#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ri1 s SER 0 N 0.00 2.99 -0.19 1.61 0.15 -0.47 -4.93 113.70 112.85 2ri1 s SER 0 Ca 0.00 -0.59 0.01 0.00 0.70 0.00 0.00 55.95 56.06 2ri1 s SER 0 Cb 0.00 -1.39 0.04 0.00 -1.71 0.00 0.00 66.02 62.97 2ri1 s SER 0 CO 0.00 0.00 -0.09 -0.32 1.20 0.00 0.00 173.24 174.03 2ri1 s MET 1 N 1.23 1.91 0.03 5.44 0.00 -1.26 -1.32 119.30 125.33 2ri1 s MET 1 Ca 0.02 -0.79 -0.03 0.00 0.00 0.00 0.00 55.69 54.89 2ri1 s MET 1 Cb -0.14 -2.35 -0.04 0.00 0.00 0.00 0.00 34.83 32.30 2ri1 s MET 1 CO -0.10 -0.44 0.24 0.15 0.00 0.00 0.00 175.02 174.87 2ri1 s LYS 2 N 1.44 3.50 -0.06 4.11 1.02 -0.53 -4.99 119.74 124.23 2ri1 s LYS 2 Ca -0.01 -0.25 0.03 0.00 0.02 0.00 0.00 55.97 55.75 2ri1 s LYS 2 Cb -0.16 -3.05 0.01 0.00 -0.52 0.00 0.00 37.83 34.11 2ri1 s LYS 2 CO -0.08 0.62 -0.13 0.99 -0.92 0.00 0.00 175.35 175.83 2ri1 s THR 3 N -1.41 1.21 -0.23 2.17 2.01 -1.26 -0.71 115.64 117.42 2ri1 s THR 3 Ca 0.31 -0.53 -0.02 0.00 0.31 0.00 0.00 61.69 61.76 2ri1 s THR 3 Cb -0.13 -1.09 0.02 0.00 0.01 0.00 0.00 72.50 71.31 2ri1 s THR 3 CO 0.21 0.37 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.79 2ri1 s ILE 4 N 0.54 2.82 0.08 1.82 1.01 0.34 -4.96 121.20 122.85 2ri1 s ILE 4 Ca -0.13 -0.90 -0.21 0.00 0.00 0.00 0.00 60.65 59.41 2ri1 s ILE 4 Cb -0.15 -2.36 -0.07 0.00 0.01 0.00 0.00 42.46 39.89 2ri1 s ILE 4 CO 0.04 0.31 0.62 -0.54 0.00 0.00 0.00 174.94 175.36 2ri1 s LYS 5 N 1.35 4.30 0.28 2.79 1.02 -1.26 -2.13 119.74 126.09 2ri1 s LYS 5 Ca 0.02 0.82 0.05 0.00 0.02 0.00 0.00 55.97 56.89 2ri1 s LYS 5 Cb -0.15 -3.26 -0.06 0.00 -0.52 0.00 0.00 37.83 33.83 2ri1 s LYS 5 CO -0.06 0.57 -0.01 0.14 -0.92 0.00 0.00 175.35 175.08 2ri1 s VAL 6 N -0.93 1.35 0.05 3.17 -7.23 0.69 -4.96 120.40 112.55 2ri1 s VAL 6 Ca 0.31 -2.06 -0.25 0.00 -1.81 0.00 0.00 61.98 58.17 2ri1 s VAL 6 Cb -0.20 -2.54 -0.17 0.00 0.56 0.00 0.00 36.38 34.03 2ri1 s VAL 6 CO 0.20 -0.21 1.54 0.50 -0.31 0.00 0.00 175.10 176.82 2ri1 h LYS 7 N 2.27 -0.08 -3.21 4.82 3.64 -1.95 -0.02 116.57 122.05 2ri1 h LYS 7 Ca -0.40 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 58.93 2ri1 h LYS 7 Cb 1.23 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.06 2ri1 h LYS 7 CO 0.68 0.12 0.18 0.54 -2.27 0.00 0.00 179.45 178.70 2ri1 s ASN 8 N -5.30 0.15 0.26 4.20 2.20 -1.26 -4.05 114.94 111.13 2ri1 s ASN 8 Ca -0.14 -1.17 -0.02 0.00 -0.94 0.00 0.00 52.86 50.58 2ri1 s ASN 8 Cb 0.04 0.81 0.44 0.00 -2.00 0.00 0.00 41.25 40.54 2ri1 s ASN 8 CO 0.65 -1.60 1.83 0.50 -2.94 0.00 0.00 177.10 175.55 2ri1 h LYS 9 N 2.02 0.92 -0.30 3.55 3.64 -1.96 -1.90 116.57 122.54 2ri1 h LYS 9 Ca -0.31 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.00 2ri1 h LYS 9 Cb 1.25 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.85 2ri1 h LYS 9 CO 0.39 0.61 0.13 1.15 -2.27 0.00 0.00 179.45 179.46 2ri1 h THR 10 N 0.94 1.16 -0.52 1.00 2.02 -1.98 0.10 112.91 115.64 2ri1 h THR 10 Ca 0.43 -0.49 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 2ri1 h THR 10 Cb 0.35 0.93 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 2ri1 h THR 10 CO -0.23 0.17 0.32 -0.08 0.37 0.00 0.00 175.52 176.07 2ri1 h GLU 11 N 0.34 0.70 -0.36 6.66 4.81 -1.93 -2.22 114.58 122.59 2ri1 h GLU 11 Ca 0.10 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.20 2ri1 h GLU 11 Cb 0.15 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2ri1 h GLU 11 CO -0.01 0.49 -0.09 0.78 -0.73 0.00 0.00 179.01 179.46 2ri1 h GLY 12 N 0.69 0.65 1.39 1.92 0.00 -1.00 -1.86 103.07 104.87 2ri1 h GLY 12 Ca 0.19 -0.45 -0.15 0.00 0.00 0.00 0.00 47.33 46.92 2ri1 h GLY 12 CO -0.04 0.41 -0.45 1.76 0.00 0.00 0.00 176.54 178.23 2ri1 h SER 13 N 0.56 0.71 -0.39 0.19 0.02 -0.81 -1.35 113.55 112.47 2ri1 h SER 13 Ca 0.10 -0.34 -0.14 0.00 -0.84 0.00 0.00 61.79 60.58 2ri1 h SER 13 Cb 0.49 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 2ri1 h SER 13 CO 0.03 1.05 -0.30 0.11 -1.14 0.00 0.00 176.83 176.58 2ri1 h LYS 14 N 0.53 0.89 -0.37 3.45 1.57 -0.88 -1.75 116.57 120.01 2ri1 h LYS 14 Ca 0.04 -0.44 0.01 0.00 -1.87 0.00 0.00 60.65 58.39 2ri1 h LYS 14 Cb 0.98 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.27 2ri1 h LYS 14 CO 0.09 1.09 0.22 0.28 -0.57 0.00 0.00 179.45 180.56 2ri1 h VAL 15 N 0.71 1.05 -0.94 0.50 2.07 -1.32 -2.31 116.25 116.00 2ri1 h VAL 15 Ca 0.07 -0.16 0.03 0.00 0.82 0.00 0.00 66.70 67.47 2ri1 h VAL 15 Cb 0.88 0.56 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 2ri1 h VAL 15 CO 0.08 0.08 0.62 0.00 0.02 0.00 0.00 177.57 178.37 2ri1 h ALA 16 N 1.16 1.38 -0.27 1.67 0.00 -1.15 0.17 119.26 122.23 2ri1 h ALA 16 Ca 0.15 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2ri1 h ALA 16 Cb -0.01 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2ri1 h ALA 16 CO -0.06 0.53 0.02 0.35 0.00 0.00 0.00 179.25 180.09 2ri1 h PHE 17 N 1.20 0.50 -0.92 0.00 3.57 -1.16 -1.72 116.94 118.42 2ri1 h PHE 17 Ca 0.37 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 2ri1 h PHE 17 Cb -0.02 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 38.55 2ri1 h PHE 17 CO -0.00 0.59 0.52 0.00 -2.23 0.00 0.00 178.31 177.19 2ri1 h ARG 18 N 0.26 1.27 -0.26 1.11 3.08 -1.02 -0.10 114.38 118.71 2ri1 h ARG 18 Ca 0.08 -0.14 0.03 0.00 0.07 0.00 0.00 59.98 60.02 2ri1 h ARG 18 Cb 0.38 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.15 2ri1 h ARG 18 CO 0.01 0.91 0.10 0.52 -1.07 0.00 0.00 179.97 180.44 2ri1 h MET 19 N 1.28 0.21 0.41 0.04 2.86 -0.85 -1.91 114.93 116.97 2ri1 h MET 19 Ca 0.32 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.94 2ri1 h MET 19 Cb -0.00 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 2ri1 h MET 19 CO -0.06 0.14 -0.24 1.25 1.06 0.00 0.00 176.91 179.07 2ri1 h LEU 20 N 0.22 -0.58 -1.24 1.22 5.85 -0.86 -1.24 115.31 118.68 2ri1 h LEU 20 Ca 0.11 0.03 0.22 0.00 0.84 0.00 0.00 57.88 59.08 2ri1 h LEU 20 Cb 0.07 0.17 -0.09 0.00 0.37 0.00 0.00 40.66 41.18 2ri1 h LEU 20 CO -0.11 -0.38 0.62 -0.08 -0.34 0.00 0.00 178.44 178.15 2ri1 h GLU 21 N -0.61 0.54 -0.26 1.25 4.81 -1.02 -0.91 114.58 118.38 2ri1 h GLU 21 Ca -0.05 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.10 2ri1 h GLU 21 Cb 0.50 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 2ri1 h GLU 21 CO 0.06 0.36 -0.05 1.49 -0.73 0.00 0.00 179.01 180.14 2ri1 h GLU 22 N 0.56 0.49 -0.55 1.92 4.57 -0.60 -1.09 114.58 119.87 2ri1 h GLU 22 Ca 0.56 -0.18 0.06 0.00 -1.18 0.00 0.00 59.36 58.62 2ri1 h GLU 22 Cb 1.16 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 29.67 2ri1 h GLU 22 CO -0.31 0.70 0.27 0.93 -1.18 0.00 0.00 179.01 179.41 2ri1 h GLU 23 N 0.24 0.49 -0.09 1.92 4.39 -0.25 -1.57 114.58 119.71 2ri1 h GLU 23 Ca 0.07 -0.03 -0.00 0.00 0.34 0.00 0.00 59.36 59.74 2ri1 h GLU 23 Cb 0.51 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 29.04 2ri1 h GLU 23 CO 0.02 0.33 0.05 0.82 -1.16 0.00 0.00 179.01 179.07 2ri1 h ILE 24 N 0.51 1.08 -0.61 3.13 2.04 -1.17 -1.03 117.51 121.45 2ri1 h ILE 24 Ca 0.25 -0.22 0.13 0.00 1.00 0.00 0.00 64.86 66.02 2ri1 h ILE 24 Cb 0.19 1.06 -0.10 0.00 -0.74 0.00 0.00 36.82 37.23 2ri1 h ILE 24 CO -0.19 0.07 -0.02 0.74 0.00 0.00 0.00 178.15 178.75 2ri1 h THR 25 N 0.06 0.49 0.00 -0.27 2.02 -0.86 -0.55 112.91 113.80 2ri1 h THR 25 Ca 0.03 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2ri1 h THR 25 Cb 0.07 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 2ri1 h THR 25 CO -0.01 0.02 0.00 0.49 0.37 0.00 0.00 175.52 176.39 2ri1 n PHE 26 N -5.29 0.00 0.00 3.16 3.01 -0.62 -4.90 117.46 112.81 2ri1 n PHE 26 Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.55 2ri1 n PHE 26 Cb 0.35 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.82 2ri1 n PHE 26 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2ri1 n GLY 27 N 0.24 0.73 3.65 1.37 0.00 -0.21 -5.04 105.19 105.93 2ri1 n GLY 27 Ca 0.10 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.64 2ri1 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ri1 n ALA 28 N -1.07 0.69 -0.01 4.61 0.00 -0.44 -4.91 120.51 119.38 2ri1 n ALA 28 Ca 0.00 0.44 -0.00 0.00 0.00 0.00 0.00 53.44 53.88 2ri1 n ALA 28 Cb 0.00 -2.30 -0.02 0.00 0.00 0.00 0.00 19.45 17.13 2ri1 n ALA 28 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2ri1 n LYS 29 N 3.66 1.97 -4.04 0.00 4.76 -1.26 -4.61 118.16 118.64 2ri1 n LYS 29 Ca 0.18 -0.01 -0.31 0.00 -2.87 0.00 0.00 58.31 55.30 2ri1 n LYS 29 Cb 0.26 -1.07 -0.16 0.00 -1.84 0.00 0.00 35.03 32.21 2ri1 n LYS 29 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 2ri1 s THR 30 N -2.14 1.73 -0.10 -0.18 2.01 -1.26 0.07 115.64 115.78 2ri1 s THR 30 Ca -0.01 -0.84 -0.01 0.00 0.31 0.00 0.00 61.69 61.14 2ri1 s THR 30 Cb 0.01 -1.66 -0.03 0.00 0.01 0.00 0.00 72.50 70.84 2ri1 s THR 30 CO 0.12 0.39 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.63 2ri1 s LEU 31 N 1.40 3.27 -0.12 4.42 1.43 0.30 -1.34 118.68 128.04 2ri1 s LEU 31 Ca 0.03 -0.02 -0.12 0.00 -1.03 0.00 0.00 54.13 52.99 2ri1 s LEU 31 Cb -0.14 -1.74 -0.05 0.00 0.03 0.00 0.00 46.19 44.29 2ri1 s LEU 31 CO -0.10 0.31 0.27 -0.83 0.23 0.00 0.00 176.35 176.22 2ri1 s GLY 32 N -0.50 2.24 0.33 -3.19 0.00 0.06 -0.39 107.32 105.87 2ri1 s GLY 32 Ca 0.08 -0.47 0.09 0.00 0.00 0.00 0.00 44.72 44.42 2ri1 s GLY 32 CO 0.02 0.13 -0.00 1.08 0.00 0.00 0.00 173.10 174.33 2ri1 s LEU 33 N -0.29 2.97 0.15 0.66 1.43 0.47 -0.96 118.68 123.11 2ri1 s LEU 33 Ca 0.17 -0.97 0.08 0.00 -1.03 0.00 0.00 54.13 52.38 2ri1 s LEU 33 Cb -0.13 -1.36 -0.04 0.00 0.03 0.00 0.00 46.19 44.69 2ri1 s LEU 33 CO 0.06 -0.21 -0.09 0.00 0.23 0.00 0.00 176.35 176.34 2ri1 s ALA 34 N -2.51 2.98 0.00 4.21 0.00 -1.24 -4.17 121.76 121.04 2ri1 s ALA 34 Ca 0.34 -1.37 0.00 0.00 0.00 0.00 0.00 51.96 50.94 2ri1 s ALA 34 Cb -0.01 -0.83 0.00 0.00 0.00 0.00 0.00 23.12 22.28 2ri1 s ALA 34 CO 0.19 0.54 0.00 0.25 0.00 0.00 0.00 175.76 176.74 2ri1 n THR 35 N 0.29 0.00 -0.42 0.00 -2.24 -1.26 -4.92 114.28 105.73 2ri1 n THR 35 Ca -0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 2ri1 n THR 35 Cb 0.54 -0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.39 2ri1 n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ri1 n GLY 36 N 5.00 -3.05 0.09 3.38 0.00 -1.26 -4.57 105.19 104.77 2ri1 n GLY 36 Ca 0.00 -1.82 -0.04 0.00 0.00 0.00 0.00 46.02 44.16 2ri1 n GLY 36 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2ri1 h SER 37 N 0.00 0.00 -0.59 1.61 0.87 -2.02 -3.38 113.55 110.04 2ri1 h SER 37 Ca 0.00 0.00 0.12 0.00 -1.23 0.00 0.00 61.79 60.68 2ri1 h SER 37 Cb 0.00 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 61.87 2ri1 h SER 37 CO 0.00 0.86 0.08 0.74 -0.53 0.00 0.00 176.83 177.97 2ri1 h THR 38 N 0.00 0.59 -0.28 2.23 2.02 -1.97 -2.02 112.91 113.48 2ri1 h THR 38 Ca -0.01 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.10 2ri1 h THR 38 Cb 1.61 0.38 0.00 0.00 -1.74 0.00 0.00 68.15 68.39 2ri1 h THR 38 CO 0.11 0.04 0.00 -0.81 0.37 0.00 0.00 175.52 175.23 2ri1 n PRO 39 N -5.19 1.74 -0.06 6.66 -0.04 -1.26 -4.54 135.00 132.32 2ri1 n PRO 39 Ca 0.09 -1.15 -0.01 0.00 -0.04 0.00 0.00 63.50 62.39 2ri1 n PRO 39 Cb 0.33 -1.30 0.26 0.00 -0.04 0.00 0.00 33.50 32.75 2ri1 n PRO 39 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2ri1 h LEU 40 N 1.99 0.61 -0.24 1.53 3.38 -1.58 0.37 115.31 121.37 2ri1 h LEU 40 Ca 0.00 -0.11 -0.21 0.00 0.09 0.00 0.00 57.88 57.66 2ri1 h LEU 40 Cb 0.45 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2ri1 h LEU 40 CO 0.00 0.64 -0.91 -0.33 0.09 0.00 0.00 178.44 177.93 2ri1 h GLU 41 N 0.63 0.22 0.06 1.13 5.08 -1.81 -1.50 114.58 118.38 2ri1 h GLU 41 Ca 0.14 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2ri1 h GLU 41 Cb 0.30 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.62 2ri1 h GLU 41 CO 0.00 0.99 -0.03 1.25 -1.00 0.00 0.00 179.01 180.22 2ri1 h LEU 42 N 0.12 -0.06 -0.85 1.33 5.85 -1.71 -1.74 115.31 118.24 2ri1 h LEU 42 Ca -0.05 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.62 2ri1 h LEU 42 Cb 1.55 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.55 2ri1 h LEU 42 CO 0.14 0.02 0.56 1.88 -0.34 0.00 0.00 178.44 180.71 2ri1 h TYR 43 N -0.14 1.07 -0.48 1.25 0.05 -0.90 -1.01 116.97 116.81 2ri1 h TYR 43 Ca -0.01 0.03 0.04 0.00 0.05 0.00 0.00 58.73 58.84 2ri1 h TYR 43 Cb 0.12 -0.36 -0.04 0.00 1.01 0.00 0.00 36.73 37.46 2ri1 h TYR 43 CO -0.05 0.66 0.24 -0.22 -1.05 0.00 0.00 178.16 177.74 2ri1 h LYS 44 N 1.14 0.45 -0.60 4.88 3.64 -1.20 -0.52 116.57 124.36 2ri1 h LYS 44 Ca 0.32 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.65 2ri1 h LYS 44 Cb -0.11 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.58 2ri1 h LYS 44 CO -0.08 0.30 0.28 1.49 -2.27 0.00 0.00 179.45 179.18 2ri1 h GLU 45 N 0.46 0.85 -0.49 1.90 4.81 -0.82 -2.59 114.58 118.70 2ri1 h GLU 45 Ca 0.21 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 59.30 2ri1 h GLU 45 Cb 0.13 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 2ri1 h GLU 45 CO -0.16 0.66 0.17 0.82 -0.73 0.00 0.00 179.01 179.78 2ri1 h ILE 46 N 0.84 1.22 -0.65 2.32 2.04 -0.87 -2.62 117.51 119.79 2ri1 h ILE 46 Ca 0.21 -0.70 0.10 0.00 1.00 0.00 0.00 64.86 65.47 2ri1 h ILE 46 Cb 0.10 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 36.90 2ri1 h ILE 46 CO -0.03 0.26 0.43 0.03 0.00 0.00 0.00 178.15 178.84 2ri1 h ARG 47 N 0.65 0.46 -0.56 2.37 3.08 -0.76 -2.08 114.38 117.54 2ri1 h ARG 47 Ca 0.16 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.18 2ri1 h ARG 47 Cb 0.23 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.18 2ri1 h ARG 47 CO -0.01 0.31 0.00 0.39 -1.07 0.00 0.00 179.97 179.59 2ri1 n GLU 48 N -4.48 2.46 -3.12 0.04 1.02 -1.01 -4.92 120.64 110.63 2ri1 n GLU 48 Ca 0.11 -2.25 -0.19 0.00 -0.02 0.00 0.00 57.16 54.80 2ri1 n GLU 48 Cb 0.37 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 30.31 2ri1 n GLU 48 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2ri1 n SER 49 N 1.36 2.18 -0.85 1.62 3.41 -0.78 -5.02 113.62 115.53 2ri1 n SER 49 Ca 0.21 -2.46 0.11 0.00 -0.26 0.00 0.00 58.87 56.48 2ri1 n SER 49 Cb 0.55 -0.16 0.28 0.00 -0.26 0.00 0.00 64.21 64.62 2ri1 n SER 49 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ri1 n HIS 50 N -1.76 0.29 -1.51 7.33 1.44 -1.26 -4.96 115.22 114.79 2ri1 n HIS 50 Ca 0.04 -0.15 -0.36 0.00 -2.01 0.00 0.00 57.72 55.25 2ri1 n HIS 50 Cb 0.51 0.00 0.09 0.00 0.12 0.00 0.00 29.99 30.71 2ri1 n HIS 50 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2ri1 s LEU 51 N -1.62 3.41 -0.17 2.39 1.43 -1.26 -5.03 118.68 117.83 2ri1 s LEU 51 Ca 0.35 2.52 -0.04 0.00 -1.03 0.00 0.00 54.13 55.92 2ri1 s LEU 51 Cb 0.20 -4.61 0.08 0.00 0.03 0.00 0.00 46.19 41.90 2ri1 s LEU 51 CO 0.29 -2.25 0.23 -0.62 0.23 0.00 0.00 176.35 174.23 2ri1 s ASP 52 N -1.70 1.05 -0.08 2.29 2.15 -1.26 -5.02 116.67 114.10 2ri1 s ASP 52 Ca 0.79 0.03 0.17 0.00 0.43 0.00 0.00 52.55 53.96 2ri1 s ASP 52 Cb -0.34 0.45 0.59 0.00 -0.30 0.00 0.00 42.92 43.33 2ri1 s ASP 52 CO 0.44 -0.30 1.51 0.49 -0.17 0.00 0.00 175.17 177.14 2ri1 n PHE 53 N 5.33 1.12 0.40 -5.34 3.72 -1.26 -4.65 117.46 116.78 2ri1 n PHE 53 Ca -0.05 -0.61 0.10 0.00 -0.05 0.00 0.00 57.45 56.83 2ri1 n PHE 53 Cb 0.50 -0.18 0.41 0.00 -0.94 0.00 0.00 39.48 39.27 2ri1 n PHE 53 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2ri1 n SER 54 N 0.81 0.40 -0.50 4.37 3.41 -1.25 -0.63 113.62 120.22 2ri1 n SER 54 Ca 0.22 0.61 0.09 0.00 -0.26 0.00 0.00 58.87 59.53 2ri1 n SER 54 Cb 0.76 -0.69 0.20 0.00 -0.26 0.00 0.00 64.21 64.22 2ri1 n SER 54 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2ri1 n ASP 55 N -1.95 3.15 -4.58 4.04 2.03 -1.26 -3.70 116.55 114.28 2ri1 n ASP 55 Ca 0.02 -3.04 -0.24 0.00 0.52 0.00 0.00 54.79 52.06 2ri1 n ASP 55 Cb 0.19 -0.49 -0.09 0.00 -0.72 0.00 0.00 41.12 40.01 2ri1 n ASP 55 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 2ri1 s MET 56 N -2.82 2.03 -0.09 -0.67 -1.94 0.20 -4.89 119.30 111.11 2ri1 s MET 56 Ca 0.37 -1.64 0.01 0.00 -1.71 0.00 0.00 55.69 52.72 2ri1 s MET 56 Cb 0.31 -1.96 -0.02 0.00 2.01 0.00 0.00 34.83 35.17 2ri1 s MET 56 CO 0.06 0.28 -0.11 0.08 -0.01 0.00 0.00 175.02 175.31 2ri1 s VAL 57 N -2.45 3.28 0.13 -6.03 1.01 0.11 -0.70 120.40 115.76 2ri1 s VAL 57 Ca 0.32 -0.61 0.06 0.00 0.00 0.00 0.00 61.98 61.75 2ri1 s VAL 57 Cb -0.04 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 2ri1 s VAL 57 CO 0.18 0.56 -0.02 -0.94 0.00 0.00 0.00 175.10 174.88 2ri1 s SER 58 N -0.31 4.77 -0.04 3.32 1.04 -0.47 -0.54 113.70 121.47 2ri1 s SER 58 Ca 0.03 -0.32 0.01 0.00 0.48 0.00 0.00 55.95 56.15 2ri1 s SER 58 Cb -0.13 -1.03 0.02 0.00 0.10 0.00 0.00 66.02 64.98 2ri1 s SER 58 CO 0.03 0.14 -0.06 -0.63 0.98 0.00 0.00 173.24 173.69 2ri1 s ILE 59 N -1.48 0.66 0.28 -1.02 1.01 0.47 -0.84 121.20 120.27 2ri1 s ILE 59 Ca 0.26 -0.21 0.06 0.00 0.00 0.00 0.00 60.65 60.76 2ri1 s ILE 59 Cb -0.10 -0.65 -0.03 0.00 0.01 0.00 0.00 42.46 41.69 2ri1 s ILE 59 CO 0.17 0.24 0.30 0.20 0.00 0.00 0.00 174.94 175.86 2ri1 s ASN 60 N 0.75 5.76 0.05 3.58 -0.87 -0.76 -0.39 114.94 123.06 2ri1 s ASN 60 Ca -0.11 -0.20 0.03 0.00 -1.57 0.00 0.00 52.86 51.01 2ri1 s ASN 60 Cb -0.14 -1.41 -0.24 0.00 -0.02 0.00 0.00 41.25 39.43 2ri1 s ASN 60 CO 0.01 -0.17 1.03 -0.07 -2.57 0.00 0.00 177.10 175.33 2ri1 h LEU 61 N 1.26 0.18 -7.91 0.60 3.38 -1.91 -3.43 115.31 107.49 2ri1 h LEU 61 Ca -0.48 -0.23 -0.16 0.00 0.09 0.00 0.00 57.88 57.10 2ri1 h LEU 61 Cb 1.24 -0.06 -0.21 0.00 0.09 0.00 0.00 40.66 41.73 2ri1 h LEU 61 CO 0.59 1.19 -0.62 -1.81 0.09 0.00 0.00 178.44 177.87 2ri1 s ASP 62 N -6.75 0.17 -0.03 -0.43 1.01 -1.26 -0.28 116.67 109.11 2ri1 s ASP 62 Ca -0.04 -0.42 -0.10 0.00 0.71 0.00 0.00 52.55 52.71 2ri1 s ASP 62 Cb 0.08 0.14 0.01 0.00 1.01 0.00 0.00 42.92 44.17 2ri1 s ASP 62 CO 0.84 -0.34 0.21 -0.70 0.21 0.00 0.00 175.17 175.39 2ri1 s GLU 63 N -1.56 0.48 0.15 8.23 2.56 -0.78 -4.48 118.70 123.31 2ri1 s GLU 63 Ca -0.14 -0.15 -0.30 0.00 0.00 0.00 0.00 54.97 54.37 2ri1 s GLU 63 Cb -0.08 0.21 -0.08 0.00 2.00 0.00 0.00 34.13 36.18 2ri1 s GLU 63 CO -0.01 -0.11 1.29 0.71 -0.56 0.00 0.00 175.26 176.58 2ri1 s TYR 64 N -0.98 3.32 0.17 5.30 2.02 -1.26 -1.01 117.35 124.90 2ri1 s TYR 64 Ca -0.11 1.21 -0.31 0.00 -0.37 0.00 0.00 57.07 57.49 2ri1 s TYR 64 Cb -0.05 -3.56 -0.10 0.00 -0.40 0.00 0.00 41.96 37.85 2ri1 s TYR 64 CO 0.02 -1.77 1.53 0.08 -1.57 0.00 0.00 175.55 173.83 2ri1 s VAL 65 N 0.48 2.72 0.00 0.71 1.01 -0.29 -2.25 120.40 122.78 2ri1 s VAL 65 Ca 0.58 0.52 0.00 0.00 0.00 0.00 0.00 61.98 63.09 2ri1 s VAL 65 Cb -0.35 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2ri1 s VAL 65 CO 0.34 0.05 0.00 0.61 0.00 0.00 0.00 175.10 176.10 2ri1 n GLY 66 N 3.51 0.44 3.60 4.51 0.00 0.19 -4.76 105.19 112.67 2ri1 n GLY 66 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 2ri1 n GLY 66 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ri1 s LEU 67 N 0.00 3.09 0.00 0.99 1.43 -0.95 -4.85 118.68 118.38 2ri1 s LEU 67 Ca 0.00 -0.45 0.01 0.00 -1.03 0.00 0.00 54.13 52.66 2ri1 s LEU 67 Cb 0.00 -1.81 -0.00 0.00 0.03 0.00 0.00 46.19 44.41 2ri1 s LEU 67 CO 0.00 0.13 0.04 -1.54 0.23 0.00 0.00 176.35 175.21 2ri1 n SER 68 N 0.26 1.87 0.32 2.29 3.41 -1.26 -3.51 113.62 117.00 2ri1 n SER 68 Ca -0.12 -2.18 0.21 0.00 -0.26 0.00 0.00 58.87 56.52 2ri1 n SER 68 Cb 0.54 0.39 1.07 0.00 -0.26 0.00 0.00 64.21 65.95 2ri1 n SER 68 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ri1 h ALA 69 N 1.26 1.04 0.00 7.33 0.00 -1.97 -1.74 119.26 125.18 2ri1 h ALA 69 Ca -0.20 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 2ri1 h ALA 69 Cb 0.67 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 2ri1 h ALA 69 CO 0.32 0.01 -0.08 -0.44 0.00 0.00 0.00 179.25 179.06 2ri1 h ASP 70 N 0.00 0.00 -3.44 0.00 3.32 -1.98 -3.41 116.42 110.90 2ri1 h ASP 70 Ca -0.00 0.00 -0.61 0.00 0.02 0.00 0.00 57.03 56.44 2ri1 h ASP 70 Cb 0.13 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.55 2ri1 h ASP 70 CO 0.00 0.08 -0.41 -1.81 -1.72 0.00 0.00 179.24 175.39 2ri1 s ASP 71 N -6.05 6.26 0.59 6.45 1.01 -0.66 -4.97 116.67 119.31 2ri1 s ASP 71 Ca -0.03 0.29 0.29 0.00 0.71 0.00 0.00 52.55 53.81 2ri1 s ASP 71 Cb 0.13 -2.14 1.70 0.00 1.01 0.00 0.00 42.92 43.62 2ri1 s ASP 71 CO 0.56 0.07 2.11 0.11 0.21 0.00 0.00 175.17 178.23 2ri1 h LYS 72 N 7.15 0.00 -0.00 8.23 1.57 -1.86 -2.33 116.57 129.33 2ri1 h LYS 72 Ca -0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 2ri1 h LYS 72 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 2ri1 h LYS 72 CO 0.71 0.00 -0.35 1.04 -0.57 0.00 0.00 179.45 180.28 2ri1 n GLN 73 N -3.75 0.06 -1.27 3.15 3.00 -1.26 -4.68 117.38 112.63 2ri1 n GLN 73 Ca 0.01 -0.03 -0.31 0.00 -0.01 0.00 0.00 57.00 56.66 2ri1 n GLN 73 Cb 0.30 -1.50 0.10 0.00 0.00 0.00 0.00 30.24 29.14 2ri1 n GLN 73 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 2ri1 s SER 74 N -2.96 4.34 0.15 1.08 1.04 -0.88 -4.96 113.70 111.51 2ri1 s SER 74 Ca 0.13 1.73 -0.08 0.00 0.48 0.00 0.00 55.95 58.21 2ri1 s SER 74 Cb 0.18 -2.44 -0.01 0.00 0.10 0.00 0.00 66.02 63.85 2ri1 s SER 74 CO 0.64 -2.13 1.44 1.88 0.98 0.00 0.00 173.24 176.05 2ri1 h TYR 75 N -1.19 0.94 -0.55 5.02 0.05 -1.90 -2.49 116.97 116.86 2ri1 h TYR 75 Ca -0.45 -0.34 0.11 0.00 0.05 0.00 0.00 58.73 58.10 2ri1 h TYR 75 Cb 1.24 -0.18 -0.11 0.00 1.01 0.00 0.00 36.73 38.70 2ri1 h TYR 75 CO 0.55 1.14 -0.21 0.00 -1.05 0.00 0.00 178.16 178.58 2ri1 h ALA 76 N 0.79 0.22 -0.42 3.88 0.00 -1.89 -0.39 119.26 121.45 2ri1 h ALA 76 Ca 0.01 0.20 0.04 0.00 0.00 0.00 0.00 54.91 55.15 2ri1 h ALA 76 Cb 1.15 0.54 -0.04 0.00 0.00 0.00 0.00 17.79 19.44 2ri1 h ALA 76 CO 0.12 -0.52 0.19 -0.92 0.00 0.00 0.00 179.25 178.12 2ri1 h TYR 77 N -0.08 0.35 -0.50 0.00 3.20 -1.77 -1.69 116.97 116.49 2ri1 h TYR 77 Ca 0.25 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.20 2ri1 h TYR 77 Cb 0.47 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.59 2ri1 h TYR 77 CO -0.51 0.17 0.20 0.35 -1.64 0.00 0.00 178.16 176.73 2ri1 h PHE 78 N 0.39 0.36 -0.58 -3.82 3.57 -0.94 -0.42 116.94 115.49 2ri1 h PHE 78 Ca 0.19 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.62 2ri1 h PHE 78 Cb 0.12 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.75 2ri1 h PHE 78 CO -0.11 0.13 0.02 0.52 -2.23 0.00 0.00 178.31 176.64 2ri1 h MET 79 N 0.39 1.02 0.02 1.11 2.86 -0.96 0.41 114.93 119.78 2ri1 h MET 79 Ca 0.24 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 2ri1 h MET 79 Cb 0.23 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 2ri1 h MET 79 CO -0.22 1.00 -0.04 -0.22 1.06 0.00 0.00 176.91 178.49 2ri1 h LYS 80 N 0.91 -0.08 0.00 1.72 3.64 -0.78 -0.11 116.57 121.87 2ri1 h LYS 80 Ca 0.17 0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.44 2ri1 h LYS 80 Cb 0.53 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.35 2ri1 h LYS 80 CO 0.03 -0.05 -0.52 0.37 -2.27 0.00 0.00 179.45 177.00 2ri1 h GLN 81 N -0.08 0.00 0.00 1.90 4.15 -0.78 -0.12 115.11 120.18 2ri1 h GLN 81 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.43 2ri1 h GLN 81 Cb 0.09 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.78 2ri1 h GLN 81 CO -0.03 0.52 -1.35 0.09 -1.93 0.00 0.00 178.83 176.14 2ri1 n ASN 82 N -3.77 0.49 0.09 -0.69 4.13 0.11 -4.84 115.26 110.77 2ri1 n ASN 82 Ca -0.01 -0.02 0.00 0.00 1.68 0.00 0.00 54.58 56.23 2ri1 n ASN 82 Cb 0.56 1.11 0.00 0.00 -1.54 0.00 0.00 39.78 39.91 2ri1 n ASN 82 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 2ri1 n LEU 83 N -2.25 -0.95 0.10 3.41 7.94 -0.16 -4.51 117.00 120.59 2ri1 n LEU 83 Ca -0.01 0.33 -0.05 0.00 -1.11 0.00 0.00 56.01 55.18 2ri1 n LEU 83 Cb 0.51 1.06 0.09 0.00 0.53 0.00 0.00 43.42 45.61 2ri1 n LEU 83 CO 0.42 -0.41 0.40 -0.26 -1.11 0.00 0.00 177.39 176.44 2ri1 h PHE 84 N 0.00 0.15 -0.40 1.96 0.04 -1.22 0.34 116.94 117.81 2ri1 h PHE 84 Ca 0.00 -0.07 0.07 0.00 2.80 0.00 0.00 57.97 60.77 2ri1 h PHE 84 Cb 0.00 -0.02 -0.06 0.00 2.20 0.00 0.00 35.95 38.07 2ri1 h PHE 84 CO 0.00 0.78 0.06 0.00 -0.60 0.00 0.00 178.31 178.55 2ri1 h ALA 85 N 1.20 0.42 0.07 2.45 0.00 -1.25 -2.90 119.26 119.23 2ri1 h ALA 85 Ca -0.02 0.09 -0.28 0.00 0.00 0.00 0.00 54.91 54.70 2ri1 h ALA 85 Cb 1.25 0.13 0.02 0.00 0.00 0.00 0.00 17.79 19.20 2ri1 h ALA 85 CO 0.10 -0.34 -1.15 0.00 0.00 0.00 0.00 179.25 177.86 2ri1 h ALA 86 N 1.32 0.08 -2.11 0.00 0.00 -1.74 -3.41 119.26 113.40 2ri1 h ALA 86 Ca 0.20 -0.74 -0.56 0.00 0.00 0.00 0.00 54.91 53.80 2ri1 h ALA 86 Cb 0.25 0.08 -0.41 0.00 0.00 0.00 0.00 17.79 17.71 2ri1 h ALA 86 CO -0.28 0.71 -0.88 1.63 0.00 0.00 0.00 179.25 180.43 2ri1 n LYS 87 N -3.80 1.77 -2.11 0.00 4.76 0.12 -5.04 118.16 113.85 2ri1 n LYS 87 Ca -0.12 -3.99 -0.35 0.00 -2.87 0.00 0.00 58.31 50.97 2ri1 n LYS 87 Cb 0.94 -1.81 0.02 0.00 -1.84 0.00 0.00 35.03 32.34 2ri1 n LYS 87 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2ri1 s PRO 88 N -2.20 3.14 0.43 1.97 0.04 -1.10 -4.33 135.00 132.94 2ri1 s PRO 88 Ca 0.40 1.71 -0.01 0.00 0.04 0.00 0.00 61.00 63.14 2ri1 s PRO 88 Cb 0.21 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.77 2ri1 s PRO 88 CO -0.08 -1.04 0.66 -0.06 0.04 0.00 0.00 177.00 176.52 2ri1 s PHE 89 N -1.71 3.37 0.22 0.56 0.08 -1.26 -3.93 117.98 115.31 2ri1 s PHE 89 Ca 0.75 0.38 -0.08 0.00 0.12 0.00 0.00 56.93 58.11 2ri1 s PHE 89 Cb -0.27 -2.20 0.35 0.00 -0.57 0.00 0.00 43.02 40.33 2ri1 s PHE 89 CO 0.31 -0.21 1.74 -0.22 -0.10 0.00 0.00 175.22 176.73 2ri1 h LYS 90 N 0.45 0.40 -2.42 0.44 3.64 -0.64 -3.43 116.57 115.02 2ri1 h LYS 90 Ca -0.47 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 58.82 2ri1 h LYS 90 Cb 1.23 -0.09 -0.25 0.00 -0.41 0.00 0.00 32.23 32.71 2ri1 h LYS 90 CO 0.59 0.26 -0.24 0.21 -2.27 0.00 0.00 179.45 178.01 2ri1 s LYS 91 N -6.07 0.45 -0.20 1.90 2.47 -1.18 -5.04 119.74 112.07 2ri1 s LYS 91 Ca -0.13 1.02 -0.04 0.00 -1.56 0.00 0.00 55.97 55.26 2ri1 s LYS 91 Cb 0.18 0.21 -0.02 0.00 -1.46 0.00 0.00 37.83 36.75 2ri1 s LYS 91 CO 0.75 -0.19 -0.03 -1.12 0.16 0.00 0.00 175.35 174.92 2ri1 s SER 92 N 1.98 4.51 -0.17 1.43 0.01 -1.26 -1.37 113.70 118.82 2ri1 s SER 92 Ca -0.07 -0.31 -0.10 0.00 1.31 0.00 0.00 55.95 56.78 2ri1 s SER 92 Cb -0.09 -1.77 -0.05 0.00 0.21 0.00 0.00 66.02 64.32 2ri1 s SER 92 CO -0.15 0.03 0.17 -0.31 0.41 0.00 0.00 173.24 173.39 2ri1 s TYR 93 N 1.19 3.46 0.15 2.43 2.02 -0.02 -4.98 117.35 121.60 2ri1 s TYR 93 Ca 0.03 0.44 0.07 0.00 -0.37 0.00 0.00 57.07 57.23 2ri1 s TYR 93 Cb -0.14 -2.16 -0.04 0.00 -0.40 0.00 0.00 41.96 39.21 2ri1 s TYR 93 CO -0.00 0.37 -0.15 -0.51 -1.57 0.00 0.00 175.55 173.68 2ri1 s LEU 94 N 0.10 2.44 0.60 -1.29 1.02 -1.26 -1.82 118.68 118.46 2ri1 s LEU 94 Ca 0.11 -0.86 -0.19 0.00 0.02 0.00 0.00 54.13 53.21 2ri1 s LEU 94 Cb -0.12 -0.64 -0.04 0.00 0.02 0.00 0.00 46.19 45.41 2ri1 s LEU 94 CO 0.01 -0.12 1.20 -2.65 0.02 0.00 0.00 176.35 174.81 2ri1 n PRO 95 N 0.32 1.21 -2.79 1.29 -0.02 -1.26 -4.93 135.00 128.82 2ri1 n PRO 95 Ca -0.14 0.46 -0.43 0.00 -2.02 0.00 0.00 63.50 61.38 2ri1 n PRO 95 Cb 0.58 -2.42 -0.04 0.00 -0.02 0.00 0.00 33.50 31.60 2ri1 n PRO 95 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2ri1 s ASN 96 N -1.19 6.17 0.46 2.55 2.47 -1.26 -4.63 114.94 119.52 2ri1 s ASN 96 Ca 0.77 -0.89 0.31 0.00 0.42 0.00 0.00 52.86 53.48 2ri1 s ASN 96 Cb -0.41 -2.45 1.53 0.00 -1.45 0.00 0.00 41.25 38.47 2ri1 s ASN 96 CO 0.45 -1.52 1.95 1.23 -3.72 0.00 0.00 177.10 175.49 2ri1 h GLY 97 N 11.71 0.00 -2.43 1.21 0.00 -1.76 -2.65 103.07 109.15 2ri1 h GLY 97 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2ri1 h GLY 97 CO 1.20 0.00 0.00 1.04 0.00 0.00 0.00 176.54 178.78 2ri1 n LEU 98 N -2.68 3.64 -4.77 3.11 4.77 -1.25 0.55 117.00 120.36 2ri1 n LEU 98 Ca -0.01 -1.83 -0.41 0.00 -0.03 0.00 0.00 56.01 53.73 2ri1 n LEU 98 Cb 0.16 -0.47 -0.01 0.00 -2.33 0.00 0.00 43.42 40.77 2ri1 n LEU 98 CO 0.19 0.72 1.09 0.00 -1.33 0.00 0.00 177.39 178.06 2ri1 s ALA 99 N -1.55 3.55 0.13 -1.18 0.00 -1.00 -4.91 121.76 116.81 2ri1 s ALA 99 Ca 0.41 1.47 -0.02 0.00 0.00 0.00 0.00 51.96 53.82 2ri1 s ALA 99 Cb 0.24 -3.57 -0.10 0.00 0.00 0.00 0.00 23.12 19.69 2ri1 s ALA 99 CO 0.23 -0.91 1.30 0.00 0.00 0.00 0.00 175.76 176.37 2ri1 h ALA 100 N 3.21 0.36 -3.63 0.00 0.00 -1.94 -3.39 119.26 113.88 2ri1 h ALA 100 Ca -0.50 -0.75 -0.61 0.00 0.00 0.00 0.00 54.91 53.04 2ri1 h ALA 100 Cb 1.23 -0.04 -0.38 0.00 0.00 0.00 0.00 17.79 18.61 2ri1 h ALA 100 CO 0.65 0.89 -0.78 0.34 0.00 0.00 0.00 179.25 180.35 2ri1 s ASP 101 N -7.03 3.93 0.38 0.00 -1.08 -1.26 -5.04 116.67 106.57 2ri1 s ASP 101 Ca -0.04 -1.26 0.15 0.00 -0.52 0.00 0.00 52.55 50.88 2ri1 s ASP 101 Cb 0.09 -1.20 0.76 0.00 -1.46 0.00 0.00 42.92 41.11 2ri1 s ASP 101 CO 0.86 -0.25 1.82 -0.07 0.52 0.00 0.00 175.17 178.05 2ri1 h LEU 102 N 7.94 0.00 -0.54 -1.34 3.38 -1.98 -2.38 115.31 120.39 2ri1 h LEU 102 Ca -0.17 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 2ri1 h LEU 102 Cb 1.06 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 2ri1 h LEU 102 CO 0.42 0.37 0.23 0.00 0.09 0.00 0.00 178.44 179.54 2ri1 h ALA 103 N 1.63 0.69 -0.94 1.53 0.00 -1.97 -0.60 119.26 119.61 2ri1 h ALA 103 Ca -0.00 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.81 2ri1 h ALA 103 Cb 0.69 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 2ri1 h ALA 103 CO 0.05 0.29 0.61 0.87 0.00 0.00 0.00 179.25 181.07 2ri1 h LYS 104 N 0.72 1.07 -0.21 0.00 1.57 -1.93 -2.08 116.57 115.71 2ri1 h LYS 104 Ca 0.18 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 2ri1 h LYS 104 Cb 0.18 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 2ri1 h LYS 104 CO -0.02 0.71 -0.02 1.49 -0.57 0.00 0.00 179.45 181.04 2ri1 h GLU 105 N 1.10 0.38 -0.54 3.15 4.57 -1.19 0.10 114.58 122.16 2ri1 h GLU 105 Ca 0.39 -0.13 -0.02 0.00 -1.18 0.00 0.00 59.36 58.42 2ri1 h GLU 105 Cb 0.14 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.68 2ri1 h GLU 105 CO -0.14 0.60 0.24 1.79 -1.18 0.00 0.00 179.01 180.32 2ri1 h THR 106 N 0.12 1.19 -0.23 0.32 1.35 -1.03 -1.09 112.91 113.55 2ri1 h THR 106 Ca 0.06 -0.55 -0.11 0.00 -0.55 0.00 0.00 66.41 65.26 2ri1 h THR 106 Cb 0.44 0.52 -0.00 0.00 -1.73 0.00 0.00 68.15 67.38 2ri1 h THR 106 CO 0.02 0.22 -0.28 -0.08 -0.25 0.00 0.00 175.52 175.15 2ri1 h GLU 107 N 0.76 0.59 -0.90 4.72 4.57 -1.30 -2.35 114.58 120.67 2ri1 h GLU 107 Ca 0.19 -0.33 0.01 0.00 -1.18 0.00 0.00 59.36 58.05 2ri1 h GLU 107 Cb 0.11 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.68 2ri1 h GLU 107 CO -0.02 0.93 0.60 -0.92 -1.18 0.00 0.00 179.01 178.41 2ri1 h TYR 108 N 0.28 1.13 -0.13 0.92 3.20 -0.54 -2.26 116.97 119.57 2ri1 h TYR 108 Ca 0.03 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.80 2ri1 h TYR 108 Cb 0.84 -0.38 -0.01 0.00 1.54 0.00 0.00 36.73 38.72 2ri1 h TYR 108 CO 0.08 0.71 -0.46 -0.92 -1.64 0.00 0.00 178.16 175.93 2ri1 h TYR 109 N 1.22 0.38 -0.11 -3.82 3.20 -1.13 -1.55 116.97 115.16 2ri1 h TYR 109 Ca 0.33 -0.12 0.01 0.00 3.14 0.00 0.00 58.73 62.09 2ri1 h TYR 109 Cb -0.14 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.04 2ri1 h TYR 109 CO -0.01 0.73 0.05 -0.44 -1.64 0.00 0.00 178.16 176.85 2ri1 h ASP 110 N 0.26 0.08 -0.34 -2.11 3.32 -1.20 -2.36 116.42 114.07 2ri1 h ASP 110 Ca 0.02 0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.14 2ri1 h ASP 110 Cb 0.91 -0.01 -0.06 0.00 0.22 0.00 0.00 39.33 40.39 2ri1 h ASP 110 CO 0.08 0.06 -0.04 1.56 -1.72 0.00 0.00 179.24 179.18 2ri1 h GLN 111 N 0.12 0.05 -0.81 3.56 4.20 -1.13 -1.80 115.11 119.30 2ri1 h GLN 111 Ca 0.05 -0.00 0.14 0.00 0.06 0.00 0.00 58.65 58.90 2ri1 h GLN 111 Cb 0.01 -0.01 -0.09 0.00 0.30 0.00 0.00 27.48 27.68 2ri1 h GLN 111 CO -0.03 0.03 0.39 0.82 -0.67 0.00 0.00 178.83 179.37 2ri1 h ILE 112 N 0.05 0.71 -0.47 2.54 1.08 -1.22 0.16 117.51 120.35 2ri1 h ILE 112 Ca 0.17 -0.19 -0.06 0.00 -0.39 0.00 0.00 64.86 64.38 2ri1 h ILE 112 Cb 0.24 0.10 -0.02 0.00 -3.07 0.00 0.00 36.82 34.07 2ri1 h ILE 112 CO -0.31 0.10 0.04 -0.07 -0.69 0.00 0.00 178.15 177.22 2ri1 h LEU 113 N 0.56 0.71 -0.44 1.44 3.38 -0.85 0.26 115.31 120.37 2ri1 h LEU 113 Ca 0.44 -0.15 -0.17 0.00 0.09 0.00 0.00 57.88 58.09 2ri1 h LEU 113 Cb 0.64 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 2ri1 h LEU 113 CO -0.37 0.76 -0.56 0.00 0.09 0.00 0.00 178.44 178.36 2ri1 h ALA 114 N 1.33 0.62 -0.03 1.53 0.00 -0.44 -2.95 119.26 119.32 2ri1 h ALA 114 Ca 0.15 -0.52 -0.17 0.00 0.00 0.00 0.00 54.91 54.37 2ri1 h ALA 114 Cb 0.38 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2ri1 h ALA 114 CO 0.01 0.69 -0.76 0.37 0.00 0.00 0.00 179.25 179.56 2ri1 h GLN 115 N 0.50 0.21 -2.18 0.00 4.15 -0.33 -3.38 115.11 114.08 2ri1 h GLN 115 Ca 0.01 -0.19 -0.59 0.00 0.77 0.00 0.00 58.65 58.65 2ri1 h GLN 115 Cb 1.12 0.04 -0.41 0.00 0.21 0.00 0.00 27.48 28.45 2ri1 h GLN 115 CO 0.11 0.87 -0.77 0.66 -1.93 0.00 0.00 178.83 177.77 2ri1 n TYR 116 N -3.74 2.22 -2.07 3.99 4.01 0.88 -5.08 117.16 117.36 2ri1 n TYR 116 Ca -0.03 -3.95 -0.42 0.00 -0.16 0.00 0.00 57.90 53.34 2ri1 n TYR 116 Cb 0.73 -0.47 -0.03 0.00 -0.31 0.00 0.00 39.34 39.25 2ri1 n TYR 116 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 2ri1 s PRO 117 N -1.95 4.29 -0.00 -0.72 0.02 -1.12 -4.69 135.00 130.82 2ri1 s PRO 117 Ca 0.37 2.21 -0.30 0.00 0.02 0.00 0.00 61.00 63.30 2ri1 s PRO 117 Cb 0.14 -3.18 -0.05 0.00 0.02 0.00 0.00 34.50 31.44 2ri1 s PRO 117 CO -0.06 -0.46 1.26 0.42 -0.33 0.00 0.00 177.00 177.84 2ri1 s ILE 118 N 0.73 4.02 -0.01 2.83 1.01 -1.26 -4.74 121.20 123.78 2ri1 s ILE 118 Ca 0.64 1.39 -0.18 0.00 0.00 0.00 0.00 60.65 62.50 2ri1 s ILE 118 Cb -0.40 -3.90 -0.33 0.00 0.01 0.00 0.00 42.46 37.84 2ri1 s ILE 118 CO 0.34 0.03 0.92 0.44 0.00 0.00 0.00 174.94 176.67 2ri1 h ASP 119 N 7.36 0.67 -3.37 3.58 3.32 -1.56 -1.64 116.42 124.77 2ri1 h ASP 119 Ca -0.37 -0.93 -0.35 0.00 0.02 0.00 0.00 57.03 55.40 2ri1 h ASP 119 Cb 1.18 -0.22 -0.37 0.00 0.22 0.00 0.00 39.33 40.14 2ri1 h ASP 119 CO 0.87 1.59 -0.73 -0.22 -1.72 0.00 0.00 179.24 179.02 2ri1 s LEU 120 N -7.69 0.42 -0.24 1.55 2.96 -1.21 -1.66 118.68 112.81 2ri1 s LEU 120 Ca -0.12 0.07 -0.10 0.00 -0.22 0.00 0.00 54.13 53.76 2ri1 s LEU 120 Cb 0.03 -0.11 -0.05 0.00 0.50 0.00 0.00 46.19 46.56 2ri1 s LEU 120 CO 0.89 -0.21 0.15 -1.58 -1.32 0.00 0.00 176.35 174.28 2ri1 s GLN 121 N 1.83 4.03 -0.06 1.98 2.00 -0.44 -0.76 119.66 128.24 2ri1 s GLN 121 Ca 0.01 -0.29 -0.20 0.00 -2.00 0.00 0.00 55.36 52.88 2ri1 s GLN 121 Cb -0.12 -3.52 -0.05 0.00 0.80 0.00 0.00 33.01 30.12 2ri1 s GLN 121 CO -0.03 0.03 0.56 0.42 -0.50 0.00 0.00 175.29 175.78 2ri1 s ILE 122 N 1.13 5.05 0.07 -2.34 -1.09 -0.13 -0.74 121.20 123.14 2ri1 s ILE 122 Ca 0.07 1.16 0.03 0.00 -2.23 0.00 0.00 60.65 59.68 2ri1 s ILE 122 Cb -0.14 -3.90 -0.03 0.00 -1.58 0.00 0.00 42.46 36.81 2ri1 s ILE 122 CO 0.05 0.36 -0.10 -0.76 -1.23 0.00 0.00 174.94 173.26 2ri1 s LEU 123 N 0.27 2.34 0.00 2.97 1.43 0.15 -3.58 118.68 122.25 2ri1 s LEU 123 Ca 0.30 -0.70 0.04 0.00 -1.03 0.00 0.00 54.13 52.74 2ri1 s LEU 123 Cb -0.17 -0.28 0.04 0.00 0.03 0.00 0.00 46.19 45.81 2ri1 s LEU 123 CO 0.15 -0.22 0.32 0.61 0.23 0.00 0.00 176.35 177.44 2ri1 n GLY 124 N 0.95 2.69 3.01 -3.19 0.00 -1.26 -1.00 105.19 106.39 2ri1 n GLY 124 Ca -0.19 -2.25 -0.16 0.00 0.00 0.00 0.00 46.02 43.42 2ri1 n GLY 124 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2ri1 s ILE 125 N -1.80 0.57 0.60 -0.61 2.07 -1.25 -4.72 121.20 116.06 2ri1 s ILE 125 Ca 0.25 -0.50 -0.13 0.00 -1.41 0.00 0.00 60.65 58.87 2ri1 s ILE 125 Cb -0.02 -0.52 -0.04 0.00 0.13 0.00 0.00 42.46 42.01 2ri1 s ILE 125 CO 0.16 0.03 1.03 -0.83 -1.91 0.00 0.00 174.94 173.42 2ri1 s GLY 126 N -0.51 1.78 0.50 1.50 0.00 -0.12 -4.94 107.32 105.52 2ri1 s GLY 126 Ca 0.00 0.03 0.16 0.00 0.00 0.00 0.00 44.72 44.91 2ri1 s GLY 126 CO 0.00 0.30 2.09 3.21 0.00 0.00 0.00 173.10 178.71 2ri1 h ARG 127 N -0.05 0.13 -0.74 2.90 3.08 -1.89 -1.33 114.38 116.48 2ri1 h ARG 127 Ca -0.45 -0.01 -0.18 0.00 0.07 0.00 0.00 59.98 59.41 2ri1 h ARG 127 Cb 1.19 -0.03 -0.11 0.00 0.08 0.00 0.00 29.97 31.10 2ri1 h ARG 127 CO 0.61 0.08 0.23 0.27 -1.07 0.00 0.00 179.97 180.10 2ri1 n ASN 128 N -4.49 4.92 0.00 7.04 6.94 -1.26 -4.30 115.26 124.10 2ri1 n ASN 128 Ca 0.01 -3.14 0.00 0.00 -0.02 0.00 0.00 54.58 51.43 2ri1 n ASN 128 Cb 0.20 -0.74 0.00 0.00 -2.36 0.00 0.00 39.78 36.89 2ri1 n ASN 128 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2ri1 n ALA 129 N -0.02 0.00 -1.59 -2.53 0.00 -0.50 -4.71 120.51 111.16 2ri1 n ALA 129 Ca 0.38 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.43 2ri1 n ALA 129 Cb 1.34 -0.60 0.03 0.00 0.00 0.00 0.00 19.45 20.22 2ri1 n ALA 129 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2ri1 n HIS 130 N -2.32 0.71 -3.89 0.00 1.44 -1.26 -1.46 115.22 108.44 2ri1 n HIS 130 Ca 0.00 0.49 -0.27 0.00 -2.01 0.00 0.00 57.72 55.93 2ri1 n HIS 130 Cb 0.14 -2.15 -0.17 0.00 0.12 0.00 0.00 29.99 27.93 2ri1 n HIS 130 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2ri1 s ILE 131 N -1.44 1.02 0.00 0.61 -1.09 -0.96 -0.95 121.20 118.38 2ri1 s ILE 131 Ca 0.69 -0.39 0.00 0.00 -2.23 0.00 0.00 60.65 58.72 2ri1 s ILE 131 Cb -0.49 -1.10 0.00 0.00 -1.58 0.00 0.00 42.46 39.29 2ri1 s ILE 131 CO 0.53 0.27 0.00 0.61 -1.23 0.00 0.00 174.94 175.12 2ri1 n GLY 132 N 4.93 4.08 1.37 6.18 0.00 -1.26 -0.86 105.19 119.63 2ri1 n GLY 132 Ca -0.12 0.05 0.09 0.00 0.00 0.00 0.00 46.02 46.04 2ri1 n GLY 132 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2ri1 n PHE 133 N 13.98 1.32 -2.87 1.61 3.72 -1.26 -4.92 117.46 129.03 2ri1 n PHE 133 Ca 0.00 -0.66 -0.43 0.00 -0.05 0.00 0.00 57.45 56.32 2ri1 n PHE 133 Cb 0.00 -0.26 -0.04 0.00 -0.94 0.00 0.00 39.48 38.24 2ri1 n PHE 133 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 2ri1 s ASN 134 N -1.09 6.30 0.65 4.37 0.01 -0.04 -5.02 114.94 120.11 2ri1 s ASN 134 Ca 0.46 -0.51 -0.04 0.00 -0.71 0.00 0.00 52.86 52.06 2ri1 s ASN 134 Cb 0.31 -2.42 0.05 0.00 0.41 0.00 0.00 41.25 39.60 2ri1 s ASN 134 CO 0.20 -1.23 0.94 -1.61 -1.51 0.00 0.00 177.10 173.88 2ri1 s GLU 135 N 3.86 2.37 0.16 -0.60 0.41 -1.26 -2.28 118.70 121.36 2ri1 s GLU 135 Ca 0.28 -0.36 -0.33 0.00 -0.41 0.00 0.00 54.97 54.15 2ri1 s GLU 135 Cb -0.14 -2.26 -0.16 0.00 -1.78 0.00 0.00 34.13 29.79 2ri1 s GLU 135 CO 0.17 -1.04 1.10 -2.30 -0.49 0.00 0.00 175.26 172.71 2ri1 n PRO 136 N -2.73 0.98 -0.00 0.39 -0.02 -1.26 -1.56 135.00 130.79 2ri1 n PRO 136 Ca 0.07 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 2ri1 n PRO 136 Cb 0.60 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 2ri1 n PRO 136 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ri1 n GLY 137 N 1.95 0.16 3.71 -1.23 0.00 0.11 -4.90 105.19 104.99 2ri1 n GLY 137 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2ri1 n GLY 137 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ri1 s THR 138 N -2.04 3.20 0.33 2.61 2.01 -0.60 -4.95 115.64 116.20 2ri1 s THR 138 Ca 0.00 0.83 -0.29 0.00 0.31 0.00 0.00 61.69 62.55 2ri1 s THR 138 Cb 0.00 -3.53 -0.11 0.00 0.01 0.00 0.00 72.50 68.87 2ri1 s THR 138 CO 0.00 0.05 1.40 0.00 -0.69 0.00 0.00 174.62 175.38 2ri1 s ALA 139 N 1.33 3.55 0.20 7.40 0.00 -1.26 -4.76 121.76 128.23 2ri1 s ALA 139 Ca 0.66 1.39 0.35 0.00 0.00 0.00 0.00 51.96 54.36 2ri1 s ALA 139 Cb -0.38 -3.54 1.71 0.00 0.00 0.00 0.00 23.12 20.91 2ri1 s ALA 139 CO 0.30 -0.81 2.05 0.74 0.00 0.00 0.00 175.76 178.04 2ri1 h PHE 140 N 3.54 0.00 -0.01 0.00 0.04 -1.97 -2.08 116.94 116.46 2ri1 h PHE 140 Ca -0.49 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.28 2ri1 h PHE 140 Cb 1.23 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.38 2ri1 h PHE 140 CO 0.56 0.00 -0.07 -1.13 -0.60 0.00 0.00 178.31 177.07 2ri1 n SER 141 N -2.84 0.81 -4.76 2.17 3.41 -1.26 -2.58 113.62 108.57 2ri1 n SER 141 Ca -0.01 -1.04 -0.41 0.00 -0.26 0.00 0.00 58.87 57.16 2ri1 n SER 141 Cb 0.16 -0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 2ri1 n SER 141 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2ri1 s SER 142 N -2.21 6.91 0.00 4.04 1.04 -0.78 -4.64 113.70 118.06 2ri1 s SER 142 Ca 0.36 2.55 0.00 0.00 0.48 0.00 0.00 55.95 59.33 2ri1 s SER 142 Cb 0.21 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.69 2ri1 s SER 142 CO 0.41 -0.43 0.00 0.00 0.98 0.00 0.00 173.24 174.19 2ri1 n GLN 143 N 1.14 3.49 -1.76 4.02 6.02 -1.26 -1.58 117.38 127.44 2ri1 n GLN 143 Ca 0.01 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.58 2ri1 n GLN 143 Cb 0.43 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.66 2ri1 n GLN 143 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2ri1 s THR 144 N 1.70 2.13 0.11 5.09 2.01 -1.26 -2.19 115.64 123.23 2ri1 s THR 144 Ca 0.00 0.09 -0.12 0.00 0.31 0.00 0.00 61.69 61.97 2ri1 s THR 144 Cb 0.00 -3.06 0.01 0.00 0.01 0.00 0.00 72.50 69.47 2ri1 s THR 144 CO 0.00 0.01 0.29 -1.38 -0.69 0.00 0.00 174.62 172.84 2ri1 s HIS 145 N 1.20 0.01 0.05 4.92 -3.43 -0.30 -4.83 115.29 112.92 2ri1 s HIS 145 Ca 0.74 -0.39 -0.31 0.00 -0.80 0.00 0.00 55.06 54.30 2ri1 s HIS 145 Cb -0.49 0.08 -0.06 0.00 -1.43 0.00 0.00 32.58 30.68 2ri1 s HIS 145 CO 0.32 -0.62 1.34 -0.51 -2.00 0.00 0.00 174.74 173.27 2ri1 s LEU 146 N -2.84 4.35 -0.06 5.38 1.43 -1.26 -0.90 118.68 124.77 2ri1 s LEU 146 Ca 0.05 2.15 0.03 0.00 -1.03 0.00 0.00 54.13 55.33 2ri1 s LEU 146 Cb 0.03 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.66 2ri1 s LEU 146 CO -0.11 -0.63 -0.15 -0.69 0.23 0.00 0.00 176.35 175.01 2ri1 s VAL 147 N 1.60 3.02 -0.36 -1.59 1.01 0.71 -4.97 120.40 119.82 2ri1 s VAL 147 Ca 0.62 -0.73 -0.19 0.00 0.00 0.00 0.00 61.98 61.68 2ri1 s VAL 147 Cb -0.33 -2.19 0.00 0.00 0.00 0.00 0.00 36.38 33.86 2ri1 s VAL 147 CO 0.28 0.58 0.57 -1.81 0.00 0.00 0.00 175.10 174.73 2ri1 s ASP 148 N -0.52 6.36 0.69 3.32 1.01 -1.26 -1.32 116.67 124.95 2ri1 s ASP 148 Ca 0.07 0.02 -0.15 0.00 0.71 0.00 0.00 52.55 53.19 2ri1 s ASP 148 Cb -0.12 -2.30 0.02 0.00 1.01 0.00 0.00 42.92 41.54 2ri1 s ASP 148 CO 0.01 -0.55 1.17 -0.76 0.21 0.00 0.00 175.17 175.25 2ri1 s LEU 149 N 2.55 3.37 0.68 1.23 1.43 0.44 -4.98 118.68 123.40 2ri1 s LEU 149 Ca 0.21 2.22 -0.16 0.00 -1.03 0.00 0.00 54.13 55.37 2ri1 s LEU 149 Cb -0.15 -4.57 0.01 0.00 0.03 0.00 0.00 46.19 41.51 2ri1 s LEU 149 CO 0.14 -1.96 1.17 0.42 0.23 0.00 0.00 176.35 176.35 2ri1 s THR 150 N -2.09 2.70 0.51 5.49 -4.23 -1.26 -4.84 115.64 111.91 2ri1 s THR 150 Ca 0.72 0.35 0.24 0.00 -1.18 0.00 0.00 61.69 61.82 2ri1 s THR 150 Cb -0.26 -2.93 0.40 0.00 1.34 0.00 0.00 72.50 71.06 2ri1 s THR 150 CO 0.43 -0.17 1.96 -0.65 -0.54 0.00 0.00 174.62 175.64 2ri1 h PRO 151 N 0.04 0.09 -0.01 3.99 0.11 -2.00 -1.00 132.00 133.23 2ri1 h PRO 151 Ca -0.48 -0.01 -0.23 0.00 0.11 0.00 0.00 66.00 65.40 2ri1 h PRO 151 Cb 1.28 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 32.37 2ri1 h PRO 151 CO 0.52 0.06 -0.95 1.03 -0.21 0.00 0.00 178.00 178.46 2ri1 h SER 152 N 0.10 0.60 -0.22 -2.05 0.87 -1.99 -0.56 113.55 110.29 2ri1 h SER 152 Ca 0.31 -0.48 -0.01 0.00 -1.23 0.00 0.00 61.79 60.38 2ri1 h SER 152 Cb 1.10 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.86 2ri1 h SER 152 CO -0.03 1.27 0.10 0.74 -0.53 0.00 0.00 176.83 178.38 2ri1 h THR 153 N 0.27 1.15 0.04 2.23 2.02 -1.74 -0.91 112.91 115.97 2ri1 h THR 153 Ca -0.09 -0.45 0.00 0.00 0.77 0.00 0.00 66.41 66.65 2ri1 h THR 153 Cb 1.58 1.04 -0.00 0.00 -1.74 0.00 0.00 68.15 69.03 2ri1 h THR 153 CO 0.17 0.15 -0.04 0.40 0.37 0.00 0.00 175.52 176.57 2ri1 h ILE 154 N 0.22 0.91 -0.77 3.11 2.04 -1.10 -1.82 117.51 120.10 2ri1 h ILE 154 Ca 0.08 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.07 2ri1 h ILE 154 Cb 0.15 0.91 -0.09 0.00 -0.74 0.00 0.00 36.82 37.05 2ri1 h ILE 154 CO -0.01 0.00 0.35 0.00 0.00 0.00 0.00 178.15 178.50 2ri1 h ALA 155 N 0.87 1.11 -0.20 1.87 0.00 -1.05 -0.35 119.26 121.50 2ri1 h ALA 155 Ca 0.00 0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.83 2ri1 h ALA 155 Cb 0.09 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2ri1 h ALA 155 CO -0.01 -0.14 -0.58 0.00 0.00 0.00 0.00 179.25 178.52 2ri1 h ALA 156 N 1.52 0.61 0.00 0.00 0.00 -0.92 -3.21 119.26 117.26 2ri1 h ALA 156 Ca 0.41 -0.53 -0.16 0.00 0.00 0.00 0.00 54.91 54.63 2ri1 h ALA 156 Cb 0.57 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2ri1 h ALA 156 CO -0.36 0.69 -0.77 -0.91 0.00 0.00 0.00 179.25 177.91 2ri1 h ASN 157 N 0.48 0.00 -0.78 0.00 2.35 -0.89 -3.27 115.58 113.47 2ri1 h ASN 157 Ca 0.00 0.00 0.07 0.00 -0.55 0.00 0.00 56.30 55.83 2ri1 h ASN 157 Cb 1.15 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.47 2ri1 h ASN 157 CO 0.11 0.77 0.51 -1.28 -1.65 0.00 0.00 177.43 175.89 2ri1 h SER 158 N 0.00 0.71 -0.03 5.81 0.87 -1.07 -1.10 113.55 118.73 2ri1 h SER 158 Ca -0.01 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.57 2ri1 h SER 158 Cb 1.59 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 63.41 2ri1 h SER 158 CO 0.10 0.45 0.64 0.03 -0.53 0.00 0.00 176.83 177.52 2ri1 h ARG 159 N 0.80 0.00 -0.30 2.24 2.47 -1.70 -2.41 114.38 115.47 2ri1 h ARG 159 Ca 0.34 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.06 2ri1 h ARG 159 Cb 0.30 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.62 2ri1 h ARG 159 CO -0.12 0.00 0.00 1.19 0.56 0.00 0.00 179.97 181.60 2ri1 n PHE 160 N -2.74 0.40 -4.25 3.04 3.72 -0.42 -4.75 117.46 112.45 2ri1 n PHE 160 Ca -0.00 -0.36 -0.27 0.00 -0.05 0.00 0.00 57.45 56.77 2ri1 n PHE 160 Cb 0.68 -0.02 -0.17 0.00 -0.94 0.00 0.00 39.48 39.03 2ri1 n PHE 160 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2ri1 s PHE 161 N -1.03 1.72 0.00 1.38 0.08 -0.91 -4.89 117.98 114.33 2ri1 s PHE 161 Ca 0.24 -0.81 0.00 0.00 0.12 0.00 0.00 56.93 56.48 2ri1 s PHE 161 Cb 0.13 -1.30 0.00 0.00 -0.57 0.00 0.00 43.02 41.28 2ri1 s PHE 161 CO 0.18 -0.47 0.00 0.39 -0.10 0.00 0.00 175.22 175.22 2ri1 n GLU 162 N 4.42 0.00 -4.30 0.44 1.02 -1.26 -4.71 120.64 116.25 2ri1 n GLU 162 Ca -0.18 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.66 2ri1 n GLU 162 Cb 0.51 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.82 2ri1 n GLU 162 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 2ri1 s LYS 163 N 0.00 2.14 0.46 3.49 -2.85 -1.26 -5.05 119.74 116.68 2ri1 s LYS 163 Ca 0.00 -1.00 0.12 0.00 -1.00 0.00 0.00 55.97 54.10 2ri1 s LYS 163 Cb 0.00 -2.30 1.05 0.00 -2.06 0.00 0.00 37.83 34.52 2ri1 s LYS 163 CO 0.00 0.52 2.07 0.00 0.10 0.00 0.00 175.35 178.04 2ri1 h ALA 164 N 3.81 1.81 0.00 0.59 0.00 -1.94 -2.38 119.26 121.15 2ri1 h ALA 164 Ca -0.49 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 2ri1 h ALA 164 Cb 1.17 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2ri1 h ALA 164 CO 0.51 0.16 -0.06 0.93 0.00 0.00 0.00 179.25 180.79 2ri1 h GLU 165 N 0.18 0.00 0.00 0.00 3.07 -1.99 -2.61 114.58 113.24 2ri1 h GLU 165 Ca 0.05 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.83 2ri1 h GLU 165 Cb 0.09 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.98 2ri1 h GLU 165 CO -0.00 0.06 -0.36 -0.44 -1.40 0.00 0.00 179.01 176.87 2ri1 h ASP 166 N 0.00 0.00 -2.57 1.42 3.32 -1.86 -3.46 116.42 113.28 2ri1 h ASP 166 Ca -0.00 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.51 2ri1 h ASP 166 Cb 0.21 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.76 2ri1 h ASP 166 CO 0.01 0.36 1.11 -0.69 -1.72 0.00 0.00 179.24 178.31 2ri1 s VAL 167 N -3.18 3.45 0.59 -1.35 1.01 -0.98 -4.95 120.40 114.98 2ri1 s VAL 167 Ca 0.03 0.57 -0.20 0.00 0.00 0.00 0.00 61.98 62.38 2ri1 s VAL 167 Cb 0.08 -3.37 -0.03 0.00 0.00 0.00 0.00 36.38 33.06 2ri1 s VAL 167 CO 0.71 -0.05 1.29 -2.84 0.00 0.00 0.00 175.10 174.21 2ri1 s PRO 168 N 4.04 2.94 -0.00 2.72 0.02 -1.26 -4.93 135.00 138.53 2ri1 s PRO 168 Ca 0.76 2.06 0.02 0.00 0.02 0.00 0.00 61.00 63.87 2ri1 s PRO 168 Cb -0.35 -2.05 -0.02 0.00 0.02 0.00 0.00 34.50 32.09 2ri1 s PRO 168 CO 0.32 -1.30 0.08 1.63 -0.33 0.00 0.00 177.00 177.40 2ri1 n LYS 169 N -1.42 5.28 -4.32 5.54 4.76 -1.26 -4.87 118.16 121.87 2ri1 n LYS 169 Ca 0.13 -0.00 -0.18 0.00 -2.87 0.00 0.00 58.31 55.39 2ri1 n LYS 169 Cb 0.47 -0.67 -0.10 0.00 -1.84 0.00 0.00 35.03 32.89 2ri1 n LYS 169 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2ri1 s GLN 170 N -1.35 1.25 0.06 1.97 -0.21 -1.26 -0.42 119.66 119.70 2ri1 s GLN 170 Ca 0.01 -1.53 0.01 0.00 0.02 0.00 0.00 55.36 53.87 2ri1 s GLN 170 Cb 0.02 -1.01 -0.03 0.00 1.00 0.00 0.00 33.01 32.98 2ri1 s GLN 170 CO 0.08 0.17 -0.05 0.00 -2.12 0.00 0.00 175.29 173.37 2ri1 s ALA 171 N -2.94 0.64 -0.24 6.09 0.00 -0.44 -1.14 121.76 123.74 2ri1 s ALA 171 Ca 0.20 -1.08 -0.16 0.00 0.00 0.00 0.00 51.96 50.92 2ri1 s ALA 171 Cb -0.01 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 2ri1 s ALA 171 CO 0.05 -0.21 0.39 0.42 0.00 0.00 0.00 175.76 176.41 2ri1 s ILE 172 N -2.92 5.18 -0.05 0.00 1.01 -0.18 -0.21 121.20 124.03 2ri1 s ILE 172 Ca 0.02 0.65 0.00 0.00 0.00 0.00 0.00 60.65 61.32 2ri1 s ILE 172 Cb 0.01 -3.72 0.02 0.00 0.01 0.00 0.00 42.46 38.78 2ri1 s ILE 172 CO -0.05 0.19 -0.02 -0.44 0.00 0.00 0.00 174.94 174.63 2ri1 s SER 173 N 1.36 0.99 0.23 3.58 0.01 -0.08 -1.86 113.70 117.93 2ri1 s SER 173 Ca 0.17 -0.09 -0.31 0.00 1.31 0.00 0.00 55.95 57.04 2ri1 s SER 173 Cb -0.15 -0.38 -0.15 0.00 0.21 0.00 0.00 66.02 65.55 2ri1 s SER 173 CO 0.09 -0.11 1.18 0.23 0.41 0.00 0.00 173.24 175.04 2ri1 n MET 174 N 4.38 1.46 -2.00 12.44 2.81 0.62 -1.15 117.12 135.67 2ri1 n MET 174 Ca -0.20 0.52 -0.18 0.00 -1.81 0.00 0.00 57.70 56.03 2ri1 n MET 174 Cb 0.50 -2.02 0.10 0.00 -0.71 0.00 0.00 33.22 31.09 2ri1 n MET 174 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ri1 n GLY 175 N 1.77 0.45 0.12 3.03 0.00 -0.93 -4.77 105.19 104.85 2ri1 n GLY 175 Ca 0.12 -1.98 -0.07 0.00 0.00 0.00 0.00 46.02 44.09 2ri1 n GLY 175 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2ri1 h LEU 176 N 0.00 0.17 -0.26 0.99 3.38 -1.68 -1.28 115.31 116.63 2ri1 h LEU 176 Ca -0.26 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 57.55 2ri1 h LEU 176 Cb 0.91 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2ri1 h LEU 176 CO 0.26 0.94 0.04 0.00 0.09 0.00 0.00 178.44 179.78 2ri1 h ALA 177 N 1.05 0.34 -0.02 1.53 0.00 -1.02 -0.80 119.26 120.34 2ri1 h ALA 177 Ca -0.03 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.73 2ri1 h ALA 177 Cb 1.47 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 19.12 2ri1 h ALA 177 CO 0.12 0.02 -0.20 0.77 0.00 0.00 0.00 179.25 179.96 2ri1 h SER 178 N 0.24 -0.59 -0.57 0.00 0.02 -1.53 -2.80 113.55 108.32 2ri1 h SER 178 Ca 0.08 0.09 0.03 0.00 -0.84 0.00 0.00 61.79 61.14 2ri1 h SER 178 Cb 0.32 0.25 -0.04 0.00 0.14 0.00 0.00 62.40 63.08 2ri1 h SER 178 CO 0.00 -0.27 0.34 0.40 -1.14 0.00 0.00 176.83 176.17 2ri1 h ILE 179 N -0.31 1.06 0.00 3.27 2.04 -1.15 -2.55 117.51 119.88 2ri1 h ILE 179 Ca 0.06 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.69 2ri1 h ILE 179 Cb 0.40 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 2ri1 h ILE 179 CO -0.20 0.12 0.11 0.24 0.00 0.00 0.00 178.15 178.42 2ri1 h MET 180 N 0.68 0.00 0.00 2.37 2.86 -0.91 -2.67 114.93 117.26 2ri1 h MET 180 Ca 0.23 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.87 2ri1 h MET 180 Cb 0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.68 2ri1 h MET 180 CO -0.10 0.00 0.00 0.77 1.06 0.00 0.00 176.91 178.64 2ri1 h SER 181 N 0.00 0.00 -2.66 1.22 0.02 -1.20 -3.45 113.55 107.48 2ri1 h SER 181 Ca 0.00 0.00 -0.60 0.00 -0.84 0.00 0.00 61.79 60.35 2ri1 h SER 181 Cb 0.22 0.00 0.13 0.00 0.14 0.00 0.00 62.40 62.88 2ri1 h SER 181 CO 0.00 0.00 0.03 0.00 -1.14 0.00 0.00 176.83 175.72 2ri1 n ALA 182 N -1.86 -0.35 -0.18 3.77 0.00 -1.01 -4.75 120.51 116.12 2ri1 n ALA 182 Ca 0.03 0.28 -0.06 0.00 0.00 0.00 0.00 53.44 53.70 2ri1 n ALA 182 Cb 0.34 -1.99 0.10 0.00 0.00 0.00 0.00 19.45 17.91 2ri1 n ALA 182 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2ri1 h LYS 183 N 1.56 0.97 -3.59 0.00 1.79 -1.35 -3.44 116.57 112.50 2ri1 h LYS 183 Ca -0.41 -0.25 -0.19 0.00 -2.18 0.00 0.00 60.65 57.62 2ri1 h LYS 183 Cb 1.35 -0.12 -0.25 0.00 -1.58 0.00 0.00 32.23 31.63 2ri1 h LYS 183 CO 0.57 0.90 -0.61 1.41 -1.08 0.00 0.00 179.45 180.65 2ri1 s MET 184 N -5.16 0.19 -0.09 3.15 1.75 -0.66 -4.49 119.30 114.00 2ri1 s MET 184 Ca -0.11 -0.08 0.02 0.00 -1.25 0.00 0.00 55.69 54.27 2ri1 s MET 184 Cb 0.15 0.08 0.01 0.00 2.84 0.00 0.00 34.83 37.91 2ri1 s MET 184 CO 0.83 -0.03 -0.15 0.42 -0.65 0.00 0.00 175.02 175.44 2ri1 s ILE 185 N -0.42 1.42 -0.42 10.11 1.01 -0.72 -1.33 121.20 130.85 2ri1 s ILE 185 Ca -0.05 -0.62 -0.08 0.00 0.00 0.00 0.00 60.65 59.91 2ri1 s ILE 185 Cb -0.03 -1.29 0.09 0.00 0.01 0.00 0.00 42.46 41.23 2ri1 s ILE 185 CO 0.00 0.42 0.25 -0.22 0.00 0.00 0.00 174.94 175.40 2ri1 s LEU 186 N 0.84 5.21 -0.18 2.97 2.96 0.08 -0.80 118.68 129.77 2ri1 s LEU 186 Ca -0.10 -1.65 -0.14 0.00 -0.22 0.00 0.00 54.13 52.01 2ri1 s LEU 186 Cb -0.15 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.54 2ri1 s LEU 186 CO 0.01 -0.56 0.33 -0.22 -1.32 0.00 0.00 176.35 174.59 2ri1 s LEU 187 N 1.36 4.21 -0.04 -0.68 0.20 -0.67 -0.67 118.68 122.38 2ri1 s LEU 187 Ca 0.04 0.50 0.01 0.00 0.69 0.00 0.00 54.13 55.36 2ri1 s LEU 187 Cb -0.23 -2.42 -0.03 0.00 -0.43 0.00 0.00 46.19 43.07 2ri1 s LEU 187 CO 0.00 0.03 -0.02 -0.04 -0.29 0.00 0.00 176.35 176.04 2ri1 s MET 188 N 0.79 2.81 -0.15 1.98 -1.94 -0.17 -1.29 119.30 121.32 2ri1 s MET 188 Ca 0.17 -0.55 -0.09 0.00 -1.71 0.00 0.00 55.69 53.51 2ri1 s MET 188 Cb -0.14 -2.67 0.05 0.00 2.01 0.00 0.00 34.83 34.09 2ri1 s MET 188 CO 0.06 0.65 0.37 0.00 -0.01 0.00 0.00 175.02 176.09 2ri1 s ALA 189 N -0.96 -0.94 -0.01 3.03 0.00 -0.32 -3.92 121.76 118.65 2ri1 s ALA 189 Ca 0.16 1.36 0.02 0.00 0.00 0.00 0.00 51.96 53.49 2ri1 s ALA 189 Cb -0.11 -0.82 0.00 0.00 0.00 0.00 0.00 23.12 22.18 2ri1 s ALA 189 CO 0.06 -0.24 -0.05 -0.06 0.00 0.00 0.00 175.76 175.47 2ri1 s PHE 190 N 1.18 0.51 0.00 0.00 0.08 -1.26 -2.66 117.98 115.83 2ri1 s PHE 190 Ca -0.08 -0.10 0.00 0.00 0.12 0.00 0.00 56.93 56.87 2ri1 s PHE 190 Cb -0.08 -0.36 0.00 0.00 -0.57 0.00 0.00 43.02 42.01 2ri1 s PHE 190 CO -0.10 -0.03 0.00 0.41 -0.10 0.00 0.00 175.22 175.40 2ri1 n GLY 191 N 3.13 -0.15 0.46 4.36 0.00 -1.26 -4.61 105.19 107.12 2ri1 n GLY 191 Ca -0.15 -1.51 0.39 0.00 0.00 0.00 0.00 46.02 44.75 2ri1 n GLY 191 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2ri1 h GLU 192 N 0.00 0.02 0.00 1.61 3.07 -1.95 -1.24 114.58 116.09 2ri1 h GLU 192 Ca 0.00 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2ri1 h GLU 192 Cb 0.00 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 2ri1 h GLU 192 CO 0.00 0.01 0.00 0.93 -1.40 0.00 0.00 179.01 178.55 2ri1 h GLU 193 N 0.02 0.00 -0.01 2.33 3.07 -1.90 -1.73 114.58 116.37 2ri1 h GLU 193 Ca 0.87 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.73 2ri1 h GLU 193 Cb 2.74 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.65 2ri1 h GLU 193 CO -0.50 0.00 -0.69 1.63 -1.40 0.00 0.00 179.01 178.05 2ri1 n LYS 194 N -2.81 0.49 -0.20 2.33 4.76 -0.47 -4.67 118.16 117.58 2ri1 n LYS 194 Ca -0.00 -0.38 -0.07 0.00 -2.87 0.00 0.00 58.31 54.98 2ri1 n LYS 194 Cb 0.21 -1.49 0.03 0.00 -1.84 0.00 0.00 35.03 31.93 2ri1 n LYS 194 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ri1 h ALA 195 N 3.36 0.75 -0.52 7.82 0.00 -1.40 -0.13 119.26 129.14 2ri1 h ALA 195 Ca 0.00 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 2ri1 h ALA 195 Cb 0.59 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 2ri1 h ALA 195 CO 0.00 0.34 -0.09 1.49 0.00 0.00 0.00 179.25 180.99 2ri1 h GLU 196 N 0.79 0.98 -0.34 0.00 4.81 -1.83 -1.27 114.58 117.72 2ri1 h GLU 196 Ca 0.20 -0.36 -0.05 0.00 -0.13 0.00 0.00 59.36 59.01 2ri1 h GLU 196 Cb 0.17 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 2ri1 h GLU 196 CO -0.02 1.04 0.02 0.00 -0.73 0.00 0.00 179.01 179.31 2ri1 h ALA 197 N 0.92 0.45 -0.30 2.92 0.00 -1.65 -0.36 119.26 121.25 2ri1 h ALA 197 Ca 0.14 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2ri1 h ALA 197 Cb 0.65 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 2ri1 h ALA 197 CO 0.05 0.19 0.16 0.28 0.00 0.00 0.00 179.25 179.93 2ri1 h VAL 198 N 0.40 1.14 -0.19 0.00 2.07 -1.03 -0.50 116.25 118.14 2ri1 h VAL 198 Ca 0.10 -0.37 0.01 0.00 0.82 0.00 0.00 66.70 67.26 2ri1 h VAL 198 Cb 0.42 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 2ri1 h VAL 198 CO 0.01 0.14 0.10 0.00 0.02 0.00 0.00 177.57 177.84 2ri1 h ALA 199 N 1.03 0.22 -0.94 1.67 0.00 -1.22 -1.27 119.26 118.75 2ri1 h ALA 199 Ca 0.10 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2ri1 h ALA 199 Cb 0.08 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2ri1 h ALA 199 CO -0.02 -0.32 0.62 0.00 0.00 0.00 0.00 179.25 179.53 2ri1 h ALA 200 N 1.09 1.34 -0.72 0.00 0.00 -0.99 0.33 119.26 120.31 2ri1 h ALA 200 Ca 0.07 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2ri1 h ALA 200 Cb 0.01 -0.37 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 2ri1 h ALA 200 CO -0.05 0.60 0.17 1.98 0.00 0.00 0.00 179.25 181.96 2ri1 h MET 201 N 1.26 1.15 0.17 0.00 -1.53 -0.85 -2.82 114.93 112.30 2ri1 h MET 201 Ca 0.35 -0.28 -0.33 0.00 -3.44 0.00 0.00 59.70 56.00 2ri1 h MET 201 Cb -0.12 -0.15 0.01 0.00 -0.55 0.00 0.00 31.60 30.78 2ri1 h MET 201 CO -0.08 1.01 -1.68 0.28 0.14 0.00 0.00 176.91 176.58 2ri1 h VAL 202 N 1.09 0.94 0.00 -5.77 2.07 -1.09 -3.40 116.25 110.09 2ri1 h VAL 202 Ca 0.22 -2.47 -0.01 0.00 0.82 0.00 0.00 66.70 65.26 2ri1 h VAL 202 Cb 0.38 2.74 -0.00 0.00 -1.52 0.00 0.00 31.29 32.89 2ri1 h VAL 202 CO 0.00 0.82 -1.16 0.29 0.02 0.00 0.00 177.57 177.55 2ri1 n LYS 203 N -3.67 1.03 -1.91 1.57 4.76 0.09 -5.03 118.16 115.00 2ri1 n LYS 203 Ca -0.25 -0.02 -0.25 0.00 -2.87 0.00 0.00 58.31 54.92 2ri1 n LYS 203 Cb 1.03 -1.08 0.16 0.00 -1.84 0.00 0.00 35.03 33.31 2ri1 n LYS 203 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2ri1 n GLY 204 N 2.45 -0.86 3.76 0.72 0.00 -1.06 -5.02 105.19 105.18 2ri1 n GLY 204 Ca -0.02 -1.80 -0.32 0.00 0.00 0.00 0.00 46.02 43.89 2ri1 n GLY 204 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ri1 s PRO 205 N -5.40 2.41 -0.52 1.61 0.04 -1.26 -4.96 135.00 126.92 2ri1 s PRO 205 Ca 0.66 1.29 -0.28 0.00 0.04 0.00 0.00 61.00 62.71 2ri1 s PRO 205 Cb -0.02 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.64 2ri1 s PRO 205 CO 0.45 -1.54 1.15 0.08 0.04 0.00 0.00 177.00 177.18 2ri1 s VAL 206 N -2.64 4.14 -0.15 -0.36 1.01 -1.26 -4.87 120.40 116.27 2ri1 s VAL 206 Ca 0.64 1.04 -0.18 0.00 0.00 0.00 0.00 61.98 63.49 2ri1 s VAL 206 Cb -0.19 -4.65 0.05 0.00 0.00 0.00 0.00 36.38 31.59 2ri1 s VAL 206 CO 0.50 -1.15 0.48 0.28 0.00 0.00 0.00 175.10 175.21 2ri1 s THR 207 N 4.62 0.01 0.42 3.92 -1.32 -1.26 -5.04 115.64 116.98 2ri1 s THR 207 Ca 0.45 -0.06 0.33 0.00 -1.21 0.00 0.00 61.69 61.20 2ri1 s THR 207 Cb -0.07 -0.69 0.35 0.00 -1.51 0.00 0.00 72.50 70.58 2ri1 s THR 207 CO 0.29 -0.03 2.14 -0.33 -2.21 0.00 0.00 174.62 174.47 2ri1 h GLU 208 N 5.00 0.00 -0.10 7.08 3.07 -1.93 -2.11 114.58 125.59 2ri1 h GLU 208 Ca -0.28 0.00 0.03 0.00 -0.50 0.00 0.00 59.36 58.61 2ri1 h GLU 208 Cb 1.17 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.08 2ri1 h GLU 208 CO 0.24 0.06 0.12 0.93 -1.40 0.00 0.00 179.01 178.96 2ri1 h GLU 209 N 0.00 0.00 -3.08 2.33 4.39 -1.90 0.32 114.58 116.64 2ri1 h GLU 209 Ca -0.00 0.00 -0.62 0.00 0.34 0.00 0.00 59.36 59.08 2ri1 h GLU 209 Cb 0.28 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 28.52 2ri1 h GLU 209 CO 0.01 0.00 -0.70 0.42 -1.16 0.00 0.00 179.01 177.58 2ri1 s ILE 210 N -4.58 1.85 0.29 3.13 -1.09 -0.79 -4.48 121.20 115.53 2ri1 s ILE 210 Ca -0.05 -2.97 0.04 0.00 -2.23 0.00 0.00 60.65 55.45 2ri1 s ILE 210 Cb 0.15 -2.28 0.28 0.00 -1.58 0.00 0.00 42.46 39.03 2ri1 s ILE 210 CO 0.53 -0.90 1.75 -0.65 -1.23 0.00 0.00 174.94 174.44 2ri1 h PRO 211 N 6.46 0.60 0.00 2.79 0.11 -1.64 -1.09 132.00 139.24 2ri1 h PRO 211 Ca 0.00 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.06 2ri1 h PRO 211 Cb 0.90 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.87 2ri1 h PRO 211 CO 0.56 0.40 -0.06 0.00 -0.21 0.00 0.00 178.00 178.69 2ri1 h ALA 212 N 1.65 1.17 -0.07 -0.75 0.00 -1.57 -3.06 119.26 116.63 2ri1 h ALA 212 Ca 0.56 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.43 2ri1 h ALA 212 Cb 0.92 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2ri1 h ALA 212 CO -0.42 0.08 0.09 0.66 0.00 0.00 0.00 179.25 179.65 2ri1 h SER 213 N 0.00 0.00 -0.44 0.00 4.64 -1.40 -2.28 113.55 114.07 2ri1 h SER 213 Ca -0.00 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.45 2ri1 h SER 213 Cb 0.28 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.35 2ri1 h SER 213 CO 0.01 0.00 0.36 -0.29 -0.87 0.00 0.00 176.83 176.04 2ri1 h ILE 214 N 0.00 0.62 -0.02 0.95 6.09 -1.71 -1.32 117.51 122.12 2ri1 h ILE 214 Ca 0.03 0.00 0.01 0.00 -1.37 0.00 0.00 64.86 63.53 2ri1 h ILE 214 Cb 0.21 0.74 -0.00 0.00 0.47 0.00 0.00 36.82 38.24 2ri1 h ILE 214 CO -0.00 0.00 0.04 -0.07 -3.07 0.00 0.00 178.15 175.05 2ri1 h LEU 215 N 0.00 0.00 -2.78 2.19 3.38 -1.67 0.12 115.31 116.54 2ri1 h LEU 215 Ca 0.21 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 2ri1 h LEU 215 Cb 0.92 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.67 2ri1 h LEU 215 CO -0.00 0.00 -0.00 1.56 0.09 0.00 0.00 178.44 180.08 2ri1 h GLN 216 N 0.00 0.00 -0.02 1.13 4.20 -1.45 -2.19 115.11 116.77 2ri1 h GLN 216 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 2ri1 h GLN 216 Cb 0.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.87 2ri1 h GLN 216 CO -0.00 0.00 -0.16 0.25 -0.67 0.00 0.00 178.83 178.25 2ri1 n THR 217 N -3.20 0.00 -2.89 -0.54 -2.24 0.03 -4.28 114.28 101.16 2ri1 n THR 217 Ca -0.03 -0.42 -0.40 0.00 -2.27 0.00 0.00 64.05 60.94 2ri1 n THR 217 Cb 0.09 1.39 -0.06 0.00 -2.10 0.00 0.00 70.33 69.66 2ri1 n THR 217 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2ri1 s HIS 218 N -2.06 3.90 -0.75 4.78 5.04 -0.83 -4.09 115.29 121.28 2ri1 s HIS 218 Ca 0.23 1.71 0.22 0.00 -1.54 0.00 0.00 55.06 55.68 2ri1 s HIS 218 Cb 0.18 -2.87 0.87 0.00 0.04 0.00 0.00 32.58 30.80 2ri1 s HIS 218 CO 0.38 0.43 1.66 -0.35 -2.34 0.00 0.00 174.74 174.52 2ri1 n PRO 219 N 1.87 0.12 -3.11 2.88 -0.04 -1.26 -1.37 135.00 134.08 2ri1 n PRO 219 Ca -0.03 0.29 -0.12 0.00 -0.04 0.00 0.00 63.50 63.59 2ri1 n PRO 219 Cb 0.48 -1.70 -0.04 0.00 -0.04 0.00 0.00 33.50 32.21 2ri1 n PRO 219 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2ri1 s LYS 220 N -3.14 0.91 -0.08 0.54 2.20 -1.25 -4.11 119.74 114.81 2ri1 s LYS 220 Ca 0.07 -1.22 0.03 0.00 -0.36 0.00 0.00 55.97 54.49 2ri1 s LYS 220 Cb 0.11 -0.55 -0.01 0.00 -1.51 0.00 0.00 37.83 35.87 2ri1 s LYS 220 CO 0.39 -1.30 -0.19 0.08 -0.36 0.00 0.00 175.35 173.97 2ri1 s VAL 221 N 0.87 2.58 -0.13 4.02 1.01 -0.44 -1.75 120.40 126.57 2ri1 s VAL 221 Ca 0.26 -0.86 0.02 0.00 0.00 0.00 0.00 61.98 61.40 2ri1 s VAL 221 Cb -0.03 -2.01 -0.00 0.00 0.00 0.00 0.00 36.38 34.34 2ri1 s VAL 221 CO -0.09 0.56 -0.19 -0.63 0.00 0.00 0.00 175.10 174.76 2ri1 s ILE 222 N -0.09 2.48 -0.16 2.22 -1.09 0.02 -1.45 121.20 123.13 2ri1 s ILE 222 Ca -0.04 -0.86 -0.03 0.00 -2.23 0.00 0.00 60.65 57.49 2ri1 s ILE 222 Cb -0.14 -2.00 -0.02 0.00 -1.58 0.00 0.00 42.46 38.71 2ri1 s ILE 222 CO 0.04 0.54 -0.05 -0.22 -1.23 0.00 0.00 174.94 174.02 2ri1 s LEU 223 N 0.52 3.13 -0.22 2.97 2.96 0.11 -1.67 118.68 126.47 2ri1 s LEU 223 Ca -0.12 -0.19 0.02 0.00 -0.22 0.00 0.00 54.13 53.62 2ri1 s LEU 223 Cb -0.16 -1.75 0.04 0.00 0.50 0.00 0.00 46.19 44.82 2ri1 s LEU 223 CO 0.05 0.15 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.44 2ri1 s ILE 224 N 0.48 2.10 0.02 6.68 1.01 -0.41 -0.51 121.20 130.56 2ri1 s ILE 224 Ca -0.04 -1.31 0.03 0.00 0.00 0.00 0.00 60.65 59.33 2ri1 s ILE 224 Cb -0.15 -2.07 -0.01 0.00 0.01 0.00 0.00 42.46 40.24 2ri1 s ILE 224 CO 0.03 0.23 -0.09 0.68 0.00 0.00 0.00 174.94 175.80 2ri1 s VAL 225 N 1.20 0.65 0.85 2.92 -7.23 -0.90 -1.17 120.40 116.72 2ri1 s VAL 225 Ca -0.02 -0.66 -0.12 0.00 -1.81 0.00 0.00 61.98 59.37 2ri1 s VAL 225 Cb -0.17 -0.61 0.10 0.00 0.56 0.00 0.00 36.38 36.27 2ri1 s VAL 225 CO -0.09 -0.03 1.13 1.51 -0.31 0.00 0.00 175.10 177.32 2ri1 s ASP 226 N -0.76 4.05 0.30 4.85 -4.77 -1.09 -0.22 116.67 119.03 2ri1 s ASP 226 Ca -0.01 1.03 0.05 0.00 -3.30 0.00 0.00 52.55 50.31 2ri1 s ASP 226 Cb -0.06 -1.64 0.71 0.00 -1.09 0.00 0.00 42.92 40.84 2ri1 s ASP 226 CO 0.00 -2.22 1.76 -0.33 0.70 0.00 0.00 175.17 175.09 2ri1 h GLU 227 N -1.27 0.68 -0.20 2.11 4.39 -1.13 0.12 114.58 119.28 2ri1 h GLU 227 Ca -0.49 -0.04 -0.10 0.00 0.34 0.00 0.00 59.36 59.07 2ri1 h GLU 227 Cb 1.31 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 29.81 2ri1 h GLU 227 CO 0.62 0.45 -0.27 0.87 -1.16 0.00 0.00 179.01 179.53 2ri1 h LYS 228 N 0.70 0.54 0.00 2.33 1.57 -1.87 -2.56 116.57 117.27 2ri1 h LYS 228 Ca 0.56 -0.31 -0.12 0.00 -1.87 0.00 0.00 60.65 58.91 2ri1 h LYS 228 Cb 0.89 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.20 2ri1 h LYS 228 CO -0.40 0.90 -0.57 0.00 -0.57 0.00 0.00 179.45 178.81 2ri1 h ALA 229 N 0.63 1.00 -0.45 3.86 0.00 -1.47 -3.12 119.26 119.71 2ri1 h ALA 229 Ca 0.02 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2ri1 h ALA 229 Cb 0.84 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2ri1 h ALA 229 CO 0.06 0.72 0.00 0.41 0.00 0.00 0.00 179.25 180.44 2ri1 n GLY 230 N 0.22 1.34 0.29 0.00 0.00 0.37 -3.93 105.19 103.47 2ri1 n GLY 230 Ca -0.01 -0.58 0.12 0.00 0.00 0.00 0.00 46.02 45.54 2ri1 n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ri1 h ALA 231 N 4.10 2.03 -0.25 4.61 0.00 -1.39 -2.24 119.26 126.11 2ri1 h ALA 231 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ri1 h ALA 231 Cb 0.73 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2ri1 h ALA 231 CO 0.00 -0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.52 2ri1 n GLY 232 N -1.53 0.94 0.00 0.00 0.00 -1.26 -5.11 105.19 98.23 2ri1 n GLY 232 Ca -0.00 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2ri1 n GLY 232 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61