#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlr h SER 2 N 0.00 -0.22 -3.59 1.61 0.87 -2.09 -3.45 113.55 106.67 2dlr h SER 2 Ca 0.00 -0.31 -0.46 0.00 -1.23 0.00 0.00 61.79 59.80 2dlr h SER 2 Cb 0.00 0.06 0.10 0.00 -0.44 0.00 0.00 62.40 62.11 2dlr h SER 2 CO 0.00 0.25 0.26 -0.94 -0.53 0.00 0.00 176.83 175.87 2dlr s SER 3 N -5.36 4.39 0.00 6.23 1.04 -1.26 -4.98 113.70 113.76 2dlr s SER 3 Ca -0.14 0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.59 2dlr s SER 3 Cb 0.01 -0.78 0.00 0.00 0.10 0.00 0.00 66.02 65.35 2dlr s SER 3 CO 0.53 -1.88 0.00 0.61 0.98 0.00 0.00 173.24 173.48 2dlr n GLY 4 N -3.09 -0.97 0.11 7.32 0.00 -1.26 -4.94 105.19 102.35 2dlr n GLY 4 Ca 0.11 0.44 -0.13 0.00 0.00 0.00 0.00 46.02 46.44 2dlr n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2dlr h SER 5 N 0.00 0.24 -0.72 1.61 4.64 -1.99 -3.13 113.55 114.19 2dlr h SER 5 Ca 0.00 -0.41 -0.02 0.00 -0.47 0.00 0.00 61.79 60.89 2dlr h SER 5 Cb 0.00 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 61.99 2dlr h SER 5 CO 0.00 0.59 0.38 0.77 -0.87 0.00 0.00 176.83 177.70 2dlr h SER 6 N -0.12 0.92 -7.00 4.97 4.64 -1.95 -3.46 113.55 111.54 2dlr h SER 6 Ca 0.02 -0.08 -0.56 0.00 -0.47 0.00 0.00 61.79 60.70 2dlr h SER 6 Cb 0.50 -0.23 -0.05 0.00 -0.31 0.00 0.00 62.40 62.31 2dlr h SER 6 CO 0.02 0.76 -0.92 0.61 -0.87 0.00 0.00 176.83 176.42 2dlr n GLY 7 N -1.15 -0.63 0.37 -0.77 0.00 -1.19 -4.78 105.19 97.03 2dlr n GLY 7 Ca 0.07 0.27 0.09 0.00 0.00 0.00 0.00 46.02 46.46 2dlr n GLY 7 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2dlr h SER 8 N -2.04 0.71 -3.64 1.61 0.02 -1.91 -3.43 113.55 104.87 2dlr h SER 8 Ca -0.64 0.03 -0.43 0.00 -0.84 0.00 0.00 61.79 59.90 2dlr h SER 8 Cb 1.28 -0.12 0.18 0.00 0.14 0.00 0.00 62.40 63.88 2dlr h SER 8 CO 0.50 0.40 0.15 -0.76 -1.14 0.00 0.00 176.83 175.98 2dlr s LEU 9 N -9.84 1.02 -0.02 5.07 2.01 -1.26 -4.96 118.68 110.69 2dlr s LEU 9 Ca -0.10 0.88 -0.30 0.00 0.01 0.00 0.00 54.13 54.62 2dlr s LEU 9 Cb 0.21 -2.80 -0.04 0.00 0.01 0.00 0.00 46.19 43.58 2dlr s LEU 9 CO 0.79 -3.75 1.16 -1.59 1.01 0.00 0.00 176.35 173.96 2dlr s LYS 10 N -5.19 4.40 -0.26 1.70 0.00 -1.26 -4.94 119.74 114.19 2dlr s LYS 10 Ca 0.68 1.65 -0.15 0.00 0.00 0.00 0.00 55.97 58.15 2dlr s LYS 10 Cb -0.14 -3.49 -0.14 0.00 0.00 0.00 0.00 37.83 34.06 2dlr s LYS 10 CO 0.57 -0.34 -0.24 -1.13 0.00 0.00 0.00 175.35 174.21 2dlr n SER 11 N 4.72 1.94 0.25 0.03 3.41 -1.26 -4.32 113.62 118.40 2dlr n SER 11 Ca 0.10 0.33 -0.18 0.00 -0.26 0.00 0.00 58.87 58.86 2dlr n SER 11 Cb 0.47 -0.83 -0.10 0.00 -0.26 0.00 0.00 64.21 63.49 2dlr n SER 11 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2dlr h THR 12 N -0.94 0.00 -1.00 6.66 1.35 -1.94 -2.20 112.91 114.83 2dlr h THR 12 Ca -0.63 0.00 0.31 0.00 -0.55 0.00 0.00 66.41 65.54 2dlr h THR 12 Cb 1.58 0.00 -0.18 0.00 -1.73 0.00 0.00 68.15 67.81 2dlr h THR 12 CO -0.37 0.00 0.16 0.00 -0.25 0.00 0.00 175.52 175.07 2dlr h ALA 13 N -0.85 1.45 -0.09 6.62 0.00 -1.97 0.58 119.26 125.00 2dlr h ALA 13 Ca -0.05 0.33 0.01 0.00 0.00 0.00 0.00 54.91 55.20 2dlr h ALA 13 Cb 0.84 0.53 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 2dlr h ALA 13 CO -0.11 -0.68 0.01 0.87 0.00 0.00 0.00 179.25 179.34 2dlr h LYS 14 N 0.00 0.04 -0.11 0.00 1.57 -1.60 0.12 116.57 116.59 2dlr h LYS 14 Ca 0.67 -0.00 0.01 0.00 -1.87 0.00 0.00 60.65 59.46 2dlr h LYS 14 Cb 1.52 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.81 2dlr h LYS 14 CO -0.89 0.03 0.03 -1.49 -0.57 0.00 0.00 179.45 176.55 2dlr h TRP 15 N 0.04 0.05 -0.89 -1.35 6.55 0.47 -2.57 115.95 118.25 2dlr h TRP 15 Ca 0.04 0.01 0.01 0.00 0.95 0.00 0.00 58.89 59.89 2dlr h TRP 15 Cb 0.04 -0.01 -0.04 0.00 -0.86 0.00 0.00 29.16 28.29 2dlr h TRP 15 CO -0.12 0.03 0.58 0.00 -1.05 0.00 0.00 178.44 177.88 2dlr h ALA 16 N 1.07 1.13 -0.07 1.49 0.00 -0.91 -3.01 119.26 118.97 2dlr h ALA 16 Ca 0.05 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.92 2dlr h ALA 16 Cb 0.03 -0.36 -0.06 0.00 0.00 0.00 0.00 17.79 17.40 2dlr h ALA 16 CO -0.06 0.55 -0.43 0.00 0.00 0.00 0.00 179.25 179.31 2dlr h ALA 17 N 1.32 -0.66 -2.44 0.00 0.00 -0.35 -3.44 119.26 113.69 2dlr h ALA 17 Ca 0.33 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.12 2dlr h ALA 17 Cb -0.12 0.79 -0.22 0.00 0.00 0.00 0.00 17.79 18.24 2dlr h ALA 17 CO -0.07 -0.96 -0.09 0.45 0.00 0.00 0.00 179.25 178.58 2dlr s SER 18 N -4.84 -0.53 0.21 0.00 0.15 -1.08 -5.05 113.70 102.57 2dlr s SER 18 Ca -0.16 0.98 -0.11 0.00 0.70 0.00 0.00 55.95 57.36 2dlr s SER 18 Cb 0.09 1.00 0.28 0.00 -1.71 0.00 0.00 66.02 65.67 2dlr s SER 18 CO 0.64 -0.22 1.65 0.25 1.20 0.00 0.00 173.24 176.76 2dlr h LEU 19 N 5.09 -0.36 -0.83 3.45 5.85 -1.86 -1.21 115.31 125.45 2dlr h LEU 19 Ca -0.28 0.16 0.15 0.00 0.84 0.00 0.00 57.88 58.75 2dlr h LEU 19 Cb 1.17 0.30 -0.15 0.00 0.37 0.00 0.00 40.66 42.36 2dlr h LEU 19 CO 0.20 -0.14 -0.31 -0.33 -0.34 0.00 0.00 178.44 177.52 2dlr h GLU 20 N 0.08 -0.05 -0.94 1.25 5.08 -1.93 0.85 114.58 118.92 2dlr h GLU 20 Ca 0.32 0.00 0.19 0.00 -1.00 0.00 0.00 59.36 58.88 2dlr h GLU 20 Cb 0.51 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.69 2dlr h GLU 20 CO -0.56 -0.03 0.60 -0.91 -1.00 0.00 0.00 179.01 177.11 2dlr h ASN 21 N -0.05 0.55 -0.12 1.42 2.35 -1.47 0.25 115.58 118.51 2dlr h ASN 21 Ca 0.34 0.06 -0.17 0.00 -0.55 0.00 0.00 56.30 55.98 2dlr h ASN 21 Cb 0.60 -0.04 0.01 0.00 0.05 0.00 0.00 38.32 38.93 2dlr h ASN 21 CO -0.86 0.22 -0.58 0.25 -1.65 0.00 0.00 177.43 174.81 2dlr h LEU 22 N 0.54 0.72 -0.27 1.61 5.85 0.68 -2.71 115.31 121.73 2dlr h LEU 22 Ca 0.50 -0.63 -0.03 0.00 0.84 0.00 0.00 57.88 58.56 2dlr h LEU 22 Cb 1.05 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 2dlr h LEU 22 CO -0.24 1.24 0.07 -0.07 -0.34 0.00 0.00 178.44 179.10 2dlr h LEU 23 N 0.25 0.40 -0.75 2.25 3.38 0.69 -2.98 115.31 118.56 2dlr h LEU 23 Ca -0.04 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.74 2dlr h LEU 23 Cb 1.22 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.81 2dlr h LEU 23 CO 0.12 0.52 0.47 1.05 0.09 0.00 0.00 178.44 180.69 2dlr h GLU 24 N 0.26 0.88 -6.65 1.13 4.11 -0.65 -3.42 114.58 110.24 2dlr h GLU 24 Ca 0.08 -0.05 -0.52 0.00 0.07 0.00 0.00 59.36 58.94 2dlr h GLU 24 Cb 0.28 -0.20 0.02 0.00 0.50 0.00 0.00 28.75 29.34 2dlr h GLU 24 CO 0.00 0.58 0.55 -0.51 0.07 0.00 0.00 179.01 179.70 2dlr s ASP 25 N -5.76 7.10 -0.02 3.06 1.11 -1.02 -4.97 116.67 116.16 2dlr s ASP 25 Ca -0.13 2.21 -0.25 0.00 0.18 0.00 0.00 52.55 54.56 2dlr s ASP 25 Cb 0.16 -2.60 -0.19 0.00 1.07 0.00 0.00 42.92 41.35 2dlr s ASP 25 CO 0.78 -0.37 1.23 1.55 1.18 0.00 0.00 175.17 179.54 2dlr h PRO 26 N 5.33 -0.06 -0.63 8.23 0.13 -1.82 -2.76 132.00 140.42 2dlr h PRO 26 Ca -0.44 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 64.77 2dlr h PRO 26 Cb 1.21 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 32.29 2dlr h PRO 26 CO 0.75 0.40 0.29 1.05 -0.23 0.00 0.00 178.00 180.26 2dlr h GLU 27 N -0.55 0.50 0.68 0.86 4.11 -1.93 -2.80 114.58 115.45 2dlr h GLU 27 Ca -0.01 -0.03 -0.03 0.00 0.07 0.00 0.00 59.36 59.36 2dlr h GLU 27 Cb 0.49 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2dlr h GLU 27 CO 0.01 0.33 -0.36 0.78 0.07 0.00 0.00 179.01 179.85 2dlr h GLY 28 N 0.52 -1.01 -0.79 1.06 0.00 -1.78 -2.84 103.07 98.23 2dlr h GLY 28 Ca 0.30 0.39 0.28 0.00 0.00 0.00 0.00 47.33 48.31 2dlr h GLY 28 CO -0.25 -0.36 0.19 -2.08 0.00 0.00 0.00 176.54 174.03 2dlr h VAL 29 N -0.95 0.12 0.25 4.60 2.07 -1.25 -0.05 116.25 121.03 2dlr h VAL 29 Ca -0.09 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.40 2dlr h VAL 29 Cb 0.74 0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 2dlr h VAL 29 CO 0.13 0.01 -0.46 0.11 0.02 0.00 0.00 177.57 177.39 2dlr h LYS 30 N 0.08 -0.74 -0.64 1.57 1.79 -1.26 -0.58 116.57 116.80 2dlr h LYS 30 Ca 0.63 0.05 0.12 0.00 -2.18 0.00 0.00 60.65 59.27 2dlr h LYS 30 Cb 1.36 0.17 -0.09 0.00 -1.58 0.00 0.00 32.23 32.09 2dlr h LYS 30 CO -0.80 -0.49 0.17 0.00 -1.08 0.00 0.00 179.45 177.24 2dlr h ARG 31 N -0.76 0.29 0.13 3.15 2.47 -0.97 -2.21 114.38 116.48 2dlr h ARG 31 Ca -0.03 -0.02 0.02 0.00 -1.26 0.00 0.00 59.98 58.69 2dlr h ARG 31 Cb 0.71 -0.07 -0.04 0.00 -1.65 0.00 0.00 29.97 28.92 2dlr h ARG 31 CO -0.17 0.19 -0.40 0.35 0.56 0.00 0.00 179.97 180.51 2dlr h PHE 32 N 0.30 -1.12 -0.24 3.04 3.57 -0.78 -2.96 116.94 118.75 2dlr h PHE 32 Ca 0.34 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.90 2dlr h PHE 32 Cb 0.51 0.47 -0.05 0.00 2.79 0.00 0.00 35.95 39.67 2dlr h PHE 32 CO -0.23 -0.50 -0.38 0.00 -2.23 0.00 0.00 178.31 174.97 2dlr h ARG 33 N -0.64 -0.29 -0.64 1.11 3.08 -0.51 -2.08 114.38 114.40 2dlr h ARG 33 Ca 0.02 0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.15 2dlr h ARG 33 Cb 0.66 0.06 -0.08 0.00 0.08 0.00 0.00 29.97 30.70 2dlr h ARG 33 CO -0.23 -0.19 -0.38 0.39 -1.07 0.00 0.00 179.97 178.49 2dlr n GLU 34 N -4.50 -0.28 0.04 0.04 -0.58 -0.99 0.35 120.64 114.72 2dlr n GLU 34 Ca -0.03 0.97 -0.04 0.00 -0.42 0.00 0.00 57.16 57.64 2dlr n GLU 34 Cb 0.24 -1.43 -0.03 0.00 -0.57 0.00 0.00 31.44 29.65 2dlr n GLU 34 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 2dlr h PHE 35 N 0.00 -0.40 -0.45 -0.32 3.57 -1.26 -2.51 116.94 115.58 2dlr h PHE 35 Ca 0.10 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.67 2dlr h PHE 35 Cb 0.27 0.17 -0.09 0.00 2.79 0.00 0.00 35.95 39.09 2dlr h PHE 35 CO -0.66 -0.16 -0.51 -0.07 -2.23 0.00 0.00 178.31 174.67 2dlr h LEU 36 N -0.21 -1.72 -0.88 0.59 3.38 -0.49 0.13 115.31 116.11 2dlr h LEU 36 Ca -0.00 0.24 0.35 0.00 0.09 0.00 0.00 57.88 58.56 2dlr h LEU 36 Cb 0.21 0.73 -0.16 0.00 0.09 0.00 0.00 40.66 41.52 2dlr h LEU 36 CO -0.07 -0.38 0.41 1.17 0.09 0.00 0.00 178.44 179.66 2dlr n LYS 37 N -5.39 -0.06 -0.24 1.13 4.81 0.16 0.15 118.16 118.72 2dlr n LYS 37 Ca -0.02 1.23 0.05 0.00 -0.87 0.00 0.00 58.31 58.70 2dlr n LYS 37 Cb 0.34 -2.16 0.17 0.00 0.02 0.00 0.00 35.03 33.41 2dlr n LYS 37 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 2dlr h LYS 38 N 0.00 0.30 -0.61 1.64 1.57 -0.29 0.39 116.57 119.58 2dlr h LYS 38 Ca 0.72 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.48 2dlr h LYS 38 Cb 1.85 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 34.09 2dlr h LYS 38 CO -0.70 0.20 0.00 -0.85 -0.57 0.00 0.00 179.45 177.53 2dlr n GLU 39 N -5.11 2.90 -3.84 3.15 0.28 0.39 -4.92 120.64 113.48 2dlr n GLU 39 Ca 0.14 -2.16 -0.26 0.00 -0.16 0.00 0.00 57.16 54.72 2dlr n GLU 39 Cb 0.43 -1.67 0.02 0.00 1.43 0.00 0.00 31.44 31.66 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 -2.08 0.10 -1.84 3.01 0.14 -4.86 117.46 112.83 2dlr n PHE 40 Ca 0.20 0.87 0.02 0.00 1.01 0.00 0.00 57.45 59.54 2dlr n PHE 40 Cb 0.65 -4.11 -0.02 0.00 -0.01 0.00 0.00 39.48 35.99 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 -2.93 1.65 -0.42 4.37 7.64 -1.14 -4.67 113.62 118.11 2dlr n SER 41 Ca -0.12 -0.37 0.37 0.00 1.01 0.00 0.00 58.87 59.76 2dlr n SER 41 Cb 0.60 1.06 0.64 0.00 -1.01 0.00 0.00 64.21 65.50 2dlr n SER 41 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2dlr n GLU 42 N -1.28 -0.04 -0.39 1.43 2.13 -1.26 -0.00 120.64 121.23 2dlr n GLU 42 Ca 0.00 1.29 0.34 0.00 0.66 0.00 0.00 57.16 59.45 2dlr n GLU 42 Cb 0.07 -2.46 0.53 0.00 0.27 0.00 0.00 31.44 29.85 2dlr n GLU 42 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87 2dlr n GLU 43 N -4.88 0.01 0.50 5.31 0.00 -1.26 0.34 120.64 120.65 2dlr n GLU 43 Ca 0.39 0.88 -0.20 0.00 0.00 0.00 0.00 57.16 58.24 2dlr n GLU 43 Cb 1.47 -2.11 -0.09 0.00 0.00 0.00 0.00 31.44 30.70 2dlr n GLU 43 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.13 174.18 2dlr h ASN 44 N 0.00 -1.08 -0.66 -1.84 7.08 -0.73 -2.00 115.58 116.36 2dlr h ASN 44 Ca 0.60 0.04 -0.08 0.00 -3.08 0.00 0.00 56.30 53.78 2dlr h ASN 44 Cb 2.83 0.28 -0.03 0.00 -2.08 0.00 0.00 38.32 39.32 2dlr h ASN 44 CO -0.01 -0.75 0.11 -0.37 -2.08 0.00 0.00 177.43 174.34 2dlr h VAL 45 N -1.33 1.26 -0.94 6.14 -1.51 -0.34 -0.45 116.25 119.09 2dlr h VAL 45 Ca -0.13 -1.02 0.15 0.00 -1.23 0.00 0.00 66.70 64.47 2dlr h VAL 45 Cb 0.98 0.62 -0.08 0.00 -2.13 0.00 0.00 31.29 30.68 2dlr h VAL 45 CO 0.21 0.39 0.60 -0.07 -1.23 0.00 0.00 177.57 177.47 2dlr h LEU 46 N 1.03 0.72 0.20 4.19 3.38 -1.34 0.53 115.31 124.02 2dlr h LEU 46 Ca 0.20 0.05 -0.35 0.00 0.09 0.00 0.00 57.88 57.88 2dlr h LEU 46 Cb 0.43 -0.09 0.02 0.00 0.09 0.00 0.00 40.66 41.11 2dlr h LEU 46 CO 0.01 0.35 -1.66 0.15 0.09 0.00 0.00 178.44 177.38 2dlr h PHE 47 N 0.75 0.79 0.03 1.13 3.57 -1.05 -3.26 116.94 118.90 2dlr h PHE 47 Ca 0.48 -0.57 0.02 0.00 3.53 0.00 0.00 57.97 61.43 2dlr h PHE 47 Cb 0.73 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.41 2dlr h PHE 47 CO -0.00 1.63 -0.14 2.35 -2.23 0.00 0.00 178.31 179.91 2dlr h TRP 48 N 0.12 -0.37 -0.75 0.41 7.01 -0.30 -2.35 115.95 119.71 2dlr h TRP 48 Ca -0.31 0.01 0.08 0.00 2.11 0.00 0.00 58.89 60.78 2dlr h TRP 48 Cb 2.12 0.16 -0.07 0.00 -2.10 0.00 0.00 29.16 29.27 2dlr h TRP 48 CO 0.11 -0.22 0.41 -0.07 -2.79 0.00 0.00 178.44 175.88 2dlr h LEU 49 N -0.26 0.58 -0.68 0.65 3.38 -1.08 -1.77 115.31 116.13 2dlr h LEU 49 Ca 0.04 0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.16 2dlr h LEU 49 Cb 0.30 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 2dlr h LEU 49 CO -0.12 0.34 0.31 0.00 0.09 0.00 0.00 178.44 179.06 2dlr h ALA 50 N 1.42 0.92 -0.08 1.53 0.00 -1.48 -2.09 119.26 119.49 2dlr h ALA 50 Ca 0.36 0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.36 2dlr h ALA 50 Cb 0.31 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 2dlr h ALA 50 CO -0.24 -0.11 -0.40 0.00 0.00 0.00 0.00 179.25 178.50 2dlr h GLU 52 N -0.44 -0.71 -0.99 0.00 4.39 -1.48 -1.93 114.58 113.42 2dlr h GLU 52 Ca 0.02 0.05 0.31 0.00 0.34 0.00 0.00 59.36 60.08 2dlr h GLU 52 Cb 0.51 0.16 -0.18 0.00 -0.10 0.00 0.00 28.75 29.14 2dlr h GLU 52 CO -0.31 -0.47 0.19 -0.44 -1.16 0.00 0.00 179.01 176.82 2dlr h ASP 53 N -0.74 -0.21 0.28 1.42 3.32 -1.20 0.11 116.42 119.40 2dlr h ASP 53 Ca -0.03 0.27 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 2dlr h ASP 53 Cb 0.69 0.41 -0.02 0.00 0.22 0.00 0.00 39.33 40.63 2dlr h ASP 53 CO -0.17 -0.36 -0.35 0.15 -1.72 0.00 0.00 179.24 176.79 2dlr h PHE 54 N 0.02 -0.97 -0.75 4.55 3.57 -0.21 -1.33 116.94 121.81 2dlr h PHE 54 Ca 0.67 0.01 0.12 0.00 3.53 0.00 0.00 57.97 62.30 2dlr h PHE 54 Cb 1.52 0.39 -0.05 0.00 2.79 0.00 0.00 35.95 40.60 2dlr h PHE 54 CO -0.34 -0.44 0.50 1.57 -2.23 0.00 0.00 178.31 177.36 2dlr h LYS 55 N -0.64 0.56 -0.62 1.11 2.10 -0.76 -1.32 116.57 117.00 2dlr h LYS 55 Ca -0.03 -0.03 0.04 0.00 -2.00 0.00 0.00 60.65 58.62 2dlr h LYS 55 Cb 0.57 -0.13 -0.05 0.00 -0.90 0.00 0.00 32.23 31.73 2dlr h LYS 55 CO -0.08 0.37 0.36 0.87 -2.00 0.00 0.00 179.45 178.97 2dlr h LYS 56 N 0.58 0.68 -6.63 0.07 1.57 -0.26 -3.42 116.57 109.15 2dlr h LYS 56 Ca 0.36 -0.04 -0.54 0.00 -1.87 0.00 0.00 60.65 58.55 2dlr h LYS 56 Cb 0.60 -0.15 0.06 0.00 0.08 0.00 0.00 32.23 32.82 2dlr h LYS 56 CO -0.13 0.45 0.92 -1.33 -0.57 0.00 0.00 179.45 178.79 2dlr n MET 57 N -4.76 2.57 -0.02 3.15 2.81 -0.50 -4.92 117.12 115.45 2dlr n MET 57 Ca 0.07 0.92 -0.21 0.00 -1.81 0.00 0.00 57.70 56.67 2dlr n MET 57 Cb 0.12 -2.73 -0.13 0.00 -0.71 0.00 0.00 33.22 29.77 2dlr n MET 57 CO 0.00 0.00 0.00 0.37 1.51 0.00 0.00 175.97 177.85 2dlr h GLN 58 N 6.14 0.18 -6.58 0.03 -0.00 -1.85 -3.47 115.11 109.55 2dlr h GLN 58 Ca -0.44 -0.30 -0.59 0.00 -0.00 0.00 0.00 58.65 57.32 2dlr h GLN 58 Cb 1.22 0.11 0.09 0.00 0.00 0.00 0.00 27.48 28.91 2dlr h GLN 58 CO 0.91 1.14 0.48 -0.25 0.00 0.00 0.00 178.83 181.11 2dlr n ASP 59 N -3.98 2.39 -0.06 -0.69 8.00 -1.26 -4.93 116.55 116.03 2dlr n ASP 59 Ca -0.28 1.16 -0.12 0.00 0.71 0.00 0.00 54.79 56.26 2dlr n ASP 59 Cb 0.86 -1.40 -0.11 0.00 -0.02 0.00 0.00 41.12 40.46 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 3.42 -0.01 -0.65 -1.24 3.64 -2.00 -3.23 116.57 116.50 2dlr h LYS 60 Ca -0.44 0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.02 2dlr h LYS 60 Cb 1.29 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 33.01 2dlr h LYS 60 CO 0.70 0.79 -0.50 1.15 -2.27 0.00 0.00 179.45 179.32 2dlr h THR 61 N -0.94 0.04 -0.86 1.00 2.02 -2.00 0.25 112.91 112.41 2dlr h THR 61 Ca -0.00 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.34 2dlr h THR 61 Cb 0.81 0.04 -0.10 0.00 -1.74 0.00 0.00 68.15 67.16 2dlr h THR 61 CO 0.00 0.00 0.44 1.56 0.37 0.00 0.00 175.52 177.90 2dlr h GLN 62 N -0.21 0.59 -0.49 6.66 4.20 -1.98 -0.69 115.11 123.19 2dlr h GLN 62 Ca 0.16 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.83 2dlr h GLN 62 Cb 0.54 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 2dlr h GLN 62 CO -0.74 0.39 0.31 0.52 -0.67 0.00 0.00 178.83 178.64 2dlr h MET 63 N 0.61 0.66 -0.88 1.46 2.86 -0.62 0.11 114.93 119.13 2dlr h MET 63 Ca 0.48 -0.05 0.20 0.00 -2.06 0.00 0.00 59.70 58.27 2dlr h MET 63 Cb 0.71 -0.14 -0.12 0.00 0.06 0.00 0.00 31.60 32.11 2dlr h MET 63 CO -0.38 0.46 0.39 1.96 1.06 0.00 0.00 176.91 180.40 2dlr h GLN 64 N 0.66 0.43 0.06 1.72 4.20 0.57 0.51 115.11 123.26 2dlr h GLN 64 Ca 0.18 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.86 2dlr h GLN 64 Cb -0.04 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.65 2dlr h GLN 64 CO -0.04 0.28 -0.03 0.93 -0.67 0.00 0.00 178.83 179.31 2dlr h GLU 65 N 0.44 -0.07 -0.96 1.46 5.08 -1.29 -3.20 114.58 116.03 2dlr h GLU 65 Ca 0.53 0.01 0.25 0.00 -1.00 0.00 0.00 59.36 59.15 2dlr h GLU 65 Cb 0.95 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 30.16 2dlr h GLU 65 CO -0.49 0.37 0.65 -0.22 -1.00 0.00 0.00 179.01 178.33 2dlr h LYS 66 N -0.97 0.21 0.09 2.33 1.63 -0.57 0.25 116.57 119.54 2dlr h LYS 66 Ca -0.01 -0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 59.78 2dlr h LYS 66 Cb 0.48 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 32.07 2dlr h LYS 66 CO 0.01 0.14 -0.04 0.00 -3.45 0.00 0.00 179.45 176.11 2dlr h ALA 67 N 1.57 -0.87 -0.81 5.00 0.00 -0.06 -2.42 119.26 121.68 2dlr h ALA 67 Ca 0.49 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.44 2dlr h ALA 67 Cb 1.55 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 19.32 2dlr h ALA 67 CO -0.12 -0.86 0.48 1.57 0.00 0.00 0.00 179.25 180.32 2dlr h LYS 68 N -0.14 0.84 -0.22 0.00 2.10 -1.47 -2.21 116.57 115.48 2dlr h LYS 68 Ca -0.01 -0.05 0.04 0.00 -2.00 0.00 0.00 60.65 58.63 2dlr h LYS 68 Cb 0.09 -0.19 -0.07 0.00 -0.90 0.00 0.00 32.23 31.16 2dlr h LYS 68 CO 0.02 0.56 -0.53 0.93 -2.00 0.00 0.00 179.45 178.43 2dlr h GLU 69 N 0.87 -0.50 -0.18 0.07 4.39 -0.56 0.37 114.58 119.04 2dlr h GLU 69 Ca 0.36 0.03 0.03 0.00 0.34 0.00 0.00 59.36 60.12 2dlr h GLU 69 Cb 0.21 0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.95 2dlr h GLU 69 CO -0.19 -0.33 -0.01 0.82 -1.16 0.00 0.00 179.01 178.14 2dlr h ILE 70 N -0.51 0.87 -0.70 3.13 2.04 -1.17 -2.37 117.51 118.79 2dlr h ILE 70 Ca 0.05 -0.02 0.11 0.00 1.00 0.00 0.00 64.86 66.01 2dlr h ILE 70 Cb 0.65 0.82 -0.08 0.00 -0.74 0.00 0.00 36.82 37.47 2dlr h ILE 70 CO -0.48 0.01 0.31 0.22 0.00 0.00 0.00 178.15 178.20 2dlr h TYR 71 N 0.05 0.54 0.00 1.37 5.03 -0.75 0.51 116.97 123.72 2dlr h TYR 71 Ca 0.08 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.42 2dlr h TYR 71 Cb 0.11 -0.14 0.00 0.00 1.55 0.00 0.00 36.73 38.25 2dlr h TYR 71 CO -0.17 0.15 0.00 -1.33 -1.32 0.00 0.00 178.16 175.49 2dlr n MET 72 N -4.93 0.31 -0.01 1.82 2.81 0.12 -0.59 117.12 116.65 2dlr n MET 72 Ca 0.11 0.07 -0.00 0.00 -1.81 0.00 0.00 57.70 56.07 2dlr n MET 72 Cb 0.32 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.33 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 -1.11 0.11 -0.11 2.03 -1.04 0.18 -4.58 114.28 109.75 2dlr n THR 73 Ca 0.08 0.48 -0.14 0.00 -2.04 0.00 0.00 64.05 62.43 2dlr n THR 73 Cb 0.07 -1.57 -0.13 0.00 -1.82 0.00 0.00 70.33 66.88 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 -2.52 0.00 1.00 -1.42 3.72 -1.03 -4.29 117.46 112.92 2dlr n PHE 74 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 2dlr n PHE 74 Cb 0.03 -0.96 0.00 0.00 -0.94 0.00 0.00 39.48 37.61 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 -3.03 0.65 -4.61 4.37 4.77 0.24 -4.77 117.00 114.61 2dlr n LEU 75 Ca -0.39 -0.32 -0.28 0.00 -0.03 0.00 0.00 56.01 54.99 2dlr n LEU 75 Cb 1.03 -0.32 -0.11 0.00 -2.33 0.00 0.00 43.42 41.69 2dlr n LEU 75 CO 0.31 0.16 -0.29 -0.55 -1.33 0.00 0.00 177.39 175.70 2dlr s SER 76 N -0.39 3.81 0.45 -1.43 0.15 -0.13 -4.73 113.70 111.43 2dlr s SER 76 Ca 0.00 -1.38 -0.15 0.00 0.70 0.00 0.00 55.95 55.12 2dlr s SER 76 Cb 0.00 -0.37 -0.08 0.00 -1.71 0.00 0.00 66.02 63.86 2dlr s SER 76 CO 0.00 -0.47 0.89 -0.44 1.20 0.00 0.00 173.24 174.42 2dlr s SER 77 N -3.70 6.64 -1.26 5.45 0.01 -1.26 -3.97 113.70 115.61 2dlr s SER 77 Ca 0.35 1.42 -0.05 0.00 1.31 0.00 0.00 55.95 58.97 2dlr s SER 77 Cb 0.10 -2.44 0.01 0.00 0.21 0.00 0.00 66.02 63.89 2dlr s SER 77 CO 0.18 -0.46 0.71 0.29 0.41 0.00 0.00 173.24 174.36 2dlr n LYS 78 N -1.26 -5.19 -3.18 12.44 4.01 -1.26 -4.97 118.16 118.76 2dlr n LYS 78 Ca 0.05 0.75 -0.41 0.00 -0.51 0.00 0.00 58.31 58.19 2dlr n LYS 78 Cb 0.54 -5.36 -0.07 0.00 -0.51 0.00 0.00 35.03 29.63 2dlr n LYS 78 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2dlr s ALA 79 N -3.16 3.52 0.10 7.82 0.00 -1.25 -4.95 121.76 123.83 2dlr s ALA 79 Ca 0.35 -0.77 -0.16 0.00 0.00 0.00 0.00 51.96 51.38 2dlr s ALA 79 Cb -0.16 -3.04 -0.08 0.00 0.00 0.00 0.00 23.12 19.85 2dlr s ALA 79 CO 0.44 -1.08 1.46 0.77 0.00 0.00 0.00 175.76 177.34 2dlr h SER 80 N 8.27 0.65 -0.28 0.00 0.02 -1.93 -2.82 113.55 117.47 2dlr h SER 80 Ca -0.27 -0.42 0.00 0.00 -0.84 0.00 0.00 61.79 60.26 2dlr h SER 80 Cb 1.12 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.48 2dlr h SER 80 CO 0.78 0.93 0.00 -1.20 -1.14 0.00 0.00 176.83 176.20 2dlr n SER 81 N -4.38 2.88 -4.56 3.07 7.64 -1.26 -4.92 113.62 112.09 2dlr n SER 81 Ca -0.03 -2.34 -0.48 0.00 1.01 0.00 0.00 58.87 57.03 2dlr n SER 81 Cb 0.39 -0.51 -0.05 0.00 -1.01 0.00 0.00 64.21 63.02 2dlr n SER 81 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2dlr n GLN 82 N 0.33 1.61 -0.40 1.43 7.27 -1.07 -4.76 117.38 121.80 2dlr n GLN 82 Ca 0.12 0.50 -0.28 0.00 0.07 0.00 0.00 57.00 57.41 2dlr n GLN 82 Cb 0.60 -2.70 0.25 0.00 2.41 0.00 0.00 30.24 30.80 2dlr n GLN 82 CO 0.00 0.00 0.00 1.33 0.07 0.00 0.00 177.06 178.46 2dlr n VAL 83 N 6.68 0.00 -4.03 1.69 0.24 -1.26 -5.00 118.33 116.65 2dlr n VAL 83 Ca 0.33 -0.20 -0.33 0.00 -2.04 0.00 0.00 64.34 62.09 2dlr n VAL 83 Cb 0.30 -0.87 -0.15 0.00 -1.47 0.00 0.00 33.84 31.65 2dlr n VAL 83 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2dlr s ASN 84 N -2.53 4.24 0.17 -1.34 0.01 -1.26 -5.10 114.94 109.14 2dlr s ASN 84 Ca 0.62 -1.12 -0.11 0.00 -0.71 0.00 0.00 52.86 51.53 2dlr s ASN 84 Cb -0.15 -1.59 0.00 0.00 0.41 0.00 0.00 41.25 39.92 2dlr s ASN 84 CO 0.57 -0.15 0.35 0.68 -1.51 0.00 0.00 177.10 177.04 2dlr s VAL 85 N 1.21 0.06 -0.25 1.60 -7.23 -1.26 -4.83 120.40 109.70 2dlr s VAL 85 Ca -0.04 -1.22 -0.14 0.00 -1.81 0.00 0.00 61.98 58.77 2dlr s VAL 85 Cb -0.18 -1.76 -0.04 0.00 0.56 0.00 0.00 36.38 34.96 2dlr s VAL 85 CO -0.06 -0.26 0.35 -1.61 -0.31 0.00 0.00 175.10 173.21 2dlr s GLU 86 N -3.94 4.06 -0.21 4.82 8.01 -1.26 -4.29 118.70 125.90 2dlr s GLU 86 Ca 0.15 0.03 -0.01 0.00 0.01 0.00 0.00 54.97 55.15 2dlr s GLU 86 Cb 0.02 -3.61 0.00 0.00 -4.31 0.00 0.00 34.13 26.23 2dlr s GLU 86 CO -0.01 -0.16 0.18 0.41 0.01 0.00 0.00 175.26 175.68 2dlr n GLY 87 N 4.44 0.53 0.13 -1.39 0.00 -1.26 -5.00 105.19 102.65 2dlr n GLY 87 Ca -0.09 -0.46 -0.10 0.00 0.00 0.00 0.00 46.02 45.36 2dlr n GLY 87 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2dlr h GLN 88 N -0.38 -0.21 -0.24 1.61 -0.00 -2.00 -3.15 115.11 110.76 2dlr h GLN 88 Ca -0.09 0.01 0.07 0.00 -0.00 0.00 0.00 58.65 58.64 2dlr h GLN 88 Cb 1.06 0.05 -0.01 0.00 0.00 0.00 0.00 27.48 28.58 2dlr h GLN 88 CO 0.09 0.21 0.82 1.03 0.00 0.00 0.00 178.83 180.98 2dlr h SER 89 N -0.88 0.00 -1.41 -0.69 0.87 -1.94 -1.62 113.55 107.88 2dlr h SER 89 Ca -0.02 0.00 0.45 0.00 -1.23 0.00 0.00 61.79 60.99 2dlr h SER 89 Cb 0.52 0.00 -0.10 0.00 -0.44 0.00 0.00 62.40 62.38 2dlr h SER 89 CO 0.04 0.00 0.96 -1.14 -0.53 0.00 0.00 176.83 176.15 2dlr n ARG 90 N -2.85 -0.02 -3.16 2.24 0.63 -1.19 -4.29 116.66 108.02 2dlr n ARG 90 Ca 0.05 1.05 -0.25 0.00 -0.92 0.00 0.00 57.85 57.78 2dlr n ARG 90 Cb 0.91 -2.19 -0.01 0.00 0.45 0.00 0.00 32.46 31.61 2dlr n ARG 90 CO 0.00 0.00 0.00 -0.48 -2.51 0.00 0.00 177.63 174.64 2dlr s LEU 91 N -8.38 3.90 0.11 6.15 2.34 -0.61 -5.10 118.68 117.09 2dlr s LEU 91 Ca -0.06 0.61 -0.14 0.00 0.06 0.00 0.00 54.13 54.60 2dlr s LEU 91 Cb 0.26 -3.49 0.03 0.00 -0.56 0.00 0.00 46.19 42.42 2dlr s LEU 91 CO 0.75 -0.37 0.34 0.20 -1.06 0.00 0.00 176.35 176.21 2dlr s ASN 92 N -4.01 -0.14 0.24 1.48 -0.87 -1.26 -5.01 114.94 105.36 2dlr s ASN 92 Ca 0.42 -0.39 0.16 0.00 -1.57 0.00 0.00 52.86 51.48 2dlr s ASN 92 Cb -0.10 0.43 0.85 0.00 -0.02 0.00 0.00 41.25 42.41 2dlr s ASN 92 CO 0.38 -0.81 0.94 -0.62 -2.57 0.00 0.00 177.10 174.42 2dlr n GLU 93 N -0.14 -0.03 -0.18 -0.60 4.71 -1.26 0.19 120.64 123.33 2dlr n GLU 93 Ca -0.16 0.79 -0.01 0.00 -0.01 0.00 0.00 57.16 57.77 2dlr n GLU 93 Cb 0.63 -1.48 0.06 0.00 -1.01 0.00 0.00 31.44 29.64 2dlr n GLU 93 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 2dlr h LYS 94 N 0.00 0.05 -0.80 3.49 1.79 -2.02 0.19 116.57 119.28 2dlr h LYS 94 Ca 0.52 -0.00 0.23 0.00 -2.18 0.00 0.00 60.65 59.21 2dlr h LYS 94 Cb 1.52 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 32.12 2dlr h LYS 94 CO -0.37 0.04 1.05 0.97 -1.08 0.00 0.00 179.45 180.05 2dlr h ILE 95 N 0.06 0.06 -0.12 1.86 2.10 0.16 1.52 117.51 123.14 2dlr h ILE 95 Ca 0.27 0.00 -0.22 0.00 1.08 0.00 0.00 64.86 65.99 2dlr h ILE 95 Cb 0.43 0.12 0.01 0.00 -1.09 0.00 0.00 36.82 36.29 2dlr h ILE 95 CO -0.51 0.00 -0.80 -0.07 -1.08 0.00 0.00 178.15 175.69 2dlr h LEU 96 N 0.00 0.84 -0.65 2.19 3.38 -0.73 -3.32 115.31 117.00 2dlr h LEU 96 Ca 0.38 -0.56 0.06 0.00 0.09 0.00 0.00 57.88 57.85 2dlr h LEU 96 Cb 2.48 -0.25 -0.08 0.00 0.09 0.00 0.00 40.66 42.90 2dlr h LEU 96 CO -0.00 1.35 -0.37 -0.62 0.09 0.00 0.00 178.44 178.89 2dlr n GLU 97 N -3.90 -0.27 -3.73 1.13 1.02 0.52 -3.23 120.64 112.18 2dlr n GLU 97 Ca -0.07 0.99 -0.37 0.00 -0.02 0.00 0.00 57.16 57.68 2dlr n GLU 97 Cb 0.75 -1.45 -0.11 0.00 -0.02 0.00 0.00 31.44 30.61 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 -5.37 2.22 0.14 3.49 -1.05 -1.25 -5.08 118.70 111.80 2dlr s GLU 98 Ca -0.08 -1.68 -0.31 0.00 -0.15 0.00 0.00 54.97 52.75 2dlr s GLU 98 Cb 0.08 -3.62 -0.08 0.00 -0.44 0.00 0.00 34.13 30.07 2dlr s GLU 98 CO 0.41 -1.02 1.34 -1.25 0.95 0.00 0.00 175.26 175.70 2dlr s PRO 99 N 1.23 4.36 -0.08 -4.83 0.04 -1.20 -4.98 135.00 129.54 2dlr s PRO 99 Ca 0.05 2.04 -0.26 0.00 0.04 0.00 0.00 61.00 62.88 2dlr s PRO 99 Cb -0.23 -3.23 0.06 0.00 0.04 0.00 0.00 34.50 31.13 2dlr s PRO 99 CO -0.02 -0.35 0.59 -3.38 0.04 0.00 0.00 177.00 173.88 2dlr s HIS 100 N 0.70 -0.56 -1.19 0.56 -3.43 -1.26 -5.02 115.29 105.09 2dlr s HIS 100 Ca 0.61 1.05 0.00 0.00 -0.80 0.00 0.00 55.06 55.92 2dlr s HIS 100 Cb -0.36 0.31 0.00 0.00 -1.43 0.00 0.00 32.58 31.10 2dlr s HIS 100 CO 0.33 -0.51 0.29 -0.35 -2.00 0.00 0.00 174.74 172.51 2dlr n PRO 101 N 1.34 0.49 -0.03 -0.38 -0.04 -1.26 -2.19 135.00 132.93 2dlr n PRO 101 Ca -0.19 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.25 2dlr n PRO 101 Cb 0.57 -1.20 -0.06 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 0.11 0.00 -0.30 1.53 4.77 -1.26 -3.88 117.00 117.98 2dlr n LEU 102 Ca 0.00 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.10 2dlr n LEU 102 Cb 0.10 0.15 0.29 0.00 -2.33 0.00 0.00 43.42 41.63 2dlr n LEU 102 CO 0.00 0.15 1.01 0.00 -1.33 0.00 0.00 177.39 177.22 2dlr h MET 103 N 0.00 0.34 0.03 3.23 -0.00 -1.83 -2.48 114.93 114.23 2dlr h MET 103 Ca -0.16 -0.02 -0.37 0.00 -0.00 0.00 0.00 59.70 59.15 2dlr h MET 103 Cb 1.25 -0.08 -0.05 0.00 -0.00 0.00 0.00 31.60 32.71 2dlr h MET 103 CO 0.01 0.23 -2.25 1.19 -0.00 0.00 0.00 176.91 176.09 2dlr n PHE 104 N -5.09 0.45 -0.23 -0.10 3.72 -1.26 -4.39 117.46 110.56 2dlr n PHE 104 Ca 0.21 0.11 0.14 0.00 -0.05 0.00 0.00 57.45 57.86 2dlr n PHE 104 Cb 0.63 -1.07 0.27 0.00 -0.94 0.00 0.00 39.48 38.37 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 -3.20 -0.05 0.35 -1.08 0.00 -0.95 0.26 117.38 112.72 2dlr n GLN 105 Ca -0.36 0.97 -0.14 0.00 -0.00 0.00 0.00 57.00 57.47 2dlr n GLN 105 Cb 1.05 -1.62 -0.07 0.00 0.00 0.00 0.00 30.24 29.60 2dlr n GLN 105 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.06 176.84 2dlr h LYS 106 N 0.00 -0.88 -0.20 3.69 3.64 -1.73 -3.03 116.57 118.07 2dlr h LYS 106 Ca 0.46 0.06 0.05 0.00 -1.27 0.00 0.00 60.65 59.96 2dlr h LYS 106 Cb 1.07 0.20 -0.06 0.00 -0.41 0.00 0.00 32.23 33.04 2dlr h LYS 106 CO -0.59 -0.58 -0.17 -0.07 -2.27 0.00 0.00 179.45 175.77 2dlr h LEU 107 N -1.04 -0.55 -0.90 5.20 3.38 -0.42 -2.41 115.31 118.57 2dlr h LEU 107 Ca -0.09 0.11 0.15 0.00 0.09 0.00 0.00 57.88 58.13 2dlr h LEU 107 Cb 0.70 0.27 -0.15 0.00 0.09 0.00 0.00 40.66 41.57 2dlr h LEU 107 CO 0.15 -0.21 -0.33 1.67 0.09 0.00 0.00 178.44 179.81 2dlr n GLN 108 N -5.32 -0.19 -0.33 1.13 7.27 0.99 0.90 117.38 121.83 2dlr n GLN 108 Ca -0.02 1.39 0.14 0.00 0.07 0.00 0.00 57.00 58.59 2dlr n GLN 108 Cb 0.24 -2.07 0.30 0.00 2.41 0.00 0.00 30.24 31.12 2dlr n GLN 108 CO 0.00 0.00 0.00 0.22 0.07 0.00 0.00 177.06 177.35 2dlr h ASP 109 N 0.00 -0.35 0.90 1.69 1.82 -1.30 0.28 116.42 119.45 2dlr h ASP 109 Ca 0.33 0.26 -0.04 0.00 -0.39 0.00 0.00 57.03 57.19 2dlr h ASP 109 Cb 0.56 0.43 0.01 0.00 0.68 0.00 0.00 39.33 41.01 2dlr h ASP 109 CO -0.90 -0.32 -0.43 1.56 -1.61 0.00 0.00 179.24 177.54 2dlr h GLN 110 N 0.04 -1.16 0.04 0.28 4.20 0.43 -2.98 115.11 115.97 2dlr h GLN 110 Ca 0.59 0.08 0.03 0.00 0.06 0.00 0.00 58.65 59.41 2dlr h GLN 110 Cb 1.23 0.26 -0.05 0.00 0.30 0.00 0.00 27.48 29.22 2dlr h GLN 110 CO -0.85 -0.77 -0.39 0.82 -0.67 0.00 0.00 178.83 176.96 2dlr h ILE 111 N -1.22 0.19 -0.87 2.54 5.03 -0.91 0.75 117.51 123.02 2dlr h ILE 111 Ca -0.12 0.00 0.35 0.00 -0.12 0.00 0.00 64.86 64.97 2dlr h ILE 111 Cb 0.92 0.19 -0.16 0.00 -3.03 0.00 0.00 36.82 34.75 2dlr h ILE 111 CO 0.20 0.00 0.41 0.33 -0.68 0.00 0.00 178.15 178.41 2dlr n PHE 112 N -5.45 0.96 0.05 1.37 7.35 0.82 0.90 117.46 123.46 2dlr n PHE 112 Ca -0.06 1.03 -0.21 0.00 -0.76 0.00 0.00 57.45 57.45 2dlr n PHE 112 Cb 0.36 -1.40 -0.15 0.00 0.35 0.00 0.00 39.48 38.64 2dlr n PHE 112 CO 0.00 0.00 0.00 -0.97 -0.76 0.00 0.00 176.76 175.03 2dlr h ASN 113 N 0.00 0.50 -0.78 -2.13 -1.24 -1.09 -3.18 115.58 107.66 2dlr h ASN 113 Ca 0.71 -0.92 0.07 0.00 0.71 0.00 0.00 56.30 56.87 2dlr h ASN 113 Cb 1.84 -0.16 -0.09 0.00 0.73 0.00 0.00 38.32 40.64 2dlr h ASN 113 CO -0.69 1.49 -0.46 -0.11 -1.29 0.00 0.00 177.43 176.37 2dlr n LEU 114 N -4.02 -0.83 -0.20 0.34 7.94 0.26 0.57 117.00 121.05 2dlr n LEU 114 Ca -0.17 1.41 -0.10 0.00 -1.11 0.00 0.00 56.01 56.04 2dlr n LEU 114 Cb 0.88 -0.19 0.02 0.00 0.53 0.00 0.00 43.42 44.66 2dlr n LEU 114 CO 0.48 -1.14 0.79 0.24 -1.11 0.00 0.00 177.39 176.65 2dlr h MET 115 N 0.00 1.04 -0.48 1.96 0.00 -1.65 0.65 114.93 116.45 2dlr h MET 115 Ca 0.13 -0.35 0.14 0.00 0.00 0.00 0.00 59.70 59.61 2dlr h MET 115 Cb 0.32 -0.08 -0.02 0.00 0.00 0.00 0.00 31.60 31.82 2dlr h MET 115 CO -0.74 1.05 0.74 -0.22 0.00 0.00 0.00 176.91 177.74 2dlr h LYS 116 N 0.93 0.00 0.00 1.72 3.64 0.15 0.62 116.57 123.63 2dlr h LYS 116 Ca 0.16 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 2dlr h LYS 116 Cb 0.60 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 2dlr h LYS 116 CO 0.04 0.00 -1.15 0.66 -2.27 0.00 0.00 179.45 176.73 2dlr n TYR 117 N -3.26 0.00 0.01 1.91 4.02 -0.63 -3.89 117.16 115.32 2dlr n TYR 117 Ca 0.10 0.00 -0.01 0.00 -0.01 0.00 0.00 57.90 57.98 2dlr n TYR 117 Cb 0.91 -0.10 -0.00 0.00 -0.02 0.00 0.00 39.34 40.13 2dlr n TYR 117 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 2dlr h ASP 118 N 0.00 -0.03 0.00 7.72 5.19 0.16 -3.36 116.42 126.10 2dlr h ASP 118 Ca -0.06 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.33 2dlr h ASP 118 Cb 1.13 0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.64 2dlr h ASP 118 CO 0.00 0.01 -0.60 -1.54 -3.12 0.00 0.00 179.24 173.99 2dlr n SER 119 N -2.24 1.82 -0.52 6.45 3.41 -0.15 -3.79 113.62 118.60 2dlr n SER 119 Ca -0.00 0.61 0.39 0.00 -0.26 0.00 0.00 58.87 59.60 2dlr n SER 119 Cb 0.01 -0.88 0.60 0.00 -0.26 0.00 0.00 64.21 63.69 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 -4.59 0.02 0.00 7.33 9.36 0.20 0.13 117.16 129.61 2dlr n TYR 120 Ca -0.10 0.02 -0.00 0.00 3.32 0.00 0.00 57.90 61.14 2dlr n TYR 120 Cb 0.31 -0.39 -0.00 0.00 -0.63 0.00 0.00 39.34 38.63 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 -0.03 -0.08 2.98 0.02 -1.69 -3.27 113.55 111.48 2dlr h SER 121 Ca 0.69 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.64 2dlr h SER 121 Cb 2.76 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 65.30 2dlr h SER 121 CO -0.02 0.07 0.03 0.08 -1.14 0.00 0.00 176.83 175.85 2dlr h ARG 122 N -0.21 0.11 -0.99 3.45 0.11 -0.83 -3.10 114.38 112.92 2dlr h ARG 122 Ca -0.00 -0.02 0.15 0.00 0.10 0.00 0.00 59.98 60.21 2dlr h ARG 122 Cb 0.02 -0.02 -0.16 0.00 1.11 0.00 0.00 29.97 30.92 2dlr h ARG 122 CO 0.01 0.23 -0.38 0.34 0.10 0.00 0.00 179.97 180.27 2dlr n PHE 123 N -4.95 0.04 -0.24 4.08 7.35 0.34 0.72 117.46 124.81 2dlr n PHE 123 Ca -0.06 1.22 0.01 0.00 -0.76 0.00 0.00 57.45 57.87 2dlr n PHE 123 Cb 0.11 -0.88 0.14 0.00 0.35 0.00 0.00 39.48 39.20 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 0.39 -0.99 -2.13 3.38 -1.59 -0.19 115.31 114.18 2dlr h LEU 124 Ca 0.35 0.07 -0.10 0.00 0.09 0.00 0.00 57.88 58.29 2dlr h LEU 124 Cb 0.60 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 2dlr h LEU 124 CO -0.99 0.22 -0.48 0.11 0.09 0.00 0.00 178.44 177.39 2dlr h LYS 125 N 0.54 0.00 -7.11 1.13 1.57 0.33 -3.35 116.57 109.68 2dlr h LYS 125 Ca 0.35 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 58.73 2dlr h LYS 125 Cb 0.40 0.00 0.21 0.00 0.08 0.00 0.00 32.23 32.92 2dlr h LYS 125 CO -0.29 0.48 -0.05 -1.12 -0.57 0.00 0.00 179.45 177.89 2dlr s SER 126 N -6.77 -0.39 -0.06 0.86 0.01 0.21 -4.84 113.70 102.71 2dlr s SER 126 Ca -0.02 0.93 -0.18 0.00 1.31 0.00 0.00 55.95 58.00 2dlr s SER 126 Cb 0.13 -1.36 -0.30 0.00 0.21 0.00 0.00 66.02 64.70 2dlr s SER 126 CO 0.73 -4.97 0.77 -2.24 0.41 0.00 0.00 173.24 167.94 2dlr h ASP 127 N -3.15 0.49 -0.87 2.44 3.04 -1.87 -2.99 116.42 113.51 2dlr h ASP 127 Ca -0.47 -0.91 0.31 0.00 -3.24 0.00 0.00 57.03 52.72 2dlr h ASP 127 Cb 1.33 -0.16 -0.10 0.00 -1.04 0.00 0.00 39.33 39.36 2dlr h ASP 127 CO 0.34 1.54 0.54 0.18 -2.04 0.00 0.00 179.24 179.79 2dlr n LEU 128 N -3.98 0.17 -0.02 0.15 4.77 -1.26 0.31 117.00 117.13 2dlr n LEU 128 Ca -0.19 0.98 -0.02 0.00 -0.03 0.00 0.00 56.01 56.75 2dlr n LEU 128 Cb 0.90 -0.48 -0.01 0.00 -2.33 0.00 0.00 43.42 41.50 2dlr n LEU 128 CO 0.47 -1.08 -0.17 0.33 -1.33 0.00 0.00 177.39 175.61 2dlr n PHE 129 N -4.16 0.05 -0.31 -1.77 7.35 -1.25 -4.29 117.46 113.08 2dlr n PHE 129 Ca 0.27 0.02 0.12 0.00 -0.76 0.00 0.00 57.45 57.11 2dlr n PHE 129 Cb 1.01 -0.19 0.25 0.00 0.35 0.00 0.00 39.48 40.90 2dlr n PHE 129 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 2dlr n LEU 130 N -3.02 -0.12 -0.00 -2.13 4.77 -0.86 -0.12 117.00 115.52 2dlr n LEU 130 Ca -0.04 1.50 -0.15 0.00 -0.03 0.00 0.00 56.01 57.29 2dlr n LEU 130 Cb 0.13 -0.54 -0.10 0.00 -2.33 0.00 0.00 43.42 40.58 2dlr n LEU 130 CO 0.05 -1.51 0.51 0.50 -1.33 0.00 0.00 177.39 175.61 2dlr h LYS 131 N 0.00 -0.57 0.32 3.23 1.63 -0.38 0.11 116.57 120.91 2dlr h LYS 131 Ca 0.52 0.04 0.00 0.00 -0.85 0.00 0.00 60.65 60.36 2dlr h LYS 131 Cb 1.06 0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 32.79 2dlr h LYS 131 CO -0.84 -0.38 -0.38 1.25 -3.45 0.00 0.00 179.45 175.65 2dlr h HIS 132 N -0.59 -1.05 -0.56 1.91 2.76 -0.70 -2.49 115.15 114.43 2dlr h HIS 132 Ca 0.03 0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.28 2dlr h HIS 132 Cb 0.69 0.42 -0.10 0.00 1.55 0.00 0.00 27.41 29.96 2dlr h HIS 132 CO -0.58 -0.52 -0.51 -0.22 -1.30 0.00 0.00 177.93 174.79 2dlr h LYS 133 N -0.75 -0.27 -0.66 5.26 3.64 -0.97 -0.66 116.57 122.16 2dlr h LYS 133 Ca -0.02 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.50 2dlr h LYS 133 Cb 0.69 0.06 -0.12 0.00 -0.41 0.00 0.00 32.23 32.45 2dlr h LYS 133 CO -0.10 -0.18 -0.30 -0.09 -2.27 0.00 0.00 179.45 176.51 2dlr h ARG 134 N -0.28 -0.10 -0.82 1.90 1.12 -0.62 0.12 114.38 115.71 2dlr h ARG 134 Ca 0.13 0.01 0.20 0.00 -1.11 0.00 0.00 59.98 59.21 2dlr h ARG 134 Cb 0.56 0.02 -0.13 0.00 -0.01 0.00 0.00 29.97 30.41 2dlr h ARG 134 CO -0.68 -0.07 0.13 1.15 -3.11 0.00 0.00 179.97 177.39 2dlr h THR 135 N -0.11 0.34 -4.26 0.20 2.02 -0.67 -3.41 112.91 107.03 2dlr h THR 135 Ca 0.27 -0.06 -0.46 0.00 0.77 0.00 0.00 66.41 66.94 2dlr h THR 135 Cb 0.55 0.16 0.14 0.00 -1.74 0.00 0.00 68.15 67.25 2dlr h THR 135 CO -0.72 0.03 0.38 -1.61 0.37 0.00 0.00 175.52 173.97 2dlr s GLU 136 N -6.02 1.11 0.05 6.66 2.02 0.42 -5.04 118.70 117.89 2dlr s GLU 136 Ca -0.13 -0.09 -0.20 0.00 0.02 0.00 0.00 54.97 54.57 2dlr s GLU 136 Cb 0.24 -1.87 -0.06 0.00 0.10 0.00 0.00 34.13 32.54 2dlr s GLU 136 CO 0.76 -2.15 0.59 -1.21 0.02 0.00 0.00 175.26 173.27 2dlr s GLU 137 N -5.66 4.26 0.69 1.61 2.02 -1.26 -4.95 118.70 115.41 2dlr s GLU 137 Ca 0.68 0.75 -0.11 0.00 0.02 0.00 0.00 54.97 56.31 2dlr s GLU 137 Cb -0.08 -3.28 0.02 0.00 0.10 0.00 0.00 34.13 30.89 2dlr s GLU 137 CO 0.52 0.54 1.07 -1.83 0.02 0.00 0.00 175.26 175.58 2dlr s GLU 138 N -0.79 2.80 0.61 1.61 -1.05 -1.26 -5.05 118.70 115.57 2dlr s GLU 138 Ca 0.30 0.35 0.02 0.00 -0.15 0.00 0.00 54.97 55.49 2dlr s GLU 138 Cb -0.19 -2.06 0.07 0.00 -0.44 0.00 0.00 34.13 31.51 2dlr s GLU 138 CO 0.19 -1.02 0.85 -1.21 0.95 0.00 0.00 175.26 175.01 2dlr s GLU 139 N -5.32 2.20 0.42 -4.83 2.02 -1.26 -5.12 118.70 106.82 2dlr s GLU 139 Ca 0.58 -1.04 0.08 0.00 0.02 0.00 0.00 54.97 54.61 2dlr s GLU 139 Cb -0.11 -2.46 0.01 0.00 0.10 0.00 0.00 34.13 31.67 2dlr s GLU 139 CO 0.50 -0.98 0.57 -1.83 0.02 0.00 0.00 175.26 173.54 2dlr s GLU 140 N -4.87 2.84 -1.40 1.61 -1.05 -1.26 -4.48 118.70 110.09 2dlr s GLU 140 Ca 0.61 -1.23 -0.09 0.00 -0.15 0.00 0.00 54.97 54.11 2dlr s GLU 140 Cb -0.08 -2.76 0.06 0.00 -0.44 0.00 0.00 34.13 30.91 2dlr s GLU 140 CO 0.40 -0.26 0.60 -0.25 0.95 0.00 0.00 175.26 176.71 2dlr n ASP 141 N -1.84 -4.59 -4.66 0.83 8.00 -1.26 -4.87 116.55 108.15 2dlr n ASP 141 Ca 0.08 -0.42 -0.43 0.00 0.71 0.00 0.00 54.79 54.73 2dlr n ASP 141 Cb 0.59 -3.74 -0.01 0.00 -0.02 0.00 0.00 41.12 37.94 2dlr n ASP 141 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2dlr n LEU 142 N -3.97 3.04 -4.58 0.64 4.77 -1.26 -4.86 117.00 110.77 2dlr n LEU 142 Ca -0.03 1.19 -0.42 0.00 -0.03 0.00 0.00 56.01 56.72 2dlr n LEU 142 Cb 0.56 -1.42 -0.03 0.00 -2.33 0.00 0.00 43.42 40.20 2dlr n LEU 142 CO 0.54 -0.79 1.51 -2.16 -1.33 0.00 0.00 177.39 175.15 2dlr s PRO 143 N -1.81 3.17 0.04 3.23 0.04 -1.26 -4.90 135.00 133.51 2dlr s PRO 143 Ca 0.57 1.11 -0.27 0.00 0.04 0.00 0.00 61.00 62.44 2dlr s PRO 143 Cb -0.60 -4.22 -0.17 0.00 0.04 0.00 0.00 34.50 29.54 2dlr s PRO 143 CO 0.61 -2.06 1.40 0.66 0.04 0.00 0.00 177.00 177.65 2dlr h SER 144 N 13.12 -0.47 -3.97 6.66 4.64 -2.03 -3.49 113.55 128.00 2dlr h SER 144 Ca -0.30 -0.08 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2dlr h SER 144 Cb 1.16 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2dlr h SER 144 CO 1.10 -0.19 0.00 0.61 -0.87 0.00 0.00 176.83 177.47 2dlr n GLY 145 N -0.78 3.53 3.75 -0.77 0.00 -1.26 -5.07 105.19 104.58 2dlr n GLY 145 Ca -0.11 -1.66 -0.41 0.00 0.00 0.00 0.00 46.02 43.84 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 -4.19 4.42 -0.05 1.61 0.04 -1.26 -4.98 135.00 130.59 2dlr s PRO 146 Ca 0.00 2.05 -0.08 0.00 0.04 0.00 0.00 61.00 63.01 2dlr s PRO 146 Cb 0.00 -3.16 -0.04 0.00 0.04 0.00 0.00 34.50 31.33 2dlr s PRO 146 CO 0.00 -0.16 0.38 0.77 0.04 0.00 0.00 177.00 178.03 2dlr h SER 147 N 4.64 -0.24 -3.32 6.66 0.02 -2.07 -3.45 113.55 115.79 2dlr h SER 147 Ca -0.46 0.01 -0.46 0.00 -0.84 0.00 0.00 61.79 60.04 2dlr h SER 147 Cb 1.22 0.06 -0.36 0.00 0.14 0.00 0.00 62.40 63.46 2dlr h SER 147 CO 0.73 0.12 -0.78 -0.55 -1.14 0.00 0.00 176.83 175.20 2dlr s SER 148 N -4.65 1.55 0.00 3.07 0.15 -1.26 -5.34 113.70 107.21 2dlr s SER 148 Ca -0.04 -0.18 0.00 0.00 0.70 0.00 0.00 55.95 56.43 2dlr s SER 148 Cb 0.00 -0.59 0.00 0.00 -1.71 0.00 0.00 66.02 63.72 2dlr s SER 148 CO 0.13 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.07