#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 5.70 0.89 1.61 0.01 -1.26 -5.06 113.70 115.59 2dlr s SER 2 Ca 0.00 0.04 -0.14 0.00 1.31 0.00 0.00 55.95 57.16 2dlr s SER 2 Cb 0.00 -1.58 0.15 0.00 0.21 0.00 0.00 66.02 64.80 2dlr s SER 2 CO 0.00 0.17 1.26 -0.94 0.41 0.00 0.00 173.24 174.14 2dlr s SER 3 N -2.43 3.73 0.00 2.44 1.04 -1.26 -4.93 113.70 112.29 2dlr s SER 3 Ca 0.30 0.48 0.00 0.00 0.48 0.00 0.00 55.95 57.21 2dlr s SER 3 Cb -0.12 -0.72 0.00 0.00 0.10 0.00 0.00 66.02 65.28 2dlr s SER 3 CO 0.23 -2.36 0.00 0.61 0.98 0.00 0.00 173.24 172.70 2dlr n GLY 4 N -3.56 1.05 3.12 7.32 0.00 -1.26 -5.16 105.19 106.69 2dlr n GLY 4 Ca 0.12 0.40 -0.13 0.00 0.00 0.00 0.00 46.02 46.42 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 2.00 -0.27 0.01 1.61 1.04 -1.26 -5.07 113.70 111.76 2dlr s SER 5 Ca 0.00 0.53 -0.25 0.00 0.48 0.00 0.00 55.95 56.71 2dlr s SER 5 Cb 0.00 0.49 -0.17 0.00 0.10 0.00 0.00 66.02 66.45 2dlr s SER 5 CO 0.00 -0.12 1.25 0.77 0.98 0.00 0.00 173.24 176.12 2dlr h SER 6 N 6.25 -0.31 0.00 7.02 4.64 -2.04 -3.48 113.55 125.63 2dlr h SER 6 Ca -0.31 -0.19 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 2dlr h SER 6 Cb 1.18 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2dlr h SER 6 CO 0.35 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.98 2dlr n GLY 7 N -0.28 0.65 3.32 -0.77 0.00 -1.26 -5.10 105.19 101.75 2dlr n GLY 7 Ca -0.09 -0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 2dlr n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dlr s SER 8 N 0.00 5.59 0.73 1.61 0.15 -1.26 -5.08 113.70 115.43 2dlr s SER 8 Ca 0.00 -1.16 -0.14 0.00 0.70 0.00 0.00 55.95 55.35 2dlr s SER 8 Cb 0.00 -1.97 0.04 0.00 -1.71 0.00 0.00 66.02 62.38 2dlr s SER 8 CO 0.00 -0.40 1.15 -0.22 1.20 0.00 0.00 173.24 174.97 2dlr s LEU 9 N 1.48 3.26 0.09 3.45 0.20 -1.26 -4.91 118.68 121.00 2dlr s LEU 9 Ca 0.01 2.16 -0.31 0.00 0.69 0.00 0.00 54.13 56.68 2dlr s LEU 9 Cb -0.20 -4.57 -0.10 0.00 -0.43 0.00 0.00 46.19 40.89 2dlr s LEU 9 CO 0.04 -2.11 1.87 0.29 -0.29 0.00 0.00 176.35 176.16 2dlr n LYS 10 N -2.86 2.79 0.15 1.98 4.01 -1.26 -4.90 118.16 118.07 2dlr n LYS 10 Ca 0.12 1.02 -0.14 0.00 -0.51 0.00 0.00 58.31 58.79 2dlr n LYS 10 Cb 0.51 -2.92 -0.07 0.00 -0.51 0.00 0.00 35.03 32.03 2dlr n LYS 10 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 2dlr h SER 11 N 9.07 -0.31 -1.22 4.39 4.64 -2.01 -2.17 113.55 125.94 2dlr h SER 11 Ca -0.47 0.02 0.35 0.00 -0.47 0.00 0.00 61.79 61.21 2dlr h SER 11 Cb 1.23 0.09 -0.07 0.00 -0.31 0.00 0.00 62.40 63.33 2dlr h SER 11 CO 0.95 -0.21 0.84 0.71 -0.87 0.00 0.00 176.83 178.25 2dlr h THR 12 N -0.34 0.38 -0.14 2.95 1.35 -1.96 0.24 112.91 115.38 2dlr h THR 12 Ca -0.03 -0.04 -0.05 0.00 -0.55 0.00 0.00 66.41 65.74 2dlr h THR 12 Cb 0.27 0.23 -0.00 0.00 -1.73 0.00 0.00 68.15 66.92 2dlr h THR 12 CO 0.04 0.02 -0.11 0.00 -0.25 0.00 0.00 175.52 175.22 2dlr h ALA 13 N 1.47 0.20 -0.88 6.62 0.00 -1.78 -2.54 119.26 122.34 2dlr h ALA 13 Ca 0.63 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 55.30 2dlr h ALA 13 Cb 2.19 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 19.87 2dlr h ALA 13 CO -0.15 0.05 0.56 0.87 0.00 0.00 0.00 179.25 180.58 2dlr h LYS 14 N -0.04 1.00 0.71 0.00 1.57 -0.35 -1.46 116.57 118.00 2dlr h LYS 14 Ca 0.03 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 2dlr h LYS 14 Cb 0.62 -0.23 0.01 0.00 0.08 0.00 0.00 32.23 32.71 2dlr h LYS 14 CO 0.03 0.66 -0.34 -1.49 -0.57 0.00 0.00 179.45 177.74 2dlr h TRP 15 N 1.03 -0.88 -1.08 -1.35 6.55 -1.36 -2.89 115.95 115.98 2dlr h TRP 15 Ca 0.38 -0.02 0.29 0.00 0.95 0.00 0.00 58.89 60.49 2dlr h TRP 15 Cb 0.13 0.29 -0.07 0.00 -0.86 0.00 0.00 29.16 28.65 2dlr h TRP 15 CO -0.02 -0.55 0.73 0.00 -1.05 0.00 0.00 178.44 177.55 2dlr h ALA 16 N -1.47 2.60 -0.33 1.49 0.00 -1.34 0.13 119.26 120.34 2dlr h ALA 16 Ca -0.10 0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.89 2dlr h ALA 16 Cb 0.73 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 2dlr h ALA 16 CO 0.16 -0.97 -0.02 0.00 0.00 0.00 0.00 179.25 178.42 2dlr h ALA 17 N 1.54 0.28 -2.57 0.00 0.00 -1.05 -3.46 119.26 114.00 2dlr h ALA 17 Ca 0.57 0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.68 2dlr h ALA 17 Cb 1.80 0.17 -0.11 0.00 0.00 0.00 0.00 17.79 19.65 2dlr h ALA 17 CO -0.17 -0.42 0.39 -1.12 0.00 0.00 0.00 179.25 177.93 2dlr s SER 18 N -5.24 -0.34 0.10 0.00 0.01 0.03 -5.06 113.70 103.21 2dlr s SER 18 Ca -0.13 -0.21 -0.18 0.00 1.31 0.00 0.00 55.95 56.73 2dlr s SER 18 Cb 0.12 0.52 -0.06 0.00 0.21 0.00 0.00 66.02 66.81 2dlr s SER 18 CO 0.70 -0.89 1.59 0.25 0.41 0.00 0.00 173.24 175.30 2dlr h LEU 19 N 2.00 0.45 -0.19 2.44 5.85 -1.90 -3.24 115.31 120.72 2dlr h LEU 19 Ca -0.25 -0.24 0.02 0.00 0.84 0.00 0.00 57.88 58.25 2dlr h LEU 19 Cb 1.25 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 42.13 2dlr h LEU 19 CO 0.30 0.58 -0.26 -0.33 -0.34 0.00 0.00 178.44 178.38 2dlr h GLU 20 N 0.31 -0.17 -0.92 1.25 5.08 -1.94 0.05 114.58 118.24 2dlr h GLU 20 Ca 0.09 0.01 0.28 0.00 -1.00 0.00 0.00 59.36 58.74 2dlr h GLU 20 Cb 0.31 0.04 -0.17 0.00 0.50 0.00 0.00 28.75 29.42 2dlr h GLU 20 CO 0.00 -0.12 0.11 0.09 -1.00 0.00 0.00 179.01 178.09 2dlr n ASN 21 N -3.94 -0.03 -0.16 1.42 3.02 -1.23 0.15 115.26 114.49 2dlr n ASN 21 Ca -0.02 1.56 -0.08 0.00 -0.03 0.00 0.00 54.58 56.01 2dlr n ASN 21 Cb 0.16 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 38.73 2dlr n ASN 21 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 2dlr h LEU 22 N 0.00 0.63 -0.47 3.41 5.85 -1.07 0.21 115.31 123.86 2dlr h LEU 22 Ca 0.60 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 59.13 2dlr h LEU 22 Cb 1.33 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.17 2dlr h LEU 22 CO -0.84 0.61 0.14 -0.07 -0.34 0.00 0.00 178.44 177.94 2dlr h LEU 23 N 0.60 0.69 0.40 2.25 3.38 0.27 -2.48 115.31 120.43 2dlr h LEU 23 Ca 0.16 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2dlr h LEU 23 Cb 0.17 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2dlr h LEU 23 CO -0.01 0.73 -0.19 -0.33 0.09 0.00 0.00 178.44 178.72 2dlr h GLU 24 N 0.63 -0.52 -6.64 1.13 5.08 -0.50 -3.43 114.58 110.33 2dlr h GLU 24 Ca 0.15 0.04 -0.58 0.00 -1.00 0.00 0.00 59.36 57.96 2dlr h GLU 24 Cb 0.29 0.12 0.11 0.00 0.50 0.00 0.00 28.75 29.77 2dlr h GLU 24 CO -0.00 -0.21 0.36 -3.47 -1.00 0.00 0.00 179.01 174.70 2dlr n ASP 25 N -5.19 2.20 -0.09 1.42 -0.08 0.72 -4.91 116.55 110.62 2dlr n ASP 25 Ca -0.10 1.20 -0.13 0.00 -1.51 0.00 0.00 54.79 54.25 2dlr n ASP 25 Cb 0.29 -1.41 -0.04 0.00 2.34 0.00 0.00 41.12 42.29 2dlr n ASP 25 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2dlr h PRO 26 N 2.37 0.68 -0.39 -0.67 0.13 -1.86 -2.76 132.00 129.49 2dlr h PRO 26 Ca -0.44 -0.36 -0.11 0.00 -0.87 0.00 0.00 66.00 64.22 2dlr h PRO 26 Cb 1.30 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.44 2dlr h PRO 26 CO 0.62 0.97 -0.20 0.93 -0.23 0.00 0.00 178.00 180.09 2dlr h GLU 27 N 0.41 0.82 -0.88 0.86 5.08 -1.91 -2.64 114.58 116.33 2dlr h GLU 27 Ca 0.04 -0.36 0.01 0.00 -1.00 0.00 0.00 59.36 58.05 2dlr h GLU 27 Cb 0.85 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.03 2dlr h GLU 27 CO 0.07 1.00 0.58 0.78 -1.00 0.00 0.00 179.01 180.44 2dlr h GLY 28 N 0.63 1.24 1.01 -3.84 0.00 -1.73 -2.63 103.07 97.75 2dlr h GLY 28 Ca 0.09 -0.46 -0.08 0.00 0.00 0.00 0.00 47.33 46.88 2dlr h GLY 28 CO 0.06 0.44 0.00 -2.08 0.00 0.00 0.00 176.54 174.96 2dlr h VAL 29 N 1.18 1.26 0.01 4.60 2.07 -1.14 -2.38 116.25 121.85 2dlr h VAL 29 Ca 0.33 -1.08 0.00 0.00 0.82 0.00 0.00 66.70 66.77 2dlr h VAL 29 Cb -0.11 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 2dlr h VAL 29 CO -0.08 0.38 -0.11 0.50 0.02 0.00 0.00 177.57 178.28 2dlr h LYS 30 N 0.75 -0.13 -0.41 1.57 1.63 -1.10 -1.95 116.57 116.93 2dlr h LYS 30 Ca 0.14 0.01 0.08 0.00 -0.85 0.00 0.00 60.65 60.04 2dlr h LYS 30 Cb 0.51 0.03 -0.08 0.00 -0.60 0.00 0.00 32.23 32.10 2dlr h LYS 30 CO 0.03 -0.09 -0.11 0.00 -3.45 0.00 0.00 179.45 175.83 2dlr h ARG 31 N -0.14 -0.01 -0.97 1.90 -0.00 -1.59 -1.04 114.38 112.53 2dlr h ARG 31 Ca 0.00 0.00 0.29 0.00 -0.50 0.00 0.00 59.98 59.78 2dlr h ARG 31 Cb 0.15 0.00 -0.17 0.00 0.00 0.00 0.00 29.97 29.95 2dlr h ARG 31 CO -0.07 -0.00 0.19 0.35 0.00 0.00 0.00 179.97 180.44 2dlr h PHE 32 N -0.01 0.24 -0.06 3.04 3.57 -1.12 1.20 116.94 123.81 2dlr h PHE 32 Ca 0.20 0.06 -0.17 0.00 3.53 0.00 0.00 57.97 61.59 2dlr h PHE 32 Cb 0.31 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 2dlr h PHE 32 CO -0.37 -0.39 -0.71 0.00 -2.23 0.00 0.00 178.31 174.61 2dlr h ARG 33 N 0.06 0.30 -0.30 1.11 3.08 -0.43 -0.90 114.38 117.29 2dlr h ARG 33 Ca 0.64 -0.24 -0.05 0.00 0.07 0.00 0.00 59.98 60.40 2dlr h ARG 33 Cb 1.43 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.52 2dlr h ARG 33 CO -0.83 0.89 -0.01 0.93 -1.07 0.00 0.00 179.97 179.89 2dlr h GLU 34 N 0.20 0.53 -0.14 0.04 4.39 0.20 -0.45 114.58 119.35 2dlr h GLU 34 Ca -0.02 -0.17 -0.22 0.00 0.34 0.00 0.00 59.36 59.28 2dlr h GLU 34 Cb 1.27 -0.05 0.01 0.00 -0.10 0.00 0.00 28.75 29.88 2dlr h GLU 34 CO 0.11 0.68 -0.79 0.35 -1.16 0.00 0.00 179.01 178.21 2dlr h PHE 35 N 0.32 1.06 0.19 4.33 3.57 -0.54 -3.21 116.94 122.67 2dlr h PHE 35 Ca 0.08 -0.48 -0.01 0.00 3.53 0.00 0.00 57.97 61.10 2dlr h PHE 35 Cb 0.45 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.03 2dlr h PHE 35 CO 0.04 1.31 -0.09 -0.07 -2.23 0.00 0.00 178.31 177.26 2dlr h LEU 36 N 0.51 -0.22 -1.28 0.59 3.38 -1.14 -2.68 115.31 114.46 2dlr h LEU 36 Ca -0.06 -0.08 0.29 0.00 0.09 0.00 0.00 57.88 58.12 2dlr h LEU 36 Cb 1.42 0.06 -0.11 0.00 0.09 0.00 0.00 40.66 42.12 2dlr h LEU 36 CO 0.16 -0.06 0.67 0.50 0.09 0.00 0.00 178.44 179.80 2dlr h LYS 37 N -0.37 0.38 -0.50 1.13 1.63 -1.16 0.14 116.57 117.82 2dlr h LYS 37 Ca -0.03 -0.02 0.09 0.00 -0.85 0.00 0.00 60.65 59.84 2dlr h LYS 37 Cb 0.28 -0.08 -0.07 0.00 -0.60 0.00 0.00 32.23 31.76 2dlr h LYS 37 CO 0.04 0.25 0.07 0.87 -3.45 0.00 0.00 179.45 177.23 2dlr h LYS 38 N 0.39 0.19 -0.53 1.90 1.79 -1.48 0.62 116.57 119.46 2dlr h LYS 38 Ca 0.64 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 59.10 2dlr h LYS 38 Cb 1.59 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 32.20 2dlr h LYS 38 CO -0.36 0.13 0.00 -0.85 -1.08 0.00 0.00 179.45 177.28 2dlr n GLU 39 N -5.15 2.32 -3.48 3.15 0.28 0.34 -4.91 120.64 113.19 2dlr n GLU 39 Ca 0.05 -1.84 -0.25 0.00 -0.16 0.00 0.00 57.16 54.97 2dlr n GLU 39 Cb 0.25 -1.46 0.05 0.00 1.43 0.00 0.00 31.44 31.72 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 0.91 -2.43 -0.73 -1.84 3.72 0.21 -4.87 117.46 112.42 2dlr n PHE 40 Ca 0.17 0.81 0.07 0.00 -0.05 0.00 0.00 57.45 58.46 2dlr n PHE 40 Cb 0.47 -4.53 0.18 0.00 -0.94 0.00 0.00 39.48 34.66 2dlr n PHE 40 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2dlr n SER 41 N -2.79 3.08 0.13 4.37 7.64 -0.53 -4.60 113.62 120.91 2dlr n SER 41 Ca -0.02 -2.71 -0.01 0.00 1.01 0.00 0.00 58.87 57.13 2dlr n SER 41 Cb 0.57 -0.39 0.22 0.00 -1.01 0.00 0.00 64.21 63.60 2dlr n SER 41 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 2dlr h GLU 42 N 1.16 0.12 -0.02 1.43 4.81 -1.89 -2.81 114.58 117.37 2dlr h GLU 42 Ca 0.00 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.17 2dlr h GLU 42 Cb 1.08 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.46 2dlr h GLU 42 CO 0.10 0.59 0.29 1.05 -0.73 0.00 0.00 179.01 180.30 2dlr h GLU 43 N 0.09 0.00 0.77 1.92 4.11 -1.94 -1.86 114.58 117.67 2dlr h GLU 43 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.39 2dlr h GLU 43 Cb 0.91 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.16 2dlr h GLU 43 CO 0.07 0.00 -0.37 -0.91 0.07 0.00 0.00 179.01 177.87 2dlr h ASN 44 N 0.00 -0.88 -0.30 3.06 2.35 -1.86 -3.02 115.58 114.93 2dlr h ASN 44 Ca 0.01 0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 55.74 2dlr h ASN 44 Cb 0.58 0.23 -0.01 0.00 0.05 0.00 0.00 38.32 39.17 2dlr h ASN 44 CO -0.00 -0.55 -0.01 -0.37 -1.65 0.00 0.00 177.43 174.86 2dlr h VAL 45 N -1.21 1.26 -1.21 2.81 -1.51 -1.61 -2.90 116.25 111.89 2dlr h VAL 45 Ca -0.11 -0.96 0.42 0.00 -1.23 0.00 0.00 66.70 64.83 2dlr h VAL 45 Cb 0.80 1.29 -0.14 0.00 -2.13 0.00 0.00 31.29 31.11 2dlr h VAL 45 CO 0.17 0.31 0.75 -0.07 -1.23 0.00 0.00 177.57 177.50 2dlr h LEU 46 N 0.32 0.30 0.13 4.19 3.38 -1.43 1.23 115.31 123.43 2dlr h LEU 46 Ca 0.08 0.17 -0.28 0.00 0.09 0.00 0.00 57.88 57.95 2dlr h LEU 46 Cb 0.45 0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2dlr h LEU 46 CO 0.02 -0.24 -1.28 0.15 0.09 0.00 0.00 178.44 177.18 2dlr h PHE 47 N 0.09 0.51 0.16 1.13 3.57 -1.38 -3.19 116.94 117.84 2dlr h PHE 47 Ca 0.82 -0.37 -0.01 0.00 3.53 0.00 0.00 57.97 61.94 2dlr h PHE 47 Cb 2.40 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 41.12 2dlr h PHE 47 CO -0.01 1.30 -0.08 2.35 -2.23 0.00 0.00 178.31 179.65 2dlr h TRP 48 N 0.08 -0.20 -0.03 0.41 7.01 0.15 -3.12 115.95 120.24 2dlr h TRP 48 Ca -0.15 -0.00 0.04 0.00 2.11 0.00 0.00 58.89 60.88 2dlr h TRP 48 Cb 1.99 0.07 -0.05 0.00 -2.10 0.00 0.00 29.16 29.06 2dlr h TRP 48 CO 0.07 0.08 -0.31 -0.07 -2.79 0.00 0.00 178.44 175.41 2dlr h LEU 49 N -0.48 -0.95 -0.97 0.65 3.38 -0.79 -1.71 115.31 114.44 2dlr h LEU 49 Ca -0.02 0.13 0.30 0.00 0.09 0.00 0.00 57.88 58.37 2dlr h LEU 49 Cb 0.37 0.39 -0.17 0.00 0.09 0.00 0.00 40.66 41.34 2dlr h LEU 49 CO 0.04 -0.37 0.19 0.00 0.09 0.00 0.00 178.44 178.38 2dlr h ALA 50 N 0.31 1.41 -0.16 1.53 0.00 -1.58 -0.33 119.26 120.45 2dlr h ALA 50 Ca 0.07 0.30 0.03 0.00 0.00 0.00 0.00 54.91 55.31 2dlr h ALA 50 Cb 0.55 0.48 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 2dlr h ALA 50 CO -0.28 -0.63 -0.40 0.00 0.00 0.00 0.00 179.25 177.93 2dlr h GLU 52 N -0.38 -0.47 -0.92 0.00 4.39 -1.10 -1.30 114.58 114.79 2dlr h GLU 52 Ca 0.03 0.03 0.24 0.00 0.34 0.00 0.00 59.36 60.01 2dlr h GLU 52 Cb 0.48 0.11 -0.13 0.00 -0.10 0.00 0.00 28.75 29.10 2dlr h GLU 52 CO -0.35 -0.31 0.40 -0.44 -1.16 0.00 0.00 179.01 177.14 2dlr h ASP 53 N -0.49 0.31 0.44 1.42 3.32 -0.98 0.15 116.42 120.58 2dlr h ASP 53 Ca 0.07 0.17 -0.01 0.00 0.02 0.00 0.00 57.03 57.28 2dlr h ASP 53 Cb 0.59 0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.28 2dlr h ASP 53 CO -0.31 -0.05 -0.37 0.15 -1.72 0.00 0.00 179.24 176.94 2dlr h PHE 54 N 0.35 -1.00 0.00 4.55 3.57 0.36 -1.97 116.94 122.80 2dlr h PHE 54 Ca 0.59 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 62.08 2dlr h PHE 54 Cb 1.19 0.38 -0.00 0.00 2.79 0.00 0.00 35.95 40.31 2dlr h PHE 54 CO -0.14 -0.53 -0.08 1.57 -2.23 0.00 0.00 178.31 176.90 2dlr h LYS 55 N -0.81 0.00 -0.32 1.11 2.10 -0.79 -1.73 116.57 116.12 2dlr h LYS 55 Ca -0.04 0.00 -0.04 0.00 -2.00 0.00 0.00 60.65 58.57 2dlr h LYS 55 Cb 0.71 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.02 2dlr h LYS 55 CO -0.02 0.08 0.03 0.87 -2.00 0.00 0.00 179.45 178.41 2dlr h LYS 56 N 0.00 0.48 -6.41 0.07 1.57 -0.06 -3.42 116.57 108.80 2dlr h LYS 56 Ca -0.00 -0.09 -0.54 0.00 -1.87 0.00 0.00 60.65 58.15 2dlr h LYS 56 Cb 0.14 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.38 2dlr h LYS 56 CO 0.01 0.48 0.76 -1.64 -0.57 0.00 0.00 179.45 178.49 2dlr s MET 57 N -5.04 4.32 -0.17 3.15 -1.94 -0.65 -4.94 119.30 114.03 2dlr s MET 57 Ca -0.07 1.92 -0.25 0.00 -1.71 0.00 0.00 55.69 55.57 2dlr s MET 57 Cb 0.16 -3.48 -0.22 0.00 2.01 0.00 0.00 34.83 33.29 2dlr s MET 57 CO 0.75 -0.49 0.49 0.37 -0.01 0.00 0.00 175.02 176.14 2dlr h GLN 58 N 7.45 0.00 -6.39 2.03 4.15 -1.85 -3.46 115.11 117.03 2dlr h GLN 58 Ca -0.39 0.00 -0.63 0.00 0.77 0.00 0.00 58.65 58.41 2dlr h GLN 58 Cb 1.19 0.00 0.05 0.00 0.21 0.00 0.00 27.48 28.93 2dlr h GLN 58 CO 0.88 1.00 0.73 -0.25 -1.93 0.00 0.00 178.83 179.26 2dlr n ASP 59 N -4.52 2.65 0.09 -0.69 8.00 -1.26 -4.90 116.55 115.91 2dlr n ASP 59 Ca -0.21 1.08 -0.12 0.00 0.71 0.00 0.00 54.79 56.25 2dlr n ASP 59 Cb 0.58 -1.33 -0.08 0.00 -0.02 0.00 0.00 41.12 40.27 2dlr n ASP 59 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2dlr h LYS 60 N 5.96 -0.28 -0.96 -1.24 3.11 -2.00 -3.14 116.57 118.02 2dlr h LYS 60 Ca -0.46 0.02 0.12 0.00 -2.81 0.00 0.00 60.65 57.52 2dlr h LYS 60 Cb 1.28 0.06 -0.14 0.00 -1.00 0.00 0.00 32.23 32.44 2dlr h LYS 60 CO 0.87 0.10 -0.47 1.15 -2.81 0.00 0.00 179.45 178.29 2dlr h THR 61 N -0.81 0.01 -0.96 1.00 2.02 -2.00 0.92 112.91 113.08 2dlr h THR 61 Ca -0.03 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.32 2dlr h THR 61 Cb 0.51 0.01 -0.09 0.00 -1.74 0.00 0.00 68.15 66.84 2dlr h THR 61 CO 0.05 0.00 0.61 1.56 0.37 0.00 0.00 175.52 178.11 2dlr h GLN 62 N -0.02 0.71 -0.30 6.66 4.20 -1.97 -0.84 115.11 123.55 2dlr h GLN 62 Ca 0.26 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.82 2dlr h GLN 62 Cb 0.52 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2dlr h GLN 62 CO -0.94 0.47 -0.22 0.52 -0.67 0.00 0.00 178.83 177.99 2dlr h MET 63 N 0.74 0.68 -1.08 1.46 2.86 0.75 -2.81 114.93 117.53 2dlr h MET 63 Ca 0.52 -0.33 0.38 0.00 -2.06 0.00 0.00 59.70 58.21 2dlr h MET 63 Cb 0.83 -0.00 -0.15 0.00 0.06 0.00 0.00 31.60 32.33 2dlr h MET 63 CO -0.28 0.93 0.63 1.96 1.06 0.00 0.00 176.91 181.21 2dlr h GLN 64 N 0.43 0.15 0.00 1.72 4.20 0.83 0.21 115.11 122.66 2dlr h GLN 64 Ca 0.06 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.76 2dlr h GLN 64 Cb 0.77 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.51 2dlr h GLN 64 CO 0.06 0.10 -0.02 0.93 -0.67 0.00 0.00 178.83 179.23 2dlr h GLU 65 N 0.16 0.00 -1.53 1.46 5.08 -1.50 -3.34 114.58 114.91 2dlr h GLU 65 Ca 0.79 0.00 0.50 0.00 -1.00 0.00 0.00 59.36 59.65 2dlr h GLU 65 Cb 2.09 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 31.21 2dlr h GLU 65 CO -0.61 0.00 1.02 -0.22 -1.00 0.00 0.00 179.01 178.20 2dlr h LYS 66 N -0.52 0.00 0.03 2.33 1.63 -1.15 -0.35 116.57 118.54 2dlr h LYS 66 Ca 0.00 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 2dlr h LYS 66 Cb 0.02 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.64 2dlr h LYS 66 CO 0.00 0.00 -0.13 0.00 -3.45 0.00 0.00 179.45 175.87 2dlr h ALA 67 N 1.46 -0.66 -0.31 5.00 0.00 -0.73 -1.54 119.26 122.48 2dlr h ALA 67 Ca 0.90 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.75 2dlr h ALA 67 Cb 3.07 0.56 -0.02 0.00 0.00 0.00 0.00 17.79 21.41 2dlr h ALA 67 CO -0.36 -0.69 0.04 1.57 0.00 0.00 0.00 179.25 179.82 2dlr h LYS 68 N -0.18 0.46 -0.12 0.00 2.10 -1.25 -2.65 116.57 114.92 2dlr h LYS 68 Ca -0.00 -0.08 0.04 0.00 -2.00 0.00 0.00 60.65 58.61 2dlr h LYS 68 Cb 0.18 -0.08 -0.07 0.00 -0.90 0.00 0.00 32.23 31.37 2dlr h LYS 68 CO -0.07 0.45 -0.47 0.93 -2.00 0.00 0.00 179.45 178.29 2dlr h GLU 69 N 0.45 -0.52 -0.15 0.07 5.08 -0.79 0.71 114.58 119.42 2dlr h GLU 69 Ca 0.10 0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 2dlr h GLU 69 Cb 0.23 0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 2dlr h GLU 69 CO 0.00 -0.35 0.05 0.82 -1.00 0.00 0.00 179.01 178.54 2dlr h ILE 70 N -0.54 1.16 -0.40 3.13 2.04 -1.19 -2.57 117.51 119.15 2dlr h ILE 70 Ca 0.06 -0.50 0.08 0.00 1.00 0.00 0.00 64.86 65.51 2dlr h ILE 70 Cb 0.66 1.22 -0.02 0.00 -0.74 0.00 0.00 36.82 37.94 2dlr h ILE 70 CO -0.41 0.15 0.28 0.22 0.00 0.00 0.00 178.15 178.39 2dlr h TYR 71 N 0.07 0.17 -0.01 1.37 5.03 -1.09 0.40 116.97 122.92 2dlr h TYR 71 Ca 0.05 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.36 2dlr h TYR 71 Cb 0.19 -0.05 0.00 0.00 1.55 0.00 0.00 36.73 38.41 2dlr h TYR 71 CO -0.01 0.08 0.00 -1.33 -1.32 0.00 0.00 178.16 175.59 2dlr n MET 72 N -4.46 1.20 0.00 1.82 2.81 0.24 0.26 117.12 118.99 2dlr n MET 72 Ca 0.06 -0.29 0.00 0.00 -1.81 0.00 0.00 57.70 55.65 2dlr n MET 72 Cb 0.36 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.40 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 -0.62 0.00 -0.07 2.03 -1.04 0.14 -4.69 114.28 110.03 2dlr n THR 73 Ca 0.21 0.38 -0.07 0.00 -2.04 0.00 0.00 64.05 62.54 2dlr n THR 73 Cb 0.18 -1.32 -0.02 0.00 -1.82 0.00 0.00 70.33 67.34 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 -2.11 0.15 -0.35 -1.42 3.01 -1.12 -4.45 117.46 111.17 2dlr n PHE 74 Ca 0.00 0.07 0.32 0.00 1.01 0.00 0.00 57.45 58.85 2dlr n PHE 74 Cb 0.00 -0.46 0.57 0.00 -0.01 0.00 0.00 39.48 39.57 2dlr n PHE 74 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 2dlr n LEU 75 N -4.13 0.26 -4.72 4.37 4.77 -1.23 -4.41 117.00 111.91 2dlr n LEU 75 Ca -0.10 1.38 -0.34 0.00 -0.03 0.00 0.00 56.01 56.92 2dlr n LEU 75 Cb 0.39 -0.68 0.10 0.00 -2.33 0.00 0.00 43.42 40.90 2dlr n LEU 75 CO 0.16 -1.53 0.79 -0.55 -1.33 0.00 0.00 177.39 174.92 2dlr s SER 76 N -4.45 4.13 0.57 -1.43 0.15 0.14 -4.84 113.70 107.97 2dlr s SER 76 Ca -0.07 2.33 -0.14 0.00 0.70 0.00 0.00 55.95 58.76 2dlr s SER 76 Cb 0.29 -2.59 -0.05 0.00 -1.71 0.00 0.00 66.02 61.96 2dlr s SER 76 CO 0.72 -2.31 1.02 -0.44 1.20 0.00 0.00 173.24 173.43 2dlr s SER 77 N -2.10 6.28 -1.31 5.45 0.01 -1.26 -3.70 113.70 117.06 2dlr s SER 77 Ca 0.74 1.57 -0.03 0.00 1.31 0.00 0.00 55.95 59.53 2dlr s SER 77 Cb -0.28 -2.50 0.02 0.00 0.21 0.00 0.00 66.02 63.47 2dlr s SER 77 CO 0.46 -0.83 0.25 0.29 0.41 0.00 0.00 173.24 173.83 2dlr n LYS 78 N -2.12 -3.00 -2.33 12.44 4.76 -1.26 -4.90 118.16 121.75 2dlr n LYS 78 Ca 0.07 0.68 -0.41 0.00 -2.87 0.00 0.00 58.31 55.77 2dlr n LYS 78 Cb 0.54 -5.37 -0.03 0.00 -1.84 0.00 0.00 35.03 28.32 2dlr n LYS 78 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dlr s ALA 79 N -2.87 3.46 0.60 7.82 0.00 -1.24 -4.87 121.76 124.67 2dlr s ALA 79 Ca 0.17 0.98 0.28 0.00 0.00 0.00 0.00 51.96 53.39 2dlr s ALA 79 Cb -0.08 -3.45 1.16 0.00 0.00 0.00 0.00 23.12 20.75 2dlr s ALA 79 CO 0.21 -0.45 1.54 0.77 0.00 0.00 0.00 175.76 177.83 2dlr h SER 80 N 5.81 0.00 -1.85 0.00 0.02 -1.91 -3.32 113.55 112.30 2dlr h SER 80 Ca -0.44 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.37 2dlr h SER 80 Cb 1.21 0.00 -0.29 0.00 0.14 0.00 0.00 62.40 63.46 2dlr h SER 80 CO 0.78 0.00 -0.47 -0.44 -1.14 0.00 0.00 176.83 175.56 2dlr s SER 81 N -4.13 0.17 0.10 3.07 0.01 -1.26 -5.16 113.70 106.50 2dlr s SER 81 Ca -0.03 0.24 0.05 0.00 1.31 0.00 0.00 55.95 57.52 2dlr s SER 81 Cb 0.15 1.16 -0.04 0.00 0.21 0.00 0.00 66.02 67.50 2dlr s SER 81 CO 0.51 -0.30 -0.02 -1.10 0.41 0.00 0.00 173.24 172.74 2dlr s GLN 82 N 2.56 2.47 0.34 12.44 -0.21 -1.25 -4.46 119.66 131.55 2dlr s GLN 82 Ca 0.13 -0.88 0.06 0.00 0.02 0.00 0.00 55.36 54.69 2dlr s GLN 82 Cb -0.15 -2.49 -0.01 0.00 1.00 0.00 0.00 33.01 31.35 2dlr s GLN 82 CO -0.16 0.53 0.49 0.14 -2.12 0.00 0.00 175.29 174.16 2dlr s VAL 83 N -1.32 4.10 -0.22 1.09 -7.23 -1.26 -4.96 120.40 110.59 2dlr s VAL 83 Ca 0.25 -0.95 -0.12 0.00 -1.81 0.00 0.00 61.98 59.35 2dlr s VAL 83 Cb -0.11 -3.43 -0.05 0.00 0.56 0.00 0.00 36.38 33.35 2dlr s VAL 83 CO 0.18 -0.18 0.21 0.20 -0.31 0.00 0.00 175.10 175.20 2dlr s ASN 84 N -4.17 6.22 0.30 4.85 0.01 -1.26 -5.05 114.94 115.84 2dlr s ASN 84 Ca 0.45 0.24 -0.11 0.00 -0.71 0.00 0.00 52.86 52.72 2dlr s ASN 84 Cb -0.10 -2.13 0.01 0.00 0.41 0.00 0.00 41.25 39.44 2dlr s ASN 84 CO 0.32 0.06 0.56 0.68 -1.51 0.00 0.00 177.10 177.20 2dlr s VAL 85 N 0.96 0.00 0.09 1.60 -7.23 -1.26 -4.78 120.40 109.78 2dlr s VAL 85 Ca 0.11 -1.34 -0.29 0.00 -1.81 0.00 0.00 61.98 58.64 2dlr s VAL 85 Cb -0.13 -2.42 -0.15 0.00 0.56 0.00 0.00 36.38 34.24 2dlr s VAL 85 CO 0.04 0.00 1.65 -0.08 -0.31 0.00 0.00 175.10 176.41 2dlr h GLU 86 N 2.14 -0.55 -0.66 4.82 4.22 -1.99 -3.43 114.58 119.14 2dlr h GLU 86 Ca -0.27 0.04 -0.03 0.00 0.08 0.00 0.00 59.36 59.18 2dlr h GLU 86 Cb 1.25 0.13 -0.17 0.00 0.50 0.00 0.00 28.75 30.45 2dlr h GLU 86 CO 0.36 -0.37 -0.32 0.20 -2.18 0.00 0.00 179.01 176.70 2dlr s GLY 87 N -2.20 -1.46 0.09 1.92 0.00 -1.26 -5.02 107.32 99.39 2dlr s GLY 87 Ca -0.16 0.36 -0.13 0.00 0.00 0.00 0.00 44.72 44.80 2dlr s GLY 87 CO 0.64 3.94 1.26 0.06 0.00 0.00 0.00 173.10 178.99 2dlr h GLN 88 N 5.56 0.73 -1.28 2.90 -0.00 -1.97 -3.18 115.11 117.87 2dlr h GLN 88 Ca 0.02 -0.68 0.37 0.00 -0.00 0.00 0.00 58.65 58.36 2dlr h GLN 88 Cb 1.17 0.17 -0.05 0.00 -0.00 0.00 0.00 27.48 28.77 2dlr h GLN 88 CO -0.00 1.28 1.16 0.77 -0.00 0.00 0.00 178.83 182.04 2dlr h SER 89 N 0.46 0.00 -0.25 0.06 0.02 -1.95 0.22 113.55 112.11 2dlr h SER 89 Ca -0.09 0.00 0.07 0.00 -0.84 0.00 0.00 61.79 60.93 2dlr h SER 89 Cb 1.54 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.07 2dlr h SER 89 CO 0.18 0.00 0.80 -0.09 -1.14 0.00 0.00 176.83 176.58 2dlr h ARG 90 N 0.00 0.00 -7.32 3.45 9.65 -1.98 -3.39 114.38 114.79 2dlr h ARG 90 Ca 0.61 0.00 -0.50 0.00 -1.10 0.00 0.00 59.98 58.99 2dlr h ARG 90 Cb 2.93 0.00 0.06 0.00 -1.39 0.00 0.00 29.97 31.57 2dlr h ARG 90 CO -0.01 0.00 0.36 -0.51 2.80 0.00 0.00 179.97 182.62 2dlr s LEU 91 N -5.77 3.20 0.01 3.80 1.43 0.78 -5.09 118.68 117.04 2dlr s LEU 91 Ca -0.02 1.24 -0.20 0.00 -1.03 0.00 0.00 54.13 54.12 2dlr s LEU 91 Cb 0.07 -4.21 0.04 0.00 0.03 0.00 0.00 46.19 42.12 2dlr s LEU 91 CO 0.23 -0.96 0.44 0.20 0.23 0.00 0.00 176.35 176.49 2dlr s ASN 92 N -4.22 -0.34 0.60 2.29 0.01 -1.26 -5.00 114.94 107.01 2dlr s ASN 92 Ca 0.55 0.18 0.31 0.00 -0.71 0.00 0.00 52.86 53.19 2dlr s ASN 92 Cb -0.11 0.42 1.08 0.00 0.41 0.00 0.00 41.25 43.05 2dlr s ASN 92 CO 0.52 -0.60 1.36 -0.33 -1.51 0.00 0.00 177.10 176.53 2dlr h GLU 93 N 3.23 0.00 -0.32 -0.60 5.08 -1.98 0.94 114.58 120.93 2dlr h GLU 93 Ca -0.30 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 2dlr h GLU 93 Cb 1.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 2dlr h GLU 93 CO 0.41 0.00 0.16 0.87 -1.00 0.00 0.00 179.01 179.46 2dlr h LYS 94 N 0.00 0.45 -0.14 2.33 6.56 -2.02 -2.07 116.57 121.68 2dlr h LYS 94 Ca 0.58 -0.06 0.04 0.00 -1.06 0.00 0.00 60.65 60.15 2dlr h LYS 94 Cb 3.09 -0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 34.66 2dlr h LYS 94 CO -0.01 0.40 0.70 0.97 -2.06 0.00 0.00 179.45 179.45 2dlr h ILE 95 N 0.38 0.03 -0.09 1.86 2.10 0.54 0.92 117.51 123.25 2dlr h ILE 95 Ca 0.11 0.00 -0.21 0.00 1.08 0.00 0.00 64.86 65.84 2dlr h ILE 95 Cb 0.09 0.33 0.00 0.00 -1.09 0.00 0.00 36.82 36.15 2dlr h ILE 95 CO -0.02 0.00 -0.79 -0.07 -1.08 0.00 0.00 178.15 176.19 2dlr h LEU 96 N 0.00 0.70 -0.70 2.19 3.38 -1.49 -3.32 115.31 116.07 2dlr h LEU 96 Ca 0.07 -0.48 0.07 0.00 0.09 0.00 0.00 57.88 57.63 2dlr h LEU 96 Cb 1.47 -0.21 -0.09 0.00 0.09 0.00 0.00 40.66 41.92 2dlr h LEU 96 CO -0.00 1.25 -0.38 -0.62 0.09 0.00 0.00 178.44 178.78 2dlr n GLU 97 N -3.87 -0.28 -3.66 1.13 1.02 0.32 -3.25 120.64 112.05 2dlr n GLU 97 Ca -0.06 1.06 -0.39 0.00 -0.02 0.00 0.00 57.16 57.75 2dlr n GLU 97 Cb 0.75 -1.57 -0.10 0.00 -0.02 0.00 0.00 31.44 30.50 2dlr n GLU 97 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2dlr s GLU 98 N -5.42 2.35 0.05 3.49 2.02 -1.25 -5.07 118.70 114.87 2dlr s GLU 98 Ca -0.09 -1.67 -0.31 0.00 0.02 0.00 0.00 54.97 52.93 2dlr s GLU 98 Cb 0.09 -3.73 -0.07 0.00 0.10 0.00 0.00 34.13 30.53 2dlr s GLU 98 CO 0.45 -1.05 1.41 -1.25 0.02 0.00 0.00 175.26 174.84 2dlr s PRO 99 N 1.30 4.30 -0.05 0.39 0.04 -1.20 -4.99 135.00 134.78 2dlr s PRO 99 Ca 0.05 2.03 -0.22 0.00 0.04 0.00 0.00 61.00 62.90 2dlr s PRO 99 Cb -0.24 -3.44 0.05 0.00 0.04 0.00 0.00 34.50 30.91 2dlr s PRO 99 CO -0.01 -0.52 0.49 -3.38 0.04 0.00 0.00 177.00 173.62 2dlr s HIS 100 N 1.86 -0.43 -2.00 0.56 -3.43 -1.26 -4.98 115.29 105.62 2dlr s HIS 100 Ca 0.65 0.77 0.07 0.00 -0.80 0.00 0.00 55.06 55.74 2dlr s HIS 100 Cb -0.34 0.24 0.41 0.00 -1.43 0.00 0.00 32.58 31.46 2dlr s HIS 100 CO 0.28 -0.47 0.87 -0.35 -2.00 0.00 0.00 174.74 173.07 2dlr n PRO 101 N 1.32 0.49 0.02 -0.38 -0.04 -1.26 -2.09 135.00 133.05 2dlr n PRO 101 Ca -0.19 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.37 2dlr n PRO 101 Cb 0.56 -1.22 -0.12 0.00 -0.04 0.00 0.00 33.50 32.68 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 -0.72 0.25 0.27 1.53 4.77 -1.26 -2.78 117.00 119.05 2dlr n LEU 102 Ca 0.05 0.10 0.13 0.00 -0.03 0.00 0.00 56.01 56.26 2dlr n LEU 102 Cb 0.02 -0.01 0.82 0.00 -2.33 0.00 0.00 43.42 41.93 2dlr n LEU 102 CO 0.04 -0.04 1.11 0.00 -1.33 0.00 0.00 177.39 177.17 2dlr h MET 103 N 0.00 0.00 0.00 3.23 -0.00 -1.81 -2.88 114.93 113.46 2dlr h MET 103 Ca -0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.68 2dlr h MET 103 Cb 1.03 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.63 2dlr h MET 103 CO 0.00 0.00 -1.20 1.19 -0.00 0.00 0.00 176.91 176.90 2dlr n PHE 104 N -4.05 0.00 -0.33 -0.10 3.72 -1.26 -4.69 117.46 110.75 2dlr n PHE 104 Ca -0.02 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.40 2dlr n PHE 104 Cb 0.13 -0.11 0.10 0.00 -0.94 0.00 0.00 39.48 38.65 2dlr n PHE 104 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 2dlr h GLN 105 N 0.00 -0.01 0.14 -1.08 4.15 -1.33 0.21 115.11 117.20 2dlr h GLN 105 Ca -0.02 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.40 2dlr h GLN 105 Cb 0.34 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.04 2dlr h GLN 105 CO 0.00 -0.01 -0.07 -0.22 -1.93 0.00 0.00 178.83 176.60 2dlr h LYS 106 N -0.01 -0.18 -0.92 1.69 1.63 -1.84 -3.14 116.57 113.79 2dlr h LYS 106 Ca 0.41 0.01 0.28 0.00 -0.85 0.00 0.00 60.65 60.50 2dlr h LYS 106 Cb 0.65 0.04 -0.17 0.00 -0.60 0.00 0.00 32.23 32.15 2dlr h LYS 106 CO -0.94 -0.12 0.13 1.28 -3.45 0.00 0.00 179.45 176.35 2dlr n LEU 107 N -2.57 -0.01 -0.11 5.20 4.77 -0.90 -0.88 117.00 122.50 2dlr n LEU 107 Ca -0.02 1.56 -0.06 0.00 -0.03 0.00 0.00 56.01 57.46 2dlr n LEU 107 Cb 0.07 -0.61 -0.04 0.00 -2.33 0.00 0.00 43.42 40.51 2dlr n LEU 107 CO 0.06 -1.61 0.50 -0.61 -1.33 0.00 0.00 177.39 174.39 2dlr h GLN 108 N 0.00 -0.10 -0.81 3.23 4.15 -0.54 -1.53 115.11 119.50 2dlr h GLN 108 Ca 0.61 0.01 0.09 0.00 0.77 0.00 0.00 58.65 60.12 2dlr h GLN 108 Cb 1.36 0.02 -0.11 0.00 0.21 0.00 0.00 27.48 28.97 2dlr h GLN 108 CO -0.83 -0.07 -0.44 -3.47 -1.93 0.00 0.00 178.83 172.09 2dlr n ASP 109 N -3.94 -0.77 -0.22 -0.69 -0.08 -0.05 -0.01 116.55 110.79 2dlr n ASP 109 Ca -0.01 1.44 -0.08 0.00 -1.51 0.00 0.00 54.79 54.63 2dlr n ASP 109 Cb 0.14 -0.22 -0.03 0.00 2.34 0.00 0.00 41.12 43.34 2dlr n ASP 109 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 2dlr h GLN 110 N 0.00 -0.20 -0.18 -0.67 4.20 -1.32 -0.68 115.11 116.25 2dlr h GLN 110 Ca 0.17 0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.90 2dlr h GLN 110 Cb 0.37 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 2dlr h GLN 110 CO -0.78 -0.13 0.10 0.82 -0.67 0.00 0.00 178.83 178.17 2dlr h ILE 111 N -0.21 1.01 -0.86 2.54 1.08 0.01 0.29 117.51 121.37 2dlr h ILE 111 Ca 0.19 -0.07 0.16 0.00 -0.39 0.00 0.00 64.86 64.74 2dlr h ILE 111 Cb 0.56 0.78 -0.16 0.00 -3.07 0.00 0.00 36.82 34.94 2dlr h ILE 111 CO -0.71 0.04 -0.29 0.15 -0.69 0.00 0.00 178.15 176.65 2dlr h PHE 112 N 0.21 -0.74 -0.08 1.37 3.57 0.87 -0.13 116.94 122.02 2dlr h PHE 112 Ca 0.07 0.09 -0.11 0.00 3.53 0.00 0.00 57.97 61.55 2dlr h PHE 112 Cb 0.00 0.45 0.00 0.00 2.79 0.00 0.00 35.95 39.20 2dlr h PHE 112 CO -0.08 -0.39 -0.38 -2.95 -2.23 0.00 0.00 178.31 172.28 2dlr h ASN 113 N -0.03 0.47 -0.19 0.41 -1.07 -1.13 -2.95 115.58 111.09 2dlr h ASN 113 Ca 0.37 -0.65 0.02 0.00 0.07 0.00 0.00 56.30 56.11 2dlr h ASN 113 Cb 0.62 -0.14 -0.02 0.00 -2.07 0.00 0.00 38.32 36.70 2dlr h ASN 113 CO -0.89 1.04 -0.12 0.25 0.07 0.00 0.00 177.43 177.78 2dlr h LEU 114 N -0.07 -0.43 -2.12 6.14 5.85 0.88 1.01 115.31 126.57 2dlr h LEU 114 Ca -0.02 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.76 2dlr h LEU 114 Cb 1.02 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.25 2dlr h LEU 114 CO 0.08 -0.05 0.00 0.24 -0.34 0.00 0.00 178.44 178.37 2dlr h MET 115 N -0.00 0.00 -0.41 1.25 2.86 -1.47 0.81 114.93 117.96 2dlr h MET 115 Ca 0.03 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.59 2dlr h MET 115 Cb 0.08 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 2dlr h MET 115 CO -0.18 0.00 -0.08 -0.22 1.06 0.00 0.00 176.91 177.49 2dlr h LYS 116 N 0.00 0.71 -0.00 1.72 3.64 0.12 1.58 116.57 124.34 2dlr h LYS 116 Ca 0.00 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 2dlr h LYS 116 Cb 0.13 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2dlr h LYS 116 CO 0.00 0.78 -0.08 0.66 -2.27 0.00 0.00 179.45 178.54 2dlr n TYR 117 N -4.19 0.00 -0.02 1.91 4.02 -0.50 -3.34 117.16 115.04 2dlr n TYR 117 Ca 0.02 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.89 2dlr n TYR 117 Cb 0.33 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.65 2dlr n TYR 117 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2dlr n ASP 118 N -0.52 0.37 -0.08 7.72 -0.08 0.27 -4.63 116.55 119.61 2dlr n ASP 118 Ca 0.01 0.26 -0.07 0.00 -1.51 0.00 0.00 54.79 53.48 2dlr n ASP 118 Cb 0.06 -0.57 -0.02 0.00 2.34 0.00 0.00 41.12 42.93 2dlr n ASP 118 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2dlr n SER 119 N -2.77 1.85 -0.25 1.67 3.41 -1.00 -4.15 113.62 112.38 2dlr n SER 119 Ca -0.02 0.41 0.16 0.00 -0.26 0.00 0.00 58.87 59.17 2dlr n SER 119 Cb 0.07 -0.77 0.31 0.00 -0.26 0.00 0.00 64.21 63.55 2dlr n SER 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dlr n TYR 120 N -4.45 0.64 -0.25 7.33 9.36 0.53 0.28 117.16 130.60 2dlr n TYR 120 Ca -0.12 0.89 -0.06 0.00 3.32 0.00 0.00 57.90 61.94 2dlr n TYR 120 Cb 0.43 -1.16 0.05 0.00 -0.63 0.00 0.00 39.34 38.03 2dlr n TYR 120 CO 0.00 0.00 0.00 0.77 0.22 0.00 0.00 176.86 177.85 2dlr h SER 121 N 0.00 0.93 0.11 2.98 0.02 -1.67 -2.76 113.55 113.15 2dlr h SER 121 Ca 0.53 -0.14 -0.23 0.00 -0.84 0.00 0.00 61.79 61.11 2dlr h SER 121 Cb 1.24 -0.24 0.01 0.00 0.14 0.00 0.00 62.40 63.54 2dlr h SER 121 CO -0.65 0.81 -0.88 -0.09 -1.14 0.00 0.00 176.83 174.88 2dlr h ARG 122 N 0.98 0.59 0.01 3.45 2.43 0.39 -3.32 114.38 118.91 2dlr h ARG 122 Ca 0.24 -0.55 0.03 0.00 -0.81 0.00 0.00 59.98 58.88 2dlr h ARG 122 Cb 0.13 0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 29.76 2dlr h ARG 122 CO -0.03 1.17 -0.47 0.35 -1.51 0.00 0.00 179.97 179.48 2dlr h PHE 123 N 0.37 -1.36 -0.97 2.20 3.57 -0.04 0.98 116.94 121.69 2dlr h PHE 123 Ca -0.07 0.04 0.32 0.00 3.53 0.00 0.00 57.97 61.78 2dlr h PHE 123 Cb 1.50 0.59 -0.16 0.00 2.79 0.00 0.00 35.95 40.68 2dlr h PHE 123 CO 0.07 -0.54 0.44 -0.07 -2.23 0.00 0.00 178.31 175.98 2dlr h LEU 124 N -0.63 0.27 -0.54 0.59 3.38 -1.60 1.61 115.31 118.40 2dlr h LEU 124 Ca 0.03 0.21 -0.09 0.00 0.09 0.00 0.00 57.88 58.13 2dlr h LEU 124 Cb 0.69 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 2dlr h LEU 124 CO -0.33 -0.22 -0.43 0.11 0.09 0.00 0.00 178.44 177.66 2dlr h LYS 125 N 0.21 0.00 -6.87 1.13 6.56 -1.30 -3.41 116.57 112.89 2dlr h LYS 125 Ca 0.70 0.00 -0.38 0.00 -1.06 0.00 0.00 60.65 59.91 2dlr h LYS 125 Cb 1.61 0.00 0.21 0.00 -0.57 0.00 0.00 32.23 33.48 2dlr h LYS 125 CO -0.68 0.43 -0.23 0.45 -2.06 0.00 0.00 179.45 177.36 2dlr n SER 126 N -3.38 -3.10 -0.10 0.86 2.88 0.55 -4.92 113.62 106.42 2dlr n SER 126 Ca 0.01 -0.52 -0.23 0.00 -1.33 0.00 0.00 58.87 56.80 2dlr n SER 126 Cb 0.61 -1.06 -0.12 0.00 -0.75 0.00 0.00 64.21 62.89 2dlr n SER 126 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2dlr n ASP 127 N -4.63 1.92 -0.38 -3.46 5.75 -1.26 -3.54 116.55 110.95 2dlr n ASP 127 Ca 0.07 0.36 0.31 0.00 -0.01 0.00 0.00 54.79 55.52 2dlr n ASP 127 Cb 0.55 -0.91 0.50 0.00 -1.03 0.00 0.00 41.12 40.23 2dlr n ASP 127 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 2dlr n LEU 128 N -4.24 0.10 -0.02 -2.12 0.00 -1.26 -0.91 117.00 108.55 2dlr n LEU 128 Ca -0.36 0.87 -0.01 0.00 0.00 0.00 0.00 56.01 56.50 2dlr n LEU 128 Cb 0.78 -0.43 -0.00 0.00 0.00 0.00 0.00 43.42 43.76 2dlr n LEU 128 CO 0.20 -0.92 -0.09 0.15 0.00 0.00 0.00 177.39 176.72 2dlr h PHE 129 N 0.00 0.00 -0.81 1.96 3.57 -1.83 -3.38 116.94 116.44 2dlr h PHE 129 Ca 0.62 0.00 0.07 0.00 3.53 0.00 0.00 57.97 62.19 2dlr h PHE 129 Cb 2.17 0.00 -0.10 0.00 2.79 0.00 0.00 35.95 40.81 2dlr h PHE 129 CO -0.00 0.00 -0.47 1.28 -2.23 0.00 0.00 178.31 176.88 2dlr n LEU 130 N -2.90 -0.85 -0.28 0.59 4.77 -0.34 0.08 117.00 118.07 2dlr n LEU 130 Ca -0.02 1.44 -0.01 0.00 -0.03 0.00 0.00 56.01 57.39 2dlr n LEU 130 Cb 0.07 -0.19 0.02 0.00 -2.33 0.00 0.00 43.42 40.99 2dlr n LEU 130 CO 0.03 -1.18 0.43 0.29 -1.33 0.00 0.00 177.39 175.63 2dlr n LYS 131 N -5.02 -0.18 -0.05 3.23 5.02 -0.08 0.75 118.16 121.82 2dlr n LYS 131 Ca 0.02 1.13 -0.15 0.00 -2.02 0.00 0.00 58.31 57.29 2dlr n LYS 131 Cb 0.21 -1.68 -0.07 0.00 -0.02 0.00 0.00 35.03 33.47 2dlr n LYS 131 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2dlr h HIS 132 N 0.00 0.77 -1.33 2.13 2.76 -0.54 -3.15 115.15 115.79 2dlr h HIS 132 Ca 0.25 -0.30 0.41 0.00 -2.20 0.00 0.00 60.37 58.53 2dlr h HIS 132 Cb 0.43 -0.13 -0.11 0.00 1.55 0.00 0.00 27.41 29.15 2dlr h HIS 132 CO -0.65 1.07 0.89 -0.22 -1.30 0.00 0.00 177.93 177.71 2dlr h LYS 133 N 0.26 0.12 -0.58 5.26 3.64 0.32 0.18 116.57 125.76 2dlr h LYS 133 Ca -0.01 -0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.48 2dlr h LYS 133 Cb 1.06 -0.03 -0.11 0.00 -0.41 0.00 0.00 32.23 32.74 2dlr h LYS 133 CO 0.10 0.08 -0.17 0.00 -2.27 0.00 0.00 179.45 177.18 2dlr h ARG 134 N 0.12 -0.03 -1.46 1.90 2.47 -1.17 0.91 114.38 117.12 2dlr h ARG 134 Ca 0.77 0.00 0.45 0.00 -1.26 0.00 0.00 59.98 59.94 2dlr h ARG 134 Cb 2.50 0.01 -0.09 0.00 -1.65 0.00 0.00 29.97 30.74 2dlr h ARG 134 CO -0.31 -0.02 1.01 -2.37 0.56 0.00 0.00 179.97 178.85 2dlr n THR 135 N -5.41 -0.08 0.19 2.04 5.66 0.62 0.42 114.28 117.70 2dlr n THR 135 Ca 0.06 1.34 -0.15 0.00 -3.05 0.00 0.00 64.05 62.25 2dlr n THR 135 Cb 0.31 -2.22 -0.08 0.00 -1.55 0.00 0.00 70.33 66.79 2dlr n THR 135 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 2dlr h GLU 136 N 0.00 -0.70 -5.48 1.09 4.81 -0.98 -3.41 114.58 109.92 2dlr h GLU 136 Ca 0.77 0.05 -0.65 0.00 -0.13 0.00 0.00 59.36 59.40 2dlr h GLU 136 Cb 2.85 0.16 -0.20 0.00 0.63 0.00 0.00 28.75 32.18 2dlr h GLU 136 CO -0.16 -0.47 -0.66 -2.00 -0.73 0.00 0.00 179.01 174.99 2dlr s GLU 137 N -5.95 3.50 0.39 1.92 2.12 0.17 -5.12 118.70 115.72 2dlr s GLU 137 Ca -0.17 -0.50 0.08 0.00 0.36 0.00 0.00 54.97 54.74 2dlr s GLU 137 Cb 0.06 -2.87 -0.02 0.00 0.26 0.00 0.00 34.13 31.56 2dlr s GLU 137 CO 0.63 0.35 0.36 -1.83 -0.54 0.00 0.00 175.26 174.23 2dlr s GLU 138 N 0.08 2.63 0.45 4.30 -1.05 -1.26 -4.86 118.70 118.99 2dlr s GLU 138 Ca -0.00 -1.42 0.26 0.00 -0.15 0.00 0.00 54.97 53.66 2dlr s GLU 138 Cb -0.13 -2.45 0.68 0.00 -0.44 0.00 0.00 34.13 31.79 2dlr s GLU 138 CO 0.03 -0.10 1.73 0.93 0.95 0.00 0.00 175.26 178.80 2dlr h GLU 139 N 1.07 0.00 -6.79 -4.83 4.39 -1.99 -3.45 114.58 102.98 2dlr h GLU 139 Ca -0.42 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 58.75 2dlr h GLU 139 Cb 1.26 0.00 0.07 0.00 -0.10 0.00 0.00 28.75 29.98 2dlr h GLU 139 CO 0.57 0.00 0.75 -1.21 -1.16 0.00 0.00 179.01 177.96 2dlr s GLU 140 N -3.34 4.25 0.00 2.33 0.41 -1.26 -4.91 118.70 116.18 2dlr s GLU 140 Ca 0.05 2.34 0.11 0.00 -0.41 0.00 0.00 54.97 57.06 2dlr s GLU 140 Cb 0.07 -3.08 0.28 0.00 -1.78 0.00 0.00 34.13 29.61 2dlr s GLU 140 CO 0.62 -0.41 1.20 -0.40 -0.49 0.00 0.00 175.26 175.77 2dlr n ASP 141 N 1.90 2.79 -4.78 -0.19 5.68 -1.26 -5.02 116.55 115.67 2dlr n ASP 141 Ca 0.05 -1.91 -0.35 0.00 -0.50 0.00 0.00 54.79 52.08 2dlr n ASP 141 Cb 0.40 -0.20 -0.02 0.00 -1.14 0.00 0.00 41.12 40.17 2dlr n ASP 141 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 2dlr s LEU 142 N -0.99 3.82 0.00 -2.12 1.43 -1.26 -5.05 118.68 114.51 2dlr s LEU 142 Ca 0.22 2.07 -0.12 0.00 -1.03 0.00 0.00 54.13 55.27 2dlr s LEU 142 Cb 0.12 -4.54 0.18 0.00 0.03 0.00 0.00 46.19 41.98 2dlr s LEU 142 CO 0.16 -0.98 0.66 -0.81 0.23 0.00 0.00 176.35 175.60 2dlr n PRO 143 N -1.07 -2.31 -4.51 1.29 -0.04 -1.26 -5.09 135.00 122.01 2dlr n PRO 143 Ca 0.10 -1.05 -0.25 0.00 -0.04 0.00 0.00 63.50 62.27 2dlr n PRO 143 Cb 0.51 -0.98 -0.10 0.00 -0.04 0.00 0.00 33.50 32.89 2dlr n PRO 143 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2dlr s SER 144 N -3.27 3.54 0.02 3.54 0.01 -1.26 -5.16 113.70 111.12 2dlr s SER 144 Ca 0.43 -1.16 0.01 0.00 1.31 0.00 0.00 55.95 56.54 2dlr s SER 144 Cb -0.04 -0.31 -0.01 0.00 0.21 0.00 0.00 66.02 65.87 2dlr s SER 144 CO 0.33 -0.18 -0.05 -0.83 0.41 0.00 0.00 173.24 172.91 2dlr s GLY 145 N -3.56 0.30 0.29 3.44 0.00 -1.26 -5.01 107.32 101.52 2dlr s GLY 145 Ca 0.31 -0.43 -0.29 0.00 0.00 0.00 0.00 44.72 44.32 2dlr s GLY 145 CO 0.15 -0.44 1.24 2.56 0.00 0.00 0.00 173.10 176.62 2dlr s PRO 146 N -0.78 4.45 -0.17 2.90 0.04 -1.26 -4.98 135.00 135.21 2dlr s PRO 146 Ca -0.05 2.05 -0.23 0.00 0.04 0.00 0.00 61.00 62.81 2dlr s PRO 146 Cb -0.05 -3.13 -0.21 0.00 0.04 0.00 0.00 34.50 31.15 2dlr s PRO 146 CO -0.00 -0.07 0.43 1.03 0.04 0.00 0.00 177.00 178.42 2dlr h SER 147 N 3.92 0.00 -0.03 6.66 0.87 -2.00 -3.38 113.55 119.59 2dlr h SER 147 Ca -0.47 -0.68 0.02 0.00 -1.23 0.00 0.00 61.79 59.43 2dlr h SER 147 Cb 1.22 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.15 2dlr h SER 147 CO 0.68 1.21 -0.11 0.28 -0.53 0.00 0.00 176.83 178.36 2dlr h SER 148 N -1.00 -0.34 0.00 6.23 0.02 -2.04 -3.56 113.55 112.85 2dlr h SER 148 Ca -0.17 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 2dlr h SER 148 Cb 1.09 0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.78 2dlr h SER 148 CO -0.10 -0.16 0.00 0.61 -1.14 0.00 0.00 176.83 176.03