 3jvv n ARG 180 Cb 0.00 -0.89 0.03 0.00 0.45 0.00 0.00 32.46 32.05 3jvv n ARG 180 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3jvv n ASP 181 N -3.63 0.63 -3.66 6.15 8.00 0.22 -4.95 116.55 119.32 3jvv n ASP 181 Ca -0.17 -0.30 -0.11 0.00 0.71 0.00 0.00 54.79 54.92 3jvv n ASP 181 Cb 0.51 0.77 -0.05 0.00 -0.02 0.00 0.00 41.12 42.33 3jvv n ASP 181 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3jvv s THR 182 N -3.16 0.07 -0.03 -3.53 -1.32 -1.10 -4.86 115.64 101.72 3jvv s THR 182 Ca 0.05 -0.60 0.13 0.00 -1.21 0.00 0.00 61.69 60.06 3jvv s THR 182 Cb 0.15 -1.14 -0.01 0.00 -1.51 0.00 0.00 72.50 69.99 3jvv s THR 182 CO 0.80 -0.33 1.43 -0.07 -2.21 0.00 0.00 174.62 174.23 3jvv h LEU 183 N 2.51 0.00 -7.29 9.08 3.38 -1.90 0.41 115.31 121.49 3jvv h LEU 183 Ca -0.33 0.00 0.31 0.00 0.09 0.00 0.00 57.88 57.95 3jvv h LEU 183 Cb 1.24 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.88 3jvv h LEU 183 CO 0.47 0.64 0.79 -0.83 0.09 0.00 0.00 178.44 179.61 3jvv s GLY 184 N -4.53 -0.39 0.19 0.83 0.00 -1.26 -4.35 107.32 97.82 3jvv s GLY 184 Ca 0.03 0.61 -0.11 0.00 0.00 0.00 0.00 44.72 45.24 3jvv s GLY 184 CO 0.76 0.27 1.78 0.74 0.00 0.00 0.00 173.10 176.65 3jvv h PHE 185 N 2.00 0.51 0.04 1.90 0.04 -1.98 -1.89 116.94 117.55 3jvv h PHE 185 Ca -0.30 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.51 3jvv h PHE 185 Cb 1.21 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 39.20 3jvv h PHE 185 CO 0.36 0.22 -0.09 0.77 -0.60 0.00 0.00 178.31 178.98 3jvv h SER 186 N 0.53 -0.24 0.05 2.17 0.02 -1.95 0.14 113.55 114.26 3jvv h SER 186 Ca 0.26 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.25 3jvv h SER 186 Cb 0.20 0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 3jvv h SER 186 CO -0.20 -0.13 -0.07 -0.33 -1.14 0.00 0.00 176.83 174.96 3jvv h GLU 187 N -0.17 -0.14 -0.89 3.45 3.07 -1.90 0.19 114.58 118.20 3jvv h GLU 187 Ca 0.02 0.01 0.03 0.00 -0.50 0.00 0.00 59.36 58.92 3jvv h GLU 187 Cb 0.19 0.03 -0.05 0.00 -0.84 0.00 0.00 28.75 28.08 3jvv h GLU 187 CO -0.06 -0.09 0.58 0.00 -1.40 0.00 0.00 179.01 178.03 3jvv h ALA 188 N 0.80 1.16 -0.40 3.43 0.00 -1.18 0.25 119.26 123.31 3jvv h ALA 188 Ca 0.01 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 3jvv h ALA 188 Cb 0.16 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3jvv h ALA 188 CO -0.04 0.46 -0.14 -0.07 0.00 0.00 0.00 179.25 179.46 3jvv h LEU 189 N 1.14 0.81 -1.40 0.00 3.38 -0.04 0.57 115.31 119.77 3jvv h LEU 189 Ca 0.34 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3jvv h LEU 189 Cb -0.04 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 3jvv h LEU 189 CO -0.10 1.01 0.38 0.03 0.09 0.00 0.00 178.44 179.84 3jvv h ARG 190 N 0.61 0.78 -0.21 1.13 3.08 -0.26 -2.74 114.38 116.77 3jvv h ARG 190 Ca 0.10 -0.05 -0.19 0.00 0.07 0.00 0.00 59.98 59.90 3jvv h ARG 190 Cb 0.67 -0.17 0.01 0.00 0.08 0.00 0.00 29.97 30.56 3jvv h ARG 190 CO 0.05 0.53 -0.62 0.77 -1.07 0.00 0.00 179.97 179.62 3jvv h SER 191 N 0.80 0.91 -0.79 7.04 0.02 -0.39 -3.27 113.55 117.87 3jvv h SER 191 Ca 0.21 -0.58 0.18 0.00 -0.84 0.00 0.00 61.79 60.76 3jvv h SER 191 Cb -0.07 -0.27 -0.14 0.00 0.14 0.00 0.00 62.40 62.06 3jvv h SER 191 CO -0.04 1.33 -0.06 0.00 -1.14 0.00 0.00 176.83 176.92 3jvv h ALA 192 N 0.60 0.73 0.00 3.77 0.00 0.45 0.47 119.26 125.28 3jvv h ALA 192 Ca -0.02 0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3jvv h ALA 192 Cb 1.24 0.50 0.00 0.00 0.00 0.00 0.00 17.79 19.53 3jvv h ALA 192 CO 0.13 -0.43 0.24 -0.07 0.00 0.00 0.00 179.25 179.12 3jvv h LEU 193 N 0.06 0.00 -3.07 0.00 3.38 -1.60 0.16 115.31 114.24 3jvv h LEU 193 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 3jvv h LEU 193 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 3jvv h LEU 193 CO -0.74 0.00 0.00 0.54 0.09 0.00 0.00 178.44 178.33 3jvv n ARG 194 N -2.73 2.15 -0.49 1.13 1.74 0.16 -4.48 116.66 114.14 3jvv n ARG 194 Ca -0.02 -2.48 0.08 0.00 -0.77 0.00 0.00 57.85 54.67 3jvv n ARG 194 Cb 0.28 -1.52 0.27 0.00 -1.02 0.00 0.00 32.46 30.48 3jvv n ARG 194 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3jvv n GLU 195 N -0.87 3.14 -3.85 5.56 1.02 0.56 -5.01 120.64 121.20 3jvv n GLU 195 Ca 0.15 -2.86 -0.33 0.00 -0.02 0.00 0.00 57.16 54.10 3jvv n GLU 195 Cb 0.65 -1.88 0.01 0.00 -0.02 0.00 0.00 31.44 30.20 3jvv n GLU 195 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3jvv n ASP 196 N -0.36 -4.82 -4.84 1.62 2.03 -1.25 -4.96 116.55 103.97 3jvv n ASP 196 Ca 0.22 -1.05 -0.37 0.00 0.52 0.00 0.00 54.79 54.11 3jvv n ASP 196 Cb 0.92 -2.11 -0.07 0.00 -0.72 0.00 0.00 41.12 39.15 3jvv n ASP 196 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3jvv s PRO 197 N -5.94 3.59 0.03 -0.67 0.04 -1.26 -4.77 135.00 126.03 3jvv s PRO 197 Ca 0.26 -0.16 -0.06 0.00 0.04 0.00 0.00 61.00 61.08 3jvv s PRO 197 Cb -0.13 -3.23 -0.29 0.00 0.04 0.00 0.00 34.50 30.89 3jvv s PRO 197 CO 0.91 0.67 0.96 -0.44 0.04 0.00 0.00 177.00 179.15 3jvv h ASP 198 N 5.36 0.48 -3.60 6.66 3.32 -1.32 -3.46 116.42 123.86 3jvv h ASP 198 Ca -0.52 -0.59 -0.47 0.00 0.02 0.00 0.00 57.03 55.47 3jvv h ASP 198 Cb 1.21 -0.16 -0.32 0.00 0.22 0.00 0.00 39.33 40.28 3jvv h ASP 198 CO 0.62 1.48 -0.80 -0.63 -1.72 0.00 0.00 179.24 178.18 3jvv s ILE 199 N -2.63 0.95 -0.10 0.35 1.01 -0.32 -1.07 121.20 119.39 3jvv s ILE 199 Ca -0.08 -0.40 0.01 0.00 0.00 0.00 0.00 60.65 60.18 3jvv s ILE 199 Cb 0.06 -0.87 0.02 0.00 0.01 0.00 0.00 42.46 41.68 3jvv s ILE 199 CO 0.88 0.30 -0.10 -0.63 0.00 0.00 0.00 174.94 175.39 3jvv s ILE 200 N 0.50 1.14 -0.33 2.92 1.01 0.27 -0.63 121.20 126.08 3jvv s ILE 200 Ca -0.10 -0.41 -0.14 0.00 0.00 0.00 0.00 60.65 60.01 3jvv s ILE 200 Cb -0.13 -1.10 -0.02 0.00 0.01 0.00 0.00 42.46 41.22 3jvv s ILE 200 CO 0.02 0.38 0.28 -0.22 0.00 0.00 0.00 174.94 175.40 3jvv s LEU 201 N 1.26 4.45 -0.52 2.97 2.96 -0.47 -0.12 118.68 129.21 3jvv s LEU 201 Ca -0.03 -0.31 -0.18 0.00 -0.22 0.00 0.00 54.13 53.40 3jvv s LEU 201 Cb -0.14 -2.22 0.08 0.00 0.50 0.00 0.00 46.19 44.41 3jvv s LEU 201 CO -0.04 -0.26 0.56 0.68 -1.32 0.00 0.00 176.35 175.97 3jvv s VAL 202 N 1.84 5.01 0.26 1.68 -7.23 -0.01 -1.29 120.40 120.65 3jvv s VAL 202 Ca 0.08 -0.86 -0.02 0.00 -1.81 0.00 0.00 61.98 59.38 3jvv s VAL 202 Cb -0.17 -4.29 0.24 0.00 0.56 0.00 0.00 36.38 32.72 3jvv s VAL 202 CO 0.11 -0.80 1.73 1.23 -0.31 0.00 0.00 175.10 177.06 3jvv h GLY 203 N 9.39 1.27 -6.50 2.32 0.00 -1.23 -3.36 103.07 104.96 3jvv h GLY 203 Ca -0.28 -0.17 -0.44 0.00 0.00 0.00 0.00 47.33 46.44 3jvv h GLY 203 CO 0.97 -0.12 -0.78 -0.54 0.00 0.00 0.00 176.54 176.08 3jvv s GLU 204 N -5.98 0.88 -0.86 4.80 2.02 -1.26 -4.59 118.70 113.72 3jvv s GLU 204 Ca -0.12 -0.07 -0.14 0.00 0.02 0.00 0.00 54.97 54.65 3jvv s GLU 204 Cb 0.22 -0.99 -0.10 0.00 0.10 0.00 0.00 34.13 33.35 3jvv s GLU 204 CO 0.77 -0.16 2.01 -1.33 0.02 0.00 0.00 175.26 176.57 3jvv n MET 205 N 4.47 1.80 0.00 1.61 2.81 -1.24 -4.72 117.12 121.86 3jvv n MET 205 Ca -0.18 -1.70 -0.11 0.00 -1.81 0.00 0.00 57.70 53.91 3jvv n MET 205 Cb 0.51 -2.72 -0.05 0.00 -0.71 0.00 0.00 33.22 30.24 3jvv n MET 205 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 3jvv h ARG 206 N 7.13 0.05 -4.19 0.03 2.43 -1.94 -3.47 114.38 114.43 3jvv h ARG 206 Ca 0.46 -0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 59.36 3jvv h ARG 206 Cb 0.44 -0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 29.89 3jvv h ARG 206 CO 1.73 0.03 -0.26 0.16 -1.51 0.00 0.00 179.97 180.13 3jvv s ASP 207 N -5.23 0.77 0.25 -3.80 -4.77 -1.26 -5.02 116.67 97.62 3jvv s ASP 207 Ca -0.13 -1.43 -0.04 0.00 -3.30 0.00 0.00 52.55 47.65 3jvv s ASP 207 Cb 0.08 0.61 0.37 0.00 -1.09 0.00 0.00 42.92 42.89 3jvv s ASP 207 CO 0.67 -1.20 1.86 -0.07 0.70 0.00 0.00 175.17 177.13 3jvv h LEU 208 N 2.19 0.89 -0.36 2.11 3.38 -1.96 -1.67 115.31 119.89 3jvv h LEU 208 Ca -0.28 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 3jvv h LEU 208 Cb 1.24 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.81 3jvv h LEU 208 CO 0.40 0.56 0.20 -0.08 0.09 0.00 0.00 178.44 179.61 3jvv h GLU 209 N 1.02 0.50 -0.74 1.13 4.57 -1.99 0.17 114.58 119.24 3jvv h GLU 209 Ca 0.40 -0.06 0.08 0.00 -1.18 0.00 0.00 59.36 58.60 3jvv h GLU 209 Cb 0.20 -0.10 -0.06 0.00 -0.16 0.00 0.00 28.75 28.63 3jvv h GLU 209 CO -0.18 0.41 0.42 1.15 -1.18 0.00 0.00 179.01 179.62 3jvv h THR 210 N 0.46 0.94 -0.20 0.32 2.02 -1.77 -0.81 112.91 113.87 3jvv h THR 210 Ca 0.13 -0.25 -0.03 0.00 0.77 0.00 0.00 66.41 67.03 3jvv h THR 210 Cb 0.05 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.59 3jvv h THR 210 CO -0.02 0.13 0.02 0.40 0.37 0.00 0.00 175.52 176.42 3jvv h ILE 211 N 0.74 1.24 -0.24 3.11 2.04 -0.55 0.34 117.51 124.19 3jvv h ILE 211 Ca 0.35 -0.80 0.06 0.00 1.00 0.00 0.00 64.86 65.47 3jvv h ILE 211 Cb 0.27 1.38 -0.07 0.00 -0.74 0.00 0.00 36.82 37.66 3jvv h ILE 211 CO -0.21 0.25 -0.25 0.03 0.00 0.00 0.00 178.15 177.96 3jvv h ARG 212 N 0.11 -0.25 -0.46 2.37 3.08 -0.32 0.19 114.38 119.10 3jvv h ARG 212 Ca 0.06 0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.04 3jvv h ARG 212 Cb 0.35 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 3jvv h ARG 212 CO 0.01 -0.17 -0.06 -0.07 -1.07 0.00 0.00 179.97 178.61 3jvv h LEU 213 N -0.26 0.78 -0.16 3.04 3.38 -0.91 0.22 115.31 121.40 3jvv h LEU 213 Ca 0.13 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 57.90 3jvv h LEU 213 Cb 0.47 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3jvv h LEU 213 CO -0.39 0.88 0.09 0.00 0.09 0.00 0.00 178.44 179.11 3jvv h ALA 214 N 1.20 0.19 -0.42 1.53 0.00 0.40 0.35 119.26 122.51 3jvv h ALA 214 Ca 0.13 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 3jvv h ALA 214 Cb 0.53 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 3jvv h ALA 214 CO 0.03 -0.34 0.22 -0.07 0.00 0.00 0.00 179.25 179.09 3jvv h LEU 215 N 0.18 0.53 -0.43 0.00 3.38 -0.17 0.12 115.31 118.93 3jvv h LEU 215 Ca 0.06 -0.10 0.08 0.00 0.09 0.00 0.00 57.88 58.01 3jvv h LEU 215 Cb 0.00 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.55 3jvv h LEU 215 CO -0.03 0.48 0.04 0.74 0.09 0.00 0.00 178.44 179.75 3jvv h THR 216 N 0.54 0.72 -0.99 0.22 2.02 -0.35 0.18 112.91 115.25 3jvv h THR 216 Ca 0.15 -0.05 0.01 0.00 0.77 0.00 0.00 66.41 67.28 3jvv h THR 216 Cb 0.07 0.55 -0.05 0.00 -1.74 0.00 0.00 68.15 66.98 3jvv h THR 216 CO -0.02 0.03 0.65 0.00 0.37 0.00 0.00 175.52 176.54 3jvv h ALA 217 N 1.36 1.29 0.18 6.16 0.00 0.62 0.31 119.26 129.18 3jvv h ALA 217 Ca 0.21 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3jvv h ALA 217 Cb 0.29 -0.40 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3jvv h ALA 217 CO -0.32 0.66 -0.09 0.00 0.00 0.00 0.00 179.25 179.50 3jvv h ALA 218 N 1.38 -0.24 -0.94 0.00 0.00 -0.12 -2.78 119.26 116.56 3jvv h ALA 218 Ca 0.36 -0.21 0.15 0.00 0.00 0.00 0.00 54.91 55.21 3jvv h ALA 218 Cb -0.15 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 17.64 3jvv h ALA 218 CO -0.08 -0.39 0.55 1.49 0.00 0.00 0.00 179.25 180.82 3jvv h GLU 219 N -0.72 0.76 0.00 0.00 4.81 -0.48 0.01 114.58 118.96 3jvv h GLU 219 Ca -0.02 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 3jvv h GLU 219 Cb 0.50 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.71 3jvv h GLU 219 CO 0.04 0.50 0.00 0.00 -0.73 0.00 0.00 179.01 178.82 3jvv h THR 220 N 0.78 0.00 0.00 0.32 1.03 -0.33 -3.45 112.91 111.27 3jvv h THR 220 Ca 0.50 -0.05 0.00 0.00 -0.01 0.00 0.00 66.41 66.85 3jvv h THR 220 Cb 0.66 0.62 0.00 0.00 -1.07 0.00 0.00 68.15 68.36 3jvv h THR 220 CO -0.33 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 175.79 3jvv n GLY 221 N -1.01 1.12 3.89 2.99 0.00 -0.01 -5.09 105.19 107.08 3jvv n GLY 221 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 3jvv n GLY 221 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3jvv s HIS 222 N -1.62 3.27 -0.33 1.61 3.76 -1.06 -4.56 115.29 116.35 3jvv s HIS 222 Ca 0.00 0.93 -0.16 0.00 -0.15 0.00 0.00 55.06 55.68 3jvv s HIS 222 Cb 0.00 -3.05 -0.01 0.00 1.11 0.00 0.00 32.58 30.63 3jvv s HIS 222 CO 0.00 -1.17 0.41 -1.17 -0.85 0.00 0.00 174.74 171.96 3jvv s LEU 223 N -5.30 4.35 -0.12 0.89 2.96 -0.23 -1.12 118.68 120.10 3jvv s LEU 223 Ca 0.58 -0.09 -0.02 0.00 -0.22 0.00 0.00 54.13 54.38 3jvv s LEU 223 Cb -0.11 -2.43 -0.03 0.00 0.50 0.00 0.00 46.19 44.12 3jvv s LEU 223 CO 0.50 -0.36 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.45 3jvv s VAL 224 N 2.15 4.00 -0.15 1.68 1.01 0.34 -0.56 120.40 128.87 3jvv s VAL 224 Ca 0.15 -0.34 -0.01 0.00 0.00 0.00 0.00 61.98 61.77 3jvv s VAL 224 Cb -0.16 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 3jvv s VAL 224 CO 0.12 0.55 -0.11 -0.36 0.00 0.00 0.00 175.10 175.30 3jvv s PHE 225 N -0.26 2.86 0.26 5.22 0.08 0.82 -0.93 117.98 126.03 3jvv s PHE 225 Ca 0.05 -0.66 0.01 0.00 0.12 0.00 0.00 56.93 56.45 3jvv s PHE 225 Cb -0.13 -1.90 -0.04 0.00 -0.57 0.00 0.00 43.02 40.39 3jvv s PHE 225 CO 0.02 -0.25 0.14 0.20 -0.10 0.00 0.00 175.22 175.23 3jvv s GLY 226 N 0.52 1.77 0.11 4.36 0.00 -0.27 -0.83 107.32 112.97 3jvv s GLY 226 Ca -0.07 -1.79 0.04 0.00 0.00 0.00 0.00 44.72 42.90 3jvv s GLY 226 CO 0.04 -1.52 -0.11 -0.51 0.00 0.00 0.00 173.10 170.99 3jvv s THR 227 N -3.83 1.08 0.15 0.90 -4.23 -1.26 -1.28 115.64 107.17 3jvv s THR 227 Ca 0.38 -1.67 -0.03 0.00 -1.18 0.00 0.00 61.69 59.20 3jvv s THR 227 Cb 0.06 -1.42 -0.03 0.00 1.34 0.00 0.00 72.50 72.45 3jvv s THR 227 CO 0.15 -0.51 0.11 -0.76 -0.54 0.00 0.00 174.62 173.08 3jvv s LEU 228 N -2.45 1.51 -0.19 4.79 1.43 -1.22 -3.58 118.68 118.97 3jvv s LEU 228 Ca 0.07 -1.18 0.07 0.00 -1.03 0.00 0.00 54.13 52.06 3jvv s LEU 228 Cb -0.04 0.49 0.49 0.00 0.03 0.00 0.00 46.19 47.16 3jvv s LEU 228 CO 0.01 -0.78 1.37 1.41 0.23 0.00 0.00 176.35 178.59 3jvv n HIS 229 N -0.15 1.49 -2.19 0.29 8.25 -1.26 -2.52 115.22 119.13 3jvv n HIS 229 Ca -0.04 -0.70 -0.28 0.00 -0.26 0.00 0.00 57.72 56.43 3jvv n HIS 229 Cb 0.64 -0.45 0.04 0.00 1.12 0.00 0.00 29.99 31.33 3jvv n HIS 229 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3jvv s THR 230 N -2.10 3.65 -1.05 1.59 -4.23 -1.26 -3.99 115.64 108.25 3jvv s THR 230 Ca 0.35 0.22 0.09 0.00 -1.18 0.00 0.00 61.69 61.17 3jvv s THR 230 Cb 0.27 -3.48 0.13 0.00 1.34 0.00 0.00 72.50 70.76 3jvv s THR 230 CO 0.09 -0.56 0.93 0.35 -0.54 0.00 0.00 174.62 174.89 3jvv n THR 231 N -2.74 0.31 -3.52 3.99 -2.24 -1.26 -1.07 114.28 107.74 3jvv n THR 231 Ca 0.05 -0.65 -0.12 0.00 -2.27 0.00 0.00 64.05 61.06 3jvv n THR 231 Cb 0.57 0.98 -0.03 0.00 -2.10 0.00 0.00 70.33 69.75 3jvv n THR 231 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3jvv s SER 232 N -0.85 -0.44 0.20 3.42 1.04 -1.26 -4.75 113.70 111.06 3jvv s SER 232 Ca 0.14 -0.06 -0.10 0.00 0.48 0.00 0.00 55.95 56.40 3jvv s SER 232 Cb 0.09 0.54 0.23 0.00 0.10 0.00 0.00 66.02 66.97 3jvv s SER 232 CO 0.12 -0.88 1.78 0.00 0.98 0.00 0.00 173.24 175.24 3jvv h ALA 233 N 2.27 0.78 0.56 5.32 0.00 -1.91 -1.75 119.26 124.53 3jvv h ALA 233 Ca -0.33 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 3jvv h ALA 233 Cb 1.27 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 19.03 3jvv h ALA 233 CO 0.41 -0.09 -0.27 0.00 0.00 0.00 0.00 179.25 179.31 3jvv h ALA 234 N 1.35 -0.75 -0.89 0.00 0.00 -1.96 -1.86 119.26 115.15 3jvv h ALA 234 Ca 0.28 -0.18 0.15 0.00 0.00 0.00 0.00 54.91 55.16 3jvv h ALA 234 Cb 0.25 0.29 -0.07 0.00 0.00 0.00 0.00 17.79 18.26 3jvv h ALA 234 CO -0.22 -0.89 0.57 0.87 0.00 0.00 0.00 179.25 179.58 3jvv h LYS 235 N -0.81 0.64 -0.13 0.00 1.57 -1.95 0.22 116.57 116.11 3jvv h LYS 235 Ca -0.08 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 3jvv h LYS 235 Cb 0.60 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 3jvv h LYS 235 CO 0.13 0.42 0.08 1.15 -0.57 0.00 0.00 179.45 180.66 3jvv h THR 236 N 0.66 1.02 -0.08 -0.16 2.02 -1.02 0.21 112.91 115.57 3jvv h THR 236 Ca 0.45 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 67.56 3jvv h THR 236 Cb 0.76 0.84 -0.00 0.00 -1.74 0.00 0.00 68.15 68.01 3jvv h THR 236 CO -0.20 0.03 -0.00 0.40 0.37 0.00 0.00 175.52 176.12 3jvv h ILE 237 N 0.17 1.25 -0.37 3.11 2.04 0.10 -1.48 117.51 122.33 3jvv h ILE 237 Ca 0.05 -0.79 0.08 0.00 1.00 0.00 0.00 64.86 65.20 3jvv h ILE 237 Cb -0.01 1.63 -0.08 0.00 -0.74 0.00 0.00 36.82 37.62 3jvv h ILE 237 CO -0.02 0.22 -0.23 0.44 0.00 0.00 0.00 178.15 178.56 3jvv h ASP 238 N -0.15 -0.77 -0.52 1.72 3.32 -0.65 -2.72 116.42 116.64 3jvv h ASP 238 Ca 0.02 0.16 0.02 0.00 0.02 0.00 0.00 57.03 57.25 3jvv h ASP 238 Cb 0.35 0.39 -0.03 0.00 0.22 0.00 0.00 39.33 40.25 3jvv h ASP 238 CO 0.00 -0.26 0.32 -0.09 -1.72 0.00 0.00 179.24 177.49 3jvv h ARG 239 N -0.18 0.61 -0.92 3.56 9.65 -0.11 0.44 114.38 127.44 3jvv h ARG 239 Ca 0.18 -0.04 0.14 0.00 -1.10 0.00 0.00 59.98 59.16 3jvv h ARG 239 Cb 0.46 -0.14 -0.08 0.00 -1.39 0.00 0.00 29.97 28.83 3jvv h ARG 239 CO -0.47 0.41 0.59 0.28 2.80 0.00 0.00 179.97 183.57 3jvv h VAL 240 N 0.63 0.85 0.07 0.20 2.07 -0.97 -2.21 116.25 116.89 3jvv h VAL 240 Ca 0.21 -0.27 -0.11 0.00 0.82 0.00 0.00 66.70 67.35 3jvv h VAL 240 Cb 0.01 0.01 0.01 0.00 -1.52 0.00 0.00 31.29 29.79 3jvv h VAL 240 CO -0.09 0.14 -0.50 0.58 0.02 0.00 0.00 177.57 177.73 3jvv h VAL 241 N 0.78 1.59 -0.93 2.57 2.07 -0.95 -3.37 116.25 118.00 3jvv h VAL 241 Ca 0.47 -2.43 0.16 0.00 0.82 0.00 0.00 66.70 65.71 3jvv h VAL 241 Cb 0.66 3.22 -0.10 0.00 -1.52 0.00 0.00 31.29 33.56 3jvv h VAL 241 CO -0.23 0.65 0.54 0.44 0.02 0.00 0.00 177.57 178.99 3jvv h ASP 242 N -0.68 0.69 -0.02 0.57 3.32 0.33 -1.63 116.42 119.00 3jvv h ASP 242 Ca -0.10 0.09 0.01 0.00 0.02 0.00 0.00 57.03 57.05 3jvv h ASP 242 Cb 1.34 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.86 3jvv h ASP 242 CO 0.06 0.29 0.10 -0.37 -1.72 0.00 0.00 179.24 177.60 3jvv h VAL 243 N 0.74 0.11 -3.66 -1.35 -1.51 -1.58 -3.43 116.25 105.57 3jvv h VAL 243 Ca 0.51 0.00 -0.50 0.00 -1.23 0.00 0.00 66.70 65.48 3jvv h VAL 243 Cb 0.72 0.91 -0.03 0.00 -2.13 0.00 0.00 31.29 30.76 3jvv h VAL 243 CO -0.35 0.00 0.06 -0.36 -1.23 0.00 0.00 177.57 175.69 3jvv s PHE 244 N -4.25 3.40 0.75 5.19 0.08 -0.61 -5.03 117.98 117.52 3jvv s PHE 244 Ca -0.05 1.17 -0.14 0.00 0.12 0.00 0.00 56.93 58.04 3jvv s PHE 244 Cb 0.13 -2.49 0.05 0.00 -0.57 0.00 0.00 43.02 40.13 3jvv s PHE 244 CO 0.41 0.14 1.17 -1.25 -0.10 0.00 0.00 175.22 175.59 3jvv s PRO 245 N -2.87 2.10 0.23 0.24 0.04 -1.26 -4.73 135.00 128.74 3jvv s PRO 245 Ca 0.52 1.60 -0.12 0.00 0.04 0.00 0.00 61.00 63.04 3jvv s PRO 245 Cb -0.11 -1.85 0.29 0.00 0.04 0.00 0.00 34.50 32.88 3jvv s PRO 245 CO 0.18 -1.83 1.62 0.00 0.04 0.00 0.00 177.00 177.01 3jvv h ALA 246 N -0.56 0.49 -0.25 8.56 0.00 -1.97 -0.10 119.26 125.43 3jvv h ALA 246 Ca -0.46 0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.79 3jvv h ALA 246 Cb 1.28 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 19.58 3jvv h ALA 246 CO 0.49 -0.42 0.26 1.05 0.00 0.00 0.00 179.25 180.63 3jvv h GLU 247 N 0.01 0.00 -0.00 0.00 9.09 -2.04 -2.44 114.58 119.20 3jvv h GLU 247 Ca 0.34 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.75 3jvv h GLU 247 Cb 0.53 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.63 3jvv h GLU 247 CO -0.72 0.00 -0.84 -1.91 0.05 0.00 0.00 179.01 175.59 3jvv n GLU 248 N -3.88 0.98 -0.09 1.06 2.13 -0.07 -4.62 120.64 116.15 3jvv n GLU 248 Ca 0.03 -0.04 -0.09 0.00 0.66 0.00 0.00 57.16 57.72 3jvv n GLU 248 Cb 0.40 -1.36 -0.02 0.00 0.27 0.00 0.00 31.44 30.72 3jvv n GLU 248 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 3jvv h LYS 249 N 0.10 0.41 -0.26 5.31 1.57 -1.19 -2.94 116.57 119.58 3jvv h LYS 249 Ca 0.00 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.78 3jvv h LYS 249 Cb 0.44 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.63 3jvv h LYS 249 CO 0.00 0.34 0.00 0.00 -0.57 0.00 0.00 179.45 179.22 3jvv h ALA 250 N 1.05 0.23 -0.58 3.86 0.00 -1.82 0.16 119.26 122.16 3jvv h ALA 250 Ca 0.11 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 3jvv h ALA 250 Cb 0.04 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3jvv h ALA 250 CO -0.02 -0.41 0.06 0.00 0.00 0.00 0.00 179.25 178.88 3jvv h MET 251 N 0.09 0.96 -0.31 0.00 -0.00 -1.86 0.11 114.93 113.91 3jvv h MET 251 Ca 0.12 -0.25 -0.02 0.00 -0.00 0.00 0.00 59.70 59.55 3jvv h MET 251 Cb 0.16 -0.11 -0.01 0.00 -0.00 0.00 0.00 31.60 31.63 3jvv h MET 251 CO -0.20 0.91 0.12 0.28 -0.00 0.00 0.00 176.91 178.02 3jvv h VAL 252 N 0.90 1.19 -0.45 -0.10 2.07 -1.24 0.39 116.25 119.00 3jvv h VAL 252 Ca 0.18 -0.57 0.08 0.00 0.82 0.00 0.00 66.70 67.20 3jvv h VAL 252 Cb 0.44 0.98 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 3jvv h VAL 252 CO 0.02 0.20 0.08 -0.09 0.02 0.00 0.00 177.57 177.79 3jvv h ARG 253 N 0.36 0.21 0.25 1.57 2.43 -0.24 0.77 114.38 119.72 3jvv h ARG 253 Ca 0.10 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 3jvv h ARG 253 Cb 0.19 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3jvv h ARG 253 CO -0.01 0.14 -0.12 0.66 -1.51 0.00 0.00 179.97 179.13 3jvv h SER 254 N 0.21 -0.28 -0.80 -3.80 4.64 -0.29 -0.95 113.55 112.28 3jvv h SER 254 Ca 0.22 -0.23 0.19 0.00 -0.47 0.00 0.00 61.79 61.50 3jvv h SER 254 Cb 0.29 0.07 -0.14 0.00 -0.31 0.00 0.00 62.40 62.31 3jvv h SER 254 CO -0.30 0.12 -0.02 0.24 -0.87 0.00 0.00 176.83 176.00 3jvv h MET 255 N -0.73 0.08 -0.44 4.77 2.86 -0.15 -1.60 114.93 119.72 3jvv h MET 255 Ca -0.03 -0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.55 3jvv h MET 255 Cb 0.49 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.12 3jvv h MET 255 CO 0.06 0.05 0.08 1.25 1.06 0.00 0.00 176.91 179.41 3jvv h LEU 256 N 0.08 0.69 -0.46 1.22 5.85 -0.62 0.38 115.31 122.45 3jvv h LEU 256 Ca 0.44 -0.25 0.07 0.00 0.84 0.00 0.00 57.88 58.98 3jvv h LEU 256 Cb 0.79 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.58 3jvv h LEU 256 CO -0.73 0.76 0.11 0.77 -0.34 0.00 0.00 178.44 179.01 3jvv h SER 257 N 0.58 0.05 -0.07 1.25 4.64 -0.37 0.11 113.55 119.74 3jvv h SER 257 Ca 0.13 0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 61.52 3jvv h SER 257 Cb 0.36 0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 3jvv h SER 257 CO 0.01 0.06 0.01 -0.33 -0.87 0.00 0.00 176.83 175.70 3jvv h GLU 258 N 0.25 0.13 0.00 4.77 4.39 -0.92 -3.37 114.58 119.83 3jvv h GLU 258 Ca 0.22 -0.04 -0.05 0.00 0.34 0.00 0.00 59.36 59.84 3jvv h GLU 258 Cb 0.27 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 3jvv h GLU 258 CO -0.27 0.36 -0.92 0.66 -1.16 0.00 0.00 179.01 177.67 3jvv h SER 259 N -0.13 0.00 -2.85 1.42 4.64 -0.56 -3.47 113.55 112.60 3jvv h SER 259 Ca 0.02 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.81 3jvv h SER 259 Cb 0.29 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.40 3jvv h SER 259 CO 0.00 0.19 0.86 -0.22 -0.87 0.00 0.00 176.83 176.79 3jvv s LEU 260 N -5.68 4.35 -0.18 5.97 2.96 0.36 -0.98 118.68 125.48 3jvv s LEU 260 Ca 0.00 2.36 0.07 0.00 -0.22 0.00 0.00 54.13 56.34 3jvv s LEU 260 Cb 0.08 -3.57 -0.16 0.00 0.50 0.00 0.00 46.19 43.04 3jvv s LEU 260 CO 0.77 -0.77 -0.07 0.00 -1.32 0.00 0.00 176.35 174.96 3jvv n GLN 261 N 4.84 0.92 -3.52 1.98 1.13 0.75 -4.53 117.38 118.95 3jvv n GLN 261 Ca 0.14 0.06 -0.13 0.00 -1.94 0.00 0.00 57.00 55.13 3jvv n GLN 261 Cb 0.42 -1.41 -0.04 0.00 0.11 0.00 0.00 30.24 29.31 3jvv n GLN 261 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3jvv s SER 262 N -5.51 -0.50 -0.04 1.08 0.15 -1.20 0.48 113.70 108.17 3jvv s SER 262 Ca -0.19 0.38 0.03 0.00 0.70 0.00 0.00 55.95 56.87 3jvv s SER 262 Cb 0.06 0.45 0.01 0.00 -1.71 0.00 0.00 66.02 64.82 3jvv s SER 262 CO 0.55 -0.58 -0.10 -0.69 1.20 0.00 0.00 173.24 173.61 3jvv s VAL 263 N -1.91 0.93 -0.27 4.45 1.01 -0.76 -1.66 120.40 122.18 3jvv s VAL 263 Ca -0.03 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.55 3jvv s VAL 263 Cb -0.00 -0.84 0.08 0.00 0.00 0.00 0.00 36.38 35.62 3jvv s VAL 263 CO 0.00 0.29 -0.00 -0.63 0.00 0.00 0.00 175.10 174.76 3jvv s ILE 264 N 0.37 1.58 -0.09 2.22 1.01 0.83 -1.19 121.20 125.93 3jvv s ILE 264 Ca -0.07 -1.51 -0.02 0.00 0.00 0.00 0.00 60.65 59.05 3jvv s ILE 264 Cb -0.11 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 3jvv s ILE 264 CO 0.01 -0.32 0.02 -0.44 0.00 0.00 0.00 174.94 174.21 3jvv s SER 265 N 1.32 5.37 0.03 3.58 0.01 -0.17 0.14 113.70 123.99 3jvv s SER 265 Ca 0.01 0.18 -0.05 0.00 1.31 0.00 0.00 55.95 57.40 3jvv s SER 265 Cb -0.19 -1.54 -0.01 0.00 0.21 0.00 0.00 66.02 64.49 3jvv s SER 265 CO -0.10 0.38 0.09 -1.58 0.41 0.00 0.00 173.24 172.44 3jvv s GLN 266 N -0.89 0.54 0.06 12.44 0.74 0.98 0.43 119.66 133.96 3jvv s GLN 266 Ca 0.13 -0.68 -0.15 0.00 0.05 0.00 0.00 55.36 54.71 3jvv s GLN 266 Cb -0.11 0.21 0.02 0.00 1.10 0.00 0.00 33.01 34.23 3jvv s GLN 266 CO 0.02 -0.13 0.34 -0.08 -0.55 0.00 0.00 175.29 174.89 3jvv s THR 267 N -2.29 0.08 0.19 -0.34 -1.32 -0.78 -4.35 115.64 106.83 3jvv s THR 267 Ca -0.08 -0.66 0.03 0.00 -1.21 0.00 0.00 61.69 59.77 3jvv s THR 267 Cb -0.03 -1.03 0.03 0.00 -1.51 0.00 0.00 72.50 69.96 3jvv s THR 267 CO -0.03 -0.36 0.23 0.18 -2.21 0.00 0.00 174.62 172.42 3jvv n LEU 268 N 0.33 0.00 0.00 9.08 4.77 -1.25 -0.80 117.00 129.13 3jvv n LEU 268 Ca -0.18 -0.89 0.00 0.00 -0.03 0.00 0.00 56.01 54.91 3jvv n LEU 268 Cb 0.61 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 3jvv n LEU 268 CO 0.20 -0.50 0.00 0.54 -1.33 0.00 0.00 177.39 176.30 3jvv n ARG 276 N -1.27 0.00 -4.13 3.23 3.00 -1.26 -4.99 116.66 111.24 3jvv n ARG 276 Ca 0.04 0.00 -0.15 0.00 -0.01 0.00 0.00 57.85 57.73 3jvv n ARG 276 Cb 0.21 0.00 -0.11 0.00 0.00 0.00 0.00 32.46 32.55 3jvv n ARG 276 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 3jvv s VAL 277 N -2.08 0.82 0.11 1.55 0.11 -1.26 -5.15 120.40 114.50 3jvv s VAL 277 Ca 0.00 -1.37 -0.17 0.00 -2.93 0.00 0.00 61.98 57.51 3jvv s VAL 277 Cb 0.00 -1.03 -0.07 0.00 -1.53 0.00 0.00 36.38 33.75 3jvv s VAL 277 CO 0.00 -0.43 0.56 0.00 -3.33 0.00 0.00 175.10 171.89 3jvv s ALA 278 N -1.85 3.58 0.03 1.54 0.00 -1.26 -4.99 121.76 118.82 3jvv s ALA 278 Ca -0.02 -0.06 0.09 0.00 0.00 0.00 0.00 51.96 51.98 3jvv s ALA 278 Cb -0.07 -2.57 -0.03 0.00 0.00 0.00 0.00 23.12 20.45 3jvv s ALA 278 CO 0.00 0.43 -0.26 0.00 0.00 0.00 0.00 175.76 175.93 3jvv s ALA 279 N -1.29 2.26 -0.03 0.00 0.00 0.02 -4.99 121.76 117.72 3jvv s ALA 279 Ca 0.33 -1.24 0.03 0.00 0.00 0.00 0.00 51.96 51.08 3jvv s ALA 279 Cb -0.17 -0.51 0.00 0.00 0.00 0.00 0.00 23.12 22.44 3jvv s ALA 279 CO 0.19 0.54 -0.10 -1.01 0.00 0.00 0.00 175.76 175.37 3jvv s HIS 280 N -0.77 1.04 -0.05 0.00 0.09 -1.26 -1.86 115.29 112.47 3jvv s HIS 280 Ca 0.12 -0.26 -0.16 0.00 -0.00 0.00 0.00 55.06 54.76 3jvv s HIS 280 Cb -0.10 -0.72 -0.05 0.00 -0.00 0.00 0.00 32.58 31.70 3jvv s HIS 280 CO 0.02 -0.10 0.42 -2.00 -0.00 0.00 0.00 174.74 173.07 3jvv s GLU 281 N 0.13 4.07 -0.07 1.40 2.12 0.17 -4.42 118.70 122.09 3jvv s GLU 281 Ca -0.02 0.40 0.01 0.00 0.36 0.00 0.00 54.97 55.71 3jvv s GLU 281 Cb -0.08 -3.30 0.02 0.00 0.26 0.00 0.00 34.13 31.03 3jvv s GLU 281 CO 0.01 0.51 -0.07 0.42 -0.54 0.00 0.00 175.26 175.58 3jvv s ILE 282 N -0.48 0.82 -0.00 -3.70 1.01 0.32 -1.00 121.20 118.18 3jvv s ILE 282 Ca 0.24 -0.24 0.07 0.00 0.00 0.00 0.00 60.65 60.72 3jvv s ILE 282 Cb -0.16 -0.83 -0.02 0.00 0.01 0.00 0.00 42.46 41.46 3jvv s ILE 282 CO 0.12 0.31 -0.21 -0.32 0.00 0.00 0.00 174.94 174.83 3jvv s MET 283 N 1.21 1.67 -0.07 2.79 1.75 -0.33 -1.63 119.30 124.69 3jvv s MET 283 Ca -0.05 -0.81 0.04 0.00 -1.25 0.00 0.00 55.69 53.62 3jvv s MET 283 Cb -0.14 -1.66 -0.00 0.00 2.84 0.00 0.00 34.83 35.87 3jvv s MET 283 CO -0.02 0.45 -0.21 0.42 -0.65 0.00 0.00 175.02 175.01 3jvv s ILE 284 N -0.57 1.81 -1.17 10.11 1.01 -1.26 -1.83 121.20 129.29 3jvv s ILE 284 Ca 0.08 -0.90 -0.21 0.00 0.00 0.00 0.00 60.65 59.63 3jvv s ILE 284 Cb -0.08 -1.56 -0.05 0.00 0.01 0.00 0.00 42.46 40.78 3jvv s ILE 284 CO -0.00 0.51 1.90 0.61 0.00 0.00 0.00 174.94 177.95 3jvv n GLY 285 N 3.35 1.87 3.90 6.18 0.00 0.18 -4.93 105.19 115.74 3jvv n GLY 285 Ca -0.19 -1.03 -0.28 0.00 0.00 0.00 0.00 46.02 44.52 3jvv n GLY 285 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3jvv s THR 286 N 7.87 4.93 0.27 2.61 -4.23 -1.26 -4.85 115.64 120.97 3jvv s THR 286 Ca 0.62 0.17 -0.03 0.00 -1.18 0.00 0.00 61.69 61.27 3jvv s THR 286 Cb 0.04 -3.82 0.30 0.00 1.34 0.00 0.00 72.50 70.36 3jvv s THR 286 CO 0.11 -0.66 1.64 1.55 -0.54 0.00 0.00 174.62 176.71 3jvv h PRO 287 N 0.72 0.14 -0.06 3.99 0.13 -1.98 0.22 132.00 135.16 3jvv h PRO 287 Ca -0.47 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 64.66 3jvv h PRO 287 Cb 1.20 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 3jvv h PRO 287 CO 0.63 0.09 -0.01 0.00 -0.23 0.00 0.00 178.00 178.47 3jvv h ALA 288 N 1.76 0.04 -0.76 -0.56 0.00 -1.98 0.17 119.26 117.92 3jvv h ALA 288 Ca 0.48 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.37 3jvv h ALA 288 Cb 0.91 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 3jvv h ALA 288 CO -0.68 -0.49 0.33 0.82 0.00 0.00 0.00 179.25 179.23 3jvv h ILE 289 N 0.00 1.25 -0.84 0.00 2.04 -1.57 0.09 117.51 118.48 3jvv h ILE 289 Ca 0.03 -0.77 0.06 0.00 1.00 0.00 0.00 64.86 65.18 3jvv h ILE 289 Cb 0.04 0.33 -0.06 0.00 -0.74 0.00 0.00 36.82 36.39 3jvv h ILE 289 CO -0.06 0.32 0.52 0.03 0.00 0.00 0.00 178.15 178.96 3jvv h ARG 290 N 1.10 0.93 -0.48 2.37 3.08 -0.06 0.90 114.38 122.21 3jvv h ARG 290 Ca 0.26 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.25 3jvv h ARG 290 Cb 0.18 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 3jvv h ARG 290 CO -0.02 0.61 0.31 -0.91 -1.07 0.00 0.00 179.97 178.89 3jvv h ASN 291 N 0.95 0.57 -0.66 7.04 4.21 0.18 0.22 115.58 128.10 3jvv h ASN 291 Ca 0.36 -0.03 0.12 0.00 1.21 0.00 0.00 56.30 57.96 3jvv h ASN 291 Cb 0.16 -0.14 -0.09 0.00 -1.12 0.00 0.00 38.32 37.13 3jvv h ASN 291 CO -0.17 0.43 0.20 -0.07 -1.29 0.00 0.00 177.43 176.54 3jvv h LEU 292 N 0.65 0.13 -0.11 1.61 3.38 0.91 0.65 115.31 122.53 3jvv h LEU 292 Ca 0.18 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 3jvv h LEU 292 Cb -0.05 0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 3jvv h LEU 292 CO -0.04 0.06 0.01 0.40 0.09 0.00 0.00 178.44 178.97 3jvv h ILE 293 N 0.35 1.23 -0.59 1.22 2.04 -0.58 0.33 117.51 121.50 3jvv h ILE 293 Ca 0.35 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.45 3jvv h ILE 293 Cb 0.51 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 38.07 3jvv h ILE 293 CO -0.39 0.21 0.27 -0.09 0.00 0.00 0.00 178.15 178.16 3jvv h ARG 294 N -0.06 0.86 -0.00 2.37 2.43 0.46 -2.24 114.38 118.19 3jvv h ARG 294 Ca 0.03 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 3jvv h ARG 294 Cb 0.32 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 3jvv h ARG 294 CO 0.00 0.71 -0.06 0.39 -1.51 0.00 0.00 179.97 179.50 3jvv n GLU 295 N -4.52 0.75 -3.00 0.20 1.02 0.22 -4.90 120.64 110.41 3jvv n GLU 295 Ca 0.04 -0.19 -0.12 0.00 -0.02 0.00 0.00 57.16 56.86 3jvv n GLU 295 Cb 0.13 -1.50 0.06 0.00 -0.02 0.00 0.00 31.44 30.12 3jvv n GLU 295 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3jvv n ASP 296 N -0.96 -2.47 -1.09 1.62 -0.08 -0.73 -4.94 116.55 107.91 3jvv n ASP 296 Ca 0.16 -0.41 0.02 0.00 -1.51 0.00 0.00 54.79 53.05 3jvv n ASP 296 Cb 0.25 -3.60 0.13 0.00 2.34 0.00 0.00 41.12 40.24 3jvv n ASP 296 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 3jvv n LYS 297 N -3.17 1.44 0.02 -0.67 5.02 0.11 -4.84 118.16 116.06 3jvv n LYS 297 Ca -0.16 -3.10 0.22 0.00 -2.02 0.00 0.00 58.31 53.25 3jvv n LYS 297 Cb 0.60 -1.30 0.73 0.00 -0.02 0.00 0.00 35.03 35.04 3jvv n LYS 297 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 3jvv h VAL 298 N 2.82 0.54 -1.30 -0.18 3.04 -1.88 -0.59 116.25 118.70 3jvv h VAL 298 Ca -0.02 0.00 0.40 0.00 -1.01 0.00 0.00 66.70 66.07 3jvv h VAL 298 Cb 1.29 0.67 -0.11 0.00 -2.01 0.00 0.00 31.29 31.14 3jvv h VAL 298 CO 0.12 0.00 0.86 0.00 -1.01 0.00 0.00 177.57 177.53 3jvv h ALA 299 N 1.61 2.75 0.00 3.17 0.00 -1.92 0.54 119.26 125.41 3jvv h ALA 299 Ca 0.25 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3jvv h ALA 299 Cb 1.14 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3jvv h ALA 299 CO -0.00 -1.30 0.00 1.96 0.00 0.00 0.00 179.25 179.91 3jvv h GLN 300 N 0.14 0.00 -0.42 0.00 4.20 -1.51 -3.37 115.11 114.15 3jvv h GLN 300 Ca 0.76 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 59.45 3jvv h GLN 300 Cb 2.40 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 30.16 3jvv h GLN 300 CO -0.32 0.00 0.18 1.98 -0.67 0.00 0.00 178.83 180.00 3jvv h MET 301 N 0.00 0.58 -0.76 1.46 4.05 -0.08 -2.79 114.93 117.39 3jvv h MET 301 Ca 0.00 -0.07 0.14 0.00 -0.28 0.00 0.00 59.70 59.49 3jvv h MET 301 Cb 0.65 -0.11 -0.10 0.00 -0.80 0.00 0.00 31.60 31.24 3jvv h MET 301 CO 0.00 0.47 0.31 -0.92 0.23 0.00 0.00 176.91 177.00 3jvv h TYR 302 N 0.58 0.52 -0.14 1.39 5.03 -1.74 0.22 116.97 122.83 3jvv h TYR 302 Ca 0.15 0.04 -0.19 0.00 2.58 0.00 0.00 58.73 61.30 3jvv h TYR 302 Cb 0.10 -0.12 -0.00 0.00 1.55 0.00 0.00 36.73 38.26 3jvv h TYR 302 CO 0.00 0.06 -0.69 0.66 -1.32 0.00 0.00 178.16 176.88 3jvv h SER 303 N 0.45 0.68 -0.78 -2.11 4.64 -1.81 -2.26 113.55 112.36 3jvv h SER 303 Ca 0.42 -0.42 0.13 0.00 -0.47 0.00 0.00 61.79 61.44 3jvv h SER 303 Cb 0.63 -0.20 -0.05 0.00 -0.31 0.00 0.00 62.40 62.47 3jvv h SER 303 CO -0.40 1.18 0.51 0.00 -0.87 0.00 0.00 176.83 177.25 3jvv h ALA 304 N 0.82 1.94 -0.06 5.18 0.00 -0.86 0.14 119.26 126.42 3jvv h ALA 304 Ca -0.03 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3jvv h ALA 304 Cb 1.28 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 3jvv h ALA 304 CO 0.13 -0.13 0.00 0.82 0.00 0.00 0.00 179.25 180.08 3jvv h ILE 305 N 0.57 1.23 -1.01 0.00 2.04 -0.39 -2.64 117.51 117.31 3jvv h ILE 305 Ca 0.38 -0.72 0.24 0.00 1.00 0.00 0.00 64.86 65.76 3jvv h ILE 305 Cb 0.67 1.61 -0.11 0.00 -0.74 0.00 0.00 36.82 38.24 3jvv h ILE 305 CO -0.14 0.20 0.61 1.56 0.00 0.00 0.00 178.15 180.38 3jvv h GLN 306 N -0.17 0.56 -0.40 2.37 4.20 -0.24 0.43 115.11 121.85 3jvv h GLN 306 Ca 0.02 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.69 3jvv h GLN 306 Cb 0.31 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.96 3jvv h GLN 306 CO 0.00 0.37 0.00 0.25 -0.67 0.00 0.00 178.83 178.78 3jvv n THR 307 N -4.80 0.53 -1.02 -0.54 -2.24 0.09 -4.25 114.28 102.05 3jvv n THR 307 Ca 0.26 -0.57 -0.01 0.00 -2.27 0.00 0.00 64.05 61.46 3jvv n THR 307 Cb 0.74 0.36 0.32 0.00 -2.10 0.00 0.00 70.33 69.65 3jvv n THR 307 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3jvv n GLY 308 N 1.22 3.60 0.37 3.38 0.00 0.14 -4.66 105.19 109.23 3jvv n GLY 308 Ca 0.16 -1.00 0.11 0.00 0.00 0.00 0.00 46.02 45.29 3jvv n GLY 308 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3jvv h GLY 309 N 2.85 1.53 0.73 -0.02 0.00 -1.72 -1.80 103.07 104.63 3jvv h GLY 309 Ca 0.16 -0.36 0.11 0.00 0.00 0.00 0.00 47.33 47.24 3jvv h GLY 309 CO 0.60 0.06 0.55 1.48 0.00 0.00 0.00 176.54 179.23 3jvv h SER 310 N 0.81 0.71 0.25 0.19 4.64 -1.89 0.25 113.55 118.51 3jvv h SER 310 Ca 0.51 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 3jvv h SER 310 Cb 0.72 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3jvv h SER 310 CO -0.28 0.41 -0.08 0.18 -0.87 0.00 0.00 176.83 176.19 3jvv n LEU 311 N -4.53 0.55 0.00 5.97 4.77 -0.75 -4.91 117.00 118.11 3jvv n LEU 311 Ca 0.15 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 3jvv n LEU 311 Cb 0.35 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 3jvv n LEU 311 CO 0.31 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.08 3jvv n GLY 312 N 1.22 0.85 3.80 -0.72 0.00 0.88 -4.98 105.19 106.23 3jvv n GLY 312 Ca 0.17 -0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 3jvv n GLY 312 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3jvv s MET 313 N -0.66 2.82 -0.28 1.61 -1.94 -0.80 -4.86 119.30 115.19 3jvv s MET 313 Ca 0.00 1.12 -0.25 0.00 -1.71 0.00 0.00 55.69 54.85 3jvv s MET 313 Cb 0.00 -1.97 0.13 0.00 2.01 0.00 0.00 34.83 35.00 3jvv s MET 313 CO 0.00 -1.20 1.08 1.14 -0.01 0.00 0.00 175.02 176.03 3jvv s GLN 314 N -4.68 0.45 0.62 2.03 -2.07 -0.64 -4.08 119.66 111.28 3jvv s GLN 314 Ca 0.61 0.51 -0.12 0.00 -1.82 0.00 0.00 55.36 54.54 3jvv s GLN 314 Cb -0.16 0.22 -0.03 0.00 -1.09 0.00 0.00 33.01 31.94 3jvv s GLN 314 CO 0.50 -0.06 1.03 0.95 -1.32 0.00 0.00 175.29 176.39 3jvv s THR 315 N 0.14 4.44 0.15 3.63 -4.23 -1.26 -0.52 115.64 117.99 3jvv s THR 315 Ca 0.04 0.88 -0.23 0.00 -1.18 0.00 0.00 61.69 61.20 3jvv s THR 315 Cb -0.05 -3.69 0.02 0.00 1.34 0.00 0.00 72.50 70.13 3jvv s THR 315 CO -0.07 -0.94 1.63 0.25 -0.54 0.00 0.00 174.62 174.94 3jvv h LEU 316 N -0.14 -0.81 -0.80 4.79 7.12 -1.92 -2.00 115.31 121.54 3jvv h LEU 316 Ca -0.45 0.14 0.12 0.00 0.13 0.00 0.00 57.88 57.82 3jvv h LEU 316 Cb 1.20 0.38 -0.08 0.00 -0.53 0.00 0.00 40.66 41.62 3jvv h LEU 316 CO 0.60 -0.29 0.42 0.44 -0.13 0.00 0.00 178.44 179.48 3jvv h ASP 317 N -0.27 0.54 0.11 1.25 5.19 -1.92 -1.38 116.42 119.93 3jvv h ASP 317 Ca 0.13 0.07 0.02 0.00 -0.62 0.00 0.00 57.03 56.63 3jvv h ASP 317 Cb 0.47 -0.02 -0.03 0.00 0.18 0.00 0.00 39.33 39.94 3jvv h ASP 317 CO -0.38 0.27 -0.23 0.24 -3.12 0.00 0.00 179.24 176.02 3jvv h MET 318 N 0.65 -0.40 -1.00 3.56 2.86 -1.78 -2.06 114.93 116.76 3jvv h MET 318 Ca 0.42 0.03 0.10 0.00 -2.06 0.00 0.00 59.70 58.18 3jvv h MET 318 Cb 0.50 0.09 -0.08 0.00 0.06 0.00 0.00 31.60 32.18 3jvv h MET 318 CO -0.31 -0.27 0.63 0.00 1.06 0.00 0.00 176.91 178.02 3jvv h LEU 320 N 1.05 0.00 -0.16 0.00 3.38 -0.56 -1.11 115.31 117.92 3jvv h LEU 320 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.44 3jvv h LEU 320 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3jvv h LEU 320 CO -0.23 0.00 -0.03 0.29 0.09 0.00 0.00 178.44 178.56 3jvv n LYS 321 N -2.92 0.88 -0.14 1.13 5.02 0.20 -5.01 118.16 117.32 3jvv n LYS 321 Ca -0.02 -0.16 0.06 0.00 -2.02 0.00 0.00 58.31 56.17 3jvv n LYS 321 Cb 0.10 -1.50 0.18 0.00 -0.02 0.00 0.00 35.03 33.80 3jvv n LYS 321 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3jvv n GLY 322 N 1.15 0.33 3.61 0.72 0.00 -0.42 -5.13 105.19 105.45 3jvv n GLY 322 Ca 0.19 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 3jvv n GLY 322 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3jvv n SER 330 N 0.33 1.39 -0.30 1.61 2.88 -1.26 -5.17 113.62 113.09 3jvv n SER 330 Ca 0.11 1.08 0.06 0.00 -1.33 0.00 0.00 58.87 58.78 3jvv n SER 330 Cb 0.26 -1.35 0.20 0.00 -0.75 0.00 0.00 64.21 62.57 3jvv n SER 330 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 3jvv h ARG 331 N 1.71 0.71 0.28 -1.46 2.43 -1.98 0.33 114.38 116.41 3jvv h ARG 331 Ca -0.44 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 58.68 3jvv h ARG 331 Cb 1.33 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 3jvv h ARG 331 CO 0.58 0.47 -0.14 0.93 -1.51 0.00 0.00 179.97 180.30 3jvv h GLU 332 N 0.73 -0.37 -0.86 0.20 5.08 -2.00 0.12 114.58 117.48 3jvv h GLU 332 Ca 0.44 0.03 0.22 0.00 -1.00 0.00 0.00 59.36 59.05 3jvv h GLU 332 Cb 0.52 0.08 -0.14 0.00 0.50 0.00 0.00 28.75 29.72 3jvv h GLU 332 CO -0.31 -0.07 0.22 -0.91 -1.00 0.00 0.00 179.01 176.95 3jvv h ASN 333 N -0.67 -0.01 -0.10 1.42 4.21 -1.90 0.15 115.58 118.68 3jvv h ASN 333 Ca -0.04 0.19 0.02 0.00 1.21 0.00 0.00 56.30 57.68 3jvv h ASN 333 Cb 0.47 0.26 -0.02 0.00 -1.12 0.00 0.00 38.32 37.91 3jvv h ASN 333 CO 0.06 -0.14 -0.03 0.00 -1.29 0.00 0.00 177.43 176.03 3jvv h ALA 334 N 1.76 0.06 0.00 -0.83 0.00 0.15 -2.75 119.26 117.65 3jvv h ALA 334 Ca 0.53 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.40 3jvv h ALA 334 Cb 1.05 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3jvv h ALA 334 CO -0.64 -0.50 -0.37 0.00 0.00 0.00 0.00 179.25 177.74 3jvv h ARG 335 N -0.02 0.00 -0.94 0.00 2.47 0.18 -1.44 114.38 114.64 3jvv h ARG 335 Ca 0.05 0.00 0.23 0.00 -1.26 0.00 0.00 59.98 59.00 3jvv h ARG 335 Cb 0.09 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 28.35 3jvv h ARG 335 CO -0.11 0.37 0.63 1.49 0.56 0.00 0.00 179.97 182.91 3jvv h GLU 336 N 0.00 0.31 -0.28 0.04 4.81 -0.54 -2.75 114.58 116.17 3jvv h GLU 336 Ca -0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3jvv h GLU 336 Cb 0.67 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.98 3jvv h GLU 336 CO 0.05 0.21 0.00 1.63 -0.73 0.00 0.00 179.01 180.17 3jvv n LYS 337 N -4.48 2.49 -3.01 1.92 5.02 -0.58 -5.01 118.16 114.51 3jvv n LYS 337 Ca 0.20 -1.89 -0.38 0.00 -2.02 0.00 0.00 58.31 54.23 3jvv n LYS 337 Cb 0.80 -1.25 -0.06 0.00 -0.02 0.00 0.00 35.03 34.49 3jvv n LYS 337 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3jvv s ALA 338 N -0.98 3.41 0.22 7.82 0.00 -0.97 -4.94 121.76 126.31 3jvv s ALA 338 Ca 0.21 0.30 -0.09 0.00 0.00 0.00 0.00 51.96 52.37 3jvv s ALA 338 Cb 0.11 -2.92 0.17 0.00 0.00 0.00 0.00 23.12 20.48 3jvv s ALA 338 CO 0.15 0.30 1.87 -0.22 0.00 0.00 0.00 175.76 177.86 3jvv h LYS 339 N 3.83 1.07 -3.78 0.00 3.64 -1.93 -3.37 116.57 116.03 3jvv h LYS 339 Ca -0.47 -0.08 -0.64 0.00 -1.27 0.00 0.00 60.65 58.18 3jvv h LYS 339 Cb 1.20 -0.23 -0.40 0.00 -0.41 0.00 0.00 32.23 32.38 3jvv h LYS 339 CO 0.65 0.74 -0.68 0.42 -2.27 0.00 0.00 179.45 178.31 3jvv s ILE 340 N -6.04 2.23 0.07 2.00 1.01 -1.26 -5.09 121.20 114.11 3jvv s ILE 340 Ca -0.13 -2.78 -0.31 0.00 0.00 0.00 0.00 60.65 57.43 3jvv s ILE 340 Cb 0.15 -2.59 -0.08 0.00 0.01 0.00 0.00 42.46 39.95 3jvv s ILE 340 CO 0.79 -0.74 1.71 -2.16 0.00 0.00 0.00 174.94 174.55 3jvv s PRO 341 N 0.30 4.18 0.00 2.79 0.04 -1.26 -5.09 135.00 135.97 3jvv s PRO 341 Ca 0.15 2.39 0.00 0.00 0.04 0.00 0.00 61.00 63.57 3jvv s PRO 341 Cb -0.23 -3.67 0.00 0.00 0.04 0.00 0.00 34.50 30.64 3jvv s PRO 341 CO -0.04 -0.78 0.00 -0.85 0.04 0.00 0.00 177.00 175.37