#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dlv h SER 2 N 0.00 -0.44 -3.43 1.61 0.87 -2.08 -3.44 113.55 106.64 2dlv h SER 2 Ca 0.00 -0.02 -0.64 0.00 -1.23 0.00 0.00 61.79 59.90 2dlv h SER 2 Cb 0.00 0.11 -0.21 0.00 -0.44 0.00 0.00 62.40 61.86 2dlv h SER 2 CO 0.00 0.00 -0.63 -0.55 -0.53 0.00 0.00 176.83 175.12 2dlv s SER 3 N -4.97 5.05 -0.31 6.23 0.15 -1.26 -5.07 113.70 113.52 2dlv s SER 3 Ca -0.08 -0.14 -0.02 0.00 0.70 0.00 0.00 55.95 56.41 2dlv s SER 3 Cb 0.01 -1.87 0.10 0.00 -1.71 0.00 0.00 66.02 62.55 2dlv s SER 3 CO 0.26 0.08 0.12 -0.83 1.20 0.00 0.00 173.24 174.07 2dlv s GLY 4 N 0.92 0.84 -0.01 9.45 0.00 -1.26 -4.89 107.32 112.37 2dlv s GLY 4 Ca 0.02 -1.46 0.04 0.00 0.00 0.00 0.00 44.72 43.32 2dlv s GLY 4 CO 0.02 1.81 -0.13 -0.45 0.00 0.00 0.00 173.10 174.35 2dlv s SER 5 N 1.77 1.56 0.21 1.64 0.15 -1.26 -5.04 113.70 112.73 2dlv s SER 5 Ca 0.10 -0.24 -0.09 0.00 0.70 0.00 0.00 55.95 56.42 2dlv s SER 5 Cb -0.17 -0.22 0.28 0.00 -1.71 0.00 0.00 66.02 64.20 2dlv s SER 5 CO -0.29 0.15 1.76 -1.28 1.20 0.00 0.00 173.24 174.78 2dlv h SER 6 N 5.91 0.31 0.00 5.45 0.87 -2.00 -3.46 113.55 120.63 2dlv h SER 6 Ca -0.34 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 2dlv h SER 6 Cb 1.17 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 2dlv h SER 6 CO 0.49 0.18 0.00 0.61 -0.53 0.00 0.00 176.83 177.58 2dlv n GLY 7 N -1.29 2.76 3.69 5.77 0.00 -1.25 -4.85 105.19 110.01 2dlv n GLY 7 Ca 0.09 0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 2dlv n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dlv s SER 8 N 0.00 5.22 0.00 1.61 0.01 -1.26 -4.65 113.70 114.63 2dlv s SER 8 Ca 0.00 0.08 0.15 0.00 1.31 0.00 0.00 55.95 57.49 2dlv s SER 8 Cb 0.00 -1.42 0.85 0.00 0.21 0.00 0.00 66.02 65.65 2dlv s SER 8 CO 0.00 0.33 1.37 -0.81 0.41 0.00 0.00 173.24 174.54 2dlv n PRO 9 N 1.74 0.36 0.08 12.44 -0.04 -1.26 -2.59 135.00 145.73 2dlv n PRO 9 Ca -0.16 0.07 -0.18 0.00 -0.04 0.00 0.00 63.50 63.19 2dlv n PRO 9 Cb 0.53 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.35 2dlv n PRO 9 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2dlv h GLU 10 N 0.00 0.29 0.00 0.54 4.57 -1.98 -3.31 114.58 114.69 2dlv h GLU 10 Ca 0.00 -0.49 -0.13 0.00 -1.18 0.00 0.00 59.36 57.56 2dlv h GLU 10 Cb 0.06 0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.82 2dlv h GLU 10 CO 0.00 1.18 -0.81 1.05 -1.18 0.00 0.00 179.01 179.24 2dlv h GLU 11 N 0.08 0.00 -0.98 1.92 4.11 -1.93 -3.38 114.58 114.40 2dlv h GLU 11 Ca -0.22 0.00 0.32 0.00 0.07 0.00 0.00 59.36 59.53 2dlv h GLU 11 Cb 2.02 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 31.10 2dlv h GLU 11 CO 0.18 0.74 0.25 0.00 0.07 0.00 0.00 179.01 180.26 2dlv h ALA 12 N -0.54 1.55 -0.97 1.06 0.00 -1.71 1.05 119.26 119.71 2dlv h ALA 12 Ca -0.20 0.29 0.18 0.00 0.00 0.00 0.00 54.91 55.19 2dlv h ALA 12 Cb 1.01 0.45 -0.09 0.00 0.00 0.00 0.00 17.79 19.16 2dlv h ALA 12 CO -0.12 -0.68 0.61 -0.24 0.00 0.00 0.00 179.25 178.82 2dlv h VAL 13 N 0.05 0.73 0.03 0.00 3.04 -1.73 -1.69 116.25 116.68 2dlv h VAL 13 Ca 0.68 -0.24 -0.13 0.00 -1.01 0.00 0.00 66.70 66.00 2dlv h VAL 13 Cb 1.57 -0.02 0.01 0.00 -2.01 0.00 0.00 31.29 30.84 2dlv h VAL 13 CO -0.82 0.13 -0.53 0.11 -1.01 0.00 0.00 177.57 175.45 2dlv h LYS 14 N 0.69 0.30 -0.98 4.17 1.79 0.94 -3.29 116.57 120.19 2dlv h LYS 14 Ca 0.53 -0.37 0.33 0.00 -2.18 0.00 0.00 60.65 58.97 2dlv h LYS 14 Cb 0.92 0.11 -0.16 0.00 -1.58 0.00 0.00 32.23 31.53 2dlv h LYS 14 CO -0.30 1.08 0.43 -1.49 -1.08 0.00 0.00 179.45 178.10 2dlv h TRP 15 N -0.32 0.68 -0.69 -1.35 6.55 -0.39 0.91 115.95 121.34 2dlv h TRP 15 Ca -0.08 0.04 0.07 0.00 0.95 0.00 0.00 58.89 59.88 2dlv h TRP 15 Cb 1.30 -0.13 -0.04 0.00 -0.86 0.00 0.00 29.16 29.42 2dlv h TRP 15 CO 0.17 -0.31 0.45 0.78 -1.05 0.00 0.00 178.44 178.49 2dlv h GLY 16 N 0.16 0.86 -0.71 1.49 0.00 -1.55 -3.02 103.07 100.30 2dlv h GLY 16 Ca 0.72 -0.27 0.07 0.00 0.00 0.00 0.00 47.33 47.86 2dlv h GLY 16 CO -0.71 0.19 -0.40 1.18 0.00 0.00 0.00 176.54 176.80 2dlv n GLU 17 N -4.48 -0.29 -3.59 4.80 -0.58 0.31 -4.62 120.64 112.19 2dlv n GLU 17 Ca 0.10 1.07 -0.16 0.00 -0.42 0.00 0.00 57.16 57.75 2dlv n GLU 17 Cb 0.27 -1.57 -0.07 0.00 -0.57 0.00 0.00 31.44 29.49 2dlv n GLU 17 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2dlv s SER 18 N -5.34 -0.58 0.26 1.62 0.01 -1.14 -5.02 113.70 103.52 2dlv s SER 18 Ca -0.09 0.72 -0.08 0.00 1.31 0.00 0.00 55.95 57.81 2dlv s SER 18 Cb 0.09 0.65 0.43 0.00 0.21 0.00 0.00 66.02 67.40 2dlv s SER 18 CO 0.45 -0.50 1.58 0.15 0.41 0.00 0.00 173.24 175.33 2dlv h PHE 19 N 3.58 -0.40 -0.75 2.43 3.57 -1.82 0.56 116.94 124.11 2dlv h PHE 19 Ca -0.28 0.08 0.07 0.00 3.53 0.00 0.00 57.97 61.37 2dlv h PHE 19 Cb 1.15 0.31 -0.06 0.00 2.79 0.00 0.00 35.95 40.14 2dlv h PHE 19 CO 0.41 -0.38 0.43 0.22 -2.23 0.00 0.00 178.31 176.76 2dlv h ASP 20 N 0.01 0.63 -0.89 0.41 1.82 -1.96 -1.62 116.42 114.81 2dlv h ASP 20 Ca 0.44 0.04 0.17 0.00 -0.39 0.00 0.00 57.03 57.29 2dlv h ASP 20 Cb 0.71 -0.09 -0.10 0.00 0.68 0.00 0.00 39.33 40.53 2dlv h ASP 20 CO -0.89 0.38 0.46 0.11 -1.61 0.00 0.00 179.24 177.69 2dlv h LYS 21 N 0.76 0.59 0.80 0.28 1.79 -0.14 -0.67 116.57 119.98 2dlv h LYS 21 Ca 0.35 -0.04 -0.04 0.00 -2.18 0.00 0.00 60.65 58.74 2dlv h LYS 21 Cb 0.26 -0.13 0.01 0.00 -1.58 0.00 0.00 32.23 30.78 2dlv h LYS 21 CO -0.21 0.39 -0.39 1.25 -1.08 0.00 0.00 179.45 179.41 2dlv h LEU 22 N 0.61 -0.91 -0.58 2.94 5.85 -1.00 -3.17 115.31 119.03 2dlv h LEU 22 Ca 0.51 0.02 0.12 0.00 0.84 0.00 0.00 57.88 59.36 2dlv h LEU 22 Cb 0.79 0.24 -0.11 0.00 0.37 0.00 0.00 40.66 41.94 2dlv h LEU 22 CO -0.40 -0.58 -0.16 -0.07 -0.34 0.00 0.00 178.44 176.89 2dlv h LEU 23 N -1.22 -0.59 -0.87 2.25 3.38 -1.20 -0.00 115.31 117.07 2dlv h LEU 23 Ca -0.11 0.18 0.32 0.00 0.09 0.00 0.00 57.88 58.36 2dlv h LEU 23 Cb 0.84 0.38 -0.16 0.00 0.09 0.00 0.00 40.66 41.81 2dlv h LEU 23 CO 0.18 -0.21 0.31 -0.24 0.09 0.00 0.00 178.44 178.57 2dlv n SER 24 N -5.41 0.16 -4.77 -0.43 2.88 -0.31 -4.19 113.62 101.55 2dlv n SER 24 Ca 0.06 1.45 -0.39 0.00 -1.33 0.00 0.00 58.87 58.66 2dlv n SER 24 Cb 0.31 -0.64 -0.06 0.00 -0.75 0.00 0.00 64.21 63.07 2dlv n SER 24 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 2dlv s HIS 25 N -5.50 3.90 -0.03 0.66 5.65 -0.01 -5.00 115.29 114.96 2dlv s HIS 25 Ca -0.09 1.62 -0.23 0.00 0.25 0.00 0.00 55.06 56.61 2dlv s HIS 25 Cb 0.28 -2.77 -0.17 0.00 -1.18 0.00 0.00 32.58 28.74 2dlv s HIS 25 CO 0.68 0.50 1.05 -0.09 -0.65 0.00 0.00 174.74 176.22 2dlv h ARG 26 N 4.44 -0.23 -0.41 2.88 9.65 -1.83 -1.52 114.38 127.36 2dlv h ARG 26 Ca -0.47 0.02 0.08 0.00 -1.10 0.00 0.00 59.98 58.51 2dlv h ARG 26 Cb 1.21 0.05 -0.08 0.00 -1.39 0.00 0.00 29.97 29.76 2dlv h ARG 26 CO 0.66 0.18 -0.10 -0.44 2.80 0.00 0.00 179.97 183.07 2dlv h ASP 27 N -0.77 -0.38 -0.36 -3.80 5.19 -1.92 0.13 116.42 114.51 2dlv h ASP 27 Ca -0.02 0.12 -0.02 0.00 -0.62 0.00 0.00 57.03 56.48 2dlv h ASP 27 Cb 0.52 0.25 -0.02 0.00 0.18 0.00 0.00 39.33 40.26 2dlv h ASP 27 CO 0.04 -0.13 0.13 1.23 -3.12 0.00 0.00 179.24 177.39 2dlv h GLY 28 N 0.00 0.59 0.89 2.75 0.00 -1.81 -2.57 103.07 102.93 2dlv h GLY 28 Ca 0.20 -0.33 0.02 0.00 0.00 0.00 0.00 47.33 47.22 2dlv h GLY 28 CO -0.42 0.31 0.30 -2.00 0.00 0.00 0.00 176.54 174.73 2dlv h LEU 29 N 0.44 0.48 -0.44 3.11 5.85 -0.61 -1.83 115.31 122.32 2dlv h LEU 29 Ca 0.12 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.90 2dlv h LEU 29 Cb 0.21 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.09 2dlv h LEU 29 CO -0.01 0.34 0.16 -0.33 -0.34 0.00 0.00 178.44 178.26 2dlv h GLU 30 N 0.59 0.32 -0.85 1.25 4.39 -0.65 -2.00 114.58 117.64 2dlv h GLU 30 Ca 0.20 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.88 2dlv h GLU 30 Cb 0.01 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.54 2dlv h GLU 30 CO -0.08 0.21 0.56 0.00 -1.16 0.00 0.00 179.01 178.54 2dlv h ALA 31 N 1.28 1.08 0.36 3.43 0.00 -1.07 -3.05 119.26 121.29 2dlv h ALA 31 Ca 0.20 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 2dlv h ALA 31 Cb 0.19 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2dlv h ALA 31 CO -0.20 0.49 -0.52 0.35 0.00 0.00 0.00 179.25 179.37 2dlv h PHE 32 N 1.16 -1.47 -0.93 0.00 3.57 -0.61 -2.70 116.94 115.96 2dlv h PHE 32 Ca 0.31 0.02 0.15 0.00 3.53 0.00 0.00 57.97 61.98 2dlv h PHE 32 Cb -0.13 0.59 -0.15 0.00 2.79 0.00 0.00 35.95 39.05 2dlv h PHE 32 CO -0.01 -0.65 -0.37 1.15 -2.23 0.00 0.00 178.31 176.20 2dlv h THR 33 N -0.92 0.03 -0.55 4.41 2.02 -1.36 -1.22 112.91 115.32 2dlv h THR 33 Ca -0.04 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.19 2dlv h THR 33 Cb 0.84 0.03 -0.07 0.00 -1.74 0.00 0.00 68.15 67.21 2dlv h THR 33 CO -0.15 0.00 -0.32 0.54 0.37 0.00 0.00 175.52 175.96 2dlv n ARG 34 N -5.47 -0.24 -0.29 6.66 1.74 -1.02 0.32 116.66 118.35 2dlv n ARG 34 Ca 0.09 1.27 0.19 0.00 -0.77 0.00 0.00 57.85 58.64 2dlv n ARG 34 Cb 0.40 -1.88 0.36 0.00 -1.02 0.00 0.00 32.46 30.32 2dlv n ARG 34 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2dlv n PHE 35 N -4.23 0.75 -0.03 -1.55 7.35 -0.46 0.73 117.46 120.02 2dlv n PHE 35 Ca 0.01 1.05 -0.15 0.00 -0.76 0.00 0.00 57.45 57.60 2dlv n PHE 35 Cb 0.14 -1.27 -0.10 0.00 0.35 0.00 0.00 39.48 38.60 2dlv n PHE 35 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2dlv h LEU 36 N 0.00 0.30 -0.82 -2.13 3.38 -0.09 -3.25 115.31 112.70 2dlv h LEU 36 Ca 0.62 -0.70 0.20 0.00 0.09 0.00 0.00 57.88 58.09 2dlv h LEU 36 Cb 1.45 -0.09 -0.13 0.00 0.09 0.00 0.00 40.66 41.98 2dlv h LEU 36 CO -0.76 0.95 0.20 0.11 0.09 0.00 0.00 178.44 179.03 2dlv h LYS 37 N -0.33 0.23 -0.80 1.13 1.57 0.39 0.44 116.57 119.20 2dlv h LYS 37 Ca -0.03 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2dlv h LYS 37 Cb 0.96 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 33.18 2dlv h LYS 37 CO 0.06 0.15 0.53 1.79 -0.57 0.00 0.00 179.45 181.40 2dlv h THR 38 N 0.23 1.16 -0.51 -0.16 1.35 -1.21 -0.57 112.91 113.20 2dlv h THR 38 Ca 0.49 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 66.00 2dlv h THR 38 Cb 0.92 0.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.38 2dlv h THR 38 CO -0.60 0.19 0.00 -0.62 -0.25 0.00 0.00 175.52 174.24 2dlv n GLU 39 N -4.43 3.02 -3.09 4.72 -0.58 0.13 -4.91 120.64 115.49 2dlv n GLU 39 Ca 0.10 -2.19 -0.21 0.00 -0.42 0.00 0.00 57.16 54.44 2dlv n GLU 39 Cb 0.08 -1.71 0.00 0.00 -0.57 0.00 0.00 31.44 29.24 2dlv n GLU 39 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 2dlv n PHE 40 N 0.87 -1.75 0.54 -0.32 3.72 0.53 -4.81 117.46 116.23 2dlv n PHE 40 Ca 0.20 0.38 0.05 0.00 -0.05 0.00 0.00 57.45 58.04 2dlv n PHE 40 Cb 0.69 -3.29 -0.06 0.00 -0.94 0.00 0.00 39.48 35.88 2dlv n PHE 40 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2dlv n SER 41 N -2.25 0.58 -0.33 4.37 2.88 0.11 -4.60 113.62 114.39 2dlv n SER 41 Ca -0.07 -0.79 0.22 0.00 -1.33 0.00 0.00 58.87 56.90 2dlv n SER 41 Cb 0.58 0.97 0.42 0.00 -0.75 0.00 0.00 64.21 65.43 2dlv n SER 41 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 2dlv h GLU 42 N 0.07 0.07 -1.04 -1.46 9.09 -1.82 0.23 114.58 119.71 2dlv h GLU 42 Ca 0.00 -0.00 0.35 0.00 0.05 0.00 0.00 59.36 59.75 2dlv h GLU 42 Cb 0.28 -0.01 -0.09 0.00 -1.65 0.00 0.00 28.75 27.27 2dlv h GLU 42 CO 0.00 0.04 0.69 -0.85 0.05 0.00 0.00 179.01 178.94 2dlv n GLU 43 N -5.32 -0.02 0.39 1.06 0.28 -1.26 0.99 120.64 116.76 2dlv n GLU 43 Ca 0.29 0.86 -0.17 0.00 -0.16 0.00 0.00 57.16 57.98 2dlv n GLU 43 Cb 0.96 -1.74 -0.08 0.00 1.43 0.00 0.00 31.44 32.01 2dlv n GLU 43 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 2dlv h ASN 44 N 0.00 -0.85 -0.47 -1.84 2.35 -0.80 -2.92 115.58 111.05 2dlv h ASN 44 Ca 0.63 0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 56.31 2dlv h ASN 44 Cb 2.11 0.22 -0.02 0.00 0.05 0.00 0.00 38.32 40.68 2dlv h ASN 44 CO -0.27 -0.52 0.01 -0.29 -1.65 0.00 0.00 177.43 174.70 2dlv h ILE 45 N -1.16 1.25 -0.87 2.81 6.09 0.46 -2.92 117.51 123.18 2dlv h ILE 45 Ca -0.10 -1.05 0.21 0.00 -1.37 0.00 0.00 64.86 62.55 2dlv h ILE 45 Cb 0.79 0.84 -0.13 0.00 0.47 0.00 0.00 36.82 38.80 2dlv h ILE 45 CO 0.17 0.38 0.33 -0.33 -3.07 0.00 0.00 178.15 175.63 2dlv h GLU 46 N 0.82 0.33 -0.23 2.19 5.08 -0.79 0.37 114.58 122.35 2dlv h GLU 46 Ca 0.16 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.42 2dlv h GLU 46 Cb 0.48 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2dlv h GLU 46 CO 0.02 0.22 -0.15 0.35 -1.00 0.00 0.00 179.01 178.45 2dlv h PHE 47 N 0.34 0.60 -0.59 4.33 3.57 -1.32 -1.58 116.94 122.29 2dlv h PHE 47 Ca 0.54 -0.16 0.12 0.00 3.53 0.00 0.00 57.97 61.99 2dlv h PHE 47 Cb 1.02 -0.13 -0.09 0.00 2.79 0.00 0.00 35.95 39.54 2dlv h PHE 47 CO -0.18 0.81 0.08 2.35 -2.23 0.00 0.00 178.31 179.14 2dlv h TRP 48 N 0.21 0.11 0.20 0.41 7.01 -0.88 -1.99 115.95 121.03 2dlv h TRP 48 Ca 0.05 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.07 2dlv h TRP 48 Cb 0.67 0.04 0.00 0.00 -2.10 0.00 0.00 29.16 27.78 2dlv h TRP 48 CO 0.07 -0.08 -0.09 0.82 -2.79 0.00 0.00 178.44 176.37 2dlv h ILE 49 N 0.20 0.87 -0.99 2.65 2.04 -1.26 -3.19 117.51 117.83 2dlv h ILE 49 Ca 0.31 -0.89 0.37 0.00 1.00 0.00 0.00 64.86 65.65 2dlv h ILE 49 Cb 0.47 1.36 -0.18 0.00 -0.74 0.00 0.00 36.82 37.73 2dlv h ILE 49 CO -0.43 0.18 0.38 0.00 0.00 0.00 0.00 178.15 178.28 2dlv n ALA 50 N -2.48 0.86 0.34 1.87 0.00 -0.60 -0.07 120.51 120.42 2dlv n ALA 50 Ca -0.09 1.03 -0.17 0.00 0.00 0.00 0.00 53.44 54.21 2dlv n ALA 50 Cb 0.26 -0.94 -0.09 0.00 0.00 0.00 0.00 19.45 18.68 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 -0.85 0.21 0.00 0.00 4.39 -0.49 0.47 114.58 118.31 2dlv h GLU 52 Ca -0.08 -0.01 -0.12 0.00 0.34 0.00 0.00 59.36 59.48 2dlv h GLU 52 Cb 0.64 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.23 2dlv h GLU 52 CO 0.14 0.14 -0.57 0.22 -1.16 0.00 0.00 179.01 177.77 2dlv h ASP 53 N 0.21 0.00 -0.16 1.42 1.82 -1.20 -3.16 116.42 115.35 2dlv h ASP 53 Ca 0.48 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 57.11 2dlv h ASP 53 Cb 0.91 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.91 2dlv h ASP 53 CO -0.61 0.57 0.06 0.15 -1.61 0.00 0.00 179.24 177.80 2dlv h PHE 54 N 0.00 0.24 -0.64 0.28 3.04 0.50 -2.96 116.94 117.40 2dlv h PHE 54 Ca -0.01 -0.02 -0.06 0.00 3.98 0.00 0.00 57.97 61.86 2dlv h PHE 54 Cb 1.34 -0.07 -0.03 0.00 2.56 0.00 0.00 35.95 39.75 2dlv h PHE 54 CO 0.00 0.31 0.15 1.57 -2.02 0.00 0.00 178.31 178.32 2dlv h LYS 55 N 0.10 1.01 -1.40 1.11 2.10 -1.20 -2.84 116.57 115.45 2dlv h LYS 55 Ca 0.05 -0.23 0.46 0.00 -2.00 0.00 0.00 60.65 58.93 2dlv h LYS 55 Cb 0.17 -0.14 -0.11 0.00 -0.90 0.00 0.00 32.23 31.25 2dlv h LYS 55 CO -0.00 0.90 0.93 1.63 -2.00 0.00 0.00 179.45 180.90 2dlv n LYS 56 N -4.25 -0.03 -1.22 0.07 5.02 -1.12 -4.49 118.16 112.16 2dlv n LYS 56 Ca 0.05 1.11 -0.36 0.00 -2.02 0.00 0.00 58.31 57.09 2dlv n LYS 56 Cb 0.25 -2.27 0.08 0.00 -0.02 0.00 0.00 35.03 33.07 2dlv n LYS 56 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2dlv n SER 57 N -4.35 -1.01 -0.02 4.39 2.88 -1.07 -4.96 113.62 109.48 2dlv n SER 57 Ca 0.38 0.57 -0.02 0.00 -1.33 0.00 0.00 58.87 58.47 2dlv n SER 57 Cb 1.54 -1.25 -0.02 0.00 -0.75 0.00 0.00 64.21 63.73 2dlv n SER 57 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2dlv n LYS 58 N -1.04 1.09 -2.62 -1.46 4.81 -1.26 -5.04 118.16 112.64 2dlv n LYS 58 Ca 0.10 0.01 -0.26 0.00 -0.87 0.00 0.00 58.31 57.30 2dlv n LYS 58 Cb 0.50 -1.07 0.02 0.00 0.02 0.00 0.00 35.03 34.50 2dlv n LYS 58 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 2dlv s GLY 59 N -4.04 1.57 -0.02 3.14 0.00 -1.26 -5.03 107.32 101.68 2dlv s GLY 59 Ca -0.04 -0.78 -0.25 0.00 0.00 0.00 0.00 44.72 43.66 2dlv s GLY 59 CO 0.09 -0.55 1.21 -0.56 0.00 0.00 0.00 173.10 173.29 2dlv h PRO 60 N 0.07 -0.08 -0.43 2.90 0.13 -2.00 -3.23 132.00 129.36 2dlv h PRO 60 Ca -0.46 0.01 0.04 0.00 -0.87 0.00 0.00 66.00 64.71 2dlv h PRO 60 Cb 1.25 0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.34 2dlv h PRO 60 CO 0.60 0.37 -0.25 0.94 -0.23 0.00 0.00 178.00 179.43 2dlv n GLN 61 N -4.90 -0.19 -0.30 0.86 -0.06 -1.26 0.28 117.38 111.81 2dlv n GLN 61 Ca -0.08 1.17 0.13 0.00 -2.00 0.00 0.00 57.00 56.21 2dlv n GLN 61 Cb 0.25 -1.73 0.29 0.00 -4.06 0.00 0.00 30.24 24.99 2dlv n GLN 61 CO 0.00 0.00 0.00 0.37 -0.20 0.00 0.00 177.06 177.23 2dlv h GLN 62 N 0.00 0.23 0.15 3.69 5.75 -2.00 1.00 115.11 123.92 2dlv h GLN 62 Ca 0.07 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.55 2dlv h GLN 62 Cb 0.17 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 28.68 2dlv h GLN 62 CO -0.40 0.15 -0.07 0.82 -2.65 0.00 0.00 178.83 176.68 2dlv h ILE 63 N 0.23 0.87 -0.98 2.39 2.04 -0.19 0.27 117.51 122.13 2dlv h ILE 63 Ca 0.55 -0.04 0.05 0.00 1.00 0.00 0.00 64.86 66.42 2dlv h ILE 63 Cb 1.09 0.89 -0.06 0.00 -0.74 0.00 0.00 36.82 38.00 2dlv h ILE 63 CO -0.63 0.01 0.64 0.45 0.00 0.00 0.00 178.15 178.62 2dlv h HIS 64 N -0.21 1.19 0.43 1.37 3.86 0.13 0.37 115.15 122.30 2dlv h HIS 64 Ca -0.02 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 2dlv h HIS 64 Cb 0.16 -0.40 0.00 0.00 1.06 0.00 0.00 27.41 28.24 2dlv h HIS 64 CO -0.06 0.66 -0.21 -0.07 0.86 0.00 0.00 177.93 179.11 2dlv h LEU 65 N 1.21 -0.49 -0.90 2.43 4.07 -0.60 -2.34 115.31 118.70 2dlv h LEU 65 Ca 0.41 0.02 0.13 0.00 0.08 0.00 0.00 57.88 58.52 2dlv h LEU 65 Cb 0.07 0.13 -0.09 0.00 1.08 0.00 0.00 40.66 41.84 2dlv h LEU 65 CO -0.14 -0.17 0.51 0.11 -1.08 0.00 0.00 178.44 177.67 2dlv h LYS 66 N -0.94 0.75 0.08 1.13 1.57 -0.42 -0.65 116.57 118.08 2dlv h LYS 66 Ca -0.06 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.69 2dlv h LYS 66 Cb 0.44 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 2dlv h LYS 66 CO 0.10 0.49 -0.15 0.00 -0.57 0.00 0.00 179.45 179.32 2dlv h ALA 67 N 1.54 -0.24 0.13 3.86 0.00 -0.31 0.42 119.26 124.66 2dlv h ALA 67 Ca 0.47 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.36 2dlv h ALA 67 Cb 0.58 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2dlv h ALA 67 CO -0.31 -0.66 -0.07 -0.22 0.00 0.00 0.00 179.25 177.98 2dlv h LYS 68 N -0.29 -0.18 0.24 0.00 3.64 -0.79 0.10 116.57 119.30 2dlv h LYS 68 Ca 0.02 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2dlv h LYS 68 Cb 0.31 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 2dlv h LYS 68 CO -0.08 -0.12 -0.29 0.00 -2.27 0.00 0.00 179.45 176.68 2dlv h ALA 69 N 0.68 -0.94 -0.90 5.00 0.00 -0.99 -2.07 119.26 120.04 2dlv h ALA 69 Ca -0.01 -0.10 0.15 0.00 0.00 0.00 0.00 54.91 54.95 2dlv h ALA 69 Cb 0.15 0.57 -0.10 0.00 0.00 0.00 0.00 17.79 18.42 2dlv h ALA 69 CO 0.02 -0.97 0.50 0.82 0.00 0.00 0.00 179.25 179.61 2dlv h ILE 70 N -0.55 0.74 0.00 0.00 2.04 -0.93 -1.24 117.51 117.58 2dlv h ILE 70 Ca -0.03 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.60 2dlv h ILE 70 Cb 0.49 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 2dlv h ILE 70 CO -0.07 0.13 -0.06 0.22 0.00 0.00 0.00 178.15 178.37 2dlv h TYR 71 N 0.69 -0.17 0.00 1.37 3.20 -0.39 0.12 116.97 121.79 2dlv h TYR 71 Ca 0.49 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.37 2dlv h TYR 71 Cb 0.70 0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.04 2dlv h TYR 71 CO -0.06 -0.06 0.00 0.39 -1.64 0.00 0.00 178.16 176.78 2dlv n GLU 72 N -2.81 0.11 -0.01 1.82 1.02 -0.81 0.10 120.64 120.05 2dlv n GLU 72 Ca -0.01 0.17 -0.00 0.00 -0.02 0.00 0.00 57.16 57.30 2dlv n GLU 72 Cb 0.04 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 29.96 2dlv n GLU 72 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 2dlv h LYS 73 N 0.00 0.00 0.00 3.49 3.64 0.39 -3.43 116.57 120.66 2dlv h LYS 73 Ca 0.00 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.16 2dlv h LYS 73 Cb 0.04 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 2dlv h LYS 73 CO 0.00 0.00 -1.74 1.19 -2.27 0.00 0.00 179.45 176.63 2dlv n PHE 74 N -2.77 0.00 -0.08 1.91 3.01 -0.26 -2.32 117.46 116.95 2dlv n PHE 74 Ca -0.00 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.42 2dlv n PHE 74 Cb 0.02 -0.47 -0.03 0.00 -0.01 0.00 0.00 39.48 38.98 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 -0.43 0.00 -3.89 4.37 1.08 -1.30 -3.12 117.51 114.22 2dlv h ILE 75 Ca -0.33 0.00 -0.55 0.00 -0.39 0.00 0.00 64.86 63.59 2dlv h ILE 75 Cb 1.31 0.00 0.13 0.00 -3.07 0.00 0.00 36.82 35.19 2dlv h ILE 75 CO -0.19 0.00 0.59 0.00 -0.69 0.00 0.00 178.15 177.86 2dlv n GLN 76 N -3.60 1.87 -1.79 2.37 10.64 0.11 -4.82 117.38 122.16 2dlv n GLN 76 Ca -0.00 0.68 -0.30 0.00 -1.83 0.00 0.00 57.00 55.54 2dlv n GLN 76 Cb 0.09 -2.53 0.19 0.00 -0.86 0.00 0.00 30.24 27.13 2dlv n GLN 76 CO 0.00 0.00 0.00 0.99 -1.83 0.00 0.00 177.06 176.22 2dlv s THR 77 N -1.25 1.93 -0.88 -0.39 2.01 -1.26 -4.01 115.64 111.79 2dlv s THR 77 Ca 0.67 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 62.63 2dlv s THR 77 Cb -0.44 -2.92 0.03 0.00 0.01 0.00 0.00 72.50 69.18 2dlv s THR 77 CO 0.53 0.00 0.17 0.47 -0.69 0.00 0.00 174.62 175.10 2dlv n ASP 78 N -3.93 -2.98 -4.92 3.53 8.00 -1.26 -4.92 116.55 110.07 2dlv n ASP 78 Ca 0.15 0.04 -0.20 0.00 0.71 0.00 0.00 54.79 55.49 2dlv n ASP 78 Cb 0.59 -2.55 -0.02 0.00 -0.02 0.00 0.00 41.12 39.13 2dlv n ASP 78 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dlv s ALA 79 N -2.57 4.19 0.30 2.24 0.00 -1.26 -5.02 121.76 119.64 2dlv s ALA 79 Ca 0.16 -1.80 0.08 0.00 0.00 0.00 0.00 51.96 50.40 2dlv s ALA 79 Cb -0.08 -1.23 0.46 0.00 0.00 0.00 0.00 23.12 22.27 2dlv s ALA 79 CO 0.19 -0.22 1.69 -1.00 0.00 0.00 0.00 175.76 176.42 2dlv h PRO 80 N 0.92 0.15 -0.06 0.00 0.13 -1.84 -3.14 132.00 128.15 2dlv h PRO 80 Ca -0.41 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2dlv h PRO 80 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2dlv h PRO 80 CO 0.54 0.59 0.00 1.63 -0.23 0.00 0.00 178.00 180.53 2dlv n LYS 81 N -3.98 1.99 -1.63 0.86 4.76 -0.98 -4.95 118.16 114.24 2dlv n LYS 81 Ca -0.02 -2.38 -0.47 0.00 -2.87 0.00 0.00 58.31 52.58 2dlv n LYS 81 Cb 0.51 -1.44 -0.03 0.00 -1.84 0.00 0.00 35.03 32.22 2dlv n LYS 81 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 2dlv n GLU 82 N -0.99 1.65 -4.48 1.97 0.00 -0.98 -4.07 120.64 113.75 2dlv n GLU 82 Ca 0.13 0.59 -0.23 0.00 0.00 0.00 0.00 57.16 57.65 2dlv n GLU 82 Cb 0.59 -2.19 -0.10 0.00 0.00 0.00 0.00 31.44 29.74 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 -0.04 1.75 -0.54 3.84 -7.23 -1.18 -4.87 120.40 112.15 2dlv s VAL 83 Ca 0.71 -2.11 -0.27 0.00 -1.81 0.00 0.00 61.98 58.50 2dlv s VAL 83 Cb -0.74 -2.59 -0.01 0.00 0.56 0.00 0.00 36.38 33.59 2dlv s VAL 83 CO 0.50 -0.21 1.75 0.20 -0.31 0.00 0.00 175.10 177.03 2dlv s ASN 84 N -3.51 5.59 0.06 4.85 0.01 -1.26 -4.93 114.94 115.76 2dlv s ASN 84 Ca 0.32 0.55 0.05 0.00 -0.71 0.00 0.00 52.86 53.06 2dlv s ASN 84 Cb 0.05 -2.53 -0.03 0.00 0.41 0.00 0.00 41.25 39.15 2dlv s ASN 84 CO 0.14 -2.08 -0.14 -0.76 -1.51 0.00 0.00 177.10 172.75 2dlv s LEU 85 N 7.94 2.25 0.68 0.60 1.43 -1.26 -4.79 118.68 125.54 2dlv s LEU 85 Ca 0.67 -0.58 -0.17 0.00 -1.03 0.00 0.00 54.13 53.02 2dlv s LEU 85 Cb -0.14 -0.52 0.01 0.00 0.03 0.00 0.00 46.19 45.57 2dlv s LEU 85 CO 0.25 -0.06 1.26 -0.62 0.23 0.00 0.00 176.35 177.41 2dlv s ASP 86 N -1.59 4.41 0.06 2.29 2.15 -1.26 -4.83 116.67 117.89 2dlv s ASP 86 Ca -0.02 2.54 -0.26 0.00 0.43 0.00 0.00 52.55 55.24 2dlv s ASP 86 Cb -0.09 -2.61 -0.13 0.00 -0.30 0.00 0.00 42.92 39.78 2dlv s ASP 86 CO 0.02 -2.13 1.41 0.15 -0.17 0.00 0.00 175.17 174.44 2dlv h PHE 87 N 0.21 -0.99 -0.96 -5.34 3.57 -2.00 -1.20 116.94 110.23 2dlv h PHE 87 Ca -0.50 -0.00 0.27 0.00 3.53 0.00 0.00 57.97 61.27 2dlv h PHE 87 Cb 1.32 0.37 -0.14 0.00 2.79 0.00 0.00 35.95 40.29 2dlv h PHE 87 CO 0.43 -0.52 0.48 1.25 -2.23 0.00 0.00 178.31 177.73 2dlv h HIS 88 N -0.82 0.80 -0.72 0.41 2.76 -1.98 0.57 115.15 116.16 2dlv h HIS 88 Ca -0.06 0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.10 2dlv h HIS 88 Cb 0.68 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 29.41 2dlv h HIS 88 CO -0.12 -0.10 0.28 1.15 -1.30 0.00 0.00 177.93 177.85 2dlv h THR 89 N 0.38 1.25 -0.05 6.26 2.02 -1.83 0.31 112.91 121.24 2dlv h THR 89 Ca 0.65 -0.78 -0.25 0.00 0.77 0.00 0.00 66.41 66.80 2dlv h THR 89 Cb 1.35 0.39 0.02 0.00 -1.74 0.00 0.00 68.15 68.17 2dlv h THR 89 CO -0.57 0.31 -0.95 0.11 0.37 0.00 0.00 175.52 174.80 2dlv h LYS 90 N 1.05 0.72 0.47 6.66 1.57 0.12 -3.07 116.57 124.08 2dlv h LYS 90 Ca 0.24 -0.71 -0.02 0.00 -1.87 0.00 0.00 60.65 58.29 2dlv h LYS 90 Cb 0.20 0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.70 2dlv h LYS 90 CO -0.02 1.29 -0.22 1.49 -0.57 0.00 0.00 179.45 181.42 2dlv h GLU 91 N 0.44 -0.60 -0.88 3.15 4.81 -0.27 -1.72 114.58 119.50 2dlv h GLU 91 Ca -0.10 0.04 0.23 0.00 -0.13 0.00 0.00 59.36 59.40 2dlv h GLU 91 Cb 1.59 0.14 -0.16 0.00 0.63 0.00 0.00 28.75 30.95 2dlv h GLU 91 CO 0.19 -0.35 0.06 -0.24 -0.73 0.00 0.00 179.01 177.94 2dlv h VAL 92 N -1.12 0.20 -0.41 0.32 3.04 -0.52 0.33 116.25 118.09 2dlv h VAL 92 Ca -0.06 -0.03 -0.09 0.00 -1.01 0.00 0.00 66.70 65.51 2dlv h VAL 92 Cb 0.53 0.10 -0.01 0.00 -2.01 0.00 0.00 31.29 29.90 2dlv h VAL 92 CO 0.11 0.02 -0.10 0.40 -1.01 0.00 0.00 177.57 176.98 2dlv h ILE 93 N 0.09 1.27 -0.90 3.17 2.04 -1.58 0.45 117.51 122.04 2dlv h ILE 93 Ca 0.52 -1.19 0.10 0.00 1.00 0.00 0.00 64.86 65.29 2dlv h ILE 93 Cb 1.02 1.20 -0.07 0.00 -0.74 0.00 0.00 36.82 38.23 2dlv h ILE 93 CO -0.77 0.40 0.58 0.74 0.00 0.00 0.00 178.15 179.10 2dlv h THR 94 N 0.61 0.97 0.05 -0.27 2.02 0.55 0.48 112.91 117.31 2dlv h THR 94 Ca 0.10 -0.31 -0.30 0.00 0.77 0.00 0.00 66.41 66.67 2dlv h THR 94 Cb 0.62 -0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 2dlv h THR 94 CO 0.04 0.17 -1.65 0.78 0.37 0.00 0.00 175.52 175.22 2dlv h ASN 95 N 0.91 0.16 -0.34 4.18 2.35 -0.98 -3.32 115.58 118.54 2dlv h ASN 95 Ca 0.42 -0.29 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2dlv h ASN 95 Cb 0.40 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.72 2dlv h ASN 95 CO -0.18 1.25 0.00 -0.24 -1.65 0.00 0.00 177.43 176.61 2dlv n SER 96 N -3.24 3.36 0.00 5.81 2.88 0.16 -4.14 113.62 118.44 2dlv n SER 96 Ca -0.18 -2.41 0.09 0.00 -1.33 0.00 0.00 58.87 55.03 2dlv n SER 96 Cb 1.04 -0.54 0.41 0.00 -0.75 0.00 0.00 64.21 64.37 2dlv n SER 96 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dlv n ILE 97 N 0.42 0.63 -0.01 2.46 0.13 0.16 -1.65 119.36 121.51 2dlv n ILE 97 Ca 0.15 0.16 0.06 0.00 -1.10 0.00 0.00 62.75 62.02 2dlv n ILE 97 Cb 0.69 -0.86 -0.12 0.00 -0.84 0.00 0.00 39.64 38.51 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 -1.39 0.08 -1.50 9.51 5.66 -1.26 -4.48 114.28 120.89 2dlv n THR 98 Ca 0.06 -0.36 0.04 0.00 -3.05 0.00 0.00 64.05 60.74 2dlv n THR 98 Cb 0.17 0.09 0.20 0.00 -1.55 0.00 0.00 70.33 69.25 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 -2.06 1.66 -2.26 1.09 10.64 -1.02 -5.05 117.38 120.37 2dlv n GLN 99 Ca -0.04 -3.21 -0.40 0.00 -1.83 0.00 0.00 57.00 51.52 2dlv n GLN 99 Cb 0.44 -1.67 -0.03 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 -3.20 4.44 0.53 2.61 0.04 -0.66 -5.04 135.00 133.71 2dlv s PRO 100 Ca 0.39 2.04 0.04 0.00 0.04 0.00 0.00 61.00 63.51 2dlv s PRO 100 Cb 0.37 -3.08 0.02 0.00 0.04 0.00 0.00 34.50 31.85 2dlv s PRO 100 CO -0.04 -0.05 0.25 0.95 0.04 0.00 0.00 177.00 178.15 2dlv s THR 101 N -1.17 1.49 0.43 1.26 -4.23 -1.26 -4.88 115.64 107.28 2dlv s THR 101 Ca 0.48 -1.68 0.35 0.00 -1.18 0.00 0.00 61.69 59.66 2dlv s THR 101 Cb -0.36 -2.17 0.35 0.00 1.34 0.00 0.00 72.50 71.66 2dlv s THR 101 CO 0.48 0.00 2.06 -0.07 -0.54 0.00 0.00 174.62 176.55 2dlv h LEU 102 N 0.98 0.00 -3.20 4.79 3.38 -1.95 0.26 115.31 119.57 2dlv h LEU 102 Ca -0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 2dlv h LEU 102 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 2dlv h LEU 102 CO 0.64 0.00 0.00 1.41 0.09 0.00 0.00 178.44 180.58 2dlv n HIS 103 N -2.79 0.93 0.09 1.13 8.25 -1.26 -4.48 115.22 117.09 2dlv n HIS 103 Ca -0.02 -0.80 -0.13 0.00 -0.26 0.00 0.00 57.72 56.51 2dlv n HIS 103 Cb 0.13 -0.27 -0.08 0.00 1.12 0.00 0.00 29.99 30.90 2dlv n HIS 103 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2dlv h SER 104 N 2.00 -0.14 -0.05 0.41 0.87 -0.84 -1.97 113.55 113.84 2dlv h SER 104 Ca 0.00 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 2dlv h SER 104 Cb 1.34 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.34 2dlv h SER 104 CO 0.20 -0.04 0.00 0.49 -0.53 0.00 0.00 176.83 176.95 2dlv n PHE 105 N -5.13 0.11 0.05 2.24 3.72 -1.26 -3.97 117.46 113.22 2dlv n PHE 105 Ca -0.08 -0.04 -0.13 0.00 -0.05 0.00 0.00 57.45 57.15 2dlv n PHE 105 Cb 0.12 -0.07 -0.09 0.00 -0.94 0.00 0.00 39.48 38.50 2dlv n PHE 105 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 176.76 176.93 2dlv h ASP 106 N 0.29 -0.13 0.74 4.37 3.58 -1.66 -1.22 116.42 122.39 2dlv h ASP 106 Ca 0.00 -0.34 -0.04 0.00 0.42 0.00 0.00 57.03 57.07 2dlv h ASP 106 Cb 0.36 0.03 0.01 0.00 1.72 0.00 0.00 39.33 41.45 2dlv h ASP 106 CO 0.02 0.29 -0.35 0.00 -2.88 0.00 0.00 179.24 176.32 2dlv h ALA 107 N 0.24 -0.99 -0.26 -0.78 0.00 -1.75 -2.69 119.26 113.04 2dlv h ALA 107 Ca -0.02 -0.23 0.06 0.00 0.00 0.00 0.00 54.91 54.73 2dlv h ALA 107 Cb 0.46 0.38 -0.07 0.00 0.00 0.00 0.00 17.79 18.56 2dlv h ALA 107 CO 0.02 -1.00 -0.23 0.00 0.00 0.00 0.00 179.25 178.05 2dlv h ALA 108 N -0.94 -0.09 -0.91 0.00 0.00 -1.80 -1.01 119.26 114.51 2dlv h ALA 108 Ca -0.10 0.09 0.24 0.00 0.00 0.00 0.00 54.91 55.13 2dlv h ALA 108 Cb 0.78 0.48 -0.13 0.00 0.00 0.00 0.00 17.79 18.92 2dlv h ALA 108 CO 0.17 -0.64 0.39 0.37 0.00 0.00 0.00 179.25 179.53 2dlv h GLN 109 N -0.22 0.34 -0.99 0.00 4.15 -1.22 0.38 115.11 117.54 2dlv h GLN 109 Ca 0.14 -0.02 0.02 0.00 0.77 0.00 0.00 58.65 59.57 2dlv h GLN 109 Cb 0.44 -0.08 -0.05 0.00 0.21 0.00 0.00 27.48 28.00 2dlv h GLN 109 CO -0.39 0.23 0.65 1.03 -1.93 0.00 0.00 178.83 178.42 2dlv h SER 110 N 0.35 1.11 0.53 -0.69 0.87 -0.84 0.47 113.55 115.36 2dlv h SER 110 Ca 0.58 -0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 61.10 2dlv h SER 110 Cb 1.16 -0.26 0.01 0.00 -0.44 0.00 0.00 62.40 62.86 2dlv h SER 110 CO -0.57 0.78 -0.25 -0.09 -0.53 0.00 0.00 176.83 176.17 2dlv h ARG 111 N 1.30 -0.68 0.60 2.24 1.12 0.00 -2.96 114.38 115.99 2dlv h ARG 111 Ca 0.38 0.05 -0.03 0.00 -1.11 0.00 0.00 59.98 59.27 2dlv h ARG 111 Cb -0.07 0.15 0.01 0.00 -0.01 0.00 0.00 29.97 30.05 2dlv h ARG 111 CO -0.10 -0.42 -0.29 0.28 -3.11 0.00 0.00 179.97 176.33 2dlv h VAL 112 N -0.77 0.42 -0.82 0.20 2.07 -1.23 -2.17 116.25 113.95 2dlv h VAL 112 Ca -0.07 -0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.69 2dlv h VAL 112 Cb 0.57 0.42 -0.15 0.00 -1.52 0.00 0.00 31.29 30.61 2dlv h VAL 112 CO 0.12 0.00 0.07 0.00 0.02 0.00 0.00 177.57 177.78 2dlv n TYR 113 N -5.43 0.58 0.04 1.57 9.36 0.14 0.38 117.16 123.80 2dlv n TYR 113 Ca -0.13 0.98 -0.12 0.00 3.32 0.00 0.00 57.90 61.95 2dlv n TYR 113 Cb 0.33 -1.15 -0.09 0.00 -0.63 0.00 0.00 39.34 37.80 2dlv n TYR 113 CO 0.00 0.00 0.00 1.96 0.22 0.00 0.00 176.86 179.04 2dlv h GLN 114 N 0.00 -0.15 -0.82 2.98 1.08 -1.33 -2.70 115.11 114.17 2dlv h GLN 114 Ca 0.52 0.01 0.28 0.00 -1.45 0.00 0.00 58.65 58.01 2dlv h GLN 114 Cb 1.13 0.03 -0.15 0.00 -0.05 0.00 0.00 27.48 28.44 2dlv h GLN 114 CO -0.75 0.30 0.20 1.28 -0.95 0.00 0.00 178.83 178.91 2dlv n LEU 115 N -4.93 0.07 0.07 1.46 4.77 0.16 0.42 117.00 119.03 2dlv n LEU 115 Ca -0.08 1.38 -0.04 0.00 -0.03 0.00 0.00 56.01 57.23 2dlv n LEU 115 Cb 0.26 -0.57 -0.02 0.00 -2.33 0.00 0.00 43.42 40.76 2dlv n LEU 115 CO 0.30 -1.46 0.13 0.24 -1.33 0.00 0.00 177.39 175.28 2dlv h MET 116 N 0.00 -0.24 -0.26 3.23 2.86 -1.44 -3.24 114.93 115.83 2dlv h MET 116 Ca 0.58 0.02 0.08 0.00 -2.06 0.00 0.00 59.70 58.32 2dlv h MET 116 Cb 1.38 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 33.08 2dlv h MET 116 CO -0.71 -0.16 0.72 1.49 1.06 0.00 0.00 176.91 179.31 2dlv h GLU 117 N -0.79 0.00 0.07 1.72 4.81 -0.71 0.53 114.58 120.20 2dlv h GLU 117 Ca -0.03 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2dlv h GLU 117 Cb 0.19 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.57 2dlv h GLU 117 CO 0.04 0.00 -0.03 1.96 -0.73 0.00 0.00 179.01 180.25 2dlv h GLN 118 N 0.00 -0.09 0.00 1.92 4.20 -0.06 -3.40 115.11 117.68 2dlv h GLN 118 Ca 0.13 0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 2dlv h GLN 118 Cb 1.56 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 29.35 2dlv h GLN 118 CO -0.00 -0.06 -1.16 -0.40 -0.67 0.00 0.00 178.83 176.54 2dlv n ASP 119 N -2.28 3.97 0.05 1.46 5.68 -0.73 -4.61 116.55 120.09 2dlv n ASP 119 Ca -0.01 -0.01 -0.14 0.00 -0.50 0.00 0.00 54.79 54.13 2dlv n ASP 119 Cb 0.04 0.12 -0.09 0.00 -1.14 0.00 0.00 41.12 40.05 2dlv n ASP 119 CO 0.00 0.00 0.00 -1.28 -1.33 0.00 0.00 177.20 174.59 2dlv h SER 120 N 0.00 -1.48 -0.05 -1.12 0.87 -0.22 0.23 113.55 111.78 2dlv h SER 120 Ca -0.06 0.17 0.02 0.00 -1.23 0.00 0.00 61.79 60.68 2dlv h SER 120 Cb 1.11 0.56 -0.05 0.00 -0.44 0.00 0.00 62.40 63.58 2dlv h SER 120 CO -0.01 -0.47 -0.44 0.22 -0.53 0.00 0.00 176.83 175.61 2dlv h TYR 121 N -0.60 -1.29 -1.02 2.24 3.20 -1.27 0.31 116.97 118.54 2dlv h TYR 121 Ca 0.01 0.04 0.26 0.00 3.14 0.00 0.00 58.73 62.18 2dlv h TYR 121 Cb 0.64 0.57 -0.08 0.00 1.54 0.00 0.00 36.73 39.40 2dlv h TYR 121 CO -0.50 -0.45 0.67 1.79 -1.64 0.00 0.00 178.16 178.02 2dlv h THR 122 N -0.51 0.55 -0.11 1.81 1.35 -1.72 0.25 112.91 114.52 2dlv h THR 122 Ca 0.02 -0.13 -0.06 0.00 -0.55 0.00 0.00 66.41 65.69 2dlv h THR 122 Cb 0.57 0.15 -0.00 0.00 -1.73 0.00 0.00 68.15 67.14 2dlv h THR 122 CO -0.32 0.07 -0.16 -0.09 -0.25 0.00 0.00 175.52 174.77 2dlv h ARG 123 N 0.37 0.30 -0.88 4.72 2.43 0.13 -3.14 114.38 118.31 2dlv h ARG 123 Ca 0.57 -0.18 0.09 0.00 -0.81 0.00 0.00 59.98 59.65 2dlv h ARG 123 Cb 1.49 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 31.00 2dlv h ARG 123 CO -0.25 0.75 0.57 0.35 -1.51 0.00 0.00 179.97 179.88 2dlv h PHE 124 N -0.12 0.94 -0.72 2.20 3.57 0.16 0.14 116.94 123.11 2dlv h PHE 124 Ca 0.01 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.55 2dlv h PHE 124 Cb 0.72 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 39.11 2dlv h PHE 124 CO 0.10 0.44 0.46 -0.07 -2.23 0.00 0.00 178.31 177.01 2dlv h LEU 125 N 0.87 0.78 -3.00 0.59 3.38 -1.26 -1.64 115.31 115.04 2dlv h LEU 125 Ca 0.40 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.36 2dlv h LEU 125 Cb 0.40 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2dlv h LEU 125 CO -0.17 0.56 0.00 2.29 0.09 0.00 0.00 178.44 181.21 2dlv n LYS 126 N -4.62 3.83 -3.11 1.13 2.85 -0.58 -4.51 118.16 113.15 2dlv n LYS 126 Ca 0.07 -2.68 -0.31 0.00 -1.05 0.00 0.00 58.31 54.34 2dlv n LYS 126 Cb 0.05 -1.96 -0.04 0.00 -0.65 0.00 0.00 35.03 32.43 2dlv n LYS 126 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2dlv s SER 127 N -0.80 6.60 0.10 -5.58 1.04 0.39 -4.95 113.70 110.50 2dlv s SER 127 Ca 0.47 1.08 -0.22 0.00 0.48 0.00 0.00 55.95 57.76 2dlv s SER 127 Cb 0.32 -2.29 -0.11 0.00 0.10 0.00 0.00 66.02 64.04 2dlv s SER 127 CO 0.20 -0.26 1.72 -0.78 0.98 0.00 0.00 173.24 175.11 2dlv h ASP 128 N 1.83 -0.09 -0.76 7.02 3.58 -1.89 -1.09 116.42 125.02 2dlv h ASP 128 Ca -0.47 0.02 0.17 0.00 0.42 0.00 0.00 57.03 57.17 2dlv h ASP 128 Cb 1.18 0.05 -0.13 0.00 1.72 0.00 0.00 39.33 42.15 2dlv h ASP 128 CO 0.66 -0.04 0.05 0.40 -2.88 0.00 0.00 179.24 177.42 2dlv h ILE 129 N -0.03 0.36 0.53 2.25 2.04 -1.94 0.50 117.51 121.22 2dlv h ILE 129 Ca 0.03 -0.04 -0.03 0.00 1.00 0.00 0.00 64.86 65.82 2dlv h ILE 129 Cb 0.07 0.22 0.01 0.00 -0.74 0.00 0.00 36.82 36.37 2dlv h ILE 129 CO -0.06 0.02 -0.25 0.22 0.00 0.00 0.00 178.15 178.08 2dlv h TYR 130 N 0.13 -0.66 -1.09 1.37 3.20 -1.66 0.24 116.97 118.51 2dlv h TYR 130 Ca 0.42 -0.02 0.31 0.00 3.14 0.00 0.00 58.73 62.59 2dlv h TYR 130 Cb 0.75 0.22 -0.05 0.00 1.54 0.00 0.00 36.73 39.19 2dlv h TYR 130 CO -0.39 -0.41 0.78 -0.07 -1.64 0.00 0.00 178.16 176.43 2dlv h LEU 131 N -1.02 0.05 0.00 2.82 3.38 -0.77 -1.42 115.31 118.36 2dlv h LEU 131 Ca -0.07 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 2dlv h LEU 131 Cb 0.54 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 2dlv h LEU 131 CO 0.12 0.01 -0.04 -0.78 0.09 0.00 0.00 178.44 177.84 2dlv h ASP 132 N 0.05 0.00 -1.34 -0.43 3.58 0.07 0.48 116.42 118.82 2dlv h ASP 132 Ca 0.53 -0.43 0.40 0.00 0.42 0.00 0.00 57.03 57.95 2dlv h ASP 132 Cb 2.03 0.00 -0.09 0.00 1.72 0.00 0.00 39.33 42.98 2dlv h ASP 132 CO -0.04 0.74 0.91 0.17 -2.88 0.00 0.00 179.24 178.14 2dlv h LEU 133 N -1.00 0.19 0.03 2.28 8.10 0.51 0.28 115.31 125.71 2dlv h LEU 133 Ca -0.01 0.07 -0.35 0.00 0.11 0.00 0.00 57.88 57.71 2dlv h LEU 133 Cb 0.46 0.05 -0.05 0.00 -0.44 0.00 0.00 40.66 40.68 2dlv h LEU 133 CO -0.00 -0.05 -2.07 1.15 -4.11 0.00 0.00 178.44 173.35 2dlv n MET 134 N -4.44 0.68 -3.90 0.17 0.00 -0.70 -3.92 117.12 105.01 2dlv n MET 134 Ca 0.33 0.20 -0.28 0.00 0.00 0.00 0.00 57.70 57.95 2dlv n MET 134 Cb 1.37 -1.66 0.02 0.00 0.00 0.00 0.00 33.22 32.95 2dlv n MET 134 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 2dlv n SER 135 N -3.14 -3.33 -0.04 3.17 2.88 0.99 -4.60 113.62 109.55 2dlv n SER 135 Ca -0.30 -0.84 0.00 0.00 -1.33 0.00 0.00 58.87 56.41 2dlv n SER 135 Cb 1.06 -3.73 0.00 0.00 -0.75 0.00 0.00 64.21 60.80 2dlv n SER 135 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dlv n GLY 136 N -1.66 5.69 3.71 0.46 0.00 -1.25 -5.07 105.19 107.07 2dlv n GLY 136 Ca -0.07 -1.56 -0.42 0.00 0.00 0.00 0.00 46.02 43.97 2dlv n GLY 136 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dlv s PRO 137 N 0.89 4.31 0.47 1.61 0.04 -1.26 -4.98 135.00 136.08 2dlv s PRO 137 Ca 0.00 2.04 -0.24 0.00 0.04 0.00 0.00 61.00 62.83 2dlv s PRO 137 Cb 0.00 -3.35 -0.07 0.00 0.04 0.00 0.00 34.50 31.12 2dlv s PRO 137 CO 0.00 -0.47 1.35 -1.54 0.04 0.00 0.00 177.00 176.38 2dlv s SER 138 N 1.34 5.85 0.03 6.66 1.04 -1.26 -4.95 113.70 122.41 2dlv s SER 138 Ca 0.64 2.75 -0.25 0.00 0.48 0.00 0.00 55.95 59.57 2dlv s SER 138 Cb -0.35 -2.64 -0.17 0.00 0.10 0.00 0.00 66.02 62.96 2dlv s SER 138 CO 0.29 -1.18 1.42 -1.28 0.98 0.00 0.00 173.24 173.47 2dlv h SER 139 N 2.15 -0.18 0.00 7.02 0.87 -1.94 -3.55 113.55 117.93 2dlv h SER 139 Ca -0.50 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 59.86 2dlv h SER 139 Cb 1.27 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 2dlv h SER 139 CO 0.60 0.11 0.00 0.61 -0.53 0.00 0.00 176.83 177.62