#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 0.00 -4.50 1.61 7.64 -1.26 -4.84 113.62 112.26 1ab2 n SER 2 Ca 0.00 0.00 -0.48 0.00 1.01 0.00 0.00 58.87 59.40 1ab2 n SER 2 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1ab2 n SER 2 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ab2 n GLY 3 N 0.00 -0.80 2.07 0.23 0.00 -0.99 -4.35 105.19 101.34 1ab2 n GLY 3 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1ab2 n GLY 3 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ab2 n ASN 4 N 1.70 -1.22 -2.52 1.61 2.85 -1.19 -4.92 115.26 111.57 1ab2 n ASN 4 Ca 0.15 0.34 -0.35 0.00 -0.11 0.00 0.00 54.58 54.61 1ab2 n ASN 4 Cb 0.26 1.34 0.05 0.00 1.24 0.00 0.00 39.78 42.68 1ab2 n ASN 4 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1ab2 n SER 5 N -2.94 7.16 -1.44 1.20 3.41 -1.26 -5.01 113.62 114.74 1ab2 n SER 5 Ca 0.00 -3.80 0.00 0.00 -0.26 0.00 0.00 58.87 54.81 1ab2 n SER 5 Cb 0.00 -0.91 0.00 0.00 -0.26 0.00 0.00 64.21 63.04 1ab2 n SER 5 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ab2 n LEU 6 N -0.73 -1.86 -3.58 1.04 7.99 -1.26 -4.39 117.00 114.21 1ab2 n LEU 6 Ca 0.56 2.70 -0.40 0.00 -0.01 0.00 0.00 56.01 58.87 1ab2 n LEU 6 Cb 0.54 -2.69 -0.02 0.00 -0.11 0.00 0.00 43.42 41.14 1ab2 n LEU 6 CO 0.62 -0.09 2.56 -0.62 -1.51 0.00 0.00 177.39 178.36 1ab2 n GLU 7 N -1.60 2.44 0.00 3.23 1.02 -1.26 -4.64 120.64 119.84 1ab2 n GLU 7 Ca 0.00 -2.17 0.00 0.00 -0.02 0.00 0.00 57.16 54.97 1ab2 n GLU 7 Cb 0.19 -3.01 0.00 0.00 -0.02 0.00 0.00 31.44 28.60 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 5.84 0.00 -2.10 3.49 0.00 -1.25 -4.79 118.16 119.34 1ab2 n LYS 8 Ca 0.54 0.00 -0.27 0.00 0.00 0.00 0.00 58.31 58.58 1ab2 n LYS 8 Cb 0.34 -0.06 0.11 0.00 0.00 0.00 0.00 35.03 35.43 1ab2 n LYS 8 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 1ab2 s HIS 9 N 0.00 2.35 -0.07 5.64 3.76 -1.26 -4.93 115.29 120.78 1ab2 s HIS 9 Ca 0.00 0.38 0.01 0.00 -0.15 0.00 0.00 55.06 55.30 1ab2 s HIS 9 Cb 0.00 -3.52 0.10 0.00 1.11 0.00 0.00 32.58 30.26 1ab2 s HIS 9 CO 0.00 -1.91 1.16 0.43 -0.85 0.00 0.00 174.74 173.57 1ab2 n SER 10 N -3.26 3.20 0.00 1.40 7.64 -1.26 -2.36 113.62 118.98 1ab2 n SER 10 Ca 0.11 -2.25 0.00 0.00 1.01 0.00 0.00 58.87 57.74 1ab2 n SER 10 Cb 0.60 -0.57 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 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 0.29 0.00 -4.02 1.43 4.27 -1.26 -1.49 117.44 116.66 1ab2 n TRP 11 Ca 0.09 0.00 -0.31 0.00 -3.89 0.00 0.00 57.50 53.39 1ab2 n TRP 11 Cb 0.67 0.05 -0.16 0.00 -1.36 0.00 0.00 31.31 30.51 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 0.00 2.58 -0.13 -2.67 5.04 -0.99 -4.63 117.35 116.55 1ab2 s TYR 12 Ca 0.00 -1.71 0.11 0.00 -2.44 0.00 0.00 57.07 53.03 1ab2 s TYR 12 Cb 0.00 -1.71 0.20 0.00 0.35 0.00 0.00 41.96 40.80 1ab2 s TYR 12 CO 0.00 -0.77 1.12 -2.39 -1.34 0.00 0.00 175.55 172.17 1ab2 n HIS 13 N 4.64 0.11 0.00 4.97 -0.00 -1.26 -3.93 115.22 119.75 1ab2 n HIS 13 Ca -0.15 -0.77 0.00 0.00 -0.00 0.00 0.00 57.72 56.80 1ab2 n HIS 13 Cb 0.46 -0.12 0.00 0.00 -0.00 0.00 0.00 29.99 30.34 1ab2 n HIS 13 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1ab2 n GLY 14 N -0.88 1.52 3.68 -1.39 0.00 -1.26 -2.34 105.19 104.52 1ab2 n GLY 14 Ca 0.10 -2.21 -0.42 0.00 0.00 0.00 0.00 46.02 43.48 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 -1.47 4.31 0.13 1.61 0.04 -1.26 -4.95 135.00 133.41 1ab2 s PRO 15 Ca 0.00 1.69 0.09 0.00 0.04 0.00 0.00 61.00 62.83 1ab2 s PRO 15 Cb 0.00 -3.63 -0.04 0.00 0.04 0.00 0.00 34.50 30.87 1ab2 s PRO 15 CO 0.00 -0.54 -0.22 0.08 0.04 0.00 0.00 177.00 176.35 1ab2 s VAL 16 N 2.66 1.97 0.47 -0.36 1.01 -1.26 -4.95 120.40 119.94 1ab2 s VAL 16 Ca 0.56 -1.74 -0.21 0.00 0.00 0.00 0.00 61.98 60.59 1ab2 s VAL 16 Cb -0.24 -1.81 -0.08 0.00 0.00 0.00 0.00 36.38 34.25 1ab2 s VAL 16 CO 0.20 -0.08 1.07 -0.55 0.00 0.00 0.00 175.10 175.74 1ab2 s SER 17 N -2.20 6.35 0.32 3.32 0.15 -1.26 -4.14 113.70 116.24 1ab2 s SER 17 Ca 0.12 2.03 0.08 0.00 0.70 0.00 0.00 55.95 58.88 1ab2 s SER 17 Cb -0.09 -2.57 0.81 0.00 -1.71 0.00 0.00 66.02 62.46 1ab2 s SER 17 CO 0.06 -0.78 1.78 0.08 1.20 0.00 0.00 173.24 175.58 1ab2 h ARG 18 N 1.80 0.67 0.11 5.44 0.11 -1.97 0.69 114.38 121.24 1ab2 h ARG 18 Ca -0.49 -0.04 0.01 0.00 0.10 0.00 0.00 59.98 59.55 1ab2 h ARG 18 Cb 1.23 -0.15 -0.03 0.00 1.11 0.00 0.00 29.97 32.12 1ab2 h ARG 18 CO 0.60 0.45 -0.38 -0.91 0.10 0.00 0.00 179.97 179.83 1ab2 h ASN 19 N 0.70 -1.13 -0.83 0.08 2.35 -2.00 0.82 115.58 115.57 1ab2 h ASN 19 Ca 0.57 0.12 -0.04 0.00 -0.55 0.00 0.00 56.30 56.40 1ab2 h ASN 19 Cb 0.98 0.41 -0.04 0.00 0.05 0.00 0.00 38.32 39.73 1ab2 h ASN 19 CO -0.36 -0.41 0.36 0.00 -1.65 0.00 0.00 177.43 175.38 1ab2 h ALA 20 N -0.86 1.07 -0.96 -0.83 0.00 -1.69 -2.02 119.26 113.98 1ab2 h ALA 20 Ca -0.01 -0.18 0.26 0.00 0.00 0.00 0.00 54.91 54.98 1ab2 h ALA 20 Cb 0.55 -0.33 -0.13 0.00 0.00 0.00 0.00 17.79 17.88 1ab2 h ALA 20 CO -0.19 0.67 0.49 0.00 0.00 0.00 0.00 179.25 180.22 1ab2 h ALA 21 N 1.20 1.69 -0.10 0.00 0.00 0.11 1.92 119.26 124.08 1ab2 h ALA 21 Ca 0.28 0.17 -0.17 0.00 0.00 0.00 0.00 54.91 55.18 1ab2 h ALA 21 Cb 0.17 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1ab2 h ALA 21 CO -0.03 -0.41 -0.68 0.93 0.00 0.00 0.00 179.25 179.07 1ab2 h GLU 22 N 0.41 0.41 0.12 0.00 5.08 -0.14 -1.34 114.58 119.11 1ab2 h GLU 22 Ca 0.64 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.68 1ab2 h GLU 22 Cb 1.31 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1ab2 h GLU 22 CO -0.55 0.94 -0.06 -0.92 -1.00 0.00 0.00 179.01 177.42 1ab2 h TYR 23 N 0.29 -0.15 -0.69 4.33 3.20 0.13 -3.28 116.97 120.79 1ab2 h TYR 23 Ca -0.02 -0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.05 1ab2 h TYR 23 Cb 1.24 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.53 1ab2 h TYR 23 CO 0.04 -0.09 0.52 1.37 -1.64 0.00 0.00 178.16 178.35 1ab2 h LEU 24 N -0.60 0.00 -8.15 2.82 8.10 0.24 -3.37 115.31 114.34 1ab2 h LEU 24 Ca -0.02 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 57.89 1ab2 h LEU 24 Cb 0.13 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 40.32 1ab2 h LEU 24 CO 0.03 0.00 0.59 -0.11 -4.11 0.00 0.00 178.44 174.84 1ab2 n LEU 25 N -4.23 0.42 0.00 0.17 7.94 -0.50 -4.71 117.00 116.08 1ab2 n LEU 25 Ca 0.14 -1.53 0.00 0.00 -1.11 0.00 0.00 56.01 53.51 1ab2 n LEU 25 Cb 0.78 -1.28 0.00 0.00 0.53 0.00 0.00 43.42 43.45 1ab2 n LEU 25 CO 0.37 -2.50 0.00 -1.20 -1.11 0.00 0.00 177.39 172.95 1ab2 n SER 26 N 14.15 0.00 0.00 1.96 7.64 -1.26 -4.15 113.62 131.96 1ab2 n SER 26 Ca 0.43 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.31 1ab2 n SER 26 Cb 0.39 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 1ab2 n SER 26 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1ab2 n SER 27 N 1.57 0.00 0.00 6.43 7.64 -1.26 -5.00 113.62 123.00 1ab2 n SER 27 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 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 0.76 2.53 0.23 0.00 -1.26 -5.14 105.19 102.31 1ab2 n GLY 28 Ca 0.00 -0.69 -0.15 0.00 0.00 0.00 0.00 46.02 45.19 1ab2 n GLY 28 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ab2 n ILE 29 N 0.00 0.00 1.07 -0.61 -5.35 -1.26 -4.97 119.36 108.24 1ab2 n ILE 29 Ca 0.00 -1.33 0.10 0.00 -0.27 0.00 0.00 62.75 61.24 1ab2 n ILE 29 Cb 0.00 -0.47 0.54 0.00 -1.74 0.00 0.00 39.64 37.97 1ab2 n ILE 29 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1ab2 n ASN 30 N -2.28 0.00 0.00 7.28 4.13 -1.26 -4.73 115.26 118.40 1ab2 n ASN 30 Ca 0.06 -0.25 0.00 0.00 1.68 0.00 0.00 54.58 56.06 1ab2 n ASN 30 Cb 0.40 -0.17 0.00 0.00 -1.54 0.00 0.00 39.78 38.47 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 0.34 3.51 2.99 7.41 0.00 -1.26 -4.93 105.19 113.24 1ab2 n GLY 31 Ca 0.12 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 1ab2 n GLY 31 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ab2 s SER 32 N 0.00 -0.14 -0.22 1.61 0.15 -1.10 -3.53 113.70 110.47 1ab2 s SER 32 Ca 0.00 0.30 -0.03 0.00 0.70 0.00 0.00 55.95 56.92 1ab2 s SER 32 Cb 0.00 0.26 0.07 0.00 -1.71 0.00 0.00 66.02 64.64 1ab2 s SER 32 CO 0.00 -0.08 0.05 -0.36 1.20 0.00 0.00 173.24 174.05 1ab2 s PHE 33 N 0.44 1.10 -0.17 3.44 0.40 -1.26 0.60 117.98 122.53 1ab2 s PHE 33 Ca -0.03 -1.03 -0.02 0.00 -0.60 0.00 0.00 56.93 55.25 1ab2 s PHE 33 Cb -0.04 -1.15 -0.02 0.00 0.51 0.00 0.00 43.02 42.32 1ab2 s PHE 33 CO -0.02 -0.68 -0.08 -0.48 0.70 0.00 0.00 175.22 174.66 1ab2 s LEU 34 N 1.83 2.90 0.46 -0.37 0.05 0.41 -4.95 118.68 119.01 1ab2 s LEU 34 Ca 0.02 -0.31 -0.23 0.00 0.05 0.00 0.00 54.13 53.66 1ab2 s LEU 34 Cb -0.17 -1.69 -0.07 0.00 -2.05 0.00 0.00 46.19 42.20 1ab2 s LEU 34 CO -0.14 0.10 1.18 0.54 -0.55 0.00 0.00 176.35 177.49 1ab2 s VAL 35 N 0.75 3.02 0.33 1.48 0.11 -1.26 -1.08 120.40 123.76 1ab2 s VAL 35 Ca -0.03 0.78 0.05 0.00 -2.93 0.00 0.00 61.98 59.84 1ab2 s VAL 35 Cb -0.15 -3.40 -0.07 0.00 -1.53 0.00 0.00 36.38 31.24 1ab2 s VAL 35 CO 0.02 -0.00 0.04 -0.60 -3.33 0.00 0.00 175.10 171.22 1ab2 s ARG 36 N -2.67 1.69 -0.18 1.54 3.52 -0.83 -4.46 118.95 117.56 1ab2 s ARG 36 Ca 0.63 -1.93 0.01 0.00 -0.13 0.00 0.00 55.73 54.31 1ab2 s ARG 36 Cb -0.30 -1.02 0.03 0.00 -1.56 0.00 0.00 34.95 32.10 1ab2 s ARG 36 CO 0.36 -0.14 -0.14 -2.00 -0.81 0.00 0.00 175.30 172.57 1ab2 s GLU 37 N -3.84 2.40 0.93 5.12 2.12 -1.26 0.57 118.70 124.73 1ab2 s GLU 37 Ca 0.35 -0.79 -0.12 0.00 0.36 0.00 0.00 54.97 54.77 1ab2 s GLU 37 Cb 0.08 -2.40 0.15 0.00 0.26 0.00 0.00 34.13 32.22 1ab2 s GLU 37 CO 0.15 -0.32 1.11 0.45 -0.54 0.00 0.00 175.26 176.12 1ab2 s SER 38 N 1.37 3.33 0.00 -1.70 0.15 -0.48 -4.79 113.70 111.58 1ab2 s SER 38 Ca 0.02 1.12 0.00 0.00 0.70 0.00 0.00 55.95 57.79 1ab2 s SER 38 Cb -0.15 -1.75 0.00 0.00 -1.71 0.00 0.00 66.02 62.41 1ab2 s SER 38 CO -0.10 -2.68 0.00 -0.62 1.20 0.00 0.00 173.24 171.04 1ab2 n GLU 39 N -3.87 0.61 -0.37 5.44 4.71 -1.26 -4.43 120.64 121.47 1ab2 n GLU 39 Ca 0.06 0.00 0.32 0.00 -0.01 0.00 0.00 57.16 57.53 1ab2 n GLU 39 Cb 0.58 -0.83 0.53 0.00 -1.01 0.00 0.00 31.44 30.71 1ab2 n GLU 39 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 1ab2 n SER 40 N -2.00 0.18 -4.54 1.62 2.88 -1.26 -4.01 113.62 106.48 1ab2 n SER 40 Ca 0.00 1.12 -0.33 0.00 -1.33 0.00 0.00 58.87 58.33 1ab2 n SER 40 Cb 0.33 -0.55 -0.12 0.00 -0.75 0.00 0.00 64.21 63.12 1ab2 n SER 40 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1ab2 s SER 41 N -4.36 4.38 -1.09 -3.46 0.01 -1.26 -5.01 113.70 102.92 1ab2 s SER 41 Ca -0.06 -0.14 -0.07 0.00 1.31 0.00 0.00 55.95 56.98 1ab2 s SER 41 Cb 0.25 -1.00 -0.08 0.00 0.21 0.00 0.00 66.02 65.40 1ab2 s SER 41 CO 0.65 0.32 2.51 -0.81 0.41 0.00 0.00 173.24 176.32 1ab2 n PRO 42 N 1.99 2.63 0.00 12.44 -0.04 -1.26 -3.36 135.00 147.41 1ab2 n PRO 42 Ca -0.17 -1.66 0.00 0.00 -0.04 0.00 0.00 63.50 61.63 1ab2 n PRO 42 Cb 0.53 -2.52 0.00 0.00 -0.04 0.00 0.00 33.50 31.46 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 3.57 -0.04 3.17 0.55 0.00 -1.26 -5.17 105.19 106.02 1ab2 n GLY 43 Ca 0.56 -0.31 -0.14 0.00 0.00 0.00 0.00 46.02 46.13 1ab2 n GLY 43 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ab2 s GLN 44 N 0.00 0.83 0.37 1.61 -0.44 -1.21 -5.09 119.66 115.73 1ab2 s GLN 44 Ca 0.00 -1.14 0.07 0.00 -2.50 0.00 0.00 55.36 51.79 1ab2 s GLN 44 Cb 0.00 -0.53 -0.07 0.00 -1.64 0.00 0.00 33.01 30.76 1ab2 s GLN 44 CO 0.00 0.08 -0.01 1.03 0.50 0.00 0.00 175.29 176.89 1ab2 s ARG 45 N -2.71 1.86 0.34 1.67 3.00 -1.26 -1.38 118.95 120.46 1ab2 s ARG 45 Ca 0.05 -2.02 0.05 0.00 0.00 0.00 0.00 55.73 53.81 1ab2 s ARG 45 Cb -0.03 -1.52 -0.02 0.00 0.00 0.00 0.00 34.95 33.37 1ab2 s ARG 45 CO 0.00 -0.02 0.19 -1.13 0.00 0.00 0.00 175.30 174.34 1ab2 n SER 46 N -0.87 0.38 -3.99 0.23 3.41 0.19 -2.16 113.62 110.82 1ab2 n SER 46 Ca -0.05 -2.96 -0.20 0.00 -0.26 0.00 0.00 58.87 55.40 1ab2 n SER 46 Cb 0.66 1.19 -0.15 0.00 -0.26 0.00 0.00 64.21 65.64 1ab2 n SER 46 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1ab2 s ILE 47 N -3.06 0.72 -0.32 -1.33 1.10 0.74 -1.97 121.20 117.08 1ab2 s ILE 47 Ca 0.26 -0.33 0.02 0.00 -0.51 0.00 0.00 60.65 60.09 1ab2 s ILE 47 Cb 0.01 -0.65 0.10 0.00 0.15 0.00 0.00 42.46 42.07 1ab2 s ILE 47 CO 0.19 0.23 0.07 -0.55 -2.11 0.00 0.00 174.94 172.76 1ab2 s SER 48 N 0.21 4.36 -0.04 4.50 0.15 -0.24 -1.06 113.70 121.58 1ab2 s SER 48 Ca -0.03 -1.85 -0.04 0.00 0.70 0.00 0.00 55.95 54.73 1ab2 s SER 48 Cb -0.08 -1.24 -0.04 0.00 -1.71 0.00 0.00 66.02 62.95 1ab2 s SER 48 CO 0.00 -0.39 0.15 -0.76 1.20 0.00 0.00 173.24 173.45 1ab2 s LEU 49 N 1.27 4.28 -0.12 3.45 1.43 -0.78 0.15 118.68 128.38 1ab2 s LEU 49 Ca 0.09 0.35 -0.01 0.00 -1.03 0.00 0.00 54.13 53.54 1ab2 s LEU 49 Cb -0.18 -2.38 -0.02 0.00 0.03 0.00 0.00 46.19 43.63 1ab2 s LEU 49 CO -0.16 0.31 -0.09 -0.60 0.23 0.00 0.00 176.35 176.04 1ab2 s ARG 50 N -1.61 3.25 0.00 1.70 6.06 2.54 -1.04 118.95 129.85 1ab2 s ARG 50 Ca 0.23 -0.60 0.00 0.00 -2.50 0.00 0.00 55.73 52.85 1ab2 s ARG 50 Cb -0.12 -2.69 0.00 0.00 0.06 0.00 0.00 34.95 32.20 1ab2 s ARG 50 CO 0.13 0.36 0.00 0.98 -2.50 0.00 0.00 175.30 174.28 1ab2 n TYR 51 N 3.12 0.00 0.00 5.12 4.19 -0.62 -2.71 117.16 126.26 1ab2 n TYR 51 Ca -0.18 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.03 1ab2 n TYR 51 Cb 0.53 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.36 1ab2 n TYR 51 CO 0.00 0.00 0.00 -0.85 0.91 0.00 0.00 176.86 176.92 1ab2 n GLU 52 N 0.00 0.00 -2.13 2.98 0.28 -1.26 -4.47 120.64 116.03 1ab2 n GLU 52 Ca 0.00 0.00 -0.14 0.00 -0.16 0.00 0.00 57.16 56.86 1ab2 n GLU 52 Cb 0.00 -0.98 0.04 0.00 1.43 0.00 0.00 31.44 31.93 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 -0.48 4.77 3.45 -1.84 0.00 -1.26 -4.66 105.19 105.17 1ab2 n GLY 53 Ca 0.00 -2.03 -0.09 0.00 0.00 0.00 0.00 46.02 43.89 1ab2 n GLY 53 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ab2 s ARG 54 N -3.50 1.31 0.07 1.61 6.06 -1.26 -5.17 118.95 118.06 1ab2 s ARG 54 Ca 0.42 -1.05 0.05 0.00 -2.50 0.00 0.00 55.73 52.65 1ab2 s ARG 54 Cb 0.38 0.45 -0.03 0.00 0.06 0.00 0.00 34.95 35.81 1ab2 s ARG 54 CO 0.00 -0.52 -0.15 0.08 -2.50 0.00 0.00 175.30 172.21 1ab2 s VAL 55 N -3.93 1.14 -0.08 7.11 1.01 -1.26 -1.59 120.40 122.80 1ab2 s VAL 55 Ca 0.14 -1.25 0.04 0.00 0.00 0.00 0.00 61.98 60.91 1ab2 s VAL 55 Cb 0.01 -1.08 0.00 0.00 0.00 0.00 0.00 36.38 35.31 1ab2 s VAL 55 CO 0.00 -0.17 -0.20 -0.31 0.00 0.00 0.00 175.10 174.43 1ab2 s TYR 56 N -1.18 2.14 -0.55 5.22 2.02 -0.21 -5.01 117.35 119.78 1ab2 s TYR 56 Ca -0.01 -0.83 0.02 0.00 -0.37 0.00 0.00 57.07 55.89 1ab2 s TYR 56 Cb -0.10 -1.46 0.14 0.00 -0.40 0.00 0.00 41.96 40.15 1ab2 s TYR 56 CO 0.02 -0.35 0.31 -1.01 -1.57 0.00 0.00 175.55 172.96 1ab2 s HIS 57 N 0.40 3.25 -0.17 2.71 3.76 -1.26 -1.86 115.29 122.13 1ab2 s HIS 57 Ca -0.16 -3.08 0.00 0.00 -0.15 0.00 0.00 55.06 51.67 1ab2 s HIS 57 Cb -0.17 -2.91 0.00 0.00 1.11 0.00 0.00 32.58 30.62 1ab2 s HIS 57 CO 0.07 -0.76 -0.16 0.71 -0.85 0.00 0.00 174.74 173.75 1ab2 s TYR 58 N -0.31 2.78 1.10 1.40 1.51 -0.22 -4.94 117.35 118.67 1ab2 s TYR 58 Ca 0.17 -1.21 -0.17 0.00 -1.01 0.00 0.00 57.07 54.85 1ab2 s TYR 58 Cb -0.24 -1.91 0.11 0.00 -0.11 0.00 0.00 41.96 39.82 1ab2 s TYR 58 CO -0.01 -0.58 0.18 2.89 -1.11 0.00 0.00 175.55 176.91 1ab2 n ARG 59 N 4.26 -1.47 0.00 -0.62 1.85 -1.26 -0.19 116.66 119.24 1ab2 n ARG 59 Ca -0.20 -0.41 0.00 0.00 -1.00 0.00 0.00 57.85 56.25 1ab2 n ARG 59 Cb 0.51 -1.78 0.00 0.00 -1.05 0.00 0.00 32.46 30.15 1ab2 n ARG 59 CO 0.00 0.00 0.00 -0.89 -0.01 0.00 0.00 177.63 176.73 1ab2 n ILE 60 N -4.35 0.00 0.00 8.89 2.08 -0.92 -4.44 119.36 120.63 1ab2 n ILE 60 Ca 0.02 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.33 1ab2 n ILE 60 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.49 1ab2 n ILE 60 CO 0.00 0.00 0.00 -3.20 0.56 0.00 0.00 176.55 173.91 1ab2 n ASN 61 N 0.00 0.00 -4.58 4.38 2.85 -1.26 -4.85 115.26 111.80 1ab2 n ASN 61 Ca 0.00 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 54.15 1ab2 n ASN 61 Cb 0.00 0.00 -0.11 0.00 1.24 0.00 0.00 39.78 40.91 1ab2 n ASN 61 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1ab2 s THR 62 N 0.00 3.53 -0.42 -0.44 2.01 -1.26 0.92 115.64 119.98 1ab2 s THR 62 Ca 0.00 -0.87 -0.06 0.00 0.31 0.00 0.00 61.69 61.08 1ab2 s THR 62 Cb 0.00 -2.54 -0.12 0.00 0.01 0.00 0.00 72.50 69.85 1ab2 s THR 62 CO 0.00 0.36 3.21 0.00 -0.69 0.00 0.00 174.62 177.50 1ab2 n ALA 63 N 1.47 6.57 -2.69 7.40 0.00 -0.98 -4.69 120.51 127.61 1ab2 n ALA 63 Ca -0.15 -2.55 -0.10 0.00 0.00 0.00 0.00 53.44 50.64 1ab2 n ALA 63 Cb 0.52 -2.42 -0.02 0.00 0.00 0.00 0.00 19.45 17.53 1ab2 n ALA 63 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ab2 n SER 64 N 2.09 -1.03 0.09 0.00 3.41 -1.26 -4.40 113.62 112.52 1ab2 n SER 64 Ca 0.50 0.03 0.00 0.00 -0.26 0.00 0.00 58.87 59.15 1ab2 n SER 64 Cb 0.68 -0.98 0.00 0.00 -0.26 0.00 0.00 64.21 63.65 1ab2 n SER 64 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1ab2 n ASP 65 N -1.45 -0.06 0.00 4.04 -0.08 -1.26 -5.09 116.55 112.65 1ab2 n ASP 65 Ca 0.03 0.30 0.00 0.00 -1.51 0.00 0.00 54.79 53.61 1ab2 n ASP 65 Cb 0.41 0.23 0.00 0.00 2.34 0.00 0.00 41.12 44.10 1ab2 n ASP 65 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1ab2 n GLY 66 N 1.63 -0.13 3.47 0.27 0.00 -1.26 -5.14 105.19 104.03 1ab2 n GLY 66 Ca 0.00 0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1ab2 n GLY 66 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ab2 n LYS 67 N 0.00 0.62 -3.57 1.61 0.00 -1.26 -4.71 118.16 110.85 1ab2 n LYS 67 Ca 0.00 0.23 -0.41 0.00 -0.00 0.00 0.00 58.31 58.13 1ab2 n LYS 67 Cb 0.00 -1.59 -0.11 0.00 -0.00 0.00 0.00 35.03 33.33 1ab2 n LYS 67 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1ab2 s LEU 68 N 1.37 4.77 -0.14 -5.58 1.02 0.72 -2.31 118.68 118.52 1ab2 s LEU 68 Ca 0.64 -0.95 0.00 0.00 0.02 0.00 0.00 54.13 53.84 1ab2 s LEU 68 Cb -0.56 -2.05 0.03 0.00 0.02 0.00 0.00 46.19 43.62 1ab2 s LEU 68 CO 0.57 -0.39 -0.11 -0.72 0.02 0.00 0.00 176.35 175.72 1ab2 s TYR 69 N 1.58 1.96 0.15 0.29 1.13 0.26 0.11 117.35 122.84 1ab2 s TYR 69 Ca 0.03 -1.10 0.09 0.00 -1.41 0.00 0.00 57.07 54.68 1ab2 s TYR 69 Cb -0.19 -1.48 0.04 0.00 -1.10 0.00 0.00 41.96 39.24 1ab2 s TYR 69 CO 0.07 -0.63 1.43 0.28 -2.51 0.00 0.00 175.55 174.19 1ab2 h VAL 70 N 6.14 1.53 0.00 -3.49 2.07 -1.78 -3.40 116.25 117.31 1ab2 h VAL 70 Ca -0.34 -2.81 0.00 0.00 0.82 0.00 0.00 66.70 64.37 1ab2 h VAL 70 Cb 1.13 2.54 0.00 0.00 -1.52 0.00 0.00 31.29 33.44 1ab2 h VAL 70 CO 0.48 0.79 0.00 -0.24 0.02 0.00 0.00 177.57 178.62 1ab2 n SER 71 N -3.50 0.00 0.00 0.57 2.88 -1.26 -4.82 113.62 107.48 1ab2 n SER 71 Ca -0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1ab2 n SER 71 Cb 0.80 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.26 1ab2 n SER 71 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1ab2 n SER 72 N -0.57 0.00 0.00 -3.46 7.64 -1.26 -4.92 113.62 111.05 1ab2 n SER 72 Ca 0.00 0.00 0.15 0.00 1.01 0.00 0.00 58.87 60.03 1ab2 n SER 72 Cb 0.00 0.00 0.89 0.00 -1.01 0.00 0.00 64.21 64.09 1ab2 n SER 72 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1ab2 n GLU 73 N 0.00 0.87 -3.23 1.43 0.28 -1.26 -3.86 120.64 114.86 1ab2 n GLU 73 Ca 0.00 0.00 -0.24 0.00 -0.16 0.00 0.00 57.16 56.76 1ab2 n GLU 73 Cb 0.00 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.31 1ab2 n GLU 73 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1ab2 n SER 74 N -1.05 1.83 -4.84 -1.84 7.64 -1.26 -5.10 113.62 109.00 1ab2 n SER 74 Ca 0.22 -3.08 -0.34 0.00 1.01 0.00 0.00 58.87 56.68 1ab2 n SER 74 Cb 0.13 -0.64 -0.06 0.00 -1.01 0.00 0.00 64.21 62.63 1ab2 n SER 74 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1ab2 s ARG 75 N -2.02 4.04 0.20 1.43 0.52 -1.25 -4.23 118.95 117.64 1ab2 s ARG 75 Ca 0.39 0.62 0.00 0.00 -0.52 0.00 0.00 55.73 56.22 1ab2 s ARG 75 Cb 0.20 -2.74 -0.04 0.00 0.52 0.00 0.00 34.95 32.89 1ab2 s ARG 75 CO -0.08 0.34 0.07 -0.06 0.02 0.00 0.00 175.30 175.60 1ab2 s PHE 76 N -1.67 1.23 -0.14 -0.53 0.08 0.12 -4.95 117.98 112.11 1ab2 s PHE 76 Ca 0.45 -1.20 0.08 0.00 0.12 0.00 0.00 56.93 56.37 1ab2 s PHE 76 Cb -0.14 -0.68 -0.14 0.00 -0.57 0.00 0.00 43.02 41.49 1ab2 s PHE 76 CO 0.20 -0.42 -0.03 0.09 -0.10 0.00 0.00 175.22 174.96 1ab2 n ASN 77 N -0.29 2.10 -4.37 1.36 3.02 -1.26 0.26 115.26 116.08 1ab2 n ASN 77 Ca -0.02 -0.03 -0.27 0.00 -0.03 0.00 0.00 54.58 54.23 1ab2 n ASN 77 Cb 0.65 0.41 -0.12 0.00 -0.61 0.00 0.00 39.78 40.11 1ab2 n ASN 77 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1ab2 s THR 78 N -2.33 2.12 0.16 3.41 -4.23 -1.26 -4.67 115.64 108.85 1ab2 s THR 78 Ca -0.13 -1.78 -0.18 0.00 -1.18 0.00 0.00 61.69 58.42 1ab2 s THR 78 Cb 0.05 -1.91 0.08 0.00 1.34 0.00 0.00 72.50 72.05 1ab2 s THR 78 CO 0.48 -0.02 1.66 0.17 -0.54 0.00 0.00 174.62 176.37 1ab2 h LEU 79 N 3.73 -0.49 -0.41 4.79 8.10 -1.97 -1.81 115.31 127.24 1ab2 h LEU 79 Ca -0.48 0.13 0.04 0.00 0.11 0.00 0.00 57.88 57.68 1ab2 h LEU 79 Cb 1.18 0.28 -0.07 0.00 -0.44 0.00 0.00 40.66 41.62 1ab2 h LEU 79 CO 0.42 -0.18 -0.40 0.00 -4.11 0.00 0.00 178.44 174.17 1ab2 h ALA 80 N 1.24 -0.57 -1.21 0.17 0.00 -1.99 0.98 119.26 117.88 1ab2 h ALA 80 Ca 0.18 0.02 0.35 0.00 0.00 0.00 0.00 54.91 55.46 1ab2 h ALA 80 Cb 0.35 1.08 -0.08 0.00 0.00 0.00 0.00 17.79 19.14 1ab2 h ALA 80 CO -0.41 -0.79 0.82 0.93 0.00 0.00 0.00 179.25 179.81 1ab2 h GLU 81 N -0.20 0.15 0.30 0.00 3.07 -1.81 0.89 114.58 116.99 1ab2 h GLU 81 Ca 0.07 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.91 1ab2 h GLU 81 Cb 0.38 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 1ab2 h GLU 81 CO -0.49 0.10 -0.15 1.25 -1.40 0.00 0.00 179.01 178.32 1ab2 h LEU 82 N 0.16 -0.34 -0.75 1.33 6.46 0.17 -2.37 115.31 119.96 1ab2 h LEU 82 Ca 0.64 -0.12 -0.07 0.00 -0.12 0.00 0.00 57.88 58.21 1ab2 h LEU 82 Cb 2.14 0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 42.13 1ab2 h LEU 82 CO -0.18 -0.07 0.16 0.58 -0.62 0.00 0.00 178.44 178.30 1ab2 h VAL 83 N -0.62 1.26 -0.36 1.05 2.07 0.16 0.31 116.25 120.12 1ab2 h VAL 83 Ca -0.04 -0.97 0.04 0.00 0.82 0.00 0.00 66.70 66.55 1ab2 h VAL 83 Cb 0.44 0.56 -0.07 0.00 -1.52 0.00 0.00 31.29 30.70 1ab2 h VAL 83 CO 0.07 0.37 -0.51 0.45 0.02 0.00 0.00 177.57 177.97 1ab2 h HIS 84 N 1.05 -1.57 -0.13 1.57 3.86 0.72 1.37 115.15 122.02 1ab2 h HIS 84 Ca 0.22 0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.49 1ab2 h HIS 84 Cb 0.38 0.73 -0.01 0.00 1.06 0.00 0.00 27.41 29.57 1ab2 h HIS 84 CO 0.03 -0.46 0.02 1.25 0.86 0.00 0.00 177.93 179.64 1ab2 h HIS 85 N -0.38 0.22 0.00 2.45 6.17 -1.33 -1.42 115.15 120.87 1ab2 h HIS 85 Ca 0.06 -0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.11 1ab2 h HIS 85 Cb 0.55 -0.06 0.00 0.00 2.52 0.00 0.00 27.41 30.42 1ab2 h HIS 85 CO -0.71 0.39 0.00 0.72 0.71 0.00 0.00 177.93 179.04 1ab2 n HIS 86 N -4.83 0.00 0.08 5.26 -0.00 0.09 -0.41 115.22 115.41 1ab2 n HIS 86 Ca -0.05 0.00 -0.22 0.00 -0.00 0.00 0.00 57.72 57.45 1ab2 n HIS 86 Cb 0.17 0.00 -0.14 0.00 -0.00 0.00 0.00 29.99 30.02 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 0.76 0.00 0.41 0.87 0.30 -3.35 113.55 112.54 1ab2 h SER 87 Ca 0.00 -0.86 0.00 0.00 -1.23 0.00 0.00 61.79 59.70 1ab2 h SER 87 Cb 0.00 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 61.72 1ab2 h SER 87 CO 0.00 1.55 -0.01 1.07 -0.53 0.00 0.00 176.83 178.91 1ab2 n THR 88 N -3.89 0.00 -3.22 2.23 5.66 -0.99 -4.49 114.28 109.59 1ab2 n THR 88 Ca -0.14 -0.30 -0.24 0.00 -3.05 0.00 0.00 64.05 60.32 1ab2 n THR 88 Cb 0.94 0.99 -0.07 0.00 -1.55 0.00 0.00 70.33 70.64 1ab2 n THR 88 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 175.07 173.35 1ab2 n VAL 89 N -0.62 -0.06 -1.17 1.08 0.24 0.45 -5.02 118.33 113.24 1ab2 n VAL 89 Ca 0.00 -4.32 -0.40 0.00 -2.04 0.00 0.00 64.34 57.58 1ab2 n VAL 89 Cb 0.00 -1.74 -0.07 0.00 -1.47 0.00 0.00 33.84 30.56 1ab2 n VAL 89 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ab2 n ALA 90 N 1.13 2.41 0.98 2.33 0.00 -1.26 -3.90 120.51 122.20 1ab2 n ALA 90 Ca 0.23 -3.09 0.09 0.00 0.00 0.00 0.00 53.44 50.68 1ab2 n ALA 90 Cb 0.53 -3.63 0.50 0.00 0.00 0.00 0.00 19.45 16.85 1ab2 n ALA 90 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1ab2 n ASP 91 N 9.44 0.00 0.09 0.00 -0.08 -1.26 -4.04 116.55 120.70 1ab2 n ASP 91 Ca 0.48 -0.20 0.00 0.00 -1.51 0.00 0.00 54.79 53.56 1ab2 n ASP 91 Cb 0.42 -0.18 0.00 0.00 2.34 0.00 0.00 41.12 43.70 1ab2 n ASP 91 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1ab2 n GLY 92 N 0.24 -0.17 3.76 0.27 0.00 -1.26 -4.48 105.19 103.55 1ab2 n GLY 92 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 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 -6.58 3.82 0.00 0.99 1.43 -1.26 -4.98 118.68 112.11 1ab2 s LEU 93 Ca 0.00 2.49 0.00 0.00 -1.03 0.00 0.00 54.13 55.59 1ab2 s LEU 93 Cb 0.00 -4.39 0.00 0.00 0.03 0.00 0.00 46.19 41.83 1ab2 s LEU 93 CO 0.00 -1.39 0.14 2.30 0.23 0.00 0.00 176.35 177.62 1ab2 n ILE 94 N -1.10 0.00 0.00 -0.59 -5.35 -1.26 -4.68 119.36 106.38 1ab2 n ILE 94 Ca 0.11 0.64 0.00 0.00 -0.27 0.00 0.00 62.75 63.23 1ab2 n ILE 94 Cb 0.48 -1.51 0.00 0.00 -1.74 0.00 0.00 39.64 36.87 1ab2 n ILE 94 CO 0.00 0.00 0.00 1.07 -1.76 0.00 0.00 176.55 175.86 1ab2 n THR 95 N -0.17 0.00 -3.74 7.28 5.66 -1.26 -4.88 114.28 117.16 1ab2 n THR 95 Ca 0.00 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.79 1ab2 n THR 95 Cb 0.00 0.00 -0.18 0.00 -1.55 0.00 0.00 70.33 68.60 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 0.15 0.01 1.09 -4.23 -1.26 -4.63 115.64 106.77 1ab2 s THR 96 Ca 0.00 0.25 -0.06 0.00 -1.18 0.00 0.00 61.69 60.70 1ab2 s THR 96 Cb 0.00 -0.35 -0.03 0.00 1.34 0.00 0.00 72.50 73.46 1ab2 s THR 96 CO 0.00 0.22 0.15 0.00 -0.54 0.00 0.00 174.62 174.45 1ab2 n LEU 97 N 5.12 -0.05 -1.15 4.79 -0.00 -1.25 -4.84 117.00 119.61 1ab2 n LEU 97 Ca -0.07 0.19 0.03 0.00 -0.00 0.00 0.00 56.01 56.16 1ab2 n LEU 97 Cb 0.50 -0.15 0.01 0.00 -0.00 0.00 0.00 43.42 43.78 1ab2 n LEU 97 CO 0.10 -0.36 0.13 1.57 -0.00 0.00 0.00 177.39 178.82 1ab2 n HIS 98 N 0.19 0.00 -2.70 1.47 -0.00 -1.24 -4.85 115.22 108.08 1ab2 n HIS 98 Ca 0.03 -0.33 -0.05 0.00 0.46 0.00 0.00 57.72 57.83 1ab2 n HIS 98 Cb 0.02 -0.11 0.10 0.00 -0.12 0.00 0.00 29.99 29.88 1ab2 n HIS 98 CO 0.00 0.00 0.00 2.48 0.46 0.00 0.00 176.34 179.28 1ab2 n TYR 99 N 0.32 -1.28 1.40 1.57 4.11 -1.23 -4.63 117.16 117.43 1ab2 n TYR 99 Ca 0.04 -2.07 0.00 0.00 -0.00 0.00 0.00 57.90 55.87 1ab2 n TYR 99 Cb 0.99 1.02 0.00 0.00 -0.00 0.00 0.00 39.34 41.35 1ab2 n TYR 99 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.86 176.51 1ab2 n PRO 100 N -0.72 0.76 -2.62 -3.48 -0.04 -1.26 -4.69 135.00 122.94 1ab2 n PRO 100 Ca -0.03 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.05 1ab2 n PRO 100 Cb 0.85 -1.06 -0.05 0.00 -0.04 0.00 0.00 33.50 33.20 1ab2 n PRO 100 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ab2 s ALA 101 N -1.85 3.22 0.87 0.55 0.00 -1.17 -4.13 121.76 119.24 1ab2 s ALA 101 Ca 0.00 0.69 -0.12 0.00 0.00 0.00 0.00 51.96 52.53 1ab2 s ALA 101 Cb 0.00 -3.25 0.11 0.00 0.00 0.00 0.00 23.12 19.98 1ab2 s ALA 101 CO 0.00 -0.04 1.12 -1.25 0.00 0.00 0.00 175.76 175.59 1ab2 s PRO 102 N -2.00 1.51 -0.19 0.00 0.04 -0.55 -4.27 135.00 129.54 1ab2 s PRO 102 Ca 0.51 0.41 -0.06 0.00 0.04 0.00 0.00 61.00 61.90 1ab2 s PRO 102 Cb -0.24 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 1ab2 s PRO 102 CO 0.30 -1.97 0.03 -1.59 0.04 0.00 0.00 177.00 173.81 1ab2 s LYS 103 N -5.24 3.83 -0.26 4.56 0.00 -1.26 -4.98 119.74 116.38 1ab2 s LYS 103 Ca 0.63 -0.42 -0.12 0.00 0.00 0.00 0.00 55.97 56.06 1ab2 s LYS 103 Cb -0.15 -3.14 -0.14 0.00 0.00 0.00 0.00 37.83 34.40 1ab2 s LYS 103 CO 0.54 0.18 -0.26 -2.13 0.00 0.00 0.00 175.35 173.68 1ab2 n ARG 104 N 3.78 0.60 -2.04 1.78 0.63 -1.26 -4.79 116.66 115.36 1ab2 n ARG 104 Ca -0.17 0.27 -0.28 0.00 -0.92 0.00 0.00 57.85 56.76 1ab2 n ARG 104 Cb 0.52 -1.53 -0.05 0.00 0.45 0.00 0.00 32.46 31.85 1ab2 n ARG 104 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1ab2 s GLY 105 N -5.62 0.16 -0.11 5.14 0.00 -1.26 -4.71 107.32 100.93 1ab2 s GLY 105 Ca -0.37 -1.39 -0.09 0.00 0.00 0.00 0.00 44.72 42.87 1ab2 s GLY 105 CO 0.53 3.50 -0.17 1.39 0.00 0.00 0.00 173.10 178.34 1ab2 n ILE 106 N 7.82 1.00 -2.67 0.90 -0.00 -1.26 -4.96 119.36 120.18 1ab2 n ILE 106 Ca 0.38 0.28 -0.04 0.00 -0.00 0.00 0.00 62.75 63.38 1ab2 n ILE 106 Cb 0.47 -2.10 0.10 0.00 -0.00 0.00 0.00 39.64 38.11 1ab2 n ILE 106 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1ab2 n HIS 107 N -3.87 -0.64 -3.76 1.39 1.44 -1.26 -4.97 115.22 103.54 1ab2 n HIS 107 Ca -0.07 -0.86 -0.15 0.00 -2.01 0.00 0.00 57.72 54.62 1ab2 n HIS 107 Cb 0.25 1.22 -0.16 0.00 0.12 0.00 0.00 29.99 31.42 1ab2 n HIS 107 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 1ab2 s ARG 108 N 0.06 -0.04 0.00 -1.40 0.52 -1.26 -5.10 118.95 111.74 1ab2 s ARG 108 Ca 0.19 0.21 0.00 0.00 -0.52 0.00 0.00 55.73 55.61 1ab2 s ARG 108 Cb 0.28 -0.27 0.00 0.00 0.52 0.00 0.00 34.95 35.48 1ab2 s ARG 108 CO -0.17 -0.18 0.08 -0.25 0.02 0.00 0.00 175.30 174.80