#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zze n LYS 3 N 0.00 1.87 -2.89 0.00 0.00 -1.26 -4.91 118.16 110.97 1zze n LYS 3 Ca 0.00 0.63 -0.42 0.00 0.00 0.00 0.00 58.31 58.52 1zze n LYS 3 Cb 0.00 -2.68 -0.04 0.00 0.00 0.00 0.00 35.03 32.31 1zze n LYS 3 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1zze s ILE 4 N 5.46 4.73 0.10 3.15 1.01 -1.26 -5.00 121.20 129.39 1zze s ILE 4 Ca 0.98 1.22 -0.33 0.00 0.00 0.00 0.00 60.65 62.53 1zze s ILE 4 Cb -0.69 -4.21 -0.12 0.00 0.01 0.00 0.00 42.46 37.45 1zze s ILE 4 CO 0.49 -0.33 1.75 -0.67 0.00 0.00 0.00 174.94 176.18 1zze n ASP 5 N 6.37 3.62 -3.26 3.58 2.03 -1.26 -2.66 116.55 124.98 1zze n ASP 5 Ca 0.05 1.02 -0.23 0.00 0.52 0.00 0.00 54.79 56.15 1zze n ASP 5 Cb 0.48 -1.48 0.02 0.00 -0.72 0.00 0.00 41.12 39.42 1zze n ASP 5 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1zze n ASN 6 N 4.97 -5.02 -4.71 1.67 4.13 -1.26 -4.91 115.26 110.13 1zze n ASN 6 Ca 0.18 -0.38 -0.42 0.00 1.68 0.00 0.00 54.58 55.64 1zze n ASN 6 Cb 0.33 -4.08 -0.00 0.00 -1.54 0.00 0.00 39.78 34.49 1zze n ASN 6 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1zze n ALA 7 N -3.69 1.46 0.14 5.41 0.00 -1.09 -4.41 120.51 118.33 1zze n ALA 7 Ca -0.05 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1zze n ALA 7 Cb 0.58 -2.28 0.12 0.00 0.00 0.00 0.00 19.45 17.87 1zze n ALA 7 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1zze h VAL 8 N 2.59 1.21 -3.45 0.00 2.07 -0.90 -3.42 116.25 114.34 1zze h VAL 8 Ca -0.47 -2.26 -0.62 0.00 0.82 0.00 0.00 66.70 64.17 1zze h VAL 8 Cb 1.28 2.31 -0.16 0.00 -1.52 0.00 0.00 31.29 33.19 1zze h VAL 8 CO 0.63 0.59 -0.55 -0.76 0.02 0.00 0.00 177.57 177.50 1zze s LEU 9 N -6.97 3.89 0.42 2.57 1.43 -1.26 -5.04 118.68 113.71 1zze s LEU 9 Ca 0.01 0.06 -0.24 0.00 -1.03 0.00 0.00 54.13 52.92 1zze s LEU 9 Cb 0.10 -2.02 -0.11 0.00 0.03 0.00 0.00 46.19 44.20 1zze s LEU 9 CO 0.75 0.10 0.99 -0.81 0.23 0.00 0.00 176.35 177.62 1zze n PRO 10 N 4.01 1.32 -1.60 1.29 -0.04 -1.26 -4.84 135.00 133.87 1zze n PRO 10 Ca -0.16 0.47 -0.45 0.00 -0.04 0.00 0.00 63.50 63.33 1zze n PRO 10 Cb 0.52 -2.02 -0.02 0.00 -0.04 0.00 0.00 33.50 31.94 1zze n PRO 10 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1zze n GLU 11 N 0.16 1.43 -1.06 0.54 2.13 -1.26 -0.95 120.64 121.63 1zze n GLU 11 Ca 0.09 0.50 -0.02 0.00 0.66 0.00 0.00 57.16 58.40 1zze n GLU 11 Cb 0.39 -1.92 -0.01 0.00 0.27 0.00 0.00 31.44 30.17 1zze n GLU 11 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1zze n GLY 12 N 1.34 0.42 3.63 8.31 0.00 -1.24 -4.98 105.19 112.67 1zze n GLY 12 Ca 0.10 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1zze n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zze s SER 13 N -2.17 2.50 -0.17 1.61 0.01 -0.12 -4.22 113.70 111.14 1zze s SER 13 Ca 0.00 1.83 -0.12 0.00 1.31 0.00 0.00 55.95 58.97 1zze s SER 13 Cb 0.00 -2.41 -0.05 0.00 0.21 0.00 0.00 66.02 63.77 1zze s SER 13 CO 0.00 -3.31 0.23 -0.22 0.41 0.00 0.00 173.24 170.35 1zze s LEU 14 N -6.69 4.24 -0.11 2.44 2.96 -1.26 -1.38 118.68 118.88 1zze s LEU 14 Ca 0.66 0.42 0.03 0.00 -0.22 0.00 0.00 54.13 55.02 1zze s LEU 14 Cb -0.22 -2.26 0.00 0.00 0.50 0.00 0.00 46.19 44.21 1zze s LEU 14 CO 0.60 0.15 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.85 1zze s VAL 15 N 0.32 2.04 -0.17 1.68 1.01 -0.02 -0.41 120.40 124.86 1zze s VAL 15 Ca 0.14 -1.00 -0.21 0.00 0.00 0.00 0.00 61.98 60.91 1zze s VAL 15 Cb -0.12 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 1zze s VAL 15 CO 0.02 0.55 0.61 -0.22 0.00 0.00 0.00 175.10 176.06 1zze s LEU 16 N 0.50 4.18 -0.26 3.92 2.96 0.00 -1.72 118.68 128.27 1zze s LEU 16 Ca -0.15 0.86 0.02 0.00 -0.22 0.00 0.00 54.13 54.64 1zze s LEU 16 Cb -0.17 -2.87 0.06 0.00 0.50 0.00 0.00 46.19 43.71 1zze s LEU 16 CO 0.05 -0.21 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.11 1zze s VAL 17 N 1.57 1.98 0.44 1.68 1.01 -0.69 -0.22 120.40 126.16 1zze s VAL 17 Ca 0.29 -1.56 -0.20 0.00 0.00 0.00 0.00 61.98 60.51 1zze s VAL 17 Cb -0.16 -2.16 -0.11 0.00 0.00 0.00 0.00 36.38 33.96 1zze s VAL 17 CO 0.11 -0.09 0.95 0.42 0.00 0.00 0.00 175.10 176.49 1zze s THR 18 N 1.18 4.42 -1.51 3.92 -4.23 -0.78 -1.05 115.64 117.59 1zze s THR 18 Ca -0.07 1.44 -0.06 0.00 -1.18 0.00 0.00 61.69 61.82 1zze s THR 18 Cb -0.20 -3.61 0.02 0.00 1.34 0.00 0.00 72.50 70.05 1zze s THR 18 CO -0.06 -0.36 0.66 0.61 -0.54 0.00 0.00 174.62 174.93 1zze n GLY 19 N -0.74 -0.52 0.09 3.99 0.00 -0.92 -3.01 105.19 104.08 1zze n GLY 19 Ca 0.07 0.14 0.07 0.00 0.00 0.00 0.00 46.02 46.30 1zze n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zze n ALA 20 N -3.72 1.11 0.96 4.61 0.00 -0.37 -1.75 120.51 121.34 1zze n ALA 20 Ca -0.09 0.11 0.13 0.00 0.00 0.00 0.00 53.44 53.59 1zze n ALA 20 Cb 0.60 -1.21 0.44 0.00 0.00 0.00 0.00 19.45 19.28 1zze n ALA 20 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1zze n ASN 21 N -1.95 0.28 -4.76 0.00 6.94 -1.26 -3.56 115.26 110.95 1zze n ASN 21 Ca -0.00 0.18 -0.31 0.00 -0.02 0.00 0.00 54.58 54.43 1zze n ASN 21 Cb 0.04 -0.17 0.10 0.00 -2.36 0.00 0.00 39.78 37.39 1zze n ASN 21 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1zze s GLY 22 N -3.06 1.66 0.05 4.83 0.00 -0.72 -4.81 107.32 105.27 1zze s GLY 22 Ca 0.12 0.18 -0.27 0.00 0.00 0.00 0.00 44.72 44.75 1zze s GLY 22 CO 0.61 0.56 1.42 -2.75 0.00 0.00 0.00 173.10 172.94 1zze h PHE 23 N -1.23 -1.00 -0.51 1.90 3.57 -1.89 0.59 116.94 118.37 1zze h PHE 23 Ca -0.45 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.06 1zze h PHE 23 Cb 1.24 0.36 -0.03 0.00 2.79 0.00 0.00 35.95 40.31 1zze h PHE 23 CO 0.54 -0.55 0.32 0.28 -2.23 0.00 0.00 178.31 176.67 1zze h VAL 24 N -0.89 1.08 -0.69 1.41 2.07 -1.95 -2.73 116.25 114.54 1zze h VAL 24 Ca -0.08 -0.22 0.09 0.00 0.82 0.00 0.00 66.70 67.31 1zze h VAL 24 Cb 0.72 0.39 -0.07 0.00 -1.52 0.00 0.00 31.29 30.81 1zze h VAL 24 CO 0.06 0.12 0.35 0.00 0.02 0.00 0.00 177.57 178.12 1zze h ALA 25 N 1.21 0.95 0.00 1.67 0.00 -1.81 -1.61 119.26 119.67 1zze h ALA 25 Ca 0.20 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1zze h ALA 25 Cb -0.01 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1zze h ALA 25 CO -0.08 -0.04 -0.10 0.66 0.00 0.00 0.00 179.25 179.70 1zze h SER 26 N 0.61 0.00 0.69 0.00 4.64 -0.56 0.11 113.55 119.04 1zze h SER 26 Ca 0.34 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.45 1zze h SER 26 Cb 0.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1zze h SER 26 CO -0.25 0.10 -0.95 0.45 -0.87 0.00 0.00 176.83 175.30 1zze h HIS 27 N 0.00 0.24 -0.40 4.77 3.86 -1.21 -1.46 115.15 120.95 1zze h HIS 27 Ca -0.00 -0.15 -0.09 0.00 -1.16 0.00 0.00 60.37 58.97 1zze h HIS 27 Cb 0.19 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 1zze h HIS 27 CO 0.00 1.01 -0.11 0.28 0.86 0.00 0.00 177.93 179.97 1zze h VAL 28 N 0.07 1.28 0.31 2.45 2.07 -0.70 -2.00 116.25 119.73 1zze h VAL 28 Ca -0.05 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.24 1zze h VAL 28 Cb 1.62 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 32.63 1zze h VAL 28 CO 0.14 0.41 -0.15 0.58 0.02 0.00 0.00 177.57 178.57 1zze h VAL 29 N 0.59 0.69 -1.01 2.57 2.07 -0.95 -2.30 116.25 117.92 1zze h VAL 29 Ca 0.10 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.71 1zze h VAL 29 Cb 0.64 0.69 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 1zze h VAL 29 CO 0.04 0.00 0.65 -0.08 0.02 0.00 0.00 177.57 178.20 1zze h GLU 30 N -0.42 1.08 -0.45 1.57 4.81 -1.21 -0.81 114.58 119.15 1zze h GLU 30 Ca -0.04 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 59.03 1zze h GLU 30 Cb 0.32 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1zze h GLU 30 CO 0.07 0.71 -0.08 0.37 -0.73 0.00 0.00 179.01 179.35 1zze h GLN 31 N 1.11 0.80 -0.40 1.92 5.75 -1.18 0.18 115.11 123.29 1zze h GLN 31 Ca 0.46 -0.25 -0.06 0.00 -0.15 0.00 0.00 58.65 58.64 1zze h GLN 31 Cb 0.29 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.75 1zze h GLN 31 CO -0.21 0.86 0.01 -0.07 -2.65 0.00 0.00 178.83 176.77 1zze h LEU 32 N 0.73 0.69 -0.59 -2.39 3.38 -0.73 -2.48 115.31 113.90 1zze h LEU 32 Ca 0.13 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 1zze h LEU 32 Cb 0.56 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1zze h LEU 32 CO 0.03 0.82 0.26 -0.07 0.09 0.00 0.00 178.44 179.57 1zze h LEU 33 N 0.53 0.80 -1.76 1.67 3.38 -0.88 -1.69 115.31 117.37 1zze h LEU 33 Ca 0.12 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 57.97 1zze h LEU 33 Cb 0.46 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1zze h LEU 33 CO 0.02 0.73 0.24 -0.33 0.09 0.00 0.00 178.44 179.18 1zze h GLU 34 N 0.82 0.30 -0.79 1.13 4.39 -0.82 -2.18 114.58 117.43 1zze h GLU 34 Ca 0.20 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.84 1zze h GLU 34 Cb 0.16 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.72 1zze h GLU 34 CO -0.02 0.20 0.06 0.72 -1.16 0.00 0.00 179.01 178.81 1zze n HIS 35 N -4.48 1.30 -0.98 4.33 8.25 -0.79 -4.73 115.22 118.12 1zze n HIS 35 Ca 0.04 -0.55 0.00 0.00 -0.26 0.00 0.00 57.72 56.95 1zze n HIS 35 Cb 0.19 -0.39 0.00 0.00 1.12 0.00 0.00 29.99 30.92 1zze n HIS 35 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1zze n GLY 36 N 0.24 0.49 3.84 -1.41 0.00 -0.82 -4.86 105.19 102.67 1zze n GLY 36 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 1zze n GLY 36 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1zze s TYR 37 N -2.14 3.59 0.02 1.61 2.02 -0.70 -3.60 117.35 118.14 1zze s TYR 37 Ca 0.00 1.08 -0.19 0.00 -0.37 0.00 0.00 57.07 57.60 1zze s TYR 37 Cb 0.00 -2.39 -0.06 0.00 -0.40 0.00 0.00 41.96 39.11 1zze s TYR 37 CO 0.00 0.40 0.54 0.15 -1.57 0.00 0.00 175.55 175.07 1zze s LYS 38 N -2.03 4.20 -0.02 -0.62 1.02 -0.48 -4.06 119.74 117.74 1zze s LYS 38 Ca 0.39 0.65 0.06 0.00 0.02 0.00 0.00 55.97 57.10 1zze s LYS 38 Cb -0.15 -3.28 -0.02 0.00 -0.52 0.00 0.00 37.83 33.86 1zze s LYS 38 CO 0.19 0.53 -0.21 0.08 -0.92 0.00 0.00 175.35 175.02 1zze s VAL 39 N -0.69 1.67 -0.34 3.17 1.01 -0.57 -0.84 120.40 123.81 1zze s VAL 39 Ca 0.28 -0.90 0.03 0.00 0.00 0.00 0.00 61.98 61.39 1zze s VAL 39 Cb -0.18 -1.39 0.09 0.00 0.00 0.00 0.00 36.38 34.90 1zze s VAL 39 CO 0.17 0.47 0.04 -0.60 0.00 0.00 0.00 175.10 175.18 1zze s ARG 40 N -0.47 1.73 -0.03 2.72 3.52 -0.70 -0.39 118.95 125.32 1zze s ARG 40 Ca 0.08 -1.75 -0.14 0.00 -0.13 0.00 0.00 55.73 53.78 1zze s ARG 40 Cb -0.08 -3.21 -0.05 0.00 -1.56 0.00 0.00 34.95 30.04 1zze s ARG 40 CO -0.01 -0.88 0.37 0.20 -0.81 0.00 0.00 175.30 174.17 1zze s GLY 41 N 1.09 2.42 0.14 8.12 0.00 -0.46 -1.71 107.32 116.92 1zze s GLY 41 Ca 0.06 -0.28 0.05 0.00 0.00 0.00 0.00 44.72 44.55 1zze s GLY 41 CO -0.07 0.14 0.10 -0.51 0.00 0.00 0.00 173.10 172.77 1zze s THR 42 N -0.86 4.41 0.20 0.90 -4.23 -0.22 -0.92 115.64 114.92 1zze s THR 42 Ca 0.22 -1.02 -0.18 0.00 -1.18 0.00 0.00 61.69 59.53 1zze s THR 42 Cb -0.16 -3.21 0.03 0.00 1.34 0.00 0.00 72.50 70.51 1zze s THR 42 CO 0.11 -0.04 0.54 0.00 -0.54 0.00 0.00 174.62 174.70 1zze s ALA 43 N -1.63 -0.99 -0.11 3.99 0.00 -1.12 -1.24 121.76 120.65 1zze s ALA 43 Ca 0.30 -0.19 0.29 0.00 0.00 0.00 0.00 51.96 52.36 1zze s ALA 43 Cb -0.11 0.86 1.31 0.00 0.00 0.00 0.00 23.12 25.18 1zze s ALA 43 CO 0.22 -0.82 1.87 0.00 0.00 0.00 0.00 175.76 177.04 1zze h ARG 44 N 2.17 0.00 -3.18 0.00 3.08 -1.89 -0.78 114.38 113.78 1zze h ARG 44 Ca -0.28 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.70 1zze h ARG 44 Cb 1.26 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 31.17 1zze h ARG 44 CO 0.36 0.00 -0.07 -1.54 -1.07 0.00 0.00 179.97 177.66 1zze s SER 45 N -4.81 -0.28 0.32 7.04 1.04 -1.26 -4.35 113.70 111.39 1zze s SER 45 Ca 0.01 -0.13 0.10 0.00 0.48 0.00 0.00 55.95 56.41 1zze s SER 45 Cb 0.09 0.46 0.54 0.00 0.10 0.00 0.00 66.02 67.21 1zze s SER 45 CO 0.42 -0.77 1.73 0.00 0.98 0.00 0.00 173.24 175.60 1zze h ALA 46 N 2.66 1.19 -0.37 5.32 0.00 -1.85 -3.07 119.26 123.13 1zze h ALA 46 Ca -0.33 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.08 1zze h ALA 46 Cb 1.23 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1zze h ALA 46 CO 0.45 0.59 -0.10 0.66 0.00 0.00 0.00 179.25 180.85 1zze h SER 47 N 0.07 0.62 0.17 0.00 4.64 -1.98 -2.41 113.55 114.65 1zze h SER 47 Ca 0.00 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1zze h SER 47 Cb 0.83 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 1zze h SER 47 CO 0.06 0.76 0.00 0.29 -0.87 0.00 0.00 176.83 177.07 1zze n LYS 48 N -4.19 0.13 -0.00 4.77 5.02 -1.16 -1.15 118.16 121.58 1zze n LYS 48 Ca 0.01 0.56 0.04 0.00 -2.02 0.00 0.00 58.31 56.91 1zze n LYS 48 Cb 0.33 -1.87 0.03 0.00 -0.02 0.00 0.00 35.03 33.51 1zze n LYS 48 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1zze n LEU 49 N -2.13 1.67 -0.06 -0.35 4.77 -0.93 -4.75 117.00 115.22 1zze n LEU 49 Ca -0.00 -1.01 -0.08 0.00 -0.03 0.00 0.00 56.01 54.89 1zze n LEU 49 Cb 0.07 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.14 1zze n LEU 49 CO 0.11 0.34 0.67 0.00 -1.33 0.00 0.00 177.39 177.17 1zze h ALA 50 N 1.57 -0.19 0.03 -1.18 0.00 -0.83 0.47 119.26 119.13 1zze h ALA 50 Ca 0.00 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1zze h ALA 50 Cb 0.34 0.59 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1zze h ALA 50 CO 0.00 -0.71 -0.02 -0.91 0.00 0.00 0.00 179.25 177.61 1zze h ASN 51 N -0.28 -0.04 -0.38 0.00 2.35 -1.85 -1.24 115.58 114.14 1zze h ASN 51 Ca 0.14 -0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 55.83 1zze h ASN 51 Cb 0.50 0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.86 1zze h ASN 51 CO -0.43 -0.01 0.08 -0.07 -1.65 0.00 0.00 177.43 175.35 1zze h LEU 52 N -0.06 0.65 -0.79 1.61 3.38 -1.81 -1.67 115.31 116.62 1zze h LEU 52 Ca -0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1zze h LEU 52 Cb 0.05 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1zze h LEU 52 CO 0.01 0.67 0.46 -0.61 0.09 0.00 0.00 178.44 179.05 1zze h GLN 53 N 0.67 1.08 -0.57 1.13 5.75 0.24 0.25 115.11 123.67 1zze h GLN 53 Ca 0.15 -0.11 -0.02 0.00 -0.15 0.00 0.00 58.65 58.52 1zze h GLN 53 Cb 0.30 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 28.60 1zze h GLN 53 CO 0.00 0.78 0.28 -0.22 -2.65 0.00 0.00 178.83 177.03 1zze h LYS 54 N 1.09 0.81 0.10 1.69 3.64 -0.59 0.94 116.57 124.24 1zze h LYS 54 Ca 0.28 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1zze h LYS 54 Cb -0.01 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1zze h LYS 54 CO -0.05 0.65 -0.05 -0.09 -2.27 0.00 0.00 179.45 177.65 1zze h ARG 55 N 0.77 -0.13 0.00 1.90 2.43 -0.63 -2.84 114.38 115.89 1zze h ARG 55 Ca 0.20 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.29 1zze h ARG 55 Cb 0.10 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1zze h ARG 55 CO -0.03 -0.03 -0.42 -1.49 -1.51 0.00 0.00 179.97 176.48 1zze h TRP 56 N -0.18 0.00 -0.20 2.20 6.55 -0.78 -1.89 115.95 121.64 1zze h TRP 56 Ca -0.01 0.00 -0.10 0.00 0.95 0.00 0.00 58.89 59.72 1zze h TRP 56 Cb 0.15 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.44 1zze h TRP 56 CO -0.05 0.42 -0.32 -0.44 -1.05 0.00 0.00 178.44 177.00 1zze h ASP 57 N 0.00 0.42 0.63 -3.49 3.32 -0.72 0.43 116.42 117.01 1zze h ASP 57 Ca -0.00 -0.16 -0.27 0.00 0.02 0.00 0.00 57.03 56.62 1zze h ASP 57 Cb 0.87 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.28 1zze h ASP 57 CO 0.06 0.72 -1.41 0.00 -1.72 0.00 0.00 179.24 176.88 1zze h ALA 58 N 1.31 0.43 0.10 3.45 0.00 -1.35 -2.86 119.26 120.33 1zze h ALA 58 Ca 0.04 -1.14 -0.33 0.00 0.00 0.00 0.00 54.91 53.48 1zze h ALA 58 Cb 0.74 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1zze h ALA 58 CO 0.06 1.29 -1.82 -0.22 0.00 0.00 0.00 179.25 178.56 1zze h LYS 59 N 0.03 0.21 -2.07 0.00 3.64 -1.30 -3.41 116.57 113.67 1zze h LYS 59 Ca -0.18 -0.35 -0.55 0.00 -1.27 0.00 0.00 60.65 58.29 1zze h LYS 59 Cb 1.94 0.13 -0.40 0.00 -0.41 0.00 0.00 32.23 33.49 1zze h LYS 59 CO 0.13 1.03 -0.98 0.66 -2.27 0.00 0.00 179.45 178.01 1zze n TYR 60 N -3.38 1.04 -1.62 1.91 4.01 0.15 -5.07 117.16 114.20 1zze n TYR 60 Ca -0.25 -3.79 -0.47 0.00 -0.16 0.00 0.00 57.90 53.24 1zze n TYR 60 Cb 1.05 -0.42 -0.03 0.00 -0.31 0.00 0.00 39.34 39.63 1zze n TYR 60 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1zze n PRO 61 N 0.81 1.58 -1.20 -0.72 -0.04 -1.08 -1.92 135.00 132.44 1zze n PRO 61 Ca 0.25 0.56 -0.07 0.00 -0.04 0.00 0.00 63.50 64.20 1zze n PRO 61 Cb 0.53 -2.12 -0.03 0.00 -0.04 0.00 0.00 33.50 31.84 1zze n PRO 61 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1zze n GLY 62 N 1.98 0.80 0.05 0.55 0.00 -1.26 -4.86 105.19 102.45 1zze n GLY 62 Ca 0.13 -0.18 -0.02 0.00 0.00 0.00 0.00 46.02 45.95 1zze n GLY 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zze n ARG 63 N -1.44 1.39 -4.68 1.61 5.12 -0.81 -5.00 116.66 112.86 1zze n ARG 63 Ca -0.07 -0.05 -0.33 0.00 -1.93 0.00 0.00 57.85 55.47 1zze n ARG 63 Cb 0.40 -1.33 -0.12 0.00 -1.16 0.00 0.00 32.46 30.24 1zze n ARG 63 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1zze s PHE 64 N -2.54 2.84 -0.07 -1.55 5.36 -1.26 -1.52 117.98 119.26 1zze s PHE 64 Ca -0.06 -0.05 0.02 0.00 -0.96 0.00 0.00 56.93 55.88 1zze s PHE 64 Cb 0.06 -1.66 0.02 0.00 -0.34 0.00 0.00 43.02 41.09 1zze s PHE 64 CO 0.55 0.29 -0.10 -2.00 -1.46 0.00 0.00 175.22 172.50 1zze s GLU 65 N -0.91 1.52 0.13 10.12 2.12 0.47 -4.97 118.70 127.18 1zze s GLU 65 Ca 0.13 -0.34 -0.25 0.00 0.36 0.00 0.00 54.97 54.88 1zze s GLU 65 Cb -0.11 -1.33 -0.07 0.00 0.26 0.00 0.00 34.13 32.88 1zze s GLU 65 CO 0.02 -0.03 0.77 0.99 -0.54 0.00 0.00 175.26 176.46 1zze s THR 66 N 0.86 4.47 0.16 -1.70 2.01 -1.26 -1.35 115.64 118.83 1zze s THR 66 Ca -0.11 1.67 0.01 0.00 0.31 0.00 0.00 61.69 63.56 1zze s THR 66 Cb -0.15 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 68.19 1zze s THR 66 CO 0.01 0.48 0.03 0.00 -0.69 0.00 0.00 174.62 174.46 1zze s ALA 67 N -0.87 1.20 -0.02 7.40 0.00 -0.09 -4.92 121.76 124.46 1zze s ALA 67 Ca 0.36 -1.57 0.06 0.00 0.00 0.00 0.00 51.96 50.81 1zze s ALA 67 Cb -0.22 0.71 -0.01 0.00 0.00 0.00 0.00 23.12 23.60 1zze s ALA 67 CO 0.25 -0.40 -0.19 0.08 0.00 0.00 0.00 175.76 175.51 1zze s VAL 68 N -3.81 1.48 -0.29 0.00 1.01 -1.26 -2.81 120.40 114.72 1zze s VAL 68 Ca 0.25 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.41 1zze s VAL 68 Cb 0.07 -1.24 0.11 0.00 0.00 0.00 0.00 36.38 35.32 1zze s VAL 68 CO 0.04 0.42 0.19 -0.69 0.00 0.00 0.00 175.10 175.06 1zze s VAL 69 N -0.36 -0.18 0.06 2.92 1.01 -0.30 -4.90 120.40 118.64 1zze s VAL 69 Ca 0.05 -0.68 -0.22 0.00 0.00 0.00 0.00 61.98 61.13 1zze s VAL 69 Cb -0.08 -0.98 -0.14 0.00 0.00 0.00 0.00 36.38 35.18 1zze s VAL 69 CO -0.00 -0.65 1.54 -0.33 0.00 0.00 0.00 175.10 175.66 1zze h GLU 70 N 8.34 0.14 -4.37 2.72 3.07 -1.81 -3.34 114.58 119.34 1zze h GLU 70 Ca -0.17 -0.03 -0.63 0.00 -0.50 0.00 0.00 59.36 58.03 1zze h GLU 70 Cb 1.03 -0.02 -0.39 0.00 -0.84 0.00 0.00 28.75 28.53 1zze h GLU 70 CO 0.40 0.33 -0.77 0.34 -1.40 0.00 0.00 179.01 177.91 1zze s ASP 71 N -5.56 4.18 0.09 1.42 3.68 -1.26 -4.90 116.67 114.32 1zze s ASP 71 Ca -0.14 -1.52 0.17 0.00 2.13 0.00 0.00 52.55 53.19 1zze s ASP 71 Cb 0.05 -1.28 0.74 0.00 -1.45 0.00 0.00 42.92 40.98 1zze s ASP 71 CO 0.69 -0.30 1.54 1.15 0.13 0.00 0.00 175.17 178.39 1zze n MET 72 N 4.57 0.07 0.06 4.34 0.00 -1.26 -2.73 117.12 122.16 1zze n MET 72 Ca -0.07 0.31 0.11 0.00 0.00 0.00 0.00 57.70 58.06 1zze n MET 72 Cb 0.43 -1.63 -0.01 0.00 0.00 0.00 0.00 33.22 32.01 1zze n MET 72 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1zze n LEU 73 N -1.75 0.62 -4.74 3.17 4.77 -1.26 -4.69 117.00 113.11 1zze n LEU 73 Ca 0.03 0.16 -0.41 0.00 -0.03 0.00 0.00 56.01 55.76 1zze n LEU 73 Cb 0.19 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.17 1zze n LEU 73 CO 0.15 -0.07 0.77 -0.75 -1.33 0.00 0.00 177.39 176.16 1zze s LYS 74 N -3.33 4.63 0.30 3.23 2.20 -1.10 -4.94 119.74 120.72 1zze s LYS 74 Ca -0.00 1.67 -0.30 0.00 -0.36 0.00 0.00 55.97 56.98 1zze s LYS 74 Cb 0.12 -3.28 -0.12 0.00 -1.51 0.00 0.00 37.83 33.04 1zze s LYS 74 CO 0.81 0.13 1.57 0.00 -0.36 0.00 0.00 175.35 177.50 1zze n GLN 75 N 2.28 2.65 -0.54 4.03 0.00 -1.26 -1.64 117.38 122.90 1zze n GLN 75 Ca 0.02 0.94 0.00 0.00 0.00 0.00 0.00 57.00 57.96 1zze n GLN 75 Cb 0.46 -2.71 0.00 0.00 0.00 0.00 0.00 30.24 28.00 1zze n GLN 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1zze n GLY 76 N 2.01 1.15 0.49 2.61 0.00 -1.26 -4.92 105.19 105.28 1zze n GLY 76 Ca 0.08 0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.41 1zze n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zze h ALA 77 N 0.00 2.95 -0.01 4.61 0.00 -1.60 -1.99 119.26 123.21 1zze h ALA 77 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1zze h ALA 77 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1zze h ALA 77 CO 0.00 -1.26 -0.16 0.66 0.00 0.00 0.00 179.25 178.49 1zze n TYR 78 N -4.18 0.00 -0.35 0.00 4.02 -1.26 -4.71 117.16 110.68 1zze n TYR 78 Ca 0.21 0.00 0.25 0.00 -0.01 0.00 0.00 57.90 58.36 1zze n TYR 78 Cb 1.09 0.00 0.51 0.00 -0.02 0.00 0.00 39.34 40.91 1zze n TYR 78 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1zze h ASP 79 N 2.08 0.47 0.00 7.72 3.32 -1.77 -1.05 116.42 127.18 1zze h ASP 79 Ca 0.00 0.15 -0.06 0.00 0.02 0.00 0.00 57.03 57.13 1zze h ASP 79 Cb 0.52 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 1zze h ASP 79 CO 0.00 -0.06 -0.40 -0.33 -1.72 0.00 0.00 179.24 176.73 1zze h GLU 80 N 0.33 0.00 0.00 3.56 4.39 -1.84 -3.36 114.58 117.65 1zze h GLU 80 Ca 0.71 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 60.40 1zze h GLU 80 Cb 1.75 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 30.40 1zze h GLU 80 CO -0.48 0.74 -0.05 -0.39 -1.16 0.00 0.00 179.01 177.67 1zze h VAL 81 N -1.00 0.32 0.00 3.13 -1.51 -1.81 -2.54 116.25 112.84 1zze h VAL 81 Ca -0.10 -0.28 0.00 0.00 -1.23 0.00 0.00 66.70 65.09 1zze h VAL 81 Cb 0.87 1.21 0.00 0.00 -2.13 0.00 0.00 31.29 31.24 1zze h VAL 81 CO -0.06 0.05 -0.21 0.00 -1.23 0.00 0.00 177.57 176.12 1zze n ILE 82 N -3.44 0.01 -1.68 7.19 3.06 -0.42 -4.83 119.36 119.25 1zze n ILE 82 Ca -0.02 -0.01 -0.44 0.00 -2.50 0.00 0.00 62.75 59.78 1zze n ILE 82 Cb 0.17 -0.20 -0.04 0.00 0.54 0.00 0.00 39.64 40.12 1zze n ILE 82 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 1zze n LYS 83 N -1.52 2.58 -0.92 9.51 5.02 -0.96 -1.57 118.16 130.30 1zze n LYS 83 Ca 0.06 0.94 0.00 0.00 -2.02 0.00 0.00 58.31 57.29 1zze n LYS 83 Cb 0.34 -2.80 0.00 0.00 -0.02 0.00 0.00 35.03 32.55 1zze n LYS 83 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1zze n GLY 84 N 4.14 0.84 3.73 0.72 0.00 -1.26 -5.02 105.19 108.33 1zze n GLY 84 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1zze n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zze s ALA 85 N -3.30 3.26 -0.06 4.61 0.00 -0.61 -4.43 121.76 121.23 1zze s ALA 85 Ca 0.00 0.54 0.22 0.00 0.00 0.00 0.00 51.96 52.71 1zze s ALA 85 Cb 0.00 -3.25 -0.31 0.00 0.00 0.00 0.00 23.12 19.57 1zze s ALA 85 CO 0.00 -0.02 0.49 0.00 0.00 0.00 0.00 175.76 176.22 1zze n ALA 86 N 2.84 2.68 -2.76 0.00 0.00 0.45 -2.67 120.51 121.05 1zze n ALA 86 Ca 0.02 -0.57 -0.10 0.00 0.00 0.00 0.00 53.44 52.80 1zze n ALA 86 Cb 0.49 -0.73 -0.09 0.00 0.00 0.00 0.00 19.45 19.12 1zze n ALA 86 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1zze s GLY 87 N -4.59 0.15 -0.03 0.00 0.00 -1.17 -0.65 107.32 101.02 1zze s GLY 87 Ca -0.08 -0.50 0.01 0.00 0.00 0.00 0.00 44.72 44.16 1zze s GLY 87 CO 0.89 -0.64 -0.04 0.14 0.00 0.00 0.00 173.10 173.46 1zze s VAL 88 N -2.56 0.44 -0.33 1.40 1.01 -0.46 -0.82 120.40 119.08 1zze s VAL 88 Ca -0.05 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 61.85 1zze s VAL 88 Cb -0.01 -0.47 0.08 0.00 0.00 0.00 0.00 36.38 35.99 1zze s VAL 88 CO -0.04 0.19 0.05 0.00 0.00 0.00 0.00 175.10 175.30 1zze s ALA 89 N 0.79 2.88 -0.62 5.51 0.00 0.70 -0.34 121.76 130.68 1zze s ALA 89 Ca -0.10 -2.24 -0.23 0.00 0.00 0.00 0.00 51.96 49.40 1zze s ALA 89 Cb -0.13 -2.00 0.06 0.00 0.00 0.00 0.00 23.12 21.05 1zze s ALA 89 CO -0.00 -1.54 0.96 -1.58 0.00 0.00 0.00 175.76 173.60 1zze s HIS 90 N 1.07 2.71 -0.22 0.00 2.46 -0.28 -1.86 115.29 119.16 1zze s HIS 90 Ca 0.03 -0.37 0.02 0.00 0.47 0.00 0.00 55.06 55.21 1zze s HIS 90 Cb -0.20 -4.21 0.01 0.00 -0.13 0.00 0.00 32.58 28.05 1zze s HIS 90 CO -0.05 -1.56 0.49 -0.89 -2.47 0.00 0.00 174.74 170.26 1zze n ILE 91 N 6.01 0.00 -2.21 0.89 5.41 -1.18 -2.05 119.36 126.23 1zze n ILE 91 Ca -0.02 -0.49 -0.33 0.00 1.00 0.00 0.00 62.75 62.91 1zze n ILE 91 Cb 0.46 1.04 -0.01 0.00 -0.71 0.00 0.00 39.64 40.42 1zze n ILE 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1zze s ALA 92 N -0.32 2.83 0.00 -1.39 0.00 -1.16 -4.72 121.76 117.00 1zze s ALA 92 Ca 0.02 0.39 -0.24 0.00 0.00 0.00 0.00 51.96 52.14 1zze s ALA 92 Cb 0.02 -3.21 0.05 0.00 0.00 0.00 0.00 23.12 19.97 1zze s ALA 92 CO 0.03 -0.60 0.53 -1.54 0.00 0.00 0.00 175.76 174.18 1zze s SER 93 N -2.69 -0.46 0.06 0.00 1.04 -1.26 -4.95 113.70 105.44 1zze s SER 93 Ca 0.63 0.34 -0.30 0.00 0.48 0.00 0.00 55.95 57.10 1zze s SER 93 Cb -0.15 0.47 -0.05 0.00 0.10 0.00 0.00 66.02 66.39 1zze s SER 93 CO 0.33 -0.63 1.14 -0.69 0.98 0.00 0.00 173.24 174.37 1zze s VAL 94 N -1.79 4.21 -1.77 5.02 1.01 -1.26 -4.90 120.40 120.92 1zze s VAL 94 Ca -0.09 1.62 0.00 0.00 0.00 0.00 0.00 61.98 63.51 1zze s VAL 94 Cb -0.01 -4.04 0.00 0.00 0.00 0.00 0.00 36.38 32.33 1zze s VAL 94 CO 0.04 0.14 0.78 0.52 0.00 0.00 0.00 175.10 176.58 1zze n VAL 95 N 3.75 0.00 -0.86 2.92 0.31 -1.26 -4.90 118.33 118.28 1zze n VAL 95 Ca 0.08 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 64.00 1zze n VAL 95 Cb 0.47 -0.15 -0.08 0.00 -0.91 0.00 0.00 33.84 33.17 1zze n VAL 95 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1zze n SER 96 N -0.37 0.50 -4.34 4.52 2.88 -1.26 -4.85 113.62 110.69 1zze n SER 96 Ca 0.00 0.45 -0.45 0.00 -1.33 0.00 0.00 58.87 57.54 1zze n SER 96 Cb 0.05 -0.62 -0.06 0.00 -0.75 0.00 0.00 64.21 62.83 1zze n SER 96 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 1zze s PHE 97 N 4.19 3.26 -0.24 0.66 5.36 -1.26 -4.96 117.98 124.99 1zze s PHE 97 Ca 0.83 -1.15 -0.35 0.00 -0.96 0.00 0.00 56.93 55.30 1zze s PHE 97 Cb -1.02 -3.48 0.15 0.00 -0.34 0.00 0.00 43.02 38.33 1zze s PHE 97 CO 0.45 -0.91 1.28 0.45 -1.46 0.00 0.00 175.22 175.03 1zze s SER 98 N 3.08 -0.09 -0.08 6.13 0.15 -1.26 -5.02 113.70 116.60 1zze s SER 98 Ca 0.04 0.02 0.16 0.00 0.70 0.00 0.00 55.95 56.87 1zze s SER 98 Cb -0.27 0.09 0.55 0.00 -1.71 0.00 0.00 66.02 64.68 1zze s SER 98 CO 0.05 -0.14 1.46 0.59 1.20 0.00 0.00 173.24 176.40 1zze n ASN 99 N 0.07 3.96 -4.66 5.45 3.02 -1.26 -4.86 115.26 116.98 1zze n ASN 99 Ca 0.02 -2.40 -0.42 0.00 -0.03 0.00 0.00 54.58 51.75 1zze n ASN 99 Cb 0.58 -0.46 -0.04 0.00 -0.61 0.00 0.00 39.78 39.25 1zze n ASN 99 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1zze s LYS 100 N -1.73 4.26 0.04 3.52 3.01 -1.26 -4.94 119.74 122.63 1zze s LYS 100 Ca 0.40 0.99 -0.10 0.00 -1.01 0.00 0.00 55.97 56.25 1zze s LYS 100 Cb 0.26 -3.60 -0.03 0.00 -1.01 0.00 0.00 37.83 33.45 1zze s LYS 100 CO 0.19 -0.40 1.17 -0.92 0.51 0.00 0.00 175.35 175.91 1zze h TYR 101 N 7.45 -0.55 -0.89 3.18 3.20 -1.92 -2.35 116.97 125.10 1zze h TYR 101 Ca -0.27 0.03 0.11 0.00 3.14 0.00 0.00 58.73 61.74 1zze h TYR 101 Cb 1.12 0.26 -0.08 0.00 1.54 0.00 0.00 36.73 39.56 1zze h TYR 101 CO 0.73 -0.15 0.53 -0.44 -1.64 0.00 0.00 178.16 177.18 1zze h ASP 102 N -0.12 0.75 0.40 -2.11 3.45 -1.96 0.19 116.42 117.02 1zze h ASP 102 Ca 0.02 0.05 0.00 0.00 0.43 0.00 0.00 57.03 57.54 1zze h ASP 102 Cb 0.19 -0.09 0.00 0.00 -0.56 0.00 0.00 39.33 38.87 1zze h ASP 102 CO -0.19 0.40 0.00 -0.62 -1.57 0.00 0.00 179.24 177.25 1zze n GLU 103 N -4.72 0.08 -0.04 3.56 1.02 -1.01 -1.68 120.64 117.85 1zze n GLU 103 Ca 0.16 0.22 -0.08 0.00 -0.02 0.00 0.00 57.16 57.43 1zze n GLU 103 Cb 0.33 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.22 1zze n GLU 103 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1zze n VAL 104 N -1.42 0.50 -0.08 2.62 0.31 -0.50 -4.61 118.33 115.15 1zze n VAL 104 Ca 0.05 -0.15 -0.15 0.00 -0.01 0.00 0.00 64.34 64.08 1zze n VAL 104 Cb 0.15 -1.33 -0.05 0.00 -0.91 0.00 0.00 33.84 31.70 1zze n VAL 104 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1zze h VAL 105 N -0.21 1.29 -0.04 2.52 2.07 -0.72 -2.96 116.25 118.20 1zze h VAL 105 Ca -0.22 -1.68 0.03 0.00 0.82 0.00 0.00 66.70 65.65 1zze h VAL 105 Cb 1.24 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 32.67 1zze h VAL 105 CO -0.10 0.54 -0.12 0.74 0.02 0.00 0.00 177.57 178.65 1zze h THR 106 N 0.55 0.69 -0.77 2.57 2.02 -1.52 -1.81 112.91 114.65 1zze h THR 106 Ca 0.01 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.18 1zze h THR 106 Cb 1.09 0.69 -0.04 0.00 -1.74 0.00 0.00 68.15 68.16 1zze h THR 106 CO 0.11 0.00 0.41 -0.65 0.37 0.00 0.00 175.52 175.76 1zze h PRO 107 N -0.18 1.07 -0.30 6.66 0.11 -1.76 -0.38 132.00 137.22 1zze h PRO 107 Ca 0.06 -0.12 0.02 0.00 0.11 0.00 0.00 66.00 66.06 1zze h PRO 107 Cb 0.26 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.14 1zze h PRO 107 CO -0.15 0.79 0.16 0.00 -0.21 0.00 0.00 178.00 178.59 1zze h ALA 108 N 1.38 0.37 -0.10 -0.75 0.00 -1.28 0.32 119.26 119.19 1zze h ALA 108 Ca 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1zze h ALA 108 Cb 0.04 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1zze h ALA 108 CO -0.04 -0.21 0.01 0.82 0.00 0.00 0.00 179.25 179.83 1zze h ILE 109 N 0.34 1.22 -0.44 0.00 2.04 -1.05 -2.73 117.51 116.89 1zze h ILE 109 Ca 0.12 -0.69 0.07 0.00 1.00 0.00 0.00 64.86 65.35 1zze h ILE 109 Cb 0.02 1.48 -0.06 0.00 -0.74 0.00 0.00 36.82 37.52 1zze h ILE 109 CO -0.07 0.20 0.11 1.23 0.00 0.00 0.00 178.15 179.63 1zze h GLY 110 N -0.06 0.55 1.23 5.37 0.00 -0.79 -1.50 103.07 107.87 1zze h GLY 110 Ca 0.03 -0.05 -0.05 0.00 0.00 0.00 0.00 47.33 47.26 1zze h GLY 110 CO 0.00 -0.03 0.17 -1.33 0.00 0.00 0.00 176.54 175.35 1zze h GLY 111 N 0.26 1.03 0.86 4.60 0.00 -0.94 -1.34 103.07 107.55 1zze h GLY 111 Ca 0.22 -0.60 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 1zze h GLY 111 CO -0.26 0.56 0.03 -0.84 0.00 0.00 0.00 176.54 176.04 1zze h THR 112 N 0.92 1.23 -0.48 4.70 2.02 -1.12 -3.06 112.91 117.12 1zze h THR 112 Ca 0.20 -0.80 -0.10 0.00 0.77 0.00 0.00 66.41 66.48 1zze h THR 112 Cb 0.30 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 1zze h THR 112 CO -0.00 0.25 -0.12 -0.07 0.37 0.00 0.00 175.52 175.95 1zze h LEU 113 N 0.23 0.89 -0.95 2.58 3.38 -1.15 -2.65 115.31 117.64 1zze h LEU 113 Ca 0.08 -0.28 0.05 0.00 0.09 0.00 0.00 57.88 57.81 1zze h LEU 113 Cb 0.35 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 1zze h LEU 113 CO 0.01 1.01 0.61 -1.13 0.09 0.00 0.00 178.44 179.03 1zze h ASN 114 N 0.80 1.00 -0.34 -0.43 -1.24 -1.21 0.14 115.58 114.29 1zze h ASN 114 Ca 0.13 0.00 -0.10 0.00 0.71 0.00 0.00 56.30 57.04 1zze h ASN 114 Cb 0.64 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.47 1zze h ASN 114 CO 0.04 0.66 -0.17 0.00 -1.29 0.00 0.00 177.43 176.68 1zze h ALA 115 N 1.41 0.48 -0.80 1.57 0.00 -1.43 -2.49 119.26 117.99 1zze h ALA 115 Ca 0.40 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1zze h ALA 115 Cb 0.09 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1zze h ALA 115 CO -0.15 0.40 0.34 -0.07 0.00 0.00 0.00 179.25 179.77 1zze h LEU 116 N 0.49 1.08 -0.52 0.00 3.38 -1.00 -2.31 115.31 116.43 1zze h LEU 116 Ca 0.08 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1zze h LEU 116 Cb 0.70 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1zze h LEU 116 CO 0.05 0.94 0.27 0.03 0.09 0.00 0.00 178.44 179.82 1zze h ARG 117 N 1.15 0.74 -0.40 1.13 3.08 -0.66 -0.46 114.38 118.96 1zze h ARG 117 Ca 0.27 -0.10 0.03 0.00 0.07 0.00 0.00 59.98 60.25 1zze h ARG 117 Cb 0.18 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 1zze h ARG 117 CO -0.03 0.59 0.20 0.00 -1.07 0.00 0.00 179.97 179.67 1zze h ALA 118 N 1.10 0.50 -0.77 0.04 0.00 -1.15 -1.77 119.26 117.21 1zze h ALA 118 Ca 0.18 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1zze h ALA 118 Cb 0.09 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1zze h ALA 118 CO -0.03 -0.15 0.34 0.00 0.00 0.00 0.00 179.25 179.41 1zze h ALA 119 N 1.21 1.00 -0.78 0.00 0.00 -1.15 -2.60 119.26 116.95 1zze h ALA 119 Ca 0.17 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1zze h ALA 119 Cb 0.08 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 17.50 1zze h ALA 119 CO -0.12 0.60 0.45 0.00 0.00 0.00 0.00 179.25 180.18 1zze h ALA 120 N 1.17 1.07 -0.12 0.00 0.00 -0.37 -1.52 119.26 119.50 1zze h ALA 120 Ca 0.26 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1zze h ALA 120 Cb 0.17 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1zze h ALA 120 CO -0.03 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.36 1zze n ALA 121 N -2.36 2.54 -3.96 0.00 0.00 -0.73 -4.61 120.51 111.39 1zze n ALA 121 Ca 0.11 -0.37 -0.31 0.00 0.00 0.00 0.00 53.44 52.87 1zze n ALA 121 Cb 0.20 -1.14 -0.14 0.00 0.00 0.00 0.00 19.45 18.38 1zze n ALA 121 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1zze s THR 122 N -1.84 2.57 0.52 0.00 2.01 -0.57 -4.99 115.64 113.33 1zze s THR 122 Ca 0.28 -2.77 0.34 0.00 0.31 0.00 0.00 61.69 59.85 1zze s THR 122 Cb 0.14 -2.82 0.53 0.00 0.01 0.00 0.00 72.50 70.36 1zze s THR 122 CO 0.22 -0.71 1.80 -0.65 -0.69 0.00 0.00 174.62 174.59 1zze h PRO 123 N 7.14 0.05 0.00 4.92 0.11 -1.81 -1.29 132.00 141.12 1zze h PRO 123 Ca -0.06 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.99 1zze h PRO 123 Cb 0.96 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 1zze h PRO 123 CO 0.61 0.03 -0.25 0.66 -0.21 0.00 0.00 178.00 178.85 1zze h SER 124 N 0.05 0.00 -2.85 -2.05 4.64 -1.92 -3.42 113.55 108.00 1zze h SER 124 Ca 0.57 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 61.32 1zze h SER 124 Cb 2.15 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 64.21 1zze h SER 124 CO -0.05 0.25 0.98 -0.69 -0.87 0.00 0.00 176.83 176.45 1zze s VAL 125 N -4.38 4.04 -0.13 0.95 1.01 -0.49 -4.17 120.40 117.23 1zze s VAL 125 Ca -0.03 1.24 0.10 0.00 0.00 0.00 0.00 61.98 63.29 1zze s VAL 125 Cb 0.15 -3.86 -0.15 0.00 0.00 0.00 0.00 36.38 32.51 1zze s VAL 125 CO 0.69 -0.18 0.03 0.29 0.00 0.00 0.00 175.10 175.93 1zze n LYS 126 N 6.94 1.77 -4.47 2.72 5.02 0.18 -4.51 118.16 125.80 1zze n LYS 126 Ca 0.15 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.25 1zze n LYS 126 Cb 0.45 -1.33 -0.15 0.00 -0.02 0.00 0.00 35.03 33.98 1zze n LYS 126 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1zze s ARG 127 N -2.31 0.90 -0.06 1.97 1.81 -1.20 -1.67 118.95 118.39 1zze s ARG 127 Ca -0.08 -0.39 0.01 0.00 -1.72 0.00 0.00 55.73 53.56 1zze s ARG 127 Cb 0.04 -0.87 0.02 0.00 -0.45 0.00 0.00 34.95 33.69 1zze s ARG 127 CO 0.51 0.23 -0.08 0.12 -0.68 0.00 0.00 175.30 175.39 1zze s PHE 128 N -0.22 1.15 -0.11 -0.53 2.19 -0.36 -1.35 117.98 118.75 1zze s PHE 128 Ca 0.04 -0.41 0.03 0.00 0.33 0.00 0.00 56.93 56.91 1zze s PHE 128 Cb -0.05 -0.91 0.01 0.00 -1.31 0.00 0.00 43.02 40.76 1zze s PHE 128 CO -0.00 -0.26 -0.20 0.54 1.83 0.00 0.00 175.22 177.13 1zze s VAL 129 N 0.88 1.82 -0.20 3.12 0.11 0.54 -1.89 120.40 124.78 1zze s VAL 129 Ca -0.11 -0.85 -0.08 0.00 -2.93 0.00 0.00 61.98 58.01 1zze s VAL 129 Cb -0.15 -1.62 -0.04 0.00 -1.53 0.00 0.00 36.38 33.05 1zze s VAL 129 CO 0.01 0.51 0.08 -0.22 -3.33 0.00 0.00 175.10 172.14 1zze s LEU 130 N 0.72 3.81 -0.44 2.54 2.96 -0.20 -1.13 118.68 126.94 1zze s LEU 130 Ca -0.11 0.05 -0.24 0.00 -0.22 0.00 0.00 54.13 53.61 1zze s LEU 130 Cb -0.16 -1.98 0.02 0.00 0.50 0.00 0.00 46.19 44.57 1zze s LEU 130 CO 0.02 0.13 0.84 -0.89 -1.32 0.00 0.00 176.35 175.13 1zze s THR 131 N 0.65 4.59 0.00 3.68 2.01 -0.87 -1.23 115.64 124.47 1zze s THR 131 Ca 0.04 0.64 0.00 0.00 0.31 0.00 0.00 61.69 62.68 1zze s THR 131 Cb -0.13 -4.35 0.00 0.00 0.01 0.00 0.00 72.50 68.03 1zze s THR 131 CO 0.01 -0.71 0.00 -0.24 -0.69 0.00 0.00 174.62 172.99 1zze n SER 132 N 6.84 0.00 -3.53 3.53 2.88 0.35 -4.89 113.62 118.81 1zze n SER 132 Ca 0.04 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.47 1zze n SER 132 Cb 0.48 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.91 1zze n SER 132 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1zze s SER 133 N -0.15 -0.42 0.51 -3.46 0.15 -1.26 -4.28 113.70 104.79 1zze s SER 133 Ca 0.00 0.23 0.34 0.00 0.70 0.00 0.00 55.95 57.22 1zze s SER 133 Cb 0.00 0.39 1.78 0.00 -1.71 0.00 0.00 66.02 66.48 1zze s SER 133 CO 0.00 -0.55 2.04 0.71 1.20 0.00 0.00 173.24 176.64 1zze h THR 134 N 2.32 0.00 0.00 6.45 1.35 -1.54 -1.34 112.91 120.15 1zze h THR 134 Ca -0.22 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 1zze h THR 134 Cb 1.21 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 1zze h THR 134 CO 0.32 0.00 0.00 1.33 -0.25 0.00 0.00 175.52 176.92 1zze n VAL 135 N -2.74 1.07 1.02 6.82 0.24 -1.25 -0.59 118.33 122.91 1zze n VAL 135 Ca -0.02 0.27 0.13 0.00 -2.04 0.00 0.00 64.34 62.68 1zze n VAL 135 Cb 0.10 -1.05 0.61 0.00 -1.47 0.00 0.00 33.84 32.03 1zze n VAL 135 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1zze n SER 136 N -1.47 0.00 -0.07 -1.34 3.41 -0.50 -3.55 113.62 110.08 1zze n SER 136 Ca 0.03 0.37 -0.11 0.00 -0.26 0.00 0.00 58.87 58.91 1zze n SER 136 Cb 0.14 -0.46 -0.06 0.00 -0.26 0.00 0.00 64.21 63.57 1zze n SER 136 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1zze n ALA 137 N -1.46 1.75 -3.56 7.33 0.00 0.25 -0.92 120.51 123.90 1zze n ALA 137 Ca 0.08 -0.61 -0.06 0.00 0.00 0.00 0.00 53.44 52.85 1zze n ALA 137 Cb 0.30 0.20 -0.02 0.00 0.00 0.00 0.00 19.45 19.93 1zze n ALA 137 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1zze s LEU 138 N -6.02 -0.24 -0.21 0.00 2.34 -0.50 -2.97 118.68 111.08 1zze s LEU 138 Ca -0.20 -0.01 -0.12 0.00 0.06 0.00 0.00 54.13 53.87 1zze s LEU 138 Cb 0.06 1.68 -0.05 0.00 -0.56 0.00 0.00 46.19 47.32 1zze s LEU 138 CO 0.32 -0.42 0.21 -0.63 -1.06 0.00 0.00 176.35 174.77 1zze s ILE 139 N -2.75 5.34 0.42 1.48 -1.09 -1.26 -3.90 121.20 119.44 1zze s ILE 139 Ca 0.08 0.33 -0.25 0.00 -2.23 0.00 0.00 60.65 58.58 1zze s ILE 139 Cb -0.01 -3.55 -0.10 0.00 -1.58 0.00 0.00 42.46 37.22 1zze s ILE 139 CO -0.06 0.36 1.25 -2.65 -1.23 0.00 0.00 174.94 172.61 1zze n PRO 140 N 4.00 1.88 -3.62 2.79 -0.02 -1.26 -5.01 135.00 133.76 1zze n PRO 140 Ca -0.14 0.67 -0.27 0.00 -2.02 0.00 0.00 63.50 61.75 1zze n PRO 140 Cb 0.52 -2.36 -0.17 0.00 -0.02 0.00 0.00 33.50 31.47 1zze n PRO 140 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1zze s LYS 141 N -2.21 0.15 0.67 -0.52 2.20 -1.26 -4.94 119.74 113.83 1zze s LYS 141 Ca 0.61 -0.17 -0.14 0.00 -0.36 0.00 0.00 55.97 55.91 1zze s LYS 141 Cb -0.51 -1.81 0.00 0.00 -1.51 0.00 0.00 37.83 34.01 1zze s LYS 141 CO 0.58 -0.70 1.08 -1.25 -0.36 0.00 0.00 175.35 174.70 1zze s PRO 142 N 2.10 2.86 -1.45 4.03 0.04 -1.26 -3.81 135.00 137.51 1zze s PRO 142 Ca 0.02 1.22 0.00 0.00 0.04 0.00 0.00 61.00 62.28 1zze s PRO 142 Cb -0.16 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1zze s PRO 142 CO -0.12 -1.18 0.00 0.09 0.04 0.00 0.00 177.00 175.83 1zze n ASN 143 N -2.66 -5.12 -4.38 6.66 3.02 0.05 -4.91 115.26 107.92 1zze n ASN 143 Ca 0.09 0.34 -0.34 0.00 -0.03 0.00 0.00 54.58 54.64 1zze n ASN 143 Cb 0.53 -3.82 -0.14 0.00 -0.61 0.00 0.00 39.78 35.74 1zze n ASN 143 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1zze s VAL 144 N -2.35 3.31 0.53 2.41 1.01 -1.25 -5.05 120.40 119.02 1zze s VAL 144 Ca 0.00 -0.55 -0.05 0.00 0.00 0.00 0.00 61.98 61.37 1zze s VAL 144 Cb 0.00 -2.43 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 1zze s VAL 144 CO 0.00 0.49 0.83 -1.61 0.00 0.00 0.00 175.10 174.82 1zze s GLU 145 N 0.65 3.19 -0.34 2.72 2.02 -1.26 -4.49 118.70 121.19 1zze s GLU 145 Ca -0.05 0.04 0.00 0.00 0.02 0.00 0.00 54.97 54.98 1zze s GLU 145 Cb -0.15 -2.34 0.00 0.00 0.10 0.00 0.00 34.13 31.74 1zze s GLU 145 CO 0.02 -0.46 0.00 0.41 0.02 0.00 0.00 175.26 175.25 1zze n GLY 146 N -2.41 0.63 3.52 -1.39 0.00 -1.26 -5.02 105.19 99.26 1zze n GLY 146 Ca 0.03 -0.91 -0.42 0.00 0.00 0.00 0.00 46.02 44.72 1zze n GLY 146 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1zze s ILE 147 N -2.12 5.09 -0.12 -0.61 1.01 -1.26 -5.02 121.20 118.17 1zze s ILE 147 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 60.65 60.62 1zze s ILE 147 Cb 0.00 -3.94 0.03 0.00 0.01 0.00 0.00 42.46 38.56 1zze s ILE 147 CO 0.00 -0.26 -0.04 -0.47 0.00 0.00 0.00 174.94 174.18 1zze s TYR 148 N 2.18 1.27 -0.28 3.97 5.04 -1.26 -1.46 117.35 126.80 1zze s TYR 148 Ca 0.14 -0.68 -0.10 0.00 -2.44 0.00 0.00 57.07 53.99 1zze s TYR 148 Cb -0.16 -1.11 -0.04 0.00 0.35 0.00 0.00 41.96 40.99 1zze s TYR 148 CO 0.13 -0.50 0.17 -0.51 -1.34 0.00 0.00 175.55 173.50 1zze s LEU 149 N 1.78 3.94 0.00 6.97 2.01 0.15 -4.96 118.68 128.58 1zze s LEU 149 Ca 0.03 -0.11 0.00 0.00 0.01 0.00 0.00 54.13 54.06 1zze s LEU 149 Cb -0.14 -2.07 0.00 0.00 0.01 0.00 0.00 46.19 43.99 1zze s LEU 149 CO -0.07 -0.07 0.00 -0.90 1.01 0.00 0.00 176.35 176.32 1zze n ASP 150 N 5.03 2.34 0.00 2.29 5.68 -1.26 -0.44 116.55 130.19 1zze n ASP 150 Ca -0.14 -1.58 0.07 0.00 -0.50 0.00 0.00 54.79 52.64 1zze n ASP 150 Cb 0.52 0.09 0.43 0.00 -1.14 0.00 0.00 41.12 41.01 1zze n ASP 150 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1zze n GLU 151 N -0.35 0.40 -0.07 0.11 1.02 -1.26 -1.57 120.64 118.91 1zze n GLU 151 Ca -0.05 0.04 0.08 0.00 -0.02 0.00 0.00 57.16 57.21 1zze n GLU 151 Cb 0.17 -1.50 0.10 0.00 -0.02 0.00 0.00 31.44 30.19 1zze n GLU 151 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1zze n LYS 152 N -1.08 1.59 -2.76 3.49 5.02 -1.26 -4.93 118.16 118.22 1zze n LYS 152 Ca 0.10 -1.64 -0.42 0.00 -2.02 0.00 0.00 58.31 54.33 1zze n LYS 152 Cb 0.07 -1.31 -0.03 0.00 -0.02 0.00 0.00 35.03 33.74 1zze n LYS 152 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1zze s SER 153 N -1.19 7.07 0.04 4.39 0.01 -0.61 -5.04 113.70 118.36 1zze s SER 153 Ca 0.22 1.32 0.06 0.00 1.31 0.00 0.00 55.95 58.86 1zze s SER 153 Cb 0.14 -2.51 -0.02 0.00 0.21 0.00 0.00 66.02 63.84 1zze s SER 153 CO 0.20 -0.51 -0.18 0.26 0.41 0.00 0.00 173.24 173.42 1zze s TRP 154 N 2.53 1.55 -1.42 2.43 0.52 -1.26 -4.38 118.94 118.90 1zze s TRP 154 Ca 0.42 -0.36 -0.12 0.00 0.02 0.00 0.00 56.10 56.06 1zze s TRP 154 Cb -0.16 -0.92 0.06 0.00 -1.15 0.00 0.00 33.47 31.30 1zze s TRP 154 CO 0.11 0.06 2.20 -1.71 0.02 0.00 0.00 176.95 177.64 1zze n ASN 155 N 1.90 4.68 -0.06 2.95 2.85 -0.10 -4.70 115.26 122.78 1zze n ASN 155 Ca -0.17 -2.90 -0.00 0.00 -0.11 0.00 0.00 54.58 51.40 1zze n ASN 155 Cb 0.54 -1.60 0.29 0.00 1.24 0.00 0.00 39.78 40.25 1zze n ASN 155 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1zze h LEU 156 N 9.09 0.61 -0.89 1.20 -0.00 -1.88 -2.74 115.31 120.69 1zze h LEU 156 Ca 0.55 -0.08 0.19 0.00 -0.00 0.00 0.00 57.88 58.55 1zze h LEU 156 Cb 0.60 -0.16 -0.11 0.00 -0.00 0.00 0.00 40.66 40.99 1zze h LEU 156 CO 1.80 0.58 0.43 -0.08 -0.00 0.00 0.00 178.44 181.18 1zze h GLU 157 N 0.65 0.50 -0.41 1.13 4.81 -1.96 -2.05 114.58 117.24 1zze h GLU 157 Ca 0.15 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.36 1zze h GLU 157 Cb 0.19 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1zze h GLU 157 CO -0.01 0.33 0.26 0.66 -0.73 0.00 0.00 179.01 179.52 1zze h SER 158 N 0.51 0.44 -0.45 1.04 4.64 -1.83 -1.89 113.55 116.01 1zze h SER 158 Ca 0.53 -0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.93 1zze h SER 158 Cb 0.92 -0.10 -0.07 0.00 -0.31 0.00 0.00 62.40 62.83 1zze h SER 158 CO -0.46 0.32 -0.00 0.40 -0.87 0.00 0.00 176.83 176.21 1zze h ILE 159 N 0.53 0.65 0.00 0.95 1.08 -1.48 0.28 117.51 119.53 1zze h ILE 159 Ca 0.16 -0.04 -0.00 0.00 -0.39 0.00 0.00 64.86 64.59 1zze h ILE 159 Cb -0.03 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 34.26 1zze h ILE 159 CO -0.05 0.02 -0.00 -0.78 -0.69 0.00 0.00 178.15 176.64 1zze h ASP 160 N 0.11 -0.00 -0.75 1.72 3.58 -1.57 -3.28 116.42 116.22 1zze h ASP 160 Ca 0.22 -0.76 0.05 0.00 0.42 0.00 0.00 57.03 56.96 1zze h ASP 160 Cb 0.33 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.32 1zze h ASP 160 CO -0.37 0.76 0.45 0.11 -2.88 0.00 0.00 179.24 177.31 1zze h LYS 161 N -0.77 0.83 -0.42 0.28 1.57 -1.25 -1.44 116.57 115.37 1zze h LYS 161 Ca -0.00 -0.05 0.12 0.00 -1.87 0.00 0.00 60.65 58.85 1zze h LYS 161 Cb 0.76 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.87 1zze h LYS 161 CO 0.00 0.55 0.35 0.00 -0.57 0.00 0.00 179.45 179.78 1zze h ALA 162 N 1.35 2.26 0.10 3.86 0.00 -0.54 -1.19 119.26 125.10 1zze h ALA 162 Ca 0.32 -0.01 -0.36 0.00 0.00 0.00 0.00 54.91 54.85 1zze h ALA 162 Cb 0.11 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1zze h ALA 162 CO -0.15 -0.56 -2.05 1.63 0.00 0.00 0.00 179.25 178.12 1zze n LYS 163 N -4.12 0.73 0.06 0.00 5.02 -0.63 -4.54 118.16 114.68 1zze n LYS 163 Ca 0.07 0.26 -0.07 0.00 -2.02 0.00 0.00 58.31 56.55 1zze n LYS 163 Cb 0.54 -1.68 -0.11 0.00 -0.02 0.00 0.00 35.03 33.76 1zze n LYS 163 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 1zze h THR 164 N -0.00 1.70 -3.83 -0.18 1.35 -0.98 -3.47 112.91 107.50 1zze h THR 164 Ca -0.45 -3.37 -0.55 0.00 -0.55 0.00 0.00 66.41 61.49 1zze h THR 164 Cb 1.97 2.83 0.12 0.00 -1.73 0.00 0.00 68.15 71.34 1zze h THR 164 CO 0.04 0.96 0.67 0.18 -0.25 0.00 0.00 175.52 177.12 1zze n LEU 165 N -3.37 4.74 -4.70 3.87 4.77 -0.48 -4.92 117.00 116.90 1zze n LEU 165 Ca -0.00 1.15 -0.39 0.00 -0.03 0.00 0.00 56.01 56.74 1zze n LEU 165 Cb 0.93 -1.58 0.04 0.00 -2.33 0.00 0.00 43.42 40.48 1zze n LEU 165 CO 0.47 -0.19 0.85 -2.65 -1.33 0.00 0.00 177.39 174.55 1zze n PRO 166 N 0.06 1.46 0.11 3.23 -0.02 -1.26 -4.86 135.00 133.71 1zze n PRO 166 Ca 0.04 0.54 0.12 0.00 -2.02 0.00 0.00 63.50 62.18 1zze n PRO 166 Cb 0.40 -2.44 0.61 0.00 -0.02 0.00 0.00 33.50 32.06 1zze n PRO 166 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1zze h GLU 167 N 1.19 0.11 -0.36 -0.52 4.81 -1.93 -0.97 114.58 116.91 1zze h GLU 167 Ca -0.50 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1zze h GLU 167 Cb 1.32 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1zze h GLU 167 CO 0.55 0.07 0.00 0.43 -0.73 0.00 0.00 179.01 179.34 1zze n SER 168 N -4.48 2.85 -4.74 1.04 7.64 -1.26 -4.89 113.62 109.79 1zze n SER 168 Ca 0.03 -1.91 -0.41 0.00 1.01 0.00 0.00 58.87 57.59 1zze n SER 168 Cb 0.28 -0.23 0.01 0.00 -1.01 0.00 0.00 64.21 63.26 1zze n SER 168 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1zze n ASP 169 N 1.09 3.08 0.30 6.43 -0.08 -0.37 -4.88 116.55 122.12 1zze n ASP 169 Ca 0.18 1.14 0.16 0.00 -1.51 0.00 0.00 54.79 54.76 1zze n ASP 169 Cb 0.50 -1.56 0.94 0.00 2.34 0.00 0.00 41.12 43.34 1zze n ASP 169 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1zze h PRO 170 N 2.36 0.00 -0.28 -0.67 0.13 -1.93 -2.43 132.00 129.19 1zze h PRO 170 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1zze h PRO 170 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1zze h PRO 170 CO 0.61 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.43 1zze n GLN 171 N -3.77 2.18 -0.03 0.86 6.02 -1.26 -4.63 117.38 116.76 1zze n GLN 171 Ca -0.03 -1.87 -0.08 0.00 -0.01 0.00 0.00 57.00 55.01 1zze n GLN 171 Cb 0.09 -1.30 -0.02 0.00 1.02 0.00 0.00 30.24 30.03 1zze n GLN 171 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 1zze h LYS 172 N 2.46 -0.12 -0.51 -1.09 1.63 -1.72 -1.76 116.57 115.46 1zze h LYS 172 Ca 0.00 0.01 0.07 0.00 -0.85 0.00 0.00 60.65 59.88 1zze h LYS 172 Cb 0.70 0.03 -0.06 0.00 -0.60 0.00 0.00 32.23 32.30 1zze h LYS 172 CO 0.00 -0.08 0.17 1.03 -3.45 0.00 0.00 179.45 177.12 1zze h SER 173 N -0.12 0.16 -0.18 4.20 0.87 -1.82 -0.43 113.55 116.23 1zze h SER 173 Ca 0.11 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 1zze h SER 173 Cb 0.28 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 1zze h SER 173 CO -0.26 0.12 0.12 0.25 -0.53 0.00 0.00 176.83 176.52 1zze h LEU 174 N 0.34 0.21 -0.59 2.23 5.85 -1.76 -2.01 115.31 119.58 1zze h LEU 174 Ca 0.25 -0.02 -0.13 0.00 0.84 0.00 0.00 57.88 58.82 1zze h LEU 174 Cb 0.28 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1zze h LEU 174 CO -0.26 0.17 -0.24 -0.50 -0.34 0.00 0.00 178.44 177.27 1zze h TRP 175 N 0.23 1.00 -0.85 1.25 4.06 -1.01 -0.91 115.95 119.72 1zze h TRP 175 Ca 0.07 -0.24 -0.03 0.00 2.06 0.00 0.00 58.89 60.75 1zze h TRP 175 Cb -0.01 -0.23 -0.04 0.00 -1.00 0.00 0.00 29.16 27.88 1zze h TRP 175 CO -0.06 1.02 0.43 0.28 -3.56 0.00 0.00 178.44 176.55 1zze h VAL 176 N 0.75 1.26 -0.32 1.49 2.07 -1.00 0.71 116.25 121.21 1zze h VAL 176 Ca 0.10 -0.69 -0.07 0.00 0.82 0.00 0.00 66.70 66.86 1zze h VAL 176 Cb 0.79 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1zze h VAL 176 CO 0.07 0.30 -0.06 0.22 0.02 0.00 0.00 177.57 178.11 1zze h TYR 177 N 1.21 0.68 -0.80 1.57 5.03 -1.13 -1.35 116.97 122.17 1zze h TYR 177 Ca 0.30 -0.14 -0.01 0.00 2.58 0.00 0.00 58.73 61.46 1zze h TYR 177 Cb 0.08 -0.17 -0.04 0.00 1.55 0.00 0.00 36.73 38.16 1zze h TYR 177 CO 0.01 0.77 0.46 0.00 -1.32 0.00 0.00 178.16 178.09 1zze h ALA 178 N 0.81 1.03 -0.78 1.82 0.00 -0.74 -1.75 119.26 119.64 1zze h ALA 178 Ca 0.08 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1zze h ALA 178 Cb 0.55 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1zze h ALA 178 CO 0.03 0.51 0.31 0.00 0.00 0.00 0.00 179.25 180.10 1zze h ALA 179 N 1.25 1.02 -0.58 0.00 0.00 -0.71 -0.43 119.26 119.80 1zze h ALA 179 Ca 0.29 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1zze h ALA 179 Cb -0.01 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 1zze h ALA 179 CO -0.05 0.65 0.25 0.66 0.00 0.00 0.00 179.25 180.76 1zze h SER 180 N 1.14 0.78 -0.37 0.00 4.64 -0.68 0.13 113.55 119.19 1zze h SER 180 Ca 0.26 -0.15 -0.15 0.00 -0.47 0.00 0.00 61.79 61.28 1zze h SER 180 Cb 0.22 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1zze h SER 180 CO -0.02 0.72 -0.32 0.11 -0.87 0.00 0.00 176.83 176.45 1zze h LYS 181 N 0.79 0.91 -0.09 4.77 1.79 -1.08 -0.36 116.57 123.30 1zze h LYS 181 Ca 0.20 -0.44 -0.01 0.00 -2.18 0.00 0.00 60.65 58.22 1zze h LYS 181 Cb 0.17 -0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.81 1zze h LYS 181 CO -0.02 1.09 0.01 1.15 -1.08 0.00 0.00 179.45 180.60 1zze h THR 182 N 0.76 1.22 -0.56 -0.16 2.02 -0.85 -1.90 112.91 113.44 1zze h THR 182 Ca 0.08 -0.67 -0.08 0.00 0.77 0.00 0.00 66.41 66.51 1zze h THR 182 Cb 0.90 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.79 1zze h THR 182 CO 0.08 0.19 0.05 -0.33 0.37 0.00 0.00 175.52 175.88 1zze h GLU 183 N -0.10 0.92 -0.37 6.66 4.39 -0.72 -1.31 114.58 124.07 1zze h GLU 183 Ca 0.03 -0.25 -0.03 0.00 0.34 0.00 0.00 59.36 59.45 1zze h GLU 183 Cb 0.29 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.81 1zze h GLU 183 CO 0.00 0.89 0.12 0.00 -1.16 0.00 0.00 179.01 178.86 1zze h ALA 184 N 1.18 0.48 -0.25 3.43 0.00 -1.00 -0.72 119.26 122.39 1zze h ALA 184 Ca 0.17 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 1zze h ALA 184 Cb 0.44 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1zze h ALA 184 CO 0.02 0.12 -0.47 1.49 0.00 0.00 0.00 179.25 180.41 1zze h GLU 185 N 0.44 0.64 -0.65 0.00 4.81 -1.21 -2.11 114.58 116.50 1zze h GLU 185 Ca 0.12 -0.36 -0.02 0.00 -0.13 0.00 0.00 59.36 58.97 1zze h GLU 185 Cb 0.25 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 1zze h GLU 185 CO -0.00 0.97 0.33 -0.07 -0.73 0.00 0.00 179.01 179.51 1zze h LEU 186 N 0.51 0.83 -1.27 1.64 3.38 -1.10 -2.06 115.31 117.25 1zze h LEU 186 Ca 0.03 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1zze h LEU 186 Cb 1.01 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 1zze h LEU 186 CO 0.09 0.71 0.28 0.00 0.09 0.00 0.00 178.44 179.61 1zze h ALA 187 N 1.16 1.43 -0.10 1.53 0.00 -0.93 -0.36 119.26 122.00 1zze h ALA 187 Ca 0.23 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1zze h ALA 187 Cb 0.08 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1zze h ALA 187 CO -0.03 0.45 0.03 0.00 0.00 0.00 0.00 179.25 179.70 1zze h ALA 188 N 1.52 0.13 -0.32 0.00 0.00 -0.75 -0.53 119.26 119.32 1zze h ALA 188 Ca 0.20 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1zze h ALA 188 Cb 0.07 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1zze h ALA 188 CO -0.03 -0.25 -0.19 -1.49 0.00 0.00 0.00 179.25 177.30 1zze h TRP 189 N -0.04 0.65 -0.66 0.00 4.06 -1.14 -2.36 115.95 116.47 1zze h TRP 189 Ca 0.03 -0.13 -0.08 0.00 2.06 0.00 0.00 58.89 60.78 1zze h TRP 189 Cb 0.24 -0.16 -0.03 0.00 -1.00 0.00 0.00 29.16 28.20 1zze h TRP 189 CO 0.00 0.74 0.10 -0.22 -3.56 0.00 0.00 178.44 175.50 1zze h LYS 190 N 0.53 1.09 -0.76 0.49 3.64 -0.91 -1.49 116.57 119.15 1zze h LYS 190 Ca 0.08 -0.29 -0.01 0.00 -1.27 0.00 0.00 60.65 59.16 1zze h LYS 190 Cb 0.62 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 1zze h LYS 190 CO 0.04 1.00 0.42 0.35 -2.27 0.00 0.00 179.45 179.00 1zze h PHE 191 N 1.01 1.04 -0.53 1.91 3.04 -0.79 0.73 116.94 123.35 1zze h PHE 191 Ca 0.20 -0.02 -0.06 0.00 3.98 0.00 0.00 57.97 62.07 1zze h PHE 191 Cb 0.45 -0.33 -0.02 0.00 2.56 0.00 0.00 35.95 38.60 1zze h PHE 191 CO 0.03 0.72 0.11 0.52 -2.02 0.00 0.00 178.31 177.68 1zze h MET 192 N 1.05 0.87 -0.23 1.11 2.86 -1.07 0.05 114.93 119.57 1zze h MET 192 Ca 0.27 -0.22 -0.19 0.00 -2.06 0.00 0.00 59.70 57.50 1zze h MET 192 Cb 0.02 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.58 1zze h MET 192 CO -0.04 0.83 -0.60 0.22 1.06 0.00 0.00 176.91 178.38 1zze h ASP 193 N 0.76 0.85 0.53 1.22 3.58 -0.93 -1.48 116.42 120.94 1zze h ASP 193 Ca 0.17 -0.48 -0.29 0.00 0.42 0.00 0.00 57.03 56.85 1zze h ASP 193 Cb 0.37 -0.25 -0.04 0.00 1.72 0.00 0.00 39.33 41.13 1zze h ASP 193 CO 0.01 1.25 -1.63 -0.33 -2.88 0.00 0.00 179.24 175.66 1zze h GLU 194 N 0.57 0.03 -0.01 0.28 5.08 -0.85 -3.37 114.58 116.30 1zze h GLU 194 Ca -0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1zze h GLU 194 Cb 1.19 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1zze h GLU 194 CO 0.12 0.63 -0.45 0.09 -1.00 0.00 0.00 179.01 178.41 1zze n ASN 195 N -3.13 1.36 -3.20 1.42 3.02 -0.00 -5.04 115.26 109.68 1zze n ASN 195 Ca -0.16 -1.18 -0.14 0.00 -0.03 0.00 0.00 54.58 53.08 1zze n ASN 195 Cb 1.04 0.63 0.00 0.00 -0.61 0.00 0.00 39.78 40.84 1zze n ASN 195 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1zze n LYS 196 N -0.49 -0.84 -1.29 3.52 5.02 -0.56 -4.93 118.16 118.59 1zze n LYS 196 Ca 0.06 0.40 -0.29 0.00 -2.02 0.00 0.00 58.31 56.46 1zze n LYS 196 Cb 0.31 -1.20 0.19 0.00 -0.02 0.00 0.00 35.03 34.31 1zze n LYS 196 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1zze s PRO 197 N -3.60 0.00 0.43 1.97 0.04 -1.26 -4.97 135.00 127.60 1zze s PRO 197 Ca 0.00 0.17 0.23 0.00 0.04 0.00 0.00 61.00 61.44 1zze s PRO 197 Cb -0.00 -1.72 0.40 0.00 0.04 0.00 0.00 34.50 33.22 1zze s PRO 197 CO 0.49 -2.94 1.62 1.25 0.04 0.00 0.00 177.00 177.46 1zze h HIS 198 N -2.03 0.00 -3.54 0.56 2.76 -1.92 -3.46 115.15 107.52 1zze h HIS 198 Ca -0.50 0.00 -0.46 0.00 -2.20 0.00 0.00 60.37 57.21 1zze h HIS 198 Cb 1.31 0.00 0.06 0.00 1.55 0.00 0.00 27.41 30.34 1zze h HIS 198 CO -0.67 0.08 0.17 -0.59 -1.30 0.00 0.00 177.93 175.62 1zze s PHE 199 N -3.22 3.04 -0.14 5.26 -0.12 -1.26 -5.00 117.98 116.53 1zze s PHE 199 Ca 0.06 0.45 -0.06 0.00 -0.05 0.00 0.00 56.93 57.34 1zze s PHE 199 Cb 0.06 -2.95 -0.04 0.00 -0.63 0.00 0.00 43.02 39.46 1zze s PHE 199 CO 0.67 -1.10 0.05 0.99 -0.05 0.00 0.00 175.22 175.78 1zze s THR 200 N -3.07 4.71 -0.03 -4.49 2.01 -0.67 -4.99 115.64 109.11 1zze s THR 200 Ca 0.57 -0.08 0.01 0.00 0.31 0.00 0.00 61.69 62.51 1zze s THR 200 Cb -0.11 -3.07 -0.03 0.00 0.01 0.00 0.00 72.50 69.30 1zze s THR 200 CO 0.44 0.53 -0.02 -0.22 -0.69 0.00 0.00 174.62 174.65 1zze s LEU 201 N -0.19 3.41 0.03 4.42 2.96 -1.26 -1.23 118.68 126.82 1zze s LEU 201 Ca 0.07 -0.01 -0.02 0.00 -0.22 0.00 0.00 54.13 53.96 1zze s LEU 201 Cb -0.12 -1.89 -0.02 0.00 0.50 0.00 0.00 46.19 44.65 1zze s LEU 201 CO 0.01 0.31 -0.00 0.20 -1.32 0.00 0.00 176.35 175.55 1zze s ASN 202 N -1.30 0.31 -0.01 3.68 0.01 -0.79 -1.52 114.94 115.31 1zze s ASN 202 Ca 0.17 -0.67 0.03 0.00 -0.71 0.00 0.00 52.86 51.68 1zze s ASN 202 Cb -0.11 0.16 -0.00 0.00 0.41 0.00 0.00 41.25 41.70 1zze s ASN 202 CO 0.07 -0.44 -0.09 0.00 -1.51 0.00 0.00 177.10 175.12 1zze s ALA 203 N -2.51 0.82 -0.16 0.60 0.00 -0.13 -1.03 121.76 119.35 1zze s ALA 203 Ca -0.06 -0.39 -0.05 0.00 0.00 0.00 0.00 51.96 51.47 1zze s ALA 203 Cb -0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 1zze s ALA 203 CO -0.05 0.18 -0.01 0.08 0.00 0.00 0.00 175.76 175.96 1zze s VAL 204 N -0.08 4.15 -0.54 0.00 1.01 -0.36 0.40 120.40 124.98 1zze s VAL 204 Ca 0.01 -0.27 0.02 0.00 0.00 0.00 0.00 61.98 61.75 1zze s VAL 204 Cb -0.05 -2.83 0.14 0.00 0.00 0.00 0.00 36.38 33.63 1zze s VAL 204 CO -0.00 0.49 0.30 -0.76 0.00 0.00 0.00 175.10 175.13 1zze s LEU 205 N 0.29 4.57 0.52 3.92 1.02 0.16 -0.49 118.68 128.66 1zze s LEU 205 Ca -0.01 -2.95 -0.18 0.00 0.02 0.00 0.00 54.13 51.01 1zze s LEU 205 Cb -0.14 -1.70 -0.07 0.00 0.02 0.00 0.00 46.19 44.31 1zze s LEU 205 CO 0.02 -0.27 1.02 -2.84 0.02 0.00 0.00 176.35 174.30 1zze s PRO 206 N -0.20 3.74 0.00 1.29 0.02 -1.26 -0.25 135.00 138.34 1zze s PRO 206 Ca 0.17 1.16 0.00 0.00 0.02 0.00 0.00 61.00 62.35 1zze s PRO 206 Cb -0.24 -2.10 0.00 0.00 0.02 0.00 0.00 34.50 32.18 1zze s PRO 206 CO -0.01 -0.45 0.00 -1.71 -0.33 0.00 0.00 177.00 174.49 1zze n ASN 207 N -1.44 0.00 -4.47 2.53 4.05 -0.70 -1.94 115.26 113.29 1zze n ASN 207 Ca 0.08 0.00 -0.43 0.00 0.45 0.00 0.00 54.58 54.68 1zze n ASN 207 Cb 0.53 0.00 -0.05 0.00 1.23 0.00 0.00 39.78 41.49 1zze n ASN 207 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 1zze s TYR 208 N 2.93 2.88 -0.13 1.20 5.04 -0.58 -4.92 117.35 123.77 1zze s TYR 208 Ca 0.00 -0.39 -0.28 0.00 -2.44 0.00 0.00 57.07 53.96 1zze s TYR 208 Cb 0.00 -3.92 -0.01 0.00 0.35 0.00 0.00 41.96 38.37 1zze s TYR 208 CO 0.00 -1.30 0.95 0.99 -1.34 0.00 0.00 175.55 174.85 1zze s THR 209 N 3.39 4.82 -0.17 4.34 2.01 -1.26 -1.36 115.64 127.41 1zze s THR 209 Ca 0.22 1.91 0.01 0.00 0.31 0.00 0.00 61.69 64.13 1zze s THR 209 Cb -0.17 -4.26 0.01 0.00 0.01 0.00 0.00 72.50 68.10 1zze s THR 209 CO 0.14 0.01 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.26 1zze s ILE 210 N 2.05 2.26 -0.06 1.82 1.01 -0.12 -3.55 121.20 124.61 1zze s ILE 210 Ca 0.45 -0.89 -0.30 0.00 0.00 0.00 0.00 60.65 59.91 1zze s ILE 210 Cb -0.18 -1.94 0.10 0.00 0.01 0.00 0.00 42.46 40.45 1zze s ILE 210 CO 0.16 0.53 1.34 -0.83 0.00 0.00 0.00 174.94 176.14 1zze s GLY 211 N 1.07 -0.19 0.19 6.18 0.00 -1.26 -1.41 107.32 111.91 1zze s GLY 211 Ca -0.01 0.13 -0.33 0.00 0.00 0.00 0.00 44.72 44.52 1zze s GLY 211 CO -0.07 6.18 1.63 2.41 0.00 0.00 0.00 173.10 183.25 1zze n THR 212 N -0.94 0.10 -3.10 0.90 -1.04 -1.22 -4.25 114.28 104.74 1zze n THR 212 Ca 0.05 -0.03 -0.44 0.00 -2.04 0.00 0.00 64.05 61.59 1zze n THR 212 Cb 0.58 -1.73 -0.05 0.00 -1.82 0.00 0.00 70.33 67.32 1zze n THR 212 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1zze s ILE 213 N 0.91 4.78 0.24 12.58 1.01 -1.26 -4.93 121.20 134.53 1zze s ILE 213 Ca 0.76 -0.60 -0.04 0.00 0.00 0.00 0.00 60.65 60.77 1zze s ILE 213 Cb -0.60 -4.41 0.21 0.00 0.01 0.00 0.00 42.46 37.67 1zze s ILE 213 CO 0.37 -0.99 1.79 -0.26 0.00 0.00 0.00 174.94 175.85 1zze h PHE 214 N 9.13 0.77 -2.77 3.97 0.05 -1.95 -3.35 116.94 122.78 1zze h PHE 214 Ca -0.28 0.03 -0.60 0.00 3.82 0.00 0.00 57.97 60.94 1zze h PHE 214 Cb 1.09 -0.22 -0.40 0.00 2.00 0.00 0.00 35.95 38.42 1zze h PHE 214 CO 0.81 0.27 -0.80 0.34 -0.18 0.00 0.00 178.31 178.75 1zze s ASP 215 N -5.53 3.20 0.46 2.17 -1.08 -1.26 -4.98 116.67 109.65 1zze s ASP 215 Ca -0.12 -2.56 0.21 0.00 -0.52 0.00 0.00 52.55 49.55 1zze s ASP 215 Cb 0.20 -0.76 1.20 0.00 -1.46 0.00 0.00 42.92 42.10 1zze s ASP 215 CO 0.78 -0.26 1.88 -0.65 0.52 0.00 0.00 175.17 177.44 1zze h PRO 216 N 6.66 0.27 -0.76 4.34 0.11 -1.92 -0.60 132.00 140.08 1zze h PRO 216 Ca 0.05 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 66.23 1zze h PRO 216 Cb 0.93 -0.06 -0.07 0.00 0.11 0.00 0.00 31.00 31.92 1zze h PRO 216 CO 0.40 0.18 0.43 1.49 -0.21 0.00 0.00 178.00 180.28 1zze h GLU 217 N 0.28 0.72 0.00 1.05 4.81 -1.95 -3.19 114.58 116.29 1zze h GLU 217 Ca 0.43 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.61 1zze h GLU 217 Cb 1.24 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.46 1zze h GLU 217 CO -0.12 0.47 -0.44 0.25 -0.73 0.00 0.00 179.01 178.44 1zze n THR 218 N -4.77 0.00 -0.97 0.32 -2.24 -0.85 -4.70 114.28 101.07 1zze n THR 218 Ca 0.12 -0.31 0.09 0.00 -2.27 0.00 0.00 64.05 61.67 1zze n THR 218 Cb 0.24 0.94 0.24 0.00 -2.10 0.00 0.00 70.33 69.65 1zze n THR 218 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1zze n GLN 219 N -1.23 2.75 0.00 -0.78 6.02 -0.29 -4.64 117.38 119.20 1zze n GLN 219 Ca 0.01 -2.79 0.15 0.00 -0.01 0.00 0.00 57.00 54.36 1zze n GLN 219 Cb 0.12 -1.79 0.81 0.00 1.02 0.00 0.00 30.24 30.41 1zze n GLN 219 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1zze n SER 220 N -0.58 0.00 -0.62 1.08 7.64 -1.21 -2.96 113.62 116.99 1zze n SER 220 Ca 0.20 -0.55 0.11 0.00 1.01 0.00 0.00 58.87 59.65 1zze n SER 220 Cb 0.85 -0.14 0.38 0.00 -1.01 0.00 0.00 64.21 64.29 1zze n SER 220 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1zze n GLY 221 N 1.02 0.40 3.94 0.23 0.00 -1.26 -3.82 105.19 105.70 1zze n GLY 221 Ca 0.18 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 1zze n GLY 221 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zze s SER 222 N -1.68 3.49 0.18 1.61 1.04 -1.15 -4.81 113.70 112.38 1zze s SER 222 Ca 0.34 0.26 -0.14 0.00 0.48 0.00 0.00 55.95 56.89 1zze s SER 222 Cb 0.19 -0.42 0.12 0.00 0.10 0.00 0.00 66.02 66.01 1zze s SER 222 CO 0.29 -2.49 1.79 0.71 0.98 0.00 0.00 173.24 174.51 1zze h THR 223 N -1.40 0.98 0.00 2.02 1.35 -1.90 -0.26 112.91 113.70 1zze h THR 223 Ca -0.44 -0.17 -0.10 0.00 -0.55 0.00 0.00 66.41 65.15 1zze h THR 223 Cb 1.25 0.43 -0.01 0.00 -1.73 0.00 0.00 68.15 68.09 1zze h THR 223 CO 0.42 0.09 -0.46 0.28 -0.25 0.00 0.00 175.52 175.60 1zze h SER 224 N 0.50 0.00 -0.49 5.36 0.02 -1.91 -2.57 113.55 114.46 1zze h SER 224 Ca 0.21 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.10 1zze h SER 224 Cb 0.10 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 1zze h SER 224 CO -0.14 0.46 0.08 1.23 -1.14 0.00 0.00 176.83 177.32 1zze h GLY 225 N 1.55 0.88 1.19 -3.77 0.00 -1.41 -0.84 103.07 100.67 1zze h GLY 225 Ca -0.00 -0.59 -0.07 0.00 0.00 0.00 0.00 47.33 46.66 1zze h GLY 225 CO 0.06 0.55 0.09 1.49 0.00 0.00 0.00 176.54 178.73 1zze h TRP 226 N 0.69 1.04 -0.48 5.60 6.55 -0.90 -2.02 115.95 126.43 1zze h TRP 226 Ca 0.15 -0.13 -0.09 0.00 0.95 0.00 0.00 58.89 59.77 1zze h TRP 226 Cb 0.40 -0.29 -0.02 0.00 -0.86 0.00 0.00 29.16 28.39 1zze h TRP 226 CO 0.03 0.89 -0.05 1.98 -1.05 0.00 0.00 178.44 180.24 1zze h MET 227 N 0.93 0.84 -0.46 0.49 4.05 -1.26 -2.47 114.93 117.05 1zze h MET 227 Ca 0.19 -0.26 -0.06 0.00 -0.28 0.00 0.00 59.70 59.29 1zze h MET 227 Cb 0.41 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.11 1zze h MET 227 CO 0.01 0.87 0.03 1.98 0.23 0.00 0.00 176.91 180.03 1zze h MET 228 N 0.77 0.75 -0.56 0.39 1.85 -0.79 -0.66 114.93 116.69 1zze h MET 228 Ca 0.14 -0.18 -0.06 0.00 -0.61 0.00 0.00 59.70 58.98 1zze h MET 228 Cb 0.53 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 32.44 1zze h MET 228 CO 0.03 0.74 0.10 0.77 -0.40 0.00 0.00 176.91 178.15 1zze h SER 229 N 0.71 0.84 -0.39 1.39 0.02 -0.94 -0.80 113.55 114.37 1zze h SER 229 Ca 0.14 -0.17 -0.06 0.00 -0.84 0.00 0.00 61.79 60.86 1zze h SER 229 Cb 0.40 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 1zze h SER 229 CO 0.01 0.85 0.00 0.25 -1.14 0.00 0.00 176.83 176.80 1zze h LEU 230 N 0.85 0.68 -1.09 5.07 5.85 -1.03 -1.39 115.31 124.25 1zze h LEU 230 Ca 0.18 -0.30 0.12 0.00 0.84 0.00 0.00 57.88 58.71 1zze h LEU 230 Cb 0.37 -0.18 -0.08 0.00 0.37 0.00 0.00 40.66 41.13 1zze h LEU 230 CO 0.01 0.82 0.61 0.15 -0.34 0.00 0.00 178.44 179.69 1zze h PHE 231 N 0.52 1.06 -0.04 1.25 3.57 -0.51 0.52 116.94 123.32 1zze h PHE 231 Ca 0.11 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1zze h PHE 231 Cb 0.47 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 38.87 1zze h PHE 231 CO 0.04 0.43 0.00 0.09 -2.23 0.00 0.00 178.31 176.64 1zze n ASN 232 N -4.59 0.23 0.00 0.41 3.02 -0.36 -4.88 115.26 109.09 1zze n ASN 232 Ca 0.18 -1.91 0.00 0.00 -0.03 0.00 0.00 54.58 52.81 1zze n ASN 232 Cb 0.36 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.50 1zze n ASN 232 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zze n GLY 233 N 0.61 0.29 3.72 7.41 0.00 0.18 -5.06 105.19 112.33 1zze n GLY 233 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1zze n GLY 233 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1zze s GLU 234 N -0.95 4.53 -0.38 1.61 0.41 -0.57 -4.84 118.70 118.52 1zze s GLU 234 Ca 0.00 1.24 -0.04 0.00 -0.41 0.00 0.00 54.97 55.76 1zze s GLU 234 Cb 0.00 -3.44 0.08 0.00 -1.78 0.00 0.00 34.13 28.99 1zze s GLU 234 CO 0.00 0.02 0.15 0.08 -0.49 0.00 0.00 175.26 175.03 1zze s VAL 235 N 0.80 3.40 -0.25 2.63 1.01 -1.26 -3.76 120.40 122.97 1zze s VAL 235 Ca 0.47 -1.70 -0.14 0.00 0.00 0.00 0.00 61.98 60.61 1zze s VAL 235 Cb -0.20 -3.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 1zze s VAL 235 CO 0.25 -0.47 0.31 -0.55 0.00 0.00 0.00 175.10 174.64 1zze s SER 236 N 1.69 6.23 0.33 3.32 0.15 -1.26 -4.97 113.70 119.18 1zze s SER 236 Ca 0.03 0.25 0.06 0.00 0.70 0.00 0.00 55.95 56.99 1zze s SER 236 Cb -0.22 -2.18 0.72 0.00 -1.71 0.00 0.00 66.02 62.64 1zze s SER 236 CO -0.02 -0.09 1.85 -0.65 1.20 0.00 0.00 173.24 175.54 1zze h PRO 237 N 7.90 0.78 -0.52 5.44 0.11 -1.98 0.92 132.00 144.65 1zze h PRO 237 Ca -0.34 -0.05 0.06 0.00 0.11 0.00 0.00 66.00 65.78 1zze h PRO 237 Cb 1.17 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 1zze h PRO 237 CO 0.65 0.51 0.35 0.00 -0.21 0.00 0.00 178.00 179.30 1zze h ALA 238 N 1.58 1.89 0.00 -0.75 0.00 -1.99 0.48 119.26 120.46 1zze h ALA 238 Ca 0.47 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.31 1zze h ALA 238 Cb 0.64 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1zze h ALA 238 CO -0.23 0.03 -0.30 1.25 0.00 0.00 0.00 179.25 180.00 1zze h LEU 239 N 0.47 0.00 -2.18 0.00 6.46 -1.32 -3.35 115.31 115.39 1zze h LEU 239 Ca 0.23 -0.85 0.04 0.00 -0.12 0.00 0.00 57.88 57.18 1zze h LEU 239 Cb 0.29 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.22 1zze h LEU 239 CO -0.06 1.10 0.14 0.00 -0.62 0.00 0.00 178.44 178.99 1zze h ALA 240 N -0.15 1.91 0.00 1.25 0.00 -0.74 -1.30 119.26 120.23 1zze h ALA 240 Ca -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1zze h ALA 240 Cb 1.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1zze h ALA 240 CO -0.05 -0.21 0.00 -0.07 0.00 0.00 0.00 179.25 178.92 1zze h LEU 241 N 0.00 0.00 -9.72 0.00 3.38 -1.04 -3.45 115.31 104.48 1zze h LEU 241 Ca 0.07 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.52 1zze h LEU 241 Cb 0.34 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.15 1zze h LEU 241 CO -0.00 0.00 0.79 -0.04 0.09 0.00 0.00 178.44 179.28 1zze s MET 242 N -3.18 4.24 0.82 1.13 -1.94 -0.49 -4.99 119.30 114.89 1zze s MET 242 Ca 0.09 2.34 -0.12 0.00 -1.71 0.00 0.00 55.69 56.28 1zze s MET 242 Cb 0.11 -3.11 0.08 0.00 2.01 0.00 0.00 34.83 33.92 1zze s MET 242 CO 0.56 -0.48 1.15 -1.25 -0.01 0.00 0.00 175.02 174.99 1zze s PRO 243 N -0.07 1.91 0.57 2.03 0.04 -1.26 -4.91 135.00 133.32 1zze s PRO 243 Ca 0.62 0.26 -0.20 0.00 0.04 0.00 0.00 61.00 61.71 1zze s PRO 243 Cb -0.43 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.14 1zze s PRO 243 CO 0.41 -1.66 1.31 -2.14 0.04 0.00 0.00 177.00 174.96 1zze s PRO 244 N -5.43 3.00 0.00 0.56 0.02 -1.26 -4.96 135.00 126.93 1zze s PRO 244 Ca 0.62 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.74 1zze s PRO 244 Cb -0.12 -2.12 0.00 0.00 0.02 0.00 0.00 34.50 32.28 1zze s PRO 244 CO 0.51 -1.26 0.00 0.00 -0.33 0.00 0.00 177.00 175.92 1zze n GLN 245 N -1.30 0.00 -4.04 5.54 10.64 -0.98 -4.62 117.38 122.64 1zze n GLN 245 Ca 0.12 0.00 -0.33 0.00 -1.83 0.00 0.00 57.00 54.96 1zze n GLN 245 Cb 0.47 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.78 1zze n GLN 245 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 1zze s TYR 246 N -1.91 3.36 0.45 2.61 1.51 -1.26 -0.83 117.35 121.28 1zze s TYR 246 Ca 0.00 0.24 0.07 0.00 -1.01 0.00 0.00 57.07 56.37 1zze s TYR 246 Cb 0.00 -1.76 -0.01 0.00 -0.11 0.00 0.00 41.96 40.08 1zze s TYR 246 CO 0.00 0.58 0.35 1.52 -1.11 0.00 0.00 175.55 176.88 1zze s TYR 247 N -1.25 2.36 -0.28 2.71 1.13 -0.27 -1.53 117.35 120.22 1zze s TYR 247 Ca 0.25 -0.62 -0.24 0.00 -1.41 0.00 0.00 57.07 55.05 1zze s TYR 247 Cb -0.12 -2.05 0.10 0.00 -1.10 0.00 0.00 41.96 38.78 1zze s TYR 247 CO 0.16 -0.17 0.88 0.54 -2.51 0.00 0.00 175.55 174.45 1zze s VAL 248 N -2.59 0.00 0.29 -3.49 0.11 -0.46 -0.94 120.40 113.31 1zze s VAL 248 Ca 0.43 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.19 1zze s VAL 248 Cb -0.01 -1.00 -0.10 0.00 -1.53 0.00 0.00 36.38 33.74 1zze s VAL 248 CO 0.25 0.00 1.29 -0.55 -3.33 0.00 0.00 175.10 172.76 1zze s SER 249 N 0.45 6.86 0.36 3.54 0.15 -1.26 -0.94 113.70 122.86 1zze s SER 249 Ca 0.00 2.57 0.05 0.00 0.70 0.00 0.00 55.95 59.28 1zze s SER 249 Cb -0.05 -2.64 0.73 0.00 -1.71 0.00 0.00 66.02 62.36 1zze s SER 249 CO -0.05 -0.49 1.97 0.00 1.20 0.00 0.00 173.24 175.87 1zze h ALA 250 N 4.02 1.68 -0.32 5.45 0.00 -1.57 0.02 119.26 128.54 1zze h ALA 250 Ca -0.47 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.39 1zze h ALA 250 Cb 1.22 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1zze h ALA 250 CO 0.69 0.22 0.10 0.28 0.00 0.00 0.00 179.25 180.54 1zze h VAL 251 N 0.76 1.20 -0.43 0.00 2.07 -1.91 -1.90 116.25 116.04 1zze h VAL 251 Ca 0.30 -0.64 -0.07 0.00 0.82 0.00 0.00 66.70 67.10 1zze h VAL 251 Cb 0.20 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 1zze h VAL 251 CO -0.09 0.22 -0.01 0.44 0.02 0.00 0.00 177.57 178.14 1zze h ASP 252 N 0.36 0.67 -0.55 0.57 3.32 -1.62 -1.74 116.42 117.44 1zze h ASP 252 Ca 0.10 -0.16 -0.07 0.00 0.02 0.00 0.00 57.03 56.93 1zze h ASP 252 Cb 0.24 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 1zze h ASP 252 CO -0.00 0.75 0.11 0.40 -1.72 0.00 0.00 179.24 178.77 1zze h ILE 253 N 0.66 1.25 -0.67 0.35 1.08 -0.82 0.49 117.51 119.84 1zze h ILE 253 Ca 0.13 -0.94 -0.07 0.00 -0.39 0.00 0.00 64.86 63.59 1zze h ILE 253 Cb 0.43 0.68 -0.03 0.00 -3.07 0.00 0.00 36.82 34.83 1zze h ILE 253 CO 0.02 0.35 0.16 1.23 -0.69 0.00 0.00 178.15 179.22 1zze h GLY 254 N 1.02 1.15 1.40 5.37 0.00 -0.88 -2.30 103.07 108.83 1zze h GLY 254 Ca 0.19 -0.73 -0.08 0.00 0.00 0.00 0.00 47.33 46.70 1zze h GLY 254 CO 0.01 0.68 -0.08 1.41 0.00 0.00 0.00 176.54 178.55 1zze h LEU 255 N 1.00 0.70 -0.62 3.11 3.38 -0.74 -1.72 115.31 120.42 1zze h LEU 255 Ca 0.21 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1zze h LEU 255 Cb 0.37 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1zze h LEU 255 CO 0.00 0.82 0.14 -0.07 0.09 0.00 0.00 178.44 179.43 1zze h LEU 256 N 0.66 0.94 -0.56 1.67 3.38 -0.59 0.73 115.31 121.54 1zze h LEU 256 Ca 0.12 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 1zze h LEU 256 Cb 0.53 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1zze h LEU 256 CO 0.03 0.93 0.08 0.45 0.09 0.00 0.00 178.44 180.02 1zze h HIS 257 N 0.91 0.99 -0.56 1.13 3.86 -1.21 -1.43 115.15 118.84 1zze h HIS 257 Ca 0.19 -0.14 -0.00 0.00 -1.16 0.00 0.00 60.37 59.26 1zze h HIS 257 Cb 0.36 -0.27 -0.03 0.00 1.06 0.00 0.00 27.41 28.54 1zze h HIS 257 CO 0.03 0.88 0.35 1.25 0.86 0.00 0.00 177.93 181.29 1zze h LEU 258 N 0.82 0.67 -0.88 2.43 5.85 -1.01 -1.66 115.31 121.52 1zze h LEU 258 Ca 0.17 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.85 1zze h LEU 258 Cb 0.43 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 1zze h LEU 258 CO 0.01 0.52 0.58 1.23 -0.34 0.00 0.00 178.44 180.44 1zze h GLY 259 N 0.76 1.24 2.00 3.75 0.00 -0.50 -1.15 103.07 109.16 1zze h GLY 259 Ca 0.20 -0.46 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 1zze h GLY 259 CO -0.04 0.44 -0.21 0.00 0.00 0.00 0.00 176.54 176.74 1zze h LEU 261 N 0.00 0.00 0.00 0.00 3.38 -0.38 -3.43 115.31 114.88 1zze h LEU 261 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1zze h LEU 261 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1zze h LEU 261 CO 0.03 0.82 -0.21 1.33 0.09 0.00 0.00 178.44 180.50 1zze n VAL 262 N -3.10 0.00 -2.92 1.22 0.24 -0.52 -4.46 118.33 108.79 1zze n VAL 262 Ca -0.08 -0.28 -0.41 0.00 -2.04 0.00 0.00 64.34 61.53 1zze n VAL 262 Cb 0.93 0.83 -0.04 0.00 -1.47 0.00 0.00 33.84 34.09 1zze n VAL 262 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1zze s LEU 263 N -1.73 4.22 0.38 1.34 1.43 -0.24 -0.23 118.68 123.85 1zze s LEU 263 Ca 0.00 1.20 0.05 0.00 -1.03 0.00 0.00 54.13 54.36 1zze s LEU 263 Cb 0.00 -3.21 0.75 0.00 0.03 0.00 0.00 46.19 43.75 1zze s LEU 263 CO 0.00 -0.32 2.00 1.55 0.23 0.00 0.00 176.35 179.80 1zze h PRO 264 N 7.17 0.58 0.00 1.29 0.13 -1.88 -2.81 132.00 136.48 1zze h PRO 264 Ca -0.33 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1zze h PRO 264 Cb 1.15 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1zze h PRO 264 CO 0.81 0.45 0.00 0.00 -0.23 0.00 0.00 178.00 179.03 1zze n GLN 265 N -4.41 0.91 -3.73 0.86 0.00 -1.26 -4.62 117.38 105.13 1zze n GLN 265 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 57.00 56.66 1zze n GLN 265 Cb 0.11 -1.50 -0.11 0.00 0.00 0.00 0.00 30.24 28.74 1zze n GLN 265 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1zze s ILE 266 N -2.02 3.59 -0.01 -0.39 -1.09 -1.06 -5.06 121.20 115.15 1zze s ILE 266 Ca 0.44 -1.74 -0.00 0.00 -2.23 0.00 0.00 60.65 57.12 1zze s ILE 266 Cb 0.20 -3.31 0.02 0.00 -1.58 0.00 0.00 42.46 37.79 1zze s ILE 266 CO 0.35 -0.56 0.02 -1.61 -1.23 0.00 0.00 174.94 171.91 1zze s GLU 267 N 1.26 -0.02 -1.42 2.79 2.02 -1.26 -4.89 118.70 117.18 1zze s GLU 267 Ca 0.04 0.10 -0.07 0.00 0.02 0.00 0.00 54.97 55.06 1zze s GLU 267 Cb -0.23 -0.12 0.04 0.00 0.10 0.00 0.00 34.13 33.92 1zze s GLU 267 CO -0.02 -0.09 0.87 0.54 0.02 0.00 0.00 175.26 176.59 1zze n ARG 268 N 3.63 -5.43 -4.25 1.61 1.74 -0.58 -4.99 116.66 108.39 1zze n ARG 268 Ca -0.20 0.63 -0.26 0.00 -0.77 0.00 0.00 57.85 57.25 1zze n ARG 268 Cb 0.55 -5.38 -0.08 0.00 -1.02 0.00 0.00 32.46 26.53 1zze n ARG 268 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1zze s ARG 269 N -6.30 2.24 -0.36 5.56 1.81 -1.26 -5.01 118.95 115.64 1zze s ARG 269 Ca 0.35 -1.22 -0.04 0.00 -1.72 0.00 0.00 55.73 53.10 1zze s ARG 269 Cb -0.18 -2.24 0.07 0.00 -0.45 0.00 0.00 34.95 32.15 1zze s ARG 269 CO 0.81 0.43 0.13 1.03 -0.68 0.00 0.00 175.30 177.03 1zze s ARG 270 N -3.01 2.35 -0.44 3.54 0.52 -1.26 -0.96 118.95 119.69 1zze s ARG 270 Ca 0.27 -1.47 -0.19 0.00 -0.52 0.00 0.00 55.73 53.82 1zze s ARG 270 Cb -0.09 -3.47 0.03 0.00 0.52 0.00 0.00 34.95 31.94 1zze s ARG 270 CO 0.17 -0.84 0.53 0.08 0.02 0.00 0.00 175.30 175.27 1zze s VAL 271 N 1.27 4.97 -0.08 3.52 1.01 0.16 -4.82 120.40 126.44 1zze s VAL 271 Ca 0.01 -0.24 -0.30 0.00 0.00 0.00 0.00 61.98 61.46 1zze s VAL 271 Cb -0.21 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.01 1zze s VAL 271 CO -0.01 -0.54 1.15 -0.31 0.00 0.00 0.00 175.10 175.39 1zze s TYR 272 N 2.42 3.25 -1.13 5.22 2.02 -1.26 0.36 117.35 128.22 1zze s TYR 272 Ca 0.16 1.30 -0.08 0.00 -0.37 0.00 0.00 57.07 58.07 1zze s TYR 272 Cb -0.17 -3.37 0.26 0.00 -0.40 0.00 0.00 41.96 38.29 1zze s TYR 272 CO 0.15 -1.06 1.33 0.41 -1.57 0.00 0.00 175.55 174.81 1zze n GLY 273 N 3.31 4.42 2.57 0.71 0.00 0.65 -4.80 105.19 112.05 1zze n GLY 273 Ca 0.11 -2.49 -0.29 0.00 0.00 0.00 0.00 46.02 43.34 1zze n GLY 273 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1zze s THR 274 N -1.20 0.39 -0.04 2.61 -4.23 -1.26 -1.72 115.64 110.19 1zze s THR 274 Ca 0.33 -1.49 -0.23 0.00 -1.18 0.00 0.00 61.69 59.12 1zze s THR 274 Cb -0.03 -1.30 -0.27 0.00 1.34 0.00 0.00 72.50 72.25 1zze s THR 274 CO -0.01 -0.84 0.97 0.00 -0.54 0.00 0.00 174.62 174.20 1zze h ALA 275 N 7.58 -0.00 -2.01 3.99 0.00 -1.38 -3.49 119.26 123.95 1zze h ALA 275 Ca -0.06 -0.58 0.24 0.00 0.00 0.00 0.00 54.91 54.50 1zze h ALA 275 Cb 0.98 0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.73 1zze h ALA 275 CO 0.38 0.26 0.64 0.20 0.00 0.00 0.00 179.25 180.74 1zze s GLY 276 N -4.18 -0.26 0.52 0.00 0.00 -1.23 -4.99 107.32 97.18 1zze s GLY 276 Ca -0.15 0.29 -0.09 0.00 0.00 0.00 0.00 44.72 44.78 1zze s GLY 276 CO 0.79 0.52 0.88 -0.51 0.00 0.00 0.00 173.10 174.78 1zze s THR 277 N -2.79 4.80 0.19 0.90 -4.23 -1.26 -1.11 115.64 112.13 1zze s THR 277 Ca 0.15 0.55 -0.23 0.00 -1.18 0.00 0.00 61.69 60.97 1zze s THR 277 Cb 0.01 -3.84 0.05 0.00 1.34 0.00 0.00 72.50 70.06 1zze s THR 277 CO 0.00 -0.89 0.75 0.72 -0.54 0.00 0.00 174.62 174.66 1zze s PHE 278 N -2.83 -0.30 0.21 3.99 -0.12 -0.01 -4.82 117.98 114.10 1zze s PHE 278 Ca 0.51 -0.02 -0.07 0.00 -0.05 0.00 0.00 56.93 57.31 1zze s PHE 278 Cb -0.10 0.63 -0.02 0.00 -0.63 0.00 0.00 43.02 42.90 1zze s PHE 278 CO 0.45 -0.96 0.29 0.16 -0.05 0.00 0.00 175.22 175.11 1zze s ASP 279 N -2.82 0.04 0.55 1.98 3.84 -1.26 -2.31 116.67 116.69 1zze s ASP 279 Ca 0.08 -1.12 0.21 0.00 -0.00 0.00 0.00 52.55 51.71 1zze s ASP 279 Cb -0.03 0.47 1.46 0.00 -1.38 0.00 0.00 42.92 43.44 1zze s ASP 279 CO -0.02 -0.97 2.17 -0.50 -0.00 0.00 0.00 175.17 175.86 1zze h TRP 280 N 2.47 0.00 -0.00 2.11 -0.00 -1.94 -2.05 115.95 116.54 1zze h TRP 280 Ca -0.31 0.00 -0.15 0.00 -0.00 0.00 0.00 58.89 58.43 1zze h TRP 280 Cb 1.24 0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 30.38 1zze h TRP 280 CO 0.38 0.00 -0.71 -0.91 -0.00 0.00 0.00 178.44 177.20 1zze h ASN 281 N 0.00 0.02 0.71 -3.49 2.35 -1.96 -0.50 115.58 112.70 1zze h ASN 281 Ca 0.02 -0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.61 1zze h ASN 281 Cb 0.07 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 1zze h ASN 281 CO -0.00 0.72 -0.69 0.71 -1.65 0.00 0.00 177.43 176.53 1zze h THR 282 N 0.01 1.48 -0.09 2.81 1.35 -1.79 -0.34 112.91 116.35 1zze h THR 282 Ca -0.01 -2.37 -0.04 0.00 -0.55 0.00 0.00 66.41 63.44 1zze h THR 282 Cb 1.26 2.28 -0.00 0.00 -1.73 0.00 0.00 68.15 69.96 1zze h THR 282 CO 0.09 0.67 -0.09 0.58 -0.25 0.00 0.00 175.52 176.52 1zze h VAL 283 N 0.00 1.37 -0.72 6.82 2.07 -1.21 -1.79 116.25 122.79 1zze h VAL 283 Ca -0.01 -1.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.23 1zze h VAL 283 Cb 1.23 2.01 -0.03 0.00 -1.52 0.00 0.00 31.29 32.98 1zze h VAL 283 CO 0.09 0.36 0.38 -0.07 0.02 0.00 0.00 177.57 178.35 1zze h LEU 284 N -0.21 0.89 -0.99 2.57 3.38 -0.99 -0.63 115.31 119.34 1zze h LEU 284 Ca 0.01 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1zze h LEU 284 Cb 0.62 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.10 1zze h LEU 284 CO 0.02 0.73 0.38 0.00 0.09 0.00 0.00 178.44 179.66 1zze h ALA 285 N 1.42 1.21 -0.46 1.53 0.00 -0.96 -1.31 119.26 120.69 1zze h ALA 285 Ca 0.25 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 1zze h ALA 285 Cb 0.04 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1zze h ALA 285 CO -0.04 0.61 -0.21 1.15 0.00 0.00 0.00 179.25 180.76 1zze h THR 286 N 1.09 1.27 -0.07 0.00 2.02 -0.35 -2.38 112.91 114.49 1zze h THR 286 Ca 0.27 -1.37 0.02 0.00 0.77 0.00 0.00 66.41 66.10 1zze h THR 286 Cb 0.10 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1zze h THR 286 CO -0.04 0.47 -0.02 -0.26 0.37 0.00 0.00 175.52 176.04 1zze h PHE 287 N 0.79 -0.04 -0.75 3.16 0.04 -0.73 -1.64 116.94 117.77 1zze h PHE 287 Ca 0.10 0.01 0.06 0.00 2.80 0.00 0.00 57.97 60.95 1zze h PHE 287 Cb 0.78 0.03 -0.05 0.00 2.20 0.00 0.00 35.95 38.92 1zze h PHE 287 CO 0.05 -0.04 0.50 0.00 -0.60 0.00 0.00 178.31 178.22 1zze h ARG 288 N -0.00 0.78 -0.06 1.51 3.08 -1.16 0.86 114.38 119.38 1zze h ARG 288 Ca 0.04 -0.05 -0.20 0.00 0.07 0.00 0.00 59.98 59.84 1zze h ARG 288 Cb 0.06 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 29.93 1zze h ARG 288 CO -0.08 0.51 -0.79 -0.22 -1.07 0.00 0.00 179.97 178.32 1zze h LYS 289 N 0.80 0.43 -0.02 0.04 3.64 -1.12 -2.70 116.57 117.64 1zze h LYS 289 Ca 0.33 -0.38 -0.20 0.00 -1.27 0.00 0.00 60.65 59.13 1zze h LYS 289 Cb 0.25 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1zze h LYS 289 CO -0.11 1.03 -0.83 -0.07 -2.27 0.00 0.00 179.45 177.19 1zze h LEU 290 N 0.28 0.35 -6.43 5.20 3.38 -0.55 -3.37 115.31 114.18 1zze h LEU 290 Ca -0.05 -0.27 -0.59 0.00 0.09 0.00 0.00 57.88 57.06 1zze h LEU 290 Cb 1.39 -0.11 -0.41 0.00 0.09 0.00 0.00 40.66 41.63 1zze h LEU 290 CO 0.14 1.04 -0.77 -1.22 0.09 0.00 0.00 178.44 177.71 1zze n TYR 291 N -3.73 1.78 0.16 1.13 4.01 0.23 -1.40 117.16 119.33 1zze n TYR 291 Ca -0.04 -3.90 0.18 0.00 -0.16 0.00 0.00 57.90 53.98 1zze n TYR 291 Cb 0.77 -0.37 0.79 0.00 -0.31 0.00 0.00 39.34 40.22 1zze n TYR 291 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1zze h PRO 292 N 4.75 0.00 -0.42 -0.72 0.11 -1.65 -2.05 132.00 132.02 1zze h PRO 292 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1zze h PRO 292 Cb 0.78 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1zze h PRO 292 CO 0.63 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.85 1zze n SER 293 N -3.79 3.41 -4.91 -2.05 7.64 -1.26 -4.96 113.62 107.69 1zze n SER 293 Ca 0.04 -1.96 -0.31 0.00 1.01 0.00 0.00 58.87 57.65 1zze n SER 293 Cb 0.44 -0.27 -0.04 0.00 -1.01 0.00 0.00 64.21 63.33 1zze n SER 293 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1zze s LYS 294 N -1.33 3.42 -0.07 1.43 2.20 -0.77 -5.09 119.74 119.54 1zze s LYS 294 Ca 0.37 -0.44 -0.16 0.00 -0.36 0.00 0.00 55.97 55.39 1zze s LYS 294 Cb 0.21 -3.04 -0.05 0.00 -1.51 0.00 0.00 37.83 33.45 1zze s LYS 294 CO 0.29 0.61 0.41 0.99 -0.36 0.00 0.00 175.35 177.29 1zze s THR 295 N -1.49 5.14 0.21 3.43 2.01 -1.26 -4.99 115.64 118.69 1zze s THR 295 Ca 0.34 0.81 0.06 0.00 0.31 0.00 0.00 61.69 63.22 1zze s THR 295 Cb -0.13 -3.73 -0.05 0.00 0.01 0.00 0.00 72.50 68.60 1zze s THR 295 CO 0.27 0.46 -0.11 -0.36 -0.69 0.00 0.00 174.62 174.19 1zze s PHE 296 N -0.21 1.65 0.64 4.92 0.08 -1.26 -4.86 117.98 118.95 1zze s PHE 296 Ca 0.23 -0.66 -0.18 0.00 0.12 0.00 0.00 56.93 56.43 1zze s PHE 296 Cb -0.15 -0.83 -0.02 0.00 -0.57 0.00 0.00 43.02 41.45 1zze s PHE 296 CO 0.10 0.25 1.26 -2.30 -0.10 0.00 0.00 175.22 174.43 1zze n PRO 297 N -0.38 1.10 -1.41 0.24 -0.02 -1.26 -4.97 135.00 128.30 1zze n PRO 297 Ca -0.08 0.43 -0.31 0.00 -2.02 0.00 0.00 63.50 61.53 1zze n PRO 297 Cb 0.61 -2.49 0.08 0.00 -0.02 0.00 0.00 33.50 31.68 1zze n PRO 297 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1zze s ALA 298 N -1.40 2.32 0.61 3.55 0.00 -1.26 -4.98 121.76 120.60 1zze s ALA 298 Ca 0.82 0.08 -0.19 0.00 0.00 0.00 0.00 51.96 52.67 1zze s ALA 298 Cb -0.38 -3.20 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 1zze s ALA 298 CO 0.41 -1.64 1.23 -0.25 0.00 0.00 0.00 175.76 175.51 1zze n ASP 299 N -3.41 1.90 -4.93 0.00 9.92 -1.26 -5.01 116.55 113.76 1zze n ASP 299 Ca 0.08 0.86 -0.26 0.00 -0.53 0.00 0.00 54.79 54.95 1zze n ASP 299 Cb 0.54 -1.52 0.02 0.00 -0.64 0.00 0.00 41.12 39.52 1zze n ASP 299 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1zze s PHE 300 N -1.39 3.28 0.33 1.24 0.08 -1.26 -5.01 117.98 115.25 1zze s PHE 300 Ca 0.78 0.55 -0.28 0.00 0.12 0.00 0.00 56.93 58.10 1zze s PHE 300 Cb -0.40 -2.57 -0.13 0.00 -0.57 0.00 0.00 43.02 39.36 1zze s PHE 300 CO 0.44 -0.63 1.25 -2.30 -0.10 0.00 0.00 175.22 173.89 1zze n PRO 301 N -2.40 2.03 -1.70 0.24 -0.02 -1.26 -4.83 135.00 127.06 1zze n PRO 301 Ca 0.03 0.71 -0.42 0.00 -2.02 0.00 0.00 63.50 61.80 1zze n PRO 301 Cb 0.57 -2.27 -0.03 0.00 -0.02 0.00 0.00 33.50 31.76 1zze n PRO 301 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1zze s ASP 302 N -0.34 6.42 0.00 2.55 -1.08 -1.26 -4.87 116.67 118.10 1zze s ASP 302 Ca 0.56 2.75 0.24 0.00 -0.52 0.00 0.00 52.55 55.57 1zze s ASP 302 Cb -0.59 -2.56 0.28 0.00 -1.46 0.00 0.00 42.92 38.59 1zze s ASP 302 CO 0.62 -1.02 1.31 0.00 0.52 0.00 0.00 175.17 176.60 1zze n GLN 303 N 6.08 2.39 0.00 4.34 6.02 -1.26 -5.08 117.38 129.88 1zze n GLN 303 Ca 0.18 -2.05 0.00 0.00 -0.01 0.00 0.00 57.00 55.12 1zze n GLN 303 Cb 0.39 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 30.17 1zze n GLN 303 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1zze n GLY 304 N 1.41 -0.10 3.20 1.08 0.00 -1.26 -4.83 105.19 104.69 1zze n GLY 304 Ca 0.16 -1.60 -0.09 0.00 0.00 0.00 0.00 46.02 44.49 1zze n GLY 304 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1zze s GLN 305 N 0.00 0.81 -0.39 1.61 -2.07 -1.26 -4.89 119.66 113.47 1zze s GLN 305 Ca 0.00 -0.86 -0.27 0.00 -1.82 0.00 0.00 55.36 52.41 1zze s GLN 305 Cb 0.00 0.33 0.02 0.00 -1.09 0.00 0.00 33.01 32.27 1zze s GLN 305 CO 0.00 -0.25 1.00 0.34 -1.32 0.00 0.00 175.29 175.05 1zze s ASP 306 N -2.66 6.69 0.00 12.60 -1.08 -1.26 -0.77 116.67 130.20 1zze s ASP 306 Ca 0.02 0.59 0.23 0.00 -0.52 0.00 0.00 52.55 52.87 1zze s ASP 306 Cb 0.03 -2.49 0.46 0.00 -1.46 0.00 0.00 42.92 39.46 1zze s ASP 306 CO -0.09 -0.96 1.42 0.18 0.52 0.00 0.00 175.17 176.23 1zze n LEU 307 N 7.05 3.34 -4.84 -1.34 4.77 -1.26 -4.98 117.00 119.74 1zze n LEU 307 Ca 0.09 -1.44 -0.30 0.00 -0.03 0.00 0.00 56.01 54.32 1zze n LEU 307 Cb 0.48 -0.25 0.07 0.00 -2.33 0.00 0.00 43.42 41.39 1zze n LEU 307 CO 0.62 0.72 0.73 -0.94 -1.33 0.00 0.00 177.39 177.19 1zze s SER 308 N -1.48 4.96 0.02 -1.43 1.04 -1.26 -4.69 113.70 110.87 1zze s SER 308 Ca 0.39 1.23 0.02 0.00 0.48 0.00 0.00 55.95 58.07 1zze s SER 308 Cb 0.22 -2.00 -0.02 0.00 0.10 0.00 0.00 66.02 64.33 1zze s SER 308 CO 0.31 -1.66 -0.07 -0.54 0.98 0.00 0.00 173.24 172.26 1zze s LYS 309 N -5.25 0.48 0.03 4.02 -0.14 -0.54 -5.02 119.74 113.32 1zze s LYS 309 Ca 0.59 -0.52 0.07 0.00 -1.36 0.00 0.00 55.97 54.75 1zze s LYS 309 Cb -0.13 -0.34 -0.03 0.00 -1.68 0.00 0.00 37.83 35.65 1zze s LYS 309 CO 0.53 0.08 -0.19 -0.06 -0.76 0.00 0.00 175.35 174.94 1zze s PHE 310 N -0.86 2.52 -0.83 3.18 0.08 -1.26 -0.67 117.98 120.13 1zze s PHE 310 Ca -0.05 -0.28 -0.24 0.00 0.12 0.00 0.00 56.93 56.48 1zze s PHE 310 Cb -0.07 -1.47 0.05 0.00 -0.57 0.00 0.00 43.02 40.96 1zze s PHE 310 CO 0.00 0.21 1.27 0.34 -0.10 0.00 0.00 175.22 176.94 1zze s ASP 311 N -1.27 6.32 -0.19 1.36 2.15 0.42 -4.82 116.67 120.63 1zze s ASP 311 Ca 0.14 -1.01 0.12 0.00 0.43 0.00 0.00 52.55 52.22 1zze s ASP 311 Cb -0.10 -2.52 0.68 0.00 -0.30 0.00 0.00 42.92 40.67 1zze s ASP 311 CO 0.04 -1.59 1.54 0.35 -0.17 0.00 0.00 175.17 175.33 1zze n THR 312 N 6.38 2.21 -0.04 1.71 -2.24 -1.26 -4.63 114.28 116.41 1zze n THR 312 Ca 0.13 -1.14 -0.11 0.00 -2.27 0.00 0.00 64.05 60.66 1zze n THR 312 Cb 0.49 -0.27 -0.05 0.00 -2.10 0.00 0.00 70.33 68.41 1zze n THR 312 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1zze h ALA 313 N 3.71 -0.44 0.00 6.98 0.00 -1.96 0.19 119.26 127.74 1zze h ALA 313 Ca 0.00 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1zze h ALA 313 Cb 1.68 0.74 -0.01 0.00 0.00 0.00 0.00 17.79 20.20 1zze h ALA 313 CO 0.39 -0.85 -0.23 -1.00 0.00 0.00 0.00 179.25 177.56 1zze h PRO 314 N -0.40 0.00 -0.28 0.00 0.13 -1.93 -0.35 132.00 129.17 1zze h PRO 314 Ca 0.11 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.21 1zze h PRO 314 Cb 0.58 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.70 1zze h PRO 314 CO -0.43 0.23 0.06 0.77 -0.23 0.00 0.00 178.00 178.39 1zze h SER 315 N 0.00 0.43 -0.19 1.44 0.02 -1.49 -0.71 113.55 113.06 1zze h SER 315 Ca -0.00 -0.25 -0.08 0.00 -0.84 0.00 0.00 61.79 60.62 1zze h SER 315 Cb 0.41 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1zze h SER 315 CO 0.03 0.57 -0.15 -0.07 -1.14 0.00 0.00 176.83 176.07 1zze h LEU 316 N 0.28 0.58 -0.49 5.07 3.38 -0.25 -1.53 115.31 122.35 1zze h LEU 316 Ca 0.09 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 1zze h LEU 316 Cb 0.31 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1zze h LEU 316 CO 0.00 0.75 0.04 -0.33 0.09 0.00 0.00 178.44 178.99 1zze h GLU 317 N 0.53 0.83 0.01 1.13 5.08 -0.85 -2.21 114.58 119.11 1zze h GLU 317 Ca 0.09 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.20 1zze h GLU 317 Cb 0.57 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1zze h GLU 317 CO 0.04 0.86 -0.01 0.82 -1.00 0.00 0.00 179.01 179.72 1zze h ILE 318 N 0.70 1.14 -0.88 3.13 2.04 -0.88 -0.97 117.51 121.79 1zze h ILE 318 Ca 0.14 -0.46 0.04 0.00 1.00 0.00 0.00 64.86 65.58 1zze h ILE 318 Cb 0.46 1.45 -0.05 0.00 -0.74 0.00 0.00 36.82 37.94 1zze h ILE 318 CO 0.02 0.12 0.56 -0.07 0.00 0.00 0.00 178.15 178.78 1zze h LEU 319 N -0.21 0.93 -0.27 1.44 3.38 -1.26 -1.12 115.31 118.20 1zze h LEU 319 Ca -0.00 -0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1zze h LEU 319 Cb 0.20 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1zze h LEU 319 CO 0.00 0.63 -0.23 0.50 0.09 0.00 0.00 178.44 179.43 1zze h LYS 320 N 1.08 0.62 -0.13 1.13 3.64 -1.32 -0.37 116.57 121.22 1zze h LYS 320 Ca 0.36 -0.32 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 1zze h LYS 320 Cb 0.04 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1zze h LYS 320 CO -0.13 0.91 0.02 0.77 -2.27 0.00 0.00 179.45 178.75 1zze h SER 321 N 0.35 0.16 -0.16 4.20 0.02 -0.75 -1.15 113.55 116.22 1zze h SER 321 Ca 0.05 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1zze h SER 321 Cb 0.78 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.28 1zze h SER 321 CO 0.06 0.18 0.00 0.18 -1.14 0.00 0.00 176.83 176.10 1zze n LEU 322 N -4.45 1.16 -0.39 5.07 4.77 -0.46 -4.90 117.00 117.79 1zze n LEU 322 Ca -0.01 -0.52 -0.05 0.00 -0.03 0.00 0.00 56.01 55.40 1zze n LEU 322 Cb 0.13 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 1zze n LEU 322 CO 0.35 0.26 -0.05 0.61 -1.33 0.00 0.00 177.39 177.24 1zze n GLY 323 N 0.96 0.76 2.57 -0.72 0.00 -0.43 -4.92 105.19 103.40 1zze n GLY 323 Ca 0.12 -0.56 -0.20 0.00 0.00 0.00 0.00 46.02 45.39 1zze n GLY 323 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zze n ARG 324 N -2.53 2.22 -1.62 1.61 5.12 -0.18 -5.03 116.66 116.25 1zze n ARG 324 Ca -0.05 -3.96 -0.38 0.00 -1.93 0.00 0.00 57.85 51.53 1zze n ARG 324 Cb 0.21 -1.82 0.05 0.00 -1.16 0.00 0.00 32.46 29.74 1zze n ARG 324 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 1zze n PRO 325 N -0.17 0.92 -0.38 5.56 -0.04 -0.98 -4.52 135.00 135.38 1zze n PRO 325 Ca 0.25 0.36 0.01 0.00 -0.04 0.00 0.00 63.50 64.08 1zze n PRO 325 Cb 0.67 -2.18 -0.01 0.00 -0.04 0.00 0.00 33.50 31.94 1zze n PRO 325 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1zze n GLY 326 N 1.27 -3.02 3.77 0.55 0.00 -1.26 -4.92 105.19 101.58 1zze n GLY 326 Ca 0.14 -1.24 -0.38 0.00 0.00 0.00 0.00 46.02 44.54 1zze n GLY 326 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1zze s TRP 327 N -4.02 3.79 0.32 1.61 0.52 -1.26 -5.02 118.94 114.88 1zze s TRP 327 Ca 0.00 1.82 -0.29 0.00 0.02 0.00 0.00 56.10 57.65 1zze s TRP 327 Cb 0.00 -2.93 -0.10 0.00 -1.15 0.00 0.00 33.47 29.28 1zze s TRP 327 CO 0.00 0.29 1.26 0.50 0.02 0.00 0.00 176.95 179.03 1zze s ARG 328 N -1.77 4.40 0.92 4.98 3.52 -1.26 -4.98 118.95 124.76 1zze s ARG 328 Ca 0.47 2.13 -0.11 0.00 -0.13 0.00 0.00 55.73 58.08 1zze s ARG 328 Cb -0.21 -3.08 0.14 0.00 -1.56 0.00 0.00 34.95 30.24 1zze s ARG 328 CO 0.26 -0.12 1.09 -1.54 -0.81 0.00 0.00 175.30 174.19 1zze s SER 329 N -0.58 3.17 0.31 -2.12 1.04 -1.26 -4.67 113.70 109.59 1zze s SER 329 Ca 0.48 1.70 0.12 0.00 0.48 0.00 0.00 55.95 58.73 1zze s SER 329 Cb -0.38 -2.33 0.48 0.00 0.10 0.00 0.00 66.02 63.89 1zze s SER 329 CO 0.50 -2.86 1.68 -0.29 0.98 0.00 0.00 173.24 173.25 1zze h ILE 330 N -1.70 1.34 -0.21 -1.02 2.10 -1.98 -0.50 117.51 115.53 1zze h ILE 330 Ca -0.49 -1.86 -0.01 0.00 1.08 0.00 0.00 64.86 63.58 1zze h ILE 330 Cb 1.28 2.01 -0.01 0.00 -1.09 0.00 0.00 36.82 39.01 1zze h ILE 330 CO 0.51 0.52 0.09 -0.33 -1.08 0.00 0.00 178.15 177.86 1zze h GLU 331 N 0.00 0.31 -0.48 2.19 3.07 -1.99 0.08 114.58 117.77 1zze h GLU 331 Ca -0.01 -0.05 -0.13 0.00 -0.50 0.00 0.00 59.36 58.67 1zze h GLU 331 Cb 0.97 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.82 1zze h GLU 331 CO 0.07 0.36 -0.22 1.49 -1.40 0.00 0.00 179.01 179.31 1zze h GLU 332 N 0.19 0.99 -0.47 2.33 4.81 -1.88 -1.85 114.58 118.69 1zze h GLU 332 Ca 0.07 -0.42 -0.03 0.00 -0.13 0.00 0.00 59.36 58.84 1zze h GLU 332 Cb 0.16 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1zze h GLU 332 CO -0.01 1.10 0.16 0.77 -0.73 0.00 0.00 179.01 180.31 1zze h SER 333 N 0.85 0.68 -0.38 1.04 0.02 -0.92 -0.50 113.55 114.34 1zze h SER 333 Ca 0.11 -0.19 -0.11 0.00 -0.84 0.00 0.00 61.79 60.76 1zze h SER 333 Cb 0.80 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.14 1zze h SER 333 CO 0.07 0.69 -0.15 0.40 -1.14 0.00 0.00 176.83 176.70 1zze h ILE 334 N 0.63 1.27 -0.43 3.27 2.04 -0.94 -2.30 117.51 121.05 1zze h ILE 334 Ca 0.16 -1.26 -0.04 0.00 1.00 0.00 0.00 64.86 64.71 1zze h ILE 334 Cb 0.24 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 1zze h ILE 334 CO -0.01 0.43 0.08 0.50 0.00 0.00 0.00 178.15 179.15 1zze h LYS 335 N 0.75 0.64 -0.56 2.37 3.64 -1.04 0.16 116.57 122.54 1zze h LYS 335 Ca 0.12 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1zze h LYS 335 Cb 0.67 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.36 1zze h LYS 335 CO 0.05 0.60 0.35 -0.44 -2.27 0.00 0.00 179.45 177.75 1zze h ASP 336 N 0.62 0.65 0.01 4.20 3.32 -0.55 0.33 116.42 125.01 1zze h ASP 336 Ca 0.14 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 1zze h ASP 336 Cb 0.27 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1zze h ASP 336 CO 0.00 0.49 -0.01 0.25 -1.72 0.00 0.00 179.24 178.25 1zze h LEU 337 N 0.76 -0.01 -0.43 1.55 5.85 -0.70 -3.23 115.31 119.10 1zze h LEU 337 Ca 0.20 -0.64 0.00 0.00 0.84 0.00 0.00 57.88 58.28 1zze h LEU 337 Cb -0.06 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.97 1zze h LEU 337 CO -0.04 0.80 -0.69 1.33 -0.34 0.00 0.00 178.44 179.50 1zze n VAL 338 N -4.69 0.00 -4.40 1.05 0.24 0.38 -4.74 118.33 106.18 1zze n VAL 338 Ca -0.07 -0.16 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 1zze n VAL 338 Cb 0.32 1.11 0.00 0.00 -1.47 0.00 0.00 33.84 33.79 1zze n VAL 338 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1zze n GLY 339 N 1.39 0.05 3.29 7.63 0.00 0.12 -4.93 105.19 112.74 1zze n GLY 339 Ca 0.06 -0.95 -0.12 0.00 0.00 0.00 0.00 46.02 45.01 1zze n GLY 339 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1zze s SER 340 N -4.00 -0.21 0.37 1.61 1.04 -1.26 -4.66 113.70 106.60 1zze s SER 340 Ca 0.00 -0.09 -0.27 0.00 0.48 0.00 0.00 55.95 56.07 1zze s SER 340 Cb 0.00 0.39 -0.10 0.00 0.10 0.00 0.00 66.02 66.41 1zze s SER 340 CO 0.00 -0.64 1.31 -0.70 0.98 0.00 0.00 173.24 174.19 1zze s GLU 341 N -2.49 4.16 1.03 4.02 2.12 -0.49 -5.01 118.70 122.05 1zze s GLU 341 Ca -0.05 2.19 -0.13 0.00 0.36 0.00 0.00 54.97 57.34 1zze s GLU 341 Cb -0.01 -2.91 0.21 0.00 0.26 0.00 0.00 34.13 31.68 1zze s GLU 341 CO -0.03 -0.34 1.08 -0.08 -0.54 0.00 0.00 175.26 175.36 1zze s THR 342 N -1.21 2.00 -2.00 -1.70 -1.32 -1.26 -4.98 115.64 105.17 1zze s THR 342 Ca 0.53 0.00 0.25 0.00 -1.21 0.00 0.00 61.69 61.26 1zze s THR 342 Cb -0.39 -2.44 0.72 0.00 -1.51 0.00 0.00 72.50 68.88 1zze s THR 342 CO 0.51 -0.00 1.86 0.00 -2.21 0.00 0.00 174.62 174.78