#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ab2 n SER 2 N 0.00 4.04 -3.01 1.61 3.41 -1.26 -4.74 113.62 113.67 1ab2 n SER 2 Ca 0.00 -2.82 -0.30 0.00 -0.26 0.00 0.00 58.87 55.49 1ab2 n SER 2 Cb 0.00 -1.69 -0.02 0.00 -0.26 0.00 0.00 64.21 62.23 1ab2 n SER 2 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ab2 n GLY 3 N 5.35 5.74 5.00 5.00 0.00 -1.26 -4.95 105.19 120.07 1ab2 n GLY 3 Ca 0.48 -2.75 0.00 0.00 0.00 0.00 0.00 46.02 43.75 1ab2 n GLY 3 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ab2 n ASN 4 N -0.25 0.00 -4.58 1.61 3.02 -1.26 -4.69 115.26 109.11 1ab2 n ASN 4 Ca 0.35 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.65 1ab2 n ASN 4 Cb 0.39 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.47 1ab2 n ASN 4 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1ab2 s SER 5 N 0.00 4.25 -1.36 6.41 1.04 -1.26 -5.03 113.70 117.76 1ab2 s SER 5 Ca 0.00 -0.69 -0.16 0.00 0.48 0.00 0.00 55.95 55.58 1ab2 s SER 5 Cb 0.00 -0.70 0.03 0.00 0.10 0.00 0.00 66.02 65.46 1ab2 s SER 5 CO 0.00 0.05 2.05 0.18 0.98 0.00 0.00 173.24 176.50 1ab2 n LEU 6 N -0.47 5.96 -3.74 2.42 7.99 -1.26 -4.84 117.00 123.05 1ab2 n LEU 6 Ca -0.08 -3.96 -0.42 0.00 -0.01 0.00 0.00 56.01 51.54 1ab2 n LEU 6 Cb 0.58 -1.65 -0.03 0.00 -0.11 0.00 0.00 43.42 42.21 1ab2 n LEU 6 CO 0.38 0.61 2.39 -0.62 -1.51 0.00 0.00 177.39 178.64 1ab2 n GLU 7 N 6.95 2.26 0.00 3.23 1.02 -1.26 -4.83 120.64 128.01 1ab2 n GLU 7 Ca 0.51 -2.31 0.00 0.00 -0.02 0.00 0.00 57.16 55.34 1ab2 n GLU 7 Cb 0.42 -3.15 0.00 0.00 -0.02 0.00 0.00 31.44 28.68 1ab2 n GLU 7 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1ab2 n LYS 8 N 6.63 0.00 -1.86 3.49 3.00 -1.26 -4.86 118.16 123.30 1ab2 n LYS 8 Ca 0.51 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.76 1ab2 n LYS 8 Cb 0.40 -0.21 0.01 0.00 0.00 0.00 0.00 35.03 35.23 1ab2 n LYS 8 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1ab2 n HIS 9 N 0.00 -1.88 0.65 5.64 8.25 -1.26 -4.98 115.22 121.64 1ab2 n HIS 9 Ca 0.00 -0.57 0.01 0.00 -0.26 0.00 0.00 57.72 56.89 1ab2 n HIS 9 Cb 0.00 -0.12 0.07 0.00 1.12 0.00 0.00 29.99 31.06 1ab2 n HIS 9 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1ab2 n SER 10 N -2.30 1.96 -0.19 0.41 7.64 -1.26 -2.58 113.62 117.30 1ab2 n SER 10 Ca 0.01 -2.18 0.01 0.00 1.01 0.00 0.00 58.87 57.72 1ab2 n SER 10 Cb 0.16 -0.54 0.01 0.00 -1.01 0.00 0.00 64.21 62.84 1ab2 n SER 10 CO 0.00 0.00 0.00 -2.67 -3.01 0.00 0.00 175.04 169.36 1ab2 n TRP 11 N 0.12 0.00 -3.84 1.43 4.27 -1.26 -4.44 117.44 113.72 1ab2 n TRP 11 Ca 0.06 -0.16 -0.36 0.00 -3.89 0.00 0.00 57.50 53.14 1ab2 n TRP 11 Cb 0.45 -0.04 -0.13 0.00 -1.36 0.00 0.00 31.31 30.22 1ab2 n TRP 11 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 1ab2 s TYR 12 N -0.41 3.22 0.00 -2.67 5.04 -1.06 0.61 117.35 122.08 1ab2 s TYR 12 Ca 0.03 -1.56 0.00 0.00 -2.44 0.00 0.00 57.07 53.10 1ab2 s TYR 12 Cb 0.03 -2.18 0.00 0.00 0.35 0.00 0.00 41.96 40.16 1ab2 s TYR 12 CO 0.00 -0.74 0.00 0.72 -1.34 0.00 0.00 175.55 174.19 1ab2 n HIS 13 N 4.73 0.00 0.00 4.97 8.25 -1.13 -4.67 115.22 127.37 1ab2 n HIS 13 Ca -0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.33 1ab2 n HIS 13 Cb 0.45 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.56 1ab2 n HIS 13 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ab2 n GLY 14 N 2.89 1.46 3.81 -1.41 0.00 -1.26 -5.00 105.19 105.69 1ab2 n GLY 14 Ca 0.00 0.32 -0.32 0.00 0.00 0.00 0.00 46.02 46.02 1ab2 n GLY 14 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ab2 s PRO 15 N 3.27 3.30 -0.80 1.61 0.04 -1.26 0.18 135.00 141.33 1ab2 s PRO 15 Ca 0.00 1.12 -0.07 0.00 0.04 0.00 0.00 61.00 62.09 1ab2 s PRO 15 Cb 0.00 -2.03 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 1ab2 s PRO 15 CO 0.00 -0.82 1.97 1.55 0.04 0.00 0.00 177.00 179.74 1ab2 n VAL 16 N -2.25 2.11 -1.21 -0.36 3.14 0.12 -4.34 118.33 115.55 1ab2 n VAL 16 Ca 0.08 -1.31 -0.35 0.00 -2.96 0.00 0.00 64.34 59.80 1ab2 n VAL 16 Cb 0.53 -2.08 -0.03 0.00 -1.06 0.00 0.00 33.84 31.20 1ab2 n VAL 16 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1ab2 n SER 17 N 4.64 7.45 -0.33 6.55 2.88 -1.26 -4.67 113.62 128.89 1ab2 n SER 17 Ca 0.40 -2.54 0.26 0.00 -1.33 0.00 0.00 58.87 55.67 1ab2 n SER 17 Cb 0.15 -1.45 0.51 0.00 -0.75 0.00 0.00 64.21 62.66 1ab2 n SER 17 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 1ab2 h ARG 18 N 5.42 0.16 0.06 -1.46 2.43 -1.97 0.75 114.38 119.76 1ab2 h ARG 18 Ca 0.76 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.95 1ab2 h ARG 18 Cb 0.29 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 29.75 1ab2 h ARG 18 CO 1.72 0.10 -0.45 -0.91 -1.51 0.00 0.00 179.97 178.93 1ab2 h ASN 19 N 0.16 -1.34 -0.31 -3.80 2.35 -1.99 0.13 115.58 110.78 1ab2 h ASN 19 Ca 0.77 0.15 -0.05 0.00 -0.55 0.00 0.00 56.30 56.62 1ab2 h ASN 19 Cb 1.87 0.51 -0.01 0.00 0.05 0.00 0.00 38.32 40.74 1ab2 h ASN 19 CO -0.70 -0.49 -0.01 0.00 -1.65 0.00 0.00 177.43 174.59 1ab2 h ALA 20 N -0.18 0.42 -0.95 -0.83 0.00 -0.64 -2.73 119.26 114.34 1ab2 h ALA 20 Ca 0.03 -0.24 0.29 0.00 0.00 0.00 0.00 54.91 54.99 1ab2 h ALA 20 Cb 0.69 -0.11 -0.15 0.00 0.00 0.00 0.00 17.79 18.21 1ab2 h ALA 20 CO -0.29 0.18 0.34 0.00 0.00 0.00 0.00 179.25 179.48 1ab2 h ALA 21 N 0.84 1.57 -0.29 0.00 0.00 0.86 2.48 119.26 124.72 1ab2 h ALA 21 Ca 0.09 0.24 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 1ab2 h ALA 21 Cb 0.45 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1ab2 h ALA 21 CO 0.02 -0.57 0.03 0.93 0.00 0.00 0.00 179.25 179.65 1ab2 h GLU 22 N 0.19 0.50 0.29 0.00 4.39 -0.46 -2.00 114.58 117.48 1ab2 h GLU 22 Ca 0.65 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 60.19 1ab2 h GLU 22 Cb 1.44 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 30.04 1ab2 h GLU 22 CO -0.69 0.62 -0.14 -0.92 -1.16 0.00 0.00 179.01 176.72 1ab2 h TYR 23 N 0.31 -0.36 -0.85 4.33 3.20 0.82 -3.15 116.97 121.27 1ab2 h TYR 23 Ca 0.09 -0.01 0.25 0.00 3.14 0.00 0.00 58.73 62.20 1ab2 h TYR 23 Cb 0.37 0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.73 1ab2 h TYR 23 CO 0.03 -0.22 0.98 1.25 -1.64 0.00 0.00 178.16 178.56 1ab2 h LEU 24 N -0.89 0.00 -8.17 2.82 5.85 0.37 -3.36 115.31 111.93 1ab2 h LEU 24 Ca -0.04 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.52 1ab2 h LEU 24 Cb 0.30 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 1ab2 h LEU 24 CO 0.06 0.00 0.94 -0.11 -0.34 0.00 0.00 178.44 178.99 1ab2 n LEU 25 N -3.39 0.19 0.00 2.25 -0.00 -0.75 -4.76 117.00 110.54 1ab2 n LEU 25 Ca 0.19 -1.12 0.00 0.00 -0.00 0.00 0.00 56.01 55.08 1ab2 n LEU 25 Cb 1.25 -1.13 0.00 0.00 -0.00 0.00 0.00 43.42 43.55 1ab2 n LEU 25 CO 0.25 -2.12 0.00 -0.24 -0.00 0.00 0.00 177.39 175.28 1ab2 n SER 26 N 12.43 1.35 0.00 1.96 2.88 -1.26 -4.86 113.62 126.12 1ab2 n SER 26 Ca 0.54 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.08 1ab2 n SER 26 Cb 0.31 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.77 1ab2 n SER 26 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1ab2 n SER 27 N 0.00 0.00 -1.84 -3.46 7.64 -1.26 -4.56 113.62 110.14 1ab2 n SER 27 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 1ab2 n SER 27 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1ab2 n SER 27 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ab2 n GLY 28 N 0.00 -0.81 3.93 0.23 0.00 -1.26 -5.09 105.19 102.19 1ab2 n GLY 28 Ca 0.00 0.20 -0.25 0.00 0.00 0.00 0.00 46.02 45.97 1ab2 n GLY 28 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ab2 s ILE 29 N -1.61 1.77 -2.00 -0.61 -4.36 -1.26 -4.98 121.20 108.15 1ab2 s ILE 29 Ca 0.05 -1.38 0.20 0.00 -0.26 0.00 0.00 60.65 59.26 1ab2 s ILE 29 Cb -0.02 -2.15 0.57 0.00 1.25 0.00 0.00 42.46 42.11 1ab2 s ILE 29 CO 0.19 0.00 1.65 0.59 0.24 0.00 0.00 174.94 177.61 1ab2 n ASN 30 N -1.87 0.00 0.00 4.36 4.13 -1.26 -4.73 115.26 115.90 1ab2 n ASN 30 Ca 0.02 -0.97 0.00 0.00 1.68 0.00 0.00 54.58 55.31 1ab2 n ASN 30 Cb 0.64 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.88 1ab2 n ASN 30 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ab2 n GLY 31 N 0.53 4.46 3.42 7.41 0.00 -1.25 -4.77 105.19 114.99 1ab2 n GLY 31 Ca 0.15 -0.87 -0.14 0.00 0.00 0.00 0.00 46.02 45.16 1ab2 n GLY 31 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ab2 s SER 32 N 0.00 -0.51 0.44 1.61 1.04 0.14 -4.72 113.70 111.71 1ab2 s SER 32 Ca 0.00 0.22 0.06 0.00 0.48 0.00 0.00 55.95 56.72 1ab2 s SER 32 Cb 0.00 0.53 -0.04 0.00 0.10 0.00 0.00 66.02 66.61 1ab2 s SER 32 CO 0.00 -0.76 0.19 0.72 0.98 0.00 0.00 173.24 174.37 1ab2 s PHE 33 N -2.56 2.40 -0.18 5.02 -0.71 -1.26 -0.13 117.98 120.56 1ab2 s PHE 33 Ca -0.05 -0.66 -0.10 0.00 -1.04 0.00 0.00 56.93 55.09 1ab2 s PHE 33 Cb -0.01 -1.92 0.06 0.00 -1.21 0.00 0.00 43.02 39.95 1ab2 s PHE 33 CO -0.02 0.10 0.44 -0.48 -1.34 0.00 0.00 175.22 173.92 1ab2 s LEU 34 N -3.95 -0.24 -0.08 -1.99 2.34 0.68 -4.53 118.68 110.90 1ab2 s LEU 34 Ca 0.37 0.97 -0.11 0.00 0.06 0.00 0.00 54.13 55.41 1ab2 s LEU 34 Cb 0.03 1.46 -0.05 0.00 -0.56 0.00 0.00 46.19 47.07 1ab2 s LEU 34 CO 0.20 -0.20 0.27 -0.69 -1.06 0.00 0.00 176.35 174.88 1ab2 s VAL 35 N 1.54 5.28 0.41 1.48 1.01 0.20 0.84 120.40 131.17 1ab2 s VAL 35 Ca -0.09 0.52 0.03 0.00 0.00 0.00 0.00 61.98 62.45 1ab2 s VAL 35 Cb -0.08 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.71 1ab2 s VAL 35 CO -0.14 0.55 0.12 0.54 0.00 0.00 0.00 175.10 176.17 1ab2 n ARG 36 N 2.30 0.63 -4.85 2.72 1.74 -0.70 -2.82 116.66 115.68 1ab2 n ARG 36 Ca -0.16 -3.35 -0.27 0.00 -0.77 0.00 0.00 57.85 53.30 1ab2 n ARG 36 Cb 0.53 1.66 -0.16 0.00 -1.02 0.00 0.00 32.46 33.47 1ab2 n ARG 36 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 1ab2 s GLU 37 N -3.54 1.95 0.24 5.56 -1.05 0.48 -1.36 118.70 120.97 1ab2 s GLU 37 Ca 0.17 -0.62 -0.30 0.00 -0.15 0.00 0.00 54.97 54.07 1ab2 s GLU 37 Cb 0.01 -1.64 -0.15 0.00 -0.44 0.00 0.00 34.13 31.91 1ab2 s GLU 37 CO 0.12 0.20 0.96 -1.13 0.95 0.00 0.00 175.26 176.36 1ab2 n SER 38 N 3.30 0.80 -3.92 0.83 3.41 0.51 0.12 113.62 118.68 1ab2 n SER 38 Ca -0.19 1.16 -0.43 0.00 -0.26 0.00 0.00 58.87 59.15 1ab2 n SER 38 Cb 0.53 -1.20 0.01 0.00 -0.26 0.00 0.00 64.21 63.28 1ab2 n SER 38 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1ab2 n GLU 39 N 1.06 3.73 0.00 4.33 2.13 -1.26 -3.97 120.64 126.65 1ab2 n GLU 39 Ca 0.13 -3.69 0.00 0.00 0.66 0.00 0.00 57.16 54.26 1ab2 n GLU 39 Cb 0.28 -2.87 0.00 0.00 0.27 0.00 0.00 31.44 29.12 1ab2 n GLU 39 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1ab2 n SER 40 N 3.60 0.00 -4.12 4.31 7.64 -1.26 -5.09 113.62 118.70 1ab2 n SER 40 Ca 0.38 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.92 1ab2 n SER 40 Cb 0.36 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.42 1ab2 n SER 40 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1ab2 s SER 41 N 0.00 4.47 -0.36 6.43 0.01 -1.25 -5.00 113.70 117.99 1ab2 s SER 41 Ca 0.00 -1.23 -0.05 0.00 1.31 0.00 0.00 55.95 55.98 1ab2 s SER 41 Cb 0.00 -1.61 -0.16 0.00 0.21 0.00 0.00 66.02 64.46 1ab2 s SER 41 CO 0.00 -0.19 2.73 -0.81 0.41 0.00 0.00 173.24 175.38 1ab2 n PRO 42 N 4.54 1.87 0.00 12.44 -0.04 -1.26 -2.96 135.00 149.59 1ab2 n PRO 42 Ca -0.15 -1.05 0.00 0.00 -0.04 0.00 0.00 63.50 62.26 1ab2 n PRO 42 Cb 0.44 -2.09 0.00 0.00 -0.04 0.00 0.00 33.50 31.81 1ab2 n PRO 42 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ab2 n GLY 43 N 2.94 0.00 3.77 0.55 0.00 -1.26 -5.08 105.19 106.10 1ab2 n GLY 43 Ca 0.40 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.06 1ab2 n GLY 43 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1ab2 s GLN 44 N -1.07 3.23 0.12 1.61 0.00 -1.15 -5.01 119.66 117.39 1ab2 s GLN 44 Ca 0.00 -0.28 0.09 0.00 -0.00 0.00 0.00 55.36 55.17 1ab2 s GLN 44 Cb 0.00 -2.99 -0.04 0.00 0.00 0.00 0.00 33.01 29.98 1ab2 s GLN 44 CO 0.00 0.72 -0.23 0.50 0.00 0.00 0.00 175.29 176.28 1ab2 s ARG 45 N -0.89 1.23 0.56 9.60 3.00 -1.26 -0.36 118.95 130.83 1ab2 s ARG 45 Ca 0.14 -1.25 0.09 0.00 -1.00 0.00 0.00 55.73 53.71 1ab2 s ARG 45 Cb -0.12 -1.55 0.07 0.00 0.00 0.00 0.00 34.95 33.35 1ab2 s ARG 45 CO 0.03 0.36 0.70 -1.12 0.00 0.00 0.00 175.30 175.27 1ab2 s SER 46 N -2.03 5.03 -0.00 -2.12 0.01 -0.47 -2.22 113.70 111.90 1ab2 s SER 46 Ca 0.10 -0.91 0.02 0.00 1.31 0.00 0.00 55.95 56.47 1ab2 s SER 46 Cb -0.10 0.27 -0.01 0.00 0.21 0.00 0.00 66.02 66.40 1ab2 s SER 46 CO 0.05 -1.27 -0.06 -0.51 0.41 0.00 0.00 173.24 171.86 1ab2 s ILE 47 N -2.67 0.50 -0.09 1.44 2.07 -0.92 -1.71 121.20 119.81 1ab2 s ILE 47 Ca 0.56 -0.30 0.01 0.00 -1.41 0.00 0.00 60.65 59.51 1ab2 s ILE 47 Cb -0.05 -0.43 0.02 0.00 0.13 0.00 0.00 42.46 42.13 1ab2 s ILE 47 CO 0.35 0.12 -0.09 -0.94 -1.91 0.00 0.00 174.94 172.47 1ab2 s SER 48 N -0.20 2.01 0.25 4.50 1.04 0.25 -1.49 113.70 120.05 1ab2 s SER 48 Ca 0.02 -0.30 0.08 0.00 0.48 0.00 0.00 55.95 56.23 1ab2 s SER 48 Cb -0.03 -0.84 -0.04 0.00 0.10 0.00 0.00 66.02 65.22 1ab2 s SER 48 CO -0.00 -0.06 0.06 -0.76 0.98 0.00 0.00 173.24 173.46 1ab2 s LEU 49 N 1.29 3.42 -0.08 2.42 2.01 -0.22 0.24 118.68 127.77 1ab2 s LEU 49 Ca -0.03 -0.48 -0.19 0.00 0.01 0.00 0.00 54.13 53.44 1ab2 s LEU 49 Cb -0.14 -1.96 0.04 0.00 0.01 0.00 0.00 46.19 44.14 1ab2 s LEU 49 CO -0.04 0.00 0.46 -0.60 1.01 0.00 0.00 176.35 177.18 1ab2 s ARG 50 N -3.62 0.73 0.00 1.70 3.00 0.81 -1.13 118.95 120.45 1ab2 s ARG 50 Ca 0.31 0.20 0.00 0.00 -1.00 0.00 0.00 55.73 55.24 1ab2 s ARG 50 Cb -0.07 0.34 0.00 0.00 0.00 0.00 0.00 34.95 35.22 1ab2 s ARG 50 CO 0.21 -0.18 0.00 0.66 0.00 0.00 0.00 175.30 175.99 1ab2 n TYR 51 N 1.68 0.00 -1.34 5.12 4.02 -0.70 -0.68 117.16 125.26 1ab2 n TYR 51 Ca -0.18 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.44 1ab2 n TYR 51 Cb 0.56 0.00 0.13 0.00 -0.02 0.00 0.00 39.34 40.02 1ab2 n TYR 51 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 1ab2 n GLU 52 N 0.00 2.46 0.00 -0.72 0.28 -1.26 -3.97 120.64 117.44 1ab2 n GLU 52 Ca 0.00 -3.21 0.00 0.00 -0.16 0.00 0.00 57.16 53.79 1ab2 n GLU 52 Cb 0.00 -2.19 0.00 0.00 1.43 0.00 0.00 31.44 30.68 1ab2 n GLU 52 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1ab2 n GLY 53 N -1.03 2.90 3.75 -1.84 0.00 -1.26 -5.09 105.19 102.62 1ab2 n GLY 53 Ca 0.57 -0.82 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 1ab2 n GLY 53 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ab2 s ARG 54 N 0.00 4.45 -0.05 1.61 1.70 -1.26 -5.03 118.95 120.37 1ab2 s ARG 54 Ca 0.00 2.01 0.02 0.00 -0.47 0.00 0.00 55.73 57.29 1ab2 s ARG 54 Cb 0.00 -3.17 0.01 0.00 -0.57 0.00 0.00 34.95 31.22 1ab2 s ARG 54 CO 0.00 -0.12 -0.08 0.54 -1.08 0.00 0.00 175.30 174.56 1ab2 s VAL 55 N -0.45 0.82 -0.19 4.99 0.11 -1.26 -1.72 120.40 122.71 1ab2 s VAL 55 Ca 0.52 -0.31 -0.07 0.00 -2.93 0.00 0.00 61.98 59.19 1ab2 s VAL 55 Cb -0.36 -0.77 -0.04 0.00 -1.53 0.00 0.00 36.38 33.68 1ab2 s VAL 55 CO 0.42 0.28 0.05 -0.31 -3.33 0.00 0.00 175.10 172.20 1ab2 s TYR 56 N 0.66 3.19 -0.37 1.54 2.02 -0.28 -4.90 117.35 119.21 1ab2 s TYR 56 Ca -0.11 -0.05 -0.04 0.00 -0.37 0.00 0.00 57.07 56.49 1ab2 s TYR 56 Cb -0.14 -2.08 0.07 0.00 -0.40 0.00 0.00 41.96 39.42 1ab2 s TYR 56 CO 0.02 0.05 0.14 -1.01 -1.57 0.00 0.00 175.55 173.18 1ab2 s HIS 57 N 0.53 3.39 -0.31 2.71 3.76 -1.26 -1.06 115.29 123.06 1ab2 s HIS 57 Ca 0.02 -1.92 0.01 0.00 -0.15 0.00 0.00 55.06 53.01 1ab2 s HIS 57 Cb -0.13 -2.69 0.09 0.00 1.11 0.00 0.00 32.58 30.96 1ab2 s HIS 57 CO 0.01 -0.86 0.06 0.71 -0.85 0.00 0.00 174.74 173.81 1ab2 s TYR 58 N 1.27 2.42 0.61 1.40 1.51 -0.56 -5.00 117.35 119.01 1ab2 s TYR 58 Ca 0.02 -2.11 -0.16 0.00 -1.01 0.00 0.00 57.07 53.81 1ab2 s TYR 58 Cb -0.21 -2.05 -0.02 0.00 -0.11 0.00 0.00 41.96 39.56 1ab2 s TYR 58 CO -0.01 -0.88 1.10 -0.98 -1.11 0.00 0.00 175.55 173.68 1ab2 s ARG 59 N 1.37 3.05 0.41 -0.62 1.70 -1.26 -2.16 118.95 121.45 1ab2 s ARG 59 Ca 0.08 1.42 0.08 0.00 -0.47 0.00 0.00 55.73 56.83 1ab2 s ARG 59 Cb -0.18 -1.98 -0.00 0.00 -0.57 0.00 0.00 34.95 32.22 1ab2 s ARG 59 CO -0.17 -1.05 0.49 0.42 -1.08 0.00 0.00 175.30 173.91 1ab2 s ILE 60 N -2.20 2.95 0.40 4.99 1.01 -0.94 -4.88 121.20 122.53 1ab2 s ILE 60 Ca 0.68 -1.13 0.04 0.00 0.00 0.00 0.00 60.65 60.24 1ab2 s ILE 60 Cb -0.21 -3.03 -0.02 0.00 0.01 0.00 0.00 42.46 39.22 1ab2 s ILE 60 CO 0.36 -0.01 0.15 0.20 0.00 0.00 0.00 174.94 175.64 1ab2 s ASN 61 N -4.25 2.65 0.18 3.58 0.01 -1.22 -4.63 114.94 111.26 1ab2 s ASN 61 Ca 0.52 -1.70 0.08 0.00 -0.71 0.00 0.00 52.86 51.05 1ab2 s ASN 61 Cb -0.07 0.53 -0.04 0.00 0.41 0.00 0.00 41.25 42.08 1ab2 s ASN 61 CO 0.31 -0.96 -0.07 -0.89 -1.51 0.00 0.00 177.10 173.98 1ab2 s THR 62 N -3.24 3.33 -0.01 1.60 2.01 -1.26 -2.44 115.64 115.63 1ab2 s THR 62 Ca 0.26 -1.58 -0.11 0.00 0.31 0.00 0.00 61.69 60.57 1ab2 s THR 62 Cb 0.02 -2.65 -0.06 0.00 0.01 0.00 0.00 72.50 69.82 1ab2 s THR 62 CO 0.16 -0.10 0.67 0.00 -0.69 0.00 0.00 174.62 174.66 1ab2 h ALA 63 N 2.89 -0.62 0.00 7.40 0.00 -1.13 -3.47 119.26 124.34 1ab2 h ALA 63 Ca -0.47 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1ab2 h ALA 63 Cb 1.20 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1ab2 h ALA 63 CO 0.55 -0.59 0.00 0.45 0.00 0.00 0.00 179.25 179.66 1ab2 n SER 64 N -3.75 -0.02 -0.09 0.00 2.88 -1.26 -4.96 113.62 106.42 1ab2 n SER 64 Ca -0.05 0.04 -0.14 0.00 -1.33 0.00 0.00 58.87 57.39 1ab2 n SER 64 Cb 0.15 0.08 -0.04 0.00 -0.75 0.00 0.00 64.21 63.65 1ab2 n SER 64 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1ab2 h ASP 65 N 0.00 0.92 0.00 -3.46 5.19 -2.05 -3.46 116.42 113.56 1ab2 h ASP 65 Ca 0.00 -0.51 0.00 0.00 -0.62 0.00 0.00 57.03 55.90 1ab2 h ASP 65 Cb 0.00 -0.26 0.00 0.00 0.18 0.00 0.00 39.33 39.25 1ab2 h ASP 65 CO 0.00 1.25 0.00 0.61 -3.12 0.00 0.00 179.24 177.98 1ab2 n GLY 66 N 0.29 0.29 3.54 2.75 0.00 -1.26 -5.13 105.19 105.67 1ab2 n GLY 66 Ca -0.04 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.49 1ab2 n GLY 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ab2 n LYS 67 N 0.00 0.87 -3.70 1.61 5.02 -1.26 -4.68 118.16 116.02 1ab2 n LYS 67 Ca 0.00 0.31 -0.37 0.00 -2.02 0.00 0.00 58.31 56.23 1ab2 n LYS 67 Cb 0.00 -1.70 -0.12 0.00 -0.02 0.00 0.00 35.03 33.19 1ab2 n LYS 67 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ab2 s LEU 68 N 0.95 3.69 0.09 -0.35 1.02 0.28 -0.60 118.68 123.76 1ab2 s LEU 68 Ca 0.71 -0.21 0.09 0.00 0.02 0.00 0.00 54.13 54.74 1ab2 s LEU 68 Cb -0.89 -1.98 -0.03 0.00 0.02 0.00 0.00 46.19 43.30 1ab2 s LEU 68 CO 0.54 -0.06 -0.24 -0.72 0.02 0.00 0.00 176.35 175.89 1ab2 s TYR 69 N 1.65 2.04 -0.22 0.29 -0.85 -1.02 0.16 117.35 119.39 1ab2 s TYR 69 Ca 0.06 -0.40 0.14 0.00 -0.52 0.00 0.00 57.07 56.36 1ab2 s TYR 69 Cb -0.16 -1.14 -0.20 0.00 0.38 0.00 0.00 41.96 40.84 1ab2 s TYR 69 CO 0.06 0.22 0.40 0.28 -1.52 0.00 0.00 175.55 174.99 1ab2 n VAL 70 N 1.26 0.00 -0.78 -3.49 0.31 -1.24 -3.42 118.33 110.96 1ab2 n VAL 70 Ca -0.18 -0.28 0.00 0.00 -0.01 0.00 0.00 64.34 63.87 1ab2 n VAL 70 Cb 0.53 0.43 0.00 0.00 -0.91 0.00 0.00 33.84 33.89 1ab2 n VAL 70 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1ab2 n SER 71 N -1.79 0.26 0.00 4.52 2.88 -1.26 -4.76 113.62 113.47 1ab2 n SER 71 Ca -0.01 -1.04 0.00 0.00 -1.33 0.00 0.00 58.87 56.49 1ab2 n SER 71 Cb 0.32 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.78 1ab2 n SER 71 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1ab2 n SER 72 N -0.02 0.00 0.00 -3.46 2.88 -1.26 -4.49 113.62 107.26 1ab2 n SER 72 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 1ab2 n SER 72 Cb 0.25 0.00 0.68 0.00 -0.75 0.00 0.00 64.21 64.39 1ab2 n SER 72 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 1ab2 n GLU 73 N 0.00 0.59 -3.27 -1.46 0.28 -1.26 -3.79 120.64 111.72 1ab2 n GLU 73 Ca 0.00 0.03 -0.25 0.00 -0.16 0.00 0.00 57.16 56.78 1ab2 n GLU 73 Cb 0.00 -1.50 -0.08 0.00 1.43 0.00 0.00 31.44 31.29 1ab2 n GLU 73 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1ab2 n SER 74 N -1.13 0.91 -4.83 -1.84 3.41 -1.26 -5.11 113.62 103.77 1ab2 n SER 74 Ca 0.16 -2.83 -0.36 0.00 -0.26 0.00 0.00 58.87 55.58 1ab2 n SER 74 Cb 0.13 -0.64 -0.06 0.00 -0.26 0.00 0.00 64.21 63.38 1ab2 n SER 74 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1ab2 s ARG 75 N -1.34 4.16 -0.02 4.33 0.52 -1.25 -3.64 118.95 121.70 1ab2 s ARG 75 Ca 0.36 0.74 0.01 0.00 -0.52 0.00 0.00 55.73 56.32 1ab2 s ARG 75 Cb 0.15 -2.88 0.02 0.00 0.52 0.00 0.00 34.95 32.76 1ab2 s ARG 75 CO -0.10 0.41 -0.01 -0.06 0.02 0.00 0.00 175.30 175.56 1ab2 s PHE 76 N -1.53 0.31 0.14 -0.53 0.08 0.42 -4.87 117.98 112.00 1ab2 s PHE 76 Ca 0.42 -0.02 0.01 0.00 0.12 0.00 0.00 56.93 57.46 1ab2 s PHE 76 Cb -0.16 -0.34 -0.10 0.00 -0.57 0.00 0.00 43.02 41.84 1ab2 s PHE 76 CO 0.20 -0.09 1.31 -2.95 -0.10 0.00 0.00 175.22 173.59 1ab2 h ASN 77 N 6.91 0.26 -3.44 1.36 7.08 -1.91 0.80 115.58 126.64 1ab2 h ASN 77 Ca -0.38 -0.24 -0.67 0.00 -3.08 0.00 0.00 56.30 51.93 1ab2 h ASN 77 Cb 1.15 -0.08 -0.15 0.00 -2.08 0.00 0.00 38.32 37.16 1ab2 h ASN 77 CO 0.49 1.09 -0.66 0.42 -2.08 0.00 0.00 177.43 176.69 1ab2 s THR 78 N -3.00 4.03 0.06 6.14 -4.23 -1.26 -4.78 115.64 112.60 1ab2 s THR 78 Ca -0.03 -0.55 -0.32 0.00 -1.18 0.00 0.00 61.69 59.62 1ab2 s THR 78 Cb 0.09 -2.75 -0.17 0.00 1.34 0.00 0.00 72.50 71.01 1ab2 s THR 78 CO 0.84 0.45 1.49 -0.07 -0.54 0.00 0.00 174.62 176.80 1ab2 h LEU 79 N 4.65 -1.11 -0.73 4.79 4.07 -1.98 -2.27 115.31 122.73 1ab2 h LEU 79 Ca -0.49 0.07 0.12 0.00 0.08 0.00 0.00 57.88 57.66 1ab2 h LEU 79 Cb 1.18 0.33 -0.13 0.00 1.08 0.00 0.00 40.66 43.12 1ab2 h LEU 79 CO 0.55 -0.66 -0.35 0.00 -1.08 0.00 0.00 178.44 176.91 1ab2 h ALA 80 N -1.24 0.04 -1.09 1.53 0.00 -1.99 1.08 119.26 117.58 1ab2 h ALA 80 Ca -0.09 0.20 0.33 0.00 0.00 0.00 0.00 54.91 55.36 1ab2 h ALA 80 Cb 0.84 0.85 -0.13 0.00 0.00 0.00 0.00 17.79 19.36 1ab2 h ALA 80 CO 0.07 -0.65 0.67 0.93 0.00 0.00 0.00 179.25 180.27 1ab2 h GLU 81 N -0.11 0.28 0.92 0.00 3.07 -1.92 0.77 114.58 117.60 1ab2 h GLU 81 Ca 0.27 -0.02 -0.04 0.00 -0.50 0.00 0.00 59.36 59.07 1ab2 h GLU 81 Cb 0.57 -0.06 0.01 0.00 -0.84 0.00 0.00 28.75 28.42 1ab2 h GLU 81 CO -0.78 0.19 -0.45 1.25 -1.40 0.00 0.00 179.01 177.81 1ab2 h LEU 82 N 0.29 -1.08 -1.30 1.33 6.46 0.18 -2.19 115.31 119.00 1ab2 h LEU 82 Ca 0.72 0.04 0.06 0.00 -0.12 0.00 0.00 57.88 58.58 1ab2 h LEU 82 Cb 1.84 0.29 -0.05 0.00 -0.73 0.00 0.00 40.66 42.01 1ab2 h LEU 82 CO -0.47 -0.76 0.51 0.58 -0.62 0.00 0.00 178.44 177.68 1ab2 h VAL 83 N -1.25 1.04 -0.32 1.05 2.07 -0.43 0.30 116.25 118.71 1ab2 h VAL 83 Ca -0.13 -0.29 0.04 0.00 0.82 0.00 0.00 66.70 67.14 1ab2 h VAL 83 Cb 0.96 0.11 -0.08 0.00 -1.52 0.00 0.00 31.29 30.77 1ab2 h VAL 83 CO 0.20 0.16 -0.55 0.45 0.02 0.00 0.00 177.57 177.84 1ab2 h HIS 84 N 0.86 -1.67 0.26 1.57 3.86 0.81 2.19 115.15 123.02 1ab2 h HIS 84 Ca 0.34 0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.61 1ab2 h HIS 84 Cb 0.22 0.77 0.00 0.00 1.06 0.00 0.00 27.41 29.47 1ab2 h HIS 84 CO -0.00 -0.51 -0.12 1.25 0.86 0.00 0.00 177.93 179.41 1ab2 h HIS 85 N -0.46 -0.32 0.00 2.45 -0.00 -0.91 -1.95 115.15 113.96 1ab2 h HIS 85 Ca 0.06 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.42 1ab2 h HIS 85 Cb 0.63 0.11 0.00 0.00 -0.00 0.00 0.00 27.41 28.14 1ab2 h HIS 85 CO -0.68 -0.01 0.00 0.72 -0.00 0.00 0.00 177.93 177.96 1ab2 n HIS 86 N -5.11 0.00 -0.02 5.26 -0.00 0.05 -0.72 115.22 114.68 1ab2 n HIS 86 Ca -0.09 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.50 1ab2 n HIS 86 Cb 0.24 0.00 -0.10 0.00 -0.00 0.00 0.00 29.99 30.14 1ab2 n HIS 86 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1ab2 h SER 87 N 0.00 0.06 0.00 0.41 0.87 0.44 -2.89 113.55 112.44 1ab2 h SER 87 Ca 0.00 -0.53 -0.05 0.00 -1.23 0.00 0.00 61.79 59.98 1ab2 h SER 87 Cb 0.00 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 61.93 1ab2 h SER 87 CO 0.00 0.57 -1.34 1.07 -0.53 0.00 0.00 176.83 176.60 1ab2 n THR 88 N -4.79 0.20 -3.69 2.23 5.66 -0.94 -3.90 114.28 109.05 1ab2 n THR 88 Ca -0.08 -0.20 -0.27 0.00 -3.05 0.00 0.00 64.05 60.45 1ab2 n THR 88 Cb 0.29 -0.24 -0.11 0.00 -1.55 0.00 0.00 70.33 68.72 1ab2 n THR 88 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1ab2 n VAL 89 N -1.97 1.15 -1.08 1.08 0.31 0.10 -4.99 118.33 112.94 1ab2 n VAL 89 Ca -0.05 -4.64 -0.36 0.00 -0.01 0.00 0.00 64.34 59.28 1ab2 n VAL 89 Cb 0.42 -2.07 -0.04 0.00 -0.91 0.00 0.00 33.84 31.25 1ab2 n VAL 89 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ab2 n ALA 90 N 1.87 4.22 0.94 3.52 0.00 -1.25 -3.65 120.51 126.17 1ab2 n ALA 90 Ca 0.24 -2.94 0.00 0.00 0.00 0.00 0.00 53.44 50.73 1ab2 n ALA 90 Cb 0.39 -3.40 0.00 0.00 0.00 0.00 0.00 19.45 16.44 1ab2 n ALA 90 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1ab2 n ASP 91 N 6.05 2.16 0.02 0.00 8.00 -1.26 -3.98 116.55 127.53 1ab2 n ASP 91 Ca 0.49 -1.88 0.00 0.00 0.71 0.00 0.00 54.79 54.11 1ab2 n ASP 91 Cb 0.30 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 40.93 1ab2 n ASP 91 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ab2 n GLY 92 N 0.35 -0.42 3.71 0.44 0.00 -1.26 -4.36 105.19 103.65 1ab2 n GLY 92 Ca 0.00 0.05 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1ab2 n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ab2 s LEU 93 N -5.24 3.26 0.00 0.99 2.01 -1.26 -4.81 118.68 113.64 1ab2 s LEU 93 Ca 0.00 2.37 0.00 0.00 0.01 0.00 0.00 54.13 56.51 1ab2 s LEU 93 Cb 0.00 -4.59 0.00 0.00 0.01 0.00 0.00 46.19 41.61 1ab2 s LEU 93 CO 0.00 -2.41 0.35 0.00 1.01 0.00 0.00 176.35 175.30 1ab2 n ILE 94 N -2.91 0.00 0.00 -0.59 3.06 -1.26 -4.70 119.36 112.96 1ab2 n ILE 94 Ca 0.14 0.85 0.00 0.00 -2.50 0.00 0.00 62.75 61.23 1ab2 n ILE 94 Cb 0.50 -1.43 0.00 0.00 0.54 0.00 0.00 39.64 39.25 1ab2 n ILE 94 CO 0.00 0.00 0.00 1.07 -2.50 0.00 0.00 176.55 175.12 1ab2 n THR 95 N -0.63 0.00 -4.55 9.51 5.66 -1.26 -5.01 114.28 118.00 1ab2 n THR 95 Ca 0.00 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.74 1ab2 n THR 95 Cb 0.00 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 68.69 1ab2 n THR 95 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1ab2 s THR 96 N 0.00 1.12 -0.31 1.09 -4.23 -1.26 -4.60 115.64 107.46 1ab2 s THR 96 Ca 0.00 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.40 1ab2 s THR 96 Cb 0.00 -2.58 -0.02 0.00 1.34 0.00 0.00 72.50 71.24 1ab2 s THR 96 CO 0.00 0.00 0.18 -0.76 -0.54 0.00 0.00 174.62 173.50 1ab2 s LEU 97 N -3.63 4.15 0.00 4.79 1.43 -1.09 -4.97 118.68 119.37 1ab2 s LEU 97 Ca 0.27 -0.37 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 1ab2 s LEU 97 Cb 0.06 -2.06 0.00 0.00 0.03 0.00 0.00 46.19 44.22 1ab2 s LEU 97 CO 0.13 -0.16 0.00 0.00 0.23 0.00 0.00 176.35 176.55 1ab2 n HIS 98 N 5.03 0.00 -3.68 0.29 1.44 -1.26 -4.65 115.22 112.39 1ab2 n HIS 98 Ca -0.14 0.00 -0.27 0.00 -2.01 0.00 0.00 57.72 55.30 1ab2 n HIS 98 Cb 0.50 0.00 -0.17 0.00 0.12 0.00 0.00 29.99 30.44 1ab2 n HIS 98 CO 0.00 0.00 0.00 1.52 -2.81 0.00 0.00 176.34 175.05 1ab2 s TYR 99 N 0.92 0.67 -0.80 -1.40 1.13 -1.26 -5.08 117.35 111.53 1ab2 s TYR 99 Ca 0.00 -0.66 -0.25 0.00 -1.41 0.00 0.00 57.07 54.75 1ab2 s TYR 99 Cb 0.00 -0.90 0.00 0.00 -1.10 0.00 0.00 41.96 39.96 1ab2 s TYR 99 CO 0.00 -0.58 1.62 -1.25 -2.51 0.00 0.00 175.55 172.82 1ab2 s PRO 100 N 1.98 2.99 1.00 -3.49 0.04 -1.26 -4.54 135.00 131.72 1ab2 s PRO 100 Ca 0.01 -0.21 -0.19 0.00 0.04 0.00 0.00 61.00 60.65 1ab2 s PRO 100 Cb -0.17 -4.68 -0.15 0.00 0.04 0.00 0.00 34.50 29.55 1ab2 s PRO 100 CO -0.10 -2.58 -0.90 0.00 0.04 0.00 0.00 177.00 173.46 1ab2 n ALA 101 N 11.16 -5.39 -1.78 8.56 0.00 -1.26 -4.55 120.51 127.25 1ab2 n ALA 101 Ca 0.22 -0.87 -0.40 0.00 0.00 0.00 0.00 53.44 52.39 1ab2 n ALA 101 Cb 0.50 -1.10 -0.04 0.00 0.00 0.00 0.00 19.45 18.80 1ab2 n ALA 101 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ab2 s PRO 102 N -2.13 4.66 0.16 0.00 0.04 -1.26 -4.77 135.00 131.69 1ab2 s PRO 102 Ca 0.40 1.77 0.05 0.00 0.04 0.00 0.00 61.00 63.27 1ab2 s PRO 102 Cb -0.11 -3.20 -0.04 0.00 0.04 0.00 0.00 34.50 31.19 1ab2 s PRO 102 CO 0.78 0.23 0.12 -1.59 0.04 0.00 0.00 177.00 176.57 1ab2 s LYS 103 N -1.35 2.84 -0.13 4.56 0.00 -1.26 -5.11 119.74 119.29 1ab2 s LYS 103 Ca 0.44 -0.89 -0.12 0.00 0.00 0.00 0.00 55.97 55.41 1ab2 s LYS 103 Cb -0.31 -2.62 -0.05 0.00 0.00 0.00 0.00 37.83 34.85 1ab2 s LYS 103 CO 0.40 0.49 0.26 0.50 0.00 0.00 0.00 175.35 176.99 1ab2 s ARG 104 N -3.04 4.04 0.62 1.78 3.52 -1.26 -5.04 118.95 119.56 1ab2 s ARG 104 Ca 0.30 0.06 -0.16 0.00 -0.13 0.00 0.00 55.73 55.80 1ab2 s ARG 104 Cb -0.10 -3.35 -0.14 0.00 -1.56 0.00 0.00 34.95 29.80 1ab2 s ARG 104 CO 0.23 0.42 -0.33 0.41 -0.81 0.00 0.00 175.30 175.22 1ab2 n GLY 105 N 2.89 -3.43 3.67 8.12 0.00 -1.26 -4.87 105.19 110.32 1ab2 n GLY 105 Ca -0.14 -0.36 -0.40 0.00 0.00 0.00 0.00 46.02 45.12 1ab2 n GLY 105 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1ab2 s ILE 106 N -1.84 5.06 -1.30 -0.61 -1.16 -1.26 -4.97 121.20 115.12 1ab2 s ILE 106 Ca 0.47 1.10 -0.06 0.00 -0.51 0.00 0.00 60.65 61.65 1ab2 s ILE 106 Cb -0.36 -3.90 0.14 0.00 0.61 0.00 0.00 42.46 38.95 1ab2 s ILE 106 CO 0.66 0.16 2.21 1.41 -2.81 0.00 0.00 174.94 176.57 1ab2 n HIS 107 N 4.78 2.68 0.00 3.50 8.25 -1.26 -4.84 115.22 128.33 1ab2 n HIS 107 Ca -0.03 -2.80 0.00 0.00 -0.26 0.00 0.00 57.72 54.63 1ab2 n HIS 107 Cb 0.50 -1.84 0.00 0.00 1.12 0.00 0.00 29.99 29.77 1ab2 n HIS 107 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1ab2 n ARG 108 N 2.28 0.00 -0.00 -0.41 3.00 -1.26 -5.34 116.66 114.92 1ab2 n ARG 108 Ca 0.55 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 58.39 1ab2 n ARG 108 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.74 1ab2 n ARG 108 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38