#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vol n ASP 13 N 0.00 0.00 0.14 4.52 -0.08 -1.26 -4.94 116.55 114.93 1vol n ASP 13 Ca 0.00 0.00 0.08 0.00 -1.51 0.00 0.00 54.79 53.36 1vol n ASP 13 Cb 0.00 0.00 0.41 0.00 2.34 0.00 0.00 41.12 43.87 1vol n ASP 13 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1vol n LEU 14 N 0.00 0.39 0.09 -2.67 4.77 -1.26 -0.03 117.00 118.29 1vol n LEU 14 Ca 0.00 0.63 -0.06 0.00 -0.03 0.00 0.00 56.01 56.55 1vol n LEU 14 Cb 0.00 -0.65 -0.01 0.00 -2.33 0.00 0.00 43.42 40.43 1vol n LEU 14 CO 0.00 -0.77 0.26 0.28 -1.33 0.00 0.00 177.39 175.84 1vol h SER 15 N 0.00 0.09 0.00 -1.43 0.02 -1.97 -3.22 113.55 107.04 1vol h SER 15 Ca 0.00 -0.08 -0.27 0.00 -0.84 0.00 0.00 61.79 60.60 1vol h SER 15 Cb 0.24 -0.03 -0.05 0.00 0.14 0.00 0.00 62.40 62.70 1vol h SER 15 CO 0.00 0.91 -2.04 1.17 -1.14 0.00 0.00 176.83 175.73 1vol n LYS 16 N -3.57 0.95 -3.54 3.45 4.81 0.96 -4.77 118.16 116.44 1vol n LYS 16 Ca -0.02 0.06 -0.27 0.00 -0.87 0.00 0.00 58.31 57.21 1vol n LYS 16 Cb 0.81 -1.37 -0.09 0.00 0.02 0.00 0.00 35.03 34.40 1vol n LYS 16 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1vol n HIS 17 N -2.83 3.33 0.27 5.64 8.25 0.80 -4.92 115.22 125.75 1vol n HIS 17 Ca -0.29 -4.17 0.17 0.00 -0.26 0.00 0.00 57.72 53.17 1vol n HIS 17 Cb 0.90 -0.56 0.91 0.00 1.12 0.00 0.00 29.99 32.37 1vol n HIS 17 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1vol h PRO 18 N 4.51 0.00 -0.07 -0.41 0.11 -1.76 0.26 132.00 134.64 1vol h PRO 18 Ca 0.18 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.25 1vol h PRO 18 Cb 0.70 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.80 1vol h PRO 18 CO 0.78 0.00 -0.14 0.66 -0.21 0.00 0.00 178.00 179.09 1vol h SER 19 N 0.00 0.09 0.00 -2.05 4.64 -1.91 -3.46 113.55 110.87 1vol h SER 19 Ca 0.03 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1vol h SER 19 Cb 0.22 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1vol h SER 19 CO -0.00 0.25 0.00 0.61 -0.87 0.00 0.00 176.83 176.82 1vol n GLY 20 N -1.00 0.74 3.20 -0.77 0.00 0.91 -5.04 105.19 103.23 1vol n GLY 20 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 1vol n GLY 20 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vol s ILE 21 N -2.47 1.54 -0.17 -0.61 1.01 -1.26 -4.97 121.20 114.27 1vol s ILE 21 Ca 0.00 -0.87 0.01 0.00 0.00 0.00 0.00 60.65 59.78 1vol s ILE 21 Cb 0.00 -1.29 0.02 0.00 0.01 0.00 0.00 42.46 41.20 1vol s ILE 21 CO 0.00 0.40 -0.18 -0.69 0.00 0.00 0.00 174.94 174.46 1vol s VAL 22 N -0.50 1.93 0.08 2.92 1.01 -1.26 -4.89 120.40 119.69 1vol s VAL 22 Ca 0.07 -0.86 -0.34 0.00 0.00 0.00 0.00 61.98 60.86 1vol s VAL 22 Cb -0.08 -1.75 -0.13 0.00 0.00 0.00 0.00 36.38 34.42 1vol s VAL 22 CO -0.00 0.52 1.68 -2.65 0.00 0.00 0.00 175.10 174.65 1vol n PRO 23 N 4.64 2.18 -2.90 2.72 -0.02 -1.26 -4.95 135.00 135.42 1vol n PRO 23 Ca -0.20 0.79 -0.42 0.00 -2.02 0.00 0.00 63.50 61.65 1vol n PRO 23 Cb 0.50 -2.59 -0.04 0.00 -0.02 0.00 0.00 33.50 31.35 1vol n PRO 23 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1vol s THR 24 N 1.98 4.81 0.35 3.45 -1.32 -0.61 -4.87 115.64 119.44 1vol s THR 24 Ca 0.83 1.48 -0.28 0.00 -1.21 0.00 0.00 61.69 62.51 1vol s THR 24 Cb -0.68 -4.13 -0.11 0.00 -1.51 0.00 0.00 72.50 66.07 1vol s THR 24 CO 0.42 -0.13 1.43 -0.76 -2.21 0.00 0.00 174.62 173.36 1vol s LEU 25 N 2.90 4.36 0.00 9.08 1.43 -1.26 -1.32 118.68 133.87 1vol s LEU 25 Ca 0.35 2.91 0.00 0.00 -1.03 0.00 0.00 54.13 56.35 1vol s LEU 25 Cb -0.15 -3.66 0.00 0.00 0.03 0.00 0.00 46.19 42.41 1vol s LEU 25 CO 0.09 -0.75 0.00 0.00 0.23 0.00 0.00 176.35 175.92 1vol n GLN 26 N 0.69 1.95 -3.60 1.70 1.13 -0.02 -4.87 117.38 114.36 1vol n GLN 26 Ca 0.01 0.00 -0.02 0.00 -1.94 0.00 0.00 57.00 55.05 1vol n GLN 26 Cb 0.40 -0.82 -0.06 0.00 0.11 0.00 0.00 30.24 29.87 1vol n GLN 26 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1vol s ASN 27 N -1.50 -0.51 -0.07 1.08 2.47 -1.05 -4.74 114.94 110.63 1vol s ASN 27 Ca 0.00 0.79 0.04 0.00 0.42 0.00 0.00 52.86 54.11 1vol s ASN 27 Cb 0.00 1.29 -0.01 0.00 -1.45 0.00 0.00 41.25 41.07 1vol s ASN 27 CO 0.00 -0.12 -0.20 -0.63 -3.72 0.00 0.00 177.10 172.42 1vol s ILE 28 N 1.54 2.47 -0.19 -5.21 -1.09 0.63 -1.11 121.20 118.22 1vol s ILE 28 Ca -0.08 -0.91 -0.01 0.00 -2.23 0.00 0.00 60.65 57.42 1vol s ILE 28 Cb -0.04 -1.94 0.01 0.00 -1.58 0.00 0.00 42.46 38.91 1vol s ILE 28 CO -0.15 0.57 -0.14 -0.69 -1.23 0.00 0.00 174.94 173.29 1vol s VAL 29 N -0.18 2.53 0.17 2.92 1.01 -0.33 -3.25 120.40 123.27 1vol s VAL 29 Ca -0.02 -0.78 0.08 0.00 0.00 0.00 0.00 61.98 61.26 1vol s VAL 29 Cb -0.14 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 1vol s VAL 29 CO 0.03 0.50 -0.17 -0.94 0.00 0.00 0.00 175.10 174.52 1vol s SER 30 N 1.36 2.57 0.14 3.32 1.04 -0.48 0.35 113.70 122.00 1vol s SER 30 Ca 0.05 -0.89 0.09 0.00 0.48 0.00 0.00 55.95 55.68 1vol s SER 30 Cb -0.13 -0.14 -0.04 0.00 0.10 0.00 0.00 66.02 65.81 1vol s SER 30 CO -0.09 -0.08 -0.20 0.42 0.98 0.00 0.00 173.24 174.26 1vol s THR 31 N -2.28 1.82 -0.11 2.02 -4.23 -0.20 0.06 115.64 112.73 1vol s THR 31 Ca 0.16 -1.75 -0.13 0.00 -1.18 0.00 0.00 61.69 58.80 1vol s THR 31 Cb -0.04 -1.74 0.03 0.00 1.34 0.00 0.00 72.50 72.09 1vol s THR 31 CO 0.06 -0.17 0.34 0.54 -0.54 0.00 0.00 174.62 174.86 1vol s VAL 32 N -1.58 0.01 -0.30 2.29 0.11 -0.32 -1.11 120.40 119.50 1vol s VAL 32 Ca 0.12 -0.10 -0.09 0.00 -2.93 0.00 0.00 61.98 58.98 1vol s VAL 32 Cb -0.08 -0.52 -0.01 0.00 -1.53 0.00 0.00 36.38 34.25 1vol s VAL 32 CO 0.06 -0.05 0.13 0.21 -3.33 0.00 0.00 175.10 172.11 1vol s ASN 33 N -0.13 5.44 0.12 3.54 2.47 -0.50 -0.00 114.94 125.86 1vol s ASN 33 Ca -0.03 -0.52 0.26 0.00 0.42 0.00 0.00 52.86 52.99 1vol s ASN 33 Cb -0.03 -1.97 0.97 0.00 -1.45 0.00 0.00 41.25 38.76 1vol s ASN 33 CO 0.01 -0.18 1.79 0.18 -3.72 0.00 0.00 177.10 175.19 1vol n LEU 34 N 4.96 0.41 0.00 3.21 4.77 0.48 -1.56 117.00 129.26 1vol n LEU 34 Ca -0.14 0.55 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 1vol n LEU 34 Cb 0.49 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1vol n LEU 34 CO 0.33 -0.17 0.00 -0.67 -1.33 0.00 0.00 177.39 175.55 1vol n ASP 35 N -1.89 0.00 -4.67 -1.43 -0.08 -1.26 0.61 116.55 107.83 1vol n ASP 35 Ca 0.05 0.00 -0.44 0.00 -1.51 0.00 0.00 54.79 52.89 1vol n ASP 35 Cb 0.34 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.78 1vol n ASP 35 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1vol s LYS 37 N -1.05 4.33 0.41 0.00 -0.14 -1.26 -2.69 119.74 119.34 1vol s LYS 37 Ca 0.63 1.31 -0.09 0.00 -1.36 0.00 0.00 55.97 56.46 1vol s LYS 37 Cb -0.64 -3.59 -0.06 0.00 -1.68 0.00 0.00 37.83 31.87 1vol s LYS 37 CO 0.55 -0.45 0.75 -0.51 -0.76 0.00 0.00 175.35 174.94 1vol s LEU 38 N 2.54 3.81 -0.72 3.17 2.01 -1.26 -4.92 118.68 123.31 1vol s LEU 38 Ca 0.45 1.06 -0.07 0.00 0.01 0.00 0.00 54.13 55.58 1vol s LEU 38 Cb -0.17 -3.95 0.19 0.00 0.01 0.00 0.00 46.19 42.27 1vol s LEU 38 CO 0.12 -0.41 0.59 -0.62 1.01 0.00 0.00 176.35 177.04 1vol s ASP 39 N -3.33 5.87 0.29 2.29 2.15 -1.26 -4.53 116.67 118.15 1vol s ASP 39 Ca 0.50 -2.85 -0.03 0.00 0.43 0.00 0.00 52.55 50.60 1vol s ASP 39 Cb -0.10 -2.00 0.41 0.00 -0.30 0.00 0.00 42.92 40.93 1vol s ASP 39 CO 0.34 -0.43 1.96 -0.07 -0.17 0.00 0.00 175.17 176.79 1vol h LEU 40 N 7.25 0.98 -0.45 -1.34 -0.00 -1.95 0.18 115.31 119.98 1vol h LEU 40 Ca 0.04 -0.03 0.08 0.00 -0.00 0.00 0.00 57.88 57.97 1vol h LEU 40 Cb 0.98 -0.25 -0.07 0.00 -0.00 0.00 0.00 40.66 41.32 1vol h LEU 40 CO 0.73 0.72 0.03 0.50 -0.00 0.00 0.00 178.44 180.43 1vol h LYS 41 N 1.15 0.14 0.00 1.13 3.64 -2.00 0.13 116.57 120.77 1vol h LYS 41 Ca 0.31 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1vol h LYS 41 Cb -0.12 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1vol h LYS 41 CO -0.07 0.10 0.00 0.00 -2.27 0.00 0.00 179.45 177.21 1vol n ALA 42 N -2.57 -0.14 -0.40 5.00 0.00 -0.61 -2.69 120.51 119.11 1vol n ALA 42 Ca 0.04 0.00 0.30 0.00 0.00 0.00 0.00 53.44 53.79 1vol n ALA 42 Cb 0.23 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.16 1vol n ALA 42 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1vol n ILE 43 N -0.99 -0.04 0.06 0.00 5.41 0.54 0.20 119.36 124.54 1vol n ILE 43 Ca 0.00 0.95 -0.12 0.00 1.00 0.00 0.00 62.75 64.57 1vol n ILE 43 Cb 0.00 -1.57 -0.09 0.00 -0.71 0.00 0.00 39.64 37.27 1vol n ILE 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1vol h ALA 44 N 0.69 -0.19 -0.40 -1.39 0.00 -0.62 -1.45 119.26 115.90 1vol h ALA 44 Ca 0.56 -0.22 0.12 0.00 0.00 0.00 0.00 54.91 55.37 1vol h ALA 44 Cb 2.15 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 20.00 1vol h ALA 44 CO -0.07 -0.37 0.38 -0.07 0.00 0.00 0.00 179.25 179.11 1vol h LEU 45 N -0.68 0.00 0.00 0.00 -0.00 0.26 -3.30 115.31 111.59 1vol h LEU 45 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.86 1vol h LEU 45 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.16 1vol h LEU 45 CO 0.03 0.00 -0.95 1.67 -0.00 0.00 0.00 178.44 179.19 1vol n GLN 46 N -3.92 3.16 -0.22 1.13 -0.06 -1.22 -4.80 117.38 111.44 1vol n GLN 46 Ca 0.07 0.00 -0.04 0.00 -2.00 0.00 0.00 57.00 55.03 1vol n GLN 46 Cb 0.55 -0.97 0.02 0.00 -4.06 0.00 0.00 30.24 25.78 1vol n GLN 46 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1vol h ALA 47 N 0.00 0.01 0.00 1.69 0.00 -1.34 -3.45 119.26 116.18 1vol h ALA 47 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1vol h ALA 47 Cb 0.77 0.79 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1vol h ALA 47 CO 0.00 -0.65 0.00 -2.13 0.00 0.00 0.00 179.25 176.47 1vol n ARG 48 N -5.44 0.00 0.00 0.00 0.00 -1.26 -4.44 116.66 105.52 1vol n ARG 48 Ca 0.05 0.00 0.11 0.00 -0.00 0.00 0.00 57.85 58.02 1vol n ARG 48 Cb 0.36 -0.41 0.06 0.00 0.00 0.00 0.00 32.46 32.47 1vol n ARG 48 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1vol n ASN 49 N 0.79 1.99 -2.19 6.15 6.94 -1.26 -4.94 115.26 122.74 1vol n ASN 49 Ca 0.00 -1.49 0.00 0.00 -0.02 0.00 0.00 54.58 53.07 1vol n ASN 49 Cb 0.00 0.39 0.00 0.00 -2.36 0.00 0.00 39.78 37.81 1vol n ASN 49 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1vol n ALA 50 N 0.03 0.00 0.00 -2.53 0.00 -1.26 -1.97 120.51 114.78 1vol n ALA 50 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1vol n ALA 50 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1vol n ALA 50 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1vol n GLU 51 N -0.50 0.00 -4.64 0.00 2.13 -0.92 -4.82 120.64 111.89 1vol n GLU 51 Ca 0.00 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.52 1vol n GLU 51 Cb 0.00 0.00 -0.17 0.00 0.27 0.00 0.00 31.44 31.54 1vol n GLU 51 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1vol s TYR 52 N 0.00 2.25 -0.33 4.31 5.04 -1.26 -0.14 117.35 127.21 1vol s TYR 52 Ca 0.00 -1.05 -0.01 0.00 -2.44 0.00 0.00 57.07 53.56 1vol s TYR 52 Cb 0.00 -1.57 0.12 0.00 0.35 0.00 0.00 41.96 40.86 1vol s TYR 52 CO 0.00 -0.50 0.17 1.21 -1.34 0.00 0.00 175.55 175.09 1vol s ASN 53 N 0.82 3.41 0.61 4.32 3.84 -1.26 -4.96 114.94 121.72 1vol s ASN 53 Ca -0.09 -1.84 0.28 0.00 0.21 0.00 0.00 52.86 51.42 1vol s ASN 53 Cb -0.16 -0.53 1.40 0.00 -0.55 0.00 0.00 41.25 41.42 1vol s ASN 53 CO 0.00 -0.37 1.81 1.55 -2.79 0.00 0.00 177.10 177.31 1vol h PRO 54 N 7.64 0.00 0.50 0.43 0.13 -1.94 -2.45 132.00 136.32 1vol h PRO 54 Ca -0.07 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.04 1vol h PRO 54 Cb 0.99 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.12 1vol h PRO 54 CO 0.38 0.00 -0.24 0.87 -0.23 0.00 0.00 178.00 178.78 1vol h LYS 55 N 0.00 -0.65 0.00 0.86 1.79 -2.01 -3.41 116.57 113.14 1vol h LYS 55 Ca 0.18 0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.69 1vol h LYS 55 Cb 1.25 0.15 0.00 0.00 -1.58 0.00 0.00 32.23 32.04 1vol h LYS 55 CO -0.00 -0.44 -0.38 0.00 -1.08 0.00 0.00 179.45 177.55 1vol h ARG 56 N -0.68 0.00 -5.09 3.15 3.08 -1.89 -3.47 114.38 109.48 1vol h ARG 56 Ca -0.07 0.00 -0.67 0.00 0.07 0.00 0.00 59.98 59.31 1vol h ARG 56 Cb 0.52 0.00 -0.32 0.00 0.08 0.00 0.00 29.97 30.25 1vol h ARG 56 CO 0.11 0.00 -0.81 0.12 -1.07 0.00 0.00 179.97 178.32 1vol s PHE 57 N -1.99 2.82 -1.17 3.04 5.36 -1.01 -5.03 117.98 119.99 1vol s PHE 57 Ca -0.11 -1.30 -0.10 0.00 -0.96 0.00 0.00 56.93 54.45 1vol s PHE 57 Cb 0.02 -1.95 -0.07 0.00 -0.34 0.00 0.00 43.02 40.68 1vol s PHE 57 CO 0.16 -0.65 2.35 0.00 -1.46 0.00 0.00 175.22 175.62 1vol n ALA 58 N 4.49 5.45 -3.64 11.12 0.00 -1.26 -4.29 120.51 132.38 1vol n ALA 58 Ca -0.20 -2.85 -0.07 0.00 0.00 0.00 0.00 53.44 50.32 1vol n ALA 58 Cb 0.51 -3.26 -0.07 0.00 0.00 0.00 0.00 19.45 16.62 1vol n ALA 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vol s ALA 59 N 3.25 -2.05 0.31 0.00 0.00 -1.26 -4.79 121.76 117.23 1vol s ALA 59 Ca 0.52 1.80 -0.28 0.00 0.00 0.00 0.00 51.96 54.00 1vol s ALA 59 Cb 0.14 -1.50 -0.09 0.00 0.00 0.00 0.00 23.12 21.66 1vol s ALA 59 CO -0.03 -0.20 1.11 0.08 0.00 0.00 0.00 175.76 176.72 1vol s VAL 60 N 0.07 3.46 -0.50 0.00 1.01 0.23 -4.57 120.40 120.10 1vol s VAL 60 Ca 0.04 1.39 -0.01 0.00 0.00 0.00 0.00 61.98 63.39 1vol s VAL 60 Cb -0.05 -3.85 0.13 0.00 0.00 0.00 0.00 36.38 32.61 1vol s VAL 60 CO -0.09 0.27 0.29 -0.63 0.00 0.00 0.00 175.10 174.94 1vol s ILE 61 N -1.26 3.28 0.02 2.22 1.01 0.80 -0.33 121.20 126.93 1vol s ILE 61 Ca 0.48 -2.57 0.01 0.00 0.00 0.00 0.00 60.65 58.57 1vol s ILE 61 Cb -0.31 -3.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.91 1vol s ILE 61 CO 0.39 -0.77 0.04 -0.32 0.00 0.00 0.00 174.94 174.29 1vol s MET 62 N 0.50 2.87 0.08 2.79 1.75 -0.66 -2.17 119.30 124.46 1vol s MET 62 Ca 0.13 -0.61 0.04 0.00 -1.25 0.00 0.00 55.69 54.00 1vol s MET 62 Cb -0.22 -2.73 -0.03 0.00 2.84 0.00 0.00 34.83 34.69 1vol s MET 62 CO -0.04 0.61 -0.11 1.03 -0.65 0.00 0.00 175.02 175.86 1vol s ARG 63 N -1.85 0.77 0.01 4.11 0.52 -0.83 -0.86 118.95 120.83 1vol s ARG 63 Ca 0.23 -0.99 0.02 0.00 -0.52 0.00 0.00 55.73 54.47 1vol s ARG 63 Cb -0.12 -0.61 -0.01 0.00 0.52 0.00 0.00 34.95 34.73 1vol s ARG 63 CO 0.14 0.12 -0.08 0.96 0.02 0.00 0.00 175.30 176.47 1vol s ILE 64 N -1.75 0.58 0.17 1.52 -4.36 -1.18 -4.80 121.20 111.38 1vol s ILE 64 Ca -0.01 -0.60 -0.30 0.00 -0.26 0.00 0.00 60.65 59.48 1vol s ILE 64 Cb -0.07 -0.55 -0.07 0.00 1.25 0.00 0.00 42.46 43.02 1vol s ILE 64 CO 0.01 -0.04 0.94 -0.60 0.24 0.00 0.00 174.94 175.50 1vol s ARG 65 N -0.71 4.76 -0.16 0.37 3.00 -1.26 -3.13 118.95 121.82 1vol s ARG 65 Ca -0.01 1.45 -0.05 0.00 -1.00 0.00 0.00 55.73 56.12 1vol s ARG 65 Cb -0.05 -3.33 0.02 0.00 0.00 0.00 0.00 34.95 31.58 1vol s ARG 65 CO 0.00 0.35 0.10 0.39 0.00 0.00 0.00 175.30 176.15 1vol n GLU 66 N 2.21 -3.14 -2.86 5.12 4.71 -1.26 -4.70 120.64 120.72 1vol n GLU 66 Ca 0.00 2.53 -0.41 0.00 -0.01 0.00 0.00 57.16 59.28 1vol n GLU 66 Cb 0.48 -3.87 -0.05 0.00 -1.01 0.00 0.00 31.44 27.00 1vol n GLU 66 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 1vol s PRO 67 N -0.87 4.59 -0.79 3.49 0.04 -1.26 -4.99 135.00 135.20 1vol s PRO 67 Ca -0.12 1.25 -0.23 0.00 0.04 0.00 0.00 61.00 61.94 1vol s PRO 67 Cb 0.01 -3.38 -0.17 0.00 0.04 0.00 0.00 34.50 31.00 1vol s PRO 67 CO 0.55 0.23 2.39 1.17 0.04 0.00 0.00 177.00 181.37 1vol n LYS 68 N 2.88 0.50 -4.49 4.56 4.81 -1.25 -4.74 118.16 120.43 1vol n LYS 68 Ca 0.00 -0.45 -0.24 0.00 -0.87 0.00 0.00 58.31 56.75 1vol n LYS 68 Cb 0.50 -2.94 -0.09 0.00 0.02 0.00 0.00 35.03 32.51 1vol n LYS 68 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1vol s THR 69 N 10.94 0.85 -0.01 3.15 -4.23 -1.18 -4.18 115.64 120.97 1vol s THR 69 Ca 1.05 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 59.55 1vol s THR 69 Cb -0.37 -2.52 0.01 0.00 1.34 0.00 0.00 72.50 70.96 1vol s THR 69 CO 0.25 0.00 0.03 -0.89 -0.54 0.00 0.00 174.62 173.47 1vol s THR 70 N -3.25 -0.01 0.06 3.99 2.01 0.32 -3.12 115.64 115.63 1vol s THR 70 Ca 0.28 0.05 0.07 0.00 0.31 0.00 0.00 61.69 62.41 1vol s THR 70 Cb 0.05 -0.06 -0.03 0.00 0.01 0.00 0.00 72.50 72.47 1vol s THR 70 CO 0.14 0.02 -0.20 0.00 -0.69 0.00 0.00 174.62 173.89 1vol s ALA 71 N 0.29 1.74 -0.16 7.40 0.00 -0.04 -0.74 121.76 130.25 1vol s ALA 71 Ca -0.02 -1.09 -0.00 0.00 0.00 0.00 0.00 51.96 50.85 1vol s ALA 71 Cb -0.03 -0.31 -0.00 0.00 0.00 0.00 0.00 23.12 22.77 1vol s ALA 71 CO -0.01 0.38 -0.14 -0.51 0.00 0.00 0.00 175.76 175.47 1vol s LEU 72 N -1.35 2.50 -0.11 0.00 1.43 -0.71 -1.65 118.68 118.80 1vol s LEU 72 Ca 0.07 -0.47 0.03 0.00 -1.03 0.00 0.00 54.13 52.73 1vol s LEU 72 Cb -0.09 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.55 1vol s LEU 72 CO 0.02 0.07 -0.21 -0.63 0.23 0.00 0.00 176.35 175.84 1vol s ILE 73 N 0.90 2.36 0.24 -0.59 1.01 0.55 -1.54 121.20 124.12 1vol s ILE 73 Ca -0.04 -0.92 0.09 0.00 0.00 0.00 0.00 60.65 59.78 1vol s ILE 73 Cb -0.15 -1.93 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 1vol s ILE 73 CO -0.01 0.55 0.03 -0.36 0.00 0.00 0.00 174.94 175.15 1vol s PHE 74 N 0.31 2.80 -0.29 3.97 0.40 -0.60 -0.60 117.98 123.96 1vol s PHE 74 Ca -0.16 -0.18 -0.05 0.00 -0.60 0.00 0.00 56.93 55.94 1vol s PHE 74 Cb -0.17 -1.28 -0.17 0.00 0.51 0.00 0.00 43.02 41.90 1vol s PHE 74 CO 0.08 0.57 2.81 0.00 0.70 0.00 0.00 175.22 179.38 1vol n ALA 75 N -0.72 5.35 -1.06 5.36 0.00 -1.26 -2.56 120.51 125.62 1vol n ALA 75 Ca -0.08 -1.71 0.00 0.00 0.00 0.00 0.00 53.44 51.65 1vol n ALA 75 Cb 0.58 -2.51 0.00 0.00 0.00 0.00 0.00 19.45 17.52 1vol n ALA 75 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1vol n SER 76 N 2.92 0.00 0.00 0.00 3.41 -1.26 -4.30 113.62 114.39 1vol n SER 76 Ca 0.40 -0.68 0.00 0.00 -0.26 0.00 0.00 58.87 58.32 1vol n SER 76 Cb 0.58 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.53 1vol n SER 76 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vol n GLY 77 N 0.00 2.86 3.66 5.00 0.00 -1.06 -4.50 105.19 111.15 1vol n GLY 77 Ca 0.00 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 1vol n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vol s LYS 78 N 0.00 4.16 0.23 1.61 1.02 -1.26 -0.39 119.74 125.11 1vol s LYS 78 Ca 0.00 2.39 0.11 0.00 0.02 0.00 0.00 55.97 58.49 1vol s LYS 78 Cb 0.00 -4.06 -0.05 0.00 -0.52 0.00 0.00 37.83 33.20 1vol s LYS 78 CO 0.00 -0.90 -0.21 1.41 -0.92 0.00 0.00 175.35 174.73 1vol s MET 79 N 4.20 1.56 -0.05 1.68 -2.45 0.99 -1.56 119.30 123.68 1vol s MET 79 Ca 0.80 -1.63 -0.00 0.00 -1.25 0.00 0.00 55.69 53.61 1vol s MET 79 Cb -0.38 -1.71 0.03 0.00 1.25 0.00 0.00 34.83 34.01 1vol s MET 79 CO 0.35 0.34 -0.01 0.08 1.05 0.00 0.00 175.02 176.84 1vol s VAL 80 N -2.18 0.32 -0.14 10.11 1.01 -0.59 -1.17 120.40 127.76 1vol s VAL 80 Ca 0.25 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 62.26 1vol s VAL 80 Cb -0.06 -0.42 -0.03 0.00 0.00 0.00 0.00 36.38 35.88 1vol s VAL 80 CO 0.12 0.20 -0.05 0.00 0.00 0.00 0.00 175.10 175.37 1vol s THR 82 N 0.15 0.28 0.00 0.00 -4.23 0.09 -1.38 115.64 110.54 1vol s THR 82 Ca -0.02 -1.47 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 1vol s THR 82 Cb -0.14 -1.05 0.00 0.00 1.34 0.00 0.00 72.50 72.65 1vol s THR 82 CO 0.03 -0.76 0.00 0.61 -0.54 0.00 0.00 174.62 173.96 1vol n GLY 83 N 0.70 2.30 3.71 3.99 0.00 -1.20 -0.53 105.19 114.16 1vol n GLY 83 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 1vol n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vol n ALA 84 N -0.16 1.45 -0.68 4.61 0.00 -1.26 -4.65 120.51 119.82 1vol n ALA 84 Ca 0.00 0.28 -0.04 0.00 0.00 0.00 0.00 53.44 53.68 1vol n ALA 84 Cb 0.00 -2.29 0.26 0.00 0.00 0.00 0.00 19.45 17.42 1vol n ALA 84 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1vol n LYS 85 N 0.11 3.37 -3.65 0.00 4.76 -1.26 -0.27 118.16 121.22 1vol n LYS 85 Ca 0.06 -2.57 -0.02 0.00 -2.87 0.00 0.00 58.31 52.91 1vol n LYS 85 Cb 0.39 -2.08 -0.07 0.00 -1.84 0.00 0.00 35.03 31.44 1vol n LYS 85 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1vol s SER 86 N -0.75 -0.01 0.05 4.39 0.15 -1.26 -4.69 113.70 111.58 1vol s SER 86 Ca 0.46 0.03 -0.17 0.00 0.70 0.00 0.00 55.95 56.97 1vol s SER 86 Cb 0.37 0.06 -0.07 0.00 -1.71 0.00 0.00 66.02 64.67 1vol s SER 86 CO 0.12 -0.00 1.27 -0.33 1.20 0.00 0.00 173.24 175.49 1vol h GLU 87 N 3.10 -0.33 -0.89 5.44 3.07 -1.98 1.01 114.58 124.01 1vol h GLU 87 Ca -0.27 0.02 0.24 0.00 -0.50 0.00 0.00 59.36 58.85 1vol h GLU 87 Cb 1.20 0.08 -0.14 0.00 -0.84 0.00 0.00 28.75 29.04 1vol h GLU 87 CO 0.19 -0.22 0.25 0.22 -1.40 0.00 0.00 179.01 178.04 1vol h ASP 88 N -0.34 0.01 0.10 1.42 3.58 -1.98 0.99 116.42 120.20 1vol h ASP 88 Ca 0.00 0.20 -0.08 0.00 0.42 0.00 0.00 57.03 57.57 1vol h ASP 88 Cb 0.36 0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.67 1vol h ASP 88 CO -0.17 -0.16 -0.27 -0.26 -2.88 0.00 0.00 179.24 175.50 1vol h PHE 89 N 0.21 0.31 -0.38 0.28 0.04 -0.70 0.69 116.94 117.38 1vol h PHE 89 Ca 0.56 -0.06 -0.14 0.00 2.80 0.00 0.00 57.97 61.13 1vol h PHE 89 Cb 1.14 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 39.21 1vol h PHE 89 CO -0.26 0.53 -0.32 1.03 -0.60 0.00 0.00 178.31 178.70 1vol h SER 90 N 0.25 0.88 0.43 2.17 0.87 0.80 -1.68 113.55 117.26 1vol h SER 90 Ca 0.04 -0.37 -0.02 0.00 -1.23 0.00 0.00 61.79 60.21 1vol h SER 90 Cb 0.62 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1vol h SER 90 CO 0.04 1.12 -0.21 0.50 -0.53 0.00 0.00 176.83 177.76 1vol h LYS 91 N 0.71 -0.56 -0.08 2.24 3.64 0.13 -1.91 116.57 120.74 1vol h LYS 91 Ca 0.08 0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1vol h LYS 91 Cb 0.87 0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.80 1vol h LYS 91 CO 0.08 -0.26 -0.15 1.98 -2.27 0.00 0.00 179.45 178.83 1vol h MET 92 N -0.89 -0.12 -1.01 1.90 4.05 0.41 0.60 114.93 119.87 1vol h MET 92 Ca -0.06 0.01 0.30 0.00 -0.28 0.00 0.00 59.70 59.67 1vol h MET 92 Cb 0.56 0.03 -0.14 0.00 -0.80 0.00 0.00 31.60 31.25 1vol h MET 92 CO 0.10 -0.08 0.59 0.00 0.23 0.00 0.00 176.91 177.74 1vol h ALA 93 N -1.03 1.94 -0.36 0.39 0.00 -1.37 1.00 119.26 119.83 1vol h ALA 93 Ca 0.02 0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1vol h ALA 93 Cb 0.17 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1vol h ALA 93 CO -0.14 -0.51 0.14 0.00 0.00 0.00 0.00 179.25 178.74 1vol h ALA 94 N 1.80 1.56 0.48 0.00 0.00 -0.08 -1.22 119.26 121.81 1vol h ALA 94 Ca 0.71 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.49 1vol h ALA 94 Cb 1.56 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1vol h ALA 94 CO -0.56 0.34 -0.23 0.00 0.00 0.00 0.00 179.25 178.80 1vol h ARG 95 N 0.51 -0.63 -1.42 0.00 3.08 0.22 -2.88 114.38 113.26 1vol h ARG 95 Ca 0.13 0.04 0.41 0.00 0.07 0.00 0.00 59.98 60.63 1vol h ARG 95 Cb 0.12 0.14 -0.06 0.00 0.08 0.00 0.00 29.97 30.25 1vol h ARG 95 CO -0.01 -0.33 1.03 0.87 -1.07 0.00 0.00 179.97 180.46 1vol h LYS 96 N -1.03 0.00 -0.01 0.04 1.57 -0.70 0.45 116.57 116.89 1vol h LYS 96 Ca -0.07 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1vol h LYS 96 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1vol h LYS 96 CO 0.11 0.00 -0.04 1.88 -0.57 0.00 0.00 179.45 180.83 1vol h TYR 97 N 0.00 0.06 -0.74 -1.35 0.05 -1.17 -2.30 116.97 111.52 1vol h TYR 97 Ca 0.68 -0.03 0.05 0.00 0.05 0.00 0.00 58.73 59.48 1vol h TYR 97 Cb 2.73 -0.01 -0.05 0.00 1.01 0.00 0.00 36.73 40.41 1vol h TYR 97 CO 0.00 0.66 0.45 0.00 -1.05 0.00 0.00 178.16 178.21 1vol h ALA 98 N 0.40 0.98 0.00 3.88 0.00 0.06 0.12 119.26 124.70 1vol h ALA 98 Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1vol h ALA 98 Cb 0.66 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1vol h ALA 98 CO 0.01 0.19 -0.11 0.00 0.00 0.00 0.00 179.25 179.34 1vol h ARG 99 N 0.85 0.00 0.17 0.00 -0.00 -1.19 0.71 114.38 114.92 1vol h ARG 99 Ca 0.31 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.78 1vol h ARG 99 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.07 1vol h ARG 99 CO -0.14 0.11 -0.08 0.82 0.00 0.00 0.00 179.97 180.68 1vol h ILE 100 N 0.00 0.46 -0.93 2.04 2.04 -0.27 -0.13 117.51 120.73 1vol h ILE 100 Ca -0.00 -1.06 0.20 0.00 1.00 0.00 0.00 64.86 65.00 1vol h ILE 100 Cb 0.38 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 37.21 1vol h ILE 100 CO 0.01 0.13 0.61 0.58 0.00 0.00 0.00 178.15 179.48 1vol h VAL 101 N -0.99 0.68 0.42 1.67 2.07 -0.51 0.12 116.25 119.70 1vol h VAL 101 Ca -0.02 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.32 1vol h VAL 101 Cb 0.40 0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 1vol h VAL 101 CO 0.04 0.08 -0.20 -0.61 0.02 0.00 0.00 177.57 176.90 1vol h GLN 102 N 0.46 -0.54 0.00 1.57 4.15 0.47 -2.04 115.11 119.18 1vol h GLN 102 Ca 0.49 0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.95 1vol h GLN 102 Cb 1.14 0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.96 1vol h GLN 102 CO -0.21 -0.24 0.00 1.17 -1.93 0.00 0.00 178.83 177.62 1vol n LYS 103 N -5.23 0.09 -0.00 1.69 4.81 0.32 -0.23 118.16 119.61 1vol n LYS 103 Ca -0.10 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 57.43 1vol n LYS 103 Cb 0.29 -1.41 -0.12 0.00 0.02 0.00 0.00 35.03 33.81 1vol n LYS 103 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1vol n LEU 104 N -0.91 0.71 0.00 3.14 7.99 -0.69 -4.98 117.00 122.26 1vol n LEU 104 Ca 0.02 -0.40 0.00 0.00 -0.01 0.00 0.00 56.01 55.62 1vol n LEU 104 Cb 0.01 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.32 1vol n LEU 104 CO 0.01 0.18 0.00 0.61 -1.51 0.00 0.00 177.39 176.68 1vol n GLY 105 N 1.44 1.87 3.39 -0.72 0.00 0.67 -5.06 105.19 106.78 1vol n GLY 105 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 1vol n GLY 105 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vol s PHE 106 N -2.00 2.40 0.00 1.61 0.40 -1.12 -5.02 117.98 114.25 1vol s PHE 106 Ca 0.00 -0.36 0.00 0.00 -0.60 0.00 0.00 56.93 55.97 1vol s PHE 106 Cb 0.00 -1.39 0.00 0.00 0.51 0.00 0.00 43.02 42.14 1vol s PHE 106 CO 0.00 0.21 0.29 -2.30 0.70 0.00 0.00 175.22 174.13 1vol n PRO 107 N 1.52 0.19 -1.46 0.24 -0.02 -1.26 -4.31 135.00 129.90 1vol n PRO 107 Ca -0.17 0.00 -0.57 0.00 -2.02 0.00 0.00 63.50 60.74 1vol n PRO 107 Cb 0.52 -1.40 -0.08 0.00 -0.02 0.00 0.00 33.50 32.52 1vol n PRO 107 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vol n ALA 108 N 1.44 -3.39 -3.31 3.55 0.00 -1.26 -4.22 120.51 113.32 1vol n ALA 108 Ca 0.00 0.57 -0.18 0.00 0.00 0.00 0.00 53.44 53.83 1vol n ALA 108 Cb 0.10 -1.71 -0.16 0.00 0.00 0.00 0.00 19.45 17.68 1vol n ALA 108 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1vol s LYS 109 N 0.20 0.56 -0.63 0.00 1.02 0.20 -4.97 119.74 116.12 1vol s LYS 109 Ca 0.89 -0.10 -0.05 0.00 0.02 0.00 0.00 55.97 56.72 1vol s LYS 109 Cb -1.24 -0.60 -0.01 0.00 -0.52 0.00 0.00 37.83 35.46 1vol s LYS 109 CO 0.57 -0.01 2.90 0.34 -0.92 0.00 0.00 175.35 178.22 1vol n PHE 110 N 3.63 1.52 -2.76 3.18 7.35 -1.26 -3.30 117.46 125.82 1vol n PHE 110 Ca -0.21 -2.12 -0.39 0.00 -0.76 0.00 0.00 57.45 53.96 1vol n PHE 110 Cb 0.53 -1.61 -0.06 0.00 0.35 0.00 0.00 39.48 38.69 1vol n PHE 110 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 1vol s LYS 111 N -0.69 4.81 0.00 -4.13 1.02 -0.60 -4.31 119.74 115.84 1vol s LYS 111 Ca 0.61 1.46 0.00 0.00 0.02 0.00 0.00 55.97 58.06 1vol s LYS 111 Cb 0.31 -3.19 0.00 0.00 -0.52 0.00 0.00 37.83 34.43 1vol s LYS 111 CO -0.14 0.48 0.00 -0.25 -0.92 0.00 0.00 175.35 174.52 1vol n ASP 112 N 1.32 -3.39 -4.42 2.83 8.00 -1.26 -1.42 116.55 118.22 1vol n ASP 112 Ca -0.01 0.00 -0.53 0.00 0.71 0.00 0.00 54.79 54.96 1vol n ASP 112 Cb 0.48 -2.23 -0.05 0.00 -0.02 0.00 0.00 41.12 39.29 1vol n ASP 112 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1vol n PHE 113 N -2.23 0.06 -3.69 1.24 -0.00 -1.26 -4.79 117.46 106.80 1vol n PHE 113 Ca 0.00 1.01 -0.15 0.00 -0.00 0.00 0.00 57.45 58.31 1vol n PHE 113 Cb 0.23 -2.01 -0.08 0.00 -0.00 0.00 0.00 39.48 37.62 1vol n PHE 113 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.76 176.97 1vol s LYS 114 N -0.51 0.79 -0.17 -4.13 2.20 -0.27 -4.99 119.74 112.66 1vol s LYS 114 Ca 0.77 -0.08 -0.17 0.00 -0.36 0.00 0.00 55.97 56.13 1vol s LYS 114 Cb -1.09 0.36 -0.04 0.00 -1.51 0.00 0.00 37.83 35.55 1vol s LYS 114 CO 0.56 -0.23 0.42 0.42 -0.36 0.00 0.00 175.35 176.16 1vol s ILE 115 N -1.35 5.20 -0.09 5.43 -1.09 -1.26 -1.03 121.20 127.02 1vol s ILE 115 Ca -0.12 0.78 0.10 0.00 -2.23 0.00 0.00 60.65 59.18 1vol s ILE 115 Cb -0.04 -3.75 -0.15 0.00 -1.58 0.00 0.00 42.46 36.95 1vol s ILE 115 CO 0.06 0.29 0.09 0.00 -1.23 0.00 0.00 174.94 174.14 1vol n GLN 116 N 4.13 1.77 -3.64 2.79 1.13 0.16 -4.87 117.38 118.85 1vol n GLN 116 Ca -0.08 -0.03 -0.06 0.00 -1.94 0.00 0.00 57.00 54.89 1vol n GLN 116 Cb 0.51 -1.28 -0.07 0.00 0.11 0.00 0.00 30.24 29.52 1vol n GLN 116 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1vol s ASN 117 N -4.10 -0.94 -0.20 1.08 2.47 -0.98 -4.61 114.94 107.67 1vol s ASN 117 Ca -0.05 1.48 -0.01 0.00 0.42 0.00 0.00 52.86 54.69 1vol s ASN 117 Cb 0.04 1.44 0.00 0.00 -1.45 0.00 0.00 41.25 41.29 1vol s ASN 117 CO 0.46 -0.23 -0.12 -0.63 -3.72 0.00 0.00 177.10 172.86 1vol s ILE 118 N 1.71 2.74 -0.12 -5.21 1.01 0.63 -1.18 121.20 120.78 1vol s ILE 118 Ca -0.10 -0.71 -0.05 0.00 0.00 0.00 0.00 60.65 59.79 1vol s ILE 118 Cb -0.05 -2.21 -0.04 0.00 0.01 0.00 0.00 42.46 40.17 1vol s ILE 118 CO -0.20 0.48 0.06 -0.69 0.00 0.00 0.00 174.94 174.60 1vol s VAL 119 N 1.36 4.85 0.16 2.92 1.01 -0.27 -2.95 120.40 127.48 1vol s VAL 119 Ca 0.05 -0.03 -0.08 0.00 0.00 0.00 0.00 61.98 61.92 1vol s VAL 119 Cb -0.14 -3.10 -0.01 0.00 0.00 0.00 0.00 36.38 33.13 1vol s VAL 119 CO -0.08 0.57 0.25 -0.83 0.00 0.00 0.00 175.10 175.02 1vol s GLY 120 N -0.61 0.52 0.33 4.51 0.00 -1.15 -0.84 107.32 110.08 1vol s GLY 120 Ca 0.11 -0.95 0.04 0.00 0.00 0.00 0.00 44.72 43.92 1vol s GLY 120 CO 0.02 -0.90 0.15 -1.35 0.00 0.00 0.00 173.10 171.02 1vol s SER 121 N -2.97 1.93 0.21 1.64 1.04 -0.43 -1.57 113.70 113.54 1vol s SER 121 Ca 0.17 -1.58 -0.23 0.00 0.48 0.00 0.00 55.95 54.79 1vol s SER 121 Cb 0.04 0.38 0.04 0.00 0.10 0.00 0.00 66.02 66.59 1vol s SER 121 CO -0.00 -0.88 0.79 0.00 0.98 0.00 0.00 173.24 174.13 1vol s ASP 123 N -2.88 1.35 0.43 0.00 -1.08 -1.26 0.04 116.67 113.28 1vol s ASP 123 Ca 0.10 -0.32 0.30 0.00 -0.52 0.00 0.00 52.55 52.11 1vol s ASP 123 Cb -0.04 0.50 1.36 0.00 -1.46 0.00 0.00 42.92 43.28 1vol s ASP 123 CO 0.02 -0.34 1.90 0.58 0.52 0.00 0.00 175.17 177.85 1vol h VAL 124 N 6.28 0.00 0.00 1.11 2.07 -0.86 -3.46 116.25 121.40 1vol h VAL 124 Ca -0.17 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1vol h VAL 124 Cb 1.13 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 32.01 1vol h VAL 124 CO 0.30 0.00 0.00 0.29 0.02 0.00 0.00 177.57 178.18 1vol n LYS 125 N -2.68 -0.30 -3.96 1.57 5.02 -1.26 -5.00 118.16 111.54 1vol n LYS 125 Ca 0.00 0.08 -0.11 0.00 -2.02 0.00 0.00 58.31 56.26 1vol n LYS 125 Cb 0.21 -3.29 -0.12 0.00 -0.02 0.00 0.00 35.03 31.81 1vol n LYS 125 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1vol s PHE 126 N -2.30 0.22 0.68 2.13 -0.12 -1.26 -5.06 117.98 112.28 1vol s PHE 126 Ca 0.00 -0.33 -0.14 0.00 -0.05 0.00 0.00 56.93 56.41 1vol s PHE 126 Cb 0.00 -0.15 0.01 0.00 -0.63 0.00 0.00 43.02 42.25 1vol s PHE 126 CO 0.00 -0.11 1.10 -1.25 -0.05 0.00 0.00 175.22 174.91 1vol s PRO 127 N -0.92 2.70 -0.03 1.99 0.04 -1.25 -3.54 135.00 134.00 1vol s PRO 127 Ca -0.09 1.31 0.05 0.00 0.04 0.00 0.00 61.00 62.31 1vol s PRO 127 Cb -0.06 -1.94 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 1vol s PRO 127 CO -0.00 -1.32 -0.18 0.42 0.04 0.00 0.00 177.00 175.95 1vol s ILE 128 N -2.51 1.48 -1.20 0.56 1.01 0.30 -1.17 121.20 119.67 1vol s ILE 128 Ca 0.65 -0.78 -0.19 0.00 0.00 0.00 0.00 60.65 60.33 1vol s ILE 128 Cb -0.19 -1.25 0.08 0.00 0.01 0.00 0.00 42.46 41.11 1vol s ILE 128 CO 0.45 0.42 1.59 -0.60 0.00 0.00 0.00 174.94 176.81 1vol s ARG 129 N -0.26 3.88 0.21 2.79 6.06 0.09 -4.57 118.95 127.14 1vol s ARG 129 Ca 0.03 -1.83 -0.09 0.00 -2.50 0.00 0.00 55.73 51.34 1vol s ARG 129 Cb -0.09 -5.40 0.30 0.00 0.06 0.00 0.00 34.95 29.82 1vol s ARG 129 CO 0.00 -2.16 1.72 -0.07 -2.50 0.00 0.00 175.30 172.30 1vol h LEU 130 N 12.15 0.11 -0.99 -0.88 3.38 -1.92 -2.07 115.31 125.09 1vol h LEU 130 Ca 0.35 0.10 0.12 0.00 0.09 0.00 0.00 57.88 58.54 1vol h LEU 130 Cb 0.92 0.11 -0.08 0.00 0.09 0.00 0.00 40.66 41.69 1vol h LEU 130 CO 1.41 0.06 0.62 -0.33 0.09 0.00 0.00 178.44 180.29 1vol h GLU 131 N 0.33 0.95 -0.27 1.13 3.07 -1.98 0.67 114.58 118.47 1vol h GLU 131 Ca 0.32 -0.06 -0.08 0.00 -0.50 0.00 0.00 59.36 59.04 1vol h GLU 131 Cb 0.45 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 28.13 1vol h GLU 131 CO -0.37 0.63 -0.16 0.78 -1.40 0.00 0.00 179.01 178.49 1vol h GLY 132 N 0.97 0.51 0.97 -3.84 0.00 -1.77 0.24 103.07 100.15 1vol h GLY 132 Ca 0.49 -0.37 -0.19 0.00 0.00 0.00 0.00 47.33 47.26 1vol h GLY 132 CO -0.27 0.34 -0.73 -2.00 0.00 0.00 0.00 176.54 173.88 1vol h LEU 133 N 0.44 0.71 -1.67 3.11 6.46 -0.70 -1.02 115.31 122.63 1vol h LEU 133 Ca 0.08 -0.72 -0.03 0.00 -0.12 0.00 0.00 57.88 57.09 1vol h LEU 133 Cb 0.54 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.25 1vol h LEU 133 CO 0.03 1.33 -0.14 0.00 -0.62 0.00 0.00 178.44 179.04 1vol h ALA 134 N 0.40 1.73 0.23 1.25 0.00 0.51 0.87 119.26 124.24 1vol h ALA 134 Ca -0.08 -0.14 -0.33 0.00 0.00 0.00 0.00 54.91 54.35 1vol h ALA 134 Cb 1.41 -0.03 0.03 0.00 0.00 0.00 0.00 17.79 19.20 1vol h ALA 134 CO 0.15 0.21 -1.50 1.88 0.00 0.00 0.00 179.25 179.98 1vol h TYR 135 N 0.03 0.89 0.04 0.00 0.05 -0.98 -3.24 116.97 113.77 1vol h TYR 135 Ca 0.01 -0.65 -0.23 0.00 0.05 0.00 0.00 58.73 57.90 1vol h TYR 135 Cb 0.27 -0.04 -0.00 0.00 1.01 0.00 0.00 36.73 37.97 1vol h TYR 135 CO 0.00 1.55 -1.01 1.03 -1.05 0.00 0.00 178.16 178.68 1vol h SER 136 N 0.13 0.44 -1.43 3.88 0.87 -0.57 -3.31 113.55 113.56 1vol h SER 136 Ca -0.26 -0.38 -0.66 0.00 -1.23 0.00 0.00 61.79 59.26 1vol h SER 136 Cb 2.14 -0.14 -0.35 0.00 -0.44 0.00 0.00 62.40 63.62 1vol h SER 136 CO 0.25 1.21 0.14 1.41 -0.53 0.00 0.00 176.83 179.32 1vol n HIS 137 N -3.66 3.12 -0.26 2.24 8.25 0.24 -4.83 115.22 120.32 1vol n HIS 137 Ca -0.06 -2.68 0.05 0.00 -0.26 0.00 0.00 57.72 54.76 1vol n HIS 137 Cb 0.88 -0.75 0.15 0.00 1.12 0.00 0.00 29.99 31.39 1vol n HIS 137 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1vol h ALA 138 N 2.53 0.74 -0.24 -1.41 0.00 -1.65 0.61 119.26 119.84 1vol h ALA 138 Ca 0.46 0.26 0.06 0.00 0.00 0.00 0.00 54.91 55.69 1vol h ALA 138 Cb 0.72 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1vol h ALA 138 CO 1.17 -0.43 0.17 0.00 0.00 0.00 0.00 179.25 180.16 1vol h ALA 139 N 1.73 2.16 -0.01 0.00 0.00 -1.89 -3.07 119.26 118.19 1vol h ALA 139 Ca 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.31 1vol h ALA 139 Cb 0.71 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1vol h ALA 139 CO -0.70 -0.23 -0.31 1.19 0.00 0.00 0.00 179.25 179.21 1vol n PHE 140 N -4.48 0.00 -4.64 0.00 3.72 0.18 -4.97 117.46 107.27 1vol n PHE 140 Ca 0.02 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.12 1vol n PHE 140 Cb 0.29 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.69 1vol n PHE 140 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1vol s SER 141 N -1.62 3.51 -0.22 4.37 1.04 0.72 -0.53 113.70 120.98 1vol s SER 141 Ca 0.08 -0.56 -0.00 0.00 0.48 0.00 0.00 55.95 55.94 1vol s SER 141 Cb 0.09 -0.42 0.06 0.00 0.10 0.00 0.00 66.02 65.85 1vol s SER 141 CO 0.33 0.23 -0.03 -0.55 0.98 0.00 0.00 173.24 174.20 1vol s SER 142 N -1.59 3.46 -0.45 7.02 0.15 -0.84 -4.81 113.70 116.64 1vol s SER 142 Ca 0.14 -1.02 0.02 0.00 0.70 0.00 0.00 55.95 55.80 1vol s SER 142 Cb -0.10 -0.97 0.14 0.00 -1.71 0.00 0.00 66.02 63.37 1vol s SER 142 CO 0.05 -0.25 0.26 -0.47 1.20 0.00 0.00 173.24 174.02 1vol s TYR 143 N 1.56 2.08 -0.40 3.44 5.04 -1.26 -1.88 117.35 125.94 1vol s TYR 143 Ca -0.04 -2.50 -0.01 0.00 -2.44 0.00 0.00 57.07 52.08 1vol s TYR 143 Cb -0.18 -1.93 0.11 0.00 0.35 0.00 0.00 41.96 40.31 1vol s TYR 143 CO -0.07 -0.77 0.17 -1.21 -1.34 0.00 0.00 175.55 172.33 1vol s GLU 144 N 0.23 1.88 0.30 4.97 0.41 -1.26 -4.93 118.70 120.29 1vol s GLU 144 Ca 0.19 -1.87 0.18 0.00 -0.41 0.00 0.00 54.97 53.05 1vol s GLU 144 Cb -0.22 -3.48 0.96 0.00 -1.78 0.00 0.00 34.13 29.61 1vol s GLU 144 CO -0.01 -1.04 1.51 -2.30 -0.49 0.00 0.00 175.26 172.92 1vol n PRO 145 N 4.44 0.12 0.18 0.39 -0.02 -1.26 -0.12 135.00 138.73 1vol n PRO 145 Ca -0.00 0.60 0.08 0.00 -2.02 0.00 0.00 63.50 62.17 1vol n PRO 145 Cb 0.41 -1.98 0.10 0.00 -0.02 0.00 0.00 33.50 32.02 1vol n PRO 145 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1vol h GLU 146 N 0.00 0.00 0.00 -0.52 5.08 -2.00 -3.37 114.58 113.77 1vol h GLU 146 Ca 0.00 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.22 1vol h GLU 146 Cb 0.20 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 1vol h GLU 146 CO 0.00 0.19 -1.64 1.28 -1.00 0.00 0.00 179.01 177.84 1vol n LEU 147 N -3.13 0.00 -3.65 1.33 4.77 0.83 -5.04 117.00 112.12 1vol n LEU 147 Ca 0.03 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.98 1vol n LEU 147 Cb 0.61 0.20 -0.07 0.00 -2.33 0.00 0.00 43.42 41.83 1vol n LEU 147 CO 0.37 0.20 0.85 0.12 -1.33 0.00 0.00 177.39 177.60 1vol s PHE 148 N -2.34 -0.34 -2.00 -1.77 5.36 -0.96 -5.04 117.98 110.89 1vol s PHE 148 Ca -0.05 0.72 0.05 0.00 -0.96 0.00 0.00 56.93 56.69 1vol s PHE 148 Cb 0.04 0.29 0.27 0.00 -0.34 0.00 0.00 43.02 43.29 1vol s PHE 148 CO 0.41 -0.17 0.68 -0.35 -1.46 0.00 0.00 175.22 174.34 1vol n PRO 149 N 2.90 0.39 -4.36 10.12 -0.04 -1.26 -4.10 135.00 138.66 1vol n PRO 149 Ca -0.16 0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.06 1vol n PRO 149 Cb 0.57 -1.18 -0.09 0.00 -0.04 0.00 0.00 33.50 32.76 1vol n PRO 149 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1vol s GLY 150 N -1.75 1.74 -0.48 0.55 0.00 -1.26 -4.78 107.32 101.34 1vol s GLY 150 Ca 0.07 -1.69 -0.19 0.00 0.00 0.00 0.00 44.72 42.92 1vol s GLY 150 CO 0.05 -1.75 0.58 -2.27 0.00 0.00 0.00 173.10 169.72 1vol s LEU 151 N -3.38 4.93 -0.67 0.66 1.98 0.41 -4.53 118.68 118.08 1vol s LEU 151 Ca 0.29 -0.82 -0.28 0.00 -2.89 0.00 0.00 54.13 50.43 1vol s LEU 151 Cb -0.07 -2.46 0.03 0.00 0.66 0.00 0.00 46.19 44.36 1vol s LEU 151 CO 0.17 -0.81 1.24 -0.63 -1.89 0.00 0.00 176.35 174.42 1vol s ILE 152 N 2.51 3.86 -0.09 6.68 1.01 -0.79 -1.13 121.20 133.26 1vol s ILE 152 Ca 0.15 0.63 -0.11 0.00 0.00 0.00 0.00 60.65 61.32 1vol s ILE 152 Cb -0.18 -4.83 -0.05 0.00 0.01 0.00 0.00 42.46 37.41 1vol s ILE 152 CO 0.13 -1.62 0.26 -0.47 0.00 0.00 0.00 174.94 173.23 1vol s TYR 153 N 5.37 3.61 -0.53 3.97 6.14 -0.88 -1.98 117.35 133.05 1vol s TYR 153 Ca 0.38 0.69 -0.00 0.00 0.64 0.00 0.00 57.07 58.78 1vol s TYR 153 Cb -0.08 -2.13 0.14 0.00 0.42 0.00 0.00 41.96 40.31 1vol s TYR 153 CO 0.20 0.61 0.31 1.03 0.64 0.00 0.00 175.55 178.34 1vol s ARG 154 N -0.75 2.20 0.28 4.97 0.52 0.31 -1.34 118.95 125.15 1vol s ARG 154 Ca 0.18 -2.35 -0.30 0.00 -0.52 0.00 0.00 55.73 52.73 1vol s ARG 154 Cb -0.14 -3.55 -0.12 0.00 0.52 0.00 0.00 34.95 31.66 1vol s ARG 154 CO 0.07 -1.12 1.51 -1.33 0.02 0.00 0.00 175.30 174.46 1vol n MET 155 N 3.69 2.43 0.00 3.54 2.81 -0.90 -4.81 117.12 123.88 1vol n MET 155 Ca 0.05 0.86 0.00 0.00 -1.81 0.00 0.00 57.70 56.80 1vol n MET 155 Cb 0.38 -2.59 0.00 0.00 -0.71 0.00 0.00 33.22 30.29 1vol n MET 155 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 1vol n LYS 156 N 2.01 0.00 -3.80 0.03 0.00 -1.26 -4.19 118.16 110.95 1vol n LYS 156 Ca 0.09 0.45 -0.18 0.00 -0.00 0.00 0.00 58.31 58.68 1vol n LYS 156 Cb 0.35 -1.28 -0.17 0.00 -0.00 0.00 0.00 35.03 33.93 1vol n LYS 156 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 1vol s VAL 157 N -2.13 0.04 0.84 0.58 -7.23 -1.26 -4.11 120.40 107.14 1vol s VAL 157 Ca 0.00 0.22 -0.12 0.00 -1.81 0.00 0.00 61.98 60.27 1vol s VAL 157 Cb 0.00 -0.20 0.09 0.00 0.56 0.00 0.00 36.38 36.83 1vol s VAL 157 CO 0.00 0.15 1.11 -2.16 -0.31 0.00 0.00 175.10 173.89 1vol s PRO 158 N 1.43 1.76 -1.50 4.82 0.04 -1.26 -4.88 135.00 135.41 1vol s PRO 158 Ca -0.04 0.50 -0.12 0.00 0.04 0.00 0.00 61.00 61.37 1vol s PRO 158 Cb -0.13 -1.89 0.01 0.00 0.04 0.00 0.00 34.50 32.53 1vol s PRO 158 CO -0.03 -1.81 2.43 1.17 0.04 0.00 0.00 177.00 178.80 1vol n LYS 159 N -3.54 3.20 -4.49 4.56 4.81 -1.26 -4.56 118.16 116.89 1vol n LYS 159 Ca 0.07 -2.56 -0.30 0.00 -0.87 0.00 0.00 58.31 54.65 1vol n LYS 159 Cb 0.57 -3.10 -0.13 0.00 0.02 0.00 0.00 35.03 32.39 1vol n LYS 159 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 1vol s ILE 160 N 2.60 2.51 -0.17 3.15 -5.25 -1.26 -4.81 121.20 117.98 1vol s ILE 160 Ca 0.54 -1.53 -0.07 0.00 -0.99 0.00 0.00 60.65 58.60 1vol s ILE 160 Cb 0.15 -2.10 -0.04 0.00 2.95 0.00 0.00 42.46 43.43 1vol s ILE 160 CO -0.08 0.18 0.05 -0.69 -1.79 0.00 0.00 174.94 172.61 1vol s VAL 161 N -1.02 4.68 0.41 8.37 1.01 0.34 -2.12 120.40 132.07 1vol s VAL 161 Ca 0.15 -0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.13 1vol s VAL 161 Cb -0.10 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 1vol s VAL 161 CO 0.07 0.48 0.33 -0.76 0.00 0.00 0.00 175.10 175.22 1vol s LEU 162 N 0.20 3.34 -0.43 3.92 1.02 -0.45 0.27 118.68 126.55 1vol s LEU 162 Ca 0.03 -0.80 0.04 0.00 0.02 0.00 0.00 54.13 53.42 1vol s LEU 162 Cb -0.12 -1.93 0.17 0.00 0.02 0.00 0.00 46.19 44.33 1vol s LEU 162 CO 0.01 -0.61 0.42 -0.76 0.02 0.00 0.00 176.35 175.43 1vol s LEU 163 N -4.07 0.59 0.49 1.79 1.02 0.42 -2.08 118.68 116.84 1vol s LEU 163 Ca 0.46 -2.57 -0.22 0.00 0.02 0.00 0.00 54.13 51.82 1vol s LEU 163 Cb -0.02 0.19 -0.07 0.00 0.02 0.00 0.00 46.19 46.31 1vol s LEU 163 CO 0.27 -0.16 1.17 -0.63 0.02 0.00 0.00 176.35 177.02 1vol s ILE 164 N 0.44 3.03 0.37 -0.59 -1.09 -0.29 -3.86 121.20 119.21 1vol s ILE 164 Ca 0.30 0.74 0.04 0.00 -2.23 0.00 0.00 60.65 59.49 1vol s ILE 164 Cb -0.01 -3.36 -0.05 0.00 -1.58 0.00 0.00 42.46 37.47 1vol s ILE 164 CO -0.14 -0.04 0.07 -0.36 -1.23 0.00 0.00 174.94 173.24 1vol s PHE 165 N -1.58 1.93 0.22 3.97 0.08 -1.21 -0.44 117.98 120.94 1vol s PHE 165 Ca 0.67 -1.04 0.16 0.00 0.12 0.00 0.00 56.93 56.83 1vol s PHE 165 Cb -0.28 -1.29 0.59 0.00 -0.57 0.00 0.00 43.02 41.46 1vol s PHE 165 CO 0.34 -0.05 1.71 0.28 -0.10 0.00 0.00 175.22 177.40 1vol h VAL 166 N 1.94 1.08 0.00 -0.44 2.07 -1.86 -3.20 116.25 115.84 1vol h VAL 166 Ca -0.40 -1.68 -0.11 0.00 0.82 0.00 0.00 66.70 65.33 1vol h VAL 166 Cb 1.26 1.97 -0.02 0.00 -1.52 0.00 0.00 31.29 32.98 1vol h VAL 166 CO 0.67 0.44 -0.55 0.77 0.02 0.00 0.00 177.57 178.92 1vol h SER 167 N 0.00 0.00 0.00 0.57 4.64 -1.89 0.85 113.55 117.73 1vol h SER 167 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1vol h SER 167 Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 1vol h SER 167 CO 0.06 0.55 0.00 0.61 -0.87 0.00 0.00 176.83 177.17 1vol n GLY 168 N 0.64 0.95 3.73 -0.77 0.00 -1.21 -3.76 105.19 104.76 1vol n GLY 168 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1vol n GLY 168 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vol s LYS 169 N -0.32 4.60 0.32 1.61 -0.14 -1.26 -0.14 119.74 124.41 1vol s LYS 169 Ca 0.00 1.65 0.09 0.00 -1.36 0.00 0.00 55.97 56.36 1vol s LYS 169 Cb 0.00 -3.31 -0.05 0.00 -1.68 0.00 0.00 37.83 32.79 1vol s LYS 169 CO 0.00 0.06 -0.00 0.42 -0.76 0.00 0.00 175.35 175.07 1vol s ILE 170 N 0.00 2.83 -0.15 2.17 -1.09 0.11 -3.34 121.20 121.74 1vol s ILE 170 Ca 0.50 -1.98 -0.06 0.00 -2.23 0.00 0.00 60.65 56.88 1vol s ILE 170 Cb -0.28 -2.77 0.07 0.00 -1.58 0.00 0.00 42.46 37.90 1vol s ILE 170 CO 0.33 -0.26 0.32 -0.69 -1.23 0.00 0.00 174.94 173.41 1vol s VAL 171 N -2.47 -0.38 -0.38 2.92 1.01 -1.25 -2.11 120.40 117.74 1vol s VAL 171 Ca 0.34 0.21 0.03 0.00 0.00 0.00 0.00 61.98 62.57 1vol s VAL 171 Cb -0.02 -0.51 0.11 0.00 0.00 0.00 0.00 36.38 35.96 1vol s VAL 171 CO 0.19 0.09 0.11 -0.63 0.00 0.00 0.00 175.10 174.86 1vol s ILE 172 N 2.20 2.15 0.40 2.22 1.01 -0.61 -0.44 121.20 128.14 1vol s ILE 172 Ca -0.02 -2.46 0.08 0.00 0.00 0.00 0.00 60.65 58.24 1vol s ILE 172 Cb -0.11 -2.56 -0.00 0.00 0.01 0.00 0.00 42.46 39.79 1vol s ILE 172 CO -0.10 -0.67 0.48 0.42 0.00 0.00 0.00 174.94 175.07 1vol s THR 173 N 0.70 3.13 0.00 2.92 -4.23 0.14 -2.94 115.64 115.36 1vol s THR 173 Ca 0.12 -1.13 0.00 0.00 -1.18 0.00 0.00 61.69 59.51 1vol s THR 173 Cb -0.21 -3.08 0.00 0.00 1.34 0.00 0.00 72.50 70.55 1vol s THR 173 CO -0.08 -0.04 0.00 0.61 -0.54 0.00 0.00 174.62 174.57 1vol n GLY 174 N -1.69 0.69 3.76 3.99 0.00 -1.23 -0.50 105.19 110.21 1vol n GLY 174 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1vol n GLY 174 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vol s ALA 175 N -2.05 3.39 -0.36 4.61 0.00 -1.15 -4.76 121.76 121.44 1vol s ALA 175 Ca 0.00 0.46 0.19 0.00 0.00 0.00 0.00 51.96 52.61 1vol s ALA 175 Cb 0.00 -3.07 -0.26 0.00 0.00 0.00 0.00 23.12 19.80 1vol s ALA 175 CO 0.00 0.23 0.56 1.63 0.00 0.00 0.00 175.76 178.18 1vol n LYS 176 N 1.69 0.73 -3.73 0.00 5.02 -1.26 0.23 118.16 120.84 1vol n LYS 176 Ca -0.04 -0.10 -0.23 0.00 -2.02 0.00 0.00 58.31 55.92 1vol n LYS 176 Cb 0.48 -1.41 -0.17 0.00 -0.02 0.00 0.00 35.03 33.90 1vol n LYS 176 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1vol s MET 177 N -3.08 0.40 0.55 1.97 -1.94 -1.26 -4.79 119.30 111.16 1vol s MET 177 Ca -0.01 0.09 0.49 0.00 -1.71 0.00 0.00 55.69 54.54 1vol s MET 177 Cb 0.13 -1.08 1.72 0.00 2.01 0.00 0.00 34.83 37.61 1vol s MET 177 CO 0.77 -0.38 1.60 -0.09 -0.01 0.00 0.00 175.02 176.91 1vol h ARG 178 N 8.35 0.00 0.00 2.03 2.43 -1.98 0.31 114.38 125.53 1vol h ARG 178 Ca -0.17 -0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 58.90 1vol h ARG 178 Cb 1.13 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.66 1vol h ARG 178 CO 0.25 0.00 -0.47 -0.44 -1.51 0.00 0.00 179.97 177.80 1vol h ASP 179 N 0.00 0.00 -0.32 -3.80 5.19 -1.99 -2.37 116.42 113.13 1vol h ASP 179 Ca 0.90 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 57.30 1vol h ASP 179 Cb 3.60 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 43.10 1vol h ASP 179 CO -0.03 0.47 0.14 -0.33 -3.12 0.00 0.00 179.24 176.37 1vol h GLU 180 N 0.00 0.47 -0.55 3.56 5.08 -0.80 0.15 114.58 122.49 1vol h GLU 180 Ca -0.00 -0.08 0.11 0.00 -1.00 0.00 0.00 59.36 58.38 1vol h GLU 180 Cb 0.84 -0.08 -0.11 0.00 0.50 0.00 0.00 28.75 29.90 1vol h GLU 180 CO 0.06 0.46 -0.22 1.15 -1.00 0.00 0.00 179.01 179.46 1vol h THR 181 N 0.38 0.32 -0.54 1.13 2.02 -1.47 -0.20 112.91 114.54 1vol h THR 181 Ca 0.11 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.27 1vol h THR 181 Cb 0.16 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 1vol h THR 181 CO -0.01 0.00 0.25 1.88 0.37 0.00 0.00 175.52 178.00 1vol h TYR 182 N -0.09 0.78 -0.02 3.16 0.05 -1.07 -2.43 116.97 117.36 1vol h TYR 182 Ca 0.25 -0.04 0.01 0.00 0.05 0.00 0.00 58.73 58.99 1vol h TYR 182 Cb 0.49 -0.24 -0.00 0.00 1.01 0.00 0.00 36.73 37.98 1vol h TYR 182 CO -0.53 0.62 0.02 0.87 -1.05 0.00 0.00 178.16 178.09 1vol h LYS 183 N 0.72 0.00 0.31 4.88 1.57 0.86 -1.81 116.57 123.11 1vol h LYS 183 Ca 0.18 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.95 1vol h LYS 183 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1vol h LYS 183 CO -0.02 0.00 -0.15 0.00 -0.57 0.00 0.00 179.45 178.71 1vol h ALA 184 N 1.99 -0.42 -0.43 3.86 0.00 -0.63 -2.79 119.26 120.83 1vol h ALA 184 Ca 0.01 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.84 1vol h ALA 184 Cb 0.04 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.94 1vol h ALA 184 CO -0.00 -0.42 0.12 0.35 0.00 0.00 0.00 179.25 179.30 1vol h PHE 185 N -1.05 0.21 0.00 0.00 3.57 -1.23 0.44 116.94 118.88 1vol h PHE 185 Ca -0.04 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.44 1vol h PHE 185 Cb 0.43 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 1vol h PHE 185 CO 0.03 0.05 -0.18 0.93 -2.23 0.00 0.00 178.31 176.91 1vol h GLU 186 N 0.27 0.00 -0.01 1.11 4.39 -1.45 0.35 114.58 119.24 1vol h GLU 186 Ca 0.21 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.91 1vol h GLU 186 Cb 0.23 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.88 1vol h GLU 186 CO -0.24 0.18 0.00 -0.91 -1.16 0.00 0.00 179.01 176.88 1vol h ASN 187 N 0.00 0.02 1.83 1.42 2.35 -0.69 -3.27 115.58 117.24 1vol h ASN 187 Ca -0.00 -0.30 -0.01 0.00 -0.55 0.00 0.00 56.30 55.43 1vol h ASN 187 Cb 0.37 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 38.73 1vol h ASN 187 CO 0.02 0.32 -0.17 -0.29 -1.65 0.00 0.00 177.43 175.66 1vol h ILE 188 N -0.28 0.08 -0.39 2.81 6.09 -0.64 -3.37 117.51 121.81 1vol h ILE 188 Ca 0.00 -1.12 0.05 0.00 -1.37 0.00 0.00 64.86 62.43 1vol h ILE 188 Cb 0.31 1.98 -0.05 0.00 0.47 0.00 0.00 36.82 39.53 1vol h ILE 188 CO 0.00 0.05 0.11 0.22 -3.07 0.00 0.00 178.15 175.46 1vol h TYR 189 N 0.00 0.19 0.00 2.19 3.20 -0.36 0.24 116.97 122.43 1vol h TYR 189 Ca -0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1vol h TYR 189 Cb 1.04 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.28 1vol h TYR 189 CO 0.00 0.06 0.00 -0.35 -1.64 0.00 0.00 178.16 176.23 1vol n PRO 190 N -5.05 0.31 -0.06 1.82 -0.04 -1.26 -0.03 135.00 130.69 1vol n PRO 190 Ca 0.02 0.10 -0.22 0.00 -0.04 0.00 0.00 63.50 63.36 1vol n PRO 190 Cb 0.16 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 31.99 1vol n PRO 190 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1vol n VAL 191 N -1.25 1.65 0.23 0.52 0.31 0.02 -2.91 118.33 116.90 1vol n VAL 191 Ca 0.10 -0.33 -0.15 0.00 -0.01 0.00 0.00 64.34 63.94 1vol n VAL 191 Cb 0.14 -1.89 -0.08 0.00 -0.91 0.00 0.00 33.84 31.10 1vol n VAL 191 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1vol h LEU 192 N -0.50 -0.67 -0.80 7.52 3.38 -0.17 -1.82 115.31 122.24 1vol h LEU 192 Ca -0.40 0.05 0.17 0.00 0.09 0.00 0.00 57.88 57.79 1vol h LEU 192 Cb 1.66 0.21 -0.11 0.00 0.09 0.00 0.00 40.66 42.51 1vol h LEU 192 CO -0.08 -0.41 0.31 0.28 0.09 0.00 0.00 178.44 178.63 1vol h SER 193 N -0.63 0.25 -0.72 -0.43 0.02 -0.61 0.15 113.55 111.58 1vol h SER 193 Ca -0.03 0.13 0.03 0.00 -0.84 0.00 0.00 61.79 61.07 1vol h SER 193 Cb 0.53 0.12 -0.04 0.00 0.14 0.00 0.00 62.40 63.15 1vol h SER 193 CO 0.02 0.05 0.46 -0.08 -1.14 0.00 0.00 176.83 176.13 1vol h GLU 194 N 0.41 0.87 -0.93 3.45 4.81 -1.29 -2.07 114.58 119.83 1vol h GLU 194 Ca 0.46 -0.05 -0.19 0.00 -0.13 0.00 0.00 59.36 59.45 1vol h GLU 194 Cb 0.77 -0.20 -0.11 0.00 0.63 0.00 0.00 28.75 29.84 1vol h GLU 194 CO -0.46 0.58 0.24 1.19 -0.73 0.00 0.00 179.01 179.82 1vol n PHE 195 N -4.64 1.48 -1.74 0.92 3.01 -0.00 -4.94 117.46 111.54 1vol n PHE 195 Ca 0.08 -0.96 -0.39 0.00 1.01 0.00 0.00 57.45 57.19 1vol n PHE 195 Cb 0.08 -0.53 0.03 0.00 -0.01 0.00 0.00 39.48 39.05 1vol n PHE 195 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 1vol n ARG 196 N -0.15 1.89 -2.32 -1.08 0.63 -0.78 -0.73 116.66 114.12 1vol n ARG 196 Ca 0.27 0.69 -0.43 0.00 -0.92 0.00 0.00 57.85 57.45 1vol n ARG 196 Cb 1.01 -2.58 -0.02 0.00 0.45 0.00 0.00 32.46 31.32 1vol n ARG 196 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 1vol s LYS 197 N -2.68 3.83 0.00 -0.14 1.02 -0.32 -4.64 119.74 116.81 1vol s LYS 197 Ca 0.67 1.33 0.00 0.00 0.02 0.00 0.00 55.97 57.99 1vol s LYS 197 Cb -0.43 -3.94 0.00 0.00 -0.52 0.00 0.00 37.83 32.93 1vol s LYS 197 CO 0.53 -1.23 0.00 -0.89 -0.92 0.00 0.00 175.35 172.84