#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlv n SER 2 N 0.00 3.19 -3.49 1.61 2.88 -1.26 -4.96 113.62 111.59 2dlv n SER 2 Ca 0.00 1.04 -0.02 0.00 -1.33 0.00 0.00 58.87 58.56 2dlv n SER 2 Cb 0.00 -1.39 -0.05 0.00 -0.75 0.00 0.00 64.21 62.02 2dlv n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dlv s SER 3 N 2.30 -0.90 -0.09 -3.46 0.15 -1.26 -5.12 113.70 105.31 2dlv s SER 3 Ca 0.85 1.15 -0.32 0.00 0.70 0.00 0.00 55.95 58.33 2dlv s SER 3 Cb -0.70 1.97 -0.10 0.00 -1.71 0.00 0.00 66.02 65.48 2dlv s SER 3 CO 0.44 -0.24 1.98 0.61 1.20 0.00 0.00 173.24 177.23 2dlv n GLY 4 N 5.43 1.44 3.66 9.45 0.00 -1.26 -4.95 105.19 118.95 2dlv n GLY 4 Ca -0.08 0.85 -0.29 0.00 0.00 0.00 0.00 46.02 46.50 2dlv n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dlv s SER 5 N 4.99 2.61 -0.24 1.61 0.15 -1.26 -5.07 113.70 116.49 2dlv s SER 5 Ca 0.94 1.39 -0.05 0.00 0.70 0.00 0.00 55.95 58.93 2dlv s SER 5 Cb -0.59 -2.07 0.12 0.00 -1.71 0.00 0.00 66.02 61.77 2dlv s SER 5 CO 0.47 -3.17 0.45 -0.94 1.20 0.00 0.00 173.24 171.25 2dlv s SER 6 N -3.24 -0.31 0.00 5.45 1.04 -1.26 -4.99 113.70 110.38 2dlv s SER 6 Ca 0.65 0.74 0.00 0.00 0.48 0.00 0.00 55.95 57.83 2dlv s SER 6 Cb -0.20 1.46 0.00 0.00 0.10 0.00 0.00 66.02 67.39 2dlv s SER 6 CO 0.59 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 175.16 2dlv n GLY 7 N 5.39 0.67 3.77 7.32 0.00 -1.25 -4.65 105.19 116.44 2dlv n GLY 7 Ca -0.06 -0.81 -0.40 0.00 0.00 0.00 0.00 46.02 44.74 2dlv n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dlv s SER 8 N -1.11 6.32 0.00 1.61 0.15 -1.26 -4.46 113.70 114.94 2dlv s SER 8 Ca 0.00 2.87 0.15 0.00 0.70 0.00 0.00 55.95 59.67 2dlv s SER 8 Cb 0.00 -2.66 0.77 0.00 -1.71 0.00 0.00 66.02 62.42 2dlv s SER 8 CO 0.00 -0.87 1.40 -0.81 1.20 0.00 0.00 173.24 174.17 2dlv n PRO 9 N 0.31 0.24 -0.05 5.44 -0.04 -1.26 -2.44 135.00 137.20 2dlv n PRO 9 Ca 0.02 0.13 -0.22 0.00 -0.04 0.00 0.00 63.50 63.40 2dlv n PRO 9 Cb 0.41 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.25 2dlv n PRO 9 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2dlv n GLU 10 N -1.26 0.67 -0.07 0.54 2.13 -1.26 -3.43 120.64 117.96 2dlv n GLU 10 Ca 0.07 0.39 -0.14 0.00 0.66 0.00 0.00 57.16 58.15 2dlv n GLU 10 Cb 0.11 -1.71 -0.06 0.00 0.27 0.00 0.00 31.44 30.06 2dlv n GLU 10 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 2dlv h GLU 11 N -0.44 0.61 0.50 5.31 4.11 -1.92 -3.16 114.58 119.59 2dlv h GLU 11 Ca -0.41 -0.36 -0.02 0.00 0.07 0.00 0.00 59.36 58.63 2dlv h GLU 11 Cb 1.70 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.99 2dlv h GLU 11 CO -0.07 0.97 -0.24 0.00 0.07 0.00 0.00 179.01 179.74 2dlv h ALA 12 N 0.64 -0.67 -1.16 1.06 0.00 -1.68 -0.42 119.26 117.02 2dlv h ALA 12 Ca 0.02 -0.15 0.35 0.00 0.00 0.00 0.00 54.91 55.12 2dlv h ALA 12 Cb 0.91 0.26 -0.11 0.00 0.00 0.00 0.00 17.79 18.84 2dlv h ALA 12 CO 0.08 -0.86 0.75 -0.24 0.00 0.00 0.00 179.25 178.97 2dlv h VAL 13 N -0.70 0.33 0.01 0.00 3.04 -1.63 0.37 116.25 117.66 2dlv h VAL 13 Ca -0.07 -0.08 -0.02 0.00 -1.01 0.00 0.00 66.70 65.52 2dlv h VAL 13 Cb 0.53 0.06 0.00 0.00 -2.01 0.00 0.00 31.29 29.87 2dlv h VAL 13 CO 0.11 0.04 -0.09 0.11 -1.01 0.00 0.00 177.57 176.73 2dlv h LYS 14 N 0.24 0.05 -0.84 4.17 1.57 -1.43 -3.34 116.57 117.01 2dlv h LYS 14 Ca 0.70 -0.06 0.14 0.00 -1.87 0.00 0.00 60.65 59.56 2dlv h LYS 14 Cb 2.00 0.02 -0.14 0.00 0.08 0.00 0.00 32.23 34.19 2dlv h LYS 14 CO -0.36 0.89 -0.28 0.91 -0.57 0.00 0.00 179.45 180.04 2dlv n TRP 15 N -4.61 0.13 -0.32 -1.35 8.01 0.10 0.13 117.44 119.52 2dlv n TRP 15 Ca -0.10 1.03 0.22 0.00 -1.31 0.00 0.00 57.50 57.34 2dlv n TRP 15 Cb 0.46 -0.88 0.43 0.00 -2.01 0.00 0.00 31.31 29.31 2dlv n TRP 15 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.69 177.46 2dlv h GLY 16 N 0.00 1.88 -0.61 6.99 0.00 -1.62 -1.93 103.07 107.78 2dlv h GLY 16 Ca 0.33 -0.15 0.06 0.00 0.00 0.00 0.00 47.33 47.57 2dlv h GLY 16 CO -0.84 -0.51 -0.35 1.18 0.00 0.00 0.00 176.54 176.02 2dlv n GLU 17 N -5.15 -0.26 -3.71 4.80 1.02 0.36 -4.61 120.64 113.08 2dlv n GLU 17 Ca 0.30 0.92 -0.11 0.00 -0.02 0.00 0.00 57.16 58.24 2dlv n GLU 17 Cb 0.94 -1.35 -0.06 0.00 -0.02 0.00 0.00 31.44 30.95 2dlv n GLU 17 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2dlv s SER 18 N -5.30 -0.16 0.28 1.62 1.04 -0.72 -5.04 113.70 105.42 2dlv s SER 18 Ca -0.07 -0.23 -0.00 0.00 0.48 0.00 0.00 55.95 56.13 2dlv s SER 18 Cb 0.07 0.40 0.49 0.00 0.10 0.00 0.00 66.02 67.08 2dlv s SER 18 CO 0.38 -0.70 1.88 0.15 0.98 0.00 0.00 173.24 175.94 2dlv h PHE 19 N 2.90 1.13 0.27 5.02 3.57 -1.82 -2.93 116.94 125.09 2dlv h PHE 19 Ca -0.32 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.20 2dlv h PHE 19 Cb 1.21 -0.37 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 2dlv h PHE 19 CO 0.41 0.56 -0.32 0.22 -2.23 0.00 0.00 178.31 176.95 2dlv h ASP 20 N 1.09 -0.89 -0.98 0.41 3.58 -1.96 -2.51 116.42 115.16 2dlv h ASP 20 Ca 0.43 0.08 0.16 0.00 0.42 0.00 0.00 57.03 58.12 2dlv h ASP 20 Cb 0.25 0.30 -0.16 0.00 1.72 0.00 0.00 39.33 41.44 2dlv h ASP 20 CO -0.18 -0.40 -0.36 0.29 -2.88 0.00 0.00 179.24 175.70 2dlv n LYS 21 N -4.29 -0.21 -0.19 0.28 5.02 -1.12 0.29 118.16 117.95 2dlv n LYS 21 Ca -0.07 1.51 -0.02 0.00 -2.02 0.00 0.00 58.31 57.71 2dlv n LYS 21 Cb 0.28 -2.24 0.05 0.00 -0.02 0.00 0.00 35.03 33.10 2dlv n LYS 21 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2dlv h LEU 22 N 0.00 -0.55 -0.01 -0.35 5.85 -1.40 -1.53 115.31 117.32 2dlv h LEU 22 Ca 0.36 0.17 -0.00 0.00 0.84 0.00 0.00 57.88 59.25 2dlv h LEU 22 Cb 0.60 0.36 -0.00 0.00 0.37 0.00 0.00 40.66 41.99 2dlv h LEU 22 CO -0.98 -0.19 0.01 -0.07 -0.34 0.00 0.00 178.44 176.87 2dlv h LEU 23 N -0.01 0.02 -0.99 2.25 3.38 0.28 -2.78 115.31 117.45 2dlv h LEU 23 Ca 0.27 -0.10 0.34 0.00 0.09 0.00 0.00 57.88 58.48 2dlv h LEU 23 Cb 0.42 -0.00 -0.18 0.00 0.09 0.00 0.00 40.66 40.99 2dlv h LEU 23 CO -0.59 0.11 0.26 -1.28 0.09 0.00 0.00 178.44 177.03 2dlv h SER 24 N -0.07 -0.12 -3.79 -0.43 0.87 0.05 -3.39 113.55 106.67 2dlv h SER 24 Ca 0.00 0.27 -0.49 0.00 -1.23 0.00 0.00 61.79 60.34 2dlv h SER 24 Cb 0.09 0.39 -0.00 0.00 -0.44 0.00 0.00 62.40 62.44 2dlv h SER 24 CO -0.00 -0.39 0.41 -2.28 -0.53 0.00 0.00 176.83 174.04 2dlv s HIS 25 N -5.79 3.76 0.01 2.24 5.65 -1.02 -5.00 115.29 115.15 2dlv s HIS 25 Ca -0.11 1.81 -0.17 0.00 0.25 0.00 0.00 55.06 56.83 2dlv s HIS 25 Cb 0.31 -3.11 -0.10 0.00 -1.18 0.00 0.00 32.58 28.50 2dlv s HIS 25 CO 0.78 -0.03 1.02 -0.09 -0.65 0.00 0.00 174.74 175.76 2dlv h ARG 26 N 3.87 -0.60 -0.47 2.88 9.65 -1.84 -1.74 114.38 126.14 2dlv h ARG 26 Ca -0.46 0.04 0.09 0.00 -1.10 0.00 0.00 59.98 58.56 2dlv h ARG 26 Cb 1.21 0.14 -0.10 0.00 -1.39 0.00 0.00 29.97 29.83 2dlv h ARG 26 CO 0.67 -0.40 -0.19 0.22 2.80 0.00 0.00 179.97 183.07 2dlv h ASP 27 N -0.77 -0.67 -0.01 -3.80 3.58 -1.93 -0.70 116.42 112.12 2dlv h ASP 27 Ca -0.06 0.17 0.03 0.00 0.42 0.00 0.00 57.03 57.58 2dlv h ASP 27 Cb 0.48 0.38 -0.05 0.00 1.72 0.00 0.00 39.33 41.86 2dlv h ASP 27 CO 0.11 -0.22 -0.33 1.23 -2.88 0.00 0.00 179.24 177.14 2dlv h GLY 28 N -0.09 -0.56 0.36 -0.78 0.00 -1.76 -1.47 103.07 98.77 2dlv h GLY 28 Ca 0.22 0.40 0.04 0.00 0.00 0.00 0.00 47.33 48.00 2dlv h GLY 28 CO -0.53 -0.23 -0.23 -2.00 0.00 0.00 0.00 176.54 173.55 2dlv h LEU 29 N -0.48 -0.69 -0.16 3.11 5.85 -0.68 -1.50 115.31 120.76 2dlv h LEU 29 Ca 0.06 0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.92 2dlv h LEU 29 Cb 0.57 0.30 -0.06 0.00 0.37 0.00 0.00 40.66 41.85 2dlv h LEU 29 CO -0.28 -0.28 -0.47 -0.33 -0.34 0.00 0.00 178.44 176.74 2dlv h GLU 30 N -0.31 -0.45 -0.79 1.25 5.08 -0.82 -0.89 114.58 117.65 2dlv h GLU 30 Ca 0.09 0.03 0.18 0.00 -1.00 0.00 0.00 59.36 58.66 2dlv h GLU 30 Cb 0.44 0.10 -0.12 0.00 0.50 0.00 0.00 28.75 29.67 2dlv h GLU 30 CO -0.27 -0.30 0.23 0.00 -1.00 0.00 0.00 179.01 177.66 2dlv h ALA 31 N -0.42 1.09 -0.57 3.43 0.00 -1.06 0.47 119.26 122.20 2dlv h ALA 31 Ca 0.03 0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.20 2dlv h ALA 31 Cb 0.57 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 2dlv h ALA 31 CO -0.40 -0.35 0.23 0.35 0.00 0.00 0.00 179.25 179.08 2dlv h PHE 32 N 0.29 0.41 -0.14 0.00 3.57 -0.13 -2.41 116.94 118.52 2dlv h PHE 32 Ca 0.46 0.03 0.04 0.00 3.53 0.00 0.00 57.97 62.03 2dlv h PHE 32 Cb 0.83 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.43 2dlv h PHE 32 CO -0.24 0.14 -0.10 1.15 -2.23 0.00 0.00 178.31 177.03 2dlv h THR 33 N 0.43 0.71 -0.78 4.41 2.02 0.23 -2.56 112.91 117.38 2dlv h THR 33 Ca 0.28 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.60 2dlv h THR 33 Cb 0.29 0.71 -0.14 0.00 -1.74 0.00 0.00 68.15 67.27 2dlv h THR 33 CO -0.26 0.00 -0.26 0.03 0.37 0.00 0.00 175.52 175.40 2dlv h ARG 34 N -0.10 -0.04 -0.91 6.66 3.08 -1.04 0.53 114.38 122.56 2dlv h ARG 34 Ca 0.09 0.00 0.19 0.00 0.07 0.00 0.00 59.98 60.33 2dlv h ARG 34 Cb 0.23 0.01 -0.11 0.00 0.08 0.00 0.00 29.97 30.18 2dlv h ARG 34 CO -0.21 -0.03 0.46 0.35 -1.07 0.00 0.00 179.97 179.48 2dlv h PHE 35 N -0.04 0.80 -0.05 3.04 3.57 -1.35 -1.10 116.94 121.81 2dlv h PHE 35 Ca 0.34 0.04 -0.15 0.00 3.53 0.00 0.00 57.97 61.73 2dlv h PHE 35 Cb 0.58 -0.21 0.01 0.00 2.79 0.00 0.00 35.95 39.12 2dlv h PHE 35 CO -0.67 0.09 -0.55 -0.07 -2.23 0.00 0.00 178.31 174.88 2dlv h LEU 36 N 0.55 0.57 -0.95 0.59 3.38 -0.07 -3.20 115.31 116.19 2dlv h LEU 36 Ca 0.54 -0.70 0.27 0.00 0.09 0.00 0.00 57.88 58.08 2dlv h LEU 36 Cb 0.91 -0.17 -0.14 0.00 0.09 0.00 0.00 40.66 41.35 2dlv h LEU 36 CO -0.44 1.18 0.44 0.11 0.09 0.00 0.00 178.44 179.82 2dlv h LYS 37 N 0.01 0.33 -0.30 1.13 1.57 0.80 0.62 116.57 120.73 2dlv h LYS 37 Ca -0.05 -0.02 -0.12 0.00 -1.87 0.00 0.00 60.65 58.59 2dlv h LYS 37 Cb 1.22 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 2dlv h LYS 37 CO 0.11 0.22 -0.30 1.79 -0.57 0.00 0.00 179.45 180.70 2dlv h THR 38 N 0.34 1.28 -0.41 -0.16 1.35 -1.44 -2.59 112.91 111.28 2dlv h THR 38 Ca 0.64 -1.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 2dlv h THR 38 Cb 1.33 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 2dlv h THR 38 CO -0.59 0.45 0.00 -0.62 -0.25 0.00 0.00 175.52 174.52 2dlv n GLU 39 N -4.08 2.68 -3.16 4.72 1.02 0.18 -4.90 120.64 117.09 2dlv n GLU 39 Ca -0.01 -1.79 -0.21 0.00 -0.02 0.00 0.00 57.16 55.13 2dlv n GLU 39 Cb 0.46 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 30.24 2dlv n GLU 39 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2dlv n PHE 40 N 0.64 -1.76 0.32 -0.32 3.01 0.87 -4.81 117.46 115.42 2dlv n PHE 40 Ca 0.16 0.40 0.06 0.00 1.01 0.00 0.00 57.45 59.08 2dlv n PHE 40 Cb 0.59 -3.12 -0.08 0.00 -0.01 0.00 0.00 39.48 36.86 2dlv n PHE 40 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2dlv n SER 41 N -2.24 1.25 -0.33 4.37 7.64 -0.13 -4.61 113.62 119.57 2dlv n SER 41 Ca -0.05 -0.46 0.15 0.00 1.01 0.00 0.00 58.87 59.51 2dlv n SER 41 Cb 0.56 1.21 0.30 0.00 -1.01 0.00 0.00 64.21 65.28 2dlv n SER 41 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 2dlv h GLU 42 N 0.00 0.05 -1.17 1.43 -0.00 -1.83 0.30 114.58 113.36 2dlv h GLU 42 Ca 0.00 -0.00 0.37 0.00 -0.00 0.00 0.00 59.36 59.72 2dlv h GLU 42 Cb 0.38 -0.01 -0.08 0.00 -0.00 0.00 0.00 28.75 29.04 2dlv h GLU 42 CO 0.00 0.03 0.80 -0.85 -0.00 0.00 0.00 179.01 178.99 2dlv n GLU 43 N -5.42 -0.01 0.24 1.06 0.00 -1.26 0.13 120.64 115.38 2dlv n GLU 43 Ca 0.23 0.82 -0.14 0.00 0.00 0.00 0.00 57.16 58.07 2dlv n GLU 43 Cb 0.76 -1.74 -0.07 0.00 0.00 0.00 0.00 31.44 30.38 2dlv n GLU 43 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 2dlv h ASN 44 N 0.00 -0.54 0.12 -1.84 2.35 -0.70 -3.09 115.58 111.87 2dlv h ASN 44 Ca 0.64 -0.08 -0.02 0.00 -0.55 0.00 0.00 56.30 56.28 2dlv h ASN 44 Cb 2.30 0.14 -0.00 0.00 0.05 0.00 0.00 38.32 40.81 2dlv h ASN 44 CO -0.18 -0.18 -0.11 -0.29 -1.65 0.00 0.00 177.43 175.03 2dlv h ILE 45 N -0.96 1.02 -0.76 2.81 6.09 0.89 -2.53 117.51 124.06 2dlv h ILE 45 Ca -0.07 -0.37 0.11 0.00 -1.37 0.00 0.00 64.86 63.16 2dlv h ILE 45 Cb 0.59 1.20 -0.08 0.00 0.47 0.00 0.00 36.82 39.01 2dlv h ILE 45 CO 0.11 0.10 0.38 -0.33 -3.07 0.00 0.00 178.15 175.35 2dlv h GLU 46 N 0.00 0.61 -0.16 2.19 5.08 -1.03 -1.57 114.58 119.69 2dlv h GLU 46 Ca -0.00 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 2dlv h GLU 46 Cb 0.20 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 2dlv h GLU 46 CO 0.01 0.40 -0.23 0.35 -1.00 0.00 0.00 179.01 178.55 2dlv h PHE 47 N 0.62 0.54 -0.66 4.33 3.04 -1.43 -2.47 116.94 120.92 2dlv h PHE 47 Ca 0.38 -0.18 0.13 0.00 3.98 0.00 0.00 57.97 62.29 2dlv h PHE 47 Cb 0.44 -0.11 -0.10 0.00 2.56 0.00 0.00 35.95 38.75 2dlv h PHE 47 CO -0.10 0.85 0.12 2.35 -2.02 0.00 0.00 178.31 179.51 2dlv h TRP 48 N 0.08 0.18 -0.03 0.41 7.01 -1.29 -1.93 115.95 120.37 2dlv h TRP 48 Ca 0.02 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.05 2dlv h TRP 48 Cb 0.79 0.02 -0.00 0.00 -2.10 0.00 0.00 29.16 27.87 2dlv h TRP 48 CO 0.09 -0.08 -0.00 0.82 -2.79 0.00 0.00 178.44 176.48 2dlv h ILE 49 N 0.24 1.26 -0.94 2.65 2.04 -1.32 -3.07 117.51 118.37 2dlv h ILE 49 Ca 0.35 -0.80 0.37 0.00 1.00 0.00 0.00 64.86 65.78 2dlv h ILE 49 Cb 0.57 1.74 -0.17 0.00 -0.74 0.00 0.00 36.82 38.22 2dlv h ILE 49 CO -0.47 0.22 0.42 0.00 0.00 0.00 0.00 178.15 178.32 2dlv n ALA 50 N -2.28 0.88 0.46 1.87 0.00 -0.75 -0.23 120.51 120.46 2dlv n ALA 50 Ca -0.07 0.97 -0.19 0.00 0.00 0.00 0.00 53.44 54.15 2dlv n ALA 50 Cb 0.19 -0.92 -0.09 0.00 0.00 0.00 0.00 19.45 18.63 2dlv n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dlv h GLU 52 N -1.24 0.13 0.16 0.00 4.39 -0.66 0.70 114.58 118.07 2dlv h GLU 52 Ca -0.12 -0.01 -0.31 0.00 0.34 0.00 0.00 59.36 59.26 2dlv h GLU 52 Cb 0.90 -0.03 0.01 0.00 -0.10 0.00 0.00 28.75 29.53 2dlv h GLU 52 CO 0.19 0.08 -1.50 0.22 -1.16 0.00 0.00 179.01 176.85 2dlv h ASP 53 N 0.13 0.54 -0.63 1.42 1.82 -1.20 -3.14 116.42 115.36 2dlv h ASP 53 Ca 0.80 -0.67 0.04 0.00 -0.39 0.00 0.00 57.03 56.81 2dlv h ASP 53 Cb 2.10 -0.18 -0.04 0.00 0.68 0.00 0.00 39.33 41.89 2dlv h ASP 53 CO -0.66 1.55 0.38 0.15 -1.61 0.00 0.00 179.24 179.05 2dlv h PHE 54 N 0.09 0.70 -0.51 0.28 3.04 0.54 -2.43 116.94 118.66 2dlv h PHE 54 Ca -0.24 0.02 -0.11 0.00 3.98 0.00 0.00 57.97 61.63 2dlv h PHE 54 Cb 2.06 -0.22 -0.02 0.00 2.56 0.00 0.00 35.95 40.33 2dlv h PHE 54 CO 0.08 0.38 -0.10 1.57 -2.02 0.00 0.00 178.31 178.23 2dlv h LYS 55 N 0.73 0.96 -1.59 1.11 2.10 -0.92 -2.87 116.57 116.09 2dlv h LYS 55 Ca 0.26 -0.35 0.46 0.00 -2.00 0.00 0.00 60.65 59.02 2dlv h LYS 55 Cb 0.07 -0.06 -0.07 0.00 -0.90 0.00 0.00 32.23 31.27 2dlv h LYS 55 CO -0.12 1.02 1.14 0.87 -2.00 0.00 0.00 179.45 180.36 2dlv h LYS 56 N 0.82 0.01 -6.69 0.07 1.57 -1.38 -3.41 116.57 107.57 2dlv h LYS 56 Ca 0.13 -0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.34 2dlv h LYS 56 Cb 0.65 -0.00 0.18 0.00 0.08 0.00 0.00 32.23 33.14 2dlv h LYS 56 CO 0.04 0.01 -0.24 0.45 -0.57 0.00 0.00 179.45 179.14 2dlv n SER 57 N -4.08 -0.58 -0.01 0.86 2.88 -1.08 -4.95 113.62 106.65 2dlv n SER 57 Ca 0.36 0.68 -0.02 0.00 -1.33 0.00 0.00 58.87 58.56 2dlv n SER 57 Cb 1.64 -1.26 -0.01 0.00 -0.75 0.00 0.00 64.21 63.83 2dlv n SER 57 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2dlv n LYS 58 N -0.75 1.03 -2.27 -1.46 5.02 -1.26 -5.05 118.16 113.41 2dlv n LYS 58 Ca 0.12 0.01 -0.28 0.00 -2.02 0.00 0.00 58.31 56.14 2dlv n LYS 58 Cb 0.49 -1.06 0.03 0.00 -0.02 0.00 0.00 35.03 34.47 2dlv n LYS 58 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2dlv s GLY 59 N -4.00 1.60 -0.02 0.72 0.00 -1.26 -5.03 107.32 99.33 2dlv s GLY 59 Ca -0.03 -0.52 -0.24 0.00 0.00 0.00 0.00 44.72 43.93 2dlv s GLY 59 CO 0.07 -0.25 1.10 -0.56 0.00 0.00 0.00 173.10 173.46 2dlv h PRO 60 N -0.22 -0.25 0.00 2.90 0.13 -2.00 -3.30 132.00 129.26 2dlv h PRO 60 Ca -0.45 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2dlv h PRO 60 Cb 1.24 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2dlv h PRO 60 CO 0.62 0.14 0.00 1.04 -0.23 0.00 0.00 178.00 179.57 2dlv n GLN 61 N -5.00 0.00 -0.25 0.86 1.13 -1.26 -0.37 117.38 112.50 2dlv n GLN 61 Ca -0.09 0.94 0.13 0.00 -1.94 0.00 0.00 57.00 56.04 2dlv n GLN 61 Cb 0.26 -1.46 0.24 0.00 0.11 0.00 0.00 30.24 29.39 2dlv n GLN 61 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 2dlv n GLN 62 N -2.80 -0.06 -0.15 -1.09 -0.06 -1.26 0.23 117.38 112.21 2dlv n GLN 62 Ca 0.00 1.08 -0.08 0.00 -2.00 0.00 0.00 57.00 55.99 2dlv n GLN 62 Cb 0.00 -1.74 0.00 0.00 -4.06 0.00 0.00 30.24 24.44 2dlv n GLN 62 CO 0.00 0.00 0.00 0.82 -0.20 0.00 0.00 177.06 177.68 2dlv h ILE 63 N 0.00 1.18 -0.41 1.69 2.04 -0.78 0.35 117.51 121.57 2dlv h ILE 63 Ca 0.47 -0.50 -0.12 0.00 1.00 0.00 0.00 64.86 65.70 2dlv h ILE 63 Cb 1.01 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 2dlv h ILE 63 CO -0.67 0.19 -0.23 0.45 0.00 0.00 0.00 178.15 177.90 2dlv h HIS 64 N 0.56 1.02 0.57 1.37 3.86 0.42 -1.64 115.15 121.31 2dlv h HIS 64 Ca 0.15 -0.26 -0.03 0.00 -1.16 0.00 0.00 60.37 59.07 2dlv h HIS 64 Cb 0.11 -0.23 0.01 0.00 1.06 0.00 0.00 27.41 28.36 2dlv h HIS 64 CO -0.01 1.05 -0.27 -0.07 0.86 0.00 0.00 177.93 179.49 2dlv h LEU 65 N 0.70 -0.65 -0.54 2.43 4.07 -0.13 -3.05 115.31 118.13 2dlv h LEU 65 Ca 0.09 -0.01 0.11 0.00 0.08 0.00 0.00 57.88 58.14 2dlv h LEU 65 Cb 0.80 0.17 -0.09 0.00 1.08 0.00 0.00 40.66 42.62 2dlv h LEU 65 CO 0.07 -0.25 0.03 0.11 -1.08 0.00 0.00 178.44 177.32 2dlv h LYS 66 N -1.15 0.14 -0.60 1.13 1.57 -0.40 -1.78 116.57 115.49 2dlv h LYS 66 Ca -0.08 -0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.80 2dlv h LYS 66 Cb 0.62 -0.03 -0.12 0.00 0.08 0.00 0.00 32.23 32.78 2dlv h LYS 66 CO 0.13 0.10 -0.31 0.00 -0.57 0.00 0.00 179.45 178.79 2dlv h ALA 67 N 1.47 0.01 -0.30 3.86 0.00 -1.35 0.26 119.26 123.22 2dlv h ALA 67 Ca 0.28 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.38 2dlv h ALA 67 Cb 0.43 0.75 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2dlv h ALA 67 CO -0.44 -0.65 0.15 -0.22 0.00 0.00 0.00 179.25 178.10 2dlv h LYS 68 N -0.15 0.31 0.69 0.00 3.64 -1.23 -0.07 116.57 119.75 2dlv h LYS 68 Ca 0.24 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.58 2dlv h LYS 68 Cb 0.55 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 2dlv h LYS 68 CO -0.68 0.20 -0.50 0.00 -2.27 0.00 0.00 179.45 176.20 2dlv h ALA 69 N 1.15 -1.23 -0.86 5.00 0.00 -0.40 -1.98 119.26 120.94 2dlv h ALA 69 Ca 0.12 -0.23 0.14 0.00 0.00 0.00 0.00 54.91 54.94 2dlv h ALA 69 Cb 0.03 0.67 -0.07 0.00 0.00 0.00 0.00 17.79 18.43 2dlv h ALA 69 CO -0.08 -1.22 0.56 0.82 0.00 0.00 0.00 179.25 179.33 2dlv h ILE 70 N -1.14 0.84 0.36 0.00 2.04 -0.50 -2.11 117.51 117.00 2dlv h ILE 70 Ca -0.09 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.53 2dlv h ILE 70 Cb 0.94 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 2dlv h ILE 70 CO 0.04 0.12 -0.24 0.22 0.00 0.00 0.00 178.15 178.29 2dlv h TYR 71 N 0.65 -0.65 0.00 1.37 5.03 -0.54 -0.36 116.97 122.48 2dlv h TYR 71 Ca 0.43 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.73 2dlv h TYR 71 Cb 0.72 0.23 0.00 0.00 1.55 0.00 0.00 36.73 39.23 2dlv h TYR 71 CO -0.00 -0.35 0.00 0.39 -1.32 0.00 0.00 178.16 176.88 2dlv n GLU 72 N -3.80 0.13 -0.10 1.82 1.02 -0.79 0.41 120.64 119.33 2dlv n GLU 72 Ca -0.07 0.03 -0.16 0.00 -0.02 0.00 0.00 57.16 56.94 2dlv n GLU 72 Cb 0.24 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 30.09 2dlv n GLU 72 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 2dlv n LYS 73 N -1.03 0.53 -0.01 3.49 4.81 -0.56 -4.30 118.16 121.09 2dlv n LYS 73 Ca 0.03 0.47 -0.02 0.00 -0.87 0.00 0.00 58.31 57.92 2dlv n LYS 73 Cb 0.02 -1.65 -0.01 0.00 0.02 0.00 0.00 35.03 33.40 2dlv n LYS 73 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 2dlv n PHE 74 N -4.47 0.00 0.03 5.64 3.01 -0.25 -2.28 117.46 119.14 2dlv n PHE 74 Ca -0.26 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.19 2dlv n PHE 74 Cb 0.56 -0.10 -0.01 0.00 -0.01 0.00 0.00 39.48 39.93 2dlv n PHE 74 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 2dlv h ILE 75 N -0.01 0.00 -3.29 4.37 1.08 -0.11 -3.22 117.51 116.34 2dlv h ILE 75 Ca -0.06 0.00 -0.58 0.00 -0.39 0.00 0.00 64.86 63.84 2dlv h ILE 75 Cb 1.08 0.00 0.14 0.00 -3.07 0.00 0.00 36.82 34.97 2dlv h ILE 75 CO -0.01 0.00 0.20 0.00 -0.69 0.00 0.00 178.15 177.65 2dlv n GLN 76 N -2.59 1.32 -0.07 2.37 10.64 0.87 -4.91 117.38 125.02 2dlv n GLN 76 Ca -0.01 0.48 -0.13 0.00 -1.83 0.00 0.00 57.00 55.51 2dlv n GLN 76 Cb 0.05 -2.13 -0.01 0.00 -0.86 0.00 0.00 30.24 27.28 2dlv n GLN 76 CO 0.00 0.00 0.00 1.15 -1.83 0.00 0.00 177.06 176.38 2dlv h THR 77 N 1.34 1.28 0.00 -0.39 2.02 -1.90 -2.87 112.91 112.39 2dlv h THR 77 Ca -0.46 -1.69 0.00 0.00 0.77 0.00 0.00 66.41 65.03 2dlv h THR 77 Cb 1.34 1.58 0.00 0.00 -1.74 0.00 0.00 68.15 69.33 2dlv h THR 77 CO 0.56 0.55 0.00 -0.67 0.37 0.00 0.00 175.52 176.33 2dlv n ASP 78 N -4.01 0.46 -4.85 4.18 2.03 -1.26 -4.76 116.55 108.33 2dlv n ASP 78 Ca -0.03 -1.13 -0.36 0.00 0.52 0.00 0.00 54.79 53.79 2dlv n ASP 78 Cb 0.60 -0.23 -0.06 0.00 -0.72 0.00 0.00 41.12 40.71 2dlv n ASP 78 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dlv s ALA 79 N -1.19 3.68 0.23 -1.67 0.00 -1.08 -4.99 121.76 116.74 2dlv s ALA 79 Ca 0.00 -0.26 0.22 0.00 0.00 0.00 0.00 51.96 51.92 2dlv s ALA 79 Cb 0.00 -2.37 0.96 0.00 0.00 0.00 0.00 23.12 21.70 2dlv s ALA 79 CO 0.00 0.51 1.86 -1.00 0.00 0.00 0.00 175.76 177.12 2dlv h PRO 80 N 4.06 0.00 -0.37 0.00 0.13 -1.82 -2.79 132.00 131.22 2dlv h PRO 80 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2dlv h PRO 80 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2dlv h PRO 80 CO 0.64 0.26 0.00 1.63 -0.23 0.00 0.00 178.00 180.30 2dlv n LYS 81 N -3.55 3.34 -1.43 0.86 4.76 -0.97 -5.00 118.16 116.18 2dlv n LYS 81 Ca -0.01 -2.79 -0.52 0.00 -2.87 0.00 0.00 58.31 52.12 2dlv n LYS 81 Cb 0.41 -1.84 -0.08 0.00 -1.84 0.00 0.00 35.03 31.68 2dlv n LYS 81 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 2dlv n GLU 82 N 0.00 0.95 -2.74 1.97 0.00 -1.05 -4.40 120.64 115.36 2dlv n GLU 82 Ca 0.21 0.26 -0.22 0.00 0.00 0.00 0.00 57.16 57.42 2dlv n GLU 82 Cb 0.88 -2.33 0.08 0.00 0.00 0.00 0.00 31.44 30.06 2dlv n GLU 82 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.13 177.27 2dlv s VAL 83 N 7.03 2.26 -0.49 6.31 -7.23 -1.22 -5.03 120.40 122.04 2dlv s VAL 83 Ca 1.10 -0.74 -0.26 0.00 -1.81 0.00 0.00 61.98 60.28 2dlv s VAL 83 Cb -0.94 -2.52 0.03 0.00 0.56 0.00 0.00 36.38 33.50 2dlv s VAL 83 CO 0.52 0.00 0.97 0.21 -0.31 0.00 0.00 175.10 176.49 2dlv s ASN 84 N -4.65 6.48 0.04 4.85 2.47 -1.26 -4.96 114.94 117.91 2dlv s ASN 84 Ca 0.63 0.07 0.07 0.00 0.42 0.00 0.00 52.86 54.05 2dlv s ASN 84 Cb -0.06 -2.47 -0.02 0.00 -1.45 0.00 0.00 41.25 37.25 2dlv s ASN 84 CO 0.41 -1.14 -0.20 -0.76 -3.72 0.00 0.00 177.10 171.69 2dlv s LEU 85 N 3.96 2.16 0.87 3.21 1.43 -1.26 -4.84 118.68 124.21 2dlv s LEU 85 Ca 0.37 -0.51 -0.11 0.00 -1.03 0.00 0.00 54.13 52.86 2dlv s LEU 85 Cb -0.10 -0.96 0.12 0.00 0.03 0.00 0.00 46.19 45.28 2dlv s LEU 85 CO 0.26 0.16 1.11 1.51 0.23 0.00 0.00 176.35 179.61 2dlv s ASP 86 N -1.14 3.53 0.06 2.29 -4.77 -1.26 -4.81 116.67 110.57 2dlv s ASP 86 Ca 0.07 1.86 -0.28 0.00 -3.30 0.00 0.00 52.55 50.90 2dlv s ASP 86 Cb -0.09 -2.46 -0.17 0.00 -1.09 0.00 0.00 42.92 39.11 2dlv s ASP 86 CO 0.02 -2.66 1.59 0.15 0.70 0.00 0.00 175.17 174.96 2dlv h PHE 87 N -1.56 -0.48 0.06 2.11 3.57 -2.00 -1.29 116.94 117.35 2dlv h PHE 87 Ca -0.46 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.04 2dlv h PHE 87 Cb 1.26 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 40.14 2dlv h PHE 87 CO 0.50 -0.26 -0.22 1.25 -2.23 0.00 0.00 178.31 177.36 2dlv h HIS 88 N -0.58 -0.63 -0.40 0.41 2.76 -1.99 0.79 115.15 115.52 2dlv h HIS 88 Ca -0.05 0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.19 2dlv h HIS 88 Cb 0.44 0.27 -0.08 0.00 1.55 0.00 0.00 27.41 29.58 2dlv h HIS 88 CO -0.03 -0.25 -0.52 1.15 -1.30 0.00 0.00 177.93 176.98 2dlv h THR 89 N -0.32 0.03 -0.86 6.26 2.02 -1.95 0.36 112.91 118.45 2dlv h THR 89 Ca -0.00 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.38 2dlv h THR 89 Cb 0.31 0.03 -0.12 0.00 -1.74 0.00 0.00 68.15 66.63 2dlv h THR 89 CO -0.11 0.00 0.33 0.50 0.37 0.00 0.00 175.52 176.61 2dlv h LYS 90 N -0.38 0.34 0.40 6.66 3.64 -1.07 -1.73 116.57 124.43 2dlv h LYS 90 Ca 0.09 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 2dlv h LYS 90 Cb 0.60 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 2dlv h LYS 90 CO -0.59 0.23 -0.19 1.49 -2.27 0.00 0.00 179.45 178.12 2dlv h GLU 91 N 0.35 -0.51 -0.80 1.90 4.57 0.14 -2.06 114.58 118.16 2dlv h GLU 91 Ca 0.53 0.03 0.25 0.00 -1.18 0.00 0.00 59.36 58.99 2dlv h GLU 91 Cb 0.99 0.12 -0.15 0.00 -0.16 0.00 0.00 28.75 29.55 2dlv h GLU 91 CO -0.54 -0.34 0.12 0.28 -1.18 0.00 0.00 179.01 177.35 2dlv n VAL 92 N -4.10 -0.34 -0.07 0.32 0.31 0.10 0.15 118.33 114.71 2dlv n VAL 92 Ca -0.07 1.74 -0.13 0.00 -0.01 0.00 0.00 64.34 65.87 2dlv n VAL 92 Cb 0.21 -2.60 -0.06 0.00 -0.91 0.00 0.00 33.84 30.48 2dlv n VAL 92 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2dlv h ILE 93 N 0.00 1.32 -0.73 2.52 2.04 -1.34 0.61 117.51 121.93 2dlv h ILE 93 Ca 0.54 -1.21 0.14 0.00 1.00 0.00 0.00 64.86 65.33 2dlv h ILE 93 Cb 1.20 1.69 -0.09 0.00 -0.74 0.00 0.00 36.82 38.88 2dlv h ILE 93 CO -0.72 0.36 0.27 0.74 0.00 0.00 0.00 178.15 178.80 2dlv h THR 94 N 0.11 0.65 0.03 -0.27 2.02 0.21 1.40 112.91 117.05 2dlv h THR 94 Ca 0.04 -0.14 -0.27 0.00 0.77 0.00 0.00 66.41 66.81 2dlv h THR 94 Cb 0.62 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.20 2dlv h THR 94 CO 0.03 0.08 -1.44 0.78 0.37 0.00 0.00 175.52 175.34 2dlv h ASN 95 N 0.41 0.09 -0.41 4.18 2.35 -1.20 -3.30 115.58 117.70 2dlv h ASN 95 Ca 0.40 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 2dlv h ASN 95 Cb 0.61 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.95 2dlv h ASN 95 CO -0.41 1.11 0.00 -1.20 -1.65 0.00 0.00 177.43 175.29 2dlv n SER 96 N -3.24 3.92 0.00 5.81 7.64 0.21 -4.16 113.62 123.80 2dlv n SER 96 Ca -0.11 -2.51 0.10 0.00 1.01 0.00 0.00 58.87 57.36 2dlv n SER 96 Cb 1.01 -0.57 0.44 0.00 -1.01 0.00 0.00 64.21 64.08 2dlv n SER 96 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dlv n ILE 97 N 0.53 0.59 0.15 0.44 0.13 0.47 -2.08 119.36 119.59 2dlv n ILE 97 Ca 0.18 0.14 0.08 0.00 -1.10 0.00 0.00 62.75 62.05 2dlv n ILE 97 Cb 0.80 -0.79 -0.11 0.00 -0.84 0.00 0.00 39.64 38.70 2dlv n ILE 97 CO 0.00 0.00 0.00 1.07 2.80 0.00 0.00 176.55 180.42 2dlv n THR 98 N -1.51 0.00 -1.53 9.51 5.66 -1.26 -4.46 114.28 120.69 2dlv n THR 98 Ca 0.05 -0.31 0.03 0.00 -3.05 0.00 0.00 64.05 60.78 2dlv n THR 98 Cb 0.24 0.34 0.20 0.00 -1.55 0.00 0.00 70.33 69.57 2dlv n THR 98 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2dlv n GLN 99 N -1.88 1.66 -1.79 1.09 10.64 -1.10 -5.06 117.38 120.94 2dlv n GLN 99 Ca -0.02 -3.24 -0.33 0.00 -1.83 0.00 0.00 57.00 51.58 2dlv n GLN 99 Cb 0.36 -1.67 0.04 0.00 -0.86 0.00 0.00 30.24 28.12 2dlv n GLN 99 CO 0.00 0.00 0.00 -1.25 -1.83 0.00 0.00 177.06 173.98 2dlv s PRO 100 N -3.22 2.84 0.35 2.61 0.04 -0.88 -5.04 135.00 131.69 2dlv s PRO 100 Ca 0.40 1.41 0.05 0.00 0.04 0.00 0.00 61.00 62.90 2dlv s PRO 100 Cb 0.38 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.93 2dlv s PRO 100 CO -0.05 -1.22 0.21 0.95 0.04 0.00 0.00 177.00 176.93 2dlv s THR 101 N -2.30 0.23 0.40 1.26 -4.23 -1.26 -4.92 115.64 104.82 2dlv s THR 101 Ca 0.67 -2.00 0.27 0.00 -1.18 0.00 0.00 61.69 59.45 2dlv s THR 101 Cb -0.21 -2.44 0.29 0.00 1.34 0.00 0.00 72.50 71.48 2dlv s THR 101 CO 0.40 0.00 2.06 -0.07 -0.54 0.00 0.00 174.62 176.47 2dlv h LEU 102 N 2.05 0.00 -3.31 4.79 3.38 -1.93 -1.69 115.31 118.60 2dlv h LEU 102 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2dlv h LEU 102 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2dlv h LEU 102 CO 0.46 0.12 0.00 1.41 0.09 0.00 0.00 178.44 180.52 2dlv n HIS 103 N -3.64 1.42 -0.00 1.13 8.25 -1.26 -4.63 115.22 116.49 2dlv n HIS 103 Ca -0.02 -0.74 -0.00 0.00 -0.26 0.00 0.00 57.72 56.71 2dlv n HIS 103 Cb 0.25 -0.34 -0.00 0.00 1.12 0.00 0.00 29.99 31.01 2dlv n HIS 103 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2dlv h SER 104 N 3.10 0.00 -1.41 0.41 0.02 -1.69 -3.37 113.55 110.61 2dlv h SER 104 Ca 0.00 0.00 0.43 0.00 -0.84 0.00 0.00 61.79 61.38 2dlv h SER 104 Cb 1.58 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 64.01 2dlv h SER 104 CO 0.30 0.02 0.95 -0.26 -1.14 0.00 0.00 176.83 176.70 2dlv h PHE 105 N -0.03 0.36 -0.75 3.45 0.04 -1.82 -0.55 116.94 117.64 2dlv h PHE 105 Ca 0.00 0.02 0.20 0.00 2.80 0.00 0.00 57.97 60.99 2dlv h PHE 105 Cb 0.01 -0.09 -0.14 0.00 2.20 0.00 0.00 35.95 37.93 2dlv h PHE 105 CO -0.00 -0.11 0.01 -3.47 -0.60 0.00 0.00 178.31 174.13 2dlv n ASP 106 N -4.47 -0.10 0.35 2.17 2.03 -1.26 0.37 116.55 115.65 2dlv n ASP 106 Ca 0.36 1.27 -0.18 0.00 0.52 0.00 0.00 54.79 56.76 2dlv n ASP 106 Cb 1.47 -0.46 -0.09 0.00 -0.72 0.00 0.00 41.12 41.32 2dlv n ASP 106 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dlv h ALA 107 N 1.50 -1.10 -0.85 -1.67 0.00 -1.33 -2.48 119.26 113.33 2dlv h ALA 107 Ca 0.45 -0.20 0.10 0.00 0.00 0.00 0.00 54.91 55.25 2dlv h ALA 107 Cb 0.92 0.60 -0.07 0.00 0.00 0.00 0.00 17.79 19.24 2dlv h ALA 107 CO -0.71 -1.14 0.49 0.00 0.00 0.00 0.00 179.25 177.89 2dlv h ALA 108 N -0.84 1.22 -0.85 0.00 0.00 -0.26 -1.53 119.26 117.00 2dlv h ALA 108 Ca -0.08 0.03 0.16 0.00 0.00 0.00 0.00 54.91 55.03 2dlv h ALA 108 Cb 0.86 -0.14 -0.10 0.00 0.00 0.00 0.00 17.79 18.41 2dlv h ALA 108 CO 0.03 0.12 0.41 0.37 0.00 0.00 0.00 179.25 180.17 2dlv h GLN 109 N 0.82 0.54 -0.53 0.00 4.15 -0.57 -1.26 115.11 118.26 2dlv h GLN 109 Ca 0.41 -0.03 0.11 0.00 0.77 0.00 0.00 58.65 59.90 2dlv h GLN 109 Cb 0.38 -0.12 -0.10 0.00 0.21 0.00 0.00 27.48 27.85 2dlv h GLN 109 CO -0.25 0.36 -0.12 1.03 -1.93 0.00 0.00 178.83 177.92 2dlv h SER 110 N 0.55 -0.47 0.03 -0.69 0.87 -0.83 0.24 113.55 113.26 2dlv h SER 110 Ca 0.48 0.16 0.03 0.00 -1.23 0.00 0.00 61.79 61.22 2dlv h SER 110 Cb 0.74 0.32 -0.05 0.00 -0.44 0.00 0.00 62.40 62.96 2dlv h SER 110 CO -0.40 -0.17 -0.41 0.03 -0.53 0.00 0.00 176.83 175.35 2dlv h ARG 111 N 0.01 -0.57 -0.69 2.24 2.47 -1.29 0.61 114.38 117.17 2dlv h ARG 111 Ca 0.26 0.04 0.03 0.00 -1.26 0.00 0.00 59.98 59.05 2dlv h ARG 111 Cb 0.40 0.13 -0.04 0.00 -1.65 0.00 0.00 29.97 28.80 2dlv h ARG 111 CO -0.54 -0.38 0.43 0.28 0.56 0.00 0.00 179.97 180.32 2dlv h VAL 112 N -0.59 1.09 -0.47 2.04 2.07 -1.30 0.34 116.25 119.43 2dlv h VAL 112 Ca 0.04 -0.29 0.05 0.00 0.82 0.00 0.00 66.70 67.33 2dlv h VAL 112 Cb 0.65 0.17 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 2dlv h VAL 112 CO -0.29 0.15 0.19 0.22 0.02 0.00 0.00 177.57 177.86 2dlv h TYR 113 N 0.84 0.35 -0.03 1.57 3.20 0.12 -1.72 116.97 121.30 2dlv h TYR 113 Ca 0.28 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.14 2dlv h TYR 113 Cb 0.03 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.21 2dlv h TYR 113 CO -0.04 0.14 -0.11 1.96 -1.64 0.00 0.00 178.16 178.47 2dlv h GLN 114 N 0.39 0.13 -0.99 1.82 4.20 -0.45 -2.13 115.11 118.07 2dlv h GLN 114 Ca 0.22 -0.10 0.28 0.00 0.06 0.00 0.00 58.65 59.11 2dlv h GLN 114 Cb 0.19 0.02 -0.14 0.00 0.30 0.00 0.00 27.48 27.85 2dlv h GLN 114 CO -0.20 0.73 0.55 -0.07 -0.67 0.00 0.00 178.83 179.18 2dlv h LEU 115 N -0.45 0.54 0.16 1.46 3.38 -0.13 0.47 115.31 120.74 2dlv h LEU 115 Ca -0.01 0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 2dlv h LEU 115 Cb 0.75 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.61 2dlv h LEU 115 CO 0.02 -0.04 -0.08 0.24 0.09 0.00 0.00 178.44 178.67 2dlv h MET 116 N 0.42 -0.21 -0.14 1.13 2.86 -1.33 -3.25 114.93 114.40 2dlv h MET 116 Ca 0.68 0.01 0.04 0.00 -2.06 0.00 0.00 59.70 58.38 2dlv h MET 116 Cb 1.45 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 33.15 2dlv h MET 116 CO -0.56 -0.14 0.75 1.49 1.06 0.00 0.00 176.91 179.51 2dlv h GLU 117 N -0.99 0.00 0.08 1.72 4.81 -0.83 0.36 114.58 119.73 2dlv h GLU 117 Ca -0.02 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2dlv h GLU 117 Cb 0.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.55 2dlv h GLU 117 CO 0.04 0.00 -0.04 1.96 -0.73 0.00 0.00 179.01 180.24 2dlv h GLN 118 N 0.00 -0.10 0.00 1.92 1.08 -0.95 -3.38 115.11 113.68 2dlv h GLN 118 Ca 0.07 0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.23 2dlv h GLN 118 Cb 1.56 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 29.01 2dlv h GLN 118 CO -0.00 -0.07 -1.15 -0.40 -0.95 0.00 0.00 178.83 176.26 2dlv n ASP 119 N -2.30 3.93 -0.16 1.46 5.68 -0.67 -4.45 116.55 120.05 2dlv n ASP 119 Ca -0.01 -0.01 -0.03 0.00 -0.50 0.00 0.00 54.79 54.23 2dlv n ASP 119 Cb 0.04 0.08 0.03 0.00 -1.14 0.00 0.00 41.12 40.14 2dlv n ASP 119 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 2dlv h SER 120 N 0.00 -0.51 0.60 -1.12 0.02 -0.55 0.13 113.55 112.12 2dlv h SER 120 Ca -0.06 0.15 -0.03 0.00 -0.84 0.00 0.00 61.79 61.01 2dlv h SER 120 Cb 1.10 0.32 0.01 0.00 0.14 0.00 0.00 62.40 63.97 2dlv h SER 120 CO -0.01 -0.18 -0.29 0.22 -1.14 0.00 0.00 176.83 175.44 2dlv h TYR 121 N -0.02 -0.74 -0.90 3.45 3.20 -1.42 -1.59 116.97 118.94 2dlv h TYR 121 Ca 0.24 -0.02 0.22 0.00 3.14 0.00 0.00 58.73 62.31 2dlv h TYR 121 Cb 0.38 0.25 -0.17 0.00 1.54 0.00 0.00 36.73 38.73 2dlv h TYR 121 CO -0.43 -0.46 -0.04 1.79 -1.64 0.00 0.00 178.16 177.37 2dlv h THR 122 N -1.07 0.13 -0.26 1.81 1.35 -1.68 0.29 112.91 113.47 2dlv h THR 122 Ca -0.08 -0.01 -0.02 0.00 -0.55 0.00 0.00 66.41 65.75 2dlv h THR 122 Cb 0.62 0.09 -0.01 0.00 -1.73 0.00 0.00 68.15 67.11 2dlv h THR 122 CO 0.13 0.01 0.10 0.03 -0.25 0.00 0.00 175.52 175.54 2dlv h ARG 123 N 0.04 0.40 -0.97 4.72 3.08 -0.76 -2.80 114.38 118.09 2dlv h ARG 123 Ca 0.50 -0.08 0.24 0.00 0.07 0.00 0.00 59.98 60.72 2dlv h ARG 123 Cb 0.93 -0.06 -0.12 0.00 0.08 0.00 0.00 29.97 30.80 2dlv h ARG 123 CO -0.85 0.44 0.53 0.35 -1.07 0.00 0.00 179.97 179.37 2dlv h PHE 124 N 0.27 0.91 -0.47 3.04 3.57 0.59 0.51 116.94 125.36 2dlv h PHE 124 Ca 0.09 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 2dlv h PHE 124 Cb 0.20 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 2dlv h PHE 124 CO -0.00 0.03 0.17 -0.07 -2.23 0.00 0.00 178.31 176.21 2dlv h LEU 125 N 0.52 0.61 -2.84 0.59 3.38 -1.10 -1.48 115.31 115.00 2dlv h LEU 125 Ca 0.62 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.52 2dlv h LEU 125 Cb 1.18 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2dlv h LEU 125 CO -0.49 0.57 0.00 0.29 0.09 0.00 0.00 178.44 178.89 2dlv n LYS 126 N -4.35 3.48 -3.67 1.13 5.02 0.15 -4.76 118.16 115.17 2dlv n LYS 126 Ca 0.03 -2.58 -0.36 0.00 -2.02 0.00 0.00 58.31 53.38 2dlv n LYS 126 Cb 0.16 -1.84 -0.07 0.00 -0.02 0.00 0.00 35.03 33.26 2dlv n LYS 126 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2dlv s SER 127 N -0.85 6.36 0.23 4.39 1.04 0.23 -4.99 113.70 120.12 2dlv s SER 127 Ca 0.46 0.42 -0.07 0.00 0.48 0.00 0.00 55.95 57.24 2dlv s SER 127 Cb 0.30 -2.13 0.41 0.00 0.10 0.00 0.00 66.02 64.70 2dlv s SER 127 CO 0.22 0.20 1.69 -0.78 0.98 0.00 0.00 173.24 175.55 2dlv h ASP 128 N 6.27 0.01 -0.88 7.02 3.58 -1.91 -0.22 116.42 130.29 2dlv h ASP 128 Ca -0.44 0.14 0.24 0.00 0.42 0.00 0.00 57.03 57.38 2dlv h ASP 128 Cb 1.17 0.18 -0.14 0.00 1.72 0.00 0.00 39.33 42.27 2dlv h ASP 128 CO 0.72 -0.02 0.26 0.40 -2.88 0.00 0.00 179.24 177.72 2dlv h ILE 129 N 0.27 0.32 -0.15 2.25 2.04 -1.94 0.69 117.51 120.99 2dlv h ILE 129 Ca 0.38 -0.08 -0.06 0.00 1.00 0.00 0.00 64.86 66.10 2dlv h ILE 129 Cb 0.63 0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.79 2dlv h ILE 129 CO -0.48 0.04 -0.16 0.22 0.00 0.00 0.00 178.15 177.77 2dlv h TYR 130 N 0.22 0.45 0.00 1.37 3.20 -1.25 -2.36 116.97 118.60 2dlv h TYR 130 Ca 0.56 -0.14 -0.03 0.00 3.14 0.00 0.00 58.73 62.27 2dlv h TYR 130 Cb 1.14 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 39.31 2dlv h TYR 130 CO -0.25 0.77 -0.12 -0.07 -1.64 0.00 0.00 178.16 176.85 2dlv h LEU 131 N -0.00 0.00 0.27 2.82 3.38 -0.35 -3.14 115.31 118.28 2dlv h LEU 131 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2dlv h LEU 131 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2dlv h LEU 131 CO 0.04 0.12 -0.13 -0.78 0.09 0.00 0.00 178.44 177.78 2dlv h ASP 132 N 0.00 -0.30 -0.88 -0.43 3.58 0.40 0.48 116.42 119.27 2dlv h ASP 132 Ca -0.00 0.01 0.33 0.00 0.42 0.00 0.00 57.03 57.79 2dlv h ASP 132 Cb 0.29 0.08 -0.16 0.00 1.72 0.00 0.00 39.33 41.26 2dlv h ASP 132 CO 0.02 0.08 0.32 0.00 -2.88 0.00 0.00 179.24 176.78 2dlv n LEU 133 N -4.63 0.17 0.02 2.28 -0.00 -0.90 0.87 117.00 114.80 2dlv n LEU 133 Ca -0.04 1.47 -0.17 0.00 -0.00 0.00 0.00 56.01 57.27 2dlv n LEU 133 Cb 0.14 -0.66 -0.14 0.00 -0.00 0.00 0.00 43.42 42.76 2dlv n LEU 133 CO 0.11 -1.59 -0.60 0.00 -0.00 0.00 0.00 177.39 175.31 2dlv h MET 134 N 0.00 0.20 -6.32 1.47 -0.00 -1.62 -3.34 114.93 105.32 2dlv h MET 134 Ca 0.68 -0.33 -0.47 0.00 -0.00 0.00 0.00 59.70 59.57 2dlv h MET 134 Cb 1.68 0.12 -0.03 0.00 -0.00 0.00 0.00 31.60 33.37 2dlv h MET 134 CO -0.73 1.00 -0.80 0.45 -0.00 0.00 0.00 176.91 176.83 2dlv n SER 135 N -3.36 -3.20 -4.76 -0.10 2.88 0.25 -4.85 113.62 100.48 2dlv n SER 135 Ca -0.23 -0.84 -0.37 0.00 -1.33 0.00 0.00 58.87 56.09 2dlv n SER 135 Cb 1.05 -3.72 0.02 0.00 -0.75 0.00 0.00 64.21 60.81 2dlv n SER 135 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dlv s GLY 136 N -3.70 2.80 -0.02 0.46 0.00 -1.25 -4.97 107.32 100.64 2dlv s GLY 136 Ca 0.43 1.08 -0.25 0.00 0.00 0.00 0.00 44.72 45.98 2dlv s GLY 136 CO 0.84 1.54 1.18 -0.56 0.00 0.00 0.00 173.10 176.10 2dlv h PRO 137 N 1.59 -0.13 -0.38 2.90 0.13 -1.97 -3.19 132.00 130.96 2dlv h PRO 137 Ca -0.50 0.01 -0.09 0.00 -0.87 0.00 0.00 66.00 64.55 2dlv h PRO 137 Cb 1.28 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 2dlv h PRO 137 CO 0.58 0.31 -0.10 0.66 -0.23 0.00 0.00 178.00 179.22 2dlv h SER 138 N -0.62 0.75 -0.91 1.44 4.64 -2.03 -3.05 113.55 113.77 2dlv h SER 138 Ca -0.01 -0.37 0.25 0.00 -0.47 0.00 0.00 61.79 61.19 2dlv h SER 138 Cb 0.50 -0.21 -0.14 0.00 -0.31 0.00 0.00 62.40 62.24 2dlv h SER 138 CO 0.02 0.94 0.33 0.28 -0.87 0.00 0.00 176.83 177.54 2dlv h SER 139 N 0.55 0.16 0.00 4.97 0.02 -1.97 -3.56 113.55 113.73 2dlv h SER 139 Ca 0.10 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 61.23 2dlv h SER 139 Cb 0.62 0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.38 2dlv h SER 139 CO 0.04 -0.12 0.00 0.61 -1.14 0.00 0.00 176.83 176.22