#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlr s SER 2 N 0.00 3.96 -0.05 1.61 1.04 -1.26 -5.11 113.70 113.90 2dlr s SER 2 Ca 0.00 -0.57 0.05 0.00 0.48 0.00 0.00 55.95 55.91 2dlr s SER 2 Cb 0.00 -1.65 -0.02 0.00 0.10 0.00 0.00 66.02 64.45 2dlr s SER 2 CO 0.00 -0.04 -0.21 -0.94 0.98 0.00 0.00 173.24 173.04 2dlr s SER 3 N 1.39 3.48 0.00 7.02 1.04 -1.26 -4.92 113.70 120.45 2dlr s SER 3 Ca 0.04 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.10 2dlr s SER 3 Cb -0.14 -0.72 0.00 0.00 0.10 0.00 0.00 66.02 65.26 2dlr s SER 3 CO -0.06 0.30 0.00 0.61 0.98 0.00 0.00 173.24 175.07 2dlr n GLY 4 N 2.57 1.49 3.08 7.32 0.00 -1.26 -5.03 105.19 113.35 2dlr n GLY 4 Ca -0.17 -0.70 -0.12 0.00 0.00 0.00 0.00 46.02 45.03 2dlr n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dlr s SER 5 N -4.00 -0.10 0.45 1.61 1.04 -1.26 -5.15 113.70 106.28 2dlr s SER 5 Ca 0.00 0.14 -0.21 0.00 0.48 0.00 0.00 55.95 56.36 2dlr s SER 5 Cb 0.00 0.30 -0.10 0.00 0.10 0.00 0.00 66.02 66.32 2dlr s SER 5 CO 0.00 -0.19 0.99 -0.44 0.98 0.00 0.00 173.24 174.58 2dlr s SER 6 N -0.50 6.67 0.00 7.02 0.01 -1.26 -4.78 113.70 120.85 2dlr s SER 6 Ca -0.06 1.81 0.00 0.00 1.31 0.00 0.00 55.95 59.01 2dlr s SER 6 Cb -0.04 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2dlr s SER 6 CO 0.01 -0.55 0.00 0.61 0.41 0.00 0.00 173.24 173.72 2dlr n GLY 7 N -0.42 0.27 0.36 3.44 0.00 -1.26 -4.96 105.19 102.62 2dlr n GLY 7 Ca 0.08 -0.02 0.18 0.00 0.00 0.00 0.00 46.02 46.26 2dlr n GLY 7 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2dlr h SER 8 N 0.00 0.00 -4.04 1.61 4.64 -2.07 -3.43 113.55 110.26 2dlr h SER 8 Ca 0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 2dlr h SER 8 Cb 0.00 0.00 0.12 0.00 -0.31 0.00 0.00 62.40 62.21 2dlr h SER 8 CO 0.00 0.00 0.58 -0.22 -0.87 0.00 0.00 176.83 176.32 2dlr s LEU 9 N -8.32 3.88 -0.41 5.97 1.98 -1.26 -4.83 118.68 115.69 2dlr s LEU 9 Ca -0.05 2.67 -0.31 0.00 -2.89 0.00 0.00 54.13 53.55 2dlr s LEU 9 Cb 0.18 -4.27 -0.10 0.00 0.66 0.00 0.00 46.19 42.66 2dlr s LEU 9 CO 0.65 -1.44 2.30 0.29 -1.89 0.00 0.00 176.35 176.27 2dlr n LYS 10 N -0.92 1.17 -0.09 1.98 4.01 -1.26 -4.81 118.16 118.24 2dlr n LYS 10 Ca 0.10 0.25 -0.15 0.00 -0.51 0.00 0.00 58.31 58.00 2dlr n LYS 10 Cb 0.46 -2.79 -0.07 0.00 -0.51 0.00 0.00 35.03 32.12 2dlr n LYS 10 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 2dlr n SER 11 N 11.81 1.84 -0.33 4.39 7.64 -1.26 -4.22 113.62 133.49 2dlr n SER 11 Ca 0.40 0.51 0.17 0.00 1.01 0.00 0.00 58.87 60.96 2dlr n SER 11 Cb 0.34 -0.92 0.34 0.00 -1.01 0.00 0.00 64.21 62.95 2dlr n SER 11 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2dlr n THR 12 N -4.50 -0.40 -0.17 0.44 -2.24 -1.26 1.00 114.28 107.14 2dlr n THR 12 Ca -0.22 2.07 -0.02 0.00 -2.27 0.00 0.00 64.05 63.61 2dlr n THR 12 Cb 0.52 -3.09 0.07 0.00 -2.10 0.00 0.00 70.33 65.73 2dlr n THR 12 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dlr h ALA 13 N 1.91 0.60 0.77 6.98 0.00 -1.97 0.22 119.26 127.76 2dlr h ALA 13 Ca 0.63 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.60 2dlr h ALA 13 Cb 1.38 0.13 0.01 0.00 0.00 0.00 0.00 17.79 19.31 2dlr h ALA 13 CO -0.87 -0.29 -0.37 0.87 0.00 0.00 0.00 179.25 178.59 2dlr h LYS 14 N 0.26 -1.00 -0.75 0.00 1.57 0.47 0.93 116.57 118.05 2dlr h LYS 14 Ca 0.26 0.07 0.11 0.00 -1.87 0.00 0.00 60.65 59.21 2dlr h LYS 14 Cb 0.35 0.23 -0.08 0.00 0.08 0.00 0.00 32.23 32.81 2dlr h LYS 14 CO -0.33 -0.66 0.37 -1.49 -0.57 0.00 0.00 179.45 176.77 2dlr h TRP 15 N -1.04 0.67 -0.50 -1.35 6.55 -1.13 -1.59 115.95 117.56 2dlr h TRP 15 Ca -0.11 0.03 -0.02 0.00 0.95 0.00 0.00 58.89 59.74 2dlr h TRP 15 Cb 0.79 -0.19 -0.02 0.00 -0.86 0.00 0.00 29.16 28.89 2dlr h TRP 15 CO -0.02 0.22 0.22 0.00 -1.05 0.00 0.00 178.44 177.81 2dlr h ALA 16 N 1.46 0.65 -0.00 1.49 0.00 -0.39 -3.15 119.26 119.32 2dlr h ALA 16 Ca 0.38 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.18 2dlr h ALA 16 Cb 0.44 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.97 2dlr h ALA 16 CO -0.29 0.24 -0.45 0.00 0.00 0.00 0.00 179.25 178.75 2dlr h ALA 17 N 1.06 -0.74 -2.71 0.00 0.00 0.18 -3.44 119.26 113.62 2dlr h ALA 17 Ca 0.17 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 2dlr h ALA 17 Cb 0.17 0.80 -0.25 0.00 0.00 0.00 0.00 17.79 18.50 2dlr h ALA 17 CO -0.02 -1.00 -0.27 -1.12 0.00 0.00 0.00 179.25 176.85 2dlr s SER 18 N -4.78 -0.46 0.32 0.00 0.01 -1.00 -5.04 113.70 102.74 2dlr s SER 18 Ca -0.16 0.85 0.09 0.00 1.31 0.00 0.00 55.95 58.04 2dlr s SER 18 Cb 0.08 0.80 0.90 0.00 0.21 0.00 0.00 66.02 68.01 2dlr s SER 18 CO 0.63 -0.16 1.70 0.25 0.41 0.00 0.00 173.24 176.07 2dlr h LEU 19 N 6.23 0.54 -0.80 2.44 5.85 -1.85 0.19 115.31 127.91 2dlr h LEU 19 Ca -0.31 0.16 0.17 0.00 0.84 0.00 0.00 57.88 58.73 2dlr h LEU 19 Cb 1.18 0.09 -0.11 0.00 0.37 0.00 0.00 40.66 42.19 2dlr h LEU 19 CO 0.27 0.01 0.30 -0.33 -0.34 0.00 0.00 178.44 178.35 2dlr h GLU 20 N 0.46 0.38 -0.35 1.25 5.08 -1.93 0.40 114.58 119.87 2dlr h GLU 20 Ca 0.65 -0.02 0.06 0.00 -1.00 0.00 0.00 59.36 59.04 2dlr h GLU 20 Cb 1.31 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 2dlr h GLU 20 CO -0.53 0.25 0.24 -0.91 -1.00 0.00 0.00 179.01 177.06 2dlr h ASN 21 N 0.39 0.20 0.16 1.42 2.35 -0.88 0.21 115.58 119.43 2dlr h ASN 21 Ca 0.46 -0.00 -0.31 0.00 -0.55 0.00 0.00 56.30 55.90 2dlr h ASN 21 Cb 0.78 -0.04 0.03 0.00 0.05 0.00 0.00 38.32 39.14 2dlr h ASN 21 CO -0.47 0.13 -1.30 0.25 -1.65 0.00 0.00 177.43 174.39 2dlr h LEU 22 N 0.23 0.88 -0.26 1.61 5.85 -0.28 -2.77 115.31 120.57 2dlr h LEU 22 Ca 0.15 -0.83 -0.08 0.00 0.84 0.00 0.00 57.88 57.96 2dlr h LEU 22 Cb 0.32 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 2dlr h LEU 22 CO -0.03 1.64 -0.14 -0.07 -0.34 0.00 0.00 178.44 179.50 2dlr h LEU 23 N 0.25 0.58 -0.86 2.25 3.38 -0.31 -2.96 115.31 117.64 2dlr h LEU 23 Ca -0.20 -0.42 -0.04 0.00 0.09 0.00 0.00 57.88 57.31 2dlr h LEU 23 Cb 1.97 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 42.53 2dlr h LEU 23 CO 0.25 0.87 0.38 1.05 0.09 0.00 0.00 178.44 181.08 2dlr h GLU 24 N 0.29 1.20 -6.93 1.13 4.11 -0.73 -3.43 114.58 110.22 2dlr h GLU 24 Ca 0.06 -0.19 -0.48 0.00 0.07 0.00 0.00 59.36 58.82 2dlr h GLU 24 Cb 0.66 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2dlr h GLU 24 CO 0.04 0.94 0.39 -0.51 0.07 0.00 0.00 179.01 179.94 2dlr s ASP 25 N -6.33 7.00 0.07 3.06 1.01 -1.04 -4.98 116.67 115.46 2dlr s ASP 25 Ca -0.12 1.97 -0.17 0.00 0.71 0.00 0.00 52.55 54.94 2dlr s ASP 25 Cb 0.16 -2.58 -0.11 0.00 1.01 0.00 0.00 42.92 41.40 2dlr s ASP 25 CO 0.83 -0.32 1.39 1.55 0.21 0.00 0.00 175.17 178.84 2dlr h PRO 26 N 2.80 0.55 -0.48 8.23 0.13 -1.83 -3.03 132.00 138.37 2dlr h PRO 26 Ca -0.48 -0.29 0.03 0.00 -0.87 0.00 0.00 66.00 64.40 2dlr h PRO 26 Cb 1.21 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 2dlr h PRO 26 CO 0.63 0.87 0.26 0.93 -0.23 0.00 0.00 178.00 180.46 2dlr h GLU 27 N 0.24 0.50 -0.13 0.86 5.08 -1.94 -1.23 114.58 117.95 2dlr h GLU 27 Ca 0.04 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 2dlr h GLU 27 Cb 0.77 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.88 2dlr h GLU 27 CO 0.05 0.33 -0.04 0.78 -1.00 0.00 0.00 179.01 179.13 2dlr h GLY 28 N 0.51 0.09 1.01 -3.84 0.00 -1.68 -1.90 103.07 97.26 2dlr h GLY 28 Ca 0.20 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.59 2dlr h GLY 28 CO -0.12 -0.06 0.50 -2.08 0.00 0.00 0.00 176.54 174.78 2dlr h VAL 29 N -0.01 1.21 -0.24 4.60 2.07 -1.33 0.37 116.25 122.92 2dlr h VAL 29 Ca 0.07 -0.42 0.04 0.00 0.82 0.00 0.00 66.70 67.21 2dlr h VAL 29 Cb 0.11 0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 29.93 2dlr h VAL 29 CO -0.15 0.21 -0.02 0.50 0.02 0.00 0.00 177.57 178.14 2dlr h LYS 30 N 1.06 0.05 0.30 1.57 3.64 -0.83 -1.26 116.57 121.10 2dlr h LYS 30 Ca 0.28 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.65 2dlr h LYS 30 Cb -0.08 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 2dlr h LYS 30 CO -0.06 0.03 -0.14 0.00 -2.27 0.00 0.00 179.45 177.01 2dlr h ARG 31 N 0.05 -0.39 -0.94 1.90 3.08 -1.07 -3.21 114.38 113.80 2dlr h ARG 31 Ca 0.11 0.03 0.20 0.00 0.07 0.00 0.00 59.98 60.39 2dlr h ARG 31 Cb 0.16 0.09 -0.18 0.00 0.08 0.00 0.00 29.97 30.12 2dlr h ARG 31 CO -0.21 -0.18 -0.18 0.34 -1.07 0.00 0.00 179.97 178.67 2dlr n PHE 32 N -5.04 0.39 0.18 3.04 7.35 0.13 -0.39 117.46 123.12 2dlr n PHE 32 Ca -0.06 1.14 -0.17 0.00 -0.76 0.00 0.00 57.45 57.61 2dlr n PHE 32 Cb 0.20 -1.08 -0.09 0.00 0.35 0.00 0.00 39.48 38.86 2dlr n PHE 32 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2dlr h ARG 33 N 0.00 -0.79 -0.79 -4.13 3.08 -1.31 -2.03 114.38 108.40 2dlr h ARG 33 Ca 0.48 0.05 0.15 0.00 0.07 0.00 0.00 59.98 60.73 2dlr h ARG 33 Cb 0.79 0.18 -0.15 0.00 0.08 0.00 0.00 29.97 30.88 2dlr h ARG 33 CO -0.95 -0.53 -0.26 0.93 -1.07 0.00 0.00 179.97 178.09 2dlr h GLU 34 N -0.82 -0.04 -0.51 0.04 4.39 -0.72 0.44 114.58 117.37 2dlr h GLU 34 Ca -0.02 0.00 0.09 0.00 0.34 0.00 0.00 59.36 59.77 2dlr h GLU 34 Cb 0.78 0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 29.37 2dlr h GLU 34 CO -0.19 -0.02 0.08 0.35 -1.16 0.00 0.00 179.01 178.07 2dlr h PHE 35 N -0.04 0.12 0.57 4.33 3.04 -0.95 -2.51 116.94 121.51 2dlr h PHE 35 Ca 0.35 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 62.30 2dlr h PHE 35 Cb 0.58 0.02 0.01 0.00 2.56 0.00 0.00 35.95 39.12 2dlr h PHE 35 CO -0.67 -0.03 -0.27 -0.07 -2.02 0.00 0.00 178.31 175.24 2dlr h LEU 36 N 0.21 -0.65 -0.95 0.59 3.38 0.09 -3.12 115.31 114.86 2dlr h LEU 36 Ca 0.26 0.02 0.34 0.00 0.09 0.00 0.00 57.88 58.59 2dlr h LEU 36 Cb 0.37 0.17 -0.10 0.00 0.09 0.00 0.00 40.66 41.18 2dlr h LEU 36 CO -0.36 -0.30 0.60 1.17 0.09 0.00 0.00 178.44 179.65 2dlr n LYS 37 N -4.98 -0.03 -0.25 1.13 0.00 0.12 0.18 118.16 114.34 2dlr n LYS 37 Ca -0.09 0.90 -0.09 0.00 0.00 0.00 0.00 58.31 59.03 2dlr n LYS 37 Cb 0.30 -1.76 -0.05 0.00 0.00 0.00 0.00 35.03 33.51 2dlr n LYS 37 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 2dlr h LYS 38 N 0.00 -0.20 -0.63 1.64 1.57 -1.38 0.44 116.57 118.01 2dlr h LYS 38 Ca 0.63 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.42 2dlr h LYS 38 Cb 1.98 0.04 0.00 0.00 0.08 0.00 0.00 32.23 34.33 2dlr h LYS 38 CO -0.36 -0.13 0.00 -0.85 -0.57 0.00 0.00 179.45 177.54 2dlr n GLU 39 N -5.38 3.03 -3.79 3.15 0.28 0.13 -4.91 120.64 113.16 2dlr n GLU 39 Ca 0.01 -1.98 -0.25 0.00 -0.16 0.00 0.00 57.16 54.78 2dlr n GLU 39 Cb 0.34 -1.77 0.03 0.00 1.43 0.00 0.00 31.44 31.47 2dlr n GLU 39 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 2dlr n PHE 40 N 0.63 -2.14 0.27 -1.84 3.01 0.16 -4.87 117.46 112.68 2dlr n PHE 40 Ca 0.18 0.88 0.03 0.00 1.01 0.00 0.00 57.45 59.55 2dlr n PHE 40 Cb 0.70 -4.26 -0.04 0.00 -0.01 0.00 0.00 39.48 35.88 2dlr n PHE 40 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2dlr n SER 41 N -2.96 0.60 -0.44 4.37 7.64 -1.19 -4.62 113.62 117.02 2dlr n SER 41 Ca -0.13 -0.59 0.38 0.00 1.01 0.00 0.00 58.87 59.54 2dlr n SER 41 Cb 0.60 1.03 0.71 0.00 -1.01 0.00 0.00 64.21 65.54 2dlr n SER 41 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 2dlr h GLU 42 N 0.00 0.08 -1.16 1.43 9.09 -1.88 0.24 114.58 122.38 2dlr h GLU 42 Ca 0.00 -0.00 0.34 0.00 0.05 0.00 0.00 59.36 59.74 2dlr h GLU 42 Cb 0.16 -0.02 -0.05 0.00 -1.65 0.00 0.00 28.75 27.20 2dlr h GLU 42 CO 0.00 0.05 1.18 -0.85 0.05 0.00 0.00 179.01 179.44 2dlr n GLU 43 N -4.30 0.01 0.18 1.06 0.28 -1.26 0.79 120.64 117.40 2dlr n GLU 43 Ca 0.32 0.96 -0.14 0.00 -0.16 0.00 0.00 57.16 58.14 2dlr n GLU 43 Cb 1.41 -2.35 -0.08 0.00 1.43 0.00 0.00 31.44 31.86 2dlr n GLU 43 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 2dlr h ASN 44 N 0.00 -0.34 0.27 -1.84 2.35 -1.33 -2.12 115.58 112.56 2dlr h ASN 44 Ca 0.55 -0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 56.18 2dlr h ASN 44 Cb 2.90 0.09 -0.01 0.00 0.05 0.00 0.00 38.32 41.35 2dlr h ASN 44 CO -0.01 -0.16 -0.27 -0.37 -1.65 0.00 0.00 177.43 174.98 2dlr h VAL 45 N -0.51 1.18 -0.60 2.81 -1.51 0.15 -0.79 116.25 116.97 2dlr h VAL 45 Ca -0.04 -0.91 -0.06 0.00 -1.23 0.00 0.00 66.70 64.45 2dlr h VAL 45 Cb 0.38 1.49 -0.03 0.00 -2.13 0.00 0.00 31.29 31.01 2dlr h VAL 45 CO 0.07 0.26 0.11 -0.07 -1.23 0.00 0.00 177.57 176.71 2dlr h LEU 46 N 0.00 0.90 0.24 4.19 3.38 -1.22 -0.66 115.31 122.14 2dlr h LEU 46 Ca -0.00 -0.19 -0.34 0.00 0.09 0.00 0.00 57.88 57.44 2dlr h LEU 46 Cb 0.47 -0.24 0.03 0.00 0.09 0.00 0.00 40.66 41.02 2dlr h LEU 46 CO 0.03 0.90 -1.55 0.15 0.09 0.00 0.00 178.44 178.06 2dlr h PHE 47 N 0.91 0.92 0.02 1.13 3.57 -0.99 -3.23 116.94 119.27 2dlr h PHE 47 Ca 0.19 -0.67 -0.00 0.00 3.53 0.00 0.00 57.97 61.02 2dlr h PHE 47 Cb 0.37 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.07 2dlr h PHE 47 CO 0.02 1.59 -0.01 2.35 -2.23 0.00 0.00 178.31 180.03 2dlr h TRP 48 N 0.14 -0.03 -0.31 0.41 7.01 -1.07 -2.57 115.95 119.54 2dlr h TRP 48 Ca -0.28 -0.00 0.06 0.00 2.11 0.00 0.00 58.89 60.79 2dlr h TRP 48 Cb 2.16 0.01 -0.06 0.00 -2.10 0.00 0.00 29.16 29.16 2dlr h TRP 48 CO 0.12 0.02 -0.10 -0.07 -2.79 0.00 0.00 178.44 175.62 2dlr h LEU 49 N -0.07 -0.36 -0.31 0.65 3.38 -1.26 -2.37 115.31 114.97 2dlr h LEU 49 Ca -0.00 0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.14 2dlr h LEU 49 Cb 0.06 0.22 -0.08 0.00 0.09 0.00 0.00 40.66 40.96 2dlr h LEU 49 CO 0.00 -0.13 -0.23 0.00 0.09 0.00 0.00 178.44 178.17 2dlr h ALA 50 N 1.25 -0.06 -0.78 1.53 0.00 -1.54 -2.10 119.26 117.56 2dlr h ALA 50 Ca 0.15 0.10 0.12 0.00 0.00 0.00 0.00 54.91 55.28 2dlr h ALA 50 Cb 0.27 0.51 -0.13 0.00 0.00 0.00 0.00 17.79 18.45 2dlr h ALA 50 CO -0.34 -0.64 -0.31 0.00 0.00 0.00 0.00 179.25 177.97 2dlr h GLU 52 N 0.00 -0.79 -0.99 0.00 4.39 -1.41 -3.00 114.58 112.78 2dlr h GLU 52 Ca 0.27 0.05 0.31 0.00 0.34 0.00 0.00 59.36 60.34 2dlr h GLU 52 Cb 0.47 0.18 -0.18 0.00 -0.10 0.00 0.00 28.75 29.12 2dlr h GLU 52 CO -0.78 -0.52 0.18 -0.44 -1.16 0.00 0.00 179.01 176.28 2dlr h ASP 53 N -0.90 -0.24 0.20 1.42 5.19 -0.72 0.18 116.42 121.55 2dlr h ASP 53 Ca -0.08 0.27 0.01 0.00 -0.62 0.00 0.00 57.03 56.61 2dlr h ASP 53 Cb 0.63 0.42 -0.04 0.00 0.18 0.00 0.00 39.33 40.52 2dlr h ASP 53 CO 0.14 -0.38 -0.51 0.15 -3.12 0.00 0.00 179.24 175.52 2dlr h PHE 54 N 0.01 -1.44 -0.29 4.55 3.57 -0.48 -0.02 116.94 122.84 2dlr h PHE 54 Ca 0.67 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 62.18 2dlr h PHE 54 Cb 1.52 0.60 -0.02 0.00 2.79 0.00 0.00 35.95 40.85 2dlr h PHE 54 CO -0.36 -0.60 0.08 1.57 -2.23 0.00 0.00 178.31 176.77 2dlr h LYS 55 N -0.79 0.41 0.78 1.11 2.10 -0.64 -3.03 116.57 116.50 2dlr h LYS 55 Ca -0.01 -0.05 -0.04 0.00 -2.00 0.00 0.00 60.65 58.55 2dlr h LYS 55 Cb 0.77 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.03 2dlr h LYS 55 CO -0.23 0.37 -0.42 0.87 -2.00 0.00 0.00 179.45 178.04 2dlr h LYS 56 N 0.41 -1.07 -0.78 0.07 1.57 0.14 -2.62 116.57 114.29 2dlr h LYS 56 Ca 0.10 0.07 0.32 0.00 -1.87 0.00 0.00 60.65 59.28 2dlr h LYS 56 Cb 0.15 0.24 -0.14 0.00 0.08 0.00 0.00 32.23 32.56 2dlr h LYS 56 CO -0.01 -0.71 0.41 -1.33 -0.57 0.00 0.00 179.45 177.24 2dlr n MET 57 N -5.58 -0.05 -3.68 3.15 2.81 -0.11 -4.72 117.12 108.94 2dlr n MET 57 Ca -0.15 1.08 -0.28 0.00 -1.81 0.00 0.00 57.70 56.54 2dlr n MET 57 Cb 0.46 -1.93 0.02 0.00 -0.71 0.00 0.00 33.22 31.06 2dlr n MET 57 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2dlr n GLN 58 N -4.77 -5.04 -4.72 0.03 6.02 -0.99 -4.97 117.38 102.94 2dlr n GLN 58 Ca 0.29 0.61 -0.26 0.00 -0.01 0.00 0.00 57.00 57.64 2dlr n GLN 58 Cb 0.99 -5.47 -0.16 0.00 1.02 0.00 0.00 30.24 26.62 2dlr n GLN 58 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2dlr s ASP 59 N -3.10 2.00 0.01 1.08 1.01 -1.26 -5.06 116.67 111.35 2dlr s ASP 59 Ca 0.57 -0.34 -0.26 0.00 0.71 0.00 0.00 52.55 53.24 2dlr s ASP 59 Cb -0.28 -0.76 -0.14 0.00 1.01 0.00 0.00 42.92 42.74 2dlr s ASP 59 CO 0.70 0.09 1.08 0.50 0.21 0.00 0.00 175.17 177.76 2dlr h LYS 60 N 6.63 -0.84 0.08 8.23 3.64 -1.96 -1.41 116.57 130.95 2dlr h LYS 60 Ca -0.30 0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.14 2dlr h LYS 60 Cb 1.19 0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 33.16 2dlr h LYS 60 CO 0.48 -0.54 -0.37 1.15 -2.27 0.00 0.00 179.45 177.90 2dlr h THR 61 N -1.19 0.00 -0.97 1.00 2.02 -1.99 0.28 112.91 112.05 2dlr h THR 61 Ca -0.09 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.30 2dlr h THR 61 Cb 0.69 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.98 2dlr h THR 61 CO 0.15 0.00 0.56 1.56 0.37 0.00 0.00 175.52 178.15 2dlr h GLN 62 N -0.52 0.61 -0.14 6.66 4.20 -2.00 -0.53 115.11 123.38 2dlr h GLN 62 Ca -0.00 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 2dlr h GLN 62 Cb 0.52 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 2dlr h GLN 62 CO -0.20 0.40 0.05 0.52 -0.67 0.00 0.00 178.83 178.93 2dlr h MET 63 N 0.63 0.22 -1.15 1.46 2.86 -0.31 -2.16 114.93 116.48 2dlr h MET 63 Ca 0.59 -0.05 0.40 0.00 -2.06 0.00 0.00 59.70 58.59 2dlr h MET 63 Cb 1.03 -0.03 -0.15 0.00 0.06 0.00 0.00 31.60 32.51 2dlr h MET 63 CO -0.44 0.35 0.69 1.96 1.06 0.00 0.00 176.91 180.53 2dlr h GLN 64 N 0.05 0.12 0.00 1.72 4.20 0.12 0.33 115.11 121.65 2dlr h GLN 64 Ca 0.05 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2dlr h GLN 64 Cb 0.22 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.97 2dlr h GLN 64 CO -0.00 0.08 -0.01 0.93 -0.67 0.00 0.00 178.83 179.16 2dlr h GLU 65 N 0.12 0.00 -1.19 1.46 5.08 -1.41 -3.35 114.58 115.29 2dlr h GLU 65 Ca 0.81 0.00 0.44 0.00 -1.00 0.00 0.00 59.36 59.61 2dlr h GLU 65 Cb 2.25 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 31.35 2dlr h GLU 65 CO -0.56 0.00 0.73 1.17 -1.00 0.00 0.00 179.01 179.34 2dlr n LYS 66 N -2.39 -0.04 0.01 2.33 3.00 -0.84 -1.07 118.16 119.15 2dlr n LYS 66 Ca -0.00 1.25 -0.02 0.00 -0.00 0.00 0.00 58.31 59.54 2dlr n LYS 66 Cb 0.00 -2.39 -0.01 0.00 0.00 0.00 0.00 35.03 32.64 2dlr n LYS 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2dlr h ALA 67 N 1.68 -0.56 -0.47 3.14 0.00 -0.49 0.50 119.26 123.06 2dlr h ALA 67 Ca 0.84 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.70 2dlr h ALA 67 Cb 2.52 0.57 -0.02 0.00 0.00 0.00 0.00 17.79 20.86 2dlr h ALA 67 CO -0.56 -0.58 0.15 1.57 0.00 0.00 0.00 179.25 179.83 2dlr h LYS 68 N -0.10 0.69 0.19 0.00 2.10 -1.23 -2.09 116.57 116.13 2dlr h LYS 68 Ca 0.00 -0.11 0.00 0.00 -2.00 0.00 0.00 60.65 58.54 2dlr h LYS 68 Cb 0.10 -0.12 -0.03 0.00 -0.90 0.00 0.00 32.23 31.28 2dlr h LYS 68 CO -0.05 0.60 -0.39 0.93 -2.00 0.00 0.00 179.45 178.53 2dlr h GLU 69 N 0.68 -0.61 -0.53 0.07 4.39 -0.65 0.29 114.58 118.20 2dlr h GLU 69 Ca 0.16 0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.91 2dlr h GLU 69 Cb 0.19 0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.95 2dlr h GLU 69 CO -0.01 -0.41 0.35 0.82 -1.16 0.00 0.00 179.01 178.60 2dlr h ILE 70 N -0.63 1.12 -0.60 3.13 2.04 -0.86 -2.51 117.51 119.20 2dlr h ILE 70 Ca -0.02 -0.24 0.08 0.00 1.00 0.00 0.00 64.86 65.68 2dlr h ILE 70 Cb 0.60 0.36 -0.07 0.00 -0.74 0.00 0.00 36.82 36.97 2dlr h ILE 70 CO -0.16 0.13 0.24 0.22 0.00 0.00 0.00 178.15 178.58 2dlr h TYR 71 N 0.70 0.43 0.00 1.37 5.03 -1.08 0.34 116.97 123.76 2dlr h TYR 71 Ca 0.20 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.54 2dlr h TYR 71 Cb -0.06 -0.10 0.00 0.00 1.55 0.00 0.00 36.73 38.12 2dlr h TYR 71 CO -0.04 0.13 0.00 -1.33 -1.32 0.00 0.00 178.16 175.60 2dlr n MET 72 N -4.96 0.78 -0.08 1.82 2.81 0.98 -0.71 117.12 117.76 2dlr n MET 72 Ca 0.08 0.00 -0.06 0.00 -1.81 0.00 0.00 57.70 55.91 2dlr n MET 72 Cb 0.25 -1.36 -0.02 0.00 -0.71 0.00 0.00 33.22 31.37 2dlr n MET 72 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 2dlr n THR 73 N -0.86 1.44 -0.01 2.03 -1.04 0.12 -4.64 114.28 111.32 2dlr n THR 73 Ca 0.13 0.19 -0.01 0.00 -2.04 0.00 0.00 64.05 62.33 2dlr n THR 73 Cb 0.06 -2.37 -0.02 0.00 -1.82 0.00 0.00 70.33 66.19 2dlr n THR 73 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 2dlr n PHE 74 N -4.58 0.00 1.13 -1.42 3.72 -1.01 -4.48 117.46 110.82 2dlr n PHE 74 Ca -0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.30 2dlr n PHE 74 Cb 0.34 -0.09 0.01 0.00 -0.94 0.00 0.00 39.48 38.80 2dlr n PHE 74 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2dlr n LEU 75 N -2.02 0.95 -4.75 4.37 4.77 0.11 -4.75 117.00 115.68 2dlr n LEU 75 Ca -0.03 -0.47 -0.22 0.00 -0.03 0.00 0.00 56.01 55.25 2dlr n LEU 75 Cb 0.51 -0.41 -0.06 0.00 -2.33 0.00 0.00 43.42 41.14 2dlr n LEU 75 CO 0.04 0.22 -0.22 -0.55 -1.33 0.00 0.00 177.39 175.55 2dlr s SER 76 N -0.21 5.03 0.02 -1.43 0.15 -0.49 -4.76 113.70 112.00 2dlr s SER 76 Ca 0.02 -0.49 -0.20 0.00 0.70 0.00 0.00 55.95 55.97 2dlr s SER 76 Cb 0.01 -1.07 -0.19 0.00 -1.71 0.00 0.00 66.02 63.07 2dlr s SER 76 CO 0.01 -0.09 1.20 -1.28 1.20 0.00 0.00 173.24 174.28 2dlr h SER 77 N 1.62 0.46 -0.09 5.45 0.87 -1.91 -3.07 113.55 116.88 2dlr h SER 77 Ca -0.46 -0.64 0.00 0.00 -1.23 0.00 0.00 61.79 59.46 2dlr h SER 77 Cb 1.25 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.07 2dlr h SER 77 CO 0.61 1.03 0.00 0.29 -0.53 0.00 0.00 176.83 178.22 2dlr n LYS 78 N -4.38 1.50 -1.81 2.24 5.02 -1.26 -4.87 118.16 114.61 2dlr n LYS 78 Ca -0.08 -0.44 -0.43 0.00 -2.02 0.00 0.00 58.31 55.34 2dlr n LYS 78 Cb 0.52 -1.51 -0.03 0.00 -0.02 0.00 0.00 35.03 34.00 2dlr n LYS 78 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dlr s ALA 79 N -1.38 3.02 0.52 7.82 0.00 -1.16 -4.85 121.76 125.73 2dlr s ALA 79 Ca 0.08 0.70 0.17 0.00 0.00 0.00 0.00 51.96 52.90 2dlr s ALA 79 Cb 0.06 -3.98 1.27 0.00 0.00 0.00 0.00 23.12 20.47 2dlr s ALA 79 CO 0.03 -2.37 2.12 0.66 0.00 0.00 0.00 175.76 176.19 2dlr h SER 80 N 12.93 0.02 -3.37 0.00 4.64 -1.89 -3.35 113.55 122.52 2dlr h SER 80 Ca -0.39 -0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.32 2dlr h SER 80 Cb 1.21 -0.01 -0.40 0.00 -0.31 0.00 0.00 62.40 62.89 2dlr h SER 80 CO 0.98 0.02 -0.75 -0.44 -0.87 0.00 0.00 176.83 175.76 2dlr s SER 81 N -6.91 4.14 -0.31 4.97 0.01 -1.26 -5.10 113.70 109.24 2dlr s SER 81 Ca -0.05 -1.67 -0.09 0.00 1.31 0.00 0.00 55.95 55.45 2dlr s SER 81 Cb 0.17 -1.10 -0.00 0.00 0.21 0.00 0.00 66.02 65.31 2dlr s SER 81 CO 0.68 -0.37 0.13 -1.58 0.41 0.00 0.00 173.24 172.51 2dlr s GLN 82 N 1.41 3.25 1.07 12.44 0.74 -1.26 -4.48 119.66 132.83 2dlr s GLN 82 Ca 0.07 -0.77 -0.14 0.00 0.05 0.00 0.00 55.36 54.57 2dlr s GLN 82 Cb -0.18 -3.52 0.15 0.00 1.10 0.00 0.00 33.01 30.57 2dlr s GLN 82 CO -0.17 -0.43 0.57 1.33 -0.55 0.00 0.00 175.29 176.04 2dlr n VAL 83 N 4.95 0.00 -3.56 1.34 0.24 -1.26 -4.97 118.33 115.06 2dlr n VAL 83 Ca -0.14 -0.27 -0.36 0.00 -2.04 0.00 0.00 64.34 61.53 2dlr n VAL 83 Cb 0.49 -0.79 -0.08 0.00 -1.47 0.00 0.00 33.84 31.99 2dlr n VAL 83 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2dlr s ASN 84 N -2.17 6.35 0.31 -1.34 3.84 -1.26 -5.06 114.94 115.61 2dlr s ASN 84 Ca 0.62 0.41 -0.15 0.00 0.21 0.00 0.00 52.86 53.94 2dlr s ASN 84 Cb -0.20 -2.16 0.02 0.00 -0.55 0.00 0.00 41.25 38.36 2dlr s ASN 84 CO 0.65 0.08 0.65 0.68 -2.79 0.00 0.00 177.10 176.37 2dlr s VAL 85 N 0.66 0.00 -0.01 -5.21 -7.23 -1.26 -4.88 120.40 102.46 2dlr s VAL 85 Ca 0.14 -1.17 -0.22 0.00 -1.81 0.00 0.00 61.98 58.92 2dlr s VAL 85 Cb -0.13 -2.37 -0.22 0.00 0.56 0.00 0.00 36.38 34.22 2dlr s VAL 85 CO 0.03 0.00 1.10 -0.33 -0.31 0.00 0.00 175.10 175.60 2dlr h GLU 86 N 2.08 0.32 0.00 4.82 5.08 -2.01 -3.45 114.58 121.41 2dlr h GLU 86 Ca -0.25 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 57.79 2dlr h GLU 86 Cb 1.25 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.58 2dlr h GLU 86 CO 0.33 0.99 0.00 0.41 -1.00 0.00 0.00 179.01 179.74 2dlr n GLY 87 N 0.95 -1.95 1.09 -3.84 0.00 -1.26 -5.00 105.19 95.19 2dlr n GLY 87 Ca -0.10 0.95 0.04 0.00 0.00 0.00 0.00 46.02 46.92 2dlr n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dlr n GLN 88 N 0.00 2.74 0.00 1.61 10.64 -1.26 -3.97 117.38 127.13 2dlr n GLN 88 Ca 0.00 -1.56 0.14 0.00 -1.83 0.00 0.00 57.00 53.75 2dlr n GLN 88 Cb 0.00 -1.75 0.66 0.00 -0.86 0.00 0.00 30.24 28.29 2dlr n GLN 88 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 2dlr n SER 89 N 0.39 0.02 -0.30 2.61 7.64 -1.26 -3.75 113.62 118.98 2dlr n SER 89 Ca 0.14 0.24 0.32 0.00 1.01 0.00 0.00 58.87 60.58 2dlr n SER 89 Cb 0.64 -0.40 0.70 0.00 -1.01 0.00 0.00 64.21 64.14 2dlr n SER 89 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 2dlr h ARG 90 N 0.01 0.08 -7.32 1.43 2.43 -2.03 -3.41 114.38 105.58 2dlr h ARG 90 Ca 0.00 -0.00 -0.44 0.00 -0.81 0.00 0.00 59.98 58.73 2dlr h ARG 90 Cb 0.43 -0.02 0.18 0.00 -0.42 0.00 0.00 29.97 30.13 2dlr h ARG 90 CO 0.00 0.05 0.14 -0.48 -1.51 0.00 0.00 179.97 178.17 2dlr s LEU 91 N -8.65 1.18 0.10 3.80 0.05 -1.25 -5.07 118.68 108.84 2dlr s LEU 91 Ca -0.06 1.13 -0.26 0.00 0.05 0.00 0.00 54.13 54.98 2dlr s LEU 91 Cb 0.23 -3.15 0.08 0.00 -2.05 0.00 0.00 46.19 41.30 2dlr s LEU 91 CO 0.80 -3.59 0.98 0.21 -0.55 0.00 0.00 176.35 174.20 2dlr s ASN 92 N -3.35 -0.20 0.52 1.48 3.84 -1.26 -4.99 114.94 110.99 2dlr s ASN 92 Ca 0.67 -0.29 0.31 0.00 0.21 0.00 0.00 52.86 53.76 2dlr s ASN 92 Cb -0.18 0.43 1.08 0.00 -0.55 0.00 0.00 41.25 42.02 2dlr s ASN 92 CO 0.59 -0.77 1.24 -0.62 -2.79 0.00 0.00 177.10 174.74 2dlr n GLU 93 N -0.42 0.01 -0.08 0.43 1.02 -1.26 0.19 120.64 120.53 2dlr n GLU 93 Ca -0.07 0.93 -0.11 0.00 -0.02 0.00 0.00 57.16 57.89 2dlr n GLU 93 Cb 0.61 -2.24 -0.04 0.00 -0.02 0.00 0.00 31.44 29.75 2dlr n GLU 93 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2dlr h LYS 94 N 0.00 0.41 -0.58 3.49 1.79 -2.00 -2.63 116.57 117.05 2dlr h LYS 94 Ca 0.59 -0.11 0.17 0.00 -2.18 0.00 0.00 60.65 59.11 2dlr h LYS 94 Cb 2.89 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 33.47 2dlr h LYS 94 CO -0.01 0.54 0.87 0.97 -1.08 0.00 0.00 179.45 180.75 2dlr h ILE 95 N 0.21 0.10 0.08 1.86 2.10 0.17 1.35 117.51 123.38 2dlr h ILE 95 Ca 0.07 0.00 -0.26 0.00 1.08 0.00 0.00 64.86 65.76 2dlr h ILE 95 Cb 0.33 0.26 0.00 0.00 -1.09 0.00 0.00 36.82 36.32 2dlr h ILE 95 CO 0.01 0.00 -1.13 -0.07 -1.08 0.00 0.00 178.15 175.87 2dlr h LEU 96 N 0.00 0.45 -0.14 2.19 3.38 -1.56 -3.37 115.31 116.26 2dlr h LEU 96 Ca 0.27 -0.43 0.01 0.00 0.09 0.00 0.00 57.88 57.82 2dlr h LEU 96 Cb 2.01 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 42.60 2dlr h LEU 96 CO -0.00 1.30 -0.08 -0.62 0.09 0.00 0.00 178.44 179.12 2dlr n GLU 97 N -3.61 -0.06 -3.58 1.13 1.02 0.46 -3.40 120.64 112.61 2dlr n GLU 97 Ca -0.08 0.74 -0.40 0.00 -0.02 0.00 0.00 57.16 57.40 2dlr n GLU 97 Cb 0.95 -1.10 -0.09 0.00 -0.02 0.00 0.00 31.44 31.18 2dlr n GLU 97 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2dlr s GLU 98 N -3.48 2.52 0.11 3.49 1.03 -1.26 -5.07 118.70 116.04 2dlr s GLU 98 Ca -0.02 -1.64 -0.31 0.00 0.03 0.00 0.00 54.97 53.03 2dlr s GLU 98 Cb 0.02 -3.86 -0.08 0.00 -0.80 0.00 0.00 34.13 29.41 2dlr s GLU 98 CO 0.08 -1.09 1.36 -1.25 -1.33 0.00 0.00 175.26 173.03 2dlr s PRO 99 N 1.38 4.34 -0.05 -4.83 0.04 -1.22 -5.00 135.00 129.66 2dlr s PRO 99 Ca 0.05 2.03 -0.20 0.00 0.04 0.00 0.00 61.00 62.91 2dlr s PRO 99 Cb -0.25 -3.26 0.04 0.00 0.04 0.00 0.00 34.50 31.07 2dlr s PRO 99 CO 0.00 -0.41 0.46 -3.38 0.04 0.00 0.00 177.00 173.71 2dlr s HIS 100 N 1.07 -0.39 -1.12 0.56 -3.43 -1.26 -4.97 115.29 105.76 2dlr s HIS 100 Ca 0.63 0.70 0.00 0.00 -0.80 0.00 0.00 55.06 55.59 2dlr s HIS 100 Cb -0.36 0.21 0.00 0.00 -1.43 0.00 0.00 32.58 31.00 2dlr s HIS 100 CO 0.30 -0.44 0.27 -0.35 -2.00 0.00 0.00 174.74 172.52 2dlr n PRO 101 N 1.38 0.49 -0.00 -0.38 -0.04 -1.26 -1.98 135.00 133.20 2dlr n PRO 101 Ca -0.20 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.30 2dlr n PRO 101 Cb 0.56 -1.22 -0.05 0.00 -0.04 0.00 0.00 33.50 32.76 2dlr n PRO 101 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2dlr n LEU 102 N 0.17 0.07 -0.16 1.53 4.77 -1.26 -3.76 117.00 118.36 2dlr n LEU 102 Ca 0.00 -0.11 -0.06 0.00 -0.03 0.00 0.00 56.01 55.81 2dlr n LEU 102 Cb 0.11 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.31 2dlr n LEU 102 CO 0.00 0.02 0.87 0.00 -1.33 0.00 0.00 177.39 176.95 2dlr h MET 103 N 0.00 0.91 0.00 3.23 -0.00 -1.79 -3.30 114.93 113.98 2dlr h MET 103 Ca 0.00 -0.26 -0.37 0.00 -0.00 0.00 0.00 59.70 59.07 2dlr h MET 103 Cb 0.27 -0.10 -0.07 0.00 -0.00 0.00 0.00 31.60 31.70 2dlr h MET 103 CO 0.00 0.89 -2.42 1.19 -0.00 0.00 0.00 176.91 176.58 2dlr n PHE 104 N -4.20 0.00 -0.21 -0.10 3.72 -1.26 -4.29 117.46 111.11 2dlr n PHE 104 Ca 0.03 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.50 2dlr n PHE 104 Cb 0.31 -0.97 0.14 0.00 -0.94 0.00 0.00 39.48 38.01 2dlr n PHE 104 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 2dlr n GLN 105 N -3.12 -0.05 0.05 -1.08 -0.06 -1.24 0.74 117.38 112.62 2dlr n GLN 105 Ca -0.42 0.92 -0.11 0.00 -2.00 0.00 0.00 57.00 55.38 2dlr n GLN 105 Cb 1.02 -1.42 -0.08 0.00 -4.06 0.00 0.00 30.24 25.70 2dlr n GLN 105 CO 0.00 0.00 0.00 0.87 -0.20 0.00 0.00 177.06 177.73 2dlr h LYS 106 N 0.00 -0.19 -0.98 3.69 1.57 -1.79 -2.72 116.57 116.15 2dlr h LYS 106 Ca 0.33 0.01 0.27 0.00 -1.87 0.00 0.00 60.65 59.39 2dlr h LYS 106 Cb 0.61 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.91 2dlr h LYS 106 CO -0.59 0.27 0.69 -0.07 -0.57 0.00 0.00 179.45 179.18 2dlr h LEU 107 N -0.80 0.12 -0.23 2.94 3.38 0.14 0.41 115.31 121.27 2dlr h LEU 107 Ca -0.02 0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 2dlr h LEU 107 Cb 0.54 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 2dlr h LEU 107 CO 0.03 0.04 -0.91 -0.61 0.09 0.00 0.00 178.44 177.08 2dlr h GLN 108 N 0.11 0.32 0.55 1.13 4.15 -0.12 -3.06 115.11 118.19 2dlr h GLN 108 Ca 0.49 -0.34 -0.02 0.00 0.77 0.00 0.00 58.65 59.55 2dlr h GLN 108 Cb 1.73 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 29.51 2dlr h GLN 108 CO -0.07 1.04 -0.34 -0.44 -1.93 0.00 0.00 178.83 177.08 2dlr h ASP 109 N 0.18 -0.86 0.28 -0.69 3.32 0.14 -1.33 116.42 117.46 2dlr h ASP 109 Ca -0.06 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2dlr h ASP 109 Cb 1.54 0.25 -0.03 0.00 0.22 0.00 0.00 39.33 41.31 2dlr h ASP 109 CO 0.15 -0.53 -0.36 0.06 -1.72 0.00 0.00 179.24 176.84 2dlr h GLN 110 N -0.84 -0.66 -0.93 3.56 3.07 -1.59 -2.15 115.11 115.57 2dlr h GLN 110 Ca -0.06 0.05 0.24 0.00 0.09 0.00 0.00 58.65 58.96 2dlr h GLN 110 Cb 0.69 0.15 -0.13 0.00 0.08 0.00 0.00 27.48 28.27 2dlr h GLN 110 CO 0.06 -0.44 0.44 0.82 0.09 0.00 0.00 178.83 179.80 2dlr h ILE 111 N -0.69 0.45 -0.16 1.86 1.08 -1.50 0.07 117.51 118.61 2dlr h ILE 111 Ca -0.01 -0.14 0.05 0.00 -0.39 0.00 0.00 64.86 64.37 2dlr h ILE 111 Cb 0.65 0.00 -0.05 0.00 -3.07 0.00 0.00 36.82 34.35 2dlr h ILE 111 CO -0.11 0.07 -0.19 0.15 -0.69 0.00 0.00 178.15 177.39 2dlr h PHE 112 N 0.41 -0.48 -0.63 1.37 3.57 -0.57 -1.52 116.94 119.08 2dlr h PHE 112 Ca 0.60 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 62.09 2dlr h PHE 112 Cb 1.19 0.24 -0.03 0.00 2.79 0.00 0.00 35.95 40.13 2dlr h PHE 112 CO -0.11 -0.26 0.25 -0.91 -2.23 0.00 0.00 178.31 175.05 2dlr h ASN 113 N -0.22 0.84 0.46 0.41 -0.26 -0.82 -0.53 115.58 115.45 2dlr h ASN 113 Ca 0.11 -0.11 -0.01 0.00 -0.56 0.00 0.00 56.30 55.72 2dlr h ASN 113 Cb 0.38 -0.22 -0.03 0.00 -1.06 0.00 0.00 38.32 37.40 2dlr h ASN 113 CO -0.29 0.76 -0.51 0.25 -1.06 0.00 0.00 177.43 176.58 2dlr h LEU 114 N 0.91 -1.42 -1.44 1.61 5.85 -0.28 -2.18 115.31 118.36 2dlr h LEU 114 Ca 0.21 0.12 -0.06 0.00 0.84 0.00 0.00 57.88 58.99 2dlr h LEU 114 Cb 0.18 0.48 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 2dlr h LEU 114 CO -0.02 -0.66 -0.28 0.24 -0.34 0.00 0.00 178.44 177.38 2dlr h MET 115 N -0.98 0.00 -0.79 1.25 2.86 -1.28 1.24 114.93 117.23 2dlr h MET 115 Ca -0.05 0.00 0.14 0.00 -2.06 0.00 0.00 59.70 57.73 2dlr h MET 115 Cb 0.86 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.47 2dlr h MET 115 CO -0.09 0.28 0.52 0.87 1.06 0.00 0.00 176.91 179.55 2dlr h LYS 116 N 0.00 0.49 0.00 1.72 1.57 -0.47 1.76 116.57 121.64 2dlr h LYS 116 Ca -0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2dlr h LYS 116 Cb 0.51 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2dlr h LYS 116 CO 0.04 0.32 -0.72 0.66 -0.57 0.00 0.00 179.45 179.18 2dlr n TYR 117 N -4.50 0.00 -0.04 -1.35 4.01 -1.00 -2.51 117.16 111.78 2dlr n TYR 117 Ca 0.15 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.87 2dlr n TYR 117 Cb 0.50 -0.04 -0.01 0.00 -0.31 0.00 0.00 39.34 39.48 2dlr n TYR 117 CO 0.00 0.00 0.00 0.22 -0.46 0.00 0.00 176.86 176.62 2dlr h ASP 118 N 0.00 0.00 0.00 7.72 3.58 0.18 -3.41 116.42 124.50 2dlr h ASP 118 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2dlr h ASP 118 Cb 0.13 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.18 2dlr h ASP 118 CO 0.00 0.41 -0.54 -1.20 -2.88 0.00 0.00 179.24 175.03 2dlr n SER 119 N -3.78 1.32 -0.16 2.28 7.64 -0.18 -4.32 113.62 116.42 2dlr n SER 119 Ca -0.03 0.37 -0.04 0.00 1.01 0.00 0.00 58.87 60.18 2dlr n SER 119 Cb 0.09 -0.71 -0.04 0.00 -1.01 0.00 0.00 64.21 62.54 2dlr n SER 119 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dlr n TYR 120 N -3.89 -0.17 -0.32 1.43 9.36 0.58 0.25 117.16 124.40 2dlr n TYR 120 Ca -0.08 0.48 0.01 0.00 3.32 0.00 0.00 57.90 61.64 2dlr n TYR 120 Cb 0.28 -0.47 0.07 0.00 -0.63 0.00 0.00 39.34 38.58 2dlr n TYR 120 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 2dlr n SER 121 N -3.85 -0.46 0.09 2.98 7.64 -1.04 -0.12 113.62 118.85 2dlr n SER 121 Ca 0.01 1.49 -0.13 0.00 1.01 0.00 0.00 58.87 61.25 2dlr n SER 121 Cb 0.10 -0.38 -0.08 0.00 -1.01 0.00 0.00 64.21 62.83 2dlr n SER 121 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2dlr h ARG 122 N 0.00 -0.21 -0.91 1.43 3.08 -0.39 -3.06 114.38 114.32 2dlr h ARG 122 Ca 0.34 0.01 0.30 0.00 0.07 0.00 0.00 59.98 60.70 2dlr h ARG 122 Cb 0.56 0.05 -0.17 0.00 0.08 0.00 0.00 29.97 30.49 2dlr h ARG 122 CO -0.87 0.08 0.18 0.34 -1.07 0.00 0.00 179.97 178.63 2dlr n PHE 123 N -5.06 0.75 0.18 3.04 7.35 0.83 0.47 117.46 125.01 2dlr n PHE 123 Ca -0.09 1.09 -0.14 0.00 -0.76 0.00 0.00 57.45 57.55 2dlr n PHE 123 Cb 0.20 -1.29 -0.08 0.00 0.35 0.00 0.00 39.48 38.67 2dlr n PHE 123 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2dlr h LEU 124 N 0.00 -0.35 -0.80 -2.13 3.38 -1.24 -2.41 115.31 111.76 2dlr h LEU 124 Ca 0.63 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.52 2dlr h LEU 124 Cb 1.45 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.29 2dlr h LEU 124 CO -0.80 -0.13 0.00 2.29 0.09 0.00 0.00 178.44 179.88 2dlr n LYS 125 N -5.21 1.24 -3.96 1.13 2.85 0.16 -4.16 118.16 110.21 2dlr n LYS 125 Ca -0.10 -0.23 -0.27 0.00 -1.05 0.00 0.00 58.31 56.66 2dlr n LYS 125 Cb 0.23 -1.35 -0.03 0.00 -0.65 0.00 0.00 35.03 33.22 2dlr n LYS 125 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 2dlr s SER 126 N -0.45 6.23 0.16 -5.58 0.01 0.18 -4.97 113.70 109.28 2dlr s SER 126 Ca 0.04 0.14 -0.16 0.00 1.31 0.00 0.00 55.95 57.29 2dlr s SER 126 Cb 0.03 -1.85 0.03 0.00 0.21 0.00 0.00 66.02 64.43 2dlr s SER 126 CO 0.02 0.07 1.81 0.44 0.41 0.00 0.00 173.24 175.99 2dlr h ASP 127 N 2.28 0.51 -1.00 2.44 3.32 -1.88 0.12 116.42 122.21 2dlr h ASP 127 Ca -0.48 -0.03 0.40 0.00 0.02 0.00 0.00 57.03 56.94 2dlr h ASP 127 Cb 1.19 -0.13 -0.18 0.00 0.22 0.00 0.00 39.33 40.43 2dlr h ASP 127 CO 0.69 0.38 0.48 0.25 -1.72 0.00 0.00 179.24 179.32 2dlr h LEU 128 N 0.59 0.24 0.00 1.55 5.85 -1.96 0.34 115.31 121.91 2dlr h LEU 128 Ca 0.16 0.26 -0.12 0.00 0.84 0.00 0.00 57.88 59.02 2dlr h LEU 128 Cb -0.05 0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 2dlr h LEU 128 CO -0.03 -0.42 -1.05 0.33 -0.34 0.00 0.00 178.44 176.92 2dlr n PHE 129 N -5.28 0.67 -0.24 1.25 -0.00 -0.97 -4.40 117.46 108.48 2dlr n PHE 129 Ca 0.36 0.29 -0.10 0.00 -0.00 0.00 0.00 57.45 58.01 2dlr n PHE 129 Cb 1.22 -0.84 -0.06 0.00 -0.00 0.00 0.00 39.48 39.81 2dlr n PHE 129 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 2dlr h LEU 130 N -1.00 -1.71 -0.71 -2.13 3.38 -0.18 -0.35 115.31 112.62 2dlr h LEU 130 Ca -0.18 0.27 0.11 0.00 0.09 0.00 0.00 57.88 58.16 2dlr h LEU 130 Cb 0.94 0.76 -0.11 0.00 0.09 0.00 0.00 40.66 42.34 2dlr h LEU 130 CO -0.11 -0.33 -0.28 0.29 0.09 0.00 0.00 178.44 178.10 2dlr n LYS 131 N -5.37 -0.17 -0.14 1.13 4.76 0.11 0.15 118.16 118.63 2dlr n LYS 131 Ca 0.01 1.09 -0.10 0.00 -2.87 0.00 0.00 58.31 56.43 2dlr n LYS 131 Cb 0.33 -1.61 -0.01 0.00 -1.84 0.00 0.00 35.03 31.90 2dlr n LYS 131 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 2dlr h HIS 132 N 0.00 0.76 -0.60 2.13 2.76 -1.31 -1.32 115.15 117.57 2dlr h HIS 132 Ca 0.24 -0.13 0.08 0.00 -2.20 0.00 0.00 60.37 58.36 2dlr h HIS 132 Cb 0.42 -0.20 -0.04 0.00 1.55 0.00 0.00 27.41 29.14 2dlr h HIS 132 CO -0.62 0.78 0.40 -0.22 -1.30 0.00 0.00 177.93 176.97 2dlr h LYS 133 N 0.53 0.48 0.08 5.26 3.64 0.25 0.69 116.57 127.51 2dlr h LYS 133 Ca 0.11 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 2dlr h LYS 133 Cb 0.47 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2dlr h LYS 133 CO 0.02 0.32 -0.04 0.00 -2.27 0.00 0.00 179.45 177.48 2dlr h ARG 134 N 0.50 -0.10 -0.78 1.90 3.08 -0.00 -3.31 114.38 115.66 2dlr h ARG 134 Ca 0.27 0.01 0.22 0.00 0.07 0.00 0.00 59.98 60.55 2dlr h ARG 134 Cb 0.42 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 2dlr h ARG 134 CO -0.08 -0.07 0.67 0.00 -1.07 0.00 0.00 179.97 179.42 2dlr h THR 135 N -0.68 0.39 0.64 2.04 1.03 -1.18 -1.67 112.91 113.48 2dlr h THR 135 Ca -0.01 0.00 -0.02 0.00 -0.01 0.00 0.00 66.41 66.37 2dlr h THR 135 Cb 0.08 0.50 -0.01 0.00 -1.07 0.00 0.00 68.15 67.65 2dlr h THR 135 CO 0.02 0.00 -0.49 -0.08 -0.01 0.00 0.00 175.52 174.96 2dlr h GLU 136 N 0.00 -1.05 -4.73 0.00 4.81 -0.95 -3.43 114.58 109.23 2dlr h GLU 136 Ca 0.37 0.07 -0.42 0.00 -0.13 0.00 0.00 59.36 59.25 2dlr h GLU 136 Cb 1.71 0.24 -0.30 0.00 0.63 0.00 0.00 28.75 31.03 2dlr h GLU 136 CO -0.00 -0.70 -0.79 -1.21 -0.73 0.00 0.00 179.01 175.58 2dlr s GLU 137 N -5.92 0.91 1.15 1.92 2.02 -0.63 -5.12 118.70 113.04 2dlr s GLU 137 Ca -0.18 -0.34 -0.15 0.00 0.02 0.00 0.00 54.97 54.32 2dlr s GLU 137 Cb 0.04 -0.86 0.26 0.00 0.10 0.00 0.00 34.13 33.67 2dlr s GLU 137 CO 0.61 0.17 1.06 -1.83 0.02 0.00 0.00 175.26 175.28 2dlr s GLU 138 N -0.01 -0.77 0.56 1.61 -1.05 -1.26 -4.72 118.70 113.06 2dlr s GLU 138 Ca 0.00 0.41 -0.05 0.00 -0.15 0.00 0.00 54.97 55.18 2dlr s GLU 138 Cb -0.06 -1.61 -0.00 0.00 -0.44 0.00 0.00 34.13 32.02 2dlr s GLU 138 CO 0.00 -3.51 0.86 -1.83 0.95 0.00 0.00 175.26 171.73 2dlr s GLU 139 N -4.93 3.06 -0.12 -4.83 1.03 -1.26 -5.08 118.70 106.57 2dlr s GLU 139 Ca 0.68 0.01 -0.03 0.00 0.03 0.00 0.00 54.97 55.65 2dlr s GLU 139 Cb -0.18 -2.31 -0.03 0.00 -0.80 0.00 0.00 34.13 30.81 2dlr s GLU 139 CO 0.59 -0.57 0.01 -1.83 -1.33 0.00 0.00 175.26 172.13 2dlr s GLU 140 N -4.92 3.33 -0.08 -4.83 -1.05 -1.26 -4.99 118.70 104.91 2dlr s GLU 140 Ca 0.52 -0.41 0.18 0.00 -0.15 0.00 0.00 54.97 55.12 2dlr s GLU 140 Cb -0.10 -2.91 0.65 0.00 -0.44 0.00 0.00 34.13 31.33 2dlr s GLU 140 CO 0.45 0.53 1.56 -0.25 0.95 0.00 0.00 175.26 178.49 2dlr n ASP 141 N 2.70 4.35 -4.86 0.83 9.92 -1.26 -4.97 116.55 123.26 2dlr n ASP 141 Ca -0.18 -2.33 -0.32 0.00 -0.53 0.00 0.00 54.79 51.43 2dlr n ASP 141 Cb 0.53 -0.52 -0.05 0.00 -0.64 0.00 0.00 41.12 40.44 2dlr n ASP 141 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2dlr s LEU 142 N -1.62 3.94 0.00 0.64 1.43 -1.26 -4.94 118.68 116.87 2dlr s LEU 142 Ca 0.47 1.24 0.09 0.00 -1.03 0.00 0.00 54.13 54.90 2dlr s LEU 142 Cb 0.29 -4.08 0.53 0.00 0.03 0.00 0.00 46.19 42.97 2dlr s LEU 142 CO 0.25 -0.31 0.98 -0.81 0.23 0.00 0.00 176.35 176.69 2dlr n PRO 143 N -0.82 0.49 -1.97 1.29 -0.04 -1.26 -4.77 135.00 127.92 2dlr n PRO 143 Ca 0.03 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.07 2dlr n PRO 143 Cb 0.54 -1.29 -0.03 0.00 -0.04 0.00 0.00 33.50 32.68 2dlr n PRO 143 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dlr s SER 144 N -1.79 6.44 0.00 3.54 1.04 -1.26 -4.97 113.70 116.69 2dlr s SER 144 Ca 0.13 2.04 0.00 0.00 0.48 0.00 0.00 55.95 58.60 2dlr s SER 144 Cb 0.06 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.65 2dlr s SER 144 CO 0.10 -1.15 0.00 0.61 0.98 0.00 0.00 173.24 173.79 2dlr n GLY 145 N 4.51 5.95 3.57 7.32 0.00 -1.26 -5.03 105.19 120.23 2dlr n GLY 145 Ca 0.19 -2.11 -0.27 0.00 0.00 0.00 0.00 46.02 43.83 2dlr n GLY 145 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dlr s PRO 146 N -0.37 2.54 0.17 1.61 0.04 -1.26 -4.83 135.00 132.91 2dlr s PRO 146 Ca 0.00 -0.55 -0.21 0.00 0.04 0.00 0.00 61.00 60.29 2dlr s PRO 146 Cb 0.00 -5.12 0.10 0.00 0.04 0.00 0.00 34.50 29.52 2dlr s PRO 146 CO 0.00 -3.55 1.61 0.77 0.04 0.00 0.00 177.00 175.87 2dlr h SER 147 N 10.83 -0.91 -6.02 6.66 0.02 -2.01 -3.45 113.55 118.68 2dlr h SER 147 Ca 0.13 0.18 -0.42 0.00 -0.84 0.00 0.00 61.79 60.84 2dlr h SER 147 Cb 0.99 0.46 0.07 0.00 0.14 0.00 0.00 62.40 64.05 2dlr h SER 147 CO 1.21 -0.28 -0.73 -0.24 -1.14 0.00 0.00 176.83 175.65 2dlr n SER 148 N -5.41 -4.99 0.00 3.07 2.88 -1.26 -5.32 113.62 102.59 2dlr n SER 148 Ca 0.02 -0.66 0.00 0.00 -1.33 0.00 0.00 58.87 56.91 2dlr n SER 148 Cb 0.32 -4.55 0.00 0.00 -0.75 0.00 0.00 64.21 59.24 2dlr n SER 148 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42