#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xxd s VAL 17 N 0.00 4.86 -1.13 1.39 0.11 -0.40 -3.74 120.40 121.49 1xxd s VAL 17 Ca 0.00 1.43 0.00 0.00 -2.93 0.00 0.00 61.98 60.48 1xxd s VAL 17 Cb 0.00 -4.02 0.00 0.00 -1.53 0.00 0.00 36.38 30.83 1xxd s VAL 17 CO 0.00 0.36 0.00 0.61 -3.33 0.00 0.00 175.10 172.74 1xxd n GLY 18 N 2.55 1.14 4.01 6.54 0.00 -1.21 -2.45 105.19 115.78 1xxd n GLY 18 Ca -0.04 -0.53 -0.21 0.00 0.00 0.00 0.00 46.02 45.24 1xxd n GLY 18 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xxd s GLY 19 N -2.87 1.85 0.30 -0.02 0.00 -1.25 -4.80 107.32 100.55 1xxd s GLY 19 Ca 0.00 -1.98 0.10 0.00 0.00 0.00 0.00 44.72 42.84 1xxd s GLY 19 CO 0.00 -1.75 -0.09 -1.59 0.00 0.00 0.00 173.10 169.67 1xxd s THR 20 N -2.71 2.64 -0.14 0.90 2.01 0.85 -4.83 115.64 114.37 1xxd s THR 20 Ca 0.56 -2.18 -0.29 0.00 0.31 0.00 0.00 61.69 60.09 1xxd s THR 20 Cb -0.05 -2.58 -0.02 0.00 0.01 0.00 0.00 72.50 69.86 1xxd s THR 20 CO 0.36 -0.31 1.21 0.00 -0.69 0.00 0.00 174.62 175.19 1xxd s ALA 21 N -2.50 3.61 0.54 7.40 0.00 -1.26 0.64 121.76 130.18 1xxd s ALA 21 Ca 0.32 0.47 -0.05 0.00 0.00 0.00 0.00 51.96 52.70 1xxd s ALA 21 Cb -0.03 -3.57 -0.01 0.00 0.00 0.00 0.00 23.12 19.51 1xxd s ALA 21 CO 0.17 -1.02 0.84 -1.54 0.00 0.00 0.00 175.76 174.22 1xxd s SER 22 N 1.71 5.86 0.37 0.00 1.04 -0.23 -4.89 113.70 117.55 1xxd s SER 22 Ca 0.54 0.76 0.08 0.00 0.48 0.00 0.00 55.95 57.80 1xxd s SER 22 Cb -0.22 -1.89 -0.05 0.00 0.10 0.00 0.00 66.02 63.96 1xxd s SER 22 CO 0.16 -0.86 0.11 0.54 0.98 0.00 0.00 173.24 174.17 1xxd s VAL 23 N -2.86 2.61 0.33 5.02 0.11 -1.26 -4.70 120.40 119.65 1xxd s VAL 23 Ca 0.51 -1.80 -0.25 0.00 -2.93 0.00 0.00 61.98 57.51 1xxd s VAL 23 Cb -0.10 -2.92 -0.14 0.00 -1.53 0.00 0.00 36.38 31.68 1xxd s VAL 23 CO 0.44 -0.12 0.71 -1.14 -3.33 0.00 0.00 175.10 171.66 1xxd n ARG 24 N -1.11 0.74 0.00 1.54 0.63 -1.26 -1.26 116.66 115.94 1xxd n ARG 24 Ca -0.03 0.26 0.00 0.00 -0.92 0.00 0.00 57.85 57.17 1xxd n ARG 24 Cb 0.63 -1.53 0.00 0.00 0.45 0.00 0.00 32.46 32.01 1xxd n ARG 24 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1xxd n GLY 25 N 1.62 2.95 3.58 5.14 0.00 -1.26 -4.99 105.19 112.23 1xxd n GLY 25 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 1xxd n GLY 25 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xxd s GLU 26 N -0.31 3.79 -0.25 1.61 2.12 -0.39 -4.13 118.70 121.14 1xxd s GLU 26 Ca 0.00 -0.14 -0.01 0.00 0.36 0.00 0.00 54.97 55.18 1xxd s GLU 26 Cb 0.00 -3.74 0.00 0.00 0.26 0.00 0.00 34.13 30.65 1xxd s GLU 26 CO 0.00 -0.44 0.21 0.91 -0.54 0.00 0.00 175.26 175.40 1xxd n TRP 27 N 5.45 -0.51 0.00 5.30 5.03 -1.26 -4.73 117.44 126.71 1xxd n TRP 27 Ca -0.08 0.19 0.00 0.00 3.03 0.00 0.00 57.50 60.64 1xxd n TRP 27 Cb 0.50 -1.87 0.00 0.00 -1.03 0.00 0.00 31.31 28.91 1xxd n TRP 27 CO 0.00 0.00 0.00 -0.35 -0.03 0.00 0.00 177.69 177.31 1xxd n PRO 28 N -1.37 0.00 0.00 -0.99 -0.04 -1.26 0.60 135.00 131.95 1xxd n PRO 28 Ca -0.01 0.01 0.09 0.00 -0.04 0.00 0.00 63.50 63.55 1xxd n PRO 28 Cb 0.51 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.38 1xxd n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1xxd n TRP 29 N -0.91 0.00 -2.44 0.54 2.14 -1.13 -0.14 117.44 115.50 1xxd n TRP 29 Ca 0.00 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.15 1xxd n TRP 29 Cb 0.00 0.00 -0.03 0.00 -0.81 0.00 0.00 31.31 30.47 1xxd n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1xxd s GLN 30 N -2.67 4.39 0.13 -2.67 2.00 0.20 -1.01 119.66 120.03 1xxd s GLN 30 Ca 0.07 1.72 0.04 0.00 -2.00 0.00 0.00 55.36 55.20 1xxd s GLN 30 Cb 0.14 -3.47 -0.04 0.00 0.80 0.00 0.00 33.01 30.43 1xxd s GLN 30 CO 0.72 -0.37 -0.10 0.14 -0.50 0.00 0.00 175.29 175.18 1xxd s VAL 31 N 1.73 1.09 -0.08 1.34 -7.23 -0.60 -4.25 120.40 112.39 1xxd s VAL 31 Ca 0.57 -1.89 0.02 0.00 -1.81 0.00 0.00 61.98 58.87 1xxd s VAL 31 Cb -0.27 -1.66 -0.02 0.00 0.56 0.00 0.00 36.38 34.99 1xxd s VAL 31 CO 0.25 -0.67 -0.12 0.28 -0.31 0.00 0.00 175.10 174.53 1xxd s THR 32 N -2.96 3.18 -0.41 5.32 -1.32 -0.38 -1.00 115.64 118.06 1xxd s THR 32 Ca 0.12 -0.66 -0.10 0.00 -1.21 0.00 0.00 61.69 59.85 1xxd s THR 32 Cb 0.00 -2.29 0.07 0.00 -1.51 0.00 0.00 72.50 68.78 1xxd s THR 32 CO 0.00 0.57 0.26 -0.22 -2.21 0.00 0.00 174.62 173.02 1xxd s LEU 33 N -0.41 5.09 0.46 9.08 2.96 0.43 -0.36 118.68 135.93 1xxd s LEU 33 Ca 0.05 -1.40 0.03 0.00 -0.22 0.00 0.00 54.13 52.59 1xxd s LEU 33 Cb -0.12 -2.00 0.01 0.00 0.50 0.00 0.00 46.19 44.57 1xxd s LEU 33 CO 0.02 -0.51 0.66 -1.00 -1.32 0.00 0.00 176.35 174.20 1xxd s HIS 34 N 1.46 3.02 0.00 5.38 3.76 0.35 -0.06 115.29 129.21 1xxd s HIS 34 Ca 0.03 -0.01 0.03 0.00 -0.15 0.00 0.00 55.06 54.96 1xxd s HIS 34 Cb -0.22 -2.42 -0.01 0.00 1.11 0.00 0.00 32.58 31.03 1xxd s HIS 34 CO 0.03 -0.49 -0.11 -0.08 -0.85 0.00 0.00 174.74 173.25 1xxd s THR 35 N -2.54 0.84 -0.54 1.30 -1.32 -0.67 -1.76 115.64 110.94 1xxd s THR 35 Ca 0.52 -0.54 0.01 0.00 -1.21 0.00 0.00 61.69 60.47 1xxd s THR 35 Cb -0.10 -0.72 0.45 0.00 -1.51 0.00 0.00 72.50 70.62 1xxd s THR 35 CO 0.36 0.17 1.76 0.35 -2.21 0.00 0.00 174.62 175.06 1xxd n THR 36 N 2.64 3.27 -3.34 5.08 -2.24 -0.37 -2.08 114.28 117.25 1xxd n THR 36 Ca -0.15 -3.36 -0.01 0.00 -2.27 0.00 0.00 64.05 58.27 1xxd n THR 36 Cb 0.56 -1.15 -0.04 0.00 -2.10 0.00 0.00 70.33 67.60 1xxd n THR 36 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xxd s SER 37 N -2.41 -0.87 -0.10 3.42 0.15 -1.26 -4.73 113.70 107.90 1xxd s SER 37 Ca 0.60 0.88 -0.01 0.00 0.70 0.00 0.00 55.95 58.12 1xxd s SER 37 Cb 0.48 1.88 -0.00 0.00 -1.71 0.00 0.00 66.02 66.67 1xxd s SER 37 CO 0.01 -0.26 -0.02 -0.65 1.20 0.00 0.00 173.24 173.52 1xxd h PRO 37 N 8.06 0.00 -6.62 5.44 0.11 -2.00 -3.48 132.00 133.51 1xxd h PRO 37 Ca -0.21 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.39 1xxd h PRO 37 Cb 1.14 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1xxd h PRO 37 CO 0.22 0.00 0.17 -0.08 -0.21 0.00 0.00 178.00 178.10 1xxd s THR 37 N -1.57 4.46 -0.01 -1.15 -1.32 -1.26 -5.02 115.64 109.77 1xxd s THR 37 Ca -0.01 1.47 -0.30 0.00 -1.21 0.00 0.00 61.69 61.64 1xxd s THR 37 Cb 0.00 -3.94 -0.05 0.00 -1.51 0.00 0.00 72.50 67.00 1xxd s THR 37 CO 0.02 0.26 1.40 -1.58 -2.21 0.00 0.00 174.62 172.51 1xxd s GLN 37 N -1.81 4.28 0.18 7.08 0.74 -1.24 -4.64 119.66 124.26 1xxd s GLN 37 Ca 0.43 1.95 -0.08 0.00 0.05 0.00 0.00 55.36 57.71 1xxd s GLN 37 Cb -0.18 -3.59 -0.01 0.00 1.10 0.00 0.00 33.01 30.32 1xxd s GLN 37 CO 0.23 -0.58 0.29 -0.98 -0.55 0.00 0.00 175.29 173.69 1xxd s ARG 37 N 2.48 1.23 -0.14 1.67 1.70 -0.88 -4.94 118.95 120.06 1xxd s ARG 37 Ca 0.63 -1.28 -0.29 0.00 -0.47 0.00 0.00 55.73 54.33 1xxd s ARG 37 Cb -0.31 0.37 -0.02 0.00 -0.57 0.00 0.00 34.95 34.43 1xxd s ARG 37 CO 0.26 -0.45 1.21 -1.58 -1.08 0.00 0.00 175.30 173.65 1xxd s HIS 38 N -4.01 3.03 -0.05 5.89 5.65 -1.26 -1.68 115.29 122.86 1xxd s HIS 38 Ca 0.22 1.15 -0.03 0.00 0.25 0.00 0.00 55.06 56.64 1xxd s HIS 38 Cb 0.03 -3.44 -0.01 0.00 -1.18 0.00 0.00 32.58 27.98 1xxd s HIS 38 CO 0.04 -1.38 -0.07 -0.11 -0.65 0.00 0.00 174.74 172.57 1xxd n LEU 39 N 6.13 0.58 -4.18 8.88 7.94 0.92 -4.95 117.00 132.32 1xxd n LEU 39 Ca 0.13 0.32 -0.12 0.00 -1.11 0.00 0.00 56.01 55.23 1xxd n LEU 39 Cb 0.45 -0.61 -0.10 0.00 0.53 0.00 0.00 43.42 43.70 1xxd n LEU 39 CO 0.55 -0.48 -0.23 0.00 -1.11 0.00 0.00 177.39 176.12 1xxd s GLY 41 N -3.14 1.52 0.35 0.00 0.00 0.09 -0.43 107.32 105.71 1xxd s GLY 41 Ca 0.36 -1.31 -0.07 0.00 0.00 0.00 0.00 44.72 43.71 1xxd s GLY 41 CO 0.10 -1.33 0.58 0.61 0.00 0.00 0.00 173.10 173.06 1xxd n GLY 42 N -0.86 1.70 3.09 0.20 0.00 -0.17 -3.05 105.19 106.09 1xxd n GLY 42 Ca -0.08 -1.46 -0.19 0.00 0.00 0.00 0.00 46.02 44.29 1xxd n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xxd s SER 43 N -3.02 1.37 -0.34 1.61 0.01 -0.71 -1.56 113.70 111.06 1xxd s SER 43 Ca 0.22 -0.34 -0.22 0.00 1.31 0.00 0.00 55.95 56.92 1xxd s SER 43 Cb -0.02 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 66.11 1xxd s SER 43 CO 0.16 0.05 0.73 -0.63 0.41 0.00 0.00 173.24 173.97 1xxd s ILE 44 N -0.63 4.80 -0.02 1.44 1.01 -0.18 -0.78 121.20 126.84 1xxd s ILE 44 Ca 0.01 0.87 0.00 0.00 0.00 0.00 0.00 60.65 61.53 1xxd s ILE 44 Cb -0.06 -4.14 -0.00 0.00 0.01 0.00 0.00 42.46 38.26 1xxd s ILE 44 CO 0.00 -0.34 0.11 2.30 0.00 0.00 0.00 174.94 177.01 1xxd n ILE 45 N 5.65 0.00 -3.90 2.92 -5.35 -0.88 -0.46 119.36 117.34 1xxd n ILE 45 Ca 0.02 -0.49 -0.09 0.00 -0.27 0.00 0.00 62.75 61.91 1xxd n ILE 45 Cb 0.48 1.00 -0.07 0.00 -1.74 0.00 0.00 39.64 39.32 1xxd n ILE 45 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1xxd s GLY 46 N -0.86 0.30 0.00 3.28 0.00 -0.95 -4.70 107.32 104.40 1xxd s GLY 46 Ca 0.00 -0.72 0.10 0.00 0.00 0.00 0.00 44.72 44.10 1xxd s GLY 46 CO 0.01 -0.75 1.29 1.16 0.00 0.00 0.00 173.10 174.81 1xxd n ASN 47 N -0.19 0.00 0.00 1.64 6.94 -1.26 -2.90 115.26 119.49 1xxd n ASN 47 Ca -0.10 0.37 0.00 0.00 -0.02 0.00 0.00 54.58 54.83 1xxd n ASN 47 Cb 0.63 -0.42 0.00 0.00 -2.36 0.00 0.00 39.78 37.63 1xxd n ASN 47 CO 0.00 0.00 0.00 1.67 -1.03 0.00 0.00 177.26 177.90 1xxd n GLN 48 N -1.42 0.00 -4.72 -3.83 7.27 -1.26 0.17 117.38 113.59 1xxd n GLN 48 Ca 0.03 -0.28 -0.25 0.00 0.07 0.00 0.00 57.00 56.57 1xxd n GLN 48 Cb 0.10 -0.33 -0.16 0.00 2.41 0.00 0.00 30.24 32.26 1xxd n GLN 48 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1xxd s TRP 51 N 0.00 1.61 -0.06 3.69 0.52 -1.14 -0.45 118.94 123.10 1xxd s TRP 51 Ca 0.00 -0.54 0.05 0.00 0.02 0.00 0.00 56.10 55.63 1xxd s TRP 51 Cb 0.00 -1.12 -0.01 0.00 -1.15 0.00 0.00 33.47 31.18 1xxd s TRP 51 CO 0.00 -0.23 -0.22 0.42 0.02 0.00 0.00 176.95 176.94 1xxd s ILE 52 N 0.37 2.37 -0.17 2.03 -1.09 -0.90 -2.08 121.20 121.74 1xxd s ILE 52 Ca -0.10 -0.95 -0.06 0.00 -2.23 0.00 0.00 60.65 57.30 1xxd s ILE 52 Cb -0.14 -1.89 -0.04 0.00 -1.58 0.00 0.00 42.46 38.81 1xxd s ILE 52 CO 0.03 0.57 0.05 -0.22 -1.23 0.00 0.00 174.94 174.14 1xxd s LEU 53 N -0.23 3.74 0.00 2.97 2.96 0.04 -1.22 118.68 126.94 1xxd s LEU 53 Ca -0.01 0.07 -0.03 0.00 -0.22 0.00 0.00 54.13 53.94 1xxd s LEU 53 Cb -0.13 -1.93 0.01 0.00 0.50 0.00 0.00 46.19 44.64 1xxd s LEU 53 CO 0.03 0.20 0.43 1.07 -1.32 0.00 0.00 176.35 176.76 1xxd n THR 54 N 3.36 0.00 -2.52 3.68 5.66 -0.46 -1.74 114.28 122.26 1xxd n THR 54 Ca -0.17 -1.34 -0.36 0.00 -3.05 0.00 0.00 64.05 59.13 1xxd n THR 54 Cb 0.52 0.87 -0.04 0.00 -1.55 0.00 0.00 70.33 70.14 1xxd n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1xxd s ALA 55 N -2.44 3.02 0.08 1.79 0.00 -1.26 -1.16 121.76 121.79 1xxd s ALA 55 Ca 0.22 0.70 -0.10 0.00 0.00 0.00 0.00 51.96 52.78 1xxd s ALA 55 Cb -0.01 -3.28 -0.24 0.00 0.00 0.00 0.00 23.12 19.59 1xxd s ALA 55 CO 0.16 -0.28 1.16 0.00 0.00 0.00 0.00 175.76 176.80 1xxd h ALA 56 N 2.20 0.11 0.00 0.00 0.00 -1.78 -3.16 119.26 116.64 1xxd h ALA 56 Ca -0.49 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 53.65 1xxd h ALA 56 Cb 1.22 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1xxd h ALA 56 CO 0.61 0.78 0.00 -2.39 0.00 0.00 0.00 179.25 178.25 1xxd n HIS 57 N -3.73 0.00 1.55 0.00 1.44 -1.26 -2.55 115.22 110.67 1xxd n HIS 57 Ca -0.11 0.00 0.15 0.00 -2.01 0.00 0.00 57.72 55.75 1xxd n HIS 57 Cb 0.95 0.00 0.80 0.00 0.12 0.00 0.00 29.99 31.86 1xxd n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1xxd n PHE 59 N -1.21 1.24 0.01 0.00 3.01 -1.06 -4.89 117.46 114.58 1xxd n PHE 59 Ca 0.16 -1.73 -0.07 0.00 1.01 0.00 0.00 57.45 56.82 1xxd n PHE 59 Cb 0.21 -0.26 -0.05 0.00 -0.01 0.00 0.00 39.48 39.38 1xxd n PHE 59 CO 0.00 0.00 0.00 -0.92 1.01 0.00 0.00 176.76 176.85 1xxd h TYR 59 N 1.74 -0.73 -1.74 1.38 3.20 -1.78 -2.50 116.97 116.54 1xxd h TYR 59 Ca 0.07 0.02 -0.73 0.00 3.14 0.00 0.00 58.73 61.24 1xxd h TYR 59 Cb 1.39 0.32 -0.30 0.00 1.54 0.00 0.00 36.73 39.68 1xxd h TYR 59 CO 0.65 -0.26 0.78 0.41 -1.64 0.00 0.00 178.16 178.10 1xxd n GLY 59 N -1.20 5.66 3.38 1.82 0.00 -1.26 -4.94 105.19 108.65 1xxd n GLY 59 Ca -0.03 -2.49 -0.37 0.00 0.00 0.00 0.00 46.02 43.13 1xxd n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xxd s VAL 59 N -5.08 4.00 -0.15 1.61 1.01 -0.94 -4.99 120.40 115.86 1xxd s VAL 59 Ca 0.54 -0.45 -0.21 0.00 0.00 0.00 0.00 61.98 61.86 1xxd s VAL 59 Cb 0.45 -2.95 -0.18 0.00 0.00 0.00 0.00 36.38 33.70 1xxd s VAL 59 CO -0.31 0.24 0.42 -0.33 0.00 0.00 0.00 175.10 175.12 1xxd h GLU 60 N 8.22 0.00 -4.65 2.72 5.08 -1.92 -3.49 114.58 120.54 1xxd h GLU 60 Ca -0.36 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 57.78 1xxd h GLU 60 Cb 1.15 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.25 1xxd h GLU 60 CO 0.59 0.75 -0.70 -1.54 -1.00 0.00 0.00 179.01 177.12 1xxd s SER 61 N -6.24 1.14 0.00 1.42 1.04 -1.26 -5.02 113.70 104.77 1xxd s SER 61 Ca -0.18 -1.00 0.31 0.00 0.48 0.00 0.00 55.95 55.55 1xxd s SER 61 Cb 0.00 0.09 1.63 0.00 0.10 0.00 0.00 66.02 67.85 1xxd s SER 61 CO 0.51 -0.46 2.10 -0.81 0.98 0.00 0.00 173.24 175.56 1xxd n PRO 62 N -0.03 0.59 0.00 4.02 -0.04 -1.26 -3.23 135.00 135.04 1xxd n PRO 62 Ca -0.12 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.42 1xxd n PRO 62 Cb 0.61 -1.50 0.39 0.00 -0.04 0.00 0.00 33.50 32.96 1xxd n PRO 62 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1xxd n LYS 63 N -1.21 0.09 -0.45 0.54 4.76 -1.26 -1.82 118.16 118.81 1xxd n LYS 63 Ca 0.17 0.18 0.08 0.00 -2.87 0.00 0.00 58.31 55.87 1xxd n LYS 63 Cb 0.20 -1.50 0.28 0.00 -1.84 0.00 0.00 35.03 32.17 1xxd n LYS 63 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 1xxd n ILE 64 N -1.42 1.72 -4.32 -0.18 -5.35 -1.20 -4.97 119.36 103.64 1xxd n ILE 64 Ca 0.06 -1.32 -0.27 0.00 -0.27 0.00 0.00 62.75 60.94 1xxd n ILE 64 Cb 0.18 0.14 -0.10 0.00 -1.74 0.00 0.00 39.64 38.11 1xxd n ILE 64 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1xxd s LEU 65 N -1.86 2.83 -0.14 7.28 1.43 -0.75 -1.24 118.68 126.23 1xxd s LEU 65 Ca 0.41 -0.63 -0.04 0.00 -1.03 0.00 0.00 54.13 52.84 1xxd s LEU 65 Cb 0.27 -1.55 0.07 0.00 0.03 0.00 0.00 46.19 45.01 1xxd s LEU 65 CO 0.18 0.12 0.22 -0.13 0.23 0.00 0.00 176.35 176.97 1xxd s ARG 66 N -2.69 0.12 -0.28 1.70 0.52 -0.72 -4.29 118.95 113.30 1xxd s ARG 66 Ca 0.23 0.53 -0.15 0.00 -0.52 0.00 0.00 55.73 55.82 1xxd s ARG 66 Cb -0.09 -0.46 -0.03 0.00 0.52 0.00 0.00 34.95 34.89 1xxd s ARG 66 CO 0.13 -0.40 0.36 0.08 0.02 0.00 0.00 175.30 175.49 1xxd s VAL 67 N 2.35 5.18 -0.10 3.52 1.01 -0.88 -0.49 120.40 130.99 1xxd s VAL 67 Ca 0.04 0.43 -0.03 0.00 0.00 0.00 0.00 61.98 62.42 1xxd s VAL 67 Cb -0.13 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 1xxd s VAL 67 CO -0.09 0.12 0.04 -0.31 0.00 0.00 0.00 175.10 174.86 1xxd s TYR 68 N 2.04 3.27 0.12 5.22 1.51 0.51 -1.79 117.35 128.23 1xxd s TYR 68 Ca 0.14 0.27 0.08 0.00 -1.01 0.00 0.00 57.07 56.55 1xxd s TYR 68 Cb -0.16 -1.83 -0.04 0.00 -0.11 0.00 0.00 41.96 39.83 1xxd s TYR 68 CO 0.10 0.53 -0.18 -1.54 -1.11 0.00 0.00 175.55 173.35 1xxd s SER 69 N -0.90 2.41 -1.25 2.29 1.04 -1.26 -1.25 113.70 114.77 1xxd s SER 69 Ca 0.14 -0.76 -0.07 0.00 0.48 0.00 0.00 55.95 55.73 1xxd s SER 69 Cb -0.11 -0.12 0.01 0.00 0.10 0.00 0.00 66.02 65.89 1xxd s SER 69 CO 0.03 -0.02 0.95 0.61 0.98 0.00 0.00 173.24 175.78 1xxd n GLY 70 N 0.74 -0.38 3.45 7.32 0.00 -1.25 -4.99 105.19 110.08 1xxd n GLY 70 Ca -0.17 0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.65 1xxd n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xxd s ILE 71 N -3.25 3.14 -0.14 -0.61 -1.09 -1.26 -5.00 121.20 112.98 1xxd s ILE 71 Ca 0.47 -0.67 -0.11 0.00 -2.23 0.00 0.00 60.65 58.11 1xxd s ILE 71 Cb -0.21 -2.27 -0.06 0.00 -1.58 0.00 0.00 42.46 38.34 1xxd s ILE 71 CO 0.58 0.57 -0.24 -0.11 -1.23 0.00 0.00 174.94 174.50 1xxd n LEU 72 N 2.76 1.51 -4.31 2.97 7.94 -1.26 -4.93 117.00 121.68 1xxd n LEU 72 Ca -0.18 0.25 -0.35 0.00 -1.11 0.00 0.00 56.01 54.62 1xxd n LEU 72 Cb 0.52 -0.58 -0.14 0.00 0.53 0.00 0.00 43.42 43.75 1xxd n LEU 72 CO 0.28 -0.01 -0.38 0.20 -1.11 0.00 0.00 177.39 176.36 1xxd s ASN 73 N -6.32 4.37 0.31 1.96 0.02 -1.23 -1.75 114.94 112.30 1xxd s ASN 73 Ca -0.23 -0.41 0.20 0.00 -1.02 0.00 0.00 52.86 51.40 1xxd s ASN 73 Cb 0.06 -1.75 1.09 0.00 0.02 0.00 0.00 41.25 40.68 1xxd s ASN 73 CO 0.31 -0.03 1.21 0.00 0.02 0.00 0.00 177.10 178.62 1xxd n GLN 74 N 4.80 -0.04 0.01 -0.60 1.13 -0.57 0.49 117.38 122.59 1xxd n GLN 74 Ca -0.18 1.02 -0.12 0.00 -1.94 0.00 0.00 57.00 55.78 1xxd n GLN 74 Cb 0.51 -1.91 -0.06 0.00 0.11 0.00 0.00 30.24 28.89 1xxd n GLN 74 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1xxd h ALA 75 N 1.40 -0.54 -0.76 -1.58 0.00 -1.94 -1.98 119.26 113.86 1xxd h ALA 75 Ca 0.67 -0.00 0.29 0.00 0.00 0.00 0.00 54.91 55.87 1xxd h ALA 75 Cb 1.95 0.74 -0.11 0.00 0.00 0.00 0.00 17.79 20.37 1xxd h ALA 75 CO -0.49 -0.89 0.45 0.39 0.00 0.00 0.00 179.25 178.71 1xxd n GLU 76 N -5.43 -0.03 -2.10 0.00 1.02 0.18 -3.61 120.64 110.66 1xxd n GLU 76 Ca -0.04 0.88 -0.34 0.00 -0.02 0.00 0.00 57.16 57.64 1xxd n GLU 76 Cb 0.35 -1.64 -0.04 0.00 -0.02 0.00 0.00 31.44 30.09 1xxd n GLU 76 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1xxd s ILE 77 N -4.89 3.44 0.00 -3.67 1.01 -0.74 -4.90 121.20 111.44 1xxd s ILE 77 Ca -0.06 -0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.56 1xxd s ILE 77 Cb 0.22 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 38.61 1xxd s ILE 77 CO 0.53 -1.03 0.00 0.29 0.00 0.00 0.00 174.94 174.72 1xxd n LYS 78 N 9.07 3.74 -0.02 2.79 5.02 -1.24 -5.00 118.16 132.52 1xxd n LYS 78 Ca 0.27 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.54 1xxd n LYS 78 Cb 0.50 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 35.39 1xxd n LYS 78 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1xxd n GLU 79 N 0.00 0.65 -0.74 1.97 2.13 -1.26 -4.13 120.64 119.25 1xxd n GLU 79 Ca 0.00 0.10 0.08 0.00 0.66 0.00 0.00 57.16 58.00 1xxd n GLU 79 Cb 0.00 -1.68 0.38 0.00 0.27 0.00 0.00 31.44 30.41 1xxd n GLU 79 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 1xxd n ASP 80 N -2.77 5.19 -4.63 4.31 5.75 -1.26 -4.94 116.55 118.21 1xxd n ASP 80 Ca -0.16 -2.69 -0.40 0.00 -0.01 0.00 0.00 54.79 51.53 1xxd n ASP 80 Cb 0.91 -0.63 -0.07 0.00 -1.03 0.00 0.00 41.12 40.30 1xxd n ASP 80 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1xxd s THR 81 N -2.30 5.04 0.42 2.12 2.01 -1.26 -5.04 115.64 116.63 1xxd s THR 81 Ca 0.53 1.01 -0.25 0.00 0.31 0.00 0.00 61.69 63.28 1xxd s THR 81 Cb 0.37 -3.88 -0.08 0.00 0.01 0.00 0.00 72.50 68.92 1xxd s THR 81 CO 0.20 0.09 1.25 -0.94 -0.69 0.00 0.00 174.62 174.53 1xxd s SER 81 N 1.41 6.28 0.23 3.53 1.04 -1.26 -4.89 113.70 120.04 1xxd s SER 81 Ca 0.24 2.54 -0.05 0.00 0.48 0.00 0.00 55.95 59.16 1xxd s SER 81 Cb -0.16 -2.63 -0.02 0.00 0.10 0.00 0.00 66.02 63.31 1xxd s SER 81 CO 0.09 -0.86 0.28 0.72 0.98 0.00 0.00 173.24 174.46 1xxd s PHE 82 N -1.33 0.86 -0.02 5.02 -0.12 -1.26 -4.88 117.98 116.24 1xxd s PHE 82 Ca 0.59 -1.13 -0.07 0.00 -0.05 0.00 0.00 56.93 56.27 1xxd s PHE 82 Cb -0.35 -0.25 -0.05 0.00 -0.63 0.00 0.00 43.02 41.74 1xxd s PHE 82 CO 0.44 -0.80 0.25 -0.06 -0.05 0.00 0.00 175.22 175.00 1xxd s PHE 83 N -4.04 3.59 0.13 3.49 0.08 -0.74 -4.97 117.98 115.52 1xxd s PHE 83 Ca 0.32 0.59 0.00 0.00 0.12 0.00 0.00 56.93 57.96 1xxd s PHE 83 Cb 0.04 -1.99 -0.04 0.00 -0.57 0.00 0.00 43.02 40.45 1xxd s PHE 83 CO 0.12 0.64 0.30 0.20 -0.10 0.00 0.00 175.22 176.38 1xxd s GLY 84 N -1.53 1.93 -0.23 4.36 0.00 -1.26 -2.08 107.32 108.51 1xxd s GLY 84 Ca 0.25 -0.87 -0.18 0.00 0.00 0.00 0.00 44.72 43.92 1xxd s GLY 84 CO 0.14 -0.85 0.50 0.14 0.00 0.00 0.00 173.10 173.03 1xxd s VAL 85 N -1.69 5.10 -0.15 1.40 1.01 -1.26 -0.83 120.40 123.98 1xxd s VAL 85 Ca 0.36 0.89 -0.17 0.00 0.00 0.00 0.00 61.98 63.06 1xxd s VAL 85 Cb -0.12 -3.82 -0.24 0.00 0.00 0.00 0.00 36.38 32.20 1xxd s VAL 85 CO 0.28 0.14 0.42 -0.61 0.00 0.00 0.00 175.10 175.33 1xxd h GLN 86 N 7.72 0.14 -3.11 2.72 4.15 -0.98 -3.41 115.11 122.34 1xxd h GLN 86 Ca -0.32 -0.24 -0.18 0.00 0.77 0.00 0.00 58.65 58.68 1xxd h GLN 86 Cb 1.15 0.09 -0.28 0.00 0.21 0.00 0.00 27.48 28.65 1xxd h GLN 86 CO 0.72 1.12 -0.47 -2.00 -1.93 0.00 0.00 178.83 176.27 1xxd s GLU 87 N -2.43 0.23 -0.54 1.69 2.12 -1.08 -4.95 118.70 113.73 1xxd s GLU 87 Ca -0.23 0.42 -0.14 0.00 0.36 0.00 0.00 54.97 55.37 1xxd s GLU 87 Cb 0.05 0.00 0.13 0.00 0.26 0.00 0.00 34.13 34.58 1xxd s GLU 87 CO 0.70 -0.10 0.48 0.42 -0.54 0.00 0.00 175.26 176.22 1xxd s ILE 88 N 0.68 4.94 -0.40 -3.70 1.01 -1.26 -0.85 121.20 121.63 1xxd s ILE 88 Ca -0.05 -1.67 -0.18 0.00 0.00 0.00 0.00 60.65 58.76 1xxd s ILE 88 Cb -0.06 -4.18 0.01 0.00 0.01 0.00 0.00 42.46 38.24 1xxd s ILE 88 CO -0.04 -0.86 0.50 -0.63 0.00 0.00 0.00 174.94 173.92 1xxd s ILE 89 N 1.41 5.01 -0.09 2.92 1.01 0.63 -4.96 121.20 127.14 1xxd s ILE 89 Ca 0.05 0.00 0.02 0.00 0.00 0.00 0.00 60.65 60.72 1xxd s ILE 89 Cb -0.27 -4.04 -0.02 0.00 0.01 0.00 0.00 42.46 38.14 1xxd s ILE 89 CO 0.01 -0.37 -0.14 -0.63 0.00 0.00 0.00 174.94 173.81 1xxd s ILE 90 N 2.37 3.02 -0.22 2.92 1.01 -1.26 0.59 121.20 129.63 1xxd s ILE 90 Ca 0.17 -0.71 -0.38 0.00 0.00 0.00 0.00 60.65 59.73 1xxd s ILE 90 Cb -0.16 -2.22 -0.14 0.00 0.01 0.00 0.00 42.46 39.95 1xxd s ILE 90 CO 0.15 0.56 1.79 1.57 0.00 0.00 0.00 174.94 179.01 1xxd n HIS 91 N 2.88 2.15 0.02 3.97 -0.00 -1.14 -4.82 115.22 118.28 1xxd n HIS 91 Ca -0.18 0.36 0.01 0.00 -0.00 0.00 0.00 57.72 57.91 1xxd n HIS 91 Cb 0.52 -2.53 0.05 0.00 -0.00 0.00 0.00 29.99 28.04 1xxd n HIS 91 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 1xxd n ASP 92 N 5.79 0.05 -0.63 0.26 8.00 -1.26 -0.06 116.55 128.70 1xxd n ASP 92 Ca 0.25 0.46 0.12 0.00 0.71 0.00 0.00 54.79 56.33 1xxd n ASP 92 Cb 0.18 -0.46 0.06 0.00 -0.02 0.00 0.00 41.12 40.88 1xxd n ASP 92 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xxd n GLN 93 N -1.51 1.56 -2.28 -1.24 6.02 -1.26 -4.94 117.38 113.73 1xxd n GLN 93 Ca -0.00 -1.27 -0.42 0.00 -0.01 0.00 0.00 57.00 55.29 1xxd n GLN 93 Cb 0.07 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 29.83 1xxd n GLN 93 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1xxd s TYR 94 N -2.32 3.06 0.00 1.08 5.04 0.92 -4.85 117.35 120.29 1xxd s TYR 94 Ca 0.22 0.97 0.00 0.00 -2.44 0.00 0.00 57.07 55.82 1xxd s TYR 94 Cb 0.19 -3.60 0.00 0.00 0.35 0.00 0.00 41.96 38.90 1xxd s TYR 94 CO 0.48 -2.10 0.00 1.17 -1.34 0.00 0.00 175.55 173.76 1xxd n LYS 95 N 4.85 0.59 -3.63 4.97 4.81 -1.26 -5.01 118.16 123.48 1xxd n LYS 95 Ca 0.12 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.51 1xxd n LYS 95 Cb 0.44 -0.62 -0.06 0.00 0.02 0.00 0.00 35.03 34.80 1xxd n LYS 95 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 1xxd s MET 96 N -1.25 0.56 0.19 1.64 -1.94 -1.26 -5.06 119.30 112.18 1xxd s MET 96 Ca 0.00 1.02 -0.26 0.00 -1.71 0.00 0.00 55.69 54.75 1xxd s MET 96 Cb 0.00 0.20 0.05 0.00 2.01 0.00 0.00 34.83 37.09 1xxd s MET 96 CO 0.00 -0.13 1.54 0.00 -0.01 0.00 0.00 175.02 176.43 1xxd h ALA 97 N 6.79 -0.27 0.00 3.03 0.00 -1.96 0.89 119.26 127.74 1xxd h ALA 97 Ca -0.28 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1xxd h ALA 97 Cb 1.20 1.23 0.00 0.00 0.00 0.00 0.00 17.79 20.22 1xxd h ALA 97 CO 0.16 -0.83 0.28 0.93 0.00 0.00 0.00 179.25 179.79 1xxd h GLU 98 N -0.01 0.00 0.00 0.00 3.07 -1.97 0.41 114.58 116.08 1xxd h GLU 98 Ca 0.23 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.09 1xxd h GLU 98 Cb 0.49 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.40 1xxd h GLU 98 CO -0.95 0.00 -1.43 0.43 -1.40 0.00 0.00 179.01 175.65 1xxd n SER 99 N -2.82 0.45 0.00 1.42 7.64 0.30 -4.84 113.62 115.76 1xxd n SER 99 Ca -0.02 0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.93 1xxd n SER 99 Cb 0.33 1.18 0.00 0.00 -1.01 0.00 0.00 64.21 64.71 1xxd n SER 99 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xxd n GLY 100 N 1.25 -1.49 2.41 0.23 0.00 0.14 -4.98 105.19 102.75 1xxd n GLY 100 Ca -0.01 -2.22 -0.13 0.00 0.00 0.00 0.00 46.02 43.65 1xxd n GLY 100 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1xxd n TYR 101 N -0.44 0.00 -1.56 1.61 4.02 -1.26 -4.47 117.16 115.06 1xxd n TYR 101 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 1xxd n TYR 101 Cb 0.00 -2.43 -0.01 0.00 -0.02 0.00 0.00 39.34 36.88 1xxd n TYR 101 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1xxd n ASP 102 N -0.25 4.01 -3.74 7.72 -0.08 -1.26 -4.49 116.55 118.46 1xxd n ASP 102 Ca -0.13 -2.77 -0.13 0.00 -1.51 0.00 0.00 54.79 50.24 1xxd n ASP 102 Cb 0.45 -1.53 -0.09 0.00 2.34 0.00 0.00 41.12 42.29 1xxd n ASP 102 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1xxd s ILE 103 N 3.48 0.02 0.03 5.18 2.07 -1.26 -3.59 121.20 127.14 1xxd s ILE 103 Ca 0.51 -0.19 -0.28 0.00 -1.41 0.00 0.00 60.65 59.28 1xxd s ILE 103 Cb 0.14 -0.59 0.07 0.00 0.13 0.00 0.00 42.46 42.22 1xxd s ILE 103 CO -0.04 -0.10 0.66 0.00 -1.91 0.00 0.00 174.94 173.54 1xxd s ALA 104 N -0.47 -1.71 0.05 1.50 0.00 -0.30 -2.89 121.76 117.93 1xxd s ALA 104 Ca -0.06 1.00 0.03 0.00 0.00 0.00 0.00 51.96 52.92 1xxd s ALA 104 Cb -0.04 0.34 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 1xxd s ALA 104 CO 0.02 -0.53 0.04 -0.51 0.00 0.00 0.00 175.76 174.78 1xxd s LEU 105 N -1.83 3.65 -0.21 0.00 1.43 0.20 -1.36 118.68 120.56 1xxd s LEU 105 Ca -0.06 -0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.02 1xxd s LEU 105 Cb -0.00 -2.26 0.03 0.00 0.03 0.00 0.00 46.19 43.99 1xxd s LEU 105 CO 0.00 0.21 -0.16 -0.76 0.23 0.00 0.00 176.35 175.88 1xxd s LEU 106 N -2.08 2.63 -0.58 1.79 1.43 -0.35 -0.27 118.68 121.24 1xxd s LEU 106 Ca 0.25 -0.89 -0.22 0.00 -1.03 0.00 0.00 54.13 52.24 1xxd s LEU 106 Cb -0.12 -1.52 0.06 0.00 0.03 0.00 0.00 46.19 44.64 1xxd s LEU 106 CO 0.17 -0.07 0.86 -0.75 0.23 0.00 0.00 176.35 176.79 1xxd s LYS 107 N 1.24 3.18 0.55 1.70 2.20 -0.02 -2.11 119.74 126.47 1xxd s LYS 107 Ca 0.00 -0.70 -0.21 0.00 -0.36 0.00 0.00 55.97 54.70 1xxd s LYS 107 Cb -0.15 -4.15 -0.05 0.00 -1.51 0.00 0.00 37.83 31.97 1xxd s LYS 107 CO -0.10 -1.56 1.27 -0.51 -0.36 0.00 0.00 175.35 174.10 1xxd s LEU 108 N 3.59 3.81 0.40 5.43 1.43 0.41 -0.38 118.68 133.38 1xxd s LEU 108 Ca 0.22 2.56 0.17 0.00 -1.03 0.00 0.00 54.13 56.06 1xxd s LEU 108 Cb -0.17 -4.38 0.87 0.00 0.03 0.00 0.00 46.19 42.54 1xxd s LEU 108 CO 0.13 -1.48 1.86 -0.33 0.23 0.00 0.00 176.35 176.76 1xxd h GLU 109 N 1.36 0.00 -4.46 1.70 5.08 -1.31 -3.43 114.58 113.52 1xxd h GLU 109 Ca -0.50 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 57.60 1xxd h GLU 109 Cb 1.29 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.33 1xxd h GLU 109 CO 0.57 0.32 -0.73 -0.08 -1.00 0.00 0.00 179.01 178.09 1xxd s THR 110 N -4.04 0.47 1.36 1.13 -1.32 -1.26 -5.04 115.64 106.93 1xxd s THR 110 Ca -0.02 -1.01 -0.20 0.00 -1.21 0.00 0.00 61.69 59.24 1xxd s THR 110 Cb 0.13 -0.54 0.35 0.00 -1.51 0.00 0.00 72.50 70.93 1xxd s THR 110 CO 0.68 -0.38 0.96 0.42 -2.21 0.00 0.00 174.62 174.09 1xxd s THR 111 N -1.33 1.42 -0.21 5.08 -4.23 -1.26 -4.80 115.64 110.31 1xxd s THR 111 Ca -0.10 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 60.42 1xxd s THR 111 Cb -0.10 -2.08 0.04 0.00 1.34 0.00 0.00 72.50 71.71 1xxd s THR 111 CO 0.00 0.00 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.28 1xxd s VAL 112 N -2.34 1.78 -0.36 2.29 1.01 0.13 -4.95 120.40 117.95 1xxd s VAL 112 Ca 0.69 -1.11 -0.27 0.00 0.00 0.00 0.00 61.98 61.28 1xxd s VAL 112 Cb -0.16 -1.83 -0.06 0.00 0.00 0.00 0.00 36.38 34.32 1xxd s VAL 112 CO 0.60 0.17 2.33 0.59 0.00 0.00 0.00 175.10 178.78 1xxd n ASN 113 N 4.63 2.75 -4.73 3.32 4.13 -1.26 -4.87 115.26 119.23 1xxd n ASN 113 Ca -0.15 -0.16 -0.42 0.00 1.68 0.00 0.00 54.58 55.53 1xxd n ASN 113 Cb 0.46 -1.57 -0.02 0.00 -1.54 0.00 0.00 39.78 37.11 1xxd n ASN 113 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1xxd n TYR 114 N 13.86 2.81 -3.49 3.10 4.01 -1.26 -4.85 117.16 131.33 1xxd n TYR 114 Ca 0.34 0.17 -0.11 0.00 -0.16 0.00 0.00 57.90 58.13 1xxd n TYR 114 Cb 0.49 -2.63 -0.03 0.00 -0.31 0.00 0.00 39.34 36.87 1xxd n TYR 114 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1xxd s ALA 115 N 0.46 -1.38 0.39 -0.72 0.00 -0.92 -4.98 121.76 114.60 1xxd s ALA 115 Ca 0.69 0.31 0.20 0.00 0.00 0.00 0.00 51.96 53.16 1xxd s ALA 115 Cb -0.50 0.83 1.10 0.00 0.00 0.00 0.00 23.12 24.54 1xxd s ALA 115 CO 0.42 -0.73 1.57 0.22 0.00 0.00 0.00 175.76 177.24 1xxd h ASP 116 N 2.11 0.00 0.40 0.00 -0.00 -1.99 0.91 116.42 117.86 1xxd h ASP 116 Ca -0.34 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.69 1xxd h ASP 116 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.62 1xxd h ASP 116 CO 0.41 0.00 -1.55 -1.20 -0.00 0.00 0.00 179.24 176.89 1xxd n SER 117 N -2.49 0.37 -3.41 2.28 7.64 -1.26 -4.43 113.62 112.32 1xxd n SER 117 Ca -0.01 0.10 -0.23 0.00 1.01 0.00 0.00 58.87 59.73 1xxd n SER 117 Cb 0.41 1.33 -0.10 0.00 -1.01 0.00 0.00 64.21 64.84 1xxd n SER 117 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xxd s GLN 118 N -3.43 0.58 0.11 1.43 -2.07 0.31 -3.87 119.66 112.72 1xxd s GLN 118 Ca -0.04 -1.07 0.09 0.00 -1.82 0.00 0.00 55.36 52.52 1xxd s GLN 118 Cb 0.12 -1.01 -0.04 0.00 -1.09 0.00 0.00 33.01 31.00 1xxd s GLN 118 CO 0.86 -1.20 -0.22 1.03 -1.32 0.00 0.00 175.29 174.44 1xxd s ARG 119 N 1.29 1.18 0.47 9.60 0.52 0.80 -2.18 118.95 130.63 1xxd s ARG 119 Ca 0.17 -1.21 -0.20 0.00 -0.52 0.00 0.00 55.73 53.97 1xxd s ARG 119 Cb -0.19 -1.47 -0.09 0.00 0.52 0.00 0.00 34.95 33.71 1xxd s ARG 119 CO -0.02 0.34 1.00 -1.25 0.02 0.00 0.00 175.30 175.39 1xxd s PRO 121 N -2.00 3.95 -0.10 3.54 0.04 -1.26 -2.83 135.00 136.34 1xxd s PRO 121 Ca 0.08 1.25 -0.04 0.00 0.04 0.00 0.00 61.00 62.33 1xxd s PRO 121 Cb -0.10 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 1xxd s PRO 121 CO 0.05 -0.29 0.06 -1.50 0.04 0.00 0.00 177.00 175.36 1xxd s ILE 122 N -2.10 4.84 0.04 0.56 2.07 0.40 -4.94 121.20 122.05 1xxd s ILE 122 Ca 0.65 -0.05 -0.30 0.00 -1.41 0.00 0.00 60.65 59.54 1xxd s ILE 122 Cb -0.13 -3.07 -0.05 0.00 0.13 0.00 0.00 42.46 39.33 1xxd s ILE 122 CO 0.18 0.61 1.21 0.00 -1.91 0.00 0.00 174.94 175.03 1xxd s LEU 124 N 1.32 3.42 0.86 0.00 1.43 -1.26 -1.65 118.68 122.80 1xxd s LEU 124 Ca 0.58 1.34 -0.13 0.00 -1.03 0.00 0.00 54.13 54.90 1xxd s LEU 124 Cb -0.29 -4.34 0.07 0.00 0.03 0.00 0.00 46.19 41.66 1xxd s LEU 124 CO 0.28 -0.73 0.91 -2.65 0.23 0.00 0.00 176.35 174.39 1xxd n PRO 125 N -2.33 -0.09 -1.77 1.29 -0.02 -1.26 -4.84 135.00 125.98 1xxd n PRO 125 Ca 0.05 0.04 -0.29 0.00 -2.02 0.00 0.00 63.50 61.28 1xxd n PRO 125 Cb 0.54 -2.20 0.10 0.00 -0.02 0.00 0.00 33.50 31.92 1xxd n PRO 125 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1xxd s SER 126 N -2.15 4.27 0.02 2.55 0.01 -1.26 -4.93 113.70 112.21 1xxd s SER 126 Ca 0.67 0.90 0.26 0.00 1.31 0.00 0.00 55.95 59.08 1xxd s SER 126 Cb -0.26 -1.45 1.10 0.00 0.21 0.00 0.00 66.02 65.61 1xxd s SER 126 CO 0.58 -2.07 1.83 2.29 0.41 0.00 0.00 173.24 176.28 1xxd n LYS 127 N -3.44 0.02 -0.13 12.44 2.85 -1.26 -2.94 118.16 125.70 1xxd n LYS 127 Ca 0.07 0.07 0.09 0.00 -1.05 0.00 0.00 58.31 57.49 1xxd n LYS 127 Cb 0.60 -1.53 0.16 0.00 -0.65 0.00 0.00 35.03 33.61 1xxd n LYS 127 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1xxd n GLY 128 N 1.20 1.43 2.60 2.58 0.00 -1.26 -4.54 105.19 107.19 1xxd n GLY 128 Ca 0.06 -0.58 -0.36 0.00 0.00 0.00 0.00 46.02 45.14 1xxd n GLY 128 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1xxd n ASP 129 N 1.13 7.45 0.01 1.61 8.00 -1.15 -4.52 116.55 129.09 1xxd n ASP 129 Ca 0.15 -3.72 0.13 0.00 0.71 0.00 0.00 54.79 52.05 1xxd n ASP 129 Cb 0.51 -1.05 0.35 0.00 -0.02 0.00 0.00 41.12 40.91 1xxd n ASP 129 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1xxd n ARG 130 N -0.51 0.04 -0.13 -1.24 1.74 -1.26 -3.91 116.66 111.39 1xxd n ARG 130 Ca 0.56 0.02 0.02 0.00 -0.77 0.00 0.00 57.85 57.67 1xxd n ARG 130 Cb 0.44 -1.53 0.03 0.00 -1.02 0.00 0.00 32.46 30.38 1xxd n ARG 130 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1xxd n ASN 131 N -1.60 1.01 -4.77 0.55 3.02 -1.26 -5.08 115.26 107.13 1xxd n ASN 131 Ca 0.06 -1.94 -0.35 0.00 -0.03 0.00 0.00 54.58 52.32 1xxd n ASN 131 Cb 0.35 -0.14 0.00 0.00 -0.61 0.00 0.00 39.78 39.39 1xxd n ASN 131 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1xxd s VAL 132 N -0.86 3.14 -0.16 2.41 0.11 -1.25 -5.04 120.40 118.74 1xxd s VAL 132 Ca 0.07 0.71 -0.02 0.00 -2.93 0.00 0.00 61.98 59.80 1xxd s VAL 132 Cb 0.06 -3.28 -0.02 0.00 -1.53 0.00 0.00 36.38 31.61 1xxd s VAL 132 CO 0.01 -0.16 -0.07 -0.63 -3.33 0.00 0.00 175.10 170.91 1xxd s ILE 132 N -1.78 3.47 -0.12 7.04 1.09 -1.26 -5.11 121.20 124.53 1xxd s ILE 132 Ca 0.73 -0.50 -0.04 0.00 -1.10 0.00 0.00 60.65 59.73 1xxd s ILE 132 Cb -0.24 -2.51 -0.04 0.00 -1.06 0.00 0.00 42.46 38.61 1xxd s ILE 132 CO 0.28 0.49 0.05 -0.31 -0.10 0.00 0.00 174.94 175.34 1xxd s TYR 133 N 0.59 3.27 -0.05 3.97 2.02 -1.26 -5.01 117.35 120.88 1xxd s TYR 133 Ca -0.05 0.22 0.08 0.00 -0.37 0.00 0.00 57.07 56.95 1xxd s TYR 133 Cb -0.15 -1.90 -0.12 0.00 -0.40 0.00 0.00 41.96 39.39 1xxd s TYR 133 CO 0.03 0.43 0.19 0.25 -1.57 0.00 0.00 175.55 174.88 1xxd n THR 134 N 2.50 0.00 -3.80 -0.71 -2.24 -1.26 -4.68 114.28 104.09 1xxd n THR 134 Ca -0.18 -0.20 -0.29 0.00 -2.27 0.00 0.00 64.05 61.11 1xxd n THR 134 Cb 0.54 0.39 -0.12 0.00 -2.10 0.00 0.00 70.33 69.03 1xxd n THR 134 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xxd s ASP 135 N -2.80 4.02 0.15 3.42 2.15 -1.26 -4.98 116.67 117.36 1xxd s ASP 135 Ca -0.02 -3.32 0.10 0.00 0.43 0.00 0.00 52.55 49.74 1xxd s ASP 135 Cb 0.05 -1.35 -0.04 0.00 -0.30 0.00 0.00 42.92 41.28 1xxd s ASP 135 CO 0.33 -0.16 -0.23 0.00 -0.17 0.00 0.00 175.17 174.94 1xxd s TRP 137 N -1.29 1.13 -0.11 0.00 0.52 0.26 -2.35 118.94 117.10 1xxd s TRP 137 Ca 0.17 -1.10 -0.02 0.00 0.02 0.00 0.00 56.10 55.17 1xxd s TRP 137 Cb -0.09 -0.64 0.04 0.00 -1.15 0.00 0.00 33.47 31.62 1xxd s TRP 137 CO 0.09 -0.32 0.00 0.14 0.02 0.00 0.00 176.95 176.88 1xxd s VAL 138 N -3.79 0.48 0.19 4.03 -7.23 0.11 -2.50 120.40 111.69 1xxd s VAL 138 Ca 0.25 -0.12 0.09 0.00 -1.81 0.00 0.00 61.98 60.38 1xxd s VAL 138 Cb 0.07 -0.73 -0.04 0.00 0.56 0.00 0.00 36.38 36.23 1xxd s VAL 138 CO 0.04 0.13 -0.07 0.42 -0.31 0.00 0.00 175.10 175.30 1xxd s THR 139 N 1.91 3.28 0.00 5.32 -4.23 -1.25 -1.78 115.64 118.89 1xxd s THR 139 Ca 0.03 -1.66 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 1xxd s THR 139 Cb -0.14 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.06 1xxd s THR 139 CO -0.06 -0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.48 1xxd n GLY 140 N -0.09 1.91 1.95 3.99 0.00 -0.86 -4.43 105.19 107.65 1xxd n GLY 140 Ca -0.10 -1.06 -0.21 0.00 0.00 0.00 0.00 46.02 44.65 1xxd n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1xxd n TRP 141 N -0.88 2.54 -0.75 1.61 8.01 -1.26 -1.47 117.44 125.24 1xxd n TRP 141 Ca 0.00 -2.13 -0.08 0.00 -1.31 0.00 0.00 57.50 53.98 1xxd n TRP 141 Cb 0.00 -0.90 0.07 0.00 -2.01 0.00 0.00 31.31 28.47 1xxd n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1xxd n GLY 142 N -1.04 -2.34 3.78 6.99 0.00 -1.25 -1.97 105.19 109.36 1xxd n GLY 142 Ca 0.52 -1.49 -0.37 0.00 0.00 0.00 0.00 46.02 44.68 1xxd n GLY 142 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xxd s TYR 143 N -1.60 3.30 -2.12 1.61 1.51 0.27 -2.47 117.35 117.85 1xxd s TYR 143 Ca 0.20 1.65 0.26 0.00 -1.01 0.00 0.00 57.07 58.17 1xxd s TYR 143 Cb -0.02 -3.13 0.63 0.00 -0.11 0.00 0.00 41.96 39.33 1xxd s TYR 143 CO 0.15 -0.60 1.49 0.54 -1.11 0.00 0.00 175.55 176.02 1xxd n ARG 144 N 0.04 1.26 -3.51 -0.62 1.74 -1.26 -2.04 116.66 112.27 1xxd n ARG 144 Ca 0.04 -0.85 0.02 0.00 -0.77 0.00 0.00 57.85 56.29 1xxd n ARG 144 Cb 0.49 -1.48 -0.05 0.00 -1.02 0.00 0.00 32.46 30.40 1xxd n ARG 144 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 1xxd s LYS 145 N -2.32 0.11 0.00 5.56 -2.85 -1.26 -4.47 119.74 114.51 1xxd s LYS 145 Ca 0.27 0.22 0.00 0.00 -1.00 0.00 0.00 55.97 55.46 1xxd s LYS 145 Cb 0.20 0.07 0.00 0.00 -2.06 0.00 0.00 37.83 36.03 1xxd s LYS 145 CO 0.46 -0.03 0.00 1.28 0.10 0.00 0.00 175.35 177.16 1xxd n LEU 146 N 3.71 0.00 -4.31 2.77 4.32 -1.26 -0.69 117.00 121.55 1xxd n LEU 146 Ca -0.14 0.00 -0.44 0.00 -0.02 0.00 0.00 56.01 55.41 1xxd n LEU 146 Cb 0.56 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.36 1xxd n LEU 146 CO 0.02 0.00 1.45 -1.14 -1.22 0.00 0.00 177.39 176.50 1xxd n ARG 147 N -0.46 3.48 0.00 3.23 0.63 -1.26 -4.92 116.66 117.37 1xxd n ARG 147 Ca 0.00 -3.87 0.00 0.00 -0.92 0.00 0.00 57.85 53.06 1xxd n ARG 147 Cb 0.00 -2.95 0.00 0.00 0.45 0.00 0.00 32.46 29.96 1xxd n ARG 147 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1xxd n ASP 148 N 4.83 0.00 -3.65 6.15 -0.08 0.14 -5.04 116.55 118.90 1xxd n ASP 148 Ca 0.36 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.54 1xxd n ASP 148 Cb 0.41 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.79 1xxd n ASP 148 CO 0.00 0.00 0.00 -0.75 0.12 0.00 0.00 177.20 176.57 1xxd s LYS 149 N 4.76 0.71 -0.40 -0.67 2.20 -1.26 -5.04 119.74 120.04 1xxd s LYS 149 Ca 0.00 1.09 -0.36 0.00 -0.36 0.00 0.00 55.97 56.35 1xxd s LYS 149 Cb 0.00 0.21 -0.15 0.00 -1.51 0.00 0.00 37.83 36.38 1xxd s LYS 149 CO 0.00 -0.13 1.67 -0.89 -0.36 0.00 0.00 175.35 175.64 1xxd n ILE 151 N 3.75 0.00 -1.32 5.43 5.41 -1.26 -4.76 119.36 126.60 1xxd n ILE 151 Ca -0.18 0.00 -0.36 0.00 1.00 0.00 0.00 62.75 63.21 1xxd n ILE 151 Cb 0.57 -0.40 0.08 0.00 -0.71 0.00 0.00 39.64 39.18 1xxd n ILE 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1xxd n GLN 152 N 5.74 0.43 -0.02 0.38 1.13 -0.83 -4.95 117.38 119.25 1xxd n GLN 152 Ca 0.42 0.20 -0.17 0.00 -1.94 0.00 0.00 57.00 55.51 1xxd n GLN 152 Cb -0.03 -2.06 -0.14 0.00 0.11 0.00 0.00 30.24 28.12 1xxd n GLN 152 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1xxd n ASN 153 N -1.10 1.66 -4.43 1.08 5.15 -1.26 -4.67 115.26 111.70 1xxd n ASN 153 Ca 0.12 0.23 -0.37 0.00 -0.60 0.00 0.00 54.58 53.96 1xxd n ASN 153 Cb 0.49 -0.51 -0.12 0.00 -0.53 0.00 0.00 39.78 39.11 1xxd n ASN 153 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1xxd s THR 154 N -2.56 4.33 -0.27 -0.44 2.01 -1.26 -1.52 115.64 115.94 1xxd s THR 154 Ca -0.18 -0.33 -0.33 0.00 0.31 0.00 0.00 61.69 61.16 1xxd s THR 154 Cb 0.07 -3.12 -0.15 0.00 0.01 0.00 0.00 72.50 69.32 1xxd s THR 154 CO 0.77 0.22 1.07 -0.11 -0.69 0.00 0.00 174.62 175.88 1xxd n LEU 155 N 4.93 0.64 -4.93 4.42 7.94 -0.72 -4.72 117.00 124.56 1xxd n LEU 155 Ca -0.15 0.87 -0.26 0.00 -1.11 0.00 0.00 56.01 55.36 1xxd n LEU 155 Cb 0.50 -0.65 -0.02 0.00 0.53 0.00 0.00 43.42 43.77 1xxd n LEU 155 CO 0.32 -0.83 0.08 -1.58 -1.11 0.00 0.00 177.39 174.27 1xxd s GLN 156 N 1.60 3.51 -0.07 1.96 2.00 -0.54 -1.07 119.66 127.05 1xxd s GLN 156 Ca 0.74 -0.35 -0.03 0.00 -2.00 0.00 0.00 55.36 53.73 1xxd s GLN 156 Cb -1.06 -2.77 0.04 0.00 0.80 0.00 0.00 33.01 30.03 1xxd s GLN 156 CO 0.55 0.31 0.16 -1.59 -0.50 0.00 0.00 175.29 174.21 1xxd s LYS 157 N -3.73 0.09 -0.01 1.67 -2.85 0.21 -2.03 119.74 113.10 1xxd s LYS 157 Ca 0.39 0.43 0.01 0.00 -1.00 0.00 0.00 55.97 55.80 1xxd s LYS 157 Cb -0.10 -0.19 -0.00 0.00 -2.06 0.00 0.00 37.83 35.47 1xxd s LYS 157 CO 0.31 -0.20 -0.04 0.00 0.10 0.00 0.00 175.35 175.53 1xxd s ALA 158 N 1.43 0.36 -0.26 0.59 0.00 -0.73 -0.10 121.76 123.05 1xxd s ALA 158 Ca -0.07 -0.15 -0.20 0.00 0.00 0.00 0.00 51.96 51.54 1xxd s ALA 158 Cb -0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 1xxd s ALA 158 CO -0.06 0.07 0.64 0.21 0.00 0.00 0.00 175.76 176.62 1xxd s LYS 159 N 0.01 4.09 -0.11 0.00 2.20 -1.26 0.07 119.74 124.74 1xxd s LYS 159 Ca 0.00 0.54 0.00 0.00 -0.36 0.00 0.00 55.97 56.16 1xxd s LYS 159 Cb -0.03 -3.66 0.02 0.00 -1.51 0.00 0.00 37.83 32.65 1xxd s LYS 159 CO -0.00 -0.43 -0.11 0.42 -0.36 0.00 0.00 175.35 174.87 1xxd s ILE 160 N 2.53 1.23 0.19 5.43 1.01 -0.99 -4.99 121.20 125.60 1xxd s ILE 160 Ca 0.26 -0.44 -0.31 0.00 0.00 0.00 0.00 60.65 60.16 1xxd s ILE 160 Cb -0.15 -1.19 -0.11 0.00 0.01 0.00 0.00 42.46 41.02 1xxd s ILE 160 CO 0.09 0.40 1.59 -2.16 0.00 0.00 0.00 174.94 174.85 1xxd s PRO 161 N 1.42 4.20 0.59 2.79 0.04 -1.26 -4.61 135.00 138.16 1xxd s PRO 161 Ca 0.01 2.42 -0.18 0.00 0.04 0.00 0.00 61.00 63.29 1xxd s PRO 161 Cb -0.13 -3.13 -0.04 0.00 0.04 0.00 0.00 34.50 31.24 1xxd s PRO 161 CO -0.06 -0.62 1.12 -0.51 0.04 0.00 0.00 177.00 176.96 1xxd s LEU 162 N 0.93 3.61 0.12 -3.56 1.02 -1.26 -1.86 118.68 117.67 1xxd s LEU 162 Ca 0.70 2.09 0.09 0.00 0.02 0.00 0.00 54.13 57.03 1xxd s LEU 162 Cb -0.45 -4.57 -0.04 0.00 0.02 0.00 0.00 46.19 41.15 1xxd s LEU 162 CO 0.33 -1.35 -0.22 0.68 0.02 0.00 0.00 176.35 175.81 1xxd s VAL 163 N -2.01 1.87 0.53 -1.59 -7.23 -0.54 -4.87 120.40 106.56 1xxd s VAL 163 Ca 0.70 -1.66 -0.20 0.00 -1.81 0.00 0.00 61.98 59.01 1xxd s VAL 163 Cb -0.22 -1.71 -0.06 0.00 0.56 0.00 0.00 36.38 34.94 1xxd s VAL 163 CO 0.32 -0.07 1.14 0.42 -0.31 0.00 0.00 175.10 176.61 1xxd s THR 164 N -1.28 3.13 0.40 5.32 -4.23 -1.26 -4.30 115.64 113.42 1xxd s THR 164 Ca 0.10 0.74 0.13 0.00 -1.18 0.00 0.00 61.69 61.47 1xxd s THR 164 Cb -0.09 -3.32 0.34 0.00 1.34 0.00 0.00 72.50 70.77 1xxd s THR 164 CO 0.05 -0.12 1.91 -1.13 -0.54 0.00 0.00 174.62 174.79 1xxd h ASN 165 N 1.38 0.48 0.05 3.99 -1.24 -1.95 0.42 115.58 118.72 1xxd h ASN 165 Ca -0.50 0.02 -0.00 0.00 0.71 0.00 0.00 56.30 56.53 1xxd h ASN 165 Cb 1.26 -0.07 0.00 0.00 0.73 0.00 0.00 38.32 40.24 1xxd h ASN 165 CO 0.58 0.26 -0.03 -0.08 -1.29 0.00 0.00 177.43 176.87 1xxd h GLU 166 N 0.52 -0.07 -0.22 6.67 4.81 -1.95 -1.69 114.58 122.65 1xxd h GLU 166 Ca 0.38 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.68 1xxd h GLU 166 Cb 0.74 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 1xxd h GLU 166 CO -0.14 0.35 0.17 1.49 -0.73 0.00 0.00 179.01 180.15 1xxd h GLU 167 N -0.51 0.00 0.02 1.92 4.57 -1.54 -2.54 114.58 116.49 1xxd h GLU 167 Ca -0.01 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.05 1xxd h GLU 167 Cb 0.45 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.05 1xxd h GLU 167 CO 0.01 0.00 -0.48 0.00 -1.18 0.00 0.00 179.01 177.36 1xxd h GLN 169 N -0.32 0.00 0.00 0.00 5.75 -0.92 0.11 115.11 119.74 1xxd h GLN 169 Ca -0.06 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.44 1xxd h GLN 169 Cb 1.23 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.78 1xxd h GLN 169 CO 0.09 0.00 -0.00 0.87 -2.65 0.00 0.00 178.83 177.14 1xxd h LYS 170 N 0.00 -0.00 0.00 1.69 1.57 -1.45 -2.57 116.57 115.81 1xxd h LYS 170 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1xxd h LYS 170 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1xxd h LYS 170 CO -0.00 0.36 0.00 0.54 -0.57 0.00 0.00 179.45 179.78 1xxd n ARG 171 N -4.92 0.00 -2.68 3.15 3.00 -0.04 -2.99 116.66 112.19 1xxd n ARG 171 Ca -0.08 0.29 -0.18 0.00 -0.01 0.00 0.00 57.85 57.87 1xxd n ARG 171 Cb 0.19 -1.50 0.01 0.00 0.00 0.00 0.00 32.46 31.16 1xxd n ARG 171 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1xxd n TYR 172 N -1.50 2.16 0.16 -1.55 4.02 -0.79 -4.84 117.16 114.82 1xxd n TYR 172 Ca 0.03 -3.13 0.10 0.00 -0.01 0.00 0.00 57.90 54.89 1xxd n TYR 172 Cb 0.14 -0.28 0.54 0.00 -0.02 0.00 0.00 39.34 39.71 1xxd n TYR 172 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 1xxd n ARG 173 N -0.20 0.13 -0.18 -0.72 3.00 -0.99 0.58 116.66 118.29 1xxd n ARG 173 Ca 0.24 0.62 0.10 0.00 -0.00 0.00 0.00 57.85 58.81 1xxd n ARG 173 Cb 0.70 -1.98 0.27 0.00 0.00 0.00 0.00 32.46 31.45 1xxd n ARG 173 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1xxd n GLY 173 N -1.30 1.02 3.20 5.14 0.00 -1.26 -4.91 105.19 107.09 1xxd n GLY 173 Ca -0.01 -0.53 -0.09 0.00 0.00 0.00 0.00 46.02 45.39 1xxd n GLY 173 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xxd s HIS 174 N -1.54 0.42 -0.45 1.61 3.76 0.20 -5.12 115.29 114.17 1xxd s HIS 174 Ca 0.34 -0.85 -0.12 0.00 -0.15 0.00 0.00 55.06 54.28 1xxd s HIS 174 Cb 0.18 -0.20 0.08 0.00 1.11 0.00 0.00 32.58 33.75 1xxd s HIS 174 CO 0.26 -0.55 0.33 0.21 -0.85 0.00 0.00 174.74 174.13 1xxd s LYS 175 N -3.93 2.76 -0.44 1.40 2.20 -1.26 -4.87 119.74 115.59 1xxd s LYS 175 Ca 0.12 -1.45 -0.21 0.00 -0.36 0.00 0.00 55.97 54.07 1xxd s LYS 175 Cb 0.06 -3.95 0.03 0.00 -1.51 0.00 0.00 37.83 32.45 1xxd s LYS 175 CO -0.06 -1.02 0.65 0.42 -0.36 0.00 0.00 175.35 174.98 1xxd s ILE 176 N 1.51 4.82 0.40 5.43 -1.09 -1.26 -4.98 121.20 126.04 1xxd s ILE 176 Ca 0.04 0.08 0.02 0.00 -2.23 0.00 0.00 60.65 58.56 1xxd s ILE 176 Cb -0.24 -4.22 -0.01 0.00 -1.58 0.00 0.00 42.46 36.41 1xxd s ILE 176 CO 0.04 -0.62 0.59 0.42 -1.23 0.00 0.00 174.94 174.14 1xxd s THR 177 N 2.83 4.15 -1.08 2.92 -4.23 -1.26 -4.88 115.64 114.08 1xxd s THR 177 Ca 0.22 -0.67 0.00 0.00 -1.18 0.00 0.00 61.69 60.07 1xxd s THR 177 Cb -0.14 -3.50 0.00 0.00 1.34 0.00 0.00 72.50 70.20 1xxd s THR 177 CO 0.19 -0.29 0.87 1.41 -0.54 0.00 0.00 174.62 176.26 1xxd n HIS 178 N -1.90 0.00 1.41 3.99 8.25 -1.26 0.67 115.22 126.38 1xxd n HIS 178 Ca 0.00 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.61 1xxd n HIS 178 Cb 0.58 -0.38 0.72 0.00 1.12 0.00 0.00 29.99 32.03 1xxd n HIS 178 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1xxd n LYS 179 N -1.37 0.46 -4.92 -0.41 4.76 -1.26 -4.73 118.16 110.69 1xxd n LYS 179 Ca 0.00 -0.04 -0.28 0.00 -2.87 0.00 0.00 58.31 55.12 1xxd n LYS 179 Cb 0.03 -1.50 -0.16 0.00 -1.84 0.00 0.00 35.03 31.56 1xxd n LYS 179 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 1xxd s MET 180 N -2.57 2.15 0.06 1.97 -1.94 0.21 -0.57 119.30 118.61 1xxd s MET 180 Ca 0.28 -0.66 0.06 0.00 -1.71 0.00 0.00 55.69 53.66 1xxd s MET 180 Cb 0.20 -1.77 -0.04 0.00 2.01 0.00 0.00 34.83 35.24 1xxd s MET 180 CO 0.47 0.20 -0.12 -1.50 -0.01 0.00 0.00 175.02 174.06 1xxd s ILE 181 N 0.23 3.23 0.15 2.53 2.07 -0.65 -4.70 121.20 124.05 1xxd s ILE 181 Ca -0.10 -1.11 0.11 0.00 -1.41 0.00 0.00 60.65 58.14 1xxd s ILE 181 Cb -0.14 -2.43 -0.04 0.00 0.13 0.00 0.00 42.46 39.98 1xxd s ILE 181 CO 0.04 0.27 -0.25 0.00 -1.91 0.00 0.00 174.94 173.08 1xxd s ALA 183 N -1.27 -0.13 0.00 0.00 0.00 -0.53 -1.46 121.76 118.36 1xxd s ALA 183 Ca 0.15 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.10 1xxd s ALA 183 Cb -0.09 -0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.00 1xxd s ALA 183 CO 0.07 -0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.16 1xxd n GLY 184 N 2.52 3.64 3.67 0.00 0.00 -0.78 0.36 105.19 114.60 1xxd n GLY 184 Ca -0.16 -0.76 -0.41 0.00 0.00 0.00 0.00 46.02 44.68 1xxd n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xxd s TYR 184 N -2.00 3.41 0.30 1.61 2.02 -1.26 -4.67 117.35 116.76 1xxd s TYR 184 Ca 0.00 1.16 0.23 0.00 -0.37 0.00 0.00 57.07 58.10 1xxd s TYR 184 Cb 0.00 -2.95 1.02 0.00 -0.40 0.00 0.00 41.96 39.62 1xxd s TYR 184 CO 0.00 -0.22 1.04 -2.13 -1.57 0.00 0.00 175.55 172.67 1xxd n ARG 185 N 5.19 -0.02 -0.01 -0.62 3.00 -1.26 0.42 116.66 123.36 1xxd n ARG 185 Ca 0.03 0.82 0.03 0.00 -0.00 0.00 0.00 57.85 58.73 1xxd n ARG 185 Cb 0.49 -1.65 -0.13 0.00 0.00 0.00 0.00 32.46 31.17 1xxd n ARG 185 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1xxd n GLU 186 N -3.92 0.65 0.00 -0.14 4.71 -1.26 -1.80 120.64 118.89 1xxd n GLU 186 Ca 0.27 -0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.42 1xxd n GLU 186 Cb 1.09 -1.63 0.00 0.00 -1.01 0.00 0.00 31.44 29.89 1xxd n GLU 186 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1xxd n GLY 187 N 1.41 -1.51 0.00 0.62 0.00 1.44 -3.59 105.19 103.57 1xxd n GLY 187 Ca -0.13 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.83 1xxd n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xxd n GLY 188 N 0.00 3.11 3.29 -0.02 0.00 -0.84 -4.62 105.19 106.11 1xxd n GLY 188 Ca 0.00 -0.93 -0.32 0.00 0.00 0.00 0.00 46.02 44.77 1xxd n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xxd s LYS 188 N 0.00 2.74 0.00 1.61 1.02 -1.26 -3.34 119.74 120.51 1xxd s LYS 188 Ca 0.00 -0.86 0.00 0.00 0.02 0.00 0.00 55.97 55.13 1xxd s LYS 188 Cb 0.00 -2.26 0.00 0.00 -0.52 0.00 0.00 37.83 35.05 1xxd s LYS 188 CO 0.00 0.35 0.00 -3.47 -0.92 0.00 0.00 175.35 171.31 1xxd n ASP 189 N 3.06 0.00 -4.86 2.83 2.03 -1.02 -4.49 116.55 114.10 1xxd n ASP 189 Ca -0.18 0.00 -0.24 0.00 0.52 0.00 0.00 54.79 54.89 1xxd n ASP 189 Cb 0.52 0.00 0.07 0.00 -0.72 0.00 0.00 41.12 40.99 1xxd n ASP 189 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xxd s ALA 190 N -2.00 3.39 0.00 -1.67 0.00 -1.26 -1.27 121.76 118.94 1xxd s ALA 190 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 50.79 1xxd s ALA 190 Cb 0.00 -2.38 0.00 0.00 0.00 0.00 0.00 23.12 20.74 1xxd s ALA 190 CO 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 175.76 174.52 1xxd n LYS 192 N 0.00 1.75 0.00 0.00 5.02 -1.26 0.19 118.16 123.87 1xxd n LYS 192 Ca 0.00 0.64 0.00 0.00 -2.02 0.00 0.00 58.31 56.93 1xxd n LYS 192 Cb 0.00 -2.44 0.00 0.00 -0.02 0.00 0.00 35.03 32.57 1xxd n LYS 192 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1xxd n GLY 193 N 4.42 1.88 0.02 0.72 0.00 -1.26 0.95 105.19 111.92 1xxd n GLY 193 Ca 0.25 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.39 1xxd n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1xxd n ASP 194 N 0.00 0.54 -4.48 1.61 8.00 0.13 -3.95 116.55 118.39 1xxd n ASP 194 Ca 0.00 -0.10 -0.42 0.00 0.71 0.00 0.00 54.79 54.98 1xxd n ASP 194 Cb 0.00 0.21 0.01 0.00 -0.02 0.00 0.00 41.12 41.32 1xxd n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1xxd n SER 195 N -1.70 -0.49 0.00 -2.24 7.64 -1.26 -0.12 113.62 115.45 1xxd n SER 195 Ca 0.05 0.93 0.00 0.00 1.01 0.00 0.00 58.87 60.86 1xxd n SER 195 Cb 0.37 -1.16 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 1xxd n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xxd n GLY 196 N 1.68 2.46 3.74 0.23 0.00 -0.14 -0.73 105.19 112.43 1xxd n GLY 196 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1xxd n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xxd s GLY 197 N -1.81 2.31 0.35 -0.02 0.00 0.83 -3.75 107.32 105.22 1xxd s GLY 197 Ca 0.00 1.31 -0.28 0.00 0.00 0.00 0.00 44.72 45.75 1xxd s GLY 197 CO 0.00 2.27 1.30 2.56 0.00 0.00 0.00 173.10 179.23 1xxd s PRO 198 N -0.29 4.28 -0.52 2.90 0.04 -1.26 0.42 135.00 140.57 1xxd s PRO 198 Ca 0.59 2.18 -0.03 0.00 0.04 0.00 0.00 61.00 63.79 1xxd s PRO 198 Cb -0.41 -3.00 0.14 0.00 0.04 0.00 0.00 34.50 31.26 1xxd s PRO 198 CO 0.42 -0.24 0.32 -1.17 0.04 0.00 0.00 177.00 176.38 1xxd s LEU 198 N -1.93 5.25 0.02 -3.56 2.96 0.49 -3.78 118.68 118.12 1xxd s LEU 198 Ca 0.51 -2.44 -0.14 0.00 -0.22 0.00 0.00 54.13 51.83 1xxd s LEU 198 Cb -0.39 -1.84 -0.06 0.00 0.50 0.00 0.00 46.19 44.40 1xxd s LEU 198 CO 0.51 -0.46 0.42 -0.44 -1.32 0.00 0.00 176.35 175.06 1xxd s SER 198 N 1.28 6.81 -0.14 3.68 0.01 -1.04 -2.00 113.70 122.29 1xxd s SER 198 Ca 0.12 0.97 -0.01 0.00 1.31 0.00 0.00 55.95 58.35 1xxd s SER 198 Cb -0.22 -2.25 0.03 0.00 0.21 0.00 0.00 66.02 63.80 1xxd s SER 198 CO -0.04 0.30 -0.06 0.00 0.41 0.00 0.00 173.24 173.86 1xxd s LYS 202 N 1.69 4.37 -0.22 0.00 2.20 -0.17 -2.56 119.74 125.05 1xxd s LYS 202 Ca 0.03 1.61 -0.11 0.00 -0.36 0.00 0.00 55.97 57.13 1xxd s LYS 202 Cb -0.14 -3.55 0.08 0.00 -1.51 0.00 0.00 37.83 32.71 1xxd s LYS 202 CO -0.08 -0.41 0.53 -3.38 -0.36 0.00 0.00 175.35 171.65 1xxd s HIS 202 N 2.14 -0.86 -1.24 4.03 -3.43 -0.86 -4.36 115.29 110.71 1xxd s HIS 202 Ca 0.54 1.70 0.00 0.00 -0.80 0.00 0.00 55.06 56.50 1xxd s HIS 202 Cb -0.23 0.45 0.00 0.00 -1.43 0.00 0.00 32.58 31.36 1xxd s HIS 202 CO 0.21 -0.46 0.00 -1.71 -2.00 0.00 0.00 174.74 170.79 1xxd n ASN 202 N 4.57 -4.41 -0.11 7.38 5.15 -1.26 -1.88 115.26 124.70 1xxd n ASN 202 Ca -0.19 -0.00 -0.01 0.00 -0.60 0.00 0.00 54.58 53.77 1xxd n ASN 202 Cb 0.55 -3.55 -0.01 0.00 -0.53 0.00 0.00 39.78 36.24 1xxd n ASN 202 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1xxd n GLU 202 N -2.39 -0.79 -4.41 1.20 -0.58 -1.26 -5.00 120.64 107.42 1xxd n GLU 202 Ca -0.17 0.30 -0.20 0.00 -0.42 0.00 0.00 57.16 56.67 1xxd n GLU 202 Cb 0.63 -3.96 -0.15 0.00 -0.57 0.00 0.00 31.44 27.38 1xxd n GLU 202 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1xxd s VAL 202 N -1.71 0.81 0.21 2.62 1.01 -0.79 -5.13 120.40 117.42 1xxd s VAL 202 Ca 0.00 -0.38 -0.26 0.00 0.00 0.00 0.00 61.98 61.34 1xxd s VAL 202 Cb 0.00 -0.72 -0.08 0.00 0.00 0.00 0.00 36.38 35.58 1xxd s VAL 202 CO 0.00 0.25 0.83 0.26 0.00 0.00 0.00 175.10 176.44 1xxd s TRP 203 N 0.16 3.87 -0.00 5.22 0.52 -1.26 -2.03 118.94 125.42 1xxd s TRP 203 Ca -0.03 1.69 0.04 0.00 0.02 0.00 0.00 56.10 57.82 1xxd s TRP 203 Cb -0.08 -2.82 -0.01 0.00 -1.15 0.00 0.00 33.47 29.41 1xxd s TRP 203 CO 0.00 0.45 -0.12 -1.01 0.02 0.00 0.00 176.95 176.29 1xxd s HIS 204 N -1.26 1.03 -1.22 -1.98 3.76 -1.06 -3.16 115.29 111.41 1xxd s HIS 204 Ca 0.40 -0.21 -0.18 0.00 -0.15 0.00 0.00 55.06 54.91 1xxd s HIS 204 Cb -0.22 -0.66 0.09 0.00 1.11 0.00 0.00 32.58 32.89 1xxd s HIS 204 CO 0.27 -0.01 1.61 -1.17 -0.85 0.00 0.00 174.74 174.58 1xxd s LEU 209 N -0.38 4.05 -0.01 0.89 2.96 -0.66 -1.80 118.68 123.72 1xxd s LEU 209 Ca 0.04 -2.36 -0.20 0.00 -0.22 0.00 0.00 54.13 51.39 1xxd s LEU 209 Cb -0.05 -2.54 -0.31 0.00 0.50 0.00 0.00 46.19 43.80 1xxd s LEU 209 CO -0.00 -1.15 0.97 0.58 -1.32 0.00 0.00 176.35 175.43 1xxd h VAL 210 N 5.63 1.43 -3.66 1.68 2.07 -1.74 -3.39 116.25 118.27 1xxd h VAL 210 Ca 0.37 -2.48 -0.33 0.00 0.82 0.00 0.00 66.70 65.08 1xxd h VAL 210 Cb 0.90 3.03 -0.14 0.00 -1.52 0.00 0.00 31.29 33.55 1xxd h VAL 210 CO 1.40 0.72 -0.65 -0.83 0.02 0.00 0.00 177.57 178.23 1xxd s GLY 211 N -4.40 1.47 -0.13 2.17 0.00 -1.12 -2.54 107.32 102.77 1xxd s GLY 211 Ca -0.12 -1.72 -0.00 0.00 0.00 0.00 0.00 44.72 42.87 1xxd s GLY 211 CO 0.86 -1.58 -0.07 -0.42 0.00 0.00 0.00 173.10 171.89 1xxd s ILE 212 N -3.63 1.04 -0.34 0.90 1.01 -1.08 -0.38 121.20 118.71 1xxd s ILE 212 Ca 0.29 -0.38 -0.41 0.00 0.00 0.00 0.00 60.65 60.16 1xxd s ILE 212 Cb 0.07 -1.11 -0.16 0.00 0.01 0.00 0.00 42.46 41.27 1xxd s ILE 212 CO 0.08 0.30 1.85 0.41 0.00 0.00 0.00 174.94 177.58 1xxd n THR 213 N 4.93 0.22 0.04 2.92 -1.04 0.17 -0.61 114.28 120.91 1xxd n THR 213 Ca -0.12 -0.08 -0.00 0.00 -2.04 0.00 0.00 64.05 61.81 1xxd n THR 213 Cb 0.49 -1.14 -0.00 0.00 -1.82 0.00 0.00 70.33 67.86 1xxd n THR 213 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1xxd n SER 214 N 6.21 1.01 -1.59 8.00 2.88 -0.98 -0.97 113.62 128.19 1xxd n SER 214 Ca 0.33 0.13 -0.02 0.00 -1.33 0.00 0.00 58.87 57.98 1xxd n SER 214 Cb 0.11 -0.31 0.01 0.00 -0.75 0.00 0.00 64.21 63.26 1xxd n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1xxd n TRP 215 N -3.47 -1.15 0.00 0.66 4.27 -1.14 -4.94 117.44 111.68 1xxd n TRP 215 Ca -0.00 -0.47 0.00 0.00 -3.89 0.00 0.00 57.50 53.13 1xxd n TRP 215 Cb 0.07 0.23 0.00 0.00 -1.36 0.00 0.00 31.31 30.26 1xxd n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1xxd n GLY 216 N -0.18 2.09 3.48 -1.67 0.00 -1.26 -0.88 105.19 106.77 1xxd n GLY 216 Ca -0.02 -1.00 -0.42 0.00 0.00 0.00 0.00 46.02 44.57 1xxd n GLY 216 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xxd s GLU 217 N -2.00 3.17 3.14 1.61 2.12 -1.26 -4.86 118.70 120.63 1xxd s GLU 217 Ca 0.00 -0.74 0.00 0.00 0.36 0.00 0.00 54.97 54.59 1xxd s GLU 217 Cb 0.00 -4.29 0.00 0.00 0.26 0.00 0.00 34.13 30.10 1xxd s GLU 217 CO 0.00 -1.91 0.00 0.41 -0.54 0.00 0.00 175.26 173.22 1xxd n GLY 218 N 5.40 -0.22 2.76 -1.50 0.00 -1.26 -4.53 105.19 105.84 1xxd n GLY 218 Ca 0.00 -1.05 -0.17 0.00 0.00 0.00 0.00 46.02 44.80 1xxd n GLY 218 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xxd n ALA 220 N 4.50 -0.89 -1.80 0.00 0.00 -1.26 -4.92 120.51 116.14 1xxd n ALA 220 Ca -0.20 0.17 -0.33 0.00 0.00 0.00 0.00 53.44 53.08 1xxd n ALA 220 Cb 0.50 -2.75 -0.04 0.00 0.00 0.00 0.00 19.45 17.16 1xxd n ALA 220 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1xxd s GLN 221 N -5.50 3.96 0.05 0.00 -0.21 -1.26 -1.99 119.66 114.71 1xxd s GLN 221 Ca 0.20 1.14 -0.30 0.00 0.02 0.00 0.00 55.36 56.42 1xxd s GLN 221 Cb -0.10 -2.13 -0.09 0.00 1.00 0.00 0.00 33.01 31.69 1xxd s GLN 221 CO 0.25 -0.27 1.97 -2.13 -2.12 0.00 0.00 175.29 172.98 1xxd n ARG 222 N -1.11 2.88 -2.57 2.91 0.63 -1.24 -1.45 116.66 116.71 1xxd n ARG 222 Ca 0.08 1.06 -0.16 0.00 -0.92 0.00 0.00 57.85 57.90 1xxd n ARG 222 Cb 0.54 -3.01 0.01 0.00 0.45 0.00 0.00 32.46 30.45 1xxd n ARG 222 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1xxd n GLU 223 N 7.36 -2.52 -3.28 -0.14 1.02 -0.74 -4.96 120.64 117.39 1xxd n GLU 223 Ca 0.20 0.72 -0.25 0.00 -0.02 0.00 0.00 57.16 57.81 1xxd n GLU 223 Cb 0.41 -5.10 -0.08 0.00 -0.02 0.00 0.00 31.44 26.65 1xxd n GLU 223 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1xxd n ARG 224 N -2.87 0.70 -1.71 3.49 5.12 -0.53 -4.77 116.66 116.10 1xxd n ARG 224 Ca -0.13 -3.32 -0.41 0.00 -1.93 0.00 0.00 57.85 52.05 1xxd n ARG 224 Cb 0.62 -1.42 0.01 0.00 -1.16 0.00 0.00 32.46 30.50 1xxd n ARG 224 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 1xxd n PRO 225 N 1.78 2.05 -2.26 5.56 -0.02 -1.26 -4.15 135.00 136.70 1xxd n PRO 225 Ca 0.24 0.73 -0.35 0.00 -2.02 0.00 0.00 63.50 62.09 1xxd n PRO 225 Cb 0.50 -2.39 -0.00 0.00 -0.02 0.00 0.00 33.50 31.59 1xxd n PRO 225 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1xxd s GLY 226 N -0.43 2.66 -0.15 -1.23 0.00 0.16 -4.71 107.32 103.61 1xxd s GLY 226 Ca 0.59 0.84 -0.07 0.00 0.00 0.00 0.00 44.72 46.08 1xxd s GLY 226 CO 0.60 1.21 0.08 0.14 0.00 0.00 0.00 173.10 175.13 1xxd s VAL 227 N -1.74 4.96 0.26 1.40 1.01 -0.06 -1.45 120.40 124.79 1xxd s VAL 227 Ca 0.71 0.02 0.07 0.00 0.00 0.00 0.00 61.98 62.78 1xxd s VAL 227 Cb -0.25 -3.20 -0.06 0.00 0.00 0.00 0.00 36.38 32.88 1xxd s VAL 227 CO 0.28 0.52 -0.08 -0.31 0.00 0.00 0.00 175.10 175.51 1xxd s TYR 228 N -0.18 1.91 -0.13 5.22 1.51 0.22 -2.32 117.35 123.58 1xxd s TYR 228 Ca 0.08 -0.66 -0.24 0.00 -1.01 0.00 0.00 57.07 55.24 1xxd s TYR 228 Cb -0.12 -1.04 -0.02 0.00 -0.11 0.00 0.00 41.96 40.66 1xxd s TYR 228 CO 0.01 0.31 0.76 0.99 -1.11 0.00 0.00 175.55 176.52 1xxd s THR 229 N -2.99 4.96 -0.97 -0.71 2.01 0.23 -1.64 115.64 116.53 1xxd s THR 229 Ca 0.28 1.52 -0.21 0.00 0.31 0.00 0.00 61.69 63.60 1xxd s THR 229 Cb 0.03 -4.08 -0.10 0.00 0.01 0.00 0.00 72.50 68.35 1xxd s THR 229 CO 0.11 0.12 1.97 -3.20 -0.69 0.00 0.00 174.62 172.93 1xxd n ASN 230 N 4.65 2.93 -0.27 3.53 5.15 0.27 -2.64 115.26 128.88 1xxd n ASN 230 Ca 0.02 -2.72 0.24 0.00 -0.60 0.00 0.00 54.58 51.52 1xxd n ASN 230 Cb 0.50 -1.32 0.45 0.00 -0.53 0.00 0.00 39.78 38.88 1xxd n ASN 230 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1xxd n VAL 231 N 6.09 -0.35 -0.27 3.44 0.31 -1.05 -0.24 118.33 126.25 1xxd n VAL 231 Ca 0.49 1.74 0.06 0.00 -0.01 0.00 0.00 64.34 66.63 1xxd n VAL 231 Cb 0.41 -2.76 0.21 0.00 -0.91 0.00 0.00 33.84 30.79 1xxd n VAL 231 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1xxd h VAL 232 N 0.00 0.66 0.00 2.52 2.07 -1.84 0.19 116.25 119.86 1xxd h VAL 232 Ca 0.67 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 68.02 1xxd h VAL 232 Cb 1.72 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 1xxd h VAL 232 CO -0.68 0.09 0.00 -0.62 0.02 0.00 0.00 177.57 176.38 1xxd n GLU 233 N -4.96 0.05 -0.00 1.57 -0.58 0.66 -2.31 120.64 115.07 1xxd n GLU 233 Ca 0.16 0.52 0.01 0.00 -0.42 0.00 0.00 57.16 57.43 1xxd n GLU 233 Cb 0.44 -1.66 0.01 0.00 -0.57 0.00 0.00 31.44 29.67 1xxd n GLU 233 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1xxd n TYR 234 N -1.76 0.01 -0.29 -0.32 4.01 0.03 -4.86 117.16 113.97 1xxd n TYR 234 Ca -0.00 -0.04 -0.08 0.00 -0.16 0.00 0.00 57.90 57.62 1xxd n TYR 234 Cb 0.03 -0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 38.99 1xxd n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1xxd n VAL 235 N 0.13 -0.47 -0.37 -0.72 0.31 -0.98 -0.30 118.33 115.94 1xxd n VAL 235 Ca 0.02 2.11 0.02 0.00 -0.01 0.00 0.00 64.34 66.47 1xxd n VAL 235 Cb 0.09 -2.64 0.17 0.00 -0.91 0.00 0.00 33.84 30.54 1xxd n VAL 235 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1xxd h ASP 236 N 0.00 1.03 -0.99 4.52 3.45 -1.89 0.34 116.42 122.88 1xxd h ASP 236 Ca 0.11 0.01 0.09 0.00 0.43 0.00 0.00 57.03 57.67 1xxd h ASP 236 Cb 0.29 -0.21 -0.07 0.00 -0.56 0.00 0.00 39.33 38.77 1xxd h ASP 236 CO -0.66 0.67 0.63 -0.25 -1.57 0.00 0.00 179.24 178.06 1xxd h TRP 237 N 1.17 1.15 -0.04 4.55 7.01 -1.22 -1.59 115.95 126.98 1xxd h TRP 237 Ca 0.42 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.43 1xxd h TRP 237 Cb 0.14 -0.37 0.00 0.00 -2.10 0.00 0.00 29.16 26.83 1xxd h TRP 237 CO -0.00 0.53 -0.07 0.82 -2.79 0.00 0.00 178.44 176.93 1xxd h ILE 238 N 1.07 1.43 0.00 2.65 2.04 0.27 -2.48 117.51 122.48 1xxd h ILE 238 Ca 0.46 -1.38 -0.00 0.00 1.00 0.00 0.00 64.86 64.93 1xxd h ILE 238 Cb 0.31 2.27 -0.00 0.00 -0.74 0.00 0.00 36.82 38.66 1xxd h ILE 238 CO -0.22 0.37 -0.01 -0.07 0.00 0.00 0.00 178.15 178.22 1xxd h LEU 239 N -0.41 0.00 0.07 1.44 3.38 -0.80 -1.65 115.31 117.34 1xxd h LEU 239 Ca 0.00 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.71 1xxd h LEU 239 Cb 0.64 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.42 1xxd h LEU 239 CO 0.02 0.01 -1.07 -0.08 0.09 0.00 0.00 178.44 177.41 1xxd h GLU 240 N 0.00 0.59 0.00 1.13 4.57 -1.18 -2.47 114.58 117.23 1xxd h GLU 240 Ca -0.00 -0.74 -0.07 0.00 -1.18 0.00 0.00 59.36 57.37 1xxd h GLU 240 Cb 0.06 0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 28.88 1xxd h GLU 240 CO 0.00 1.32 -0.36 0.87 -1.18 0.00 0.00 179.01 179.66 1xxd h LYS 241 N 0.20 0.00 -0.02 1.92 1.79 -0.86 -3.21 116.57 116.39 1xxd h LYS 241 Ca -0.15 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.32 1xxd h LYS 241 Cb 1.75 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.40 1xxd h LYS 241 CO 0.21 0.36 -0.16 0.25 -1.08 0.00 0.00 179.45 179.02 1xxd n THR 242 N -3.28 0.00 -1.53 -0.16 -2.24 -0.74 -5.02 114.28 101.32 1xxd n THR 242 Ca 0.02 -0.42 -0.46 0.00 -2.27 0.00 0.00 64.05 60.92 1xxd n THR 242 Cb 0.61 1.38 -0.02 0.00 -2.10 0.00 0.00 70.33 70.20 1xxd n THR 242 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1xxd n GLN 243 N 0.78 0.88 -1.56 -0.78 7.27 -0.93 -4.85 117.38 118.20 1xxd n GLN 243 Ca 0.11 0.31 -0.46 0.00 0.07 0.00 0.00 57.00 57.03 1xxd n GLN 243 Cb 0.52 -1.57 -0.02 0.00 2.41 0.00 0.00 30.24 31.57 1xxd n GLN 243 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1xxd n ALA 244 N 0.24 -0.69 -0.37 1.69 0.00 -1.26 -5.08 120.51 115.03 1xxd n ALA 244 Ca 0.13 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1xxd n ALA 244 Cb 0.29 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.77 1xxd n ALA 244 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83