#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vlr s ARG 40 N 0.00 2.58 0.82 5.55 0.52 -1.26 -5.10 118.95 122.06 1vlr s ARG 40 Ca 0.00 -1.27 -0.13 0.00 -0.52 0.00 0.00 55.73 53.81 1vlr s ARG 40 Cb 0.00 -2.34 0.08 0.00 0.52 0.00 0.00 34.95 33.21 1vlr s ARG 40 CO 0.00 0.34 1.13 1.28 0.02 0.00 0.00 175.30 178.07 1vlr n LEU 41 N -1.06 3.95 -0.51 2.53 4.77 -1.26 -4.89 117.00 120.53 1vlr n LEU 41 Ca -0.06 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.48 1vlr n LEU 41 Cb 0.59 -1.48 0.02 0.00 -2.33 0.00 0.00 43.42 40.22 1vlr n LEU 41 CO 0.42 -1.89 0.32 -0.81 -1.33 0.00 0.00 177.39 174.09 1vlr n PRO 42 N -3.17 1.20 -3.82 3.23 -0.04 -1.26 -4.79 135.00 126.36 1vlr n PRO 42 Ca 0.13 -0.17 -0.09 0.00 -0.04 0.00 0.00 63.50 63.33 1vlr n PRO 42 Cb 0.51 -1.47 0.02 0.00 -0.04 0.00 0.00 33.50 32.52 1vlr n PRO 42 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1vlr s PHE 43 N -1.21 0.16 0.27 0.54 -0.12 -1.26 -5.09 117.98 111.27 1vlr s PHE 43 Ca 0.03 -0.83 0.04 0.00 -0.05 0.00 0.00 56.93 56.11 1vlr s PHE 43 Cb 0.02 0.81 -0.03 0.00 -0.63 0.00 0.00 43.02 43.19 1vlr s PHE 43 CO 0.01 -1.57 0.21 -1.54 -0.05 0.00 0.00 175.22 172.28 1vlr s SER 44 N -3.08 1.03 -1.04 1.98 1.04 -1.26 -4.93 113.70 107.44 1vlr s SER 44 Ca 0.16 -1.60 -0.04 0.00 0.48 0.00 0.00 55.95 54.95 1vlr s SER 44 Cb -0.05 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.55 1vlr s SER 44 CO 0.12 -0.96 0.57 0.61 0.98 0.00 0.00 173.24 174.56 1vlr n GLY 45 N -0.47 -0.13 3.68 7.32 0.00 -1.26 -0.41 105.19 113.92 1vlr n GLY 45 Ca 0.05 -0.10 -0.45 0.00 0.00 0.00 0.00 46.02 45.52 1vlr n GLY 45 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1vlr n PHE 46 N -4.18 2.46 -4.35 1.61 7.35 -1.26 -4.35 117.46 114.75 1vlr n PHE 46 Ca -0.05 -0.08 -0.29 0.00 -0.76 0.00 0.00 57.45 56.27 1vlr n PHE 46 Cb 0.57 -2.70 -0.17 0.00 0.35 0.00 0.00 39.48 37.54 1vlr n PHE 46 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 1vlr s ARG 47 N 3.18 2.28 0.05 -4.13 1.81 0.39 -4.95 118.95 117.57 1vlr s ARG 47 Ca 0.86 -0.57 -0.30 0.00 -1.72 0.00 0.00 55.73 53.99 1vlr s ARG 47 Cb -0.57 -1.97 -0.08 0.00 -0.45 0.00 0.00 34.95 31.88 1vlr s ARG 47 CO 0.43 -0.11 1.65 0.08 -0.68 0.00 0.00 175.30 176.67 1vlr s VAL 48 N 1.12 3.14 -0.15 3.52 1.01 -1.26 -0.71 120.40 127.06 1vlr s VAL 48 Ca -0.03 0.53 -0.14 0.00 0.00 0.00 0.00 61.98 62.34 1vlr s VAL 48 Cb -0.14 -3.34 -0.23 0.00 0.00 0.00 0.00 36.38 32.66 1vlr s VAL 48 CO -0.04 -0.01 0.32 1.56 0.00 0.00 0.00 175.10 176.93 1vlr h GLN 49 N 8.55 0.16 -1.85 2.72 1.08 -0.27 -3.47 115.11 122.03 1vlr h GLN 49 Ca -0.42 -0.27 -0.01 0.00 -1.45 0.00 0.00 58.65 56.50 1vlr h GLN 49 Cb 1.20 0.10 -0.22 0.00 -0.05 0.00 0.00 27.48 28.51 1vlr h GLN 49 CO 0.93 1.13 0.28 0.21 -0.95 0.00 0.00 178.83 180.43 1vlr s LYS 50 N -2.47 0.79 -0.46 1.46 2.20 -1.01 -5.03 119.74 115.21 1vlr s LYS 50 Ca -0.25 0.58 -0.27 0.00 -0.36 0.00 0.00 55.97 55.67 1vlr s LYS 50 Cb 0.06 0.38 0.03 0.00 -1.51 0.00 0.00 37.83 36.79 1vlr s LYS 50 CO 0.70 -0.17 1.05 0.08 -0.36 0.00 0.00 175.35 176.65 1vlr s VAL 51 N -0.31 4.33 0.10 4.02 1.01 -1.26 -1.08 120.40 127.20 1vlr s VAL 51 Ca -0.03 1.05 -0.15 0.00 0.00 0.00 0.00 61.98 62.85 1vlr s VAL 51 Cb -0.03 -4.52 -0.07 0.00 0.00 0.00 0.00 36.38 31.75 1vlr s VAL 51 CO 0.02 -0.91 1.45 -0.07 0.00 0.00 0.00 175.10 175.59 1vlr h LEU 52 N 10.89 0.69 -7.00 3.92 3.38 -1.25 -3.46 115.31 122.49 1vlr h LEU 52 Ca -0.23 -0.43 -0.04 0.00 0.09 0.00 0.00 57.88 57.27 1vlr h LEU 52 Cb 1.07 -0.19 -0.21 0.00 0.09 0.00 0.00 40.66 41.42 1vlr h LEU 52 CO 1.08 0.97 0.17 -0.60 0.09 0.00 0.00 178.44 180.15 1vlr s ARG 53 N -4.52 0.87 0.04 1.13 3.52 -1.15 -0.50 118.95 118.35 1vlr s ARG 53 Ca -0.13 0.77 -0.03 0.00 -0.13 0.00 0.00 55.73 56.22 1vlr s ARG 53 Cb 0.09 0.42 -0.02 0.00 -1.56 0.00 0.00 34.95 33.87 1vlr s ARG 53 CO 0.81 -0.16 0.03 -1.83 -0.81 0.00 0.00 175.30 173.34 1vlr s GLU 54 N -0.05 0.55 -0.08 5.12 -1.05 -1.26 -0.56 118.70 121.36 1vlr s GLU 54 Ca -0.03 -0.89 -0.03 0.00 -0.15 0.00 0.00 54.97 53.87 1vlr s GLU 54 Cb -0.04 0.20 0.04 0.00 -0.44 0.00 0.00 34.13 33.90 1vlr s GLU 54 CO 0.03 -0.12 0.11 0.45 0.95 0.00 0.00 175.26 176.68 1vlr s SER 55 N -2.29 1.17 0.27 0.83 0.15 -0.15 -4.99 113.70 108.69 1vlr s SER 55 Ca -0.03 0.07 0.06 0.00 0.70 0.00 0.00 55.95 56.75 1vlr s SER 55 Cb 0.00 0.02 0.36 0.00 -1.71 0.00 0.00 66.02 64.69 1vlr s SER 55 CO -0.06 -0.26 1.63 0.00 1.20 0.00 0.00 173.24 175.75 1vlr h ALA 56 N 8.41 0.99 -0.15 5.45 0.00 -1.97 0.15 119.26 132.13 1vlr h ALA 56 Ca -0.13 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 1vlr h ALA 56 Cb 1.12 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1vlr h ALA 56 CO 0.17 0.67 0.06 -0.09 0.00 0.00 0.00 179.25 180.06 1vlr h ARG 57 N 0.15 0.22 -0.00 0.00 2.43 -1.97 -3.28 114.38 111.94 1vlr h ARG 57 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1vlr h ARG 57 Cb 0.98 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 1vlr h ARG 57 CO 0.08 0.32 -0.63 -0.25 -1.51 0.00 0.00 179.97 177.98 1vlr n ASP 58 N -4.87 0.85 -3.38 -3.80 8.00 -1.21 -4.99 116.55 107.16 1vlr n ASP 58 Ca -0.05 -0.68 -0.18 0.00 0.71 0.00 0.00 54.79 54.59 1vlr n ASP 58 Cb 0.12 0.50 0.07 0.00 -0.02 0.00 0.00 41.12 41.79 1vlr n ASP 58 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1vlr n LYS 59 N -1.27 -3.13 -3.93 -1.24 4.01 0.50 -4.74 118.16 108.36 1vlr n LYS 59 Ca 0.06 0.79 -0.10 0.00 -0.51 0.00 0.00 58.31 58.55 1vlr n LYS 59 Cb 0.35 -5.56 -0.11 0.00 -0.51 0.00 0.00 35.03 29.20 1vlr n LYS 59 CO 0.00 0.00 0.00 -1.50 -1.11 0.00 0.00 177.40 174.79 1vlr s ILE 60 N -3.42 0.09 -0.06 -0.18 2.07 -1.00 -1.54 121.20 117.16 1vlr s ILE 60 Ca 0.34 -0.72 -0.05 0.00 -1.41 0.00 0.00 60.65 58.81 1vlr s ILE 60 Cb -0.06 -0.30 0.02 0.00 0.13 0.00 0.00 42.46 42.26 1vlr s ILE 60 CO 0.76 -0.40 0.15 -0.51 -1.91 0.00 0.00 174.94 173.03 1vlr s ILE 61 N -1.25 -0.01 -0.21 2.00 2.07 -0.25 -0.98 121.20 122.57 1vlr s ILE 61 Ca -0.14 0.05 0.01 0.00 -1.41 0.00 0.00 60.65 59.16 1vlr s ILE 61 Cb -0.08 -0.22 0.03 0.00 0.13 0.00 0.00 42.46 42.32 1vlr s ILE 61 CO -0.00 0.02 -0.16 -0.36 -1.91 0.00 0.00 174.94 172.53 1vlr s PHE 62 N 0.37 2.93 -0.07 3.50 0.40 0.27 -1.00 117.98 124.38 1vlr s PHE 62 Ca -0.02 -1.79 0.03 0.00 -0.60 0.00 0.00 56.93 54.55 1vlr s PHE 62 Cb -0.04 -1.94 -0.02 0.00 0.51 0.00 0.00 43.02 41.53 1vlr s PHE 62 CO -0.02 -0.81 -0.17 -0.51 0.70 0.00 0.00 175.22 174.41 1vlr s LEU 63 N 1.25 2.55 -0.29 -0.37 1.43 0.62 -0.71 118.68 123.15 1vlr s LEU 63 Ca 0.01 -0.31 -0.12 0.00 -1.03 0.00 0.00 54.13 52.68 1vlr s LEU 63 Cb -0.15 -1.52 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 1vlr s LEU 63 CO -0.10 0.28 0.23 -2.28 0.23 0.00 0.00 176.35 174.70 1vlr s HIS 64 N -0.32 3.22 0.22 0.29 5.65 -0.24 -1.09 115.29 123.03 1vlr s HIS 64 Ca 0.02 0.10 0.11 0.00 0.25 0.00 0.00 55.06 55.54 1vlr s HIS 64 Cb -0.13 -2.43 -0.05 0.00 -1.18 0.00 0.00 32.58 28.80 1vlr s HIS 64 CO 0.02 -0.21 -0.22 0.20 -0.65 0.00 0.00 174.74 173.88 1vlr s GLY 65 N 1.74 1.73 -0.02 1.59 0.00 -0.30 0.50 107.32 112.57 1vlr s GLY 65 Ca 0.08 -1.70 -0.05 0.00 0.00 0.00 0.00 44.72 43.05 1vlr s GLY 65 CO 0.11 -1.75 0.21 0.54 0.00 0.00 0.00 173.10 172.21 1vlr s LYS 66 N -2.95 3.50 0.17 2.90 -0.14 0.11 -1.18 119.74 122.16 1vlr s LYS 66 Ca 0.23 -0.18 -0.00 0.00 -1.36 0.00 0.00 55.97 54.66 1vlr s LYS 66 Cb -0.07 -3.11 -0.04 0.00 -1.68 0.00 0.00 37.83 32.93 1vlr s LYS 66 CO 0.11 0.68 0.07 0.14 -0.76 0.00 0.00 175.35 175.59 1vlr s VAL 67 N -1.26 0.26 -1.59 3.17 -7.23 0.32 -0.46 120.40 113.60 1vlr s VAL 67 Ca 0.25 -1.96 -0.13 0.00 -1.81 0.00 0.00 61.98 58.34 1vlr s VAL 67 Cb -0.13 -2.24 0.10 0.00 0.56 0.00 0.00 36.38 34.68 1vlr s VAL 67 CO 0.15 -0.31 0.75 0.59 -0.31 0.00 0.00 175.10 175.97 1vlr n ASN 68 N -0.21 -2.91 -4.12 4.85 3.02 0.46 -2.35 115.26 113.99 1vlr n ASN 68 Ca -0.03 -0.96 -0.39 0.00 -0.03 0.00 0.00 54.58 53.17 1vlr n ASN 68 Cb 0.64 -3.09 -0.03 0.00 -0.61 0.00 0.00 39.78 36.69 1vlr n ASN 68 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1vlr n GLU 69 N -4.45 2.18 0.00 3.52 4.71 -1.26 -5.08 120.64 120.26 1vlr n GLU 69 Ca -0.03 -2.49 0.00 0.00 -0.01 0.00 0.00 57.16 54.63 1vlr n GLU 69 Cb 0.55 -3.35 0.00 0.00 -1.01 0.00 0.00 31.44 27.63 1vlr n GLU 69 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1vlr n GLU 77 N 7.48 0.00 -3.73 3.49 1.02 -0.99 -5.20 120.64 122.71 1vlr n GLU 77 Ca 0.49 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 57.29 1vlr n GLU 77 Cb 0.43 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.80 1vlr n GLU 77 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1vlr s ASP 78 N -2.64 6.51 0.04 1.62 1.01 -1.26 -0.52 116.67 121.42 1vlr s ASP 78 Ca 0.00 0.58 0.00 0.00 0.71 0.00 0.00 52.55 53.84 1vlr s ASP 78 Cb 0.00 -2.09 -0.03 0.00 1.01 0.00 0.00 42.92 41.81 1vlr s ASP 78 CO 0.00 0.20 -0.04 0.00 0.21 0.00 0.00 175.17 175.54 1vlr s ALA 79 N -1.38 0.33 -0.08 5.23 0.00 -0.32 -0.56 121.76 124.98 1vlr s ALA 79 Ca 0.31 -0.80 0.03 0.00 0.00 0.00 0.00 51.96 51.49 1vlr s ALA 79 Cb -0.13 0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.13 1vlr s ALA 79 CO 0.19 -0.19 -0.16 0.08 0.00 0.00 0.00 175.76 175.68 1vlr s VAL 80 N -2.12 2.82 -0.09 0.00 1.01 0.11 -1.15 120.40 120.99 1vlr s VAL 80 Ca -0.08 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.15 1vlr s VAL 80 Cb -0.05 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.21 1vlr s VAL 80 CO -0.03 0.56 -0.17 -0.69 0.00 0.00 0.00 175.10 174.77 1vlr s VAL 81 N -0.15 1.52 -0.15 2.92 1.01 -0.25 -0.19 120.40 125.12 1vlr s VAL 81 Ca -0.02 -0.69 0.02 0.00 0.00 0.00 0.00 61.98 61.29 1vlr s VAL 81 Cb -0.14 -1.36 0.01 0.00 0.00 0.00 0.00 36.38 34.90 1vlr s VAL 81 CO 0.04 0.44 -0.21 -0.63 0.00 0.00 0.00 175.10 174.73 1vlr s ILE 82 N 0.64 2.07 -0.06 2.22 1.01 0.36 -0.28 121.20 127.16 1vlr s ILE 82 Ca -0.14 -0.97 0.04 0.00 0.00 0.00 0.00 60.65 59.58 1vlr s ILE 82 Cb -0.16 -1.83 -0.02 0.00 0.01 0.00 0.00 42.46 40.45 1vlr s ILE 82 CO 0.04 0.55 -0.17 -0.76 0.00 0.00 0.00 174.94 174.60 1vlr s LEU 83 N 0.92 2.56 -0.04 2.97 1.02 -0.17 -0.76 118.68 125.19 1vlr s LEU 83 Ca -0.04 -0.29 -0.01 0.00 0.02 0.00 0.00 54.13 53.81 1vlr s LEU 83 Cb -0.15 -1.51 0.03 0.00 0.02 0.00 0.00 46.19 44.58 1vlr s LEU 83 CO -0.04 0.31 0.03 -0.70 0.02 0.00 0.00 176.35 175.96 1vlr s GLU 84 N -0.50 0.08 0.42 1.70 2.12 0.21 -1.09 118.70 121.64 1vlr s GLU 84 Ca 0.06 0.24 -0.25 0.00 0.36 0.00 0.00 54.97 55.38 1vlr s GLU 84 Cb -0.12 -0.48 -0.08 0.00 0.26 0.00 0.00 34.13 33.71 1vlr s GLU 84 CO 0.01 -0.24 1.28 0.15 -0.54 0.00 0.00 175.26 175.91 1vlr s LYS 85 N 1.62 3.89 0.32 4.30 -0.14 -0.59 -1.36 119.74 127.77 1vlr s LYS 85 Ca -0.02 2.08 -0.16 0.00 -1.36 0.00 0.00 55.97 56.52 1vlr s LYS 85 Cb -0.13 -2.67 -0.09 0.00 -1.68 0.00 0.00 37.83 33.26 1vlr s LYS 85 CO -0.03 -0.53 0.74 0.95 -0.76 0.00 0.00 175.35 175.72 1vlr s THR 86 N -1.31 4.66 0.77 2.17 -4.23 -1.26 -4.89 115.64 111.54 1vlr s THR 86 Ca 0.59 1.00 -0.14 0.00 -1.18 0.00 0.00 61.69 61.96 1vlr s THR 86 Cb -0.36 -3.64 0.06 0.00 1.34 0.00 0.00 72.50 69.90 1vlr s THR 86 CO 0.46 -0.15 1.22 -2.84 -0.54 0.00 0.00 174.62 172.77 1vlr s PRO 87 N -2.88 1.88 0.39 3.99 0.02 -1.26 -4.98 135.00 132.16 1vlr s PRO 87 Ca 0.53 1.79 -0.25 0.00 0.02 0.00 0.00 61.00 63.09 1vlr s PRO 87 Cb -0.11 -1.80 -0.09 0.00 0.02 0.00 0.00 34.50 32.53 1vlr s PRO 87 CO 0.18 -2.04 1.16 -0.06 -0.33 0.00 0.00 177.00 175.91 1vlr s PHE 88 N -2.02 3.10 -0.22 6.54 0.08 -1.26 -5.03 117.98 119.18 1vlr s PHE 88 Ca 0.74 1.56 -0.05 0.00 0.12 0.00 0.00 56.93 59.31 1vlr s PHE 88 Cb -0.30 -3.38 -0.02 0.00 -0.57 0.00 0.00 43.02 38.76 1vlr s PHE 88 CO 0.48 -1.25 -0.01 -0.65 -0.10 0.00 0.00 175.22 173.69 1vlr s GLN 89 N -2.26 3.50 0.37 0.44 -0.21 -1.26 -5.01 119.66 115.24 1vlr s GLN 89 Ca 0.56 -0.57 0.18 0.00 0.02 0.00 0.00 55.36 55.55 1vlr s GLN 89 Cb -0.30 -3.08 1.13 0.00 1.00 0.00 0.00 33.01 31.76 1vlr s GLN 89 CO 0.38 -0.13 1.69 0.28 -2.12 0.00 0.00 175.29 175.40 1vlr h VAL 90 N 5.58 0.35 0.00 1.09 2.07 -2.02 -1.08 116.25 122.24 1vlr h VAL 90 Ca -0.39 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.02 1vlr h VAL 90 Cb 1.17 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1vlr h VAL 90 CO 0.60 0.06 0.00 -1.84 0.02 0.00 0.00 177.57 176.41 1vlr n GLU 91 N -4.85 0.01 0.00 1.57 0.00 -1.26 -3.00 120.64 113.11 1vlr n GLU 91 Ca 0.31 0.20 0.05 0.00 0.00 0.00 0.00 57.16 57.71 1vlr n GLU 91 Cb 1.01 -1.52 -0.03 0.00 0.00 0.00 0.00 31.44 30.90 1vlr n GLU 91 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1vlr n HIS 92 N -1.54 0.00 -0.04 -1.84 8.25 -0.41 -4.71 115.22 114.94 1vlr n HIS 92 Ca 0.04 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.40 1vlr n HIS 92 Cb 0.21 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.36 1vlr n HIS 92 CO 0.00 0.00 0.00 -0.39 0.64 0.00 0.00 176.34 176.59 1vlr h VAL 93 N 0.49 1.30 -0.70 1.59 -1.51 -1.54 -0.79 116.25 115.09 1vlr h VAL 93 Ca 0.00 -1.66 -0.03 0.00 -1.23 0.00 0.00 66.70 63.78 1vlr h VAL 93 Cb 0.29 1.59 -0.03 0.00 -2.13 0.00 0.00 31.29 31.00 1vlr h VAL 93 CO 0.00 0.53 0.32 0.00 -1.23 0.00 0.00 177.57 177.19 1vlr h ALA 94 N 0.93 1.25 0.00 5.19 0.00 -1.84 -0.49 119.26 124.29 1vlr h ALA 94 Ca 0.03 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1vlr h ALA 94 Cb 1.01 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1vlr h ALA 94 CO 0.10 0.57 -0.33 -0.56 0.00 0.00 0.00 179.25 179.02 1vlr h GLN 95 N 0.99 0.00 -0.06 0.00 3.07 -1.72 0.99 115.11 118.38 1vlr h GLN 95 Ca 0.24 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.94 1vlr h GLN 95 Cb 0.13 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.68 1vlr h GLN 95 CO -0.03 0.33 -0.12 -0.07 0.09 0.00 0.00 178.83 179.03 1vlr h LEU 96 N 0.00 0.09 0.00 0.06 3.38 0.36 -3.27 115.31 115.92 1vlr h LEU 96 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1vlr h LEU 96 Cb 0.85 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1vlr h LEU 96 CO 0.04 0.22 -0.85 0.18 0.09 0.00 0.00 178.44 178.13 1vlr n LEU 97 N -4.34 0.48 -5.00 1.67 4.77 -0.74 -4.68 117.00 109.16 1vlr n LEU 97 Ca -0.02 -0.39 -0.18 0.00 -0.03 0.00 0.00 56.01 55.40 1vlr n LEU 97 Cb 0.22 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1vlr n LEU 97 CO 0.36 0.12 0.12 0.42 -1.33 0.00 0.00 177.39 177.09 1vlr s THR 98 N -2.40 3.15 0.00 -5.08 -4.23 0.27 -4.71 115.64 102.64 1vlr s THR 98 Ca 0.03 -1.03 0.00 0.00 -1.18 0.00 0.00 61.69 59.51 1vlr s THR 98 Cb 0.10 -3.06 0.00 0.00 1.34 0.00 0.00 72.50 70.87 1vlr s THR 98 CO 0.54 -0.03 0.00 0.61 -0.54 0.00 0.00 174.62 175.21 1vlr n GLY 99 N -1.79 0.44 2.54 3.99 0.00 -1.26 -4.02 105.19 105.08 1vlr n GLY 99 Ca 0.06 -0.75 -0.27 0.00 0.00 0.00 0.00 46.02 45.06 1vlr n GLY 99 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1vlr n SER 100 N 5.93 1.54 -4.74 1.61 7.64 -1.26 -5.10 113.62 119.24 1vlr n SER 100 Ca 0.00 -2.89 -0.37 0.00 1.01 0.00 0.00 58.87 56.62 1vlr n SER 100 Cb 0.00 -0.66 0.05 0.00 -1.01 0.00 0.00 64.21 62.59 1vlr n SER 100 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1vlr s PRO 101 N -1.10 2.90 -0.26 1.43 0.04 -1.26 -4.94 135.00 131.81 1vlr s PRO 101 Ca 0.32 2.02 -0.29 0.00 0.04 0.00 0.00 61.00 63.09 1vlr s PRO 101 Cb 0.05 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.60 1vlr s PRO 101 CO -0.14 -1.31 1.09 -2.00 0.04 0.00 0.00 177.00 174.67 1vlr s GLU 102 N -3.20 4.17 0.08 4.56 2.12 -1.26 -5.00 118.70 120.17 1vlr s GLU 102 Ca 0.77 1.29 0.04 0.00 0.36 0.00 0.00 54.97 57.43 1vlr s GLU 102 Cb -0.36 -3.70 -0.03 0.00 0.26 0.00 0.00 34.13 30.30 1vlr s GLU 102 CO 0.39 -0.76 -0.11 -0.51 -0.54 0.00 0.00 175.26 173.74 1vlr s LEU 103 N 3.45 2.34 -0.09 2.70 1.43 -1.26 -0.73 118.68 126.53 1vlr s LEU 103 Ca 0.46 -0.71 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 1vlr s LEU 103 Cb -0.15 -0.35 0.02 0.00 0.03 0.00 0.00 46.19 45.74 1vlr s LEU 103 CO 0.11 -0.19 -0.08 -0.75 0.23 0.00 0.00 176.35 175.66 1vlr s LYS 104 N -2.26 1.45 0.09 1.70 2.20 -0.12 -4.99 119.74 117.82 1vlr s LYS 104 Ca 0.01 -0.27 -0.30 0.00 -0.36 0.00 0.00 55.97 55.04 1vlr s LYS 104 Cb -0.06 -1.40 -0.05 0.00 -1.51 0.00 0.00 37.83 34.81 1vlr s LYS 104 CO 0.01 -0.14 1.00 -1.17 -0.36 0.00 0.00 175.35 174.69 1vlr s LEU 105 N 1.25 4.46 -0.15 5.43 2.96 -1.26 -0.60 118.68 130.77 1vlr s LEU 105 Ca -0.04 1.81 -0.01 0.00 -0.22 0.00 0.00 54.13 55.67 1vlr s LEU 105 Cb -0.14 -3.59 -0.09 0.00 0.50 0.00 0.00 46.19 42.88 1vlr s LEU 105 CO -0.03 -0.16 -0.15 0.00 -1.32 0.00 0.00 176.35 174.70 1vlr n GLN 106 N 3.07 0.36 -3.70 1.98 1.13 0.05 -4.91 117.38 115.35 1vlr n GLN 106 Ca 0.04 0.10 -0.14 0.00 -1.94 0.00 0.00 57.00 55.06 1vlr n GLN 106 Cb 0.49 -1.24 -0.09 0.00 0.11 0.00 0.00 30.24 29.52 1vlr n GLN 106 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 1vlr s PHE 107 N -2.29 -0.44 -0.15 1.08 5.36 -0.94 -4.98 117.98 115.62 1vlr s PHE 107 Ca -0.20 0.96 -0.07 0.00 -0.96 0.00 0.00 56.93 56.66 1vlr s PHE 107 Cb 0.06 0.18 0.07 0.00 -0.34 0.00 0.00 43.02 42.99 1vlr s PHE 107 CO 0.32 -0.33 0.34 -1.54 -1.46 0.00 0.00 175.22 172.56 1vlr s SER 108 N -0.36 -0.20 0.00 6.13 1.04 -1.26 -0.75 113.70 118.30 1vlr s SER 108 Ca -0.05 0.77 0.00 0.00 0.48 0.00 0.00 55.95 57.15 1vlr s SER 108 Cb -0.03 0.82 0.00 0.00 0.10 0.00 0.00 66.02 66.91 1vlr s SER 108 CO 0.03 -0.21 0.00 -0.46 0.98 0.00 0.00 173.24 173.58 1vlr n ASN 109 N 4.79 0.28 -0.04 7.02 0.23 -0.49 -5.01 115.26 122.04 1vlr n ASN 109 Ca -0.16 -0.23 -0.12 0.00 -0.53 0.00 0.00 54.58 53.53 1vlr n ASN 109 Cb 0.52 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.14 1vlr n ASN 109 CO 0.00 0.00 0.00 -2.24 -0.93 0.00 0.00 177.26 174.09 1vlr h ASP 110 N 0.00 -1.47 0.00 0.53 -0.00 -2.05 -3.35 116.42 110.08 1vlr h ASP 110 Ca 0.00 0.18 -0.02 0.00 -0.00 0.00 0.00 57.03 57.19 1vlr h ASP 110 Cb 0.00 0.58 -0.00 0.00 -0.00 0.00 0.00 39.33 39.91 1vlr h ASP 110 CO 0.00 -0.38 -1.49 2.30 -0.00 0.00 0.00 179.24 179.67 1vlr n ILE 111 N -4.93 0.08 -3.78 4.15 -5.35 -1.26 -5.00 119.36 103.27 1vlr n ILE 111 Ca -0.04 -0.26 -0.35 0.00 -0.27 0.00 0.00 62.75 61.83 1vlr n ILE 111 Cb 0.30 0.13 -0.09 0.00 -1.74 0.00 0.00 39.64 38.25 1vlr n ILE 111 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 1vlr s TYR 112 N -2.65 3.34 0.08 4.28 6.14 -1.26 -5.09 117.35 122.19 1vlr s TYR 112 Ca -0.04 0.22 0.02 0.00 0.64 0.00 0.00 57.07 57.91 1vlr s TYR 112 Cb 0.06 -2.17 -0.04 0.00 0.42 0.00 0.00 41.96 40.23 1vlr s TYR 112 CO 0.42 0.18 -0.07 -1.54 0.64 0.00 0.00 175.55 175.19 1vlr s SER 113 N 0.57 1.05 -0.02 4.32 1.04 -1.26 -1.39 113.70 118.00 1vlr s SER 113 Ca 0.07 -0.89 0.03 0.00 0.48 0.00 0.00 55.95 55.64 1vlr s SER 113 Cb -0.12 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.08 1vlr s SER 113 CO 0.00 -0.40 -0.10 0.42 0.98 0.00 0.00 173.24 174.14 1vlr s THR 114 N -3.05 0.86 0.21 2.02 -4.23 0.08 -4.99 115.64 106.54 1vlr s THR 114 Ca 0.06 -0.42 0.06 0.00 -1.18 0.00 0.00 61.69 60.22 1vlr s THR 114 Cb 0.01 -0.75 -0.05 0.00 1.34 0.00 0.00 72.50 73.05 1vlr s THR 114 CO -0.04 0.26 -0.10 -0.31 -0.54 0.00 0.00 174.62 173.89 1vlr s TYR 115 N 0.08 1.66 -0.19 3.99 1.51 -1.26 -0.77 117.35 122.36 1vlr s TYR 115 Ca -0.02 -0.68 -0.16 0.00 -1.01 0.00 0.00 57.07 55.21 1vlr s TYR 115 Cb -0.08 -0.85 -0.04 0.00 -0.11 0.00 0.00 41.96 40.89 1vlr s TYR 115 CO 0.00 0.24 0.41 -0.80 -1.11 0.00 0.00 175.55 174.30 1vlr s ASN 116 N -3.31 6.47 -0.17 2.29 0.01 0.23 -4.89 114.94 115.56 1vlr s ASN 116 Ca 0.24 0.55 -0.07 0.00 -0.71 0.00 0.00 52.86 52.87 1vlr s ASN 116 Cb 0.02 -2.24 -0.04 0.00 0.41 0.00 0.00 41.25 39.40 1vlr s ASN 116 CO 0.07 -0.07 0.07 -0.22 -1.51 0.00 0.00 177.10 175.44 1vlr s LEU 117 N 1.24 3.91 -0.52 0.60 2.96 -1.26 -0.94 118.68 124.66 1vlr s LEU 117 Ca 0.20 0.15 -0.06 0.00 -0.22 0.00 0.00 54.13 54.20 1vlr s LEU 117 Cb -0.15 -1.98 0.13 0.00 0.50 0.00 0.00 46.19 44.70 1vlr s LEU 117 CO 0.08 0.23 0.36 -0.36 -1.32 0.00 0.00 176.35 175.34 1vlr s PHE 118 N 0.05 3.49 0.69 5.38 0.08 0.10 -5.02 117.98 122.74 1vlr s PHE 118 Ca 0.06 -2.24 -0.15 0.00 0.12 0.00 0.00 56.93 54.72 1vlr s PHE 118 Cb -0.12 -3.38 0.01 0.00 -0.57 0.00 0.00 43.02 38.97 1vlr s PHE 118 CO 0.01 -0.95 1.16 -1.25 -0.10 0.00 0.00 175.22 174.09 1vlr s PRO 119 N 0.87 2.50 0.97 0.24 0.04 -1.26 -4.28 135.00 134.08 1vlr s PRO 119 Ca 0.10 1.61 -0.12 0.00 0.04 0.00 0.00 61.00 62.63 1vlr s PRO 119 Cb -0.23 -1.89 0.17 0.00 0.04 0.00 0.00 34.50 32.59 1vlr s PRO 119 CO -0.03 -1.52 1.09 -1.25 0.04 0.00 0.00 177.00 175.32 1vlr s PRO 120 N -3.92 0.67 0.18 0.56 0.04 -1.26 -4.80 135.00 126.47 1vlr s PRO 120 Ca 0.71 0.74 -0.13 0.00 0.04 0.00 0.00 61.00 62.37 1vlr s PRO 120 Cb -0.26 -1.75 0.15 0.00 0.04 0.00 0.00 34.50 32.69 1vlr s PRO 120 CO 0.42 -2.63 1.77 -0.09 0.04 0.00 0.00 177.00 176.52 1vlr h ARG 121 N -1.82 0.45 0.00 4.56 2.43 -1.98 -1.18 114.38 116.83 1vlr h ARG 121 Ca -0.53 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.62 1vlr h ARG 121 Cb 1.31 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1vlr h ARG 121 CO 0.55 0.30 0.00 -2.39 -1.51 0.00 0.00 179.97 176.91 1vlr n HIS 122 N -4.92 0.00 -1.46 2.20 1.44 -1.26 -1.70 115.22 109.53 1vlr n HIS 122 Ca 0.05 0.00 0.03 0.00 -2.01 0.00 0.00 57.72 55.79 1vlr n HIS 122 Cb 0.16 -0.45 0.20 0.00 0.12 0.00 0.00 29.99 30.01 1vlr n HIS 122 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1vlr n LEU 123 N -1.45 3.17 0.00 2.39 4.77 -0.47 -4.72 117.00 120.69 1vlr n LEU 123 Ca 0.05 -3.72 0.00 0.00 -0.03 0.00 0.00 56.01 52.31 1vlr n LEU 123 Cb 0.20 -0.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.74 1vlr n LEU 123 CO 0.16 1.24 0.13 -1.54 -1.33 0.00 0.00 177.39 176.06 1vlr n SER 124 N -1.13 0.53 -4.77 -1.43 3.41 -0.69 -4.72 113.62 104.82 1vlr n SER 124 Ca 0.23 -0.77 -0.34 0.00 -0.26 0.00 0.00 58.87 57.73 1vlr n SER 124 Cb 0.80 0.39 0.03 0.00 -0.26 0.00 0.00 64.21 65.17 1vlr n SER 124 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1vlr s ASP 125 N -0.39 5.34 -0.04 4.04 -4.77 -1.26 -5.04 116.67 114.56 1vlr s ASP 125 Ca 0.00 2.09 0.06 0.00 -3.30 0.00 0.00 52.55 51.39 1vlr s ASP 125 Cb 0.00 -2.57 -0.01 0.00 -1.09 0.00 0.00 42.92 39.26 1vlr s ASP 125 CO 0.00 -1.47 -0.21 -0.63 0.70 0.00 0.00 175.17 173.55 1vlr s ILE 126 N -2.08 1.75 -0.11 2.11 1.01 -1.26 -4.47 121.20 118.15 1vlr s ILE 126 Ca 0.70 -0.91 -0.30 0.00 0.00 0.00 0.00 60.65 60.14 1vlr s ILE 126 Cb -0.22 -1.48 -0.02 0.00 0.01 0.00 0.00 42.46 40.74 1vlr s ILE 126 CO 0.35 0.49 1.14 -0.75 0.00 0.00 0.00 174.94 176.17 1vlr s LYS 127 N -0.15 4.34 -0.08 2.79 2.20 -0.47 -4.88 119.74 123.49 1vlr s LYS 127 Ca -0.01 1.56 0.02 0.00 -0.36 0.00 0.00 55.97 57.17 1vlr s LYS 127 Cb -0.12 -3.59 0.02 0.00 -1.51 0.00 0.00 37.83 32.62 1vlr s LYS 127 CO 0.02 -0.47 -0.12 0.99 -0.36 0.00 0.00 175.35 175.41 1vlr s THR 128 N 2.46 1.19 -0.06 3.43 2.01 -1.26 -0.62 115.64 122.79 1vlr s THR 128 Ca 0.52 -0.48 0.04 0.00 0.31 0.00 0.00 61.69 62.08 1vlr s THR 128 Cb -0.21 -1.10 0.00 0.00 0.01 0.00 0.00 72.50 71.20 1vlr s THR 128 CO 0.18 0.37 -0.17 -0.89 -0.69 0.00 0.00 174.62 173.43 1vlr s THR 129 N 0.90 1.43 -0.09 -0.82 2.01 0.06 -4.98 115.64 114.14 1vlr s THR 129 Ca -0.10 -0.69 0.02 0.00 0.31 0.00 0.00 61.69 61.24 1vlr s THR 129 Cb -0.15 -1.25 0.01 0.00 0.01 0.00 0.00 72.50 71.13 1vlr s THR 129 CO 0.01 0.41 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.51 1vlr s VAL 130 N 0.26 1.44 -0.26 3.82 1.01 -1.26 -0.49 120.40 124.92 1vlr s VAL 130 Ca -0.09 -0.63 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 1vlr s VAL 130 Cb -0.14 -1.31 0.02 0.00 0.00 0.00 0.00 36.38 34.95 1vlr s VAL 130 CO 0.04 0.43 -0.01 -0.69 0.00 0.00 0.00 175.10 174.86 1vlr s VAL 131 N 0.80 3.28 -0.20 2.92 1.01 0.73 -4.98 120.40 123.97 1vlr s VAL 131 Ca -0.11 -0.85 -0.09 0.00 0.00 0.00 0.00 61.98 60.93 1vlr s VAL 131 Cb -0.16 -2.66 0.08 0.00 0.00 0.00 0.00 36.38 33.64 1vlr s VAL 131 CO 0.02 0.19 0.46 -0.47 0.00 0.00 0.00 175.10 175.29 1vlr s TYR 132 N 1.40 -0.76 0.35 5.22 5.04 -1.26 -0.71 117.35 126.62 1vlr s TYR 132 Ca 0.02 1.52 -0.26 0.00 -2.44 0.00 0.00 57.07 55.90 1vlr s TYR 132 Cb -0.17 0.35 -0.09 0.00 0.35 0.00 0.00 41.96 42.40 1vlr s TYR 132 CO -0.02 -0.43 1.07 -1.25 -1.34 0.00 0.00 175.55 173.58 1vlr s PRO 133 N 1.94 4.36 0.05 4.97 0.05 -1.26 -5.11 135.00 140.00 1vlr s PRO 133 Ca -0.07 1.64 -0.14 0.00 0.05 0.00 0.00 61.00 62.49 1vlr s PRO 133 Cb -0.10 -2.82 -0.06 0.00 0.05 0.00 0.00 34.50 31.57 1vlr s PRO 133 CO -0.14 0.01 0.44 0.00 0.05 0.00 0.00 177.00 177.36 1vlr s ALA 134 N -1.44 3.68 0.53 8.56 0.00 0.28 -4.99 121.76 128.38 1vlr s ALA 134 Ca 0.52 -0.22 0.08 0.00 0.00 0.00 0.00 51.96 52.34 1vlr s ALA 134 Cb -0.26 -2.40 0.05 0.00 0.00 0.00 0.00 23.12 20.51 1vlr s ALA 134 CO 0.33 0.49 0.61 0.95 0.00 0.00 0.00 175.76 178.15 1vlr s THR 135 N -1.22 2.13 0.22 0.00 -4.23 -1.26 -4.49 115.64 106.79 1vlr s THR 135 Ca 0.29 -1.18 -0.07 0.00 -1.18 0.00 0.00 61.69 59.54 1vlr s THR 135 Cb -0.16 -2.31 0.17 0.00 1.34 0.00 0.00 72.50 71.54 1vlr s THR 135 CO 0.16 0.00 1.81 -0.08 -0.54 0.00 0.00 174.62 175.97 1vlr h GLU 136 N 0.48 0.72 -0.56 3.99 4.57 -1.99 -1.59 114.58 120.20 1vlr h GLU 136 Ca -0.34 -0.04 0.10 0.00 -1.18 0.00 0.00 59.36 57.89 1vlr h GLU 136 Cb 1.29 -0.16 -0.08 0.00 -0.16 0.00 0.00 28.75 29.64 1vlr h GLU 136 CO 0.48 0.48 0.15 -0.22 -1.18 0.00 0.00 179.01 178.71 1vlr h LYS 137 N 0.75 0.28 -0.33 1.92 3.64 -1.99 0.58 116.57 121.42 1vlr h LYS 137 Ca 0.34 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.69 1vlr h LYS 137 Cb 0.24 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 1vlr h LYS 137 CO -0.21 0.19 0.14 0.45 -2.27 0.00 0.00 179.45 177.75 1vlr h HIS 138 N 0.29 0.49 -0.67 1.91 3.86 -1.78 0.83 115.15 120.08 1vlr h HIS 138 Ca 0.29 -0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.49 1vlr h HIS 138 Cb 0.39 -0.15 -0.04 0.00 1.06 0.00 0.00 27.41 28.68 1vlr h HIS 138 CO -0.22 0.45 0.43 -0.07 0.86 0.00 0.00 177.93 179.38 1vlr h LEU 139 N 0.38 0.71 -0.87 2.43 3.38 -0.67 -2.08 115.31 118.60 1vlr h LEU 139 Ca 0.11 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 1vlr h LEU 139 Cb 0.16 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1vlr h LEU 139 CO -0.01 0.50 -0.05 1.56 0.09 0.00 0.00 178.44 180.53 1vlr h GLN 140 N 0.85 0.79 -0.44 1.13 1.08 -0.67 -1.63 115.11 116.22 1vlr h GLN 140 Ca 0.26 -0.23 0.06 0.00 -1.45 0.00 0.00 58.65 57.28 1vlr h GLN 140 Cb -0.02 -0.08 -0.05 0.00 -0.05 0.00 0.00 27.48 27.28 1vlr h GLN 140 CO -0.09 0.83 0.15 -0.22 -0.95 0.00 0.00 178.83 178.55 1vlr h LYS 141 N 0.73 0.31 0.00 1.46 3.64 -0.31 -3.18 116.57 119.22 1vlr h LYS 141 Ca 0.13 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1vlr h LYS 141 Cb 0.51 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1vlr h LYS 141 CO 0.03 0.21 -0.82 1.88 -2.27 0.00 0.00 179.45 178.48 1vlr h TYR 142 N 0.32 0.00 -3.18 1.91 0.05 -1.25 -3.47 116.97 111.36 1vlr h TYR 142 Ca 0.20 0.00 -0.57 0.00 0.05 0.00 0.00 58.73 58.41 1vlr h TYR 142 Cb 0.20 0.00 0.11 0.00 1.01 0.00 0.00 36.73 38.05 1vlr h TYR 142 CO -0.15 0.00 0.45 -0.12 -1.05 0.00 0.00 178.16 177.28 1vlr n MET 143 N -2.41 2.00 -1.75 4.88 1.56 -0.62 -4.17 117.12 116.61 1vlr n MET 143 Ca 0.02 0.70 -0.40 0.00 -0.27 0.00 0.00 57.70 57.75 1vlr n MET 143 Cb 0.50 -2.25 0.03 0.00 2.15 0.00 0.00 33.22 33.64 1vlr n MET 143 CO 0.00 0.00 0.00 2.89 -0.73 0.00 0.00 175.97 178.13 1vlr n ARG 144 N 0.59 2.05 -2.35 2.12 1.85 0.35 -4.93 116.66 116.34 1vlr n ARG 144 Ca 0.05 0.74 -0.38 0.00 -1.00 0.00 0.00 57.85 57.26 1vlr n ARG 144 Cb 0.35 -2.60 -0.03 0.00 -1.05 0.00 0.00 32.46 29.14 1vlr n ARG 144 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1vlr s GLN 145 N -2.57 4.17 -0.33 2.89 -0.21 -1.26 -5.02 119.66 117.33 1vlr s GLN 145 Ca 0.65 1.79 0.04 0.00 0.02 0.00 0.00 55.36 57.86 1vlr s GLN 145 Cb -0.44 -2.74 0.10 0.00 1.00 0.00 0.00 33.01 30.92 1vlr s GLN 145 CO 0.55 -0.21 0.04 0.34 -2.12 0.00 0.00 175.29 173.89 1vlr s ASP 146 N -1.14 4.75 0.13 5.90 2.15 -1.26 -5.10 116.67 122.09 1vlr s ASP 146 Ca 0.55 -2.09 0.04 0.00 0.43 0.00 0.00 52.55 51.49 1vlr s ASP 146 Cb -0.30 -1.63 -0.04 0.00 -0.30 0.00 0.00 42.92 40.66 1vlr s ASP 146 CO 0.38 -0.36 0.12 -0.76 -0.17 0.00 0.00 175.17 174.37 1vlr s LEU 147 N 0.92 3.82 0.02 -1.34 1.43 -1.26 -1.34 118.68 120.93 1vlr s LEU 147 Ca 0.09 -0.07 0.05 0.00 -1.03 0.00 0.00 54.13 53.17 1vlr s LEU 147 Cb -0.19 -2.46 -0.02 0.00 0.03 0.00 0.00 46.19 43.55 1vlr s LEU 147 CO -0.08 0.11 -0.15 -0.13 0.23 0.00 0.00 176.35 176.34 1vlr s ARG 148 N -2.83 1.05 0.21 1.70 1.81 0.39 -4.90 118.95 116.38 1vlr s ARG 148 Ca 0.30 -0.68 -0.28 0.00 -1.72 0.00 0.00 55.73 53.35 1vlr s ARG 148 Cb -0.11 -1.05 -0.08 0.00 -0.45 0.00 0.00 34.95 33.26 1vlr s ARG 148 CO 0.23 0.27 0.88 -1.17 -0.68 0.00 0.00 175.30 174.83 1vlr s LEU 149 N -0.85 4.62 -0.05 2.53 2.96 -1.26 -1.25 118.68 125.38 1vlr s LEU 149 Ca 0.03 1.83 0.06 0.00 -0.22 0.00 0.00 54.13 55.83 1vlr s LEU 149 Cb -0.07 -3.49 -0.01 0.00 0.50 0.00 0.00 46.19 43.12 1vlr s LEU 149 CO 0.01 0.17 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.35 1vlr s ILE 150 N -1.11 1.87 -0.47 6.68 -1.09 0.17 -4.96 121.20 122.29 1vlr s ILE 150 Ca 0.39 -0.96 -0.07 0.00 -2.23 0.00 0.00 60.65 57.78 1vlr s ILE 150 Cb -0.25 -1.58 0.12 0.00 -1.58 0.00 0.00 42.46 39.17 1vlr s ILE 150 CO 0.30 0.52 0.31 -0.13 -1.23 0.00 0.00 174.94 174.71 1vlr s ARG 151 N -0.10 2.35 -0.46 2.79 0.52 -1.26 -1.17 118.95 121.62 1vlr s ARG 151 Ca -0.04 -1.85 -0.22 0.00 -0.52 0.00 0.00 55.73 53.10 1vlr s ARG 151 Cb -0.13 -3.81 0.03 0.00 0.52 0.00 0.00 34.95 31.56 1vlr s ARG 151 CO 0.03 -1.16 0.75 -2.00 0.02 0.00 0.00 175.30 172.95 1vlr s GLU 152 N 1.17 3.35 0.95 3.54 2.12 -0.05 -4.91 118.70 124.87 1vlr s GLU 152 Ca 0.08 -0.23 -0.12 0.00 0.36 0.00 0.00 54.97 55.06 1vlr s GLU 152 Cb -0.24 -3.96 0.16 0.00 0.26 0.00 0.00 34.13 30.35 1vlr s GLU 152 CO -0.02 -1.13 1.10 0.95 -0.54 0.00 0.00 175.26 175.62 1vlr s THR 153 N 3.19 2.27 0.32 -1.70 -4.23 -1.26 -1.40 115.64 112.83 1vlr s THR 153 Ca 0.27 0.09 0.01 0.00 -1.18 0.00 0.00 61.69 60.88 1vlr s THR 153 Cb -0.13 -2.61 0.19 0.00 1.34 0.00 0.00 72.50 71.29 1vlr s THR 153 CO 0.21 -0.12 1.89 1.23 -0.54 0.00 0.00 174.62 177.30 1vlr h GLY 154 N -1.73 0.80 1.26 3.99 0.00 -1.70 -0.66 103.07 105.03 1vlr h GLY 154 Ca -0.52 -0.41 -0.15 0.00 0.00 0.00 0.00 47.33 46.25 1vlr h GLY 154 CO 0.57 0.39 -0.38 -0.55 0.00 0.00 0.00 176.54 176.58 1vlr h ASP 155 N 0.73 0.87 -0.82 0.19 3.32 -1.89 -1.76 116.42 117.06 1vlr h ASP 155 Ca 0.17 -0.39 0.09 0.00 0.02 0.00 0.00 57.03 56.93 1vlr h ASP 155 Cb 0.19 -0.24 -0.07 0.00 0.22 0.00 0.00 39.33 39.42 1vlr h ASP 155 CO -0.01 1.14 0.47 0.44 -1.72 0.00 0.00 179.24 179.56 1vlr h ASP 156 N 0.67 0.67 0.17 6.45 3.32 -1.75 0.16 116.42 126.11 1vlr h ASP 156 Ca 0.06 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1vlr h ASP 156 Cb 0.94 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1vlr h ASP 156 CO 0.09 0.38 -0.08 0.22 -1.72 0.00 0.00 179.24 178.13 1vlr h TYR 157 N 0.79 -0.21 -0.02 4.55 3.20 -0.91 0.67 116.97 125.04 1vlr h TYR 157 Ca 0.40 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 62.17 1vlr h TYR 157 Cb 0.37 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1vlr h TYR 157 CO -0.06 0.08 -0.40 0.07 -1.64 0.00 0.00 178.16 176.21 1vlr h ARG 158 N -0.50 0.04 0.00 1.82 0.11 -1.08 0.20 114.38 114.97 1vlr h ARG 158 Ca -0.02 -0.02 -0.28 0.00 0.10 0.00 0.00 59.98 59.76 1vlr h ARG 158 Cb 0.38 -0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.41 1vlr h ARG 158 CO 0.04 0.44 -1.81 0.25 0.10 0.00 0.00 179.97 178.98 1vlr n THR 159 N -4.05 1.46 0.02 0.08 -2.24 0.02 -4.42 114.28 105.16 1vlr n THR 159 Ca -0.02 -0.79 -0.02 0.00 -2.27 0.00 0.00 64.05 60.96 1vlr n THR 159 Cb 0.44 -0.85 -0.01 0.00 -2.10 0.00 0.00 70.33 67.82 1vlr n THR 159 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1vlr n ILE 160 N -2.94 1.23 0.00 2.28 2.08 0.18 -4.71 119.36 117.48 1vlr n ILE 160 Ca -0.19 0.33 -0.12 0.00 0.56 0.00 0.00 62.75 63.33 1vlr n ILE 160 Cb 1.03 -1.72 -0.08 0.00 -0.75 0.00 0.00 39.64 38.12 1vlr n ILE 160 CO 0.00 0.00 0.00 0.74 0.56 0.00 0.00 176.55 177.85 1vlr h THR 161 N -0.19 1.23 0.06 1.39 2.02 -1.06 -2.42 112.91 113.94 1vlr h THR 161 Ca -0.01 -0.68 -0.00 0.00 0.77 0.00 0.00 66.41 66.48 1vlr h THR 161 Cb 0.24 1.66 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 1vlr h THR 161 CO -0.00 0.18 -0.03 0.25 0.37 0.00 0.00 175.52 176.29 1vlr h LEU 162 N -0.25 -0.07 -1.32 2.58 5.85 -0.85 -0.23 115.31 121.02 1vlr h LEU 162 Ca 0.00 -0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.71 1vlr h LEU 162 Cb 0.29 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.29 1vlr h LEU 162 CO 0.00 0.05 0.52 -0.65 -0.34 0.00 0.00 178.44 178.02 1vlr h PRO 163 N -0.18 0.77 0.28 5.25 0.11 -1.77 0.15 132.00 136.61 1vlr h PRO 163 Ca -0.01 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 1vlr h PRO 163 Cb 0.16 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.10 1vlr h PRO 163 CO 0.01 0.51 -0.13 -0.92 -0.21 0.00 0.00 178.00 177.26 1vlr h TYR 164 N 0.79 -0.35 -0.78 0.65 3.20 -1.01 -2.69 116.97 116.78 1vlr h TYR 164 Ca 0.35 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.26 1vlr h TYR 164 Cb 0.34 0.12 -0.05 0.00 1.54 0.00 0.00 36.73 38.67 1vlr h TYR 164 CO -0.00 -0.21 0.49 -0.07 -1.64 0.00 0.00 178.16 176.73 1vlr h LEU 165 N -0.38 0.79 -2.34 2.82 3.38 -0.30 -1.57 115.31 117.69 1vlr h LEU 165 Ca -0.04 0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.96 1vlr h LEU 165 Cb 0.29 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 1vlr h LEU 165 CO 0.06 0.53 0.10 -0.33 0.09 0.00 0.00 178.44 178.89 1vlr h GLU 166 N 0.93 0.00 -0.00 1.13 5.08 -0.66 -2.21 114.58 118.84 1vlr h GLU 166 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 1vlr h GLU 166 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1vlr h GLU 166 CO -0.14 0.00 -0.02 0.43 -1.00 0.00 0.00 179.01 178.29 1vlr n SER 167 N -3.84 0.02 -4.59 1.42 7.64 -0.59 -4.85 113.62 108.83 1vlr n SER 167 Ca -0.01 0.44 -0.34 0.00 1.01 0.00 0.00 58.87 59.97 1vlr n SER 167 Cb 0.20 -0.46 -0.11 0.00 -1.01 0.00 0.00 64.21 62.82 1vlr n SER 167 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1vlr s GLN 168 N -2.98 3.30 0.41 1.43 -1.52 -0.83 -5.09 119.66 114.38 1vlr s GLN 168 Ca 0.15 -0.47 -0.26 0.00 -1.95 0.00 0.00 55.36 52.83 1vlr s GLN 168 Cb 0.19 -2.84 -0.08 0.00 -0.22 0.00 0.00 33.01 30.06 1vlr s GLN 168 CO 0.53 0.47 1.27 -1.12 -0.25 0.00 0.00 175.29 176.19 1vlr s SER 169 N -0.26 6.33 0.23 5.90 0.01 -1.26 -4.93 113.70 119.72 1vlr s SER 169 Ca 0.05 2.57 0.08 0.00 1.31 0.00 0.00 55.95 59.97 1vlr s SER 169 Cb -0.12 -2.63 0.22 0.00 0.21 0.00 0.00 66.02 63.69 1vlr s SER 169 CO 0.02 -0.83 1.53 -0.07 0.41 0.00 0.00 173.24 174.31 1vlr h LEU 170 N 2.63 0.07 -2.49 2.44 4.07 -1.98 -3.48 115.31 116.58 1vlr h LEU 170 Ca -0.49 -0.05 -0.42 0.00 0.08 0.00 0.00 57.88 57.00 1vlr h LEU 170 Cb 1.24 -0.02 0.07 0.00 1.08 0.00 0.00 40.66 43.03 1vlr h LEU 170 CO 0.62 0.75 -0.89 -0.24 -1.08 0.00 0.00 178.44 177.60 1vlr n SER 171 N -3.73 -3.38 -0.61 -0.43 2.88 -1.26 -4.72 113.62 102.36 1vlr n SER 171 Ca -0.01 -0.92 0.06 0.00 -1.33 0.00 0.00 58.87 56.66 1vlr n SER 171 Cb 0.68 -3.72 0.19 0.00 -0.75 0.00 0.00 64.21 60.61 1vlr n SER 171 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1vlr n ILE 172 N -4.15 1.99 0.23 2.46 -5.35 -1.26 -4.68 119.36 108.61 1vlr n ILE 172 Ca -0.19 -2.95 0.06 0.00 -0.27 0.00 0.00 62.75 59.41 1vlr n ILE 172 Cb 0.64 -0.14 0.56 0.00 -1.74 0.00 0.00 39.64 38.95 1vlr n ILE 172 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 1vlr h GLN 173 N 0.89 0.02 -0.33 6.28 5.75 -1.99 -0.87 115.11 124.85 1vlr h GLN 173 Ca -0.02 -0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 58.42 1vlr h GLN 173 Cb 1.07 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.60 1vlr h GLN 173 CO 0.01 0.11 -0.06 0.11 -2.65 0.00 0.00 178.83 176.35 1vlr h TRP 174 N 0.02 0.56 0.19 3.99 5.08 -1.99 0.11 115.95 123.91 1vlr h TRP 174 Ca 0.00 -0.07 -0.01 0.00 1.08 0.00 0.00 58.89 59.89 1vlr h TRP 174 Cb 0.18 -0.16 0.00 0.00 -3.00 0.00 0.00 29.16 26.18 1vlr h TRP 174 CO 0.00 0.59 -0.09 0.28 -1.28 0.00 0.00 178.44 177.94 1vlr h VAL 175 N 0.50 0.87 -0.90 0.12 2.07 -1.53 -2.47 116.25 114.91 1vlr h VAL 175 Ca 0.10 -0.27 0.11 0.00 0.82 0.00 0.00 66.70 67.47 1vlr h VAL 175 Cb 0.42 1.03 -0.07 0.00 -1.52 0.00 0.00 31.29 31.15 1vlr h VAL 175 CO 0.02 0.06 0.58 1.88 0.02 0.00 0.00 177.57 180.13 1vlr h TYR 176 N -0.39 0.93 -0.57 1.57 0.05 -1.00 -1.19 116.97 116.38 1vlr h TYR 176 Ca -0.03 0.03 -0.06 0.00 0.05 0.00 0.00 58.73 58.72 1vlr h TYR 176 Cb 0.30 -0.30 -0.03 0.00 1.01 0.00 0.00 36.73 37.71 1vlr h TYR 176 CO -0.03 0.40 0.11 -0.91 -1.05 0.00 0.00 178.16 176.68 1vlr h ASN 177 N 0.84 0.85 -0.27 3.88 2.35 -0.64 0.15 115.58 122.73 1vlr h ASN 177 Ca 0.43 -0.17 -0.07 0.00 -0.55 0.00 0.00 56.30 55.94 1vlr h ASN 177 Cb 0.51 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 1vlr h ASN 177 CO -0.20 0.85 -0.11 0.40 -1.65 0.00 0.00 177.43 176.72 1vlr h ILE 178 N 0.86 1.29 -0.61 2.81 2.04 -0.79 0.25 117.51 123.37 1vlr h ILE 178 Ca 0.18 -1.18 -0.02 0.00 1.00 0.00 0.00 64.86 64.85 1vlr h ILE 178 Cb 0.35 1.48 -0.03 0.00 -0.74 0.00 0.00 36.82 37.89 1vlr h ILE 178 CO 0.00 0.37 0.31 -0.07 0.00 0.00 0.00 178.15 178.77 1vlr h LEU 179 N 0.30 0.76 -0.77 1.44 3.38 -0.72 -2.38 115.31 117.33 1vlr h LEU 179 Ca 0.06 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1vlr h LEU 179 Cb 0.61 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1vlr h LEU 179 CO 0.04 0.64 0.00 0.47 0.09 0.00 0.00 178.44 179.67 1vlr n ASP 180 N -4.37 1.18 -1.56 -0.43 8.00 0.48 -4.93 116.55 114.92 1vlr n ASP 180 Ca 0.06 -1.47 -0.16 0.00 0.71 0.00 0.00 54.79 53.93 1vlr n ASP 180 Cb 0.12 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 1vlr n ASP 180 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1vlr n LYS 181 N -0.05 -1.19 0.07 -1.24 4.76 -0.85 -4.90 118.16 114.76 1vlr n LYS 181 Ca 0.18 0.87 0.12 0.00 -2.87 0.00 0.00 58.31 56.61 1vlr n LYS 181 Cb 0.28 -5.16 0.05 0.00 -1.84 0.00 0.00 35.03 28.36 1vlr n LYS 181 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1vlr n LYS 182 N -2.52 0.44 -3.84 1.97 5.02 0.84 -4.73 118.16 115.34 1vlr n LYS 182 Ca -0.17 0.07 -0.12 0.00 -2.02 0.00 0.00 58.31 56.07 1vlr n LYS 182 Cb 0.59 -1.72 -0.12 0.00 -0.02 0.00 0.00 35.03 33.77 1vlr n LYS 182 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1vlr s ALA 183 N -3.27 -0.36 0.00 7.82 0.00 -0.90 -4.94 121.76 120.12 1vlr s ALA 183 Ca 0.02 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.22 1vlr s ALA 183 Cb 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.11 1vlr s ALA 183 CO 0.78 -0.12 0.00 0.39 0.00 0.00 0.00 175.76 176.81 1vlr n GLU 184 N 2.47 -1.06 -0.34 0.00 -0.58 -1.26 -4.09 120.64 115.78 1vlr n GLU 184 Ca -0.16 0.26 0.11 0.00 -0.42 0.00 0.00 57.16 56.95 1vlr n GLU 184 Cb 0.58 -4.09 0.29 0.00 -0.57 0.00 0.00 31.44 27.64 1vlr n GLU 184 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1vlr h ALA 185 N 0.00 1.55 0.00 0.62 0.00 -1.89 0.90 119.26 120.45 1vlr h ALA 185 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1vlr h ALA 185 Cb 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1vlr h ALA 185 CO 0.00 -0.04 0.00 -0.25 0.00 0.00 0.00 179.25 178.96 1vlr n ASP 186 N -4.79 0.50 0.07 0.00 9.92 -1.26 -2.35 116.55 118.64 1vlr n ASP 186 Ca 0.21 0.62 0.12 0.00 -0.53 0.00 0.00 54.79 55.21 1vlr n ASP 186 Cb 0.52 -0.73 0.19 0.00 -0.64 0.00 0.00 41.12 40.46 1vlr n ASP 186 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1vlr n ARG 187 N -2.05 0.29 -1.95 -1.24 1.74 0.31 -4.89 116.66 108.87 1vlr n ARG 187 Ca 0.03 0.10 -0.42 0.00 -0.77 0.00 0.00 57.85 56.78 1vlr n ARG 187 Cb 0.22 -1.70 -0.03 0.00 -1.02 0.00 0.00 32.46 29.93 1vlr n ARG 187 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1vlr s ILE 188 N -3.16 2.75 -0.14 0.55 1.01 -0.99 -4.30 121.20 116.93 1vlr s ILE 188 Ca 0.06 0.49 0.16 0.00 0.00 0.00 0.00 60.65 61.37 1vlr s ILE 188 Cb 0.13 -3.32 -0.24 0.00 0.01 0.00 0.00 42.46 39.05 1vlr s ILE 188 CO 0.71 0.03 0.32 0.52 0.00 0.00 0.00 174.94 176.53 1vlr n VAL 189 N 4.11 1.41 -3.67 2.92 0.31 0.19 -4.97 118.33 118.64 1vlr n VAL 189 Ca 0.14 -0.82 -0.14 0.00 -0.01 0.00 0.00 64.34 63.51 1vlr n VAL 189 Cb 0.39 -0.66 -0.08 0.00 -0.91 0.00 0.00 33.84 32.58 1vlr n VAL 189 CO 0.00 0.00 0.00 0.12 -1.32 0.00 0.00 176.83 175.63 1vlr s PHE 190 N -2.58 -0.55 -0.02 3.52 5.36 -1.20 -5.02 117.98 117.49 1vlr s PHE 190 Ca -0.08 1.26 0.00 0.00 -0.96 0.00 0.00 56.93 57.15 1vlr s PHE 190 Cb 0.07 0.22 0.02 0.00 -0.34 0.00 0.00 43.02 42.99 1vlr s PHE 190 CO 0.83 -0.35 0.00 -2.00 -1.46 0.00 0.00 175.22 172.24 1vlr s GLU 191 N -0.16 0.18 -0.38 10.12 2.12 -1.26 -0.42 118.70 128.91 1vlr s GLU 191 Ca -0.04 0.05 -0.11 0.00 0.36 0.00 0.00 54.97 55.24 1vlr s GLU 191 Cb -0.03 -0.33 0.03 0.00 0.26 0.00 0.00 34.13 34.06 1vlr s GLU 191 CO 0.03 -0.09 0.21 1.21 -0.54 0.00 0.00 175.26 176.08 1vlr s ASN 192 N 0.70 5.70 0.00 -1.70 3.84 0.30 -4.98 114.94 118.80 1vlr s ASN 192 Ca -0.07 -1.06 0.29 0.00 0.21 0.00 0.00 52.86 52.23 1vlr s ASN 192 Cb -0.10 -2.01 1.67 0.00 -0.55 0.00 0.00 41.25 40.27 1vlr s ASN 192 CO -0.01 -0.40 2.08 -0.81 -2.79 0.00 0.00 177.10 175.17 1vlr n PRO 193 N 4.98 1.07 -1.68 0.43 -0.04 -1.26 -0.87 135.00 137.62 1vlr n PRO 193 Ca -0.12 -0.10 -0.48 0.00 -0.04 0.00 0.00 63.50 62.76 1vlr n PRO 193 Cb 0.46 -1.46 -0.05 0.00 -0.04 0.00 0.00 33.50 32.41 1vlr n PRO 193 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1vlr n ASP 194 N -0.84 3.41 0.11 3.54 -0.08 -1.26 -4.86 116.55 116.56 1vlr n ASP 194 Ca 0.22 0.98 0.12 0.00 -1.51 0.00 0.00 54.79 54.59 1vlr n ASP 194 Cb 0.12 -1.37 0.46 0.00 2.34 0.00 0.00 41.12 42.67 1vlr n ASP 194 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1vlr n PRO 195 N 6.43 0.18 -0.12 -0.67 -0.04 -1.26 -0.20 135.00 139.31 1vlr n PRO 195 Ca 0.22 0.35 -0.23 0.00 -0.04 0.00 0.00 63.50 63.81 1vlr n PRO 195 Cb 0.29 -1.80 -0.09 0.00 -0.04 0.00 0.00 33.50 31.86 1vlr n PRO 195 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1vlr n SER 196 N -2.13 1.92 -0.28 3.54 7.64 -1.26 -3.27 113.62 119.77 1vlr n SER 196 Ca 0.03 0.39 0.07 0.00 1.01 0.00 0.00 58.87 60.37 1vlr n SER 196 Cb 0.26 -0.85 0.13 0.00 -1.01 0.00 0.00 64.21 62.74 1vlr n SER 196 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1vlr n ASP 197 N -4.36 2.64 -3.87 6.43 8.00 -1.23 -4.47 116.55 119.70 1vlr n ASP 197 Ca -0.39 -2.73 -0.17 0.00 0.71 0.00 0.00 54.79 52.22 1vlr n ASP 197 Cb 0.73 -0.34 0.01 0.00 -0.02 0.00 0.00 41.12 41.50 1vlr n ASP 197 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vlr n GLY 198 N -0.85 2.76 3.63 0.44 0.00 0.71 -4.45 105.19 107.43 1vlr n GLY 198 Ca 0.13 -2.25 -0.05 0.00 0.00 0.00 0.00 46.02 43.85 1vlr n GLY 198 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1vlr s PHE 199 N -1.74 -0.21 0.06 1.61 -0.71 -0.05 -1.53 117.98 115.41 1vlr s PHE 199 Ca 0.22 0.01 0.07 0.00 -1.04 0.00 0.00 56.93 56.20 1vlr s PHE 199 Cb -0.02 0.58 -0.03 0.00 -1.21 0.00 0.00 43.02 42.34 1vlr s PHE 199 CO 0.14 -0.61 -0.17 0.14 -1.34 0.00 0.00 175.22 173.38 1vlr s VAL 200 N -3.07 2.89 -0.22 -2.49 -7.23 -0.40 -0.54 120.40 109.35 1vlr s VAL 200 Ca 0.09 -1.25 -0.02 0.00 -1.81 0.00 0.00 61.98 58.99 1vlr s VAL 200 Cb -0.01 -2.26 0.01 0.00 0.56 0.00 0.00 36.38 34.68 1vlr s VAL 200 CO -0.04 0.26 -0.08 -0.22 -0.31 0.00 0.00 175.10 174.72 1vlr s LEU 201 N -1.68 2.82 -0.03 1.32 2.96 0.44 -0.59 118.68 123.92 1vlr s LEU 201 Ca 0.16 -0.58 0.03 0.00 -0.22 0.00 0.00 54.13 53.52 1vlr s LEU 201 Cb -0.11 -1.66 0.00 0.00 0.50 0.00 0.00 46.19 44.92 1vlr s LEU 201 CO 0.07 -0.05 -0.10 -0.51 -1.32 0.00 0.00 176.35 174.44 1vlr s ILE 202 N 1.40 0.91 0.59 6.68 2.07 0.08 -0.64 121.20 132.29 1vlr s ILE 202 Ca 0.04 -0.42 -0.19 0.00 -1.41 0.00 0.00 60.65 58.67 1vlr s ILE 202 Cb -0.15 -0.81 -0.04 0.00 0.13 0.00 0.00 42.46 41.60 1vlr s ILE 202 CO -0.06 0.28 1.22 -2.84 -1.91 0.00 0.00 174.94 171.63 1vlr s PRO 203 N 0.22 2.99 0.32 3.50 0.02 -1.26 -0.52 135.00 140.27 1vlr s PRO 203 Ca -0.04 1.87 -0.29 0.00 0.02 0.00 0.00 61.00 62.55 1vlr s PRO 203 Cb -0.10 -1.96 -0.11 0.00 0.02 0.00 0.00 34.50 32.35 1vlr s PRO 203 CO 0.01 -1.20 1.44 0.34 -0.33 0.00 0.00 177.00 177.26 1vlr s ASP 204 N -1.53 6.55 0.29 2.53 2.15 0.38 -4.81 116.67 122.24 1vlr s ASP 204 Ca 0.77 2.83 -0.01 0.00 0.43 0.00 0.00 52.55 56.57 1vlr s ASP 204 Cb -0.31 -2.65 0.44 0.00 -0.30 0.00 0.00 42.92 40.10 1vlr s ASP 204 CO 0.34 -0.74 1.90 0.25 -0.17 0.00 0.00 175.17 176.75 1vlr h LEU 205 N 3.92 0.83 0.00 -1.34 5.85 -1.93 -1.98 115.31 120.66 1vlr h LEU 205 Ca -0.48 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.15 1vlr h LEU 205 Cb 1.23 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.04 1vlr h LEU 205 CO 0.70 0.71 0.00 0.29 -0.34 0.00 0.00 178.44 179.80 1vlr n LYS 206 N -4.34 0.08 -2.27 1.25 5.02 -1.26 -4.81 118.16 111.83 1vlr n LYS 206 Ca 0.06 0.11 -0.43 0.00 -2.02 0.00 0.00 58.31 56.04 1vlr n LYS 206 Cb 0.13 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.62 1vlr n LYS 206 CO 0.00 0.00 0.00 -0.46 -0.52 0.00 0.00 177.40 176.42 1vlr s TRP 207 N -2.89 2.62 -0.59 2.13 -0.00 -0.75 -4.97 118.94 114.49 1vlr s TRP 207 Ca 0.13 0.75 -0.26 0.00 -0.00 0.00 0.00 56.10 56.72 1vlr s TRP 207 Cb 0.14 -3.65 0.04 0.00 -0.00 0.00 0.00 33.47 30.00 1vlr s TRP 207 CO 0.38 -2.44 1.08 1.21 -0.00 0.00 0.00 176.95 177.19 1vlr s ASN 208 N 2.31 6.35 0.00 5.86 3.84 -1.26 -4.91 114.94 127.12 1vlr s ASN 208 Ca 0.62 -0.23 0.17 0.00 0.21 0.00 0.00 52.86 53.63 1vlr s ASN 208 Cb -0.27 -2.50 0.98 0.00 -0.55 0.00 0.00 41.25 38.91 1vlr s ASN 208 CO 0.22 -1.42 1.42 0.00 -2.79 0.00 0.00 177.10 174.53 1vlr n GLN 209 N 8.11 0.48 0.20 0.43 6.02 -1.26 -0.92 117.38 130.44 1vlr n GLN 209 Ca 0.04 0.02 0.14 0.00 -0.01 0.00 0.00 57.00 57.20 1vlr n GLN 209 Cb 0.48 -1.50 0.57 0.00 1.02 0.00 0.00 30.24 30.81 1vlr n GLN 209 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 1vlr h GLN 210 N 0.00 0.00 -4.24 -1.09 1.08 -2.03 -3.39 115.11 105.44 1vlr h GLN 210 Ca 0.00 0.00 -0.66 0.00 -1.45 0.00 0.00 58.65 56.54 1vlr h GLN 210 Cb 0.02 0.00 -0.39 0.00 -0.05 0.00 0.00 27.48 27.06 1vlr h GLN 210 CO 0.00 0.00 -0.66 -0.65 -0.95 0.00 0.00 178.83 176.57 1vlr s GLN 211 N -3.47 1.74 0.59 1.46 -0.21 -0.10 -4.93 119.66 114.74 1vlr s GLN 211 Ca 0.03 -2.12 0.37 0.00 0.02 0.00 0.00 55.36 53.66 1vlr s GLN 211 Cb 0.09 -3.31 1.70 0.00 1.00 0.00 0.00 33.01 32.49 1vlr s GLN 211 CO 0.48 -1.02 2.11 -0.07 -2.12 0.00 0.00 175.29 174.67 1vlr h LEU 212 N 7.31 0.00 0.00 2.90 3.38 -1.82 -2.61 115.31 124.47 1vlr h LEU 212 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1vlr h LEU 212 Cb 0.98 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.73 1vlr h LEU 212 CO 0.60 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.60 1vlr n ASP 213 N -3.09 0.00 -1.04 -0.43 8.00 -1.26 -1.79 116.55 116.94 1vlr n ASP 213 Ca -0.01 0.41 0.08 0.00 0.71 0.00 0.00 54.79 55.98 1vlr n ASP 213 Cb 0.23 -0.46 0.27 0.00 -0.02 0.00 0.00 41.12 41.15 1vlr n ASP 213 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1vlr n ASP 214 N -1.46 4.07 -4.66 -2.24 8.00 -0.98 -3.75 116.55 115.53 1vlr n ASP 214 Ca 0.04 -2.83 -0.46 0.00 0.71 0.00 0.00 54.79 52.26 1vlr n ASP 214 Cb 0.17 -0.52 -0.04 0.00 -0.02 0.00 0.00 41.12 40.70 1vlr n ASP 214 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 1vlr n LEU 215 N -0.10 2.97 -3.30 0.64 0.00 -0.74 -4.82 117.00 111.65 1vlr n LEU 215 Ca 0.21 1.10 -0.04 0.00 0.00 0.00 0.00 56.01 57.28 1vlr n LEU 215 Cb 0.87 -1.41 -0.05 0.00 0.00 0.00 0.00 43.42 42.83 1vlr n LEU 215 CO 0.17 -0.40 0.03 -0.47 0.00 0.00 0.00 177.39 176.72 1vlr s TYR 216 N 0.64 -1.11 0.17 1.96 5.04 -1.25 -1.35 117.35 121.44 1vlr s TYR 216 Ca 0.77 1.22 0.08 0.00 -2.44 0.00 0.00 57.07 56.69 1vlr s TYR 216 Cb -0.69 0.25 -0.04 0.00 0.35 0.00 0.00 41.96 41.82 1vlr s TYR 216 CO 0.41 -0.76 -0.16 -0.51 -1.34 0.00 0.00 175.55 173.19 1vlr s LEU 217 N 2.67 2.46 -0.09 6.97 1.02 -0.07 -0.47 118.68 131.17 1vlr s LEU 217 Ca 0.14 -0.89 0.04 0.00 0.02 0.00 0.00 54.13 53.44 1vlr s LEU 217 Cb -0.15 -0.74 0.00 0.00 0.02 0.00 0.00 46.19 45.33 1vlr s LEU 217 CO -0.18 -0.09 -0.21 -0.63 0.02 0.00 0.00 176.35 175.26 1vlr s ILE 218 N -2.31 1.83 -0.20 -0.59 1.09 0.33 -0.25 121.20 121.09 1vlr s ILE 218 Ca 0.16 -0.89 -0.15 0.00 -1.10 0.00 0.00 60.65 58.68 1vlr s ILE 218 Cb -0.04 -1.59 -0.04 0.00 -1.06 0.00 0.00 42.46 39.73 1vlr s ILE 218 CO 0.06 0.51 0.35 0.00 -0.10 0.00 0.00 174.94 175.76 1vlr s ALA 219 N 0.40 3.57 -0.18 9.38 0.00 0.59 -0.74 121.76 134.78 1vlr s ALA 219 Ca -0.17 -0.58 -0.02 0.00 0.00 0.00 0.00 51.96 51.19 1vlr s ALA 219 Cb -0.17 -2.56 -0.01 0.00 0.00 0.00 0.00 23.12 20.37 1vlr s ALA 219 CO 0.07 -0.25 -0.09 0.42 0.00 0.00 0.00 175.76 175.92 1vlr s ILE 220 N 1.20 3.21 0.48 0.00 1.01 0.24 -0.52 121.20 126.83 1vlr s ILE 220 Ca 0.17 -0.57 -0.21 0.00 0.00 0.00 0.00 60.65 60.04 1vlr s ILE 220 Cb -0.14 -2.41 -0.08 0.00 0.01 0.00 0.00 42.46 39.84 1vlr s ILE 220 CO 0.07 0.47 1.08 0.00 0.00 0.00 0.00 174.94 176.56 1vlr h HIS 222 N 1.68 0.89 -3.25 0.00 3.86 -1.56 -3.45 115.15 113.32 1vlr h HIS 222 Ca -0.49 -0.18 -0.53 0.00 -1.16 0.00 0.00 60.37 58.01 1vlr h HIS 222 Cb 1.23 -0.22 0.07 0.00 1.06 0.00 0.00 27.41 29.55 1vlr h HIS 222 CO 0.55 0.90 0.84 0.50 0.86 0.00 0.00 177.93 181.58 1vlr s ARG 223 N -4.70 4.20 0.30 2.45 3.52 -1.20 -4.97 118.95 118.53 1vlr s ARG 223 Ca -0.09 2.43 -0.01 0.00 -0.13 0.00 0.00 55.73 57.93 1vlr s ARG 223 Cb 0.13 -3.08 -0.04 0.00 -1.56 0.00 0.00 34.95 30.40 1vlr s ARG 223 CO 0.83 -0.55 0.51 1.03 -0.81 0.00 0.00 175.30 176.32 1vlr s ARG 224 N -0.14 3.53 0.00 5.12 1.81 -1.26 -4.53 118.95 123.48 1vlr s ARG 224 Ca 0.63 -0.27 0.00 0.00 -1.72 0.00 0.00 55.73 54.37 1vlr s ARG 224 Cb -0.45 -2.70 0.00 0.00 -0.45 0.00 0.00 34.95 31.35 1vlr s ARG 224 CO 0.43 0.23 0.00 0.41 -0.68 0.00 0.00 175.30 175.68 1vlr n GLY 225 N -1.33 0.76 3.37 -3.53 0.00 -1.26 -5.02 105.19 98.17 1vlr n GLY 225 Ca -0.04 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.53 1vlr n GLY 225 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vlr s ILE 226 N -2.29 5.13 -0.08 -0.61 1.01 -1.26 -4.92 121.20 118.17 1vlr s ILE 226 Ca 0.00 -1.14 0.14 0.00 0.00 0.00 0.00 60.65 59.65 1vlr s ILE 226 Cb 0.00 -4.27 -0.09 0.00 0.01 0.00 0.00 42.46 38.11 1vlr s ILE 226 CO 0.00 -0.78 1.09 0.03 0.00 0.00 0.00 174.94 175.28 1vlr h ARG 227 N 8.89 0.00 0.00 2.79 3.08 -1.94 0.20 114.38 127.39 1vlr h ARG 227 Ca -0.29 0.00 0.24 0.00 0.07 0.00 0.00 59.98 60.00 1vlr h ARG 227 Cb 1.10 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.11 1vlr h ARG 227 CO 0.98 0.50 0.66 -1.13 -1.07 0.00 0.00 179.97 179.90 1vlr n SER 228 N -3.10 -0.97 -0.31 7.04 3.41 -1.26 -3.73 113.62 114.70 1vlr n SER 228 Ca -0.05 -1.26 0.25 0.00 -0.26 0.00 0.00 58.87 57.55 1vlr n SER 228 Cb 0.84 1.52 0.57 0.00 -0.26 0.00 0.00 64.21 66.89 1vlr n SER 228 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1vlr h LEU 229 N 0.00 0.33 -2.47 1.04 3.38 -1.94 -1.13 115.31 114.52 1vlr h LEU 229 Ca -0.17 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1vlr h LEU 229 Cb 0.90 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 1vlr h LEU 229 CO 0.24 0.07 -0.03 0.03 0.09 0.00 0.00 178.44 178.84 1vlr h ARG 230 N 0.29 0.00 -0.01 1.13 2.47 -1.94 -1.36 114.38 114.96 1vlr h ARG 230 Ca 0.57 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.29 1vlr h ARG 230 Cb 1.64 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.96 1vlr h ARG 230 CO -0.22 0.03 -0.26 -0.25 0.56 0.00 0.00 179.97 179.83 1vlr n ASP 231 N -3.50 0.77 -4.71 7.04 8.00 -0.43 -4.50 116.55 119.23 1vlr n ASP 231 Ca -0.03 -0.66 -0.42 0.00 0.71 0.00 0.00 54.79 54.39 1vlr n ASP 231 Cb 0.12 0.08 -0.03 0.00 -0.02 0.00 0.00 41.12 41.28 1vlr n ASP 231 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1vlr s LEU 232 N -2.60 4.35 0.36 0.64 1.43 -0.51 -5.00 118.68 117.35 1vlr s LEU 232 Ca 0.23 1.88 0.04 0.00 -1.03 0.00 0.00 54.13 55.24 1vlr s LEU 232 Cb 0.19 -3.57 -0.03 0.00 0.03 0.00 0.00 46.19 42.81 1vlr s LEU 232 CO 0.54 -0.44 0.15 0.42 0.23 0.00 0.00 176.35 177.26 1vlr s THR 233 N 1.28 0.48 0.64 5.49 -4.23 -1.26 -4.60 115.64 113.44 1vlr s THR 233 Ca 0.56 -2.00 0.35 0.00 -1.18 0.00 0.00 61.69 59.42 1vlr s THR 233 Cb -0.26 -2.45 0.37 0.00 1.34 0.00 0.00 72.50 71.50 1vlr s THR 233 CO 0.27 0.00 2.14 -0.65 -0.54 0.00 0.00 174.62 175.84 1vlr h PRO 234 N 1.99 0.00 -0.95 3.99 0.11 -1.89 0.66 132.00 135.92 1vlr h PRO 234 Ca -0.34 0.00 0.27 0.00 0.11 0.00 0.00 66.00 66.05 1vlr h PRO 234 Cb 1.26 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.33 1vlr h PRO 234 CO 0.54 0.00 0.68 1.49 -0.21 0.00 0.00 178.00 180.50 1vlr h GLU 235 N 0.00 0.01 -0.02 1.05 4.57 -1.97 -1.94 114.58 116.28 1vlr h GLU 235 Ca 0.03 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1vlr h GLU 235 Cb 0.37 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1vlr h GLU 235 CO -0.00 0.01 -0.18 0.72 -1.18 0.00 0.00 179.01 178.38 1vlr n HIS 236 N -4.26 0.00 -0.20 0.92 8.25 0.22 -4.41 115.22 115.75 1vlr n HIS 236 Ca 0.20 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.61 1vlr n HIS 236 Cb 1.01 -0.01 0.05 0.00 1.12 0.00 0.00 29.99 32.16 1vlr n HIS 236 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1vlr h LEU 237 N 3.42 0.58 -0.96 2.41 3.38 -1.40 -0.73 115.31 122.01 1vlr h LEU 237 Ca 0.00 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.00 1vlr h LEU 237 Cb 0.83 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.40 1vlr h LEU 237 CO 0.00 0.41 0.63 -0.65 0.09 0.00 0.00 178.44 178.92 1vlr h PRO 238 N 0.71 1.20 -0.03 1.13 0.11 -1.79 0.20 132.00 133.53 1vlr h PRO 238 Ca 0.24 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 66.27 1vlr h PRO 238 Cb 0.02 -0.27 -0.00 0.00 0.11 0.00 0.00 31.00 30.86 1vlr h PRO 238 CO -0.10 0.79 0.01 1.25 -0.21 0.00 0.00 178.00 179.74 1vlr h LEU 239 N 1.23 0.04 -0.60 2.35 5.85 -1.66 -1.14 115.31 121.38 1vlr h LEU 239 Ca 0.37 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 1vlr h LEU 239 Cb -0.04 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 1vlr h LEU 239 CO -0.11 0.19 0.36 -0.07 -0.34 0.00 0.00 178.44 178.47 1vlr h LEU 240 N -0.11 0.72 -0.71 2.25 3.38 -0.66 -0.09 115.31 120.09 1vlr h LEU 240 Ca 0.01 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1vlr h LEU 240 Cb 0.16 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1vlr h LEU 240 CO -0.00 0.57 0.12 0.03 0.09 0.00 0.00 178.44 179.25 1vlr h ARG 241 N 0.81 1.11 -0.58 1.13 3.08 -0.56 -1.67 114.38 117.70 1vlr h ARG 241 Ca 0.21 -0.29 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 1vlr h ARG 241 Cb -0.02 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 1vlr h ARG 241 CO -0.04 1.01 0.05 -0.91 -1.07 0.00 0.00 179.97 179.00 1vlr h ASN 242 N 1.04 0.97 -0.10 7.04 2.35 -0.49 -1.27 115.58 125.13 1vlr h ASN 242 Ca 0.21 -0.28 0.02 0.00 -0.55 0.00 0.00 56.30 55.70 1vlr h ASN 242 Cb 0.42 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 1vlr h ASN 242 CO 0.01 1.01 -0.05 0.40 -1.65 0.00 0.00 177.43 177.15 1vlr h ILE 243 N 0.89 0.84 -0.03 2.81 2.04 -0.71 0.23 117.51 123.57 1vlr h ILE 243 Ca 0.17 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.03 1vlr h ILE 243 Cb 0.49 0.84 -0.00 0.00 -0.74 0.00 0.00 36.82 37.41 1vlr h ILE 243 CO 0.02 0.00 0.02 0.25 0.00 0.00 0.00 178.15 178.44 1vlr h LEU 244 N -0.04 0.04 0.39 1.44 5.85 -1.07 0.30 115.31 122.22 1vlr h LEU 244 Ca 0.06 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1vlr h LEU 244 Cb 0.13 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.15 1vlr h LEU 244 CO -0.12 0.11 -0.19 -0.09 -0.34 0.00 0.00 178.44 177.81 1vlr h ARG 245 N -0.03 -0.51 -0.08 1.25 2.43 -1.07 -2.40 114.38 113.97 1vlr h ARG 245 Ca 0.01 0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.09 1vlr h ARG 245 Cb 0.08 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 1vlr h ARG 245 CO -0.00 -0.20 -0.53 0.93 -1.51 0.00 0.00 179.97 178.65 1vlr h GLU 246 N -0.96 0.22 -0.29 0.20 5.08 -0.64 -1.37 114.58 116.83 1vlr h GLU 246 Ca -0.05 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.14 1vlr h GLU 246 Cb 0.54 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1vlr h GLU 246 CO 0.09 0.70 0.07 0.78 -1.00 0.00 0.00 179.01 179.65 1vlr h GLY 247 N 1.40 0.49 0.98 -3.84 0.00 -1.01 -0.57 103.07 100.52 1vlr h GLY 247 Ca 0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 1vlr h GLY 247 CO 0.08 0.29 0.26 1.46 0.00 0.00 0.00 176.54 178.63 1vlr h GLN 248 N 0.29 0.64 -0.68 4.80 4.20 -1.35 -1.99 115.11 121.03 1vlr h GLN 248 Ca 0.09 -0.07 0.07 0.00 0.06 0.00 0.00 58.65 58.79 1vlr h GLN 248 Cb 0.29 -0.13 -0.06 0.00 0.30 0.00 0.00 27.48 27.88 1vlr h GLN 248 CO 0.00 0.50 0.36 0.93 -0.67 0.00 0.00 178.83 179.96 1vlr h GLU 249 N 0.61 0.64 -0.58 1.46 5.08 -1.12 -0.17 114.58 120.50 1vlr h GLU 249 Ca 0.16 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.38 1vlr h GLU 249 Cb 0.04 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 1vlr h GLU 249 CO -0.03 0.42 -0.05 0.00 -1.00 0.00 0.00 179.01 178.35 1vlr h ALA 250 N 1.37 0.80 -0.33 3.43 0.00 -0.89 -0.68 119.26 122.96 1vlr h ALA 250 Ca 0.31 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1vlr h ALA 250 Cb 0.23 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1vlr h ALA 250 CO -0.20 0.67 -0.34 0.82 0.00 0.00 0.00 179.25 180.20 1vlr h ILE 251 N 0.96 1.28 -0.37 0.00 2.04 -0.98 -1.41 117.51 119.03 1vlr h ILE 251 Ca 0.16 -1.49 0.00 0.00 1.00 0.00 0.00 64.86 64.53 1vlr h ILE 251 Cb 0.62 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 38.07 1vlr h ILE 251 CO 0.04 0.49 0.24 0.25 0.00 0.00 0.00 178.15 179.17 1vlr h LEU 252 N 0.62 0.42 -0.36 1.44 5.85 -0.70 -0.20 115.31 122.38 1vlr h LEU 252 Ca 0.06 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 1vlr h LEU 252 Cb 0.87 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 1vlr h LEU 252 CO 0.08 0.30 0.14 0.50 -0.34 0.00 0.00 178.44 179.12 1vlr h LYS 253 N 0.50 0.53 0.25 1.25 3.64 -1.00 -1.06 116.57 120.67 1vlr h LYS 253 Ca 0.14 -0.10 -0.34 0.00 -1.27 0.00 0.00 60.65 59.08 1vlr h LYS 253 Cb -0.05 -0.09 0.04 0.00 -0.41 0.00 0.00 32.23 31.72 1vlr h LYS 253 CO -0.03 0.53 -1.52 -0.09 -2.27 0.00 0.00 179.45 176.07 1vlr h ARG 254 N 0.43 0.52 -0.00 1.90 9.65 -1.19 -3.39 114.38 122.30 1vlr h ARG 254 Ca 0.12 -0.89 0.00 0.00 -1.10 0.00 0.00 59.98 58.10 1vlr h ARG 254 Cb 0.20 0.33 0.00 0.00 -1.39 0.00 0.00 29.97 29.11 1vlr h ARG 254 CO -0.01 1.43 -0.12 0.66 2.80 0.00 0.00 179.97 184.73 1vlr n TYR 255 N -3.71 0.00 -1.54 2.20 4.01 -0.10 -4.99 117.16 113.03 1vlr n TYR 255 Ca -0.18 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.41 1vlr n TYR 255 Cb 1.10 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 40.07 1vlr n TYR 255 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1vlr n GLN 256 N -0.48 -1.08 -3.49 -0.72 1.13 -0.40 -4.99 117.38 107.35 1vlr n GLN 256 Ca 0.02 1.00 -0.39 0.00 -1.94 0.00 0.00 57.00 55.69 1vlr n GLN 256 Cb 0.10 -5.17 -0.10 0.00 0.11 0.00 0.00 30.24 25.17 1vlr n GLN 256 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1vlr s VAL 257 N -2.59 5.24 0.67 5.09 1.01 -1.24 -4.96 120.40 123.63 1vlr s VAL 257 Ca 0.00 0.26 -0.11 0.00 0.00 0.00 0.00 61.98 62.13 1vlr s VAL 257 Cb 0.00 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.73 1vlr s VAL 257 CO 0.00 0.16 1.05 0.42 0.00 0.00 0.00 175.10 176.73 1vlr s THR 258 N 1.89 4.21 0.42 3.92 -4.23 -1.26 -3.22 115.64 117.38 1vlr s THR 258 Ca 0.10 0.73 0.11 0.00 -1.18 0.00 0.00 61.69 61.45 1vlr s THR 258 Cb -0.16 -3.53 0.20 0.00 1.34 0.00 0.00 72.50 70.35 1vlr s THR 258 CO 0.11 -0.93 2.00 1.23 -0.54 0.00 0.00 174.62 176.49 1vlr h GLY 259 N -0.56 0.24 1.13 3.99 0.00 -1.96 -0.23 103.07 105.67 1vlr h GLY 259 Ca -0.44 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 46.77 1vlr h GLY 259 CO 0.58 0.11 0.00 2.09 0.00 0.00 0.00 176.54 179.33 1vlr n ASP 260 N -4.37 0.00 -1.36 0.19 5.75 -1.26 -1.82 116.55 113.69 1vlr n ASP 260 Ca -0.01 -0.53 0.11 0.00 -0.01 0.00 0.00 54.79 54.35 1vlr n ASP 260 Cb 0.19 -0.06 0.32 0.00 -1.03 0.00 0.00 41.12 40.54 1vlr n ASP 260 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1vlr n ARG 261 N -1.06 2.92 -5.21 0.11 1.74 -0.10 -4.98 116.66 110.08 1vlr n ARG 261 Ca 0.15 -2.68 -0.31 0.00 -0.77 0.00 0.00 57.85 54.24 1vlr n ARG 261 Cb 0.10 -1.61 -0.16 0.00 -1.02 0.00 0.00 32.46 29.77 1vlr n ARG 261 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1vlr s LEU 262 N -1.15 2.19 -0.31 0.55 1.43 -0.75 -0.83 118.68 119.80 1vlr s LEU 262 Ca 0.48 -0.43 -0.12 0.00 -1.03 0.00 0.00 54.13 53.03 1vlr s LEU 262 Cb 0.26 -1.39 -0.03 0.00 0.03 0.00 0.00 46.19 45.06 1vlr s LEU 262 CO 0.31 0.30 0.23 -0.60 0.23 0.00 0.00 176.35 176.82 1vlr s ARG 263 N -0.49 3.71 -0.21 1.70 3.52 0.17 -4.78 118.95 122.56 1vlr s ARG 263 Ca 0.06 -0.47 0.02 0.00 -0.13 0.00 0.00 55.73 55.21 1vlr s ARG 263 Cb -0.11 -3.74 0.04 0.00 -1.56 0.00 0.00 34.95 29.57 1vlr s ARG 263 CO 0.01 -0.33 -0.16 0.08 -0.81 0.00 0.00 175.30 174.08 1vlr s VAL 264 N 1.77 2.10 0.15 7.11 1.01 -1.26 -0.73 120.40 130.55 1vlr s VAL 264 Ca 0.07 -1.22 -0.17 0.00 0.00 0.00 0.00 61.98 60.66 1vlr s VAL 264 Cb -0.17 -2.03 0.04 0.00 0.00 0.00 0.00 36.38 34.22 1vlr s VAL 264 CO 0.11 0.31 0.47 -0.72 0.00 0.00 0.00 175.10 175.26 1vlr s TYR 265 N 1.21 -0.21 0.19 5.22 1.13 -0.13 -0.68 117.35 124.08 1vlr s TYR 265 Ca -0.01 -0.10 0.08 0.00 -1.41 0.00 0.00 57.07 55.63 1vlr s TYR 265 Cb -0.16 0.34 -0.04 0.00 -1.10 0.00 0.00 41.96 41.00 1vlr s TYR 265 CO -0.10 -0.79 -0.01 -0.51 -2.51 0.00 0.00 175.55 171.63 1vlr s LEU 266 N -2.82 3.26 0.02 -3.49 1.02 0.19 0.48 118.68 117.34 1vlr s LEU 266 Ca 0.05 -0.45 -0.07 0.00 0.02 0.00 0.00 54.13 53.68 1vlr s LEU 266 Cb 0.01 -1.90 -0.05 0.00 0.02 0.00 0.00 46.19 44.27 1vlr s LEU 266 CO -0.09 0.08 0.28 -1.00 0.02 0.00 0.00 176.35 175.64 1vlr s HIS 267 N -1.81 3.58 -0.06 0.29 3.76 -1.26 -0.61 115.29 119.18 1vlr s HIS 267 Ca 0.28 0.58 -0.02 0.00 -0.15 0.00 0.00 55.06 55.74 1vlr s HIS 267 Cb -0.09 -2.00 0.04 0.00 1.11 0.00 0.00 32.58 31.64 1vlr s HIS 267 CO 0.18 0.60 0.07 -0.47 -0.85 0.00 0.00 174.74 174.28 1vlr s TYR 268 N -1.31 0.06 0.44 1.40 5.04 0.16 -3.12 117.35 120.02 1vlr s TYR 268 Ca 0.28 0.20 -0.22 0.00 -2.44 0.00 0.00 57.07 54.89 1vlr s TYR 268 Cb -0.13 -0.50 -0.09 0.00 0.35 0.00 0.00 41.96 41.59 1vlr s TYR 268 CO 0.16 -0.24 1.03 -0.51 -1.34 0.00 0.00 175.55 174.65 1vlr s LEU 269 N 2.17 3.98 0.58 6.97 1.43 -1.26 -4.40 118.68 128.16 1vlr s LEU 269 Ca 0.05 1.93 -0.11 0.00 -1.03 0.00 0.00 54.13 54.96 1vlr s LEU 269 Cb -0.13 -4.41 -0.05 0.00 0.03 0.00 0.00 46.19 41.64 1vlr s LEU 269 CO -0.04 -0.59 0.99 -2.16 0.23 0.00 0.00 176.35 174.78 1vlr s PRO 270 N -2.92 3.65 0.36 1.29 0.04 -1.18 -4.96 135.00 131.27 1vlr s PRO 270 Ca 0.63 0.71 0.18 0.00 0.04 0.00 0.00 61.00 62.56 1vlr s PRO 270 Cb -0.17 -2.13 0.57 0.00 0.04 0.00 0.00 34.50 32.81 1vlr s PRO 270 CO 0.22 -0.47 1.68 0.77 0.04 0.00 0.00 177.00 179.24 1vlr h SER 271 N -0.04 0.00 -5.19 6.66 0.02 -1.98 -3.44 113.55 109.58 1vlr h SER 271 Ca -0.45 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.38 1vlr h SER 271 Cb 1.19 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.58 1vlr h SER 271 CO 0.62 0.39 -0.61 -0.72 -1.14 0.00 0.00 176.83 175.37 1vlr s TYR 272 N -3.47 0.40 -0.98 3.45 1.13 -1.26 -5.08 117.35 111.54 1vlr s TYR 272 Ca 0.01 -0.89 -0.01 0.00 -1.41 0.00 0.00 57.07 54.77 1vlr s TYR 272 Cb 0.10 -0.29 0.33 0.00 -1.10 0.00 0.00 41.96 41.00 1vlr s TYR 272 CO 0.69 -0.39 1.89 0.66 -2.51 0.00 0.00 175.55 175.88 1vlr n TYR 273 N 0.25 2.83 -3.67 -3.49 4.02 -1.26 -4.72 117.16 111.12 1vlr n TYR 273 Ca -0.15 -2.50 -0.18 0.00 -0.01 0.00 0.00 57.90 55.06 1vlr n TYR 273 Cb 0.61 -1.20 -0.16 0.00 -0.02 0.00 0.00 39.34 38.56 1vlr n TYR 273 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 1vlr s HIS 274 N -4.26 -0.11 0.03 -0.72 2.46 -1.24 -4.25 115.29 107.19 1vlr s HIS 274 Ca 0.43 0.51 -0.38 0.00 0.47 0.00 0.00 55.06 56.09 1vlr s HIS 274 Cb 0.26 -0.33 -0.17 0.00 -0.13 0.00 0.00 32.58 32.21 1vlr s HIS 274 CO -0.21 -0.25 1.38 -0.11 -2.47 0.00 0.00 174.74 173.08 1vlr n LEU 275 N 5.31 1.62 -3.83 8.88 7.94 0.69 -4.95 117.00 132.66 1vlr n LEU 275 Ca -0.04 1.12 -0.09 0.00 -1.11 0.00 0.00 56.01 55.88 1vlr n LEU 275 Cb 0.50 -1.16 -0.07 0.00 0.53 0.00 0.00 43.42 43.22 1vlr n LEU 275 CO 0.05 -1.03 -0.07 -1.38 -1.11 0.00 0.00 177.39 173.85 1vlr s HIS 276 N 0.88 0.09 -0.04 1.96 -3.43 -1.26 -3.19 115.29 110.30 1vlr s HIS 276 Ca 0.87 -0.45 0.04 0.00 -0.80 0.00 0.00 55.06 54.72 1vlr s HIS 276 Cb -1.00 -0.02 -0.00 0.00 -1.43 0.00 0.00 32.58 30.13 1vlr s HIS 276 CO 0.50 -0.53 -0.16 0.08 -2.00 0.00 0.00 174.74 172.64 1vlr s VAL 277 N -3.50 1.32 -0.16 -5.38 1.01 0.33 -4.63 120.40 109.38 1vlr s VAL 277 Ca 0.02 -0.66 -0.13 0.00 0.00 0.00 0.00 61.98 61.20 1vlr s VAL 277 Cb 0.03 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.24 1vlr s VAL 277 CO -0.09 0.38 0.28 -1.00 0.00 0.00 0.00 175.10 174.67 1vlr s HIS 278 N -0.02 3.46 -0.29 5.22 3.76 0.18 -0.30 115.29 127.30 1vlr s HIS 278 Ca -0.02 0.59 -0.02 0.00 -0.15 0.00 0.00 55.06 55.46 1vlr s HIS 278 Cb -0.10 -2.32 0.05 0.00 1.11 0.00 0.00 32.58 31.31 1vlr s HIS 278 CO 0.01 0.26 -0.01 -0.06 -0.85 0.00 0.00 174.74 174.09 1vlr s PHE 279 N 0.41 3.24 0.13 1.40 0.40 0.65 -0.95 117.98 123.26 1vlr s PHE 279 Ca 0.16 -1.83 0.06 0.00 -0.60 0.00 0.00 56.93 54.72 1vlr s PHE 279 Cb -0.13 -2.10 -0.04 0.00 0.51 0.00 0.00 43.02 41.26 1vlr s PHE 279 CO 0.04 -0.79 -0.14 0.95 0.70 0.00 0.00 175.22 175.97 1vlr s THR 280 N 1.26 1.40 0.29 0.64 -4.23 0.09 -0.89 115.64 114.19 1vlr s THR 280 Ca -0.05 -1.78 -0.30 0.00 -1.18 0.00 0.00 61.69 58.38 1vlr s THR 280 Cb -0.19 -1.61 -0.11 0.00 1.34 0.00 0.00 72.50 71.93 1vlr s THR 280 CO -0.01 -0.43 1.57 0.00 -0.54 0.00 0.00 174.62 175.21 1vlr s ALA 281 N -2.23 3.73 0.46 3.99 0.00 -0.45 0.45 121.76 127.70 1vlr s ALA 281 Ca 0.11 1.53 0.14 0.00 0.00 0.00 0.00 51.96 53.74 1vlr s ALA 281 Cb -0.04 -3.63 1.08 0.00 0.00 0.00 0.00 23.12 20.52 1vlr s ALA 281 CO 0.03 -0.95 2.04 1.25 0.00 0.00 0.00 175.76 178.13 1vlr h LEU 282 N 4.86 0.27 0.00 0.00 5.85 -1.29 -0.73 115.31 124.27 1vlr h LEU 282 Ca -0.47 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 1vlr h LEU 282 Cb 1.22 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.19 1vlr h LEU 282 CO 0.79 0.18 0.00 0.61 -0.34 0.00 0.00 178.44 179.68 1vlr n GLY 283 N -1.53 -0.96 3.52 3.75 0.00 -1.26 -4.67 105.19 104.04 1vlr n GLY 283 Ca 0.05 -0.16 -0.39 0.00 0.00 0.00 0.00 46.02 45.53 1vlr n GLY 283 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1vlr s PHE 284 N -2.00 3.20 -1.06 1.61 5.36 -0.28 -4.98 117.98 119.84 1vlr s PHE 284 Ca 0.38 -0.20 -0.21 0.00 -0.96 0.00 0.00 56.93 55.93 1vlr s PHE 284 Cb 0.17 -2.40 -0.09 0.00 -0.34 0.00 0.00 43.02 40.36 1vlr s PHE 284 CO 0.29 -0.32 1.93 0.39 -1.46 0.00 0.00 175.22 176.05 1vlr n GLU 285 N 5.05 1.81 -1.07 10.12 1.02 -1.26 -4.78 120.64 131.53 1vlr n GLU 285 Ca -0.14 -2.34 -0.30 0.00 -0.02 0.00 0.00 57.16 54.37 1vlr n GLU 285 Cb 0.50 -3.38 0.16 0.00 -0.02 0.00 0.00 31.44 28.70 1vlr n GLU 285 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1vlr s ALA 286 N 7.64 1.23 -0.06 0.62 0.00 -1.26 -4.86 121.76 125.07 1vlr s ALA 286 Ca 0.62 -0.04 -0.33 0.00 0.00 0.00 0.00 51.96 52.21 1vlr s ALA 286 Cb 0.06 -3.22 -0.11 0.00 0.00 0.00 0.00 23.12 19.85 1vlr s ALA 286 CO 0.11 -2.62 1.89 -2.30 0.00 0.00 0.00 175.76 172.84 1vlr n PRO 287 N -4.07 2.32 -2.62 0.00 -0.02 -1.26 -2.14 135.00 127.21 1vlr n PRO 287 Ca 0.07 0.85 -0.14 0.00 -2.02 0.00 0.00 63.50 62.26 1vlr n PRO 287 Cb 0.55 -2.72 0.02 0.00 -0.02 0.00 0.00 33.50 31.33 1vlr n PRO 287 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vlr n GLY 288 N 4.41 -0.11 0.27 -1.23 0.00 -1.26 -4.91 105.19 102.36 1vlr n GLY 288 Ca 0.22 -0.23 0.15 0.00 0.00 0.00 0.00 46.02 46.16 1vlr n GLY 288 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1vlr n SER 289 N -0.87 0.84 -4.73 1.61 3.41 -0.91 -3.32 113.62 109.65 1vlr n SER 289 Ca -0.10 -1.25 -0.33 0.00 -0.26 0.00 0.00 58.87 56.93 1vlr n SER 289 Cb 0.59 -0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.63 1vlr n SER 289 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1vlr s GLY 290 N -2.03 2.18 0.54 5.00 0.00 -1.26 -4.65 107.32 107.11 1vlr s GLY 290 Ca 0.41 0.74 0.21 0.00 0.00 0.00 0.00 44.72 46.09 1vlr s GLY 290 CO 0.36 1.14 2.15 -0.24 0.00 0.00 0.00 173.10 176.51 1vlr h VAL 291 N -0.49 0.82 0.00 1.40 3.04 -1.91 -0.42 116.25 118.70 1vlr h VAL 291 Ca -0.47 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.22 1vlr h VAL 291 Cb 1.28 0.96 0.00 0.00 -2.01 0.00 0.00 31.29 31.52 1vlr h VAL 291 CO 0.50 0.00 0.00 -1.84 -1.01 0.00 0.00 177.57 175.22 1vlr n GLU 292 N -4.31 0.89 0.00 4.17 0.00 -1.26 -4.17 120.64 115.96 1vlr n GLU 292 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.15 1vlr n GLU 292 Cb 0.16 -1.25 0.00 0.00 0.00 0.00 0.00 31.44 30.36 1vlr n GLU 292 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1vlr n ARG 293 N -0.75 0.00 -3.40 3.44 0.63 -0.56 -3.90 116.66 112.13 1vlr n ARG 293 Ca 0.10 0.00 -0.38 0.00 -0.92 0.00 0.00 57.85 56.65 1vlr n ARG 293 Cb 0.05 -0.49 -0.06 0.00 0.45 0.00 0.00 32.46 32.41 1vlr n ARG 293 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1vlr s ALA 294 N -1.00 3.61 -0.17 5.13 0.00 -0.27 -0.66 121.76 128.39 1vlr s ALA 294 Ca 0.00 -0.15 0.01 0.00 0.00 0.00 0.00 51.96 51.82 1vlr s ALA 294 Cb 0.00 -2.52 0.03 0.00 0.00 0.00 0.00 23.12 20.64 1vlr s ALA 294 CO 0.00 0.33 -0.12 -1.01 0.00 0.00 0.00 175.76 174.96 1vlr s HIS 295 N -0.63 2.31 0.24 0.00 3.76 0.22 -4.73 115.29 116.47 1vlr s HIS 295 Ca 0.26 -1.41 -0.30 0.00 -0.15 0.00 0.00 55.06 53.45 1vlr s HIS 295 Cb -0.17 -1.63 -0.10 0.00 1.11 0.00 0.00 32.58 31.79 1vlr s HIS 295 CO 0.14 -0.71 1.50 -0.51 -0.85 0.00 0.00 174.74 174.31 1vlr s LEU 296 N 1.44 4.37 0.21 0.89 1.43 -1.26 -0.63 118.68 125.12 1vlr s LEU 296 Ca 0.02 2.72 -0.09 0.00 -1.03 0.00 0.00 54.13 55.74 1vlr s LEU 296 Cb -0.14 -3.62 0.23 0.00 0.03 0.00 0.00 46.19 42.69 1vlr s LEU 296 CO -0.10 -0.78 1.81 0.25 0.23 0.00 0.00 176.35 177.77 1vlr h LEU 297 N 5.40 0.56 -1.21 1.79 5.85 -1.23 -0.28 115.31 126.19 1vlr h LEU 297 Ca -0.45 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.33 1vlr h LEU 297 Cb 1.21 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 42.11 1vlr h LEU 297 CO 0.81 0.37 0.55 0.00 -0.34 0.00 0.00 178.44 179.83 1vlr h ALA 298 N 1.34 1.49 -0.03 1.25 0.00 -1.91 -0.50 119.26 120.91 1vlr h ALA 298 Ca 0.29 -0.04 -0.23 0.00 0.00 0.00 0.00 54.91 54.93 1vlr h ALA 298 Cb 0.17 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.67 1vlr h ALA 298 CO -0.17 0.43 -0.92 0.37 0.00 0.00 0.00 179.25 178.95 1vlr h GLN 299 N 1.03 0.53 -0.42 0.00 4.15 -1.69 -2.24 115.11 116.47 1vlr h GLN 299 Ca 0.33 -0.53 0.06 0.00 0.77 0.00 0.00 58.65 59.29 1vlr h GLN 299 Cb 0.04 0.14 -0.05 0.00 0.21 0.00 0.00 27.48 27.82 1vlr h GLN 299 CO -0.10 1.16 0.10 0.28 -1.93 0.00 0.00 178.83 178.34 1vlr h VAL 300 N 0.31 0.81 -0.38 2.39 2.07 -0.59 0.21 116.25 121.08 1vlr h VAL 300 Ca -0.08 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.36 1vlr h VAL 300 Cb 1.55 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 1vlr h VAL 300 CO 0.17 0.04 0.24 0.40 0.02 0.00 0.00 177.57 178.44 1vlr h ILE 301 N 0.24 1.11 -0.27 4.57 2.04 -1.03 -1.87 117.51 122.29 1vlr h ILE 301 Ca 0.20 -0.21 -0.13 0.00 1.00 0.00 0.00 64.86 65.72 1vlr h ILE 301 Cb 0.23 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1vlr h ILE 301 CO -0.25 0.10 -0.38 -0.33 0.00 0.00 0.00 178.15 177.30 1vlr h GLU 302 N 0.51 0.61 -0.27 2.37 5.08 -0.90 -0.47 114.58 121.50 1vlr h GLU 302 Ca 0.14 -0.30 0.06 0.00 -1.00 0.00 0.00 59.36 58.26 1vlr h GLU 302 Cb -0.04 -0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.15 1vlr h GLU 302 CO -0.03 0.89 -0.12 -0.91 -1.00 0.00 0.00 179.01 177.83 1vlr h ASN 303 N 0.51 -0.42 -0.28 1.42 2.35 -0.37 0.49 115.58 119.28 1vlr h ASN 303 Ca 0.05 0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.86 1vlr h ASN 303 Cb 0.88 0.24 -0.02 0.00 0.05 0.00 0.00 38.32 39.47 1vlr h ASN 303 CO 0.08 -0.16 0.06 -0.07 -1.65 0.00 0.00 177.43 175.69 1vlr h LEU 304 N -0.09 0.50 -0.70 1.61 3.38 -0.92 0.13 115.31 119.23 1vlr h LEU 304 Ca 0.14 -0.08 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 1vlr h LEU 304 Cb 0.30 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1vlr h LEU 304 CO -0.33 0.53 -0.41 -0.33 0.09 0.00 0.00 178.44 177.99 1vlr h GLU 305 N 0.53 0.53 0.24 1.13 5.08 -0.40 -3.16 114.58 118.52 1vlr h GLU 305 Ca 0.12 -0.27 -0.33 0.00 -1.00 0.00 0.00 59.36 57.88 1vlr h GLU 305 Cb 0.25 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.54 1vlr h GLU 305 CO 0.00 0.85 -1.48 0.00 -1.00 0.00 0.00 179.01 177.38 1vlr s ASP 307 N -7.52 2.21 0.51 0.00 -1.08 0.00 -5.03 116.67 105.76 1vlr s ASP 307 Ca -0.09 -0.66 0.19 0.00 -0.52 0.00 0.00 52.55 51.47 1vlr s ASP 307 Cb 0.04 0.04 1.28 0.00 -1.46 0.00 0.00 42.92 42.82 1vlr s ASP 307 CO 0.94 -0.37 2.07 1.55 0.52 0.00 0.00 175.17 179.88 1vlr h PRO 308 N 8.36 0.07 -0.64 4.34 0.13 -1.79 -1.76 132.00 140.72 1vlr h PRO 308 Ca -0.17 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1vlr h PRO 308 Cb 1.11 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1vlr h PRO 308 CO 0.33 0.04 0.00 1.63 -0.23 0.00 0.00 178.00 179.77 1vlr n LYS 309 N -4.47 3.89 -0.25 0.86 5.02 -1.26 -4.37 118.16 117.58 1vlr n LYS 309 Ca 0.03 -2.93 0.01 0.00 -2.02 0.00 0.00 58.31 53.41 1vlr n LYS 309 Cb 0.31 -1.94 0.09 0.00 -0.02 0.00 0.00 35.03 33.47 1vlr n LYS 309 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1vlr h HIS 310 N 4.05 -0.34 0.00 2.13 2.76 -1.62 -0.53 115.15 121.60 1vlr h HIS 310 Ca 0.00 0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 1vlr h HIS 310 Cb 1.52 0.26 0.00 0.00 1.55 0.00 0.00 27.41 30.75 1vlr h HIS 310 CO 0.81 -0.30 -0.00 0.66 -1.30 0.00 0.00 177.93 177.79 1vlr n TYR 311 N -5.46 0.51 0.04 5.26 4.01 -1.26 -0.76 117.16 119.49 1vlr n TYR 311 Ca 0.10 0.15 0.03 0.00 -0.16 0.00 0.00 57.90 58.02 1vlr n TYR 311 Cb 0.38 -0.74 -0.08 0.00 -0.31 0.00 0.00 39.34 38.59 1vlr n TYR 311 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1vlr n GLN 312 N -1.92 0.62 -0.07 -0.72 3.00 -0.55 -4.53 117.38 113.21 1vlr n GLN 312 Ca 0.06 0.15 -0.14 0.00 -0.01 0.00 0.00 57.00 57.06 1vlr n GLN 312 Cb 0.39 -1.77 -0.14 0.00 0.00 0.00 0.00 30.24 28.72 1vlr n GLN 312 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 1vlr n GLN 313 N -2.77 0.68 -2.57 -1.09 6.02 -0.32 -4.45 117.38 112.88 1vlr n GLN 313 Ca -0.08 0.14 -0.30 0.00 -0.01 0.00 0.00 57.00 56.75 1vlr n GLN 313 Cb 0.76 -1.61 -0.02 0.00 1.02 0.00 0.00 30.24 30.39 1vlr n GLN 313 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1vlr s ARG 314 N -2.53 3.75 -0.05 -1.09 1.81 0.06 -4.00 118.95 116.89 1vlr s ARG 314 Ca -0.17 0.57 -0.28 0.00 -1.72 0.00 0.00 55.73 54.13 1vlr s ARG 314 Cb 0.07 -2.29 -0.03 0.00 -0.45 0.00 0.00 34.95 32.26 1vlr s ARG 314 CO 0.76 -0.19 0.92 0.99 -0.68 0.00 0.00 175.30 177.10 1vlr s THR 315 N -2.61 4.88 -0.01 0.02 2.01 -1.26 -3.88 115.64 114.79 1vlr s THR 315 Ca 0.53 1.91 0.01 0.00 0.31 0.00 0.00 61.69 64.45 1vlr s THR 315 Cb -0.10 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.12 1vlr s THR 315 CO 0.37 0.13 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.66 1vlr s LEU 316 N 1.31 3.48 -0.15 4.42 1.43 -0.50 -4.89 118.68 123.78 1vlr s LEU 316 Ca 0.47 -0.01 -0.00 0.00 -1.03 0.00 0.00 54.13 53.56 1vlr s LEU 316 Cb -0.19 -1.97 -0.01 0.00 0.03 0.00 0.00 46.19 44.05 1vlr s LEU 316 CO 0.23 0.29 -0.13 -0.89 0.23 0.00 0.00 176.35 176.08 1vlr s THR 317 N -1.05 2.91 0.26 5.49 2.01 -1.26 -0.87 115.64 123.12 1vlr s THR 317 Ca 0.19 -0.69 -0.11 0.00 0.31 0.00 0.00 61.69 61.38 1vlr s THR 317 Cb -0.11 -2.24 -0.00 0.00 0.01 0.00 0.00 72.50 70.15 1vlr s THR 317 CO 0.09 0.51 0.46 0.72 -0.69 0.00 0.00 174.62 175.71 1vlr s PHE 318 N 0.66 0.49 -0.01 4.92 -0.12 -0.31 -4.57 117.98 119.04 1vlr s PHE 318 Ca -0.07 -0.83 0.03 0.00 -0.05 0.00 0.00 56.93 56.01 1vlr s PHE 318 Cb -0.15 0.13 -0.03 0.00 -0.63 0.00 0.00 43.02 42.33 1vlr s PHE 318 CO 0.02 -1.00 -0.09 0.00 -0.05 0.00 0.00 175.22 174.10 1vlr s ALA 319 N -3.87 2.91 0.08 1.99 0.00 -1.25 0.46 121.76 122.08 1vlr s ALA 319 Ca 0.24 -1.02 0.04 0.00 0.00 0.00 0.00 51.96 51.22 1vlr s ALA 319 Cb -0.00 -1.07 -0.03 0.00 0.00 0.00 0.00 23.12 22.02 1vlr s ALA 319 CO 0.11 0.60 -0.12 -0.51 0.00 0.00 0.00 175.76 175.83 1vlr s LEU 320 N -1.26 2.33 0.60 0.00 1.43 -0.38 -4.86 118.68 116.53 1vlr s LEU 320 Ca 0.15 -0.69 -0.19 0.00 -1.03 0.00 0.00 54.13 52.38 1vlr s LEU 320 Cb -0.11 -0.42 -0.03 0.00 0.03 0.00 0.00 46.19 45.66 1vlr s LEU 320 CO 0.06 -0.15 1.23 -0.13 0.23 0.00 0.00 176.35 177.58 1vlr s ARG 321 N -2.12 2.94 0.53 1.70 0.52 -1.26 -0.46 118.95 120.79 1vlr s ARG 321 Ca 0.00 1.88 0.24 0.00 -0.52 0.00 0.00 55.73 57.33 1vlr s ARG 321 Cb -0.07 -1.94 1.48 0.00 0.52 0.00 0.00 34.95 34.94 1vlr s ARG 321 CO 0.02 -1.25 2.14 1.79 0.02 0.00 0.00 175.30 178.01 1vlr h THR 322 N 0.88 0.72 -0.30 0.02 1.35 -1.56 -0.93 112.91 113.09 1vlr h THR 322 Ca -0.51 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 1vlr h THR 322 Cb 1.30 1.17 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 1vlr h THR 322 CO 0.55 0.07 0.00 -0.90 -0.25 0.00 0.00 175.52 174.99 1vlr n ASP 323 N -3.97 2.11 -4.70 5.36 5.68 -1.26 -4.72 116.55 115.05 1vlr n ASP 323 Ca -0.03 -1.87 -0.42 0.00 -0.50 0.00 0.00 54.79 51.98 1vlr n ASP 323 Cb 0.16 -0.20 -0.03 0.00 -1.14 0.00 0.00 41.12 39.91 1vlr n ASP 323 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1vlr s ASP 324 N -1.31 6.93 0.55 -1.12 -1.08 -0.35 -4.89 116.67 115.39 1vlr s ASP 324 Ca 0.31 2.11 0.22 0.00 -0.52 0.00 0.00 52.55 54.67 1vlr s ASP 324 Cb 0.17 -2.57 1.46 0.00 -1.46 0.00 0.00 42.92 40.52 1vlr s ASP 324 CO 0.24 -0.61 2.15 -0.65 0.52 0.00 0.00 175.17 176.82 1vlr h PRO 325 N 7.18 0.00 -0.24 4.34 0.11 -1.90 -0.61 132.00 140.89 1vlr h PRO 325 Ca -0.40 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.61 1vlr h PRO 325 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1vlr h PRO 325 CO 0.86 0.00 -0.30 1.25 -0.21 0.00 0.00 178.00 179.60 1vlr h LEU 326 N 0.00 0.49 -0.46 2.35 5.85 -1.95 -1.72 115.31 119.88 1vlr h LEU 326 Ca 0.04 -0.18 -0.11 0.00 0.84 0.00 0.00 57.88 58.47 1vlr h LEU 326 Cb 0.20 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1vlr h LEU 326 CO -0.00 0.78 -0.14 0.25 -0.34 0.00 0.00 178.44 178.99 1vlr h LEU 327 N 0.42 0.93 -0.28 2.25 6.46 -1.42 0.15 115.31 123.82 1vlr h LEU 327 Ca 0.05 -0.37 0.05 0.00 -0.12 0.00 0.00 57.88 57.49 1vlr h LEU 327 Cb 0.74 -0.25 -0.05 0.00 -0.73 0.00 0.00 40.66 40.37 1vlr h LEU 327 CO 0.06 1.09 -0.04 -0.61 -0.62 0.00 0.00 178.44 178.31 1vlr h GLN 328 N 0.76 0.03 -0.09 1.25 5.75 -1.26 0.21 115.11 121.76 1vlr h GLN 328 Ca 0.11 -0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.61 1vlr h GLN 328 Cb 0.69 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.23 1vlr h GLN 328 CO 0.05 0.02 0.04 -0.07 -2.65 0.00 0.00 178.83 176.22 1vlr h LEU 329 N 0.03 0.13 -0.16 -2.39 3.38 -1.08 -2.73 115.31 112.49 1vlr h LEU 329 Ca 0.13 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1vlr h LEU 329 Cb 0.19 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1vlr h LEU 329 CO -0.26 0.24 0.01 -0.07 0.09 0.00 0.00 178.44 178.45 1vlr h LEU 330 N 0.00 0.26 -0.59 1.67 3.38 -0.84 -2.13 115.31 117.07 1vlr h LEU 330 Ca 0.03 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 1vlr h LEU 330 Cb 0.15 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1vlr h LEU 330 CO -0.00 0.49 0.24 -0.61 0.09 0.00 0.00 178.44 178.64 1vlr h GLN 331 N 0.03 0.88 -0.42 1.13 4.15 -1.01 0.26 115.11 120.13 1vlr h GLN 331 Ca 0.05 -0.16 -0.07 0.00 0.77 0.00 0.00 58.65 59.24 1vlr h GLN 331 Cb 0.35 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 1vlr h GLN 331 CO 0.01 0.75 -0.01 -0.22 -1.93 0.00 0.00 178.83 177.43 1vlr h LYS 332 N 0.82 0.76 -0.53 1.69 3.64 -1.51 -1.99 116.57 119.44 1vlr h LYS 332 Ca 0.20 -0.25 -0.10 0.00 -1.27 0.00 0.00 60.65 59.23 1vlr h LYS 332 Cb 0.20 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1vlr h LYS 332 CO -0.02 0.84 -0.07 0.00 -2.27 0.00 0.00 179.45 177.93 1vlr h ALA 333 N 0.89 0.72 -0.26 5.00 0.00 -0.97 -2.18 119.26 122.45 1vlr h ALA 333 Ca 0.12 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1vlr h ALA 333 Cb 0.50 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1vlr h ALA 333 CO 0.02 0.60 -0.12 1.96 0.00 0.00 0.00 179.25 181.71 1vlr h GLN 334 N 0.85 0.44 -0.04 0.00 4.20 -0.43 -2.03 115.11 118.10 1vlr h GLN 334 Ca 0.14 -0.12 -0.17 0.00 0.06 0.00 0.00 58.65 58.56 1vlr h GLN 334 Cb 0.62 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 1vlr h GLN 334 CO 0.04 0.56 -0.75 0.37 -0.67 0.00 0.00 178.83 178.39 1vlr h GLN 335 N 0.41 0.24 -0.42 1.46 4.15 -1.10 -3.01 115.11 116.85 1vlr h GLN 335 Ca 0.08 -0.21 -0.10 0.00 0.77 0.00 0.00 58.65 59.19 1vlr h GLN 335 Cb 0.47 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.19 1vlr h GLN 335 CO 0.03 0.88 -0.14 0.93 -1.93 0.00 0.00 178.83 178.59 1vlr h GLU 336 N 0.16 0.76 -0.00 1.69 5.08 -1.21 -3.51 114.58 117.54 1vlr h GLU 336 Ca -0.03 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1vlr h GLU 336 Cb 1.31 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.51 1vlr h GLU 336 CO 0.12 0.87 0.00 2.89 -1.00 0.00 0.00 179.01 181.88