#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vir n ALA 2 N 0.00 -3.21 -3.48 -1.58 0.00 -1.26 -4.87 120.51 106.11 2vir n ALA 2 Ca 0.00 0.40 -0.19 0.00 0.00 0.00 0.00 53.44 53.66 2vir n ALA 2 Cb 0.00 -1.12 -0.12 0.00 0.00 0.00 0.00 19.45 18.21 2vir n ALA 2 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2vir s VAL 3 N -2.12 -0.32 -0.15 0.00 1.01 -1.26 -5.00 120.40 112.57 2vir s VAL 3 Ca 0.00 -0.22 -0.29 0.00 0.00 0.00 0.00 61.98 61.47 2vir s VAL 3 Cb 0.00 -0.75 -0.01 0.00 0.00 0.00 0.00 36.38 35.62 2vir s VAL 3 CO 0.00 -0.28 1.18 -0.69 0.00 0.00 0.00 175.10 175.31 2vir s VAL 4 N 2.32 4.41 -0.06 2.92 1.01 -1.26 -2.85 120.40 126.89 2vir s VAL 4 Ca 0.07 1.71 0.06 0.00 0.00 0.00 0.00 61.98 63.82 2vir s VAL 4 Cb -0.15 -4.10 -0.01 0.00 0.00 0.00 0.00 36.38 32.11 2vir s VAL 4 CO -0.17 -0.10 -0.24 0.42 0.00 0.00 0.00 175.10 175.01 2vir s THR 5 N 2.97 2.16 0.09 3.92 -4.23 -0.65 -3.82 115.64 116.07 2vir s THR 5 Ca 0.52 -1.03 -0.11 0.00 -1.18 0.00 0.00 61.69 59.89 2vir s THR 5 Cb -0.21 -1.79 0.01 0.00 1.34 0.00 0.00 72.50 71.86 2vir s THR 5 CO 0.15 0.57 0.25 0.00 -0.54 0.00 0.00 174.62 175.05 2vir s GLN 6 N -0.21 0.88 0.16 3.99 -2.07 -1.26 -1.50 119.66 119.65 2vir s GLN 6 Ca -0.02 -0.83 -0.31 0.00 -1.82 0.00 0.00 55.36 52.38 2vir s GLN 6 Cb -0.13 0.37 -0.17 0.00 -1.09 0.00 0.00 33.01 31.98 2vir s GLN 6 CO 0.03 -0.29 0.70 0.39 -1.32 0.00 0.00 175.29 174.80 2vir n GLU 7 N 0.02 0.13 0.12 9.60 4.71 -1.26 -4.72 120.64 129.25 2vir n GLU 7 Ca -0.16 0.05 -0.13 0.00 -0.01 0.00 0.00 57.16 56.90 2vir n GLU 7 Cb 0.62 -1.20 -0.08 0.00 -1.01 0.00 0.00 31.44 29.77 2vir n GLU 7 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 177.13 177.99 2vir h SER 8 N 1.63 -0.26 -5.05 1.62 0.02 -1.95 -3.34 113.55 106.23 2vir h SER 8 Ca -0.35 -0.17 -0.04 0.00 -0.84 0.00 0.00 61.79 60.39 2vir h SER 8 Cb 1.43 0.07 -0.12 0.00 0.14 0.00 0.00 62.40 63.91 2vir h SER 8 CO 0.60 0.04 0.05 0.00 -1.14 0.00 0.00 176.83 176.37 2vir s ALA 9 N -5.15 -1.19 -0.09 3.77 0.00 -1.26 -0.90 121.76 116.94 2vir s ALA 9 Ca -0.15 0.14 -0.07 0.00 0.00 0.00 0.00 51.96 51.88 2vir s ALA 9 Cb 0.03 0.78 0.03 0.00 0.00 0.00 0.00 23.12 23.96 2vir s ALA 9 CO 0.60 -0.71 0.24 -1.17 0.00 0.00 0.00 175.76 174.72 2vir s LEU 10 N -2.79 0.87 -0.18 0.00 2.96 0.17 -4.82 118.68 114.89 2vir s LEU 10 Ca 0.03 0.48 0.00 0.00 -0.22 0.00 0.00 54.13 54.42 2vir s LEU 10 Cb 0.00 0.77 0.01 0.00 0.50 0.00 0.00 46.19 47.48 2vir s LEU 10 CO -0.12 -0.11 -0.18 0.28 -1.32 0.00 0.00 176.35 174.91 2vir s THR 11 N 0.52 2.28 0.48 3.68 -1.32 -1.26 -0.73 115.64 119.29 2vir s THR 11 Ca -0.03 -0.87 0.02 0.00 -1.21 0.00 0.00 61.69 59.60 2vir s THR 11 Cb -0.05 -1.97 -0.01 0.00 -1.51 0.00 0.00 72.50 68.97 2vir s THR 11 CO -0.03 0.52 0.06 1.07 -2.21 0.00 0.00 174.62 174.03 2vir n THR 12 N 4.59 0.00 -4.27 5.08 5.66 -0.39 -4.95 114.28 119.99 2vir n THR 12 Ca -0.20 -2.44 -0.16 0.00 -3.05 0.00 0.00 64.05 58.19 2vir n THR 12 Cb 0.50 0.64 -0.10 0.00 -1.55 0.00 0.00 70.33 69.82 2vir n THR 12 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 2vir s SER 13 N -3.74 2.03 0.37 1.09 0.01 -1.26 -1.37 113.70 110.84 2vir s SER 13 Ca 0.08 -0.95 -0.27 0.00 1.31 0.00 0.00 55.95 56.12 2vir s SER 13 Cb 0.00 -0.06 -0.11 0.00 0.21 0.00 0.00 66.02 66.06 2vir s SER 13 CO 0.06 -0.24 1.35 -2.65 0.41 0.00 0.00 173.24 172.17 2vir n PRO 14 N -0.01 2.25 0.00 12.44 -0.02 -1.26 -2.49 135.00 145.91 2vir n PRO 14 Ca -0.11 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 2vir n PRO 14 Cb 0.59 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 2vir n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vir n GLY 15 N 0.68 2.94 3.31 -1.23 0.00 -0.42 -4.92 105.19 105.54 2vir n GLY 15 Ca 0.04 -0.77 -0.32 0.00 0.00 0.00 0.00 46.02 44.98 2vir n GLY 15 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2vir n GLU 16 N 0.00 -1.63 -3.98 1.61 1.02 -1.04 -3.58 120.64 113.04 2vir n GLU 16 Ca 0.00 -0.46 -0.32 0.00 -0.02 0.00 0.00 57.16 56.36 2vir n GLU 16 Cb 0.00 -1.77 -0.14 0.00 -0.02 0.00 0.00 31.44 29.51 2vir n GLU 16 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2vir s THR 17 N -2.27 2.47 0.36 2.62 2.01 -1.26 -2.01 115.64 117.55 2vir s THR 17 Ca 0.58 -2.22 -0.01 0.00 0.31 0.00 0.00 61.69 60.35 2vir s THR 17 Cb -0.14 -2.76 -0.04 0.00 0.01 0.00 0.00 72.50 69.57 2vir s THR 17 CO 0.66 -0.56 0.58 0.68 -0.69 0.00 0.00 174.62 175.29 2vir s VAL 18 N 0.97 5.08 -0.23 3.82 -7.23 -0.81 -4.95 120.40 117.04 2vir s VAL 18 Ca 0.09 -0.33 -0.04 0.00 -1.81 0.00 0.00 61.98 59.89 2vir s VAL 18 Cb -0.20 -3.85 0.09 0.00 0.56 0.00 0.00 36.38 32.98 2vir s VAL 18 CO -0.07 -0.57 0.15 -0.89 -0.31 0.00 0.00 175.10 173.41 2vir s THR 19 N -2.34 -0.16 0.67 5.32 2.01 -1.26 -1.50 115.64 118.37 2vir s THR 19 Ca 0.41 -0.40 -0.12 0.00 0.31 0.00 0.00 61.69 61.89 2vir s THR 19 Cb -0.10 -0.78 -0.00 0.00 0.01 0.00 0.00 72.50 71.63 2vir s THR 19 CO 0.36 -0.45 1.06 -0.76 -0.69 0.00 0.00 174.62 174.15 2vir s LEU 20 N 2.18 3.24 0.21 4.42 2.01 -0.19 -4.88 118.68 125.67 2vir s LEU 20 Ca 0.06 1.69 0.05 0.00 0.01 0.00 0.00 54.13 55.94 2vir s LEU 20 Cb -0.16 -4.51 -0.05 0.00 0.01 0.00 0.00 46.19 41.49 2vir s LEU 20 CO -0.22 -1.38 -0.06 0.42 1.01 0.00 0.00 176.35 176.12 2vir s THR 21 N -2.86 1.27 -0.23 5.49 -4.23 -1.26 -2.50 115.64 111.33 2vir s THR 21 Ca 0.60 -2.08 -0.03 0.00 -1.18 0.00 0.00 61.69 58.99 2vir s THR 21 Cb -0.15 -2.15 0.10 0.00 1.34 0.00 0.00 72.50 71.64 2vir s THR 21 CO 0.49 -0.50 0.20 0.00 -0.54 0.00 0.00 174.62 174.27 2vir s ARG 23 N 2.27 3.55 -0.15 0.00 0.52 -0.56 -1.61 118.95 122.97 2vir s ARG 23 Ca 0.07 -0.24 0.02 0.00 -0.52 0.00 0.00 55.73 55.06 2vir s ARG 23 Cb -0.15 -2.84 0.01 0.00 0.52 0.00 0.00 34.95 32.49 2vir s ARG 23 CO -0.19 0.42 -0.21 0.45 0.02 0.00 0.00 175.30 175.79 2vir s SER 24 N -2.90 3.16 0.22 0.23 0.15 -1.24 -1.64 113.70 111.67 2vir s SER 24 Ca 0.39 -0.61 -0.09 0.00 0.70 0.00 0.00 55.95 56.35 2vir s SER 24 Cb -0.11 -1.46 0.22 0.00 -1.71 0.00 0.00 66.02 62.95 2vir s SER 24 CO 0.28 0.06 1.85 0.77 1.20 0.00 0.00 173.24 177.39 2vir h SER 25 N 7.51 0.74 0.00 5.45 4.64 -1.91 -1.04 113.55 128.94 2vir h SER 25 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2vir h SER 25 Cb 1.18 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 2vir h SER 25 CO 0.58 0.51 0.00 0.35 -0.87 0.00 0.00 176.83 177.40 2vir n THR 26 N -4.66 0.00 0.00 2.95 -2.24 -1.26 -4.96 114.28 104.11 2vir n THR 26 Ca 0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 2vir n THR 26 Cb 0.11 -0.60 0.00 0.00 -2.10 0.00 0.00 70.33 67.74 2vir n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vir n GLY 27 N -0.22 0.51 3.83 3.38 0.00 -0.39 -5.08 105.19 107.20 2vir n GLY 27 Ca 0.05 -1.77 -0.34 0.00 0.00 0.00 0.00 46.02 43.96 2vir n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vir s ALA 28 N -1.44 3.21 -0.58 4.61 0.00 -1.26 -3.63 121.76 122.67 2vir s ALA 28 Ca 0.00 0.26 -0.21 0.00 0.00 0.00 0.00 51.96 52.01 2vir s ALA 28 Cb 0.00 -2.98 0.07 0.00 0.00 0.00 0.00 23.12 20.21 2vir s ALA 28 CO 0.00 0.23 0.80 0.08 0.00 0.00 0.00 175.76 176.87 2vir s VAL 29 N -1.97 4.61 0.09 0.00 1.01 0.31 -4.93 120.40 119.53 2vir s VAL 29 Ca 0.56 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 62.13 2vir s VAL 29 Cb -0.11 -4.50 0.02 0.00 0.00 0.00 0.00 36.38 31.79 2vir s VAL 29 CO 0.17 -1.12 0.12 1.07 0.00 0.00 0.00 175.10 175.34 2vir n THR 30 N 5.81 0.00 0.21 3.92 5.66 -1.26 -4.65 114.28 123.97 2vir n THR 30 Ca -0.05 -0.12 0.10 0.00 -3.05 0.00 0.00 64.05 60.94 2vir n THR 30 Cb 0.45 -1.69 0.28 0.00 -1.55 0.00 0.00 70.33 67.82 2vir n THR 30 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 175.07 172.76 2vir h THR 31 N -0.80 0.29 -0.07 1.09 2.02 -1.98 -3.15 112.91 110.32 2vir h THR 31 Ca -0.04 -1.21 0.02 0.00 0.77 0.00 0.00 66.41 65.95 2vir h THR 31 Cb 0.12 1.97 -0.00 0.00 -1.74 0.00 0.00 68.15 68.49 2vir h THR 31 CO 0.03 0.15 0.11 -1.28 0.37 0.00 0.00 175.52 174.90 2vir h SER 32 N 0.00 0.00 1.19 4.18 0.87 -1.95 -2.24 113.55 115.60 2vir h SER 32 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2vir h SER 32 Cb 0.96 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.92 2vir h SER 32 CO 0.02 0.00 -0.28 0.59 -0.53 0.00 0.00 176.83 176.63 2vir n ASN 33 N -3.55 0.75 -2.56 6.23 5.03 -1.19 -4.84 115.26 115.14 2vir n ASN 33 Ca -0.01 0.36 -0.17 0.00 0.87 0.00 0.00 54.58 55.63 2vir n ASN 33 Cb 0.20 -0.36 -0.00 0.00 -1.02 0.00 0.00 39.78 38.60 2vir n ASN 33 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2vir n TYR 34 N -2.18 -1.37 -0.14 3.10 4.01 -0.85 -0.50 117.16 119.24 2vir n TYR 34 Ca 0.05 0.09 -0.06 0.00 -0.16 0.00 0.00 57.90 57.82 2vir n TYR 34 Cb 0.43 -3.31 -0.01 0.00 -0.31 0.00 0.00 39.34 36.14 2vir n TYR 34 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2vir n ALA 35 N -2.39 -0.07 -2.63 -0.72 0.00 -1.26 -2.71 120.51 110.73 2vir n ALA 35 Ca -0.16 0.03 -0.34 0.00 0.00 0.00 0.00 53.44 52.97 2vir n ALA 35 Cb 0.63 -0.17 -0.10 0.00 0.00 0.00 0.00 19.45 19.81 2vir n ALA 35 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2vir s ASN 36 N 0.35 4.91 -0.31 0.00 3.84 -0.13 -1.45 114.94 122.14 2vir s ASN 36 Ca 0.09 0.04 0.02 0.00 0.21 0.00 0.00 52.86 53.23 2vir s ASN 36 Cb -0.13 -1.29 0.09 0.00 -0.55 0.00 0.00 41.25 39.37 2vir s ASN 36 CO 0.07 0.36 0.04 0.26 -2.79 0.00 0.00 177.10 175.04 2vir s TRP 37 N -0.86 3.00 0.08 0.43 0.52 -0.85 0.06 118.94 121.31 2vir s TRP 37 Ca 0.13 -2.45 -0.08 0.00 0.02 0.00 0.00 56.10 53.72 2vir s TRP 37 Cb -0.11 -2.36 -0.06 0.00 -1.15 0.00 0.00 33.47 29.80 2vir s TRP 37 CO 0.02 -0.90 0.37 0.08 0.02 0.00 0.00 176.95 176.54 2vir s VAL 38 N 1.17 5.15 -0.31 4.03 1.01 0.23 -1.68 120.40 130.00 2vir s VAL 38 Ca 0.07 0.30 -0.04 0.00 0.00 0.00 0.00 61.98 62.31 2vir s VAL 38 Cb -0.19 -3.62 0.04 0.00 0.00 0.00 0.00 36.38 32.61 2vir s VAL 38 CO -0.12 0.25 0.05 -1.58 0.00 0.00 0.00 175.10 173.69 2vir s GLN 39 N -2.05 2.60 -0.33 2.72 0.74 0.47 0.41 119.66 124.21 2vir s GLN 39 Ca 0.34 -1.17 -0.20 0.00 0.05 0.00 0.00 55.36 54.37 2vir s GLN 39 Cb -0.13 -3.31 -0.01 0.00 1.10 0.00 0.00 33.01 30.66 2vir s GLN 39 CO 0.19 -0.61 0.61 -2.00 -0.55 0.00 0.00 175.29 172.93 2vir s GLU 40 N 1.35 3.80 0.64 1.67 2.12 0.62 -1.68 118.70 127.22 2vir s GLU 40 Ca -0.03 0.17 0.02 0.00 0.36 0.00 0.00 54.97 55.49 2vir s GLU 40 Cb -0.19 -3.76 0.09 0.00 0.26 0.00 0.00 34.13 30.53 2vir s GLU 40 CO 0.01 -0.63 0.88 0.15 -0.54 0.00 0.00 175.26 175.14 2vir s LYS 41 N 2.61 2.07 0.25 4.30 -0.14 -1.12 -1.76 119.74 125.95 2vir s LYS 41 Ca 0.24 -1.10 -0.28 0.00 -1.36 0.00 0.00 55.97 53.47 2vir s LYS 41 Cb -0.15 -2.44 -0.15 0.00 -1.68 0.00 0.00 37.83 33.41 2vir s LYS 41 CO 0.13 -1.10 0.79 -2.30 -0.76 0.00 0.00 175.35 172.10 2vir n PRO 42 N -2.57 0.75 -3.60 -1.68 -0.02 -1.26 -2.33 135.00 124.29 2vir n PRO 42 Ca 0.13 0.26 -0.23 0.00 -2.02 0.00 0.00 63.50 61.64 2vir n PRO 42 Cb 0.60 -1.47 0.07 0.00 -0.02 0.00 0.00 33.50 32.69 2vir n PRO 42 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2vir n ASP 43 N 1.56 -4.69 -2.68 2.55 8.00 -1.26 -4.15 116.55 115.87 2vir n ASP 43 Ca 0.13 -0.61 -0.21 0.00 0.71 0.00 0.00 54.79 54.81 2vir n ASP 43 Cb 0.29 -4.86 0.02 0.00 -0.02 0.00 0.00 41.12 36.56 2vir n ASP 43 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vir n HIS 44 N -4.69 -1.43 -3.60 1.24 1.44 -0.98 -4.96 115.22 102.23 2vir n HIS 44 Ca -0.09 0.60 -0.29 0.00 -2.01 0.00 0.00 57.72 55.93 2vir n HIS 44 Cb 0.59 -1.10 -0.12 0.00 0.12 0.00 0.00 29.99 29.48 2vir n HIS 44 CO 0.00 0.00 0.00 -1.17 -2.81 0.00 0.00 176.34 172.36 2vir s LEU 45 N -1.48 2.07 0.56 2.39 0.20 -1.24 -5.00 118.68 116.17 2vir s LEU 45 Ca 0.21 -2.56 -0.17 0.00 0.69 0.00 0.00 54.13 52.30 2vir s LEU 45 Cb -0.02 -0.78 -0.05 0.00 -0.43 0.00 0.00 46.19 44.90 2vir s LEU 45 CO 0.47 -0.27 1.05 -0.36 -0.29 0.00 0.00 176.35 176.95 2vir s PHE 46 N 0.51 3.01 -0.06 5.38 0.40 -1.26 -2.80 117.98 123.16 2vir s PHE 46 Ca 0.19 1.53 -0.03 0.00 -0.60 0.00 0.00 56.93 58.02 2vir s PHE 46 Cb -0.21 -3.02 0.03 0.00 0.51 0.00 0.00 43.02 40.33 2vir s PHE 46 CO -0.02 -1.00 0.13 0.99 0.70 0.00 0.00 175.22 176.02 2vir s THR 47 N -2.31 -0.03 0.23 0.64 2.01 -0.68 -4.98 115.64 110.53 2vir s THR 47 Ca 0.65 0.11 -0.30 0.00 0.31 0.00 0.00 61.69 62.46 2vir s THR 47 Cb -0.16 -0.21 -0.09 0.00 0.01 0.00 0.00 72.50 72.06 2vir s THR 47 CO 0.31 0.05 1.14 -0.83 -0.69 0.00 0.00 174.62 174.59 2vir s GLY 48 N 0.73 2.90 -0.07 4.40 0.00 -1.26 -0.40 107.32 113.62 2vir s GLY 48 Ca -0.05 0.91 -0.04 0.00 0.00 0.00 0.00 44.72 45.54 2vir s GLY 48 CO -0.03 1.65 -0.10 -0.10 0.00 0.00 0.00 173.10 174.52 2vir n LEU 49 N 1.81 0.56 -3.99 0.66 7.94 -0.67 -4.85 117.00 118.46 2vir n LEU 49 Ca 0.01 0.10 -0.10 0.00 -1.11 0.00 0.00 56.01 54.91 2vir n LEU 49 Cb 0.45 -0.23 -0.11 0.00 0.53 0.00 0.00 43.42 44.05 2vir n LEU 49 CO 0.55 0.13 -0.37 -0.63 -1.11 0.00 0.00 177.39 175.95 2vir s ILE 50 N -2.14 0.21 0.04 1.96 1.01 -1.16 -1.36 121.20 119.76 2vir s ILE 50 Ca -0.10 -0.87 -0.03 0.00 0.00 0.00 0.00 60.65 59.65 2vir s ILE 50 Cb 0.04 -0.33 -0.02 0.00 0.01 0.00 0.00 42.46 42.16 2vir s ILE 50 CO 0.13 -0.42 0.03 -0.83 0.00 0.00 0.00 174.94 173.85 2vir s GLY 51 N -1.35 0.30 -1.47 6.18 0.00 -0.94 -2.01 107.32 108.04 2vir s GLY 51 Ca -0.13 -0.84 -0.02 0.00 0.00 0.00 0.00 44.72 43.74 2vir s GLY 51 CO -0.01 -0.95 0.18 0.61 0.00 0.00 0.00 173.10 172.93 2vir n GLY 52 N 0.57 -0.50 2.17 0.20 0.00 -1.10 -1.73 105.19 104.80 2vir n GLY 52 Ca -0.17 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2vir n GLY 52 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2vir n THR 53 N -3.92 0.00 -1.59 2.61 -1.04 -0.53 -4.45 114.28 105.36 2vir n THR 53 Ca -0.17 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.84 2vir n THR 53 Cb 0.64 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.15 2vir n THR 53 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 2vir n ASN 54 N 1.73 0.00 -4.54 8.00 0.23 -1.16 -2.83 115.26 116.69 2vir n ASN 54 Ca 0.00 -1.00 -0.41 0.00 -0.53 0.00 0.00 54.58 52.64 2vir n ASN 54 Cb 0.00 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 37.67 2vir n ASN 54 CO 0.00 0.00 0.00 0.20 -0.93 0.00 0.00 177.26 176.53 2vir s ASN 55 N 0.00 6.18 0.05 0.53 -0.87 -0.70 -4.43 114.94 115.69 2vir s ASN 55 Ca 0.00 -0.50 -0.30 0.00 -1.57 0.00 0.00 52.86 50.48 2vir s ASN 55 Cb 0.00 -2.54 -0.08 0.00 -0.02 0.00 0.00 41.25 38.61 2vir s ASN 55 CO 0.00 -1.75 1.77 -0.60 -2.57 0.00 0.00 177.10 173.95 2vir s ARG 56 N 5.41 4.17 0.24 -0.60 3.52 -1.26 -2.20 118.95 128.23 2vir s ARG 56 Ca 0.33 2.43 -0.30 0.00 -0.13 0.00 0.00 55.73 58.07 2vir s ARG 56 Cb -0.09 -3.82 -0.09 0.00 -1.56 0.00 0.00 34.95 29.38 2vir s ARG 56 CO 0.15 -0.83 1.32 0.00 -0.81 0.00 0.00 175.30 175.13 2vir s ALA 57 N 3.40 3.53 0.00 6.12 0.00 -0.46 -4.95 121.76 129.39 2vir s ALA 57 Ca 0.79 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.93 2vir s ALA 57 Cb -0.41 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.23 2vir s ALA 57 CO 0.35 -0.58 0.07 -2.30 0.00 0.00 0.00 175.76 173.29 2vir n PRO 58 N 2.06 0.00 -0.06 0.00 -0.02 -1.26 -0.71 135.00 135.01 2vir n PRO 58 Ca 0.04 0.07 0.18 0.00 -2.02 0.00 0.00 63.50 61.77 2vir n PRO 58 Cb 0.42 -0.12 0.62 0.00 -0.02 0.00 0.00 33.50 34.40 2vir n PRO 58 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2vir h GLY 59 N 0.00 0.26 -5.57 -1.23 0.00 -1.94 -3.43 103.07 91.17 2vir h GLY 59 Ca 0.00 -0.07 -0.66 0.00 0.00 0.00 0.00 47.33 46.61 2vir h GLY 59 CO 0.00 0.03 0.76 -0.62 0.00 0.00 0.00 176.54 176.70 2vir n VAL 60 N -4.42 0.17 -1.67 4.60 0.31 0.12 -4.92 118.33 112.52 2vir n VAL 60 Ca 0.11 -0.03 -0.35 0.00 -0.01 0.00 0.00 64.34 64.06 2vir n VAL 60 Cb 0.57 -1.28 0.07 0.00 -0.91 0.00 0.00 33.84 32.28 2vir n VAL 60 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 2vir s PRO 61 N 1.89 2.49 0.54 5.55 0.02 -1.26 -4.88 135.00 139.35 2vir s PRO 61 Ca 0.87 1.78 0.24 0.00 0.02 0.00 0.00 61.00 63.91 2vir s PRO 61 Cb -0.86 -1.87 1.41 0.00 0.02 0.00 0.00 34.50 33.20 2vir s PRO 61 CO 0.49 -1.57 2.04 0.00 -0.33 0.00 0.00 177.00 177.64 2vir h ALA 62 N 0.17 2.27 0.00 -1.55 0.00 -1.95 -2.67 119.26 115.53 2vir h ALA 62 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2vir h ALA 62 Cb 1.30 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2vir h ALA 62 CO 0.52 -0.45 0.00 2.89 0.00 0.00 0.00 179.25 182.21 2vir n ARG 63 N -4.31 0.06 -3.41 0.00 1.85 -1.26 -4.52 116.66 105.06 2vir n ARG 63 Ca 0.06 0.53 -0.37 0.00 -1.00 0.00 0.00 57.85 57.06 2vir n ARG 63 Cb 0.45 -1.68 -0.06 0.00 -1.05 0.00 0.00 32.46 30.12 2vir n ARG 63 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2vir s PHE 64 N -3.21 3.55 -0.01 2.89 0.40 -1.01 -1.89 117.98 118.69 2vir s PHE 64 Ca -0.00 0.83 0.01 0.00 -0.60 0.00 0.00 56.93 57.17 2vir s PHE 64 Cb 0.03 -2.44 0.01 0.00 0.51 0.00 0.00 43.02 41.13 2vir s PHE 64 CO 0.11 0.29 -0.02 0.45 0.70 0.00 0.00 175.22 176.75 2vir s SER 65 N 0.22 0.37 -0.05 1.36 0.15 -1.02 -4.95 113.70 109.77 2vir s SER 65 Ca 0.23 -0.04 -0.04 0.00 0.70 0.00 0.00 55.95 56.79 2vir s SER 65 Cb -0.15 -0.10 -0.04 0.00 -1.71 0.00 0.00 66.02 64.02 2vir s SER 65 CO 0.09 -0.01 0.16 -0.83 1.20 0.00 0.00 173.24 173.85 2vir s GLY 66 N 0.31 2.16 0.05 9.45 0.00 -1.26 -1.35 107.32 116.68 2vir s GLY 66 Ca -0.03 -0.72 -0.28 0.00 0.00 0.00 0.00 44.72 43.69 2vir s GLY 66 CO -0.01 -0.55 1.01 -1.35 0.00 0.00 0.00 173.10 172.20 2vir s SER 67 N -1.57 -0.21 -0.21 1.64 1.04 -0.79 -4.47 113.70 109.12 2vir s SER 67 Ca 0.22 -0.21 -0.07 0.00 0.48 0.00 0.00 55.95 56.38 2vir s SER 67 Cb -0.12 0.38 -0.03 0.00 0.10 0.00 0.00 66.02 66.34 2vir s SER 67 CO 0.13 -0.67 0.05 -0.76 0.98 0.00 0.00 173.24 172.97 2vir s LEU 68 N -2.74 3.59 -0.50 2.42 2.01 -1.26 0.62 118.68 122.81 2vir s LEU 68 Ca 0.10 -0.06 0.03 0.00 0.01 0.00 0.00 54.13 54.21 2vir s LEU 68 Cb -0.00 -1.92 0.13 0.00 0.01 0.00 0.00 46.19 44.40 2vir s LEU 68 CO -0.03 0.09 0.24 -0.63 1.01 0.00 0.00 176.35 177.03 2vir s ILE 69 N 0.88 2.63 0.00 -0.59 1.01 -0.81 -4.94 121.20 119.39 2vir s ILE 69 Ca 0.03 -3.13 0.00 0.00 0.00 0.00 0.00 60.65 57.55 2vir s ILE 69 Cb -0.14 -2.83 0.00 0.00 0.01 0.00 0.00 42.46 39.50 2vir s ILE 69 CO 0.02 -0.77 0.00 0.61 0.00 0.00 0.00 174.94 174.80 2vir n GLY 70 N 3.33 1.36 1.03 6.18 0.00 -1.26 -3.29 105.19 112.55 2vir n GLY 70 Ca 0.05 -0.57 0.08 0.00 0.00 0.00 0.00 46.02 45.58 2vir n GLY 70 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2vir n ASP 71 N 8.08 3.70 -4.25 1.61 5.75 -1.26 -4.88 116.55 125.30 2vir n ASP 71 Ca 0.00 -2.25 -0.16 0.00 -0.01 0.00 0.00 54.79 52.37 2vir n ASP 71 Cb 0.00 -0.41 -0.10 0.00 -1.03 0.00 0.00 41.12 39.58 2vir n ASP 71 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 2vir s LYS 72 N -1.46 1.05 0.40 0.11 -2.85 -1.21 -0.53 119.74 115.26 2vir s LYS 72 Ca 0.37 -1.38 -0.03 0.00 -1.00 0.00 0.00 55.97 53.93 2vir s LYS 72 Cb 0.23 -0.73 -0.04 0.00 -2.06 0.00 0.00 37.83 35.23 2vir s LYS 72 CO 0.20 0.11 0.67 0.00 0.10 0.00 0.00 175.35 176.43 2vir s ALA 73 N -2.90 3.54 0.13 0.59 0.00 -0.63 -1.92 121.76 120.56 2vir s ALA 73 Ca 0.14 -0.65 -0.03 0.00 0.00 0.00 0.00 51.96 51.42 2vir s ALA 73 Cb -0.00 -2.38 -0.03 0.00 0.00 0.00 0.00 23.12 20.71 2vir s ALA 73 CO 0.02 -0.14 0.10 0.00 0.00 0.00 0.00 175.76 175.74 2vir s ALA 74 N -2.48 0.62 -0.01 0.00 0.00 0.20 -0.10 121.76 119.99 2vir s ALA 74 Ca 0.44 -1.30 0.01 0.00 0.00 0.00 0.00 51.96 51.11 2vir s ALA 74 Cb -0.10 0.80 0.01 0.00 0.00 0.00 0.00 23.12 23.83 2vir s ALA 74 CO 0.39 -0.51 -0.01 -1.17 0.00 0.00 0.00 175.76 174.46 2vir s LEU 75 N -3.01 1.74 -0.18 0.00 2.96 -1.04 -1.89 118.68 117.26 2vir s LEU 75 Ca 0.21 -0.03 -0.01 0.00 -0.22 0.00 0.00 54.13 54.07 2vir s LEU 75 Cb 0.07 -0.13 0.05 0.00 0.50 0.00 0.00 46.19 46.68 2vir s LEU 75 CO -0.00 -0.01 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.11 2vir s THR 76 N 0.28 0.90 -0.31 3.68 2.01 -0.45 -1.02 115.64 120.72 2vir s THR 76 Ca -0.02 -0.64 -0.21 0.00 0.31 0.00 0.00 61.69 61.13 2vir s THR 76 Cb -0.05 -1.21 -0.00 0.00 0.01 0.00 0.00 72.50 71.25 2vir s THR 76 CO -0.01 -0.03 0.67 -0.63 -0.69 0.00 0.00 174.62 173.94 2vir s ILE 77 N 1.71 4.89 -0.72 1.82 1.01 -0.56 -2.45 121.20 126.90 2vir s ILE 77 Ca -0.01 0.89 -0.14 0.00 0.00 0.00 0.00 60.65 61.39 2vir s ILE 77 Cb -0.16 -4.05 0.19 0.00 0.01 0.00 0.00 42.46 38.44 2vir s ILE 77 CO -0.07 -0.20 0.66 -0.89 0.00 0.00 0.00 174.94 174.44 2vir s THR 78 N 2.71 5.41 0.00 2.92 2.01 -0.79 -1.92 115.64 125.98 2vir s THR 78 Ca 0.27 -2.13 0.00 0.00 0.31 0.00 0.00 61.69 60.14 2vir s THR 78 Cb -0.15 -4.39 0.00 0.00 0.01 0.00 0.00 72.50 67.97 2vir s THR 78 CO 0.12 -0.97 0.00 0.61 -0.69 0.00 0.00 174.62 173.70 2vir n GLY 79 N 4.43 0.55 3.58 4.40 0.00 -0.85 -4.86 105.19 112.43 2vir n GLY 79 Ca 0.04 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 2vir n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vir n ALA 80 N -0.01 -0.25 -2.44 4.61 0.00 -1.07 -4.48 120.51 116.86 2vir n ALA 80 Ca 0.00 0.26 -0.24 0.00 0.00 0.00 0.00 53.44 53.47 2vir n ALA 80 Cb 0.01 -2.01 -0.11 0.00 0.00 0.00 0.00 19.45 17.34 2vir n ALA 80 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2vir s GLN 81 N -1.81 1.46 0.54 0.00 -0.21 -1.26 -1.31 119.66 117.08 2vir s GLN 81 Ca 0.62 -1.55 0.38 0.00 0.02 0.00 0.00 55.36 54.83 2vir s GLN 81 Cb -0.61 -1.61 1.56 0.00 1.00 0.00 0.00 33.01 33.36 2vir s GLN 81 CO 0.58 0.33 1.77 1.79 -2.12 0.00 0.00 175.29 177.63 2vir h THR 82 N 2.95 0.35 0.00 -0.19 1.35 -1.96 0.37 112.91 115.78 2vir h THR 82 Ca -0.43 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 2vir h THR 82 Cb 1.22 0.34 0.00 0.00 -1.73 0.00 0.00 68.15 67.98 2vir h THR 82 CO 0.53 0.00 0.00 -1.84 -0.25 0.00 0.00 175.52 173.96 2vir n GLU 83 N -4.17 0.95 0.00 4.72 0.28 -1.26 -2.56 120.64 118.60 2vir n GLU 83 Ca 0.28 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.28 2vir n GLU 83 Cb 1.34 -1.12 0.00 0.00 1.43 0.00 0.00 31.44 33.10 2vir n GLU 83 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2vir n ASP 84 N 0.43 0.64 -4.70 -1.84 8.00 0.13 -5.00 116.55 114.21 2vir n ASP 84 Ca 0.00 -0.85 -0.42 0.00 0.71 0.00 0.00 54.79 54.23 2vir n ASP 84 Cb 0.42 0.23 -0.03 0.00 -0.02 0.00 0.00 41.12 41.72 2vir n ASP 84 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2vir s GLU 85 N -0.23 4.17 0.00 -1.24 2.12 -1.06 -4.88 118.70 117.58 2vir s GLU 85 Ca 0.00 2.46 0.00 0.00 0.36 0.00 0.00 54.97 57.79 2vir s GLU 85 Cb 0.00 -3.48 0.00 0.00 0.26 0.00 0.00 34.13 30.91 2vir s GLU 85 CO 0.00 -0.76 0.00 0.00 -0.54 0.00 0.00 175.26 173.96 2vir n ALA 86 N 5.24 0.00 -2.64 6.30 0.00 -1.17 -4.90 120.51 123.33 2vir n ALA 86 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.22 2vir n ALA 86 Cb 0.39 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.75 2vir n ALA 86 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2vir s ILE 87 N -2.00 5.22 -0.49 0.00 1.09 -0.72 -1.13 121.20 123.17 2vir s ILE 87 Ca 0.00 0.56 -0.14 0.00 -1.10 0.00 0.00 60.65 59.97 2vir s ILE 87 Cb 0.00 -3.67 0.10 0.00 -1.06 0.00 0.00 42.46 37.83 2vir s ILE 87 CO 0.00 0.23 0.41 -0.31 -0.10 0.00 0.00 174.94 175.17 2vir s TYR 88 N 1.55 3.29 0.00 3.97 1.51 0.20 -0.27 117.35 127.60 2vir s TYR 88 Ca 0.15 -1.30 -0.23 0.00 -1.01 0.00 0.00 57.07 54.68 2vir s TYR 88 Cb -0.15 -3.43 -0.05 0.00 -0.11 0.00 0.00 41.96 38.22 2vir s TYR 88 CO 0.08 -0.92 0.70 -0.06 -1.11 0.00 0.00 175.55 174.24 2vir s PHE 89 N 1.55 3.68 -0.17 2.71 0.08 0.16 -2.85 117.98 123.15 2vir s PHE 89 Ca 0.04 1.33 -0.07 0.00 0.12 0.00 0.00 56.93 58.35 2vir s PHE 89 Cb -0.27 -2.75 -0.04 0.00 -0.57 0.00 0.00 43.02 39.39 2vir s PHE 89 CO 0.03 0.26 0.07 0.00 -0.10 0.00 0.00 175.22 175.48 2vir s ALA 91 N 0.20 1.67 -0.12 0.00 0.00 0.11 0.46 121.76 124.08 2vir s ALA 91 Ca 0.05 -0.81 0.03 0.00 0.00 0.00 0.00 51.96 51.23 2vir s ALA 91 Cb -0.12 -0.50 0.01 0.00 0.00 0.00 0.00 23.12 22.51 2vir s ALA 91 CO 0.00 0.35 -0.20 -0.51 0.00 0.00 0.00 175.76 175.40 2vir s LEU 92 N -0.18 1.97 -0.05 0.00 1.43 0.55 -0.96 118.68 121.45 2vir s LEU 92 Ca 0.00 -0.53 -0.27 0.00 -1.03 0.00 0.00 54.13 52.30 2vir s LEU 92 Cb -0.10 -1.30 -0.03 0.00 0.03 0.00 0.00 46.19 44.79 2vir s LEU 92 CO 0.01 0.08 0.88 0.86 0.23 0.00 0.00 176.35 178.41 2vir s TRP 93 N 0.76 3.59 -0.40 0.29 -0.11 0.34 -1.52 118.94 121.89 2vir s TRP 93 Ca -0.10 1.50 0.01 0.00 1.22 0.00 0.00 56.10 58.74 2vir s TRP 93 Cb -0.16 -3.02 0.14 0.00 -1.50 0.00 0.00 33.47 28.93 2vir s TRP 93 CO 0.01 -0.03 0.24 0.71 -4.62 0.00 0.00 176.95 173.25 2vir s TYR 94 N 1.20 1.31 -0.76 5.86 2.02 0.04 -4.25 117.35 122.77 2vir s TYR 94 Ca 0.46 -2.03 -0.02 0.00 -0.37 0.00 0.00 57.07 55.11 2vir s TYR 94 Cb -0.19 -1.35 0.00 0.00 -0.40 0.00 0.00 41.96 40.02 2vir s TYR 94 CO 0.22 -0.80 0.65 0.43 -1.57 0.00 0.00 175.55 174.48 2vir n SER 95 N 3.72 -6.52 -2.71 2.29 7.64 -1.26 -3.12 113.62 113.65 2vir n SER 95 Ca 0.12 -0.43 -0.21 0.00 1.01 0.00 0.00 58.87 59.36 2vir n SER 95 Cb 0.37 -3.71 0.02 0.00 -1.01 0.00 0.00 64.21 59.88 2vir n SER 95 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2vir n ASN 96 N -2.03 -5.92 -3.69 6.43 3.02 -1.26 -4.98 115.26 106.83 2vir n ASN 96 Ca -0.13 -0.19 -0.11 0.00 -0.03 0.00 0.00 54.58 54.12 2vir n ASN 96 Cb 0.59 -4.80 -0.11 0.00 -0.61 0.00 0.00 39.78 34.84 2vir n ASN 96 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2vir s HIS 97 N -3.11 -0.57 0.31 3.10 3.76 -1.18 -5.17 115.29 112.43 2vir s HIS 97 Ca 0.20 1.20 0.00 0.00 -0.15 0.00 0.00 55.06 56.31 2vir s HIS 97 Cb -0.09 0.19 -0.04 0.00 1.11 0.00 0.00 32.58 33.76 2vir s HIS 97 CO 0.25 -0.35 0.51 -1.58 -0.85 0.00 0.00 174.74 172.72 2vir s TRP 98 N 1.76 3.49 -0.25 1.40 0.52 -1.26 -0.78 118.94 123.82 2vir s TRP 98 Ca -0.07 0.35 -0.02 0.00 0.02 0.00 0.00 56.10 56.39 2vir s TRP 98 Cb -0.10 -1.89 0.12 0.00 -1.15 0.00 0.00 33.47 30.45 2vir s TRP 98 CO -0.11 0.19 0.28 0.08 0.02 0.00 0.00 176.95 177.40 2vir s VAL 99 N -2.20 -0.41 0.80 4.03 1.01 -0.58 -4.92 120.40 118.13 2vir s VAL 99 Ca 0.40 -0.27 -0.12 0.00 0.00 0.00 0.00 61.98 61.99 2vir s VAL 99 Cb -0.10 -0.84 0.07 0.00 0.00 0.00 0.00 36.38 35.51 2vir s VAL 99 CO 0.34 -0.31 1.17 -0.36 0.00 0.00 0.00 175.10 175.94 2vir s PHE 100 N 2.38 2.99 0.52 5.22 0.40 -1.26 -0.33 117.98 127.90 2vir s PHE 100 Ca 0.09 0.77 0.08 0.00 -0.60 0.00 0.00 56.93 57.28 2vir s PHE 100 Cb -0.15 -3.45 0.06 0.00 0.51 0.00 0.00 43.02 39.99 2vir s PHE 100 CO -0.22 -1.71 0.72 0.20 0.70 0.00 0.00 175.22 174.91 2vir s GLY 101 N -4.56 1.81 0.36 4.36 0.00 0.17 -4.22 107.32 105.24 2vir s GLY 101 Ca 0.62 -1.93 0.27 0.00 0.00 0.00 0.00 44.72 43.67 2vir s GLY 101 CO 0.49 -1.58 1.80 -1.33 0.00 0.00 0.00 173.10 172.49 2vir h GLY 102 N 0.31 0.00 0.00 0.20 0.00 -1.86 -3.43 103.07 98.29 2vir h GLY 102 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.99 2vir h GLY 102 CO 0.43 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.58 2vir n GLY 103 N -0.31 -0.16 3.19 4.60 0.00 -1.26 -5.04 105.19 106.21 2vir n GLY 103 Ca 0.01 -1.61 -0.27 0.00 0.00 0.00 0.00 46.02 44.15 2vir n GLY 103 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vir s THR 104 N -2.99 1.55 -0.24 2.61 2.01 -1.13 -4.48 115.64 112.98 2vir s THR 104 Ca 0.00 -0.82 -0.15 0.00 0.31 0.00 0.00 61.69 61.04 2vir s THR 104 Cb 0.00 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 71.16 2vir s THR 104 CO 0.00 0.44 0.36 -0.75 -0.69 0.00 0.00 174.62 173.98 2vir s LYS 105 N -0.26 4.08 -0.24 4.92 2.47 -0.08 -0.63 119.74 129.99 2vir s LYS 105 Ca 0.03 0.06 -0.06 0.00 -1.56 0.00 0.00 55.97 54.43 2vir s LYS 105 Cb -0.09 -3.60 -0.02 0.00 -1.46 0.00 0.00 37.83 32.65 2vir s LYS 105 CO 0.01 -0.16 0.04 -1.17 0.16 0.00 0.00 175.35 174.23 2vir s LEU 106 N 1.70 3.29 0.01 5.43 2.96 -0.28 0.44 118.68 132.22 2vir s LEU 106 Ca 0.15 -0.26 -0.06 0.00 -0.22 0.00 0.00 54.13 53.75 2vir s LEU 106 Cb -0.15 -1.87 -0.05 0.00 0.50 0.00 0.00 46.19 44.62 2vir s LEU 106 CO 0.09 -0.03 0.26 -0.89 -1.32 0.00 0.00 176.35 174.46 2vir s THR 107 N 1.57 5.32 -0.50 3.68 2.01 0.09 -3.05 115.64 124.75 2vir s THR 107 Ca 0.06 0.11 0.07 0.00 0.31 0.00 0.00 61.69 62.24 2vir s THR 107 Cb -0.15 -3.56 0.24 0.00 0.01 0.00 0.00 72.50 69.03 2vir s THR 107 CO 0.02 0.35 0.58 0.52 -0.69 0.00 0.00 174.62 175.39 2vir n VAL 108 N 1.05 0.48 -0.26 3.82 0.31 -1.24 -1.26 118.33 121.23 2vir n VAL 108 Ca -0.11 -4.43 -0.09 0.00 -0.01 0.00 0.00 64.34 59.70 2vir n VAL 108 Cb 0.53 -1.99 -0.03 0.00 -0.91 0.00 0.00 33.84 31.44 2vir n VAL 108 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2vir n LEU 109 N 1.40 0.09 -0.04 7.52 7.99 -0.47 -4.69 117.00 128.80 2vir n LEU 109 Ca 0.25 0.07 0.01 0.00 -0.01 0.00 0.00 56.01 56.33 2vir n LEU 109 Cb 0.47 -0.17 0.00 0.00 -0.11 0.00 0.00 43.42 43.61 2vir n LEU 109 CO 0.26 -0.14 0.20 0.61 -1.51 0.00 0.00 177.39 176.81 2vir n GLY 110 N 1.28 -0.83 3.24 -0.72 0.00 -1.26 -4.32 105.19 102.57 2vir n GLY 110 Ca 0.11 -0.03 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 2vir n GLY 110 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2vir s GLN 111 N -0.34 0.97 0.41 1.61 -2.07 -1.26 -5.14 119.66 113.83 2vir s GLN 111 Ca 0.01 -1.17 -0.27 0.00 -1.82 0.00 0.00 55.36 52.12 2vir s GLN 111 Cb 0.01 0.32 -0.10 0.00 -1.09 0.00 0.00 33.01 32.16 2vir s GLN 111 CO 0.02 -0.32 1.43 -2.14 -1.32 0.00 0.00 175.29 172.96 2vir s PRO 112 N -3.95 3.94 0.20 9.60 0.02 -1.26 -4.94 135.00 138.61 2vir s PRO 112 Ca 0.14 2.43 -0.33 0.00 0.02 0.00 0.00 61.00 63.27 2vir s PRO 112 Cb 0.05 -2.82 -0.13 0.00 0.02 0.00 0.00 34.50 31.61 2vir s PRO 112 CO -0.04 -0.62 1.56 1.17 -0.33 0.00 0.00 177.00 178.74 2vir n LYS 113 N 0.18 2.26 -5.29 5.54 4.81 -1.26 -4.84 118.16 119.56 2vir n LYS 113 Ca 0.03 0.81 -0.31 0.00 -0.87 0.00 0.00 58.31 57.97 2vir n LYS 113 Cb 0.41 -2.57 -0.16 0.00 0.02 0.00 0.00 35.03 32.73 2vir n LYS 113 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2vir s SER 114 N 0.75 3.04 0.21 3.14 0.15 0.22 -4.90 113.70 116.30 2vir s SER 114 Ca 0.74 -0.48 -0.19 0.00 0.70 0.00 0.00 55.95 56.73 2vir s SER 114 Cb -0.63 -0.46 -0.08 0.00 -1.71 0.00 0.00 66.02 63.14 2vir s SER 114 CO 0.41 0.30 0.70 -0.44 1.20 0.00 0.00 173.24 175.41 2vir s SER 115 N -0.50 7.02 0.80 5.45 0.01 -1.26 -1.10 113.70 124.12 2vir s SER 115 Ca 0.07 1.37 -0.10 0.00 1.31 0.00 0.00 55.95 58.59 2vir s SER 115 Cb -0.11 -2.40 0.07 0.00 0.21 0.00 0.00 66.02 63.80 2vir s SER 115 CO 0.00 0.04 1.10 -2.16 0.41 0.00 0.00 173.24 172.64 2vir s PRO 116 N -1.97 2.02 -0.29 12.44 0.04 -1.26 -4.41 135.00 141.56 2vir s PRO 116 Ca 0.42 1.24 -0.08 0.00 0.04 0.00 0.00 61.00 62.62 2vir s PRO 116 Cb -0.16 -1.86 -0.00 0.00 0.04 0.00 0.00 34.50 32.51 2vir s PRO 116 CO 0.21 -1.83 0.10 -1.12 0.04 0.00 0.00 177.00 174.39 2vir s SER 117 N -3.26 5.23 0.02 6.66 0.01 0.62 -4.90 113.70 118.08 2vir s SER 117 Ca 0.62 -0.56 -0.03 0.00 1.31 0.00 0.00 55.95 57.29 2vir s SER 117 Cb -0.18 -1.92 -0.04 0.00 0.21 0.00 0.00 66.02 64.09 2vir s SER 117 CO 0.56 -0.16 0.21 -0.69 0.41 0.00 0.00 173.24 173.58 2vir s VAL 118 N 1.55 5.39 -0.09 3.43 1.01 -1.26 -1.92 120.40 128.51 2vir s VAL 118 Ca 0.04 -0.15 -0.04 0.00 0.00 0.00 0.00 61.98 61.83 2vir s VAL 118 Cb -0.17 -3.57 0.05 0.00 0.00 0.00 0.00 36.38 32.69 2vir s VAL 118 CO 0.04 0.27 0.20 -0.89 0.00 0.00 0.00 175.10 174.71 2vir s THR 119 N -1.39 -0.14 -0.14 3.92 2.01 -1.08 -4.99 115.64 113.84 2vir s THR 119 Ca 0.30 0.22 -0.01 0.00 0.31 0.00 0.00 61.69 62.50 2vir s THR 119 Cb -0.13 -0.32 -0.02 0.00 0.01 0.00 0.00 72.50 72.04 2vir s THR 119 CO 0.21 0.09 -0.10 -0.22 -0.69 0.00 0.00 174.62 173.91 2vir s LEU 120 N 1.58 2.90 -0.12 4.42 2.96 -1.26 -1.25 118.68 127.91 2vir s LEU 120 Ca -0.06 -0.26 0.00 0.00 -0.22 0.00 0.00 54.13 53.60 2vir s LEU 120 Cb -0.11 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 44.89 2vir s LEU 120 CO -0.07 0.16 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.63 2vir s PHE 121 N 0.37 2.80 0.50 5.38 0.08 -0.43 -5.00 117.98 121.67 2vir s PHE 121 Ca -0.08 -0.56 -0.11 0.00 0.12 0.00 0.00 56.93 56.30 2vir s PHE 121 Cb -0.15 -1.81 -0.06 0.00 -0.57 0.00 0.00 43.02 40.43 2vir s PHE 121 CO 0.05 -0.14 0.89 -1.25 -0.10 0.00 0.00 175.22 174.67 2vir s PRO 122 N 0.18 3.74 0.44 0.24 0.04 -1.26 -2.53 135.00 135.85 2vir s PRO 122 Ca -0.07 0.62 -0.25 0.00 0.04 0.00 0.00 61.00 61.33 2vir s PRO 122 Cb -0.15 -2.24 -0.08 0.00 0.04 0.00 0.00 34.50 32.06 2vir s PRO 122 CO 0.05 -0.26 1.41 -1.25 0.04 0.00 0.00 177.00 176.99 2vir s PRO 123 N -4.39 3.74 0.17 0.56 0.04 -1.26 -4.91 135.00 128.96 2vir s PRO 123 Ca 0.54 2.38 -0.30 0.00 0.04 0.00 0.00 61.00 63.65 2vir s PRO 123 Cb -0.10 -2.68 -0.07 0.00 0.04 0.00 0.00 34.50 31.68 2vir s PRO 123 CO 0.39 -0.76 0.97 -1.54 0.04 0.00 0.00 177.00 176.10 2vir s SER 124 N -0.54 7.53 0.29 6.66 1.04 -1.26 -4.93 113.70 122.50 2vir s SER 124 Ca 0.60 1.90 -0.00 0.00 0.48 0.00 0.00 55.95 58.93 2vir s SER 124 Cb -0.43 -2.60 0.68 0.00 0.10 0.00 0.00 66.02 63.77 2vir s SER 124 CO 0.55 0.01 1.59 0.77 0.98 0.00 0.00 173.24 177.14 2vir h SER 125 N 4.90 -0.40 0.27 7.02 4.64 -1.98 0.19 113.55 128.20 2vir h SER 125 Ca -0.44 0.25 0.01 0.00 -0.47 0.00 0.00 61.79 61.14 2vir h SER 125 Cb 1.21 0.43 -0.04 0.00 -0.31 0.00 0.00 62.40 63.69 2vir h SER 125 CO 0.70 -0.29 -0.45 -0.33 -0.87 0.00 0.00 176.83 175.58 2vir h GLU 126 N 0.05 -0.76 -0.53 4.77 3.07 -1.99 0.11 114.58 119.32 2vir h GLU 126 Ca 0.55 0.05 0.05 0.00 -0.50 0.00 0.00 59.36 59.52 2vir h GLU 126 Cb 1.11 0.17 -0.03 0.00 -0.84 0.00 0.00 28.75 29.16 2vir h GLU 126 CO -0.84 -0.51 0.35 1.49 -1.40 0.00 0.00 179.01 178.11 2vir h GLU 127 N -0.79 0.50 -0.33 2.33 4.81 -1.03 -1.60 114.58 118.47 2vir h GLU 127 Ca -0.01 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 59.08 2vir h GLU 127 Cb 0.75 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 2vir h GLU 127 CO -0.17 0.33 -0.24 -0.07 -0.73 0.00 0.00 179.01 178.13 2vir h LEU 128 N 0.52 0.66 -1.13 1.64 3.38 0.84 -2.73 115.31 118.49 2vir h LEU 128 Ca 0.22 -0.24 0.12 0.00 0.09 0.00 0.00 57.88 58.08 2vir h LEU 128 Cb 0.22 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 40.72 2vir h LEU 128 CO -0.06 0.89 0.60 -0.33 0.09 0.00 0.00 178.44 179.63 2vir h GLU 129 N 0.57 0.86 -0.88 1.13 5.08 0.17 0.41 114.58 121.93 2vir h GLU 129 Ca 0.08 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2vir h GLU 129 Cb 0.72 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 2vir h GLU 129 CO 0.06 0.57 0.01 0.25 -1.00 0.00 0.00 179.01 178.89 2vir n THR 130 N -4.58 0.86 -3.64 1.13 -2.24 -1.04 -4.91 114.28 99.87 2vir n THR 130 Ca 0.18 -0.42 -0.23 0.00 -2.27 0.00 0.00 64.05 61.31 2vir n THR 130 Cb 0.37 -0.45 0.06 0.00 -2.10 0.00 0.00 70.33 68.22 2vir n THR 130 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2vir n ASN 131 N 0.18 -3.72 -3.78 3.42 4.13 0.14 -5.00 115.26 110.64 2vir n ASN 131 Ca 0.09 -0.67 -0.13 0.00 1.68 0.00 0.00 54.58 55.55 2vir n ASN 131 Cb 0.55 -4.63 -0.10 0.00 -1.54 0.00 0.00 39.78 34.06 2vir n ASN 131 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2vir s LYS 132 N -6.03 0.48 -0.07 3.52 1.02 -1.18 -3.35 119.74 114.13 2vir s LYS 132 Ca 0.31 0.11 0.00 0.00 0.02 0.00 0.00 55.97 56.42 2vir s LYS 132 Cb -0.14 0.22 0.02 0.00 -0.52 0.00 0.00 37.83 37.41 2vir s LYS 132 CO 0.77 -0.10 -0.04 0.00 -0.92 0.00 0.00 175.35 175.05 2vir s ALA 133 N -0.54 0.86 -0.25 5.17 0.00 0.73 -3.15 121.76 124.58 2vir s ALA 133 Ca -0.06 -0.20 -0.00 0.00 0.00 0.00 0.00 51.96 51.69 2vir s ALA 133 Cb -0.04 -0.62 0.07 0.00 0.00 0.00 0.00 23.12 22.53 2vir s ALA 133 CO 0.02 -0.21 0.01 0.99 0.00 0.00 0.00 175.76 176.57 2vir s THR 134 N 1.35 1.20 0.07 0.00 2.01 -1.26 -0.65 115.64 118.36 2vir s THR 134 Ca -0.04 -1.17 -0.31 0.00 0.31 0.00 0.00 61.69 60.48 2vir s THR 134 Cb -0.14 -1.65 -0.07 0.00 0.01 0.00 0.00 72.50 70.66 2vir s THR 134 CO -0.03 -0.28 1.37 -0.76 -0.69 0.00 0.00 174.62 174.23 2vir s LEU 135 N 1.52 4.35 -0.29 4.42 2.01 0.25 -4.47 118.68 126.47 2vir s LEU 135 Ca -0.00 2.21 -0.02 0.00 0.01 0.00 0.00 54.13 56.33 2vir s LEU 135 Cb -0.18 -3.58 0.04 0.00 0.01 0.00 0.00 46.19 42.49 2vir s LEU 135 CO -0.10 -0.65 -0.02 -0.69 1.01 0.00 0.00 176.35 175.90 2vir s VAL 136 N 1.55 2.97 -0.32 -1.59 1.01 -1.05 -0.91 120.40 122.05 2vir s VAL 136 Ca 0.64 -1.29 -0.08 0.00 0.00 0.00 0.00 61.98 61.25 2vir s VAL 136 Cb -0.34 -2.66 0.01 0.00 0.00 0.00 0.00 36.38 33.40 2vir s VAL 136 CO 0.29 -0.03 0.12 0.00 0.00 0.00 0.00 175.10 175.48 2vir s THR 138 N 1.52 5.13 -0.22 0.00 -4.23 -0.38 -1.33 115.64 116.12 2vir s THR 138 Ca 0.02 -1.05 -0.19 0.00 -1.18 0.00 0.00 61.69 59.29 2vir s THR 138 Cb -0.18 -4.04 -0.03 0.00 1.34 0.00 0.00 72.50 69.59 2vir s THR 138 CO 0.04 -0.54 0.56 -0.63 -0.54 0.00 0.00 174.62 173.52 2vir s ILE 139 N 1.62 5.06 0.20 2.99 1.01 -1.08 -2.63 121.20 128.37 2vir s ILE 139 Ca 0.04 1.02 -0.01 0.00 0.00 0.00 0.00 60.65 61.70 2vir s ILE 139 Cb -0.23 -3.88 -0.04 0.00 0.01 0.00 0.00 42.46 38.32 2vir s ILE 139 CO 0.07 0.12 0.12 0.42 0.00 0.00 0.00 174.94 175.66 2vir s THR 140 N 1.99 0.07 -1.13 2.92 -4.23 -0.81 -0.15 115.64 114.30 2vir s THR 140 Ca 0.25 -1.99 -0.03 0.00 -1.18 0.00 0.00 61.69 58.73 2vir s THR 140 Cb -0.16 -2.47 0.02 0.00 1.34 0.00 0.00 72.50 71.23 2vir s THR 140 CO 0.09 -0.04 0.20 0.47 -0.54 0.00 0.00 174.62 174.80 2vir n ASP 141 N -0.27 -3.90 -4.92 3.99 8.00 0.30 -0.28 116.55 119.47 2vir n ASP 141 Ca 0.01 -0.02 -0.26 0.00 0.71 0.00 0.00 54.79 55.23 2vir n ASP 141 Cb 0.66 -3.28 -0.01 0.00 -0.02 0.00 0.00 41.12 38.47 2vir n ASP 141 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2vir s PHE 142 N -2.74 3.53 -0.28 1.24 -0.71 -0.43 -4.43 117.98 114.15 2vir s PHE 142 Ca 0.15 0.62 -0.20 0.00 -1.04 0.00 0.00 56.93 56.46 2vir s PHE 142 Cb -0.08 -2.13 0.10 0.00 -1.21 0.00 0.00 43.02 39.70 2vir s PHE 142 CO 0.19 -0.08 0.81 -0.47 -1.34 0.00 0.00 175.22 174.33 2vir s TYR 143 N -2.51 -0.80 0.77 3.49 5.04 -0.26 0.43 117.35 123.51 2vir s TYR 143 Ca 0.44 1.73 -0.11 0.00 -2.44 0.00 0.00 57.07 56.69 2vir s TYR 143 Cb -0.10 0.44 0.05 0.00 0.35 0.00 0.00 41.96 42.70 2vir s TYR 143 CO 0.40 -0.39 1.09 -1.25 -1.34 0.00 0.00 175.55 174.05 2vir s PRO 144 N 1.03 2.31 -0.45 4.97 0.04 -1.26 0.71 135.00 142.34 2vir s PRO 144 Ca -0.05 1.09 -0.28 0.00 0.04 0.00 0.00 61.00 61.80 2vir s PRO 144 Cb -0.05 -1.91 -0.29 0.00 0.04 0.00 0.00 34.50 32.29 2vir s PRO 144 CO -0.11 -1.58 1.79 0.41 0.04 0.00 0.00 177.00 177.55 2vir n GLY 145 N -1.38 0.61 3.53 0.56 0.00 -1.26 -4.79 105.19 102.47 2vir n GLY 145 Ca 0.09 -0.72 -0.01 0.00 0.00 0.00 0.00 46.02 45.38 2vir n GLY 145 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vir s VAL 146 N 9.51 -0.48 0.19 1.61 0.11 -1.26 -4.93 120.40 125.15 2vir s VAL 146 Ca 0.70 0.00 -0.03 0.00 -2.93 0.00 0.00 61.98 59.72 2vir s VAL 146 Cb 0.09 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.91 2vir s VAL 146 CO 0.26 0.00 0.17 0.68 -3.33 0.00 0.00 175.10 172.89 2vir s VAL 147 N 2.27 0.03 -0.06 2.04 -7.23 -1.26 -4.59 120.40 111.61 2vir s VAL 147 Ca -0.05 -1.85 0.01 0.00 -1.81 0.00 0.00 61.98 58.28 2vir s VAL 147 Cb -0.07 -2.30 0.02 0.00 0.56 0.00 0.00 36.38 34.59 2vir s VAL 147 CO -0.18 -0.13 -0.06 -0.89 -0.31 0.00 0.00 175.10 173.54 2vir s THR 148 N -4.10 0.69 -0.14 5.32 2.01 -0.65 -4.96 115.64 113.80 2vir s THR 148 Ca 0.32 -0.19 -0.03 0.00 0.31 0.00 0.00 61.69 62.10 2vir s THR 148 Cb 0.06 -0.70 -0.03 0.00 0.01 0.00 0.00 72.50 71.84 2vir s THR 148 CO 0.08 0.27 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.55 2vir s VAL 149 N 1.02 3.90 -0.04 3.82 1.01 -1.26 -0.52 120.40 128.33 2vir s VAL 149 Ca -0.09 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 61.55 2vir s VAL 149 Cb -0.14 -2.69 0.01 0.00 0.00 0.00 0.00 36.38 33.55 2vir s VAL 149 CO -0.00 0.51 -0.09 -1.81 0.00 0.00 0.00 175.10 173.71 2vir s ASP 150 N 0.18 1.34 0.10 3.32 1.01 0.02 -4.96 116.67 117.66 2vir s ASP 150 Ca -0.02 -0.21 0.02 0.00 0.71 0.00 0.00 52.55 53.05 2vir s ASP 150 Cb -0.14 -0.50 -0.04 0.00 1.01 0.00 0.00 42.92 43.26 2vir s ASP 150 CO 0.03 0.03 0.19 0.26 0.21 0.00 0.00 175.17 175.90 2vir s TRP 151 N 0.47 3.41 -0.00 4.23 0.52 -1.26 1.00 118.94 127.30 2vir s TRP 151 Ca -0.08 0.16 0.00 0.00 0.02 0.00 0.00 56.10 56.20 2vir s TRP 151 Cb -0.12 -1.69 0.00 0.00 -1.15 0.00 0.00 33.47 30.52 2vir s TRP 151 CO 0.01 0.55 -0.00 0.15 0.02 0.00 0.00 176.95 177.68 2vir s LYS 152 N -2.72 0.08 -0.14 4.98 -0.14 0.54 -1.97 119.74 120.38 2vir s LYS 152 Ca 0.33 -0.00 0.02 0.00 -1.36 0.00 0.00 55.97 54.96 2vir s LYS 152 Cb -0.12 -0.12 0.01 0.00 -1.68 0.00 0.00 37.83 35.92 2vir s LYS 152 CO 0.26 -0.01 -0.20 0.08 -0.76 0.00 0.00 175.35 174.72 2vir s VAL 153 N 0.16 1.93 -1.64 3.17 1.01 0.14 -0.70 120.40 124.47 2vir s VAL 153 Ca -0.01 -0.90 -0.14 0.00 0.00 0.00 0.00 61.98 60.93 2vir s VAL 153 Cb -0.03 -1.72 0.12 0.00 0.00 0.00 0.00 36.38 34.75 2vir s VAL 153 CO -0.00 0.52 0.68 0.47 0.00 0.00 0.00 175.10 176.77 2vir n ASP 154 N 4.17 -2.50 0.00 3.32 8.00 0.14 0.23 116.55 129.90 2vir n ASP 154 Ca -0.20 -1.02 0.00 0.00 0.71 0.00 0.00 54.79 54.28 2vir n ASP 154 Cb 0.51 -2.76 0.00 0.00 -0.02 0.00 0.00 41.12 38.85 2vir n ASP 154 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2vir n GLY 155 N -1.57 2.25 3.79 0.44 0.00 -1.26 -4.97 105.19 103.87 2vir n GLY 155 Ca -0.02 -0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.68 2vir n GLY 155 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2vir s THR 156 N -0.03 3.62 -0.05 2.61 -4.23 0.14 -4.99 115.64 112.71 2vir s THR 156 Ca 0.00 0.62 -0.24 0.00 -1.18 0.00 0.00 61.69 60.89 2vir s THR 156 Cb 0.00 -3.19 -0.04 0.00 1.34 0.00 0.00 72.50 70.61 2vir s THR 156 CO 0.00 -0.60 0.73 -2.16 -0.54 0.00 0.00 174.62 172.06 2vir s PRO 157 N -4.61 4.45 0.24 3.99 0.04 -1.26 0.26 135.00 138.12 2vir s PRO 157 Ca 0.62 0.95 -0.19 0.00 0.04 0.00 0.00 61.00 62.42 2vir s PRO 157 Cb -0.17 -3.44 -0.08 0.00 0.04 0.00 0.00 34.50 30.85 2vir s PRO 157 CO 0.49 0.08 0.73 0.08 0.04 0.00 0.00 177.00 178.43 2vir s VAL 158 N 0.70 4.58 0.00 -0.36 1.01 -0.83 -4.86 120.40 120.63 2vir s VAL 158 Ca 0.39 1.24 0.00 0.00 0.00 0.00 0.00 61.98 63.61 2vir s VAL 158 Cb -0.18 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.38 2vir s VAL 158 CO 0.20 0.13 0.96 0.35 0.00 0.00 0.00 175.10 176.74 2vir n THR 159 N 0.52 0.00 -4.02 3.92 -2.24 -1.26 -4.70 114.28 106.50 2vir n THR 159 Ca -0.01 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.68 2vir n THR 159 Cb 0.51 0.53 -0.08 0.00 -2.10 0.00 0.00 70.33 69.19 2vir n THR 159 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2vir s GLN 160 N 0.00 0.97 -0.11 -0.78 -2.07 -1.26 -4.90 119.66 111.52 2vir s GLN 160 Ca 0.00 -1.23 0.00 0.00 -1.82 0.00 0.00 55.36 52.31 2vir s GLN 160 Cb 0.00 0.31 0.00 0.00 -1.09 0.00 0.00 33.01 32.23 2vir s GLN 160 CO 0.00 -0.31 0.00 0.41 -1.32 0.00 0.00 175.29 174.07 2vir n GLY 161 N -0.12 0.10 3.66 2.60 0.00 -1.26 -4.78 105.19 105.39 2vir n GLY 161 Ca -0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.58 2vir n GLY 161 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2vir s MET 162 N -1.80 3.17 -0.02 1.61 0.23 -1.24 0.32 119.30 121.56 2vir s MET 162 Ca 0.00 -0.41 -0.00 0.00 -1.03 0.00 0.00 55.69 54.25 2vir s MET 162 Cb 0.00 -2.86 0.03 0.00 -1.53 0.00 0.00 34.83 30.47 2vir s MET 162 CO 0.00 0.61 0.03 -2.00 -2.03 0.00 0.00 175.02 171.63 2vir s GLU 163 N -0.62 -0.00 -0.12 3.16 2.56 -0.77 -4.95 118.70 117.95 2vir s GLU 163 Ca 0.10 0.20 0.03 0.00 0.00 0.00 0.00 54.97 55.30 2vir s GLU 163 Cb -0.12 -0.31 0.00 0.00 2.00 0.00 0.00 34.13 35.71 2vir s GLU 163 CO 0.02 -0.18 -0.22 0.99 -0.56 0.00 0.00 175.26 175.31 2vir s THR 164 N 1.19 2.18 0.68 -1.70 2.01 -1.26 -0.22 115.64 118.51 2vir s THR 164 Ca -0.08 -0.96 -0.14 0.00 0.31 0.00 0.00 61.69 60.83 2vir s THR 164 Cb -0.13 -1.86 0.01 0.00 0.01 0.00 0.00 72.50 70.53 2vir s THR 164 CO -0.03 0.55 1.09 0.42 -0.69 0.00 0.00 174.62 175.97 2vir s THR 165 N 0.56 3.41 0.62 -0.82 -4.23 0.16 -4.99 115.64 110.35 2vir s THR 165 Ca -0.13 0.60 -0.13 0.00 -1.18 0.00 0.00 61.69 60.85 2vir s THR 165 Cb -0.17 -3.13 -0.03 0.00 1.34 0.00 0.00 72.50 70.52 2vir s THR 165 CO 0.04 -0.46 1.04 -1.58 -0.54 0.00 0.00 174.62 173.12 2vir s GLN 166 N -4.34 3.37 0.53 3.99 2.00 -1.26 -4.41 119.66 119.54 2vir s GLN 166 Ca 0.64 0.95 -0.21 0.00 -2.00 0.00 0.00 55.36 54.74 2vir s GLN 166 Cb -0.19 -2.05 -0.05 0.00 0.80 0.00 0.00 33.01 31.52 2vir s GLN 166 CO 0.45 -0.76 1.22 -2.14 -0.50 0.00 0.00 175.29 173.56 2vir s PRO 167 N -4.73 3.31 -0.03 1.67 0.02 -1.26 -4.76 135.00 129.22 2vir s PRO 167 Ca 0.58 1.88 0.05 0.00 0.02 0.00 0.00 61.00 63.53 2vir s PRO 167 Cb -0.13 -2.17 -0.01 0.00 0.02 0.00 0.00 34.50 32.21 2vir s PRO 167 CO 0.47 -0.95 -0.17 -1.12 -0.33 0.00 0.00 177.00 174.90 2vir s SER 168 N -1.39 2.10 0.66 2.53 0.01 -0.31 -4.99 113.70 112.31 2vir s SER 168 Ca 0.71 -0.33 -0.17 0.00 1.31 0.00 0.00 55.95 57.47 2vir s SER 168 Cb -0.31 -0.41 0.00 0.00 0.21 0.00 0.00 66.02 65.51 2vir s SER 168 CO 0.36 0.18 1.19 -0.75 0.41 0.00 0.00 173.24 174.64 2vir s LYS 169 N -0.19 2.59 0.53 12.44 2.47 -1.26 -1.68 119.74 134.65 2vir s LYS 169 Ca 0.02 1.74 0.05 0.00 -1.56 0.00 0.00 55.97 56.22 2vir s LYS 169 Cb -0.09 -1.89 0.03 0.00 -1.46 0.00 0.00 37.83 34.42 2vir s LYS 169 CO 0.01 -1.48 0.37 -0.65 0.16 0.00 0.00 175.35 173.75 2vir s GLN 170 N -3.68 2.26 0.01 4.03 -0.21 -1.02 -4.77 119.66 116.27 2vir s GLN 170 Ca 0.75 -2.03 -0.25 0.00 0.02 0.00 0.00 55.36 53.85 2vir s GLN 170 Cb -0.29 -2.06 -0.19 0.00 1.00 0.00 0.00 33.01 31.47 2vir s GLN 170 CO 0.39 -0.57 1.39 0.66 -2.12 0.00 0.00 175.29 175.04 2vir h SER 171 N 0.82 -0.00 0.00 5.90 4.64 -1.97 -2.46 113.55 120.48 2vir h SER 171 Ca -0.38 -0.36 0.00 0.00 -0.47 0.00 0.00 61.79 60.58 2vir h SER 171 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 2vir h SER 171 CO 0.59 0.36 0.00 -0.46 -0.87 0.00 0.00 176.83 176.45 2vir n ASN 172 N -4.92 0.00 0.00 4.97 0.23 -1.26 -4.82 115.26 109.46 2vir n ASN 172 Ca -0.08 -1.06 0.00 0.00 -0.53 0.00 0.00 54.58 52.91 2vir n ASN 172 Cb 0.19 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.89 2vir n ASN 172 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2vir n ASN 173 N -0.54 -2.82 -2.50 0.53 3.02 -0.93 -4.98 115.26 107.05 2vir n ASN 173 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.56 2vir n ASN 173 Cb 0.00 -2.12 0.00 0.00 -0.61 0.00 0.00 39.78 37.06 2vir n ASN 173 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2vir n LYS 174 N -1.07 2.29 -4.09 3.52 5.02 -1.26 -4.69 118.16 117.87 2vir n LYS 174 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.20 2vir n LYS 174 Cb 0.19 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.09 2vir n LYS 174 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2vir s TYR 175 N 0.42 0.60 0.10 2.13 1.51 0.17 -2.44 117.35 119.84 2vir s TYR 175 Ca 0.00 -0.87 0.06 0.00 -1.01 0.00 0.00 57.07 55.25 2vir s TYR 175 Cb 0.00 -0.39 -0.03 0.00 -0.11 0.00 0.00 41.96 41.42 2vir s TYR 175 CO 0.00 -0.25 -0.14 0.00 -1.11 0.00 0.00 175.55 174.05 2vir s MET 176 N -3.20 0.95 0.37 -0.62 0.23 -0.68 0.11 119.30 116.46 2vir s MET 176 Ca 0.02 -1.15 -0.09 0.00 -1.03 0.00 0.00 55.69 53.45 2vir s MET 176 Cb 0.02 -0.87 0.03 0.00 -1.53 0.00 0.00 34.83 32.48 2vir s MET 176 CO -0.06 0.17 0.64 0.00 -2.03 0.00 0.00 175.02 173.74 2vir s ALA 177 N -1.88 0.01 -0.10 3.16 0.00 0.79 -1.17 121.76 122.57 2vir s ALA 177 Ca 0.05 -1.13 -0.30 0.00 0.00 0.00 0.00 51.96 50.58 2vir s ALA 177 Cb -0.06 0.91 0.08 0.00 0.00 0.00 0.00 23.12 24.05 2vir s ALA 177 CO 0.03 -0.89 0.74 0.45 0.00 0.00 0.00 175.76 176.09 2vir s SER 178 N -3.15 -0.63 0.03 0.00 0.15 -1.26 -2.63 113.70 106.21 2vir s SER 178 Ca 0.23 0.78 0.00 0.00 0.70 0.00 0.00 55.95 57.67 2vir s SER 178 Cb -0.03 0.65 -0.02 0.00 -1.71 0.00 0.00 66.02 64.91 2vir s SER 178 CO 0.16 -0.51 -0.04 -0.55 1.20 0.00 0.00 173.24 173.50 2vir s SER 179 N -0.91 0.38 -0.01 5.45 0.15 -0.45 0.35 113.70 118.66 2vir s SER 179 Ca -0.08 -0.54 0.03 0.00 0.70 0.00 0.00 55.95 56.07 2vir s SER 179 Cb -0.01 0.09 -0.01 0.00 -1.71 0.00 0.00 66.02 64.39 2vir s SER 179 CO 0.07 -0.30 -0.11 -0.31 1.20 0.00 0.00 173.24 173.79 2vir s TYR 180 N -1.59 1.00 -0.18 3.44 2.02 0.70 -1.44 117.35 121.29 2vir s TYR 180 Ca -0.13 -0.21 0.01 0.00 -0.37 0.00 0.00 57.07 56.37 2vir s TYR 180 Cb -0.09 -0.66 0.02 0.00 -0.40 0.00 0.00 41.96 40.83 2vir s TYR 180 CO -0.01 -0.04 -0.18 -1.17 -1.57 0.00 0.00 175.55 172.57 2vir s LEU 181 N -0.15 2.21 -0.30 -1.29 2.96 -0.09 -1.85 118.68 120.17 2vir s LEU 181 Ca 0.02 -0.62 -0.03 0.00 -0.22 0.00 0.00 54.13 53.28 2vir s LEU 181 Cb -0.05 -1.51 0.04 0.00 0.50 0.00 0.00 46.19 45.17 2vir s LEU 181 CO -0.00 0.00 0.01 -0.89 -1.32 0.00 0.00 176.35 174.15 2vir s THR 182 N 1.30 3.19 0.13 3.68 2.01 0.15 0.84 115.64 126.94 2vir s THR 182 Ca 0.05 -1.22 0.01 0.00 0.31 0.00 0.00 61.69 60.84 2vir s THR 182 Cb -0.13 -2.77 -0.04 0.00 0.01 0.00 0.00 72.50 69.56 2vir s THR 182 CO -0.12 -0.05 -0.01 -1.48 -0.69 0.00 0.00 174.62 172.27 2vir s LEU 183 N 1.31 2.21 0.34 4.42 0.05 0.18 -4.62 118.68 122.57 2vir s LEU 183 Ca -0.03 -1.12 -0.25 0.00 0.05 0.00 0.00 54.13 52.78 2vir s LEU 183 Cb -0.19 0.02 -0.10 0.00 -2.05 0.00 0.00 46.19 43.87 2vir s LEU 183 CO -0.01 -0.57 0.95 0.42 -0.55 0.00 0.00 176.35 176.60 2vir s THR 184 N -3.73 4.19 0.31 5.48 -4.23 -1.26 -0.19 115.64 116.20 2vir s THR 184 Ca 0.19 1.75 0.02 0.00 -1.18 0.00 0.00 61.69 62.47 2vir s THR 184 Cb 0.06 -3.94 0.41 0.00 1.34 0.00 0.00 72.50 70.37 2vir s THR 184 CO -0.00 0.08 1.57 0.00 -0.54 0.00 0.00 174.62 175.73 2vir h ALA 185 N 2.98 1.17 -0.26 3.99 0.00 -1.80 1.10 119.26 126.43 2vir h ALA 185 Ca -0.47 0.34 0.06 0.00 0.00 0.00 0.00 54.91 54.84 2vir h ALA 185 Cb 1.19 0.59 -0.07 0.00 0.00 0.00 0.00 17.79 19.50 2vir h ALA 185 CO 0.64 -0.57 -0.23 0.07 0.00 0.00 0.00 179.25 179.16 2vir h ARG 186 N 0.01 -0.22 0.00 0.00 0.11 -1.92 0.28 114.38 112.65 2vir h ARG 186 Ca 0.60 0.01 -0.06 0.00 0.10 0.00 0.00 59.98 60.63 2vir h ARG 186 Cb 1.22 0.05 -0.01 0.00 1.11 0.00 0.00 29.97 32.35 2vir h ARG 186 CO -0.91 -0.14 -0.27 0.00 0.10 0.00 0.00 179.97 178.74 2vir h ALA 187 N 0.85 1.25 0.00 0.08 0.00 0.75 -1.48 119.26 120.70 2vir h ALA 187 Ca 0.14 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 2vir h ALA 187 Cb 0.45 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2vir h ALA 187 CO -0.40 0.34 -0.56 2.35 0.00 0.00 0.00 179.25 180.98 2vir h TRP 188 N 0.00 0.00 0.03 0.00 2.91 0.17 -3.07 115.95 115.99 2vir h TRP 188 Ca -0.00 0.00 -0.25 0.00 1.13 0.00 0.00 58.89 59.77 2vir h TRP 188 Cb 0.60 0.00 0.01 0.00 -0.51 0.00 0.00 29.16 29.26 2vir h TRP 188 CO 0.00 0.56 -1.04 0.93 -1.03 0.00 0.00 178.44 177.86 2vir h GLU 189 N 0.00 0.49 0.00 2.65 5.08 0.42 -3.31 114.58 119.91 2vir h GLU 189 Ca -0.01 -0.57 0.00 0.00 -1.00 0.00 0.00 59.36 57.78 2vir h GLU 189 Cb 1.11 0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2vir h GLU 189 CO 0.07 1.21 0.24 -2.13 -1.00 0.00 0.00 179.01 177.40 2vir n ARG 190 N -3.76 0.06 -4.28 2.33 0.63 -0.76 -4.70 116.66 106.18 2vir n ARG 190 Ca -0.09 0.47 -0.15 0.00 -0.92 0.00 0.00 57.85 57.16 2vir n ARG 190 Cb 0.89 -1.92 -0.10 0.00 0.45 0.00 0.00 32.46 31.77 2vir n ARG 190 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 2vir s HIS 191 N -3.06 1.38 -0.23 -0.14 3.76 -1.25 -5.10 115.29 110.65 2vir s HIS 191 Ca -0.01 -1.02 -0.08 0.00 -0.15 0.00 0.00 55.06 53.81 2vir s HIS 191 Cb 0.02 -0.79 -0.11 0.00 1.11 0.00 0.00 32.58 32.81 2vir s HIS 191 CO 0.08 -0.18 -0.27 0.45 -0.85 0.00 0.00 174.74 173.96 2vir n SER 192 N -0.33 1.84 -4.33 1.40 2.88 -1.26 -5.01 113.62 108.80 2vir n SER 192 Ca -0.05 0.17 -0.32 0.00 -1.33 0.00 0.00 58.87 57.34 2vir n SER 192 Cb 0.64 -0.60 -0.15 0.00 -0.75 0.00 0.00 64.21 63.35 2vir n SER 192 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2vir s SER 193 N -6.84 3.46 -0.05 -3.46 1.04 -1.26 -3.81 113.70 102.78 2vir s SER 193 Ca -0.32 -0.41 0.04 0.00 0.48 0.00 0.00 55.95 55.74 2vir s SER 193 Cb 0.11 -1.04 -0.00 0.00 0.10 0.00 0.00 66.02 65.19 2vir s SER 193 CO 0.44 0.24 -0.18 -0.31 0.98 0.00 0.00 173.24 174.42 2vir s TYR 194 N -0.14 1.77 0.02 5.02 2.02 -0.31 0.23 117.35 125.97 2vir s TYR 194 Ca -0.03 -0.52 0.01 0.00 -0.37 0.00 0.00 57.07 56.16 2vir s TYR 194 Cb -0.14 -1.19 -0.01 0.00 -0.40 0.00 0.00 41.96 40.21 2vir s TYR 194 CO 0.04 -0.18 -0.05 -1.54 -1.57 0.00 0.00 175.55 172.25 2vir s SER 195 N 0.05 0.53 -0.19 2.29 1.04 0.12 -0.34 113.70 117.20 2vir s SER 195 Ca -0.05 -0.34 -0.00 0.00 0.48 0.00 0.00 55.95 56.04 2vir s SER 195 Cb -0.12 0.02 0.01 0.00 0.10 0.00 0.00 66.02 66.03 2vir s SER 195 CO 0.02 -0.13 -0.16 0.00 0.98 0.00 0.00 173.24 173.96 2vir s GLN 197 N 1.33 2.43 -0.40 0.00 -0.21 0.28 -1.74 119.66 121.34 2vir s GLN 197 Ca 0.05 -1.49 -0.20 0.00 0.02 0.00 0.00 55.36 53.74 2vir s GLN 197 Cb -0.13 -3.61 0.01 0.00 1.00 0.00 0.00 33.01 30.28 2vir s GLN 197 CO -0.10 -0.90 0.61 0.08 -2.12 0.00 0.00 175.29 172.86 2vir s VAL 198 N 1.33 4.88 -0.37 1.09 1.01 -0.59 -0.80 120.40 126.95 2vir s VAL 198 Ca 0.03 0.25 -0.11 0.00 0.00 0.00 0.00 61.98 62.15 2vir s VAL 198 Cb -0.22 -4.13 0.03 0.00 0.00 0.00 0.00 36.38 32.06 2vir s VAL 198 CO 0.00 -0.46 0.21 -0.89 0.00 0.00 0.00 175.10 173.96 2vir s THR 199 N 2.70 4.60 -0.17 3.92 2.01 0.32 0.33 115.64 129.35 2vir s THR 199 Ca 0.22 -0.83 -0.04 0.00 0.31 0.00 0.00 61.69 61.35 2vir s THR 199 Cb -0.15 -3.56 0.06 0.00 0.01 0.00 0.00 72.50 68.87 2vir s THR 199 CO 0.17 -0.22 0.07 -2.28 -0.69 0.00 0.00 174.62 171.66 2vir s HIS 200 N 1.56 0.52 -0.67 4.92 5.65 -0.16 -1.63 115.29 125.48 2vir s HIS 200 Ca 0.02 -0.49 -0.01 0.00 0.25 0.00 0.00 55.06 54.83 2vir s HIS 200 Cb -0.19 -0.81 -0.01 0.00 -1.18 0.00 0.00 32.58 30.39 2vir s HIS 200 CO 0.07 -0.53 0.57 0.39 -0.65 0.00 0.00 174.74 174.58 2vir n GLU 201 N 5.19 -3.30 0.00 2.88 -0.58 -1.26 -3.71 120.64 119.86 2vir n GLU 201 Ca -0.08 0.49 0.00 0.00 -0.42 0.00 0.00 57.16 57.16 2vir n GLU 201 Cb 0.48 -4.35 0.00 0.00 -0.57 0.00 0.00 31.44 27.01 2vir n GLU 201 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2vir n GLY 202 N -1.13 1.91 3.89 0.62 0.00 -1.26 -4.96 105.19 104.26 2vir n GLY 202 Ca -0.14 -0.22 -0.29 0.00 0.00 0.00 0.00 46.02 45.37 2vir n GLY 202 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2vir s HIS 203 N 0.00 3.59 -0.09 1.61 5.04 -1.24 -5.06 115.29 119.13 2vir s HIS 203 Ca 0.00 1.02 0.03 0.00 -1.54 0.00 0.00 55.06 54.58 2vir s HIS 203 Cb 0.00 -2.50 0.00 0.00 0.04 0.00 0.00 32.58 30.12 2vir s HIS 203 CO 0.00 -0.48 -0.20 0.99 -2.34 0.00 0.00 174.74 172.71 2vir s THR 204 N -2.95 1.76 -0.24 0.89 2.01 -1.26 -0.98 115.64 114.87 2vir s THR 204 Ca 0.51 -0.84 0.02 0.00 0.31 0.00 0.00 61.69 61.69 2vir s THR 204 Cb -0.11 -1.54 0.05 0.00 0.01 0.00 0.00 72.50 70.91 2vir s THR 204 CO 0.49 0.49 -0.13 -0.69 -0.69 0.00 0.00 174.62 174.09 2vir s VAL 205 N 0.49 2.19 0.30 3.82 1.01 0.15 -4.95 120.40 123.40 2vir s VAL 205 Ca -0.17 -1.43 0.09 0.00 0.00 0.00 0.00 61.98 60.47 2vir s VAL 205 Cb -0.17 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 2vir s VAL 205 CO 0.07 0.12 0.04 -1.83 0.00 0.00 0.00 175.10 173.50 2vir s GLU 206 N 1.16 2.27 0.11 2.72 -1.05 -1.26 -1.54 118.70 121.11 2vir s GLU 206 Ca -0.05 -1.52 0.04 0.00 -0.15 0.00 0.00 54.97 53.30 2vir s GLU 206 Cb -0.18 -2.12 -0.04 0.00 -0.44 0.00 0.00 34.13 31.35 2vir s GLU 206 CO -0.07 0.25 -0.11 0.15 0.95 0.00 0.00 175.26 176.43 2vir s LYS 207 N -3.73 0.90 0.16 -4.83 -0.14 -0.71 -5.00 119.74 106.40 2vir s LYS 207 Ca 0.34 -1.19 -0.14 0.00 -1.36 0.00 0.00 55.97 53.61 2vir s LYS 207 Cb -0.04 -0.64 0.02 0.00 -1.68 0.00 0.00 37.83 35.49 2vir s LYS 207 CO 0.21 0.11 0.40 -1.54 -0.76 0.00 0.00 175.35 173.77 2vir s SER 208 N -2.48 -0.15 0.26 2.83 1.04 -1.26 -1.77 113.70 112.17 2vir s SER 208 Ca 0.07 -0.55 0.01 0.00 0.48 0.00 0.00 55.95 55.95 2vir s SER 208 Cb -0.03 0.50 -0.00 0.00 0.10 0.00 0.00 66.02 66.58 2vir s SER 208 CO 0.01 -0.94 0.31 0.00 0.98 0.00 0.00 173.24 173.60 2vir n LEU 209 N -0.26 0.00 0.00 2.42 -0.00 0.54 -4.96 117.00 114.75 2vir n LEU 209 Ca -0.11 -2.20 0.00 0.00 -0.00 0.00 0.00 56.01 53.70 2vir n LEU 209 Cb 0.63 1.67 0.00 0.00 -0.00 0.00 0.00 43.42 45.72 2vir n LEU 209 CO 0.19 -0.45 0.00 -1.54 -0.00 0.00 0.00 177.39 175.59