#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2epe s VAL 2 N 0.00 4.93 0.53 3.15 1.01 -1.26 -0.92 120.40 127.84 2epe s VAL 2 Ca 0.00 0.26 -0.16 0.00 0.00 0.00 0.00 61.98 62.08 2epe s VAL 2 Cb 0.00 -4.08 -0.07 0.00 0.00 0.00 0.00 36.38 32.23 2epe s VAL 2 CO 0.00 -0.38 0.99 -0.36 0.00 0.00 0.00 175.10 175.35 2epe s PHE 3 N 2.58 3.46 0.46 5.22 0.40 -0.05 -4.99 117.98 125.06 2epe s PHE 3 Ca 0.21 1.45 -0.02 0.00 -0.60 0.00 0.00 56.93 57.96 2epe s PHE 3 Cb -0.15 -2.79 -0.02 0.00 0.51 0.00 0.00 43.02 40.57 2epe s PHE 3 CO 0.16 -0.42 0.71 0.20 0.70 0.00 0.00 175.22 176.57 2epe s GLY 4 N -3.18 1.50 0.08 4.36 0.00 -1.26 -4.84 107.32 103.98 2epe s GLY 4 Ca 0.59 -0.80 -0.33 0.00 0.00 0.00 0.00 44.72 44.18 2epe s GLY 4 CO 0.34 -0.64 1.61 -0.09 0.00 0.00 0.00 173.10 174.32 2epe h ARG 5 N 0.33 -0.83 -0.11 2.90 2.43 -1.97 -1.04 114.38 116.09 2epe h ARG 5 Ca -0.47 0.06 -0.11 0.00 -0.81 0.00 0.00 59.98 58.65 2epe h ARG 5 Cb 1.23 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.96 2epe h ARG 5 CO 0.60 -0.55 -0.40 0.00 -1.51 0.00 0.00 179.97 178.10 2epe h GLU 7 N 0.20 1.11 -0.12 0.00 4.81 -1.90 0.30 114.58 118.99 2epe h GLU 7 Ca 0.02 -0.26 -0.14 0.00 -0.13 0.00 0.00 59.36 58.85 2epe h GLU 7 Cb 0.80 -0.15 0.01 0.00 0.63 0.00 0.00 28.75 30.04 2epe h GLU 7 CO 0.06 0.97 -0.47 1.25 -0.73 0.00 0.00 179.01 180.10 2epe h LEU 8 N 1.06 0.62 -0.28 1.64 5.85 -0.99 -1.29 115.31 121.92 2epe h LEU 8 Ca 0.22 -0.62 0.06 0.00 0.84 0.00 0.00 57.88 58.38 2epe h LEU 8 Cb 0.35 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.14 2epe h LEU 8 CO -0.00 1.13 -0.11 0.00 -0.34 0.00 0.00 178.44 179.13 2epe h ALA 9 N 0.50 0.13 -0.85 1.25 0.00 -0.97 0.84 119.26 120.15 2epe h ALA 9 Ca -0.02 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2epe h ALA 9 Cb 1.10 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 19.13 2epe h ALA 9 CO 0.10 -0.50 0.44 0.00 0.00 0.00 0.00 179.25 179.28 2epe h ALA 10 N 1.19 1.10 -0.64 0.00 0.00 -0.82 -1.07 119.26 119.02 2epe h ALA 10 Ca 0.14 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2epe h ALA 10 Cb 0.27 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2epe h ALA 10 CO -0.32 0.63 0.29 0.00 0.00 0.00 0.00 179.25 179.85 2epe h ALA 11 N 1.24 1.30 -0.38 0.00 0.00 -0.51 -1.48 119.26 119.43 2epe h ALA 11 Ca 0.30 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 2epe h ALA 11 Cb 0.07 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2epe h ALA 11 CO -0.04 0.53 -0.21 0.52 0.00 0.00 0.00 179.25 180.05 2epe h MET 12 N 0.91 0.81 -0.45 0.00 2.86 -0.44 -1.18 114.93 117.45 2epe h MET 12 Ca 0.22 -0.37 0.00 0.00 -2.06 0.00 0.00 59.70 57.49 2epe h MET 12 Cb 0.13 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 2epe h MET 12 CO -0.03 1.00 0.28 -0.22 1.06 0.00 0.00 176.91 179.01 2epe h LYS 13 N 0.61 0.60 -0.39 1.72 3.64 -1.01 -1.48 116.57 120.26 2epe h LYS 13 Ca 0.08 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2epe h LYS 13 Cb 0.77 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.44 2epe h LYS 13 CO 0.06 0.42 0.14 -0.09 -2.27 0.00 0.00 179.45 177.71 2epe h ARG 14 N 0.60 0.55 -0.52 1.90 2.43 -1.09 -1.40 114.38 116.86 2epe h ARG 14 Ca 0.16 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2epe h ARG 14 Cb -0.04 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 2epe h ARG 14 CO -0.03 0.46 0.00 0.72 -1.51 0.00 0.00 179.97 179.61 2epe n HIS 15 N -4.38 0.55 -1.27 2.20 8.25 -0.46 -4.92 115.22 115.19 2epe n HIS 15 Ca 0.02 -0.22 -0.03 0.00 -0.26 0.00 0.00 57.72 57.23 2epe n HIS 15 Cb 0.15 -0.11 -0.01 0.00 1.12 0.00 0.00 29.99 31.14 2epe n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2epe n GLY 16 N 0.64 0.54 0.16 -1.41 0.00 -0.53 -4.97 105.19 99.63 2epe n GLY 16 Ca 0.10 -0.91 0.06 0.00 0.00 0.00 0.00 46.02 45.27 2epe n GLY 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2epe h LEU 17 N 0.00 0.00 -9.00 0.99 3.38 -1.52 -3.39 115.31 105.77 2epe h LEU 17 Ca -0.06 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.33 2epe h LEU 17 Cb 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2epe h LEU 17 CO 0.09 0.30 1.40 -0.62 0.09 0.00 0.00 178.44 179.70 2epe s ASP 18 N -6.27 5.69 -1.19 -0.43 2.15 -1.26 -1.25 116.67 114.10 2epe s ASP 18 Ca 0.04 1.83 0.00 0.00 0.43 0.00 0.00 52.55 54.86 2epe s ASP 18 Cb 0.07 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.17 2epe s ASP 18 CO 0.72 -1.79 0.00 0.59 -0.17 0.00 0.00 175.17 174.53 2epe n ASN 19 N 10.84 -4.64 -4.69 -0.34 3.02 -0.40 -4.87 115.26 114.18 2epe n ASN 19 Ca 0.27 0.28 -0.42 0.00 -0.03 0.00 0.00 54.58 54.68 2epe n ASN 19 Cb 0.45 -3.13 -0.03 0.00 -0.61 0.00 0.00 39.78 36.46 2epe n ASN 19 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 2epe s TYR 20 N -2.32 2.57 -1.93 3.10 5.04 -0.38 -1.23 117.35 122.20 2epe s TYR 20 Ca 0.00 0.43 0.00 0.00 -2.44 0.00 0.00 57.07 55.06 2epe s TYR 20 Cb 0.00 -3.92 0.00 0.00 0.35 0.00 0.00 41.96 38.39 2epe s TYR 20 CO 0.00 -3.61 0.00 0.54 -1.34 0.00 0.00 175.55 171.14 2epe n ARG 21 N 5.35 -1.54 -0.63 4.97 5.12 -1.26 -1.80 116.66 126.85 2epe n ARG 21 Ca 0.15 1.08 0.00 0.00 -1.93 0.00 0.00 57.85 57.15 2epe n ARG 21 Cb 0.41 -5.54 0.00 0.00 -1.16 0.00 0.00 32.46 26.17 2epe n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2epe n GLY 22 N -0.57 0.75 3.51 -0.13 0.00 -0.36 -5.02 105.19 103.37 2epe n GLY 22 Ca -0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 2epe n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2epe s TYR 23 N -2.61 3.23 0.84 1.61 2.02 -0.75 -4.89 117.35 116.80 2epe s TYR 23 Ca 0.00 -0.30 -0.12 0.00 -0.37 0.00 0.00 57.07 56.28 2epe s TYR 23 Cb 0.00 -2.54 0.10 0.00 -0.40 0.00 0.00 41.96 39.12 2epe s TYR 23 CO 0.00 -0.44 1.17 -1.54 -1.57 0.00 0.00 175.55 173.16 2epe s SER 24 N 1.72 3.48 0.30 2.29 1.04 -1.26 -1.27 113.70 120.00 2epe s SER 24 Ca 0.07 2.22 0.06 0.00 0.48 0.00 0.00 55.95 58.78 2epe s SER 24 Cb -0.18 -2.57 0.78 0.00 0.10 0.00 0.00 66.02 64.15 2epe s SER 24 CO 0.11 -2.73 1.73 0.25 0.98 0.00 0.00 173.24 173.58 2epe h LEU 25 N -1.27 0.60 -1.71 2.42 5.85 -1.89 0.14 115.31 119.45 2epe h LEU 25 Ca -0.45 0.13 0.17 0.00 0.84 0.00 0.00 57.88 58.57 2epe h LEU 25 Cb 1.28 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 42.30 2epe h LEU 25 CO 0.45 0.13 0.50 1.23 -0.34 0.00 0.00 178.44 180.41 2epe h GLY 26 N 0.58 0.50 0.92 3.75 0.00 -1.90 -1.45 103.07 105.47 2epe h GLY 26 Ca 0.59 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.78 2epe h GLY 26 CO -0.46 0.03 0.13 3.43 0.00 0.00 0.00 176.54 179.67 2epe h ASN 27 N 0.28 0.46 -0.48 0.19 2.35 -1.19 -0.78 115.58 116.41 2epe h ASN 27 Ca 0.36 -0.17 -0.10 0.00 -0.55 0.00 0.00 56.30 55.83 2epe h ASN 27 Cb 1.01 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 39.24 2epe h ASN 27 CO -0.09 0.51 -0.09 -0.50 -1.65 0.00 0.00 177.43 175.61 2epe h TRP 28 N 0.39 1.05 -0.20 1.19 4.06 -1.35 -0.95 115.95 120.14 2epe h TRP 28 Ca 0.11 -0.20 -0.20 0.00 2.06 0.00 0.00 58.89 60.65 2epe h TRP 28 Cb 0.20 -0.27 0.01 0.00 -1.00 0.00 0.00 29.16 28.10 2epe h TRP 28 CO -0.00 0.98 -0.68 0.28 -3.56 0.00 0.00 178.44 175.47 2epe h VAL 29 N 0.86 1.28 -0.51 1.49 2.07 -1.23 -1.57 116.25 118.64 2epe h VAL 29 Ca 0.14 -1.87 -0.08 0.00 0.82 0.00 0.00 66.70 65.71 2epe h VAL 29 Cb 0.63 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 32.25 2epe h VAL 29 CO 0.04 0.60 0.01 0.00 0.02 0.00 0.00 177.57 178.24 2epe h ALA 31 N 1.22 0.60 -0.45 0.00 0.00 -1.08 -1.95 119.26 117.61 2epe h ALA 31 Ca 0.15 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2epe h ALA 31 Cb 0.46 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2epe h ALA 31 CO 0.02 0.15 0.07 0.00 0.00 0.00 0.00 179.25 179.50 2epe h ALA 32 N 1.08 0.60 -0.43 0.00 0.00 -0.92 0.12 119.26 119.70 2epe h ALA 32 Ca 0.16 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.87 2epe h ALA 32 Cb 0.10 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2epe h ALA 32 CO -0.02 0.32 0.25 -0.22 0.00 0.00 0.00 179.25 179.58 2epe h LYS 33 N 0.61 0.49 0.00 0.00 1.63 -0.48 -1.81 116.57 117.02 2epe h LYS 33 Ca 0.14 -0.03 -0.09 0.00 -0.85 0.00 0.00 60.65 59.82 2epe h LYS 33 Cb 0.38 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 31.89 2epe h LYS 33 CO 0.01 0.33 -0.55 0.74 -3.45 0.00 0.00 179.45 176.52 2epe h PHE 34 N 0.51 0.00 0.10 1.91 0.04 -1.23 -2.30 116.94 115.97 2epe h PHE 34 Ca 0.17 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.72 2epe h PHE 34 Cb 0.02 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.19 2epe h PHE 34 CO -0.07 0.38 -0.93 0.93 -0.60 0.00 0.00 178.31 178.02 2epe h GLU 35 N 0.00 0.45 0.00 1.51 4.39 -0.57 -3.43 114.58 116.93 2epe h GLU 35 Ca -0.02 -0.62 0.00 0.00 0.34 0.00 0.00 59.36 59.05 2epe h GLU 35 Cb 1.31 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 30.17 2epe h GLU 35 CO 0.05 1.26 0.00 -1.13 -1.16 0.00 0.00 179.01 178.03 2epe n SER 36 N -4.02 0.31 -2.77 1.42 3.41 -0.70 -4.82 113.62 106.45 2epe n SER 36 Ca -0.13 -0.78 -0.21 0.00 -0.26 0.00 0.00 58.87 57.49 2epe n SER 36 Cb 0.85 0.12 0.03 0.00 -0.26 0.00 0.00 64.21 64.95 2epe n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2epe n ASN 37 N -0.12 -5.88 -0.40 4.04 5.15 -0.87 -1.92 115.26 115.26 2epe n ASN 37 Ca 0.00 -0.23 -0.05 0.00 -0.60 0.00 0.00 54.58 53.70 2epe n ASN 37 Cb 0.10 -4.74 -0.02 0.00 -0.53 0.00 0.00 39.78 34.60 2epe n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2epe n PHE 38 N -4.39 0.00 -3.56 1.20 3.72 -1.22 -4.85 117.46 108.35 2epe n PHE 38 Ca -0.13 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.87 2epe n PHE 38 Cb 0.63 -1.28 -0.11 0.00 -0.94 0.00 0.00 39.48 37.78 2epe n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2epe s ASN 39 N -2.71 5.90 0.55 4.37 2.47 -0.81 -0.87 114.94 123.84 2epe s ASN 39 Ca 0.00 -0.55 0.32 0.00 0.42 0.00 0.00 52.86 53.05 2epe s ASN 39 Cb 0.00 -2.09 1.60 0.00 -1.45 0.00 0.00 41.25 39.30 2epe s ASN 39 CO 0.00 -0.26 2.10 0.71 -3.72 0.00 0.00 177.10 175.93 2epe h THR 40 N 5.58 0.32 -0.14 -5.21 1.35 -1.34 -2.80 112.91 110.68 2epe h THR 40 Ca -0.31 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 2epe h THR 40 Cb 1.15 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.91 2epe h THR 40 CO 0.64 0.07 0.00 0.00 -0.25 0.00 0.00 175.52 175.98 2epe n GLN 41 N -3.38 1.65 -1.90 4.72 6.02 -1.26 -4.10 117.38 119.13 2epe n GLN 41 Ca -0.01 -0.97 -0.41 0.00 -0.01 0.00 0.00 57.00 55.59 2epe n GLN 41 Cb 0.23 -1.39 -0.02 0.00 1.02 0.00 0.00 30.24 30.08 2epe n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2epe s ALA 42 N -1.83 3.69 0.05 -1.58 0.00 -1.06 -4.81 121.76 116.23 2epe s ALA 42 Ca 0.32 1.45 0.04 0.00 0.00 0.00 0.00 51.96 53.77 2epe s ALA 42 Cb 0.17 -3.60 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 2epe s ALA 42 CO 0.26 -0.86 -0.11 0.95 0.00 0.00 0.00 175.76 176.01 2epe s THR 43 N 0.07 0.85 -0.14 0.00 -4.23 -1.26 -1.05 115.64 109.88 2epe s THR 43 Ca 0.62 -1.04 -0.07 0.00 -1.18 0.00 0.00 61.69 60.02 2epe s THR 43 Cb -0.45 -0.83 0.05 0.00 1.34 0.00 0.00 72.50 72.62 2epe s THR 43 CO 0.45 -0.19 0.32 0.20 -0.54 0.00 0.00 174.62 174.86 2epe s ASN 44 N -1.37 -0.34 0.07 3.99 -0.87 -0.74 -4.97 114.94 110.71 2epe s ASN 44 Ca -0.03 0.70 -0.20 0.00 -1.57 0.00 0.00 52.86 51.75 2epe s ASN 44 Cb -0.09 0.60 -0.07 0.00 -0.02 0.00 0.00 41.25 41.68 2epe s ASN 44 CO 0.01 -0.18 0.60 -0.60 -2.57 0.00 0.00 177.10 174.35 2epe s ARG 45 N 1.41 4.26 0.27 -0.60 6.06 -1.26 -0.18 118.95 128.90 2epe s ARG 45 Ca -0.09 0.78 0.03 0.00 -2.50 0.00 0.00 55.73 53.95 2epe s ARG 45 Cb -0.10 -3.26 -0.03 0.00 0.06 0.00 0.00 34.95 31.62 2epe s ARG 45 CO -0.10 0.57 0.42 -0.80 -2.50 0.00 0.00 175.30 172.89 2epe s ASN 46 N -0.91 6.32 0.44 -2.12 0.02 0.24 -4.95 114.94 113.98 2epe s ASN 46 Ca 0.30 0.25 0.11 0.00 -1.02 0.00 0.00 52.86 52.50 2epe s ASN 46 Cb -0.20 -1.94 0.98 0.00 0.02 0.00 0.00 41.25 40.12 2epe s ASN 46 CO 0.19 -0.14 2.05 0.71 0.02 0.00 0.00 177.10 179.94 2epe h THR 47 N 1.10 1.09 0.00 1.60 1.35 -1.98 -2.02 112.91 114.05 2epe h THR 47 Ca -0.51 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 2epe h THR 47 Cb 1.22 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 2epe h THR 47 CO 0.62 0.11 0.00 -0.90 -0.25 0.00 0.00 175.52 175.10 2epe n ASP 48 N -4.44 0.00 0.00 5.36 5.75 -1.26 -4.87 116.55 117.09 2epe n ASP 48 Ca -0.00 -0.65 0.00 0.00 -0.01 0.00 0.00 54.79 54.13 2epe n ASP 48 Cb 0.13 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 2epe n ASP 48 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2epe n GLY 49 N 0.19 1.01 3.90 6.12 0.00 -0.76 -5.02 105.19 110.63 2epe n GLY 49 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2epe n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2epe s SER 50 N -2.78 4.56 0.03 1.61 1.04 -1.26 -4.74 113.70 112.16 2epe s SER 50 Ca 0.00 0.81 0.03 0.00 0.48 0.00 0.00 55.95 57.28 2epe s SER 50 Cb 0.00 -1.33 -0.02 0.00 0.10 0.00 0.00 66.02 64.77 2epe s SER 50 CO 0.00 -1.88 -0.10 -0.89 0.98 0.00 0.00 173.24 171.35 2epe s THR 51 N -3.55 0.74 -0.13 2.02 2.01 -1.26 -0.59 115.64 114.88 2epe s THR 51 Ca 0.62 -0.90 -0.07 0.00 0.31 0.00 0.00 61.69 61.65 2epe s THR 51 Cb -0.11 -0.72 -0.04 0.00 0.01 0.00 0.00 72.50 71.64 2epe s THR 51 CO 0.49 -0.15 0.11 -1.81 -0.69 0.00 0.00 174.62 172.58 2epe s ASP 52 N -1.16 6.11 -0.03 3.53 1.01 0.74 -0.96 116.67 125.92 2epe s ASP 52 Ca -0.03 0.35 0.03 0.00 0.71 0.00 0.00 52.55 53.61 2epe s ASP 52 Cb -0.08 -1.96 -0.00 0.00 1.01 0.00 0.00 42.92 41.89 2epe s ASP 52 CO 0.01 0.36 -0.11 -0.31 0.21 0.00 0.00 175.17 175.32 2epe s TYR 53 N -0.71 1.15 0.00 4.23 1.51 -0.20 -1.79 117.35 121.53 2epe s TYR 53 Ca 0.13 -0.29 0.00 0.00 -1.01 0.00 0.00 57.07 55.90 2epe s TYR 53 Cb -0.12 -0.79 0.00 0.00 -0.11 0.00 0.00 41.96 40.94 2epe s TYR 53 CO 0.03 -0.10 0.00 0.41 -1.11 0.00 0.00 175.55 174.77 2epe n GLY 54 N 3.19 -2.22 0.33 0.71 0.00 -0.22 -1.24 105.19 105.75 2epe n GLY 54 Ca -0.18 -1.55 0.12 0.00 0.00 0.00 0.00 46.02 44.42 2epe n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2epe h ILE 55 N 0.00 0.90 -0.32 -0.61 2.10 -1.71 -1.19 117.51 116.68 2epe h ILE 55 Ca 0.00 -0.08 0.00 0.00 1.08 0.00 0.00 64.86 65.86 2epe h ILE 55 Cb 0.00 0.65 0.00 0.00 -1.09 0.00 0.00 36.82 36.38 2epe h ILE 55 CO 0.00 0.04 0.00 0.18 -1.08 0.00 0.00 178.15 177.29 2epe n LEU 56 N -4.46 3.15 -4.04 2.19 4.77 -1.26 -4.00 117.00 113.34 2epe n LEU 56 Ca 0.06 -2.25 -0.34 0.00 -0.03 0.00 0.00 56.01 53.46 2epe n LEU 56 Cb 0.33 -0.30 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 2epe n LEU 56 CO 0.35 0.71 -0.26 0.00 -1.33 0.00 0.00 177.39 176.87 2epe n GLN 57 N 0.26 -1.50 -2.53 3.23 1.13 -0.45 -4.90 117.38 112.61 2epe n GLN 57 Ca 0.14 0.24 -0.42 0.00 -1.94 0.00 0.00 57.00 55.02 2epe n GLN 57 Cb 0.54 -3.68 -0.03 0.00 0.11 0.00 0.00 30.24 27.18 2epe n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2epe s ILE 58 N -3.88 4.37 0.03 5.09 1.01 -0.37 -4.32 121.20 123.13 2epe s ILE 58 Ca 0.21 1.70 -0.22 0.00 0.00 0.00 0.00 60.65 62.34 2epe s ILE 58 Cb -0.10 -4.09 -0.06 0.00 0.01 0.00 0.00 42.46 38.22 2epe s ILE 58 CO 0.94 0.11 0.67 0.21 0.00 0.00 0.00 174.94 176.87 2epe s ASN 59 N 1.09 7.10 0.00 3.58 3.84 -1.26 -1.04 114.94 128.25 2epe s ASN 59 Ca 0.56 1.31 0.30 0.00 0.21 0.00 0.00 52.86 55.24 2epe s ASN 59 Cb -0.26 -2.41 1.39 0.00 -0.55 0.00 0.00 41.25 39.42 2epe s ASN 59 CO 0.28 0.09 1.99 -1.54 -2.79 0.00 0.00 177.10 175.13 2epe n SER 60 N 2.58 0.03 0.13 -4.21 3.41 -0.13 -1.54 113.62 113.89 2epe n SER 60 Ca -0.05 0.09 -0.00 0.00 -0.26 0.00 0.00 58.87 58.64 2epe n SER 60 Cb 0.50 -0.35 0.26 0.00 -0.26 0.00 0.00 64.21 64.36 2epe n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2epe h ARG 61 N 0.02 0.11 0.00 4.33 9.65 -1.82 -3.39 114.38 123.28 2epe h ARG 61 Ca 0.00 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 2epe h ARG 61 Cb 0.38 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.95 2epe h ARG 61 CO 0.00 0.54 -0.82 0.91 2.80 0.00 0.00 179.97 183.40 2epe n TRP 62 N -4.00 0.00 -0.04 2.20 7.02 -1.18 -0.94 117.44 120.50 2epe n TRP 62 Ca -0.02 0.00 -0.01 0.00 -1.02 0.00 0.00 57.50 56.46 2epe n TRP 62 Cb 0.49 0.00 -0.10 0.00 -2.42 0.00 0.00 31.31 29.27 2epe n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 2epe n TRP 63 N -1.69 0.00 -4.01 -5.99 7.02 -0.59 -0.70 117.44 111.48 2epe n TRP 63 Ca 0.00 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.40 2epe n TRP 63 Cb 0.38 -0.51 -0.09 0.00 -2.42 0.00 0.00 31.31 28.67 2epe n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2epe s ASN 65 N -2.90 5.98 0.00 0.00 2.47 0.01 -4.56 114.94 115.93 2epe s ASN 65 Ca 0.07 0.05 0.03 0.00 0.42 0.00 0.00 52.86 53.43 2epe s ASN 65 Cb 0.07 -2.09 0.05 0.00 -1.45 0.00 0.00 41.25 37.84 2epe s ASN 65 CO -0.10 0.03 0.80 -0.90 -3.72 0.00 0.00 177.10 173.21 2epe n ASP 66 N 4.53 1.69 0.00 -4.21 5.68 -1.26 -0.76 116.55 122.21 2epe n ASP 66 Ca -0.15 -1.49 0.00 0.00 -0.50 0.00 0.00 54.79 52.65 2epe n ASP 66 Cb 0.52 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.47 2epe n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2epe n GLY 67 N 0.04 0.21 0.89 6.12 0.00 -1.26 -4.82 105.19 106.37 2epe n GLY 67 Ca 0.03 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.06 2epe n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2epe n ARG 68 N -0.68 0.00 -3.88 1.61 1.85 -1.26 -4.97 116.66 109.34 2epe n ARG 68 Ca 0.00 -1.31 -0.29 0.00 -1.00 0.00 0.00 57.85 55.25 2epe n ARG 68 Cb 0.27 -0.25 -0.13 0.00 -1.05 0.00 0.00 32.46 31.31 2epe n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2epe s THR 69 N 0.00 2.47 0.15 8.89 2.01 -1.26 -4.88 115.64 123.02 2epe s THR 69 Ca 0.12 -3.59 -0.34 0.00 0.31 0.00 0.00 61.69 58.19 2epe s THR 69 Cb 0.14 -2.68 -0.16 0.00 0.01 0.00 0.00 72.50 69.82 2epe s THR 69 CO -0.06 -0.91 1.24 -2.65 -0.69 0.00 0.00 174.62 171.55 2epe n PRO 70 N 2.69 1.22 -2.59 4.92 -0.02 -1.26 -2.56 135.00 137.40 2epe n PRO 70 Ca 0.12 0.44 -0.15 0.00 -2.02 0.00 0.00 63.50 61.89 2epe n PRO 70 Cb 0.34 -2.00 0.01 0.00 -0.02 0.00 0.00 33.50 31.84 2epe n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2epe n GLY 71 N 2.22 -0.19 3.88 -1.23 0.00 -1.26 -4.98 105.19 103.64 2epe n GLY 71 Ca 0.16 -0.20 -0.21 0.00 0.00 0.00 0.00 46.02 45.78 2epe n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2epe s SER 72 N -2.62 5.61 0.47 1.61 1.04 -1.06 -5.05 113.70 113.70 2epe s SER 72 Ca 0.13 -0.30 0.08 0.00 0.48 0.00 0.00 55.95 56.34 2epe s SER 72 Cb -0.06 -1.26 0.02 0.00 0.10 0.00 0.00 66.02 64.82 2epe s SER 72 CO 0.16 -0.24 0.52 -0.13 0.98 0.00 0.00 173.24 174.54 2epe s ARG 73 N -3.98 2.54 -0.40 4.02 1.81 -0.12 -4.98 118.95 117.85 2epe s ARG 73 Ca 0.38 -1.53 0.11 0.00 -1.72 0.00 0.00 55.73 52.96 2epe s ARG 73 Cb -0.07 -2.51 0.33 0.00 -0.45 0.00 0.00 34.95 32.24 2epe s ARG 73 CO 0.27 -0.41 0.72 -1.71 -0.68 0.00 0.00 175.30 173.49 2epe n ASN 74 N -1.81 1.14 0.17 0.23 5.15 -1.19 -3.64 115.26 115.30 2epe n ASN 74 Ca 0.07 -3.03 0.17 0.00 -0.60 0.00 0.00 54.58 51.19 2epe n ASN 74 Cb 0.61 -0.62 0.79 0.00 -0.53 0.00 0.00 39.78 40.03 2epe n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2epe h LEU 75 N 3.20 0.00 -0.62 1.20 3.38 -0.98 0.00 115.31 121.49 2epe h LEU 75 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2epe h LEU 75 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 2epe h LEU 75 CO 0.53 0.00 -0.25 0.00 0.09 0.00 0.00 178.44 178.81 2epe n ASN 77 N -0.47 -2.01 -3.94 0.00 3.02 -0.01 -5.00 115.26 106.85 2epe n ASN 77 Ca 0.13 -0.80 -0.09 0.00 -0.03 0.00 0.00 54.58 53.78 2epe n ASN 77 Cb 0.37 -4.09 -0.10 0.00 -0.61 0.00 0.00 39.78 35.35 2epe n ASN 77 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2epe s ILE 78 N -3.58 0.12 0.37 2.41 -4.36 -1.26 -5.07 121.20 109.83 2epe s ILE 78 Ca 0.14 -1.02 -0.26 0.00 -0.26 0.00 0.00 60.65 59.26 2epe s ILE 78 Cb -0.07 -0.69 -0.09 0.00 1.25 0.00 0.00 42.46 42.86 2epe s ILE 78 CO 0.81 -0.56 1.11 -2.16 0.24 0.00 0.00 174.94 174.38 2epe s PRO 79 N -2.17 4.24 0.53 0.37 0.04 -1.26 -0.81 135.00 135.94 2epe s PRO 79 Ca -0.09 1.72 0.22 0.00 0.04 0.00 0.00 61.00 62.89 2epe s PRO 79 Cb -0.04 -2.76 1.37 0.00 0.04 0.00 0.00 34.50 33.11 2epe s PRO 79 CO -0.03 -0.12 2.07 0.00 0.04 0.00 0.00 177.00 178.96 2epe h SER 81 N 0.00 0.00 0.04 0.00 4.64 -1.90 0.39 113.55 116.72 2epe h SER 81 Ca 0.13 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2epe h SER 81 Cb 0.55 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.64 2epe h SER 81 CO -0.00 0.00 -0.02 0.00 -0.87 0.00 0.00 176.83 175.94 2epe h ALA 82 N 1.85 1.70 0.00 5.18 0.00 -1.60 -1.42 119.26 124.96 2epe h ALA 82 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2epe h ALA 82 Cb 0.50 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2epe h ALA 82 CO -0.00 0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.56 2epe n LEU 83 N -4.13 0.00 -0.46 0.00 4.77 0.14 -3.28 117.00 114.04 2epe n LEU 83 Ca -0.03 0.22 0.07 0.00 -0.03 0.00 0.00 56.01 56.24 2epe n LEU 83 Cb 0.11 -0.22 0.03 0.00 -2.33 0.00 0.00 43.42 41.01 2epe n LEU 83 CO 0.31 -0.08 0.38 0.18 -1.33 0.00 0.00 177.39 176.84 2epe n LEU 84 N -1.22 1.89 -4.70 2.23 4.77 -0.54 -4.07 117.00 115.35 2epe n LEU 84 Ca 0.10 -0.90 -0.33 0.00 -0.03 0.00 0.00 56.01 54.86 2epe n LEU 84 Cb 0.14 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.35 2epe n LEU 84 CO 0.14 0.35 0.75 -0.55 -1.33 0.00 0.00 177.39 176.75 2epe s SER 85 N -1.41 3.63 0.50 -1.43 0.15 -1.20 -4.15 113.70 109.79 2epe s SER 85 Ca 0.14 2.30 0.30 0.00 0.70 0.00 0.00 55.95 59.40 2epe s SER 85 Cb 0.12 -2.58 1.08 0.00 -1.71 0.00 0.00 66.02 62.93 2epe s SER 85 CO 0.25 -2.64 1.87 0.77 1.20 0.00 0.00 173.24 174.69 2epe h SER 86 N -0.98 0.00 -3.51 5.45 4.64 -1.93 -3.39 113.55 113.82 2epe h SER 86 Ca -0.46 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.25 2epe h SER 86 Cb 1.29 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.26 2epe h SER 86 CO 0.46 0.00 0.03 -0.62 -0.87 0.00 0.00 176.83 175.83 2epe s ASP 87 N -5.72 6.52 0.00 4.97 -1.08 -1.26 -4.94 116.67 115.16 2epe s ASP 87 Ca 0.03 0.63 0.30 0.00 -0.52 0.00 0.00 52.55 53.00 2epe s ASP 87 Cb 0.08 -2.30 1.58 0.00 -1.46 0.00 0.00 42.92 40.81 2epe s ASP 87 CO 0.57 -0.28 2.04 2.30 0.52 0.00 0.00 175.17 180.32 2epe n ILE 88 N 4.96 0.00 -0.21 4.11 -5.35 -1.26 -4.34 119.36 117.27 2epe n ILE 88 Ca -0.03 -0.09 -0.02 0.00 -0.27 0.00 0.00 62.75 62.34 2epe n ILE 88 Cb 0.50 -0.13 0.05 0.00 -1.74 0.00 0.00 39.64 38.32 2epe n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 2epe h THR 89 N 0.87 0.29 -0.67 7.28 2.02 -1.93 -0.14 112.91 120.63 2epe h THR 89 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2epe h THR 89 Cb 0.19 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 66.86 2epe h THR 89 CO 0.00 0.00 0.38 0.00 0.37 0.00 0.00 175.52 176.27 2epe h ALA 90 N 1.46 0.85 -0.63 6.16 0.00 -1.86 -0.16 119.26 125.07 2epe h ALA 90 Ca 0.29 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2epe h ALA 90 Cb 0.50 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2epe h ALA 90 CO -0.67 0.35 0.41 0.77 0.00 0.00 0.00 179.25 180.11 2epe h SER 91 N 0.91 0.73 -0.33 0.00 0.02 -1.53 -1.88 113.55 111.47 2epe h SER 91 Ca 0.24 -0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 61.08 2epe h SER 91 Cb 0.01 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 2epe h SER 91 CO -0.04 0.54 -0.10 0.58 -1.14 0.00 0.00 176.83 176.67 2epe h VAL 92 N 0.86 1.28 -0.64 2.27 2.07 -0.71 -0.16 116.25 121.21 2epe h VAL 92 Ca 0.23 -1.17 -0.01 0.00 0.82 0.00 0.00 66.70 66.58 2epe h VAL 92 Cb -0.08 1.35 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 2epe h VAL 92 CO -0.05 0.38 0.37 0.78 0.02 0.00 0.00 177.57 179.07 2epe h ASN 93 N 0.43 0.79 0.16 0.57 2.35 -0.90 0.18 115.58 119.17 2epe h ASN 93 Ca 0.08 -0.08 -0.16 0.00 -0.55 0.00 0.00 56.30 55.59 2epe h ASN 93 Cb 0.61 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 2epe h ASN 93 CO 0.04 0.64 -0.59 0.00 -1.65 0.00 0.00 177.43 175.87 2epe h ALA 95 N 1.04 1.05 -0.77 0.00 0.00 -0.34 -1.55 119.26 118.70 2epe h ALA 95 Ca -0.00 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2epe h ALA 95 Cb 1.12 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 18.54 2epe h ALA 95 CO 0.10 0.51 0.50 0.87 0.00 0.00 0.00 179.25 181.23 2epe h LYS 96 N 1.13 1.01 -0.20 0.00 1.57 -0.91 0.36 116.57 119.54 2epe h LYS 96 Ca 0.30 -0.07 -0.17 0.00 -1.87 0.00 0.00 60.65 58.84 2epe h LYS 96 Cb -0.05 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.03 2epe h LYS 96 CO -0.06 0.68 -0.57 0.87 -0.57 0.00 0.00 179.45 179.80 2epe h LYS 97 N 1.04 0.64 -0.08 3.15 1.57 -1.26 -2.89 116.57 118.75 2epe h LYS 97 Ca 0.28 -0.42 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 2epe h LYS 97 Cb -0.11 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.25 2epe h LYS 97 CO -0.06 1.03 0.05 0.82 -0.57 0.00 0.00 179.45 180.72 2epe h ILE 98 N 0.49 1.05 0.00 1.86 2.04 -0.51 -2.52 117.51 119.91 2epe h ILE 98 Ca 0.00 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2epe h ILE 98 Cb 1.14 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.22 2epe h ILE 98 CO 0.11 0.04 0.00 1.62 0.00 0.00 0.00 178.15 179.93 2epe h VAL 99 N 0.07 0.00 0.00 1.67 3.04 -0.99 -0.77 116.25 119.27 2epe h VAL 99 Ca 0.03 -0.26 0.00 0.00 -1.01 0.00 0.00 66.70 65.45 2epe h VAL 99 Cb 0.03 1.03 0.00 0.00 -2.01 0.00 0.00 31.29 30.35 2epe h VAL 99 CO -0.01 0.00 -0.61 -1.20 -1.01 0.00 0.00 177.57 174.74 2epe n SER 100 N -2.40 0.60 0.00 3.17 7.64 -1.00 -3.83 113.62 117.79 2epe n SER 100 Ca 0.02 -0.39 0.01 0.00 1.01 0.00 0.00 58.87 59.51 2epe n SER 100 Cb 0.23 0.41 0.03 0.00 -1.01 0.00 0.00 64.21 63.87 2epe n SER 100 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2epe n ASP 101 N -1.52 0.00 0.00 6.43 2.03 -0.29 -4.84 116.55 118.36 2epe n ASP 101 Ca 0.05 0.48 0.00 0.00 0.52 0.00 0.00 54.79 55.84 2epe n ASP 101 Cb 0.34 -0.48 0.00 0.00 -0.72 0.00 0.00 41.12 40.25 2epe n ASP 101 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2epe n GLY 102 N -1.34 1.32 0.70 0.27 0.00 -1.26 -4.90 105.19 99.98 2epe n GLY 102 Ca 0.00 -0.33 0.13 0.00 0.00 0.00 0.00 46.02 45.82 2epe n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2epe n ASN 103 N 0.02 2.18 0.00 1.61 3.02 -1.26 -5.05 115.26 115.78 2epe n ASN 103 Ca 0.00 -1.73 0.00 0.00 -0.03 0.00 0.00 54.58 52.82 2epe n ASN 103 Cb 0.00 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 2epe n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2epe n GLY 104 N 1.26 2.71 0.00 7.41 0.00 -1.25 -2.60 105.19 112.72 2epe n GLY 104 Ca 0.17 -0.36 0.10 0.00 0.00 0.00 0.00 46.02 45.93 2epe n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2epe n MET 105 N 13.66 0.15 0.06 1.61 2.81 -1.26 -2.99 117.12 131.17 2epe n MET 105 Ca 0.00 0.12 0.07 0.00 -1.81 0.00 0.00 57.70 56.09 2epe n MET 105 Cb 0.00 -1.50 0.34 0.00 -0.71 0.00 0.00 33.22 31.35 2epe n MET 105 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2epe n ASN 106 N -1.39 0.28 0.27 7.83 3.02 -1.07 -1.23 115.26 122.97 2epe n ASN 106 Ca 0.07 0.59 0.13 0.00 -0.03 0.00 0.00 54.58 55.34 2epe n ASN 106 Cb 0.19 -0.64 0.75 0.00 -0.61 0.00 0.00 39.78 39.47 2epe n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2epe h ALA 107 N 2.23 1.34 -2.33 5.41 0.00 -1.73 -3.37 119.26 120.81 2epe h ALA 107 Ca 0.00 -0.09 -0.74 0.00 0.00 0.00 0.00 54.91 54.08 2epe h ALA 107 Cb 0.17 -0.02 -0.23 0.00 0.00 0.00 0.00 17.79 17.72 2epe h ALA 107 CO 0.00 0.13 -0.34 -1.58 0.00 0.00 0.00 179.25 177.46 2epe s TRP 108 N -4.29 3.25 0.20 0.00 0.51 -0.37 -4.97 118.94 113.28 2epe s TRP 108 Ca -0.03 -0.98 -0.10 0.00 -2.12 0.00 0.00 56.10 52.87 2epe s TRP 108 Cb 0.14 -3.17 0.25 0.00 -0.81 0.00 0.00 33.47 29.87 2epe s TRP 108 CO 0.58 -0.81 1.77 0.28 -0.51 0.00 0.00 176.95 178.26 2epe h VAL 109 N 5.78 0.85 -0.56 4.03 2.07 -1.84 -1.60 116.25 124.99 2epe h VAL 109 Ca -0.28 -0.17 -0.00 0.00 0.82 0.00 0.00 66.70 67.07 2epe h VAL 109 Cb 1.11 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 2epe h VAL 109 CO 0.87 0.09 0.34 0.00 0.02 0.00 0.00 177.57 178.89 2epe h ALA 110 N 1.38 1.55 -0.09 1.67 0.00 -1.93 0.33 119.26 122.16 2epe h ALA 110 Ca 0.29 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2epe h ALA 110 Cb 0.30 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2epe h ALA 110 CO -0.25 0.40 0.02 2.35 0.00 0.00 0.00 179.25 181.77 2epe h TRP 111 N 0.76 0.16 -0.60 0.00 7.01 -1.66 0.26 115.95 121.88 2epe h TRP 111 Ca 0.20 -0.02 -0.07 0.00 2.11 0.00 0.00 58.89 61.11 2epe h TRP 111 Cb -0.03 -0.04 -0.03 0.00 -2.10 0.00 0.00 29.16 26.96 2epe h TRP 111 CO 0.00 0.34 0.09 -0.09 -2.79 0.00 0.00 178.44 175.99 2epe h ARG 112 N -0.07 0.97 0.00 2.65 2.43 -0.91 0.27 114.38 119.73 2epe h ARG 112 Ca 0.03 -0.25 -0.05 0.00 -0.81 0.00 0.00 59.98 58.90 2epe h ARG 112 Cb 0.26 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 2epe h ARG 112 CO 0.00 0.90 -0.82 -0.91 -1.51 0.00 0.00 179.97 177.63 2epe h ASN 113 N 0.92 0.00 0.00 -3.80 2.35 -0.91 -3.38 115.58 110.76 2epe h ASN 113 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 2epe h ASN 113 Cb 0.41 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 2epe h ASN 113 CO 0.01 0.19 -0.36 0.54 -1.65 0.00 0.00 177.43 176.16 2epe n ARG 114 N -2.88 3.21 -0.03 0.81 1.74 0.07 -4.87 116.66 114.71 2epe n ARG 114 Ca -0.01 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.01 2epe n ARG 114 Cb 0.63 -0.60 -0.03 0.00 -1.02 0.00 0.00 32.46 31.44 2epe n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2epe n LYS 116 N -2.98 1.73 -0.97 0.00 4.81 0.70 -1.41 118.16 120.03 2epe n LYS 116 Ca -0.12 0.63 0.00 0.00 -0.87 0.00 0.00 58.31 57.94 2epe n LYS 116 Cb 0.61 -2.36 0.00 0.00 0.02 0.00 0.00 35.03 33.30 2epe n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2epe n GLY 117 N 3.37 0.43 4.02 3.14 0.00 -1.26 -4.96 105.19 109.93 2epe n GLY 117 Ca 0.19 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.03 2epe n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2epe s THR 118 N -1.99 2.50 -1.27 2.61 -4.23 -0.50 -4.99 115.64 107.77 2epe s THR 118 Ca 0.00 -0.98 -0.19 0.00 -1.18 0.00 0.00 61.69 59.34 2epe s THR 118 Cb 0.00 -2.52 0.03 0.00 1.34 0.00 0.00 72.50 71.35 2epe s THR 118 CO 0.00 0.00 1.79 -0.62 -0.54 0.00 0.00 174.62 175.25 2epe s ASP 119 N -4.54 6.35 0.39 3.99 2.15 -1.26 -4.79 116.67 118.96 2epe s ASP 119 Ca 0.59 -2.24 0.28 0.00 0.43 0.00 0.00 52.55 51.61 2epe s ASP 119 Cb -0.08 -2.58 1.18 0.00 -0.30 0.00 0.00 42.92 41.14 2epe s ASP 119 CO 0.37 -1.68 1.84 -0.37 -0.17 0.00 0.00 175.17 175.15 2epe h VAL 120 N 5.73 0.00 0.00 1.11 -1.51 -1.90 -2.60 116.25 117.08 2epe h VAL 120 Ca 0.39 -0.33 -0.03 0.00 -1.23 0.00 0.00 66.70 65.51 2epe h VAL 120 Cb 0.89 1.16 -0.00 0.00 -2.13 0.00 0.00 31.29 31.21 2epe h VAL 120 CO 1.40 0.00 -0.12 -0.61 -1.23 0.00 0.00 177.57 177.00 2epe h GLN 121 N 0.00 0.00 -0.24 5.19 -0.00 -1.88 -1.53 115.11 116.65 2epe h GLN 121 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 58.65 58.72 2epe h GLN 121 Cb 0.40 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 27.87 2epe h GLN 121 CO 0.00 0.12 0.22 0.00 0.00 0.00 0.00 178.83 179.17 2epe h ALA 122 N 1.88 1.99 0.00 3.38 0.00 -1.86 -1.32 119.26 123.32 2epe h ALA 122 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2epe h ALA 122 Cb 0.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2epe h ALA 122 CO 0.02 -0.35 0.00 -1.49 0.00 0.00 0.00 179.25 177.43 2epe h TRP 123 N 0.00 0.00 -0.07 0.00 4.06 -1.49 -2.50 115.95 115.94 2epe h TRP 123 Ca 0.11 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.06 2epe h TRP 123 Cb 0.56 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.72 2epe h TRP 123 CO 0.00 0.00 0.00 0.44 -3.56 0.00 0.00 178.44 175.32 2epe n ILE 124 N -2.61 0.21 -1.85 1.49 -5.35 -0.54 -4.81 119.36 105.91 2epe n ILE 124 Ca 0.02 -0.60 -0.41 0.00 -0.27 0.00 0.00 62.75 61.49 2epe n ILE 124 Cb 0.30 1.06 -0.01 0.00 -1.74 0.00 0.00 39.64 39.25 2epe n ILE 124 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2epe s ARG 125 N -0.87 4.15 0.00 6.28 1.04 -0.95 -2.08 118.95 126.53 2epe s ARG 125 Ca 0.14 2.51 0.00 0.00 -1.04 0.00 0.00 55.73 57.34 2epe s ARG 125 Cb 0.09 -3.01 0.00 0.00 -2.04 0.00 0.00 34.95 29.99 2epe s ARG 125 CO 0.13 -0.51 0.00 0.41 -0.04 0.00 0.00 175.30 175.28 2epe n GLY 126 N 1.10 2.34 3.83 3.88 0.00 -1.26 -5.02 105.19 110.06 2epe n GLY 126 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 2epe n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2epe s ARG 128 N -3.00 3.10 0.00 0.00 3.52 -1.26 -5.13 118.95 116.18 2epe s ARG 128 Ca 0.58 -1.33 0.24 0.00 -0.13 0.00 0.00 55.73 55.09 2epe s ARG 128 Cb -0.10 -4.31 0.27 0.00 -1.56 0.00 0.00 34.95 29.25 2epe s ARG 128 CO 0.15 -1.58 1.30 1.28 -0.81 0.00 0.00 175.30 175.65