#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d88 h SER 2 N 0.00 -0.94 0.00 1.61 0.02 -2.12 -3.38 113.55 108.74 2d88 h SER 2 Ca 0.00 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 2d88 h SER 2 Cb 0.00 0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 2d88 h SER 2 CO 0.00 -0.61 -0.50 -1.28 -1.14 0.00 0.00 176.83 173.30 2d88 h SER 3 N -1.24 0.00 -1.53 3.07 0.87 -2.11 -3.51 113.55 109.10 2d88 h SER 3 Ca -0.11 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.28 2d88 h SER 3 Cb 0.86 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.82 2d88 h SER 3 CO 0.19 0.86 0.00 0.61 -0.53 0.00 0.00 176.83 177.95 2d88 n GLY 4 N 1.62 -0.53 3.79 5.77 0.00 -1.26 -5.15 105.19 109.43 2d88 n GLY 4 Ca -0.11 -1.50 -0.23 0.00 0.00 0.00 0.00 46.02 44.19 2d88 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d88 s SER 5 N -3.77 4.72 -0.06 1.61 1.04 -1.26 -4.98 113.70 111.00 2d88 s SER 5 Ca 0.00 -0.89 0.03 0.00 0.48 0.00 0.00 55.95 55.57 2d88 s SER 5 Cb 0.00 -0.56 0.00 0.00 0.10 0.00 0.00 66.02 65.56 2d88 s SER 5 CO 0.00 -0.54 -0.16 -0.55 0.98 0.00 0.00 173.24 172.97 2d88 s SER 6 N -3.98 2.12 -1.37 7.02 0.15 -1.26 -4.79 113.70 111.59 2d88 s SER 6 Ca 0.43 -0.36 -0.03 0.00 0.70 0.00 0.00 55.95 56.70 2d88 s SER 6 Cb 0.00 -0.79 0.02 0.00 -1.71 0.00 0.00 66.02 63.53 2d88 s SER 6 CO 0.25 0.11 0.72 0.61 1.20 0.00 0.00 173.24 176.12 2d88 n GLY 7 N 3.46 -0.32 2.99 9.45 0.00 -1.26 -4.99 105.19 114.52 2d88 n GLY 7 Ca -0.20 0.14 -0.20 0.00 0.00 0.00 0.00 46.02 45.76 2d88 n GLY 7 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2d88 s VAL 8 N -3.63 0.74 0.18 1.61 1.01 -1.26 -5.04 120.40 114.00 2d88 s VAL 8 Ca 0.14 -0.34 -0.14 0.00 0.00 0.00 0.00 61.98 61.63 2d88 s VAL 8 Cb -0.07 -0.66 0.18 0.00 0.00 0.00 0.00 36.38 35.83 2d88 s VAL 8 CO 0.83 0.23 1.23 0.00 0.00 0.00 0.00 175.10 177.39 2d88 n ALA 9 N 3.29 -0.12 -0.89 5.51 0.00 -1.26 -4.47 120.51 122.57 2d88 n ALA 9 Ca -0.18 0.78 -0.34 0.00 0.00 0.00 0.00 53.44 53.70 2d88 n ALA 9 Cb 0.54 -0.34 0.09 0.00 0.00 0.00 0.00 19.45 19.75 2d88 n ALA 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2d88 n ARG 10 N -5.16 -0.17 -4.01 0.00 5.12 -1.26 -2.94 116.66 108.24 2d88 n ARG 10 Ca 0.08 -0.02 -0.32 0.00 -1.93 0.00 0.00 57.85 55.66 2d88 n ARG 10 Cb 0.31 -1.60 -0.02 0.00 -1.16 0.00 0.00 32.46 30.00 2d88 n ARG 10 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2d88 n SER 11 N 0.18 -1.69 -4.70 0.55 3.41 -1.26 -4.81 113.62 105.30 2d88 n SER 11 Ca 0.04 -1.13 -0.44 0.00 -0.26 0.00 0.00 58.87 57.09 2d88 n SER 11 Cb 0.54 -2.51 -0.03 0.00 -0.26 0.00 0.00 64.21 61.95 2d88 n SER 11 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2d88 n SER 12 N -2.74 3.36 -0.30 4.04 2.88 -1.15 -4.81 113.62 114.90 2d88 n SER 12 Ca -0.24 1.11 0.17 0.00 -1.33 0.00 0.00 58.87 58.59 2d88 n SER 12 Cb 0.65 -1.50 0.33 0.00 -0.75 0.00 0.00 64.21 62.95 2d88 n SER 12 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2d88 n LYS 13 N 2.85 -0.06 0.23 -1.46 3.00 -1.26 0.03 118.16 121.48 2d88 n LYS 13 Ca 0.13 1.28 -0.14 0.00 -0.00 0.00 0.00 58.31 59.58 2d88 n LYS 13 Cb 0.33 -2.10 -0.08 0.00 0.00 0.00 0.00 35.03 33.18 2d88 n LYS 13 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.40 178.65 2d88 h LEU 14 N 0.00 -0.51 -0.70 3.14 5.85 -2.00 -3.28 115.31 117.81 2d88 h LEU 14 Ca 0.59 -0.09 0.06 0.00 0.84 0.00 0.00 57.88 59.28 2d88 h LEU 14 Cb 1.35 0.13 -0.08 0.00 0.37 0.00 0.00 40.66 42.43 2d88 h LEU 14 CO -0.78 -0.16 -0.41 -0.11 -0.34 0.00 0.00 178.44 176.64 2d88 n LEU 15 N -5.24 -0.74 -0.15 2.25 7.94 0.10 -1.03 117.00 120.14 2d88 n LEU 15 Ca -0.10 1.29 -0.04 0.00 -1.11 0.00 0.00 56.01 56.05 2d88 n LEU 15 Cb 0.30 -0.18 -0.03 0.00 0.53 0.00 0.00 43.42 44.03 2d88 n LEU 15 CO 0.30 -1.04 0.48 0.61 -1.11 0.00 0.00 177.39 176.64 2d88 n GLY 16 N -1.18 -2.89 0.26 -3.96 0.00 -1.02 -0.63 105.19 95.77 2d88 n GLY 16 Ca 0.01 0.79 0.02 0.00 0.00 0.00 0.00 46.02 46.84 2d88 n GLY 16 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2d88 n TRP 17 N -3.77 0.17 -0.06 1.61 -0.00 -0.20 0.17 117.44 115.36 2d88 n TRP 17 Ca 0.01 0.86 -0.08 0.00 -0.00 0.00 0.00 57.50 58.29 2d88 n TRP 17 Cb 0.09 -0.86 -0.02 0.00 -0.00 0.00 0.00 31.31 30.53 2d88 n TRP 17 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2d88 h GLN 19 N 0.21 -0.07 0.16 0.00 4.20 0.24 0.67 115.11 120.52 2d88 h GLN 19 Ca 0.11 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.81 2d88 h GLN 19 Cb 0.07 0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.86 2d88 h GLN 19 CO -0.10 -0.05 -0.08 0.00 -0.67 0.00 0.00 178.83 177.93 2d88 h ARG 20 N -0.07 -0.21 0.52 1.46 -0.00 -0.50 -0.24 114.38 115.34 2d88 h ARG 20 Ca -0.00 0.01 -0.03 0.00 -0.50 0.00 0.00 59.98 59.47 2d88 h ARG 20 Cb 0.06 0.05 0.01 0.00 0.00 0.00 0.00 29.97 30.09 2d88 h ARG 20 CO -0.00 -0.14 -0.25 1.96 0.00 0.00 0.00 179.97 181.54 2d88 h GLN 21 N -0.22 -0.67 -1.12 0.04 1.08 -0.47 -3.08 115.11 110.67 2d88 h GLN 21 Ca -0.02 0.05 0.33 0.00 -1.45 0.00 0.00 58.65 57.56 2d88 h GLN 21 Cb 0.17 0.15 -0.12 0.00 -0.05 0.00 0.00 27.48 27.63 2d88 h GLN 21 CO 0.04 -0.45 0.70 1.79 -0.95 0.00 0.00 178.83 179.95 2d88 h THR 22 N -0.84 0.33 -1.41 -0.54 1.35 0.29 -3.41 112.91 108.68 2d88 h THR 22 Ca -0.07 -0.10 -0.76 0.00 -0.55 0.00 0.00 66.41 64.93 2d88 h THR 22 Cb 0.54 0.03 0.03 0.00 -1.73 0.00 0.00 68.15 67.01 2d88 h THR 22 CO 0.12 0.05 0.65 -0.67 -0.25 0.00 0.00 175.52 175.42 2d88 n ASP 23 N -4.77 1.69 0.00 5.36 -0.08 -0.10 -2.21 116.55 116.44 2d88 n ASP 23 Ca 0.31 1.12 0.00 0.00 -1.51 0.00 0.00 54.79 54.71 2d88 n ASP 23 Cb 1.08 -1.08 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2d88 n ASP 23 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2d88 n GLY 24 N 3.41 1.06 2.47 0.27 0.00 -1.26 -5.01 105.19 106.13 2d88 n GLY 24 Ca 0.25 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.06 2d88 n GLY 24 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2d88 n TYR 25 N 0.00 -3.69 -3.99 1.61 4.02 -0.94 -5.04 117.16 109.13 2d88 n TYR 25 Ca 0.00 -0.71 -0.33 0.00 -0.01 0.00 0.00 57.90 56.85 2d88 n TYR 25 Cb 0.00 -0.77 -0.14 0.00 -0.02 0.00 0.00 39.34 38.41 2d88 n TYR 25 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2d88 s ALA 26 N -3.20 2.70 0.00 -0.72 0.00 -1.26 -4.59 121.76 114.68 2d88 s ALA 26 Ca 0.50 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.66 2d88 s ALA 26 Cb -0.04 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.31 2d88 s ALA 26 CO 0.37 -1.25 0.00 0.41 0.00 0.00 0.00 175.76 175.29 2d88 n GLY 27 N 4.52 0.54 2.48 0.00 0.00 -1.26 -5.00 105.19 106.47 2d88 n GLY 27 Ca -0.13 -0.82 -0.28 0.00 0.00 0.00 0.00 46.02 44.79 2d88 n GLY 27 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2d88 n VAL 28 N -2.75 2.48 -3.19 1.61 0.31 -1.26 -4.94 118.33 110.59 2d88 n VAL 28 Ca 0.00 -5.24 -0.44 0.00 -0.01 0.00 0.00 64.34 58.65 2d88 n VAL 28 Cb 0.00 -2.11 -0.07 0.00 -0.91 0.00 0.00 33.84 30.76 2d88 n VAL 28 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2d88 s ASN 29 N -2.38 6.23 -0.60 4.52 4.22 -1.26 -4.72 114.94 120.96 2d88 s ASN 29 Ca 0.39 -0.81 -0.24 0.00 -2.14 0.00 0.00 52.86 50.06 2d88 s ASN 29 Cb 0.13 -2.28 0.05 0.00 1.28 0.00 0.00 41.25 40.43 2d88 s ASN 29 CO -0.02 -0.81 1.00 -0.69 -2.04 0.00 0.00 177.10 174.55 2d88 s VAL 30 N 2.53 4.27 -0.00 3.54 1.01 -1.26 -4.77 120.40 125.72 2d88 s VAL 30 Ca 0.15 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.31 2d88 s VAL 30 Cb -0.18 -4.63 -0.00 0.00 0.00 0.00 0.00 36.38 31.57 2d88 s VAL 30 CO 0.13 -1.29 0.00 1.07 0.00 0.00 0.00 175.10 175.01 2d88 n THR 31 N 6.18 0.00 -4.19 3.92 5.66 -1.26 -4.80 114.28 119.79 2d88 n THR 31 Ca 0.01 -0.49 -0.13 0.00 -3.05 0.00 0.00 64.05 60.39 2d88 n THR 31 Cb 0.47 1.00 -0.09 0.00 -1.55 0.00 0.00 70.33 70.16 2d88 n THR 31 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2d88 s ASP 32 N -1.01 0.34 -0.12 1.09 1.01 -1.26 -5.06 116.67 111.66 2d88 s ASP 32 Ca 0.00 -1.40 0.16 0.00 0.71 0.00 0.00 52.55 52.02 2d88 s ASP 32 Cb 0.00 0.43 0.31 0.00 1.01 0.00 0.00 42.92 44.67 2d88 s ASP 32 CO 0.00 -0.90 1.20 0.18 0.21 0.00 0.00 175.17 175.86 2d88 n LEU 33 N -0.33 2.71 0.00 1.23 4.77 -1.26 -4.39 117.00 119.73 2d88 n LEU 33 Ca 0.02 -2.89 0.00 0.00 -0.03 0.00 0.00 56.01 53.11 2d88 n LEU 33 Cb 0.65 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2d88 n LEU 33 CO 0.32 0.68 0.00 0.35 -1.33 0.00 0.00 177.39 177.41 2d88 n THR 34 N -1.01 0.00 0.10 -5.08 -2.24 -1.26 -4.73 114.28 100.05 2d88 n THR 34 Ca 0.15 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.75 2d88 n THR 34 Cb 0.64 -0.73 -0.12 0.00 -2.10 0.00 0.00 70.33 68.02 2d88 n THR 34 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2d88 h MET 35 N 0.00 0.41 -1.91 -0.78 -0.00 -1.93 -3.14 114.93 107.58 2d88 h MET 35 Ca 0.00 -0.60 0.55 0.00 -0.00 0.00 0.00 59.70 59.65 2d88 h MET 35 Cb 0.00 0.21 -0.08 0.00 -0.00 0.00 0.00 31.60 31.73 2d88 h MET 35 CO 0.00 1.26 1.41 0.45 -0.00 0.00 0.00 176.91 180.03 2d88 n SER 36 N -3.66 0.00 -0.05 -0.10 2.88 -1.26 0.22 113.62 111.65 2d88 n SER 36 Ca -0.10 0.97 0.00 0.00 -1.33 0.00 0.00 58.87 58.42 2d88 n SER 36 Cb 0.98 -0.48 -0.15 0.00 -0.75 0.00 0.00 64.21 63.82 2d88 n SER 36 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 2d88 n TRP 37 N -3.86 0.00 -0.42 0.66 7.02 -1.24 -4.39 117.44 115.21 2d88 n TRP 37 Ca 0.43 0.00 0.36 0.00 -1.02 0.00 0.00 57.50 57.27 2d88 n TRP 37 Cb 1.99 -0.68 0.69 0.00 -2.42 0.00 0.00 31.31 30.89 2d88 n TRP 37 CO 0.00 0.00 0.00 0.87 -2.02 0.00 0.00 177.69 176.54 2d88 h LYS 38 N 0.00 0.09 0.18 -0.99 1.57 0.27 0.16 116.57 117.86 2d88 h LYS 38 Ca -0.25 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 2d88 h LYS 38 Cb 1.52 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.81 2d88 h LYS 38 CO 0.01 0.06 -0.09 1.03 -0.57 0.00 0.00 179.45 179.90 2d88 h SER 39 N 0.10 -0.21 0.00 0.86 0.87 -1.74 -3.45 113.55 109.98 2d88 h SER 39 Ca 0.69 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 61.13 2d88 h SER 39 Cb 2.45 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 64.47 2d88 h SER 39 CO -0.15 -0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.75 2d88 n GLY 40 N -0.75 2.45 0.26 5.77 0.00 0.57 -4.32 105.19 109.18 2d88 n GLY 40 Ca -0.09 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 45.00 2d88 n GLY 40 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2d88 h LEU 41 N 0.00 -0.93 -0.14 0.99 3.38 -1.87 -1.89 115.31 114.85 2d88 h LEU 41 Ca 0.00 0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.09 2d88 h LEU 41 Cb 0.00 0.35 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 2d88 h LEU 41 CO 0.00 -0.29 -0.08 0.00 0.09 0.00 0.00 178.44 178.16 2d88 n ALA 42 N -2.77 -0.09 -0.33 1.53 0.00 -1.26 0.14 120.51 117.73 2d88 n ALA 42 Ca -0.04 0.12 0.19 0.00 0.00 0.00 0.00 53.44 53.71 2d88 n ALA 42 Cb 0.22 0.27 0.40 0.00 0.00 0.00 0.00 19.45 20.35 2d88 n ALA 42 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2d88 h LEU 43 N 0.00 0.42 -0.56 0.00 5.85 -1.84 0.42 115.31 119.61 2d88 h LEU 43 Ca 0.02 0.18 -0.07 0.00 0.84 0.00 0.00 57.88 58.85 2d88 h LEU 43 Cb 0.06 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 2d88 h LEU 43 CO -0.13 -0.08 0.08 0.00 -0.34 0.00 0.00 178.44 177.96 2d88 h ALA 45 N 0.99 1.00 0.00 0.00 0.00 0.37 -2.11 119.26 119.51 2d88 h ALA 45 Ca 0.17 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2d88 h ALA 45 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2d88 h ALA 45 CO 0.01 0.00 -0.00 0.82 0.00 0.00 0.00 179.25 180.08 2d88 h ILE 46 N 0.00 1.73 -0.59 0.00 1.08 -0.65 -1.49 117.51 117.60 2d88 h ILE 46 Ca 0.00 -2.16 -0.10 0.00 -0.39 0.00 0.00 64.86 62.21 2d88 h ILE 46 Cb 0.25 3.20 -0.02 0.00 -3.07 0.00 0.00 36.82 37.18 2d88 h ILE 46 CO 0.00 0.56 -0.01 0.40 -0.69 0.00 0.00 178.15 178.42 2d88 h ILE 47 N -0.92 1.27 -0.19 -0.67 2.04 -1.36 -3.14 117.51 114.53 2d88 h ILE 47 Ca -0.00 -1.15 -0.10 0.00 1.00 0.00 0.00 64.86 64.61 2d88 h ILE 47 Cb 0.92 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 37.83 2d88 h ILE 47 CO 0.00 0.42 -0.26 -0.74 0.00 0.00 0.00 178.15 177.57 2d88 h HIS 48 N 0.94 0.63 -0.76 1.37 2.76 -1.41 0.11 115.15 118.79 2d88 h HIS 48 Ca 0.17 -0.21 0.24 0.00 -2.20 0.00 0.00 60.37 58.37 2d88 h HIS 48 Cb 0.56 -0.12 -0.14 0.00 1.55 0.00 0.00 27.41 29.26 2d88 h HIS 48 CO 0.04 0.90 0.12 -2.13 -1.30 0.00 0.00 177.93 175.56 2d88 n ARG 49 N -4.39 -0.06 -0.14 5.26 3.00 -0.56 -1.73 116.66 118.05 2d88 n ARG 49 Ca -0.06 1.12 -0.28 0.00 -0.00 0.00 0.00 57.85 58.64 2d88 n ARG 49 Cb 0.45 -1.83 -0.10 0.00 0.00 0.00 0.00 32.46 30.97 2d88 n ARG 49 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 2d88 n TYR 50 N -4.98 0.07 -3.89 -0.14 4.02 -1.22 -4.85 117.16 106.17 2d88 n TYR 50 Ca 0.21 0.03 -0.30 0.00 -0.01 0.00 0.00 57.90 57.82 2d88 n TYR 50 Cb 0.69 -1.01 -0.14 0.00 -0.02 0.00 0.00 39.34 38.86 2d88 n TYR 50 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2d88 s ARG 51 N -2.50 1.44 0.34 -0.72 1.81 0.38 -4.96 118.95 114.74 2d88 s ARG 51 Ca -0.38 -1.97 0.13 0.00 -1.72 0.00 0.00 55.73 51.80 2d88 s ARG 51 Cb 0.14 -2.85 0.61 0.00 -0.45 0.00 0.00 34.95 32.39 2d88 s ARG 51 CO 0.52 -1.04 1.74 -1.00 -0.68 0.00 0.00 175.30 174.84 2d88 h PRO 52 N 7.22 0.00 0.16 3.54 0.13 -1.61 -3.23 132.00 138.21 2d88 h PRO 52 Ca -0.06 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.08 2d88 h PRO 52 Cb 0.97 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.07 2d88 h PRO 52 CO 0.55 0.45 -0.24 0.22 -0.23 0.00 0.00 178.00 178.76 2d88 h ASP 53 N 0.00 -0.65 -0.12 1.44 1.82 -1.91 -3.10 116.42 113.89 2d88 h ASP 53 Ca -0.00 0.07 0.02 0.00 -0.39 0.00 0.00 57.03 56.73 2d88 h ASP 53 Cb 0.84 0.24 -0.05 0.00 0.68 0.00 0.00 39.33 41.04 2d88 h ASP 53 CO 0.06 -0.33 -0.40 -0.07 -1.61 0.00 0.00 179.24 176.88 2d88 h LEU 54 N -0.46 -1.28 -8.57 2.28 3.38 -1.91 -3.40 115.31 105.34 2d88 h LEU 54 Ca 0.02 0.15 -0.67 0.00 0.09 0.00 0.00 57.88 57.47 2d88 h LEU 54 Cb 0.46 0.50 -0.28 0.00 0.09 0.00 0.00 40.66 41.43 2d88 h LEU 54 CO -0.10 -0.35 -0.81 -0.51 0.09 0.00 0.00 178.44 176.75 2d88 s ILE 55 N -4.98 2.66 -0.45 1.22 2.07 -1.17 -5.00 121.20 115.55 2d88 s ILE 55 Ca -0.11 -0.82 -0.15 0.00 -1.41 0.00 0.00 60.65 58.16 2d88 s ILE 55 Cb 0.05 -2.06 0.06 0.00 0.13 0.00 0.00 42.46 40.64 2d88 s ILE 55 CO 0.45 0.55 0.36 -0.62 -1.91 0.00 0.00 174.94 173.77 2d88 s ASP 56 N 0.10 6.11 0.16 4.50 2.15 -1.24 -4.50 116.67 123.94 2d88 s ASP 56 Ca -0.08 -1.20 0.05 0.00 0.43 0.00 0.00 52.55 51.75 2d88 s ASP 56 Cb -0.15 -2.17 -0.03 0.00 -0.30 0.00 0.00 42.92 40.27 2d88 s ASP 56 CO 0.05 -0.58 1.37 0.15 -0.17 0.00 0.00 175.17 175.99 2d88 h PHE 57 N 8.70 0.17 -0.37 -5.34 3.04 -1.89 -2.89 116.94 118.35 2d88 h PHE 57 Ca -0.28 -0.10 0.03 0.00 3.98 0.00 0.00 57.97 61.61 2d88 h PHE 57 Cb 1.11 -0.02 -0.03 0.00 2.56 0.00 0.00 35.95 39.57 2d88 h PHE 57 CO 0.61 0.94 0.17 0.22 -2.02 0.00 0.00 178.31 178.23 2d88 h ASP 58 N 0.05 0.24 -0.12 0.41 3.58 -1.98 -2.94 116.42 115.66 2d88 h ASP 58 Ca -0.03 0.02 -0.06 0.00 0.42 0.00 0.00 57.03 57.38 2d88 h ASP 58 Cb 1.55 -0.02 -0.00 0.00 1.72 0.00 0.00 39.33 42.58 2d88 h ASP 58 CO 0.13 0.18 -0.14 -1.28 -2.88 0.00 0.00 179.24 175.24 2d88 h SER 59 N 0.35 0.34 -2.86 2.28 0.87 -1.99 -3.45 113.55 109.08 2d88 h SER 59 Ca 0.16 -0.50 -0.59 0.00 -1.23 0.00 0.00 61.79 59.64 2d88 h SER 59 Cb 0.09 -0.10 0.17 0.00 -0.44 0.00 0.00 62.40 62.12 2d88 h SER 59 CO -0.13 0.77 -0.39 0.18 -0.53 0.00 0.00 176.83 176.74 2d88 n LEU 60 N -4.58 0.65 -4.56 2.23 4.77 -1.09 -5.00 117.00 109.42 2d88 n LEU 60 Ca -0.07 0.77 -0.25 0.00 -0.03 0.00 0.00 56.01 56.44 2d88 n LEU 60 Cb 0.36 -1.17 -0.09 0.00 -2.33 0.00 0.00 43.42 40.20 2d88 n LEU 60 CO 0.39 -3.01 -0.41 -0.62 -1.33 0.00 0.00 177.39 172.42 2d88 s ASP 61 N -1.12 4.12 0.22 -1.43 -1.08 -1.26 -4.95 116.67 111.17 2d88 s ASP 61 Ca 0.68 -0.75 0.26 0.00 -0.52 0.00 0.00 52.55 52.21 2d88 s ASP 61 Cb -0.47 -0.62 0.69 0.00 -1.46 0.00 0.00 42.92 41.06 2d88 s ASP 61 CO 0.55 0.05 1.69 1.05 0.52 0.00 0.00 175.17 179.03 2d88 h GLU 62 N 2.36 0.00 0.00 4.34 9.09 -1.96 -3.22 114.58 125.19 2d88 h GLU 62 Ca -0.44 0.00 -0.21 0.00 0.05 0.00 0.00 59.36 58.77 2d88 h GLU 62 Cb 1.24 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 28.31 2d88 h GLU 62 CO 0.58 0.00 -1.05 -0.56 0.05 0.00 0.00 179.01 178.02 2d88 h GLN 63 N 0.00 0.00 -5.93 1.06 3.07 -1.98 -3.44 115.11 107.89 2d88 h GLN 63 Ca 0.00 0.00 -0.60 0.00 0.09 0.00 0.00 58.65 58.14 2d88 h GLN 63 Cb 0.77 0.00 -0.09 0.00 0.08 0.00 0.00 27.48 28.23 2d88 h GLN 63 CO 0.00 0.82 0.52 -0.80 0.09 0.00 0.00 178.83 179.46 2d88 s ASN 64 N -6.54 6.71 -0.06 0.06 0.01 -1.22 -4.93 114.94 108.97 2d88 s ASN 64 Ca 0.00 0.70 -0.06 0.00 -0.71 0.00 0.00 52.86 52.80 2d88 s ASN 64 Cb 0.09 -2.44 -0.02 0.00 0.41 0.00 0.00 41.25 39.29 2d88 s ASN 64 CO 0.81 -0.72 -0.12 0.52 -1.51 0.00 0.00 177.10 176.09 2d88 n VAL 65 N 5.69 0.52 -0.32 1.60 0.31 -1.26 -3.92 118.33 120.95 2d88 n VAL 65 Ca 0.06 0.38 0.30 0.00 -0.01 0.00 0.00 64.34 65.06 2d88 n VAL 65 Cb 0.48 -1.80 0.65 0.00 -0.91 0.00 0.00 33.84 32.26 2d88 n VAL 65 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2d88 h GLU 66 N -0.35 0.16 0.00 5.55 4.81 -1.82 -1.98 114.58 120.96 2d88 h GLU 66 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2d88 h GLU 66 Cb 0.34 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.68 2d88 h GLU 66 CO 0.00 0.11 0.00 1.17 -0.73 0.00 0.00 179.01 179.56 2d88 n LYS 67 N -4.39 0.00 -0.62 1.92 3.00 -1.26 -0.36 118.16 116.45 2d88 n LYS 67 Ca 0.25 0.45 0.48 0.00 -0.00 0.00 0.00 58.31 59.49 2d88 n LYS 67 Cb 1.09 -1.24 0.76 0.00 0.00 0.00 0.00 35.03 35.64 2d88 n LYS 67 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2d88 n ASN 68 N -1.84 0.08 -0.03 3.14 3.02 -0.99 -0.38 115.26 118.25 2d88 n ASN 68 Ca 0.00 1.12 -0.01 0.00 -0.03 0.00 0.00 54.58 55.66 2d88 n ASN 68 Cb 0.00 -0.56 -0.00 0.00 -0.61 0.00 0.00 39.78 38.61 2d88 n ASN 68 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 2d88 h ASN 69 N 0.00 -0.03 -1.07 6.41 2.35 -1.36 -3.12 115.58 118.76 2d88 h ASN 69 Ca 0.91 0.00 0.29 0.00 -0.55 0.00 0.00 56.30 56.95 2d88 h ASN 69 Cb 3.40 0.01 -0.10 0.00 0.05 0.00 0.00 38.32 41.68 2d88 h ASN 69 CO -0.17 0.41 0.69 -0.61 -1.65 0.00 0.00 177.43 176.10 2d88 h GLN 70 N -0.90 0.33 0.11 0.81 5.75 0.16 -1.02 115.11 120.36 2d88 h GLN 70 Ca -0.00 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.47 2d88 h GLN 70 Cb 0.03 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 28.50 2d88 h GLN 70 CO 0.01 0.22 -0.05 1.25 -2.65 0.00 0.00 178.83 177.60 2d88 h LEU 71 N 0.34 -0.12 -0.73 -2.39 5.85 -0.83 -2.55 115.31 114.88 2d88 h LEU 71 Ca 0.62 0.00 0.14 0.00 0.84 0.00 0.00 57.88 59.49 2d88 h LEU 71 Cb 1.65 0.03 -0.14 0.00 0.37 0.00 0.00 40.66 42.58 2d88 h LEU 71 CO -0.30 -0.08 -0.19 0.00 -0.34 0.00 0.00 178.44 177.53 2d88 h ALA 72 N -1.91 0.45 -0.59 1.25 0.00 -1.37 0.96 119.26 118.04 2d88 h ALA 72 Ca -0.01 0.28 0.17 0.00 0.00 0.00 0.00 54.91 55.34 2d88 h ALA 72 Cb 0.11 0.57 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2d88 h ALA 72 CO 0.02 -0.43 0.49 0.74 0.00 0.00 0.00 179.25 180.07 2d88 h PHE 73 N -0.01 0.00 0.00 0.00 0.04 -1.24 0.36 116.94 116.09 2d88 h PHE 73 Ca 0.34 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 61.08 2d88 h PHE 73 Cb 0.54 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.68 2d88 h PHE 73 CO -0.59 0.00 -0.57 0.22 -0.60 0.00 0.00 178.31 176.76 2d88 h ASP 74 N 0.00 0.00 -0.41 2.17 3.58 0.12 -3.34 116.42 118.53 2d88 h ASP 74 Ca 0.28 -0.08 0.08 0.00 0.42 0.00 0.00 57.03 57.73 2d88 h ASP 74 Cb 1.25 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 42.23 2d88 h ASP 74 CO -0.00 0.84 -0.06 0.40 -2.88 0.00 0.00 179.24 177.54 2d88 h ILE 75 N -1.00 0.63 0.00 2.25 1.08 -0.15 0.37 117.51 120.68 2d88 h ILE 75 Ca -0.05 -0.01 0.00 0.00 -0.39 0.00 0.00 64.86 64.41 2d88 h ILE 75 Cb 0.59 0.59 0.00 0.00 -3.07 0.00 0.00 36.82 34.92 2d88 h ILE 75 CO -0.03 0.01 0.00 0.00 -0.69 0.00 0.00 178.15 177.44 2d88 n ALA 76 N -2.66 -0.14 -0.28 1.87 0.00 0.12 -0.74 120.51 118.69 2d88 n ALA 76 Ca 0.03 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.51 2d88 n ALA 76 Cb 0.22 0.34 0.26 0.00 0.00 0.00 0.00 19.45 20.27 2d88 n ALA 76 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2d88 h GLU 77 N 0.00 0.96 -0.51 0.00 4.81 -1.50 1.61 114.58 119.96 2d88 h GLU 77 Ca 0.00 -0.06 0.10 0.00 -0.13 0.00 0.00 59.36 59.27 2d88 h GLU 77 Cb 0.00 -0.22 -0.09 0.00 0.63 0.00 0.00 28.75 29.07 2d88 h GLU 77 CO 0.00 0.64 -0.09 0.87 -0.73 0.00 0.00 179.01 179.70 2d88 h LYS 78 N 0.99 0.03 0.00 1.92 1.79 0.61 -2.53 116.57 119.39 2d88 h LYS 78 Ca 0.37 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.84 2d88 h LYS 78 Cb 0.17 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 2d88 h LYS 78 CO -0.13 0.02 -0.27 0.39 -1.08 0.00 0.00 179.45 178.38 2d88 n GLU 79 N -5.33 0.14 -0.30 3.15 -0.58 0.09 -4.71 120.64 113.10 2d88 n GLU 79 Ca 0.05 0.06 0.10 0.00 -0.42 0.00 0.00 57.16 56.94 2d88 n GLU 79 Cb 0.27 -0.63 0.26 0.00 -0.57 0.00 0.00 31.44 30.77 2d88 n GLU 79 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 2d88 h LEU 80 N -0.27 0.46 0.00 -4.62 3.38 0.20 -3.46 115.31 111.01 2d88 h LEU 80 Ca 0.00 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2d88 h LEU 80 Cb 0.27 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2d88 h LEU 80 CO 0.00 0.14 0.00 0.61 0.09 0.00 0.00 178.44 179.28 2d88 n GLY 81 N -1.33 1.57 3.55 0.83 0.00 0.13 -4.90 105.19 105.04 2d88 n GLY 81 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 2d88 n GLY 81 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2d88 s ILE 82 N -2.43 3.11 0.25 -0.61 1.01 -1.25 -4.63 121.20 116.64 2d88 s ILE 82 Ca 0.00 0.01 -0.31 0.00 0.00 0.00 0.00 60.65 60.35 2d88 s ILE 82 Cb 0.00 -3.27 -0.12 0.00 0.01 0.00 0.00 42.46 39.08 2d88 s ILE 82 CO 0.00 -0.26 1.63 -1.54 0.00 0.00 0.00 174.94 174.78 2d88 n SER 83 N 15.74 3.81 -4.77 3.58 3.41 -1.26 -3.21 113.62 130.92 2d88 n SER 83 Ca 0.36 1.11 -0.34 0.00 -0.26 0.00 0.00 58.87 59.74 2d88 n SER 83 Cb 0.51 -1.57 0.03 0.00 -0.26 0.00 0.00 64.21 62.93 2d88 n SER 83 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2d88 s PRO 84 N 0.18 3.01 -0.03 4.33 0.04 -1.26 -4.98 135.00 136.29 2d88 s PRO 84 Ca 0.69 1.48 0.20 0.00 0.04 0.00 0.00 61.00 63.41 2d88 s PRO 84 Cb -0.52 -1.97 -0.25 0.00 0.04 0.00 0.00 34.50 31.80 2d88 s PRO 84 CO 0.42 -1.10 0.51 0.44 0.04 0.00 0.00 177.00 177.31 2d88 n ILE 85 N -2.00 0.56 -4.07 0.56 -5.35 -1.26 -5.00 119.36 102.80 2d88 n ILE 85 Ca 0.11 -0.61 -0.10 0.00 -0.27 0.00 0.00 62.75 61.87 2d88 n ILE 85 Cb 0.52 -0.25 -0.08 0.00 -1.74 0.00 0.00 39.64 38.09 2d88 n ILE 85 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 2d88 s MET 86 N -3.18 1.25 0.07 6.28 -1.94 -1.26 -5.17 119.30 115.35 2d88 s MET 86 Ca -0.07 -1.38 -0.05 0.00 -1.71 0.00 0.00 55.69 52.49 2d88 s MET 86 Cb 0.11 0.35 -0.05 0.00 2.01 0.00 0.00 34.83 37.25 2d88 s MET 86 CO 0.86 -0.45 0.30 0.95 -0.01 0.00 0.00 175.02 176.67 2d88 s THR 87 N -4.05 5.26 0.26 2.05 -4.23 -1.26 -4.96 115.64 108.70 2d88 s THR 87 Ca 0.27 0.03 -0.06 0.00 -1.18 0.00 0.00 61.69 60.74 2d88 s THR 87 Cb 0.04 -3.60 0.34 0.00 1.34 0.00 0.00 72.50 70.62 2d88 s THR 87 CO 0.07 0.20 1.60 1.23 -0.54 0.00 0.00 174.62 177.18 2d88 h GLY 88 N 3.37 0.84 1.03 3.99 0.00 -1.85 0.38 103.07 110.84 2d88 h GLY 88 Ca -0.47 0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.00 2d88 h GLY 88 CO 0.70 -0.35 0.33 1.70 0.00 0.00 0.00 176.54 178.92 2d88 h LYS 89 N 0.04 1.11 0.00 4.80 3.11 -1.95 -1.85 116.57 121.84 2d88 h LYS 89 Ca 0.45 -0.19 -0.03 0.00 -2.81 0.00 0.00 60.65 58.08 2d88 h LYS 89 Cb 0.80 -0.19 -0.00 0.00 -1.00 0.00 0.00 32.23 31.83 2d88 h LYS 89 CO -0.80 0.89 -0.13 0.93 -2.81 0.00 0.00 179.45 177.52 2d88 h GLU 90 N 1.07 0.00 0.10 1.90 4.39 -0.74 -0.56 114.58 120.75 2d88 h GLU 90 Ca 0.25 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.69 2d88 h GLU 90 Cb 0.17 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.83 2d88 h GLU 90 CO -0.03 0.13 -1.18 1.98 -1.16 0.00 0.00 179.01 178.76 2d88 h MET 91 N 0.00 0.36 0.00 2.33 4.05 -0.12 -2.48 114.93 119.06 2d88 h MET 91 Ca -0.00 -0.52 -0.03 0.00 -0.28 0.00 0.00 59.70 58.87 2d88 h MET 91 Cb 0.39 0.18 -0.00 0.00 -0.80 0.00 0.00 31.60 31.37 2d88 h MET 91 CO 0.02 1.21 -0.25 0.00 0.23 0.00 0.00 176.91 178.12 2d88 h ALA 92 N 0.58 0.87 0.13 0.39 0.00 -0.96 -3.32 119.26 116.94 2d88 h ALA 92 Ca -0.13 -0.12 -0.21 0.00 0.00 0.00 0.00 54.91 54.46 2d88 h ALA 92 Cb 1.87 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.67 2d88 h ALA 92 CO 0.20 0.15 -0.97 0.66 0.00 0.00 0.00 179.25 179.29 2d88 h SER 93 N 0.00 0.43 -4.07 0.00 4.64 -1.15 -3.46 113.55 109.94 2d88 h SER 93 Ca -0.01 -0.92 -0.54 0.00 -0.47 0.00 0.00 61.79 59.85 2d88 h SER 93 Cb 1.09 -0.14 0.13 0.00 -0.31 0.00 0.00 62.40 63.17 2d88 h SER 93 CO 0.01 1.45 0.54 0.54 -0.87 0.00 0.00 176.83 178.50 2d88 s VAL 94 N -2.44 2.30 0.09 0.95 0.11 -0.94 -4.94 120.40 115.54 2d88 s VAL 94 Ca -0.16 0.21 0.08 0.00 -2.93 0.00 0.00 61.98 59.18 2d88 s VAL 94 Cb 0.02 -3.10 -0.22 0.00 -1.53 0.00 0.00 36.38 31.56 2d88 s VAL 94 CO 0.81 -0.02 1.17 1.23 -3.33 0.00 0.00 175.10 174.95 2d88 h GLY 95 N 1.15 0.01 -5.86 6.54 0.00 -1.89 -3.47 103.07 99.55 2d88 h GLY 95 Ca -0.51 -0.02 0.14 0.00 0.00 0.00 0.00 47.33 46.95 2d88 h GLY 95 CO 0.56 0.02 0.36 1.85 0.00 0.00 0.00 176.54 179.33 2d88 s GLU 96 N -2.69 0.32 0.97 4.80 2.12 -1.26 -5.00 118.70 117.96 2d88 s GLU 96 Ca -0.00 0.63 -0.12 0.00 0.36 0.00 0.00 54.97 55.84 2d88 s GLU 96 Cb 0.10 0.19 0.17 0.00 0.26 0.00 0.00 34.13 34.85 2d88 s GLU 96 CO 0.82 -0.08 1.09 -1.25 -0.54 0.00 0.00 175.26 175.30 2d88 s PRO 97 N 1.71 0.69 -0.19 4.30 0.04 -1.26 -5.00 135.00 135.28 2d88 s PRO 97 Ca -0.07 0.62 -0.22 0.00 0.04 0.00 0.00 61.00 61.37 2d88 s PRO 97 Cb -0.04 -1.76 -0.02 0.00 0.04 0.00 0.00 34.50 32.72 2d88 s PRO 97 CO -0.15 -2.58 0.71 0.34 0.04 0.00 0.00 177.00 175.35 2d88 s ASP 98 N -3.44 6.77 0.16 6.66 2.15 -1.26 -4.92 116.67 122.78 2d88 s ASP 98 Ca 0.65 0.95 -0.29 0.00 0.43 0.00 0.00 52.55 54.28 2d88 s ASP 98 Cb -0.18 -2.39 -0.05 0.00 -0.30 0.00 0.00 42.92 40.00 2d88 s ASP 98 CO 0.57 -0.33 1.47 1.17 -0.17 0.00 0.00 175.17 177.88 2d88 n LYS 99 N 5.21 -0.41 0.00 4.34 3.00 -1.26 -0.43 118.16 128.61 2d88 n LYS 99 Ca 0.01 1.44 0.00 0.00 -0.00 0.00 0.00 58.31 59.76 2d88 n LYS 99 Cb 0.49 -2.12 0.00 0.00 0.00 0.00 0.00 35.03 33.40 2d88 n LYS 99 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 2d88 n LEU 100 N -5.21 0.00 -0.28 3.14 4.77 -1.26 -0.34 117.00 117.82 2d88 n LEU 100 Ca 0.02 0.87 0.17 0.00 -0.03 0.00 0.00 56.01 57.04 2d88 n LEU 100 Cb 0.26 -0.37 0.32 0.00 -2.33 0.00 0.00 43.42 41.30 2d88 n LEU 100 CO -0.15 -0.37 0.73 -1.20 -1.33 0.00 0.00 177.39 175.07 2d88 n SER 101 N -1.96 0.03 0.43 -1.43 7.64 -0.93 -0.11 113.62 117.28 2d88 n SER 101 Ca 0.00 1.40 -0.17 0.00 1.01 0.00 0.00 58.87 61.11 2d88 n SER 101 Cb 0.00 -0.56 -0.08 0.00 -1.01 0.00 0.00 64.21 62.55 2d88 n SER 101 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2d88 h MET 102 N 0.00 -1.08 -0.17 1.43 2.86 -0.18 -2.36 114.93 115.43 2d88 h MET 102 Ca 0.57 0.07 0.04 0.00 -2.06 0.00 0.00 59.70 58.33 2d88 h MET 102 Cb 1.30 0.25 -0.07 0.00 0.06 0.00 0.00 31.60 33.14 2d88 h MET 102 CO -0.74 -0.72 -0.45 0.28 1.06 0.00 0.00 176.91 176.34 2d88 h VAL 103 N -1.28 0.10 -0.70 -2.22 2.07 0.25 0.22 116.25 114.69 2d88 h VAL 103 Ca -0.11 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.54 2d88 h VAL 103 Cb 0.86 0.10 -0.13 0.00 -1.52 0.00 0.00 31.29 30.60 2d88 h VAL 103 CO 0.19 0.00 -0.22 0.24 0.02 0.00 0.00 177.57 177.80 2d88 h MET 104 N -0.49 -0.04 0.83 1.57 2.86 -1.00 0.20 114.93 118.86 2d88 h MET 104 Ca 0.07 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.68 2d88 h MET 104 Cb 0.64 0.01 0.01 0.00 0.06 0.00 0.00 31.60 32.31 2d88 h MET 104 CO -0.43 -0.03 -0.40 -0.92 1.06 0.00 0.00 176.91 176.19 2d88 h TYR 105 N -0.04 -1.03 -0.90 -0.22 3.20 -0.75 -3.07 116.97 114.16 2d88 h TYR 105 Ca 0.32 -0.02 0.25 0.00 3.14 0.00 0.00 58.73 62.42 2d88 h TYR 105 Cb 0.54 0.34 -0.15 0.00 1.54 0.00 0.00 36.73 39.00 2d88 h TYR 105 CO -0.60 -0.64 0.22 -0.07 -1.64 0.00 0.00 178.16 175.43 2d88 h LEU 106 N -1.24 -0.06 -0.81 2.82 3.38 -0.01 1.00 115.31 120.39 2d88 h LEU 106 Ca -0.11 0.21 0.16 0.00 0.09 0.00 0.00 57.88 58.23 2d88 h LEU 106 Cb 0.85 0.30 -0.15 0.00 0.09 0.00 0.00 40.66 41.75 2d88 h LEU 106 CO 0.19 -0.20 -0.20 0.74 0.09 0.00 0.00 178.44 179.05 2d88 h THR 107 N 0.16 0.19 -0.95 0.22 2.02 -0.52 0.03 112.91 114.06 2d88 h THR 107 Ca 0.58 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.90 2d88 h THR 107 Cb 1.19 0.19 -0.15 0.00 -1.74 0.00 0.00 68.15 67.64 2d88 h THR 107 CO -0.70 0.00 -0.39 1.56 0.37 0.00 0.00 175.52 176.35 2d88 h GLN 108 N -0.00 -0.02 0.35 6.66 4.20 -0.83 0.34 115.11 125.82 2d88 h GLN 108 Ca 0.39 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 59.08 2d88 h GLN 108 Cb 0.59 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.38 2d88 h GLN 108 CO -0.84 -0.01 -0.18 0.74 -0.67 0.00 0.00 178.83 177.87 2d88 h PHE 109 N -0.02 -0.47 0.11 2.96 0.04 -1.11 -2.58 116.94 115.87 2d88 h PHE 109 Ca 0.32 -0.01 0.01 0.00 2.80 0.00 0.00 57.97 61.09 2d88 h PHE 109 Cb 0.58 0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.86 2d88 h PHE 109 CO -0.86 -0.29 -0.36 -0.92 -0.60 0.00 0.00 178.31 175.29 2d88 h TYR 110 N -0.49 -1.02 -1.14 -0.55 5.03 -0.54 0.38 116.97 118.63 2d88 h TYR 110 Ca -0.05 0.02 0.40 0.00 2.58 0.00 0.00 58.73 61.69 2d88 h TYR 110 Cb 0.39 0.43 -0.15 0.00 1.55 0.00 0.00 36.73 38.95 2d88 h TYR 110 CO -0.06 -0.41 0.68 0.93 -1.32 0.00 0.00 178.16 177.98 2d88 h GLU 111 N -0.53 0.11 -0.10 1.82 4.39 -0.44 1.84 114.58 121.67 2d88 h GLU 111 Ca -0.01 -0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.63 2d88 h GLU 111 Cb 0.52 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.15 2d88 h GLU 111 CO -0.17 0.08 -0.14 1.98 -1.16 0.00 0.00 179.01 179.59 2d88 h MET 112 N 0.12 0.27 -0.83 2.33 4.05 -0.81 -3.24 114.93 116.83 2d88 h MET 112 Ca 0.81 -0.16 -0.49 0.00 -0.28 0.00 0.00 59.70 59.58 2d88 h MET 112 Cb 2.25 0.01 -0.27 0.00 -0.80 0.00 0.00 31.60 32.79 2d88 h MET 112 CO -0.58 0.73 0.42 1.19 0.23 0.00 0.00 176.91 178.90 2d88 n PHE 113 N -4.59 2.64 -0.02 1.39 3.72 0.18 -4.58 117.46 116.20 2d88 n PHE 113 Ca -0.07 -2.17 -0.15 0.00 -0.05 0.00 0.00 57.45 55.01 2d88 n PHE 113 Cb 0.37 -0.94 -0.10 0.00 -0.94 0.00 0.00 39.48 37.87 2d88 n PHE 113 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 2d88 h LYS 114 N 1.39 0.28 -1.08 -1.08 2.10 0.25 -3.37 116.57 115.06 2d88 h LYS 114 Ca 0.51 -0.26 -0.47 0.00 -2.00 0.00 0.00 60.65 58.44 2d88 h LYS 114 Cb 1.90 0.06 -0.41 0.00 -0.90 0.00 0.00 32.23 32.88 2d88 h LYS 114 CO 1.06 0.93 -0.93 -0.40 -2.00 0.00 0.00 179.45 178.10 2d88 n ASP 115 N -4.44 3.39 -0.02 7.07 5.68 -1.26 -4.81 116.55 122.16 2d88 n ASP 115 Ca -0.09 -3.21 -0.21 0.00 -0.50 0.00 0.00 54.79 50.78 2d88 n ASP 115 Cb 0.52 -0.46 -0.13 0.00 -1.14 0.00 0.00 41.12 39.90 2d88 n ASP 115 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2d88 n SER 116 N -0.42 2.08 -1.63 -1.12 7.64 -1.26 -5.09 113.62 113.82 2d88 n SER 116 Ca 0.27 0.23 0.00 0.00 1.01 0.00 0.00 58.87 60.38 2d88 n SER 116 Cb 0.78 -0.87 0.00 0.00 -1.01 0.00 0.00 64.21 63.12 2d88 n SER 116 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d88 n GLY 117 N 1.91 -4.28 0.06 0.23 0.00 -1.26 -4.79 105.19 97.05 2d88 n GLY 117 Ca -0.33 -0.80 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 2d88 n GLY 117 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d88 h PRO 118 N 0.61 -0.01 -2.41 1.61 0.13 -1.98 -3.48 132.00 126.47 2d88 h PRO 118 Ca 0.00 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 65.19 2d88 h PRO 118 Cb 0.71 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 31.69 2d88 h PRO 118 CO 0.00 0.47 0.39 -1.12 -0.23 0.00 0.00 178.00 177.51 2d88 s SER 119 N -5.68 -0.45 -0.65 1.44 0.01 -1.26 -5.11 113.70 102.00 2d88 s SER 119 Ca -0.16 0.09 -0.27 0.00 1.31 0.00 0.00 55.95 56.92 2d88 s SER 119 Cb 0.02 0.45 0.01 0.00 0.21 0.00 0.00 66.02 66.70 2d88 s SER 119 CO 0.67 -0.70 1.55 -0.44 0.41 0.00 0.00 173.24 174.73 2d88 s SER 120 N -2.34 5.78 0.00 2.44 0.01 -1.26 -5.24 113.70 113.09 2d88 s SER 120 Ca 0.02 0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.29 2d88 s SER 120 Cb -0.01 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2d88 s SER 120 CO -0.08 -2.04 0.00 0.61 0.41 0.00 0.00 173.24 172.14