#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 6.05 -0.28 1.61 1.04 -1.16 -4.39 113.70 116.56 2ri1 s SER 0 Ca 0.00 0.04 -0.03 0.00 0.48 0.00 0.00 55.95 56.44 2ri1 s SER 0 Cb 0.00 -1.74 0.09 0.00 0.10 0.00 0.00 66.02 64.48 2ri1 s SER 0 CO 0.00 0.02 0.10 -0.32 0.98 0.00 0.00 173.24 174.03 2ri1 s MET 1 N -3.41 0.43 0.28 4.02 0.00 -1.26 -2.07 119.30 117.29 2ri1 s MET 1 Ca 0.33 -0.70 -0.21 0.00 0.00 0.00 0.00 55.69 55.12 2ri1 s MET 1 Cb -0.10 -1.62 -0.09 0.00 0.00 0.00 0.00 34.83 33.02 2ri1 s MET 1 CO 0.27 -0.94 0.80 0.15 0.00 0.00 0.00 175.02 175.30 2ri1 s LYS 2 N 1.89 4.30 -0.13 4.11 1.02 -0.95 -4.94 119.74 125.04 2ri1 s LYS 2 Ca 0.08 0.98 -0.01 0.00 0.02 0.00 0.00 55.97 57.04 2ri1 s LYS 2 Cb -0.17 -2.74 -0.02 0.00 -0.52 0.00 0.00 37.83 34.39 2ri1 s LYS 2 CO -0.28 0.30 -0.12 0.99 -0.92 0.00 0.00 175.35 175.32 2ri1 s THR 3 N -1.66 3.16 -0.28 2.17 2.01 -1.26 -0.99 115.64 118.79 2ri1 s THR 3 Ca 0.48 -0.62 -0.08 0.00 0.31 0.00 0.00 61.69 61.78 2ri1 s THR 3 Cb -0.16 -2.33 -0.01 0.00 0.01 0.00 0.00 72.50 70.01 2ri1 s THR 3 CO 0.21 0.52 0.09 -0.63 -0.69 0.00 0.00 174.62 174.12 2ri1 s ILE 4 N 0.36 4.28 0.02 1.82 1.01 0.18 -4.95 121.20 123.93 2ri1 s ILE 4 Ca -0.10 -0.39 -0.17 0.00 0.00 0.00 0.00 60.65 59.99 2ri1 s ILE 4 Cb -0.16 -3.11 -0.06 0.00 0.01 0.00 0.00 42.46 39.14 2ri1 s ILE 4 CO 0.05 0.19 0.49 -0.54 0.00 0.00 0.00 174.94 175.13 2ri1 s LYS 5 N 1.58 4.07 0.14 2.79 1.02 -1.26 -1.56 119.74 126.52 2ri1 s LYS 5 Ca 0.05 0.56 0.01 0.00 0.02 0.00 0.00 55.97 56.62 2ri1 s LYS 5 Cb -0.16 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 33.86 2ri1 s LYS 5 CO 0.04 0.63 -0.02 0.14 -0.92 0.00 0.00 175.35 175.22 2ri1 s VAL 6 N -0.97 0.63 0.18 3.17 -7.23 0.12 -4.95 120.40 111.36 2ri1 s VAL 6 Ca 0.26 -1.95 -0.11 0.00 -1.81 0.00 0.00 61.98 58.37 2ri1 s VAL 6 Cb -0.18 -1.92 0.10 0.00 0.56 0.00 0.00 36.38 34.94 2ri1 s VAL 6 CO 0.16 -0.65 1.77 0.50 -0.31 0.00 0.00 175.10 176.57 2ri1 h LYS 7 N 2.83 0.94 -2.73 4.82 3.64 -1.94 0.11 116.57 124.25 2ri1 h LYS 7 Ca -0.36 -0.14 0.09 0.00 -1.27 0.00 0.00 60.65 58.97 2ri1 h LYS 7 Cb 1.19 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.81 2ri1 h LYS 7 CO 0.63 0.75 0.42 0.54 -2.27 0.00 0.00 179.45 179.53 2ri1 s ASN 8 N -6.07 -0.04 0.22 4.20 2.20 -1.26 -3.97 114.94 110.22 2ri1 s ASN 8 Ca -0.13 -0.81 -0.08 0.00 -0.94 0.00 0.00 52.86 50.90 2ri1 s ASN 8 Cb 0.14 0.65 0.25 0.00 -2.00 0.00 0.00 41.25 40.29 2ri1 s ASN 8 CO 0.80 -1.28 1.84 0.50 -2.94 0.00 0.00 177.10 176.02 2ri1 h LYS 9 N 2.00 0.84 -0.75 3.55 3.64 -1.97 -1.74 116.57 122.14 2ri1 h LYS 9 Ca -0.28 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.06 2ri1 h LYS 9 Cb 1.23 -0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 32.83 2ri1 h LYS 9 CO 0.35 0.55 0.49 1.15 -2.27 0.00 0.00 179.45 179.73 2ri1 h THR 10 N 0.86 1.20 -0.03 1.00 2.02 -1.99 -0.28 112.91 115.69 2ri1 h THR 10 Ca 0.32 -0.36 -0.22 0.00 0.77 0.00 0.00 66.41 66.92 2ri1 h THR 10 Cb 0.11 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.62 2ri1 h THR 10 CO -0.15 0.19 -0.89 -0.33 0.37 0.00 0.00 175.52 174.71 2ri1 h GLU 11 N 1.02 0.49 -0.41 6.66 4.39 -1.94 -2.32 114.58 122.46 2ri1 h GLU 11 Ca 0.27 -0.48 -0.07 0.00 0.34 0.00 0.00 59.36 59.43 2ri1 h GLU 11 Cb -0.11 0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 2ri1 h GLU 11 CO -0.06 1.12 -0.02 0.78 -1.16 0.00 0.00 179.01 179.67 2ri1 h GLY 12 N 1.07 0.72 1.72 -3.84 0.00 -1.09 -2.18 103.07 99.47 2ri1 h GLY 12 Ca -0.07 -0.47 -0.11 0.00 0.00 0.00 0.00 47.33 46.68 2ri1 h GLY 12 CO 0.16 0.44 -0.39 1.76 0.00 0.00 0.00 176.54 178.51 2ri1 h SER 13 N 0.63 0.33 -0.38 0.19 0.02 -0.94 -0.71 113.55 112.69 2ri1 h SER 13 Ca 0.13 -0.14 -0.16 0.00 -0.84 0.00 0.00 61.79 60.78 2ri1 h SER 13 Cb 0.42 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 2ri1 h SER 13 CO 0.02 0.69 -0.38 0.11 -1.14 0.00 0.00 176.83 176.13 2ri1 h LYS 14 N 0.27 0.93 -0.16 3.45 1.57 -1.30 -1.91 116.57 119.41 2ri1 h LYS 14 Ca 0.03 -0.49 -0.01 0.00 -1.87 0.00 0.00 60.65 58.31 2ri1 h LYS 14 Cb 0.80 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 2ri1 h LYS 14 CO 0.06 1.15 0.06 0.28 -0.57 0.00 0.00 179.45 180.43 2ri1 h VAL 15 N 0.75 1.17 -0.64 0.50 2.07 -1.27 -1.64 116.25 117.19 2ri1 h VAL 15 Ca 0.06 -0.51 0.05 0.00 0.82 0.00 0.00 66.70 67.12 2ri1 h VAL 15 Cb 0.97 1.21 -0.05 0.00 -1.52 0.00 0.00 31.29 31.90 2ri1 h VAL 15 CO 0.09 0.16 0.36 0.00 0.02 0.00 0.00 177.57 178.20 2ri1 h ALA 16 N 0.89 0.85 -0.38 1.67 0.00 -1.11 -1.73 119.26 119.44 2ri1 h ALA 16 Ca 0.05 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.04 2ri1 h ALA 16 Cb 0.20 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 2ri1 h ALA 16 CO -0.00 0.05 0.01 0.35 0.00 0.00 0.00 179.25 179.66 2ri1 h PHE 17 N 0.68 -0.00 -0.93 0.00 3.57 -1.24 -0.09 116.94 118.92 2ri1 h PHE 17 Ca 0.28 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.80 2ri1 h PHE 17 Cb 0.14 0.06 -0.04 0.00 2.79 0.00 0.00 35.95 38.90 2ri1 h PHE 17 CO -0.08 -0.06 0.54 0.00 -2.23 0.00 0.00 178.31 176.49 2ri1 h ARG 18 N 0.12 1.27 -0.30 1.11 3.08 -0.76 -0.82 114.38 118.07 2ri1 h ARG 18 Ca 0.19 -0.12 -0.13 0.00 0.07 0.00 0.00 59.98 59.98 2ri1 h ARG 18 Cb 0.26 -0.26 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 2ri1 h ARG 18 CO -0.30 0.90 -0.31 0.52 -1.07 0.00 0.00 179.97 179.70 2ri1 h MET 19 N 1.28 0.74 0.09 0.04 2.86 -1.20 -2.51 114.93 116.23 2ri1 h MET 19 Ca 0.33 -0.39 0.01 0.00 -2.06 0.00 0.00 59.70 57.59 2ri1 h MET 19 Cb -0.03 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 2ri1 h MET 19 CO -0.06 1.01 -0.13 1.25 1.06 0.00 0.00 176.91 180.04 2ri1 h LEU 20 N 0.49 -0.37 -1.40 1.22 5.85 -0.85 -1.55 115.31 118.70 2ri1 h LEU 20 Ca 0.05 0.04 0.12 0.00 0.84 0.00 0.00 57.88 58.93 2ri1 h LEU 20 Cb 0.89 0.14 -0.06 0.00 0.37 0.00 0.00 40.66 42.00 2ri1 h LEU 20 CO 0.08 -0.20 0.53 -0.08 -0.34 0.00 0.00 178.44 178.42 2ri1 h GLU 21 N -0.27 0.60 -0.25 1.25 4.81 -1.07 -1.96 114.58 117.69 2ri1 h GLU 21 Ca 0.02 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.08 2ri1 h GLU 21 Cb 0.28 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 2ri1 h GLU 21 CO -0.07 0.40 -0.37 0.93 -0.73 0.00 0.00 179.01 179.17 2ri1 h GLU 22 N 0.62 0.69 -0.67 1.92 4.39 -1.19 -1.80 114.58 118.54 2ri1 h GLU 22 Ca 0.39 -0.41 0.07 0.00 0.34 0.00 0.00 59.36 59.74 2ri1 h GLU 22 Cb 0.64 0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 29.26 2ri1 h GLU 22 CO -0.15 1.03 0.36 0.93 -1.16 0.00 0.00 179.01 180.02 2ri1 h GLU 23 N 0.41 0.63 -0.60 2.33 4.39 -0.79 0.02 114.58 120.97 2ri1 h GLU 23 Ca 0.02 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 2ri1 h GLU 23 Cb 0.96 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.44 2ri1 h GLU 23 CO 0.09 0.42 0.31 0.82 -1.16 0.00 0.00 179.01 179.48 2ri1 h ILE 24 N 0.65 1.21 -0.01 3.13 2.04 -1.39 0.11 117.51 123.25 2ri1 h ILE 24 Ca 0.31 -0.56 -0.09 0.00 1.00 0.00 0.00 64.86 65.52 2ri1 h ILE 24 Cb 0.23 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 2ri1 h ILE 24 CO -0.20 0.23 -0.41 0.00 0.00 0.00 0.00 178.15 177.77 2ri1 h THR 25 N 0.82 1.30 -0.10 -0.27 1.03 -0.83 -2.67 112.91 112.19 2ri1 h THR 25 Ca 0.21 -1.42 0.00 0.00 -0.01 0.00 0.00 66.41 65.19 2ri1 h THR 25 Cb 0.09 1.75 0.00 0.00 -1.07 0.00 0.00 68.15 68.91 2ri1 h THR 25 CO -0.03 0.41 0.00 0.49 -0.01 0.00 0.00 175.52 176.38 2ri1 n PHE 26 N -4.05 0.12 0.00 0.00 3.01 -0.05 -4.92 117.46 111.57 2ri1 n PHE 26 Ca -0.02 -0.06 0.00 0.00 1.01 0.00 0.00 57.45 58.38 2ri1 n PHE 26 Cb 0.44 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.91 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 1.04 1.25 3.75 1.37 0.00 -0.66 -5.04 105.19 106.90 2ri1 n GLY 27 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2ri1 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ri1 s ALA 28 N -2.00 3.66 0.00 4.61 0.00 0.31 -4.91 121.76 123.43 2ri1 s ALA 28 Ca 0.00 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.38 2ri1 s ALA 28 Cb 0.00 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.53 2ri1 s ALA 28 CO 0.00 -0.84 0.00 1.63 0.00 0.00 0.00 175.76 176.55 2ri1 n LYS 29 N 2.06 2.49 -4.50 0.00 4.76 -1.26 -4.65 118.16 117.07 2ri1 n LYS 29 Ca 0.06 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.19 2ri1 n LYS 29 Cb 0.39 -0.82 -0.16 0.00 -1.84 0.00 0.00 35.03 32.60 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 -1.58 1.90 -0.10 -0.18 2.01 -1.26 -0.80 115.64 115.64 2ri1 s THR 30 Ca 0.00 -0.87 -0.00 0.00 0.31 0.00 0.00 61.69 61.12 2ri1 s THR 30 Cb 0.00 -1.70 -0.03 0.00 0.01 0.00 0.00 72.50 70.78 2ri1 s THR 30 CO 0.00 0.52 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.62 2ri1 s LEU 31 N 0.97 3.13 -0.07 4.42 1.43 0.03 -0.30 118.68 128.29 2ri1 s LEU 31 Ca -0.04 -0.09 -0.15 0.00 -1.03 0.00 0.00 54.13 52.82 2ri1 s LEU 31 Cb -0.15 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.32 2ri1 s LEU 31 CO -0.04 0.29 0.38 -0.83 0.23 0.00 0.00 176.35 176.37 2ri1 s GLY 32 N -0.36 2.37 0.32 -3.19 0.00 0.75 -0.36 107.32 106.85 2ri1 s GLY 32 Ca 0.05 -0.30 0.09 0.00 0.00 0.00 0.00 44.72 44.56 2ri1 s GLY 32 CO 0.02 0.32 0.03 1.08 0.00 0.00 0.00 173.10 174.55 2ri1 s LEU 33 N -0.33 3.07 0.16 0.66 1.43 0.12 -1.18 118.68 122.62 2ri1 s LEU 33 Ca 0.22 -0.87 0.08 0.00 -1.03 0.00 0.00 54.13 52.53 2ri1 s LEU 33 Cb -0.15 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.52 2ri1 s LEU 33 CO 0.10 -0.19 -0.07 0.00 0.23 0.00 0.00 176.35 176.41 2ri1 s ALA 34 N -2.46 3.01 0.27 4.21 0.00 -1.23 -4.12 121.76 121.44 2ri1 s ALA 34 Ca 0.35 -1.40 0.02 0.00 0.00 0.00 0.00 51.96 50.92 2ri1 s ALA 34 Cb -0.02 -0.83 0.02 0.00 0.00 0.00 0.00 23.12 22.28 2ri1 s ALA 34 CO 0.20 0.51 0.13 0.25 0.00 0.00 0.00 175.76 176.85 2ri1 n THR 35 N 0.14 0.00 -1.07 0.00 -2.24 -1.26 -4.91 114.28 104.94 2ri1 n THR 35 Ca -0.11 -1.13 0.00 0.00 -2.27 0.00 0.00 64.05 60.54 2ri1 n THR 35 Cb 0.55 -0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 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 1.80 -2.55 0.20 3.38 0.00 -1.26 -4.55 105.19 102.21 2ri1 n GLY 36 Ca -0.05 -1.79 -0.08 0.00 0.00 0.00 0.00 46.02 44.10 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 0.52 -0.65 1.61 0.87 -2.02 -3.38 113.55 110.50 2ri1 h SER 37 Ca 0.00 -0.28 0.13 0.00 -1.23 0.00 0.00 61.79 60.40 2ri1 h SER 37 Cb 0.00 -0.15 -0.10 0.00 -0.44 0.00 0.00 62.40 61.72 2ri1 h SER 37 CO 0.00 0.98 0.13 0.74 -0.53 0.00 0.00 176.83 178.15 2ri1 h THR 38 N 0.35 0.59 -0.47 2.23 2.02 -1.97 -2.20 112.91 113.46 2ri1 h THR 38 Ca 0.00 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.09 2ri1 h THR 38 Cb 1.11 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 67.83 2ri1 h THR 38 CO 0.10 0.05 0.00 -0.81 0.37 0.00 0.00 175.52 175.23 2ri1 n PRO 39 N -5.15 3.38 -0.23 6.66 -0.04 -1.26 -4.61 135.00 133.75 2ri1 n PRO 39 Ca 0.11 -2.23 -0.06 0.00 -0.04 0.00 0.00 63.50 61.27 2ri1 n PRO 39 Cb 0.37 -1.86 0.09 0.00 -0.04 0.00 0.00 33.50 32.05 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 3.07 1.01 -0.22 1.53 3.38 -1.60 -0.12 115.31 122.34 2ri1 h LEU 40 Ca 0.00 -0.20 -0.20 0.00 0.09 0.00 0.00 57.88 57.57 2ri1 h LEU 40 Cb 1.32 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2ri1 h LEU 40 CO 0.25 0.96 -0.92 -0.33 0.09 0.00 0.00 178.44 178.48 2ri1 h GLU 41 N 1.02 0.17 -0.55 1.13 5.08 -1.81 -2.17 114.58 117.45 2ri1 h GLU 41 Ca 0.22 -0.20 0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2ri1 h GLU 41 Cb 0.33 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 2ri1 h GLU 41 CO -0.00 0.97 0.35 1.25 -1.00 0.00 0.00 179.01 180.58 2ri1 h LEU 42 N 0.09 0.59 -0.86 1.33 5.85 -1.76 -2.16 115.31 118.38 2ri1 h LEU 42 Ca -0.05 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 2ri1 h LEU 42 Cb 1.57 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.42 2ri1 h LEU 42 CO 0.14 0.42 0.52 1.88 -0.34 0.00 0.00 178.44 181.06 2ri1 h TYR 43 N 0.71 1.13 -0.30 1.25 0.05 -0.92 -1.68 116.97 117.21 2ri1 h TYR 43 Ca 0.21 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.99 2ri1 h TYR 43 Cb -0.04 -0.37 -0.01 0.00 1.01 0.00 0.00 36.73 37.31 2ri1 h TYR 43 CO -0.05 0.76 0.19 -0.22 -1.05 0.00 0.00 178.16 177.79 2ri1 h LYS 44 N 1.18 0.41 -0.62 4.88 3.64 -1.24 -1.45 116.57 123.36 2ri1 h LYS 44 Ca 0.31 -0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.74 2ri1 h LYS 44 Cb -0.05 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 31.62 2ri1 h LYS 44 CO -0.06 0.30 0.28 1.49 -2.27 0.00 0.00 179.45 179.20 2ri1 h GLU 45 N 0.40 0.50 -0.61 1.90 4.81 -1.21 -1.25 114.58 119.11 2ri1 h GLU 45 Ca 0.11 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.32 2ri1 h GLU 45 Cb -0.01 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 2ri1 h GLU 45 CO -0.02 0.33 0.40 0.82 -0.73 0.00 0.00 179.01 179.80 2ri1 h ILE 46 N 0.51 1.13 -0.85 2.32 2.04 -1.03 -2.07 117.51 119.56 2ri1 h ILE 46 Ca 0.30 -0.28 0.02 0.00 1.00 0.00 0.00 64.86 65.91 2ri1 h ILE 46 Cb 0.31 0.26 -0.05 0.00 -0.74 0.00 0.00 36.82 36.60 2ri1 h ILE 46 CO -0.25 0.15 0.56 0.03 0.00 0.00 0.00 178.15 178.63 2ri1 h ARG 47 N 0.81 1.06 -0.01 2.37 3.08 -0.69 -1.49 114.38 119.50 2ri1 h ARG 47 Ca 0.23 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2ri1 h ARG 47 Cb -0.06 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 29.75 2ri1 h ARG 47 CO -0.06 0.70 -0.12 0.39 -1.07 0.00 0.00 179.97 179.81 2ri1 n GLU 48 N -4.43 1.24 -2.52 0.04 1.02 -0.53 -4.94 120.64 110.52 2ri1 n GLU 48 Ca 0.10 -0.70 -0.25 0.00 -0.02 0.00 0.00 57.16 56.29 2ri1 n GLU 48 Cb 0.07 -1.49 0.13 0.00 -0.02 0.00 0.00 31.44 30.14 2ri1 n GLU 48 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2ri1 s SER 49 N -2.25 4.00 0.00 1.62 1.04 -0.56 -5.01 113.70 112.54 2ri1 s SER 49 Ca 0.32 -0.40 0.20 0.00 0.48 0.00 0.00 55.95 56.54 2ri1 s SER 49 Cb 0.20 0.16 0.53 0.00 0.10 0.00 0.00 66.02 67.01 2ri1 s SER 49 CO 0.43 -2.12 1.44 0.00 0.98 0.00 0.00 173.24 173.97 2ri1 n HIS 50 N -3.03 0.55 -1.79 5.02 1.44 -1.26 -4.96 115.22 111.19 2ri1 n HIS 50 Ca 0.17 -0.27 -0.37 0.00 -2.01 0.00 0.00 57.72 55.23 2ri1 n HIS 50 Cb 0.61 0.00 0.05 0.00 0.12 0.00 0.00 29.99 30.77 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 -1.27 3.70 -0.17 2.39 1.43 -1.26 -5.02 118.68 118.48 2ri1 s LEU 51 Ca 0.36 2.67 -0.03 0.00 -1.03 0.00 0.00 54.13 56.10 2ri1 s LEU 51 Cb 0.20 -4.47 0.05 0.00 0.03 0.00 0.00 46.19 42.00 2ri1 s LEU 51 CO 0.27 -1.78 0.03 -0.62 0.23 0.00 0.00 176.35 174.48 2ri1 s ASP 52 N -1.22 2.64 -0.14 2.29 2.15 -1.26 -5.02 116.67 116.11 2ri1 s ASP 52 Ca 0.77 -0.67 0.16 0.00 0.43 0.00 0.00 52.55 53.24 2ri1 s ASP 52 Cb -0.38 -0.56 0.72 0.00 -0.30 0.00 0.00 42.92 42.40 2ri1 s ASP 52 CO 0.43 -0.28 1.63 0.49 -0.17 0.00 0.00 175.17 177.26 2ri1 n PHE 53 N 5.07 1.60 0.29 -5.34 3.72 -1.26 -4.60 117.46 116.95 2ri1 n PHE 53 Ca -0.09 -0.61 0.17 0.00 -0.05 0.00 0.00 57.45 56.88 2ri1 n PHE 53 Cb 0.48 -0.31 0.67 0.00 -0.94 0.00 0.00 39.48 39.38 2ri1 n PHE 53 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2ri1 h SER 54 N 3.93 0.00 -0.51 4.37 4.64 -1.88 -0.91 113.55 123.19 2ri1 h SER 54 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ri1 h SER 54 Cb 1.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.64 2ri1 h SER 54 CO 0.30 0.00 0.00 -0.67 -0.87 0.00 0.00 176.83 175.59 2ri1 n ASP 55 N -3.03 3.54 -4.81 4.97 2.03 -1.26 -3.44 116.55 114.56 2ri1 n ASP 55 Ca 0.01 -1.99 -0.22 0.00 0.52 0.00 0.00 54.79 53.11 2ri1 n ASP 55 Cb 0.30 -0.33 -0.05 0.00 -0.72 0.00 0.00 41.12 40.32 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 -1.33 2.73 -0.01 -0.67 -1.94 -0.37 -4.83 119.30 112.88 2ri1 s MET 56 Ca 0.42 -1.23 0.08 0.00 -1.71 0.00 0.00 55.69 53.25 2ri1 s MET 56 Cb 0.23 -2.45 -0.02 0.00 2.01 0.00 0.00 34.83 34.60 2ri1 s MET 56 CO 0.32 0.26 -0.26 0.08 -0.01 0.00 0.00 175.02 175.40 2ri1 s VAL 57 N -2.25 2.06 0.13 -6.03 1.01 0.02 -0.24 120.40 115.11 2ri1 s VAL 57 Ca 0.36 -1.16 0.09 0.00 0.00 0.00 0.00 61.98 61.28 2ri1 s VAL 57 Cb -0.06 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 2ri1 s VAL 57 CO 0.25 0.54 -0.19 -0.94 0.00 0.00 0.00 175.10 174.75 2ri1 s SER 58 N -0.72 3.78 -0.06 3.32 1.04 -0.65 -0.79 113.70 119.62 2ri1 s SER 58 Ca 0.10 -0.62 0.00 0.00 0.48 0.00 0.00 55.95 55.92 2ri1 s SER 58 Cb -0.10 -0.48 0.02 0.00 0.10 0.00 0.00 66.02 65.56 2ri1 s SER 58 CO -0.00 0.17 -0.05 -0.63 0.98 0.00 0.00 173.24 173.70 2ri1 s ILE 59 N -1.20 0.67 0.19 -1.02 1.01 0.51 -0.83 121.20 120.53 2ri1 s ILE 59 Ca 0.18 -0.15 -0.01 0.00 0.00 0.00 0.00 60.65 60.67 2ri1 s ILE 59 Cb -0.10 -0.70 -0.04 0.00 0.01 0.00 0.00 42.46 41.62 2ri1 s ILE 59 CO 0.10 0.27 0.38 0.20 0.00 0.00 0.00 174.94 175.89 2ri1 s ASN 60 N 1.23 6.39 0.24 3.58 -0.87 -0.80 0.14 114.94 124.85 2ri1 s ASN 60 Ca -0.06 0.40 0.05 0.00 -1.57 0.00 0.00 52.86 51.67 2ri1 s ASN 60 Cb -0.14 -2.01 0.25 0.00 -0.02 0.00 0.00 41.25 39.33 2ri1 s ASN 60 CO -0.02 -0.03 1.56 -0.07 -2.57 0.00 0.00 177.10 175.97 2ri1 h LEU 61 N 2.09 0.26 -7.59 0.60 3.38 -1.91 -3.43 115.31 108.72 2ri1 h LEU 61 Ca -0.48 -0.15 -0.18 0.00 0.09 0.00 0.00 57.88 57.16 2ri1 h LEU 61 Cb 1.19 -0.08 -0.25 0.00 0.09 0.00 0.00 40.66 41.61 2ri1 h LEU 61 CO 0.69 0.81 -0.51 -1.81 0.09 0.00 0.00 178.44 177.70 2ri1 s ASP 62 N -6.90 -0.15 0.02 -0.43 1.01 -1.26 0.48 116.67 109.44 2ri1 s ASP 62 Ca -0.04 0.25 0.01 0.00 0.71 0.00 0.00 52.55 53.48 2ri1 s ASP 62 Cb 0.12 0.33 -0.01 0.00 1.01 0.00 0.00 42.92 44.37 2ri1 s ASP 62 CO 0.80 -0.12 -0.04 -0.70 0.21 0.00 0.00 175.17 175.32 2ri1 s GLU 63 N -0.17 0.31 0.19 8.23 2.56 -0.76 -4.59 118.70 124.47 2ri1 s GLU 63 Ca -0.03 -0.40 -0.31 0.00 0.00 0.00 0.00 54.97 54.24 2ri1 s GLU 63 Cb -0.02 -0.13 -0.09 0.00 2.00 0.00 0.00 34.13 35.88 2ri1 s GLU 63 CO 0.00 0.02 1.43 0.71 -0.56 0.00 0.00 175.26 176.87 2ri1 s TYR 64 N -0.78 3.13 0.17 5.30 2.02 -1.26 -0.78 117.35 125.16 2ri1 s TYR 64 Ca -0.07 0.96 -0.30 0.00 -0.37 0.00 0.00 57.07 57.29 2ri1 s TYR 64 Cb -0.06 -3.77 -0.09 0.00 -0.40 0.00 0.00 41.96 37.65 2ri1 s TYR 64 CO -0.00 -2.61 1.34 0.08 -1.57 0.00 0.00 175.55 172.79 2ri1 s VAL 65 N 0.55 3.22 0.00 0.71 1.01 -0.74 -2.88 120.40 122.27 2ri1 s VAL 65 Ca 0.63 0.96 0.00 0.00 0.00 0.00 0.00 61.98 63.56 2ri1 s VAL 65 Cb -0.40 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.37 2ri1 s VAL 65 CO 0.36 0.12 0.00 0.61 0.00 0.00 0.00 175.10 176.19 2ri1 n GLY 66 N 2.73 1.66 3.82 4.51 0.00 0.31 -4.66 105.19 113.56 2ri1 n GLY 66 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 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 4.34 0.72 0.99 1.43 -1.14 -4.86 118.68 120.16 2ri1 s LEU 67 Ca 0.00 0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 53.45 2ri1 s LEU 67 Cb 0.00 -2.16 0.02 0.00 0.03 0.00 0.00 46.19 44.08 2ri1 s LEU 67 CO 0.00 0.31 1.10 -0.94 0.23 0.00 0.00 176.35 177.05 2ri1 s SER 68 N -0.53 5.34 0.55 2.29 1.04 -1.26 -3.87 113.70 117.26 2ri1 s SER 68 Ca 0.14 1.16 0.24 0.00 0.48 0.00 0.00 55.95 57.98 2ri1 s SER 68 Cb -0.12 -1.95 1.57 0.00 0.10 0.00 0.00 66.02 65.61 2ri1 s SER 68 CO 0.03 -1.42 2.19 0.00 0.98 0.00 0.00 173.24 175.03 2ri1 h ALA 69 N -0.71 1.64 0.00 5.32 0.00 -1.98 -2.39 119.26 121.14 2ri1 h ALA 69 Ca -0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2ri1 h ALA 69 Cb 1.25 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2ri1 h ALA 69 CO 0.63 0.03 -0.19 -0.44 0.00 0.00 0.00 179.25 179.29 2ri1 h ASP 70 N 0.00 0.00 -2.46 0.00 3.32 -1.97 -3.29 116.42 112.03 2ri1 h ASP 70 Ca -0.00 -0.04 -0.53 0.00 0.02 0.00 0.00 57.03 56.48 2ri1 h ASP 70 Cb 0.06 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.65 2ri1 h ASP 70 CO 0.00 0.02 1.14 -0.67 -1.72 0.00 0.00 179.24 178.01 2ri1 n ASP 71 N -2.53 4.07 0.31 6.45 -0.08 -0.90 -4.87 116.55 119.00 2ri1 n ASP 71 Ca 0.04 0.97 0.12 0.00 -1.51 0.00 0.00 54.79 54.41 2ri1 n ASP 71 Cb 0.47 -1.54 0.65 0.00 2.34 0.00 0.00 41.12 43.05 2ri1 n ASP 71 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2ri1 h LYS 72 N 9.00 0.00 -0.02 -0.67 1.57 -1.89 -1.35 116.57 123.21 2ri1 h LYS 72 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 2ri1 h LYS 72 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 2ri1 h LYS 72 CO 0.95 0.00 -0.22 1.04 -0.57 0.00 0.00 179.45 180.65 2ri1 n GLN 73 N -2.72 1.42 -2.90 3.15 1.13 -1.26 -4.70 117.38 111.50 2ri1 n GLN 73 Ca -0.02 -1.03 -0.33 0.00 -1.94 0.00 0.00 57.00 53.68 2ri1 n GLN 73 Cb 0.45 -1.48 -0.06 0.00 0.11 0.00 0.00 30.24 29.25 2ri1 n GLN 73 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 2ri1 s SER 74 N -2.29 6.86 0.50 1.08 1.04 -0.51 -4.97 113.70 115.41 2ri1 s SER 74 Ca 0.26 1.53 0.20 0.00 0.48 0.00 0.00 55.95 58.42 2ri1 s SER 74 Cb 0.19 -2.48 1.27 0.00 0.10 0.00 0.00 66.02 65.11 2ri1 s SER 74 CO 0.45 -0.32 2.08 1.88 0.98 0.00 0.00 173.24 178.31 2ri1 h TYR 75 N 1.95 0.00 -0.90 5.02 0.05 -1.88 -2.04 116.97 119.17 2ri1 h TYR 75 Ca -0.48 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.31 2ri1 h TYR 75 Cb 1.18 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.87 2ri1 h TYR 75 CO 0.62 0.11 0.60 0.00 -1.05 0.00 0.00 178.16 178.43 2ri1 h ALA 76 N 1.89 1.37 0.07 3.88 0.00 -1.88 -1.59 119.26 123.01 2ri1 h ALA 76 Ca -0.00 -0.06 -0.21 0.00 0.00 0.00 0.00 54.91 54.64 2ri1 h ALA 76 Cb 0.21 -0.36 0.02 0.00 0.00 0.00 0.00 17.79 17.66 2ri1 h ALA 76 CO 0.01 0.57 -0.88 -0.92 0.00 0.00 0.00 179.25 178.04 2ri1 h TYR 77 N 1.20 0.75 -0.60 0.00 3.20 -1.55 -1.35 116.97 118.63 2ri1 h TYR 77 Ca 0.34 -0.46 0.12 0.00 3.14 0.00 0.00 58.73 61.87 2ri1 h TYR 77 Cb -0.11 -0.06 -0.11 0.00 1.54 0.00 0.00 36.73 37.99 2ri1 h TYR 77 CO -0.00 1.31 -0.17 0.35 -1.64 0.00 0.00 178.16 178.01 2ri1 h PHE 78 N -0.02 -0.37 -0.29 -3.82 3.57 -1.32 -0.06 116.94 114.62 2ri1 h PHE 78 Ca -0.13 0.06 -0.09 0.00 3.53 0.00 0.00 57.97 61.34 2ri1 h PHE 78 Cb 1.60 0.26 -0.02 0.00 2.79 0.00 0.00 35.95 40.58 2ri1 h PHE 78 CO 0.15 -0.27 -0.18 0.52 -2.23 0.00 0.00 178.31 176.29 2ri1 h MET 79 N -0.02 0.52 -0.27 1.11 2.86 -1.15 -1.68 114.93 116.30 2ri1 h MET 79 Ca 0.29 -0.17 -0.02 0.00 -2.06 0.00 0.00 59.70 57.73 2ri1 h MET 79 Cb 0.45 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 2ri1 h MET 79 CO -0.63 0.69 0.10 -0.22 1.06 0.00 0.00 176.91 177.91 2ri1 h LYS 80 N 0.47 0.41 -0.74 1.72 3.64 -0.44 0.12 116.57 121.75 2ri1 h LYS 80 Ca 0.08 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 2ri1 h LYS 80 Cb 0.59 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.31 2ri1 h LYS 80 CO 0.04 0.46 0.29 1.96 -2.27 0.00 0.00 179.45 179.93 2ri1 h GLN 81 N 0.28 1.10 0.00 1.90 1.08 -0.87 -0.88 115.11 117.73 2ri1 h GLN 81 Ca 0.09 -0.19 0.00 0.00 -1.45 0.00 0.00 58.65 57.10 2ri1 h GLN 81 Cb 0.21 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 2ri1 h GLN 81 CO -0.01 0.89 -1.70 0.09 -0.95 0.00 0.00 178.83 177.16 2ri1 n ASN 82 N -4.29 0.30 0.12 1.46 3.02 -0.65 -4.88 115.26 110.34 2ri1 n ASN 82 Ca 0.07 -0.29 0.00 0.00 -0.03 0.00 0.00 54.58 54.33 2ri1 n ASN 82 Cb 0.18 1.69 0.00 0.00 -0.61 0.00 0.00 39.78 41.05 2ri1 n ASN 82 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 2ri1 n LEU 83 N -2.04 -1.01 -0.02 3.41 7.94 0.31 -4.58 117.00 121.01 2ri1 n LEU 83 Ca -0.02 0.42 0.00 0.00 -1.11 0.00 0.00 56.01 55.30 2ri1 n LEU 83 Cb 0.50 1.10 0.30 0.00 0.53 0.00 0.00 43.42 45.85 2ri1 n LEU 83 CO 0.45 -0.45 0.98 -0.26 -1.11 0.00 0.00 177.39 177.00 2ri1 h PHE 84 N 0.00 0.58 -0.30 1.96 0.04 -1.17 0.53 116.94 118.58 2ri1 h PHE 84 Ca 0.00 -0.04 0.02 0.00 2.80 0.00 0.00 57.97 60.75 2ri1 h PHE 84 Cb 0.00 -0.17 -0.03 0.00 2.20 0.00 0.00 35.95 37.95 2ri1 h PHE 84 CO 0.00 0.53 0.14 0.00 -0.60 0.00 0.00 178.31 178.38 2ri1 h ALA 85 N 1.52 0.36 0.06 2.45 0.00 -1.41 -2.43 119.26 119.81 2ri1 h ALA 85 Ca 0.13 0.01 -0.27 0.00 0.00 0.00 0.00 54.91 54.78 2ri1 h ALA 85 Cb 0.26 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.02 2ri1 h ALA 85 CO 0.00 -0.24 -1.12 0.00 0.00 0.00 0.00 179.25 177.89 2ri1 h ALA 86 N 1.16 0.13 -2.13 0.00 0.00 -1.76 -3.41 119.26 113.25 2ri1 h ALA 86 Ca 0.12 -0.75 -0.57 0.00 0.00 0.00 0.00 54.91 53.71 2ri1 h ALA 86 Cb 0.05 0.06 -0.39 0.00 0.00 0.00 0.00 17.79 17.50 2ri1 h ALA 86 CO -0.09 0.75 -0.98 1.63 0.00 0.00 0.00 179.25 180.55 2ri1 n LYS 87 N -3.77 0.98 -1.72 0.00 4.76 0.16 -5.04 118.16 113.53 2ri1 n LYS 87 Ca -0.11 -3.50 -0.35 0.00 -2.87 0.00 0.00 58.31 51.48 2ri1 n LYS 87 Cb 0.93 -1.49 0.06 0.00 -1.84 0.00 0.00 35.03 32.68 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 -1.23 2.59 0.51 1.97 0.04 -0.92 -4.40 135.00 133.56 2ri1 s PRO 88 Ca 0.35 1.72 0.01 0.00 0.04 0.00 0.00 61.00 63.12 2ri1 s PRO 88 Cb 0.14 -1.89 0.02 0.00 0.04 0.00 0.00 34.50 32.81 2ri1 s PRO 88 CO -0.11 -1.48 0.73 -0.06 0.04 0.00 0.00 177.00 176.12 2ri1 s PHE 89 N -1.89 2.98 0.22 0.56 0.08 -1.26 -3.60 117.98 115.07 2ri1 s PHE 89 Ca 0.74 0.06 -0.09 0.00 0.12 0.00 0.00 56.93 57.76 2ri1 s PHE 89 Cb -0.28 -2.59 0.32 0.00 -0.57 0.00 0.00 43.02 39.91 2ri1 s PHE 89 CO 0.40 -0.68 1.72 -0.22 -0.10 0.00 0.00 175.22 176.34 2ri1 h LYS 90 N 0.21 0.34 -2.35 0.44 3.64 -0.28 -3.43 116.57 115.13 2ri1 h LYS 90 Ca -0.43 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 58.87 2ri1 h LYS 90 Cb 1.28 -0.08 -0.24 0.00 -0.41 0.00 0.00 32.23 32.78 2ri1 h LYS 90 CO 0.54 0.22 -0.16 0.21 -2.27 0.00 0.00 179.45 177.99 2ri1 s LYS 91 N -6.08 0.53 -0.22 1.90 2.47 -1.18 -5.04 119.74 112.11 2ri1 s LYS 91 Ca -0.13 1.00 -0.01 0.00 -1.56 0.00 0.00 55.97 55.28 2ri1 s LYS 91 Cb 0.18 0.09 0.02 0.00 -1.46 0.00 0.00 37.83 36.66 2ri1 s LYS 91 CO 0.75 -0.16 -0.11 -1.12 0.16 0.00 0.00 175.35 174.86 2ri1 s SER 92 N 1.60 3.89 -0.09 1.43 0.01 -1.26 -1.63 113.70 117.65 2ri1 s SER 92 Ca -0.09 -0.74 -0.13 0.00 1.31 0.00 0.00 55.95 56.29 2ri1 s SER 92 Cb -0.07 -1.60 -0.05 0.00 0.21 0.00 0.00 66.02 64.51 2ri1 s SER 92 CO -0.16 -0.07 0.33 -0.31 0.41 0.00 0.00 173.24 173.44 2ri1 s TYR 93 N 1.32 3.59 0.08 2.43 2.02 -0.01 -4.96 117.35 121.83 2ri1 s TYR 93 Ca 0.02 0.76 0.03 0.00 -0.37 0.00 0.00 57.07 57.51 2ri1 s TYR 93 Cb -0.15 -2.27 -0.04 0.00 -0.40 0.00 0.00 41.96 39.10 2ri1 s TYR 93 CO -0.07 0.47 -0.08 -0.51 -1.57 0.00 0.00 175.55 173.79 2ri1 s LEU 94 N -0.37 2.41 0.46 -1.29 1.02 -1.26 -1.91 118.68 117.73 2ri1 s LEU 94 Ca 0.20 -0.82 -0.23 0.00 0.02 0.00 0.00 54.13 53.30 2ri1 s LEU 94 Cb -0.14 -0.19 -0.10 0.00 0.02 0.00 0.00 46.19 45.77 2ri1 s LEU 94 CO 0.08 -0.32 0.92 -2.65 0.02 0.00 0.00 176.35 174.41 2ri1 n PRO 95 N 0.57 1.15 -2.63 1.29 -0.02 -1.26 -4.93 135.00 129.16 2ri1 n PRO 95 Ca -0.16 0.42 -0.42 0.00 -2.02 0.00 0.00 63.50 61.31 2ri1 n PRO 95 Cb 0.58 -1.98 -0.03 0.00 -0.02 0.00 0.00 33.50 32.05 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 -0.86 6.32 0.49 2.55 2.47 -1.26 -4.71 114.94 119.94 2ri1 s ASN 96 Ca 0.65 -0.21 0.31 0.00 0.42 0.00 0.00 52.86 54.04 2ri1 s ASN 96 Cb -0.53 -2.53 1.22 0.00 -1.45 0.00 0.00 41.25 37.96 2ri1 s ASN 96 CO 0.55 -1.55 1.91 1.23 -3.72 0.00 0.00 177.10 175.52 2ri1 h GLY 97 N 12.07 0.00 -1.18 1.21 0.00 -1.76 -2.41 103.07 111.00 2ri1 h GLY 97 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 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 -2.93 1.80 -4.66 3.11 4.77 -1.25 -0.53 117.00 117.32 2ri1 n LEU 98 Ca 0.01 -0.88 -0.47 0.00 -0.03 0.00 0.00 56.01 54.64 2ri1 n LEU 98 Cb 0.31 -0.21 -0.04 0.00 -2.33 0.00 0.00 43.42 41.15 2ri1 n LEU 98 CO 0.26 0.44 1.16 0.00 -1.33 0.00 0.00 177.39 177.93 2ri1 n ALA 99 N 0.47 0.96 -0.26 -1.18 0.00 -0.91 -4.90 120.51 114.68 2ri1 n ALA 99 Ca 0.12 0.45 -0.06 0.00 0.00 0.00 0.00 53.44 53.95 2ri1 n ALA 99 Cb 0.30 -2.31 0.05 0.00 0.00 0.00 0.00 19.45 17.49 2ri1 n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ri1 h ALA 100 N 5.87 0.93 -3.64 0.00 0.00 -1.94 -3.39 119.26 117.10 2ri1 h ALA 100 Ca -0.46 -0.14 -0.67 0.00 0.00 0.00 0.00 54.91 53.65 2ri1 h ALA 100 Cb 1.27 -0.29 -0.39 0.00 0.00 0.00 0.00 17.79 18.39 2ri1 h ALA 100 CO 0.87 0.48 -0.71 0.34 0.00 0.00 0.00 179.25 180.24 2ri1 s ASP 101 N -6.12 4.80 0.31 0.00 -1.08 -1.26 -4.99 116.67 108.33 2ri1 s ASP 101 Ca -0.13 -2.02 0.02 0.00 -0.52 0.00 0.00 52.55 49.90 2ri1 s ASP 101 Cb 0.14 -1.65 0.58 0.00 -1.46 0.00 0.00 42.92 40.53 2ri1 s ASP 101 CO 0.81 -0.37 1.89 -0.07 0.52 0.00 0.00 175.17 177.95 2ri1 h LEU 102 N 7.70 0.87 -1.26 -1.34 3.38 -1.98 -1.27 115.31 121.41 2ri1 h LEU 102 Ca -0.08 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 2ri1 h LEU 102 Cb 1.03 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2ri1 h LEU 102 CO 0.54 0.53 -0.32 0.00 0.09 0.00 0.00 178.44 179.27 2ri1 h ALA 103 N 1.53 1.39 -0.06 1.53 0.00 -1.97 -2.45 119.26 119.23 2ri1 h ALA 103 Ca 0.41 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 2ri1 h ALA 103 Cb 0.32 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2ri1 h ALA 103 CO -0.17 0.45 -0.49 0.87 0.00 0.00 0.00 179.25 179.90 2ri1 h LYS 104 N 0.07 0.16 0.06 0.00 1.57 -1.67 -2.68 116.57 114.08 2ri1 h LYS 104 Ca 0.01 -0.09 -0.25 0.00 -1.87 0.00 0.00 60.65 58.46 2ri1 h LYS 104 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 2ri1 h LYS 104 CO 0.04 0.62 -1.07 1.49 -0.57 0.00 0.00 179.45 179.96 2ri1 h GLU 105 N 0.13 0.33 -0.44 3.15 4.57 -1.13 -1.00 114.58 120.18 2ri1 h GLU 105 Ca 0.00 -0.44 -0.06 0.00 -1.18 0.00 0.00 59.36 57.69 2ri1 h GLU 105 Cb 0.92 0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.64 2ri1 h GLU 105 CO 0.07 1.15 0.05 1.15 -1.18 0.00 0.00 179.01 180.25 2ri1 h THR 106 N 0.15 1.25 -0.37 0.32 2.02 -1.49 -0.72 112.91 114.07 2ri1 h THR 106 Ca -0.10 -0.93 -0.08 0.00 0.77 0.00 0.00 66.41 66.07 2ri1 h THR 106 Cb 1.75 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 69.15 2ri1 h THR 106 CO 0.18 0.32 -0.08 -0.08 0.37 0.00 0.00 175.52 176.23 2ri1 h GLU 107 N 0.60 0.71 -0.63 6.66 4.57 -1.46 -2.72 114.58 122.30 2ri1 h GLU 107 Ca 0.13 -0.27 0.05 0.00 -1.18 0.00 0.00 59.36 58.09 2ri1 h GLU 107 Cb 0.41 -0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.91 2ri1 h GLU 107 CO 0.01 0.86 0.35 -0.92 -1.18 0.00 0.00 179.01 178.13 2ri1 h TYR 108 N 0.51 0.65 -0.36 0.92 3.20 -0.96 -2.19 116.97 118.74 2ri1 h TYR 108 Ca 0.09 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.87 2ri1 h TYR 108 Cb 0.59 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.64 2ri1 h TYR 108 CO 0.05 0.33 -0.26 -0.92 -1.64 0.00 0.00 178.16 175.72 2ri1 h TYR 109 N 0.67 0.84 -0.54 -3.82 3.20 -1.07 -0.96 116.97 115.29 2ri1 h TYR 109 Ca 0.27 -0.20 0.02 0.00 3.14 0.00 0.00 58.73 61.96 2ri1 h TYR 109 Cb 0.13 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.17 2ri1 h TYR 109 CO -0.08 0.92 0.33 -0.44 -1.64 0.00 0.00 178.16 177.25 2ri1 h ASP 110 N 0.64 0.55 -0.80 -2.11 3.32 -1.31 -1.29 116.42 115.41 2ri1 h ASP 110 Ca 0.08 -0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 2ri1 h ASP 110 Cb 0.76 -0.12 -0.04 0.00 0.22 0.00 0.00 39.33 40.15 2ri1 h ASP 110 CO 0.06 0.39 0.44 -0.61 -1.72 0.00 0.00 179.24 177.80 2ri1 h GLN 111 N 0.67 1.13 -0.49 3.56 -0.00 -0.93 -2.06 115.11 116.99 2ri1 h GLN 111 Ca 0.21 -0.13 -0.12 0.00 -0.00 0.00 0.00 58.65 58.62 2ri1 h GLN 111 Cb -0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 27.48 27.24 2ri1 h GLN 111 CO -0.08 0.83 -0.15 0.82 0.00 0.00 0.00 178.83 180.25 2ri1 h ILE 112 N 1.14 1.27 -0.67 2.39 1.08 -0.83 -0.95 117.51 120.93 2ri1 h ILE 112 Ca 0.29 -1.30 0.10 0.00 -0.39 0.00 0.00 64.86 63.56 2ri1 h ILE 112 Cb 0.04 1.08 -0.04 0.00 -3.07 0.00 0.00 36.82 34.82 2ri1 h ILE 112 CO -0.05 0.45 0.45 -0.07 -0.69 0.00 0.00 178.15 178.24 2ri1 h LEU 113 N 0.83 0.48 -0.29 1.44 3.38 -1.07 0.26 115.31 120.33 2ri1 h LEU 113 Ca 0.12 0.01 -0.20 0.00 0.09 0.00 0.00 57.88 57.91 2ri1 h LEU 113 Cb 0.71 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2ri1 h LEU 113 CO 0.05 0.29 -0.87 0.00 0.09 0.00 0.00 178.44 178.00 2ri1 h ALA 114 N 1.66 0.52 0.03 1.53 0.00 -0.99 -2.90 119.26 119.11 2ri1 h ALA 114 Ca 0.31 -0.71 -0.25 0.00 0.00 0.00 0.00 54.91 54.26 2ri1 h ALA 114 Cb 0.50 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2ri1 h ALA 114 CO -0.10 0.90 -1.27 0.37 0.00 0.00 0.00 179.25 179.15 2ri1 h GLN 115 N 0.12 0.06 -2.48 0.00 4.15 -0.63 -3.38 115.11 112.95 2ri1 h GLN 115 Ca -0.04 -0.10 -0.60 0.00 0.77 0.00 0.00 58.65 58.68 2ri1 h GLN 115 Cb 1.49 0.04 -0.40 0.00 0.21 0.00 0.00 27.48 28.81 2ri1 h GLN 115 CO 0.13 0.91 -0.79 0.66 -1.93 0.00 0.00 178.83 177.82 2ri1 n TYR 116 N -3.31 1.56 -1.87 3.99 4.01 0.86 -5.07 117.16 117.33 2ri1 n TYR 116 Ca -0.07 -3.87 -0.40 0.00 -0.16 0.00 0.00 57.90 53.40 2ri1 n TYR 116 Cb 0.99 -0.32 0.01 0.00 -0.31 0.00 0.00 39.34 39.70 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 -1.25 3.81 -0.08 -0.72 0.02 -1.10 -4.64 135.00 131.05 2ri1 s PRO 117 Ca 0.32 2.37 -0.30 0.00 0.02 0.00 0.00 61.00 63.42 2ri1 s PRO 117 Cb 0.06 -2.72 -0.02 0.00 0.02 0.00 0.00 34.50 31.84 2ri1 s PRO 117 CO -0.13 -0.69 1.06 0.42 -0.33 0.00 0.00 177.00 177.33 2ri1 s ILE 118 N -1.21 4.63 -0.10 2.83 1.01 -1.26 -4.64 121.20 122.45 2ri1 s ILE 118 Ca 0.59 1.91 -0.27 0.00 0.00 0.00 0.00 60.65 62.87 2ri1 s ILE 118 Cb -0.43 -4.23 -0.25 0.00 0.01 0.00 0.00 42.46 37.57 2ri1 s ILE 118 CO 0.55 0.01 0.90 0.44 0.00 0.00 0.00 174.94 176.84 2ri1 h ASP 119 N 7.17 0.05 -3.35 3.58 3.32 -1.01 -1.32 116.42 124.87 2ri1 h ASP 119 Ca -0.33 -0.88 -0.42 0.00 0.02 0.00 0.00 57.03 55.43 2ri1 h ASP 119 Cb 1.16 -0.02 -0.36 0.00 0.22 0.00 0.00 39.33 40.33 2ri1 h ASP 119 CO 0.85 0.93 -0.77 -0.22 -1.72 0.00 0.00 179.24 178.32 2ri1 s LEU 120 N -8.41 0.89 -0.20 1.55 2.96 -1.14 -1.91 118.68 112.42 2ri1 s LEU 120 Ca -0.18 -0.09 -0.06 0.00 -0.22 0.00 0.00 54.13 53.58 2ri1 s LEU 120 Cb -0.02 -0.42 -0.03 0.00 0.50 0.00 0.00 46.19 46.23 2ri1 s LEU 120 CO 0.70 -0.14 0.03 -1.58 -1.32 0.00 0.00 176.35 174.04 2ri1 s GLN 121 N 1.53 3.74 -0.08 1.98 2.00 -0.03 -0.18 119.66 128.63 2ri1 s GLN 121 Ca -0.02 -0.46 -0.21 0.00 -2.00 0.00 0.00 55.36 52.67 2ri1 s GLN 121 Cb -0.13 -3.14 -0.04 0.00 0.80 0.00 0.00 33.01 30.50 2ri1 s GLN 121 CO -0.03 0.08 0.61 0.42 -0.50 0.00 0.00 175.29 175.87 2ri1 s ILE 122 N 0.84 5.09 0.04 -2.34 -1.09 -0.33 -0.91 121.20 122.50 2ri1 s ILE 122 Ca 0.02 1.24 0.04 0.00 -2.23 0.00 0.00 60.65 59.72 2ri1 s ILE 122 Cb -0.14 -3.95 -0.02 0.00 -1.58 0.00 0.00 42.46 36.77 2ri1 s ILE 122 CO 0.02 0.30 -0.11 -0.76 -1.23 0.00 0.00 174.94 173.15 2ri1 s LEU 123 N 0.64 2.18 0.54 2.97 1.02 -0.39 -3.51 118.68 122.13 2ri1 s LEU 123 Ca 0.33 -0.44 0.09 0.00 0.02 0.00 0.00 54.13 54.12 2ri1 s LEU 123 Cb -0.17 -0.44 0.07 0.00 0.02 0.00 0.00 46.19 45.66 2ri1 s LEU 123 CO 0.15 -0.03 0.70 -0.83 0.02 0.00 0.00 176.35 176.36 2ri1 s GLY 124 N -1.16 1.85 0.01 -3.19 0.00 -1.26 -1.09 107.32 102.48 2ri1 s GLY 124 Ca -0.01 -1.96 0.08 0.00 0.00 0.00 0.00 44.72 42.82 2ri1 s GLY 124 CO 0.01 -1.69 -0.23 -1.50 0.00 0.00 0.00 173.10 169.70 2ri1 s ILE 125 N -2.62 1.82 0.75 0.90 2.07 -1.25 -4.67 121.20 118.21 2ri1 s ILE 125 Ca 0.57 -1.12 -0.11 0.00 -1.41 0.00 0.00 60.65 58.58 2ri1 s ILE 125 Cb -0.06 -1.54 0.04 0.00 0.13 0.00 0.00 42.46 41.03 2ri1 s ILE 125 CO 0.36 0.39 1.10 -0.83 -1.91 0.00 0.00 174.94 174.05 2ri1 s GLY 126 N -0.86 1.63 0.27 1.50 0.00 0.64 -4.95 107.32 105.55 2ri1 s GLY 126 Ca 0.09 -0.28 -0.02 0.00 0.00 0.00 0.00 44.72 44.51 2ri1 s GLY 126 CO 0.00 0.12 1.79 3.21 0.00 0.00 0.00 173.10 178.23 2ri1 h ARG 127 N -0.88 0.83 -0.85 2.90 3.08 -1.88 -1.66 114.38 115.92 2ri1 h ARG 127 Ca -0.46 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 59.35 2ri1 h ARG 127 Cb 1.26 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 31.17 2ri1 h ARG 127 CO 0.62 0.78 0.06 0.27 -1.07 0.00 0.00 179.97 180.63 2ri1 n ASN 128 N -4.25 3.16 -0.30 7.04 6.94 -1.26 -4.19 115.26 122.41 2ri1 n ASN 128 Ca 0.03 -2.48 -0.04 0.00 -0.02 0.00 0.00 54.58 52.08 2ri1 n ASN 128 Cb 0.26 -0.60 -0.02 0.00 -2.36 0.00 0.00 39.78 37.06 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 0.17 -0.06 -1.70 -2.53 0.00 -0.62 -4.73 120.51 111.04 2ri1 n ALA 129 Ca 0.15 0.06 -0.36 0.00 0.00 0.00 0.00 53.44 53.30 2ri1 n ALA 129 Cb 0.75 -0.96 0.05 0.00 0.00 0.00 0.00 19.45 19.29 2ri1 n ALA 129 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 2ri1 s HIS 130 N -1.82 2.22 -0.13 0.00 -3.43 -1.26 -2.38 115.29 108.48 2ri1 s HIS 130 Ca 0.00 1.51 -0.01 0.00 -0.80 0.00 0.00 55.06 55.76 2ri1 s HIS 130 Cb 0.00 -3.57 0.03 0.00 -1.43 0.00 0.00 32.58 27.61 2ri1 s HIS 130 CO 0.00 -2.56 -0.06 0.42 -2.00 0.00 0.00 174.74 170.54 2ri1 s ILE 131 N -1.55 1.00 0.00 -5.38 -1.09 -0.95 -0.26 121.20 112.98 2ri1 s ILE 131 Ca 0.79 -0.41 0.00 0.00 -2.23 0.00 0.00 60.65 58.81 2ri1 s ILE 131 Cb -0.33 -1.11 0.00 0.00 -1.58 0.00 0.00 42.46 39.44 2ri1 s ILE 131 CO 0.37 0.25 0.00 0.61 -1.23 0.00 0.00 174.94 174.94 2ri1 n GLY 132 N 4.93 2.96 1.98 6.18 0.00 -1.26 -1.05 105.19 118.93 2ri1 n GLY 132 Ca -0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 46.02 45.64 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 13.65 2.34 -3.34 1.61 3.72 -1.26 -4.95 117.46 129.23 2ri1 n PHE 133 Ca 0.00 -1.03 -0.41 0.00 -0.05 0.00 0.00 57.45 55.96 2ri1 n PHE 133 Cb 0.00 -0.63 -0.09 0.00 -0.94 0.00 0.00 39.48 37.82 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 -0.91 6.22 0.36 4.37 0.01 -0.22 -5.00 114.94 119.78 2ri1 s ASN 134 Ca 0.55 -0.23 0.03 0.00 -0.71 0.00 0.00 52.86 52.50 2ri1 s ASN 134 Cb 0.43 -2.22 -0.01 0.00 0.41 0.00 0.00 41.25 39.85 2ri1 s ASN 134 CO 0.14 -0.42 0.53 -1.61 -1.51 0.00 0.00 177.10 174.24 2ri1 s GLU 135 N 2.15 3.20 0.39 -0.60 0.41 -1.26 -2.23 118.70 120.75 2ri1 s GLU 135 Ca 0.14 -0.70 -0.23 0.00 -0.41 0.00 0.00 54.97 53.77 2ri1 s GLU 135 Cb -0.16 -2.72 -0.14 0.00 -1.78 0.00 0.00 34.13 29.33 2ri1 s GLU 135 CO 0.12 0.01 0.47 -2.30 -0.49 0.00 0.00 175.26 173.08 2ri1 n PRO 136 N -1.78 0.43 -0.15 0.39 -0.02 -1.26 -1.85 135.00 130.77 2ri1 n PRO 136 Ca -0.02 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 2ri1 n PRO 136 Cb 0.57 -1.36 0.00 0.00 -0.02 0.00 0.00 33.50 32.69 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 1.90 1.58 3.73 -1.23 0.00 0.29 -4.94 105.19 106.52 2ri1 n GLY 137 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.75 3.33 0.30 2.61 2.01 -0.77 -4.96 115.64 115.40 2ri1 s THR 138 Ca 0.00 1.04 -0.30 0.00 0.31 0.00 0.00 61.69 62.74 2ri1 s THR 138 Cb 0.00 -3.67 -0.11 0.00 0.01 0.00 0.00 72.50 68.73 2ri1 s THR 138 CO 0.00 0.13 1.59 0.00 -0.69 0.00 0.00 174.62 175.65 2ri1 s ALA 139 N 0.42 3.74 -0.17 7.40 0.00 -1.26 -4.71 121.76 127.17 2ri1 s ALA 139 Ca 0.58 1.58 0.26 0.00 0.00 0.00 0.00 51.96 54.38 2ri1 s ALA 139 Cb -0.36 -3.65 1.27 0.00 0.00 0.00 0.00 23.12 20.38 2ri1 s ALA 139 CO 0.35 -0.99 1.79 0.74 0.00 0.00 0.00 175.76 177.65 2ri1 h PHE 140 N 4.72 0.00 -0.00 0.00 0.04 -1.97 -2.57 116.94 117.15 2ri1 h PHE 140 Ca -0.47 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.30 2ri1 h PHE 140 Cb 1.22 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.37 2ri1 h PHE 140 CO 0.58 0.00 -0.07 -1.13 -0.60 0.00 0.00 178.31 177.10 2ri1 n SER 141 N -2.42 0.53 -4.76 2.17 3.41 -1.26 -2.63 113.62 108.67 2ri1 n SER 141 Ca -0.00 -0.81 -0.40 0.00 -0.26 0.00 0.00 58.87 57.39 2ri1 n SER 141 Cb 0.13 -0.05 -0.04 0.00 -0.26 0.00 0.00 64.21 63.99 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 -2.30 7.19 0.00 4.04 1.04 -0.97 -4.65 113.70 118.05 2ri1 s SER 142 Ca 0.34 2.33 0.00 0.00 0.48 0.00 0.00 55.95 59.11 2ri1 s SER 142 Cb 0.21 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.70 2ri1 s SER 142 CO 0.43 -0.21 0.00 0.00 0.98 0.00 0.00 173.24 174.44 2ri1 n GLN 143 N 1.12 3.60 -1.82 4.02 6.02 -1.26 -1.78 117.38 127.28 2ri1 n GLN 143 Ca -0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.57 2ri1 n GLN 143 Cb 0.44 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.69 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 2.09 2.18 0.17 5.09 2.01 -1.26 -1.92 115.64 123.99 2ri1 s THR 144 Ca 0.00 0.15 -0.20 0.00 0.31 0.00 0.00 61.69 61.95 2ri1 s THR 144 Cb 0.00 -3.10 0.05 0.00 0.01 0.00 0.00 72.50 69.46 2ri1 s THR 144 CO 0.00 0.02 0.56 -1.38 -0.69 0.00 0.00 174.62 173.13 2ri1 s HIS 145 N 0.01 -0.37 -0.05 4.92 -3.43 0.01 -4.83 115.29 111.56 2ri1 s HIS 145 Ca 0.63 0.09 -0.30 0.00 -0.80 0.00 0.00 55.06 54.67 2ri1 s HIS 145 Cb -0.47 0.49 -0.03 0.00 -1.43 0.00 0.00 32.58 31.14 2ri1 s HIS 145 CO 0.47 -0.87 1.11 -1.17 -2.00 0.00 0.00 174.74 172.27 2ri1 s LEU 146 N -2.80 4.30 -0.11 5.38 2.96 -1.26 -1.41 118.68 125.73 2ri1 s LEU 146 Ca 0.04 1.73 0.02 0.00 -0.22 0.00 0.00 54.13 55.70 2ri1 s LEU 146 Cb -0.01 -3.56 -0.01 0.00 0.50 0.00 0.00 46.19 43.11 2ri1 s LEU 146 CO -0.09 -0.48 -0.16 -0.69 -1.32 0.00 0.00 176.35 173.61 2ri1 s VAL 147 N 1.81 2.78 -0.18 1.68 1.01 -0.09 -4.98 120.40 122.44 2ri1 s VAL 147 Ca 0.53 -0.77 -0.26 0.00 0.00 0.00 0.00 61.98 61.48 2ri1 s VAL 147 Cb -0.23 -2.13 -0.01 0.00 0.00 0.00 0.00 36.38 34.01 2ri1 s VAL 147 CO 0.23 0.54 0.89 -1.81 0.00 0.00 0.00 175.10 174.95 2ri1 s ASP 148 N 0.19 7.00 0.60 3.32 1.01 -1.26 -1.19 116.67 126.35 2ri1 s ASP 148 Ca -0.10 1.24 -0.18 0.00 0.71 0.00 0.00 52.55 54.22 2ri1 s ASP 148 Cb -0.16 -2.48 -0.03 0.00 1.01 0.00 0.00 42.92 41.26 2ri1 s ASP 148 CO 0.06 -0.47 1.17 -0.76 0.21 0.00 0.00 175.17 175.38 2ri1 s LEU 149 N 2.40 3.61 0.59 1.23 1.43 -0.13 -4.97 118.68 122.84 2ri1 s LEU 149 Ca 0.40 2.28 -0.19 0.00 -1.03 0.00 0.00 54.13 55.58 2ri1 s LEU 149 Cb -0.16 -4.59 -0.03 0.00 0.03 0.00 0.00 46.19 41.44 2ri1 s LEU 149 CO 0.11 -1.58 1.25 0.42 0.23 0.00 0.00 176.35 176.79 2ri1 s THR 150 N -1.79 2.41 0.41 5.49 -4.23 -1.26 -4.86 115.64 111.82 2ri1 s THR 150 Ca 0.74 0.27 0.14 0.00 -1.18 0.00 0.00 61.69 61.67 2ri1 s THR 150 Cb -0.27 -3.12 0.35 0.00 1.34 0.00 0.00 72.50 70.80 2ri1 s THR 150 CO 0.34 -0.04 1.91 1.55 -0.54 0.00 0.00 174.62 177.84 2ri1 h PRO 151 N 0.99 0.46 -0.77 3.99 0.13 -1.99 -1.64 132.00 133.16 2ri1 h PRO 151 Ca -0.51 -0.03 0.03 0.00 -0.87 0.00 0.00 66.00 64.62 2ri1 h PRO 151 Cb 1.31 -0.10 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 2ri1 h PRO 151 CO 0.55 0.30 0.49 0.77 -0.23 0.00 0.00 178.00 179.89 2ri1 h SER 152 N 0.47 0.82 -0.23 1.44 0.02 -1.99 -1.30 113.55 112.78 2ri1 h SER 152 Ca 0.38 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.31 2ri1 h SER 152 Cb 0.81 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.16 2ri1 h SER 152 CO -0.13 0.57 0.08 0.74 -1.14 0.00 0.00 176.83 176.95 2ri1 h THR 153 N 0.97 1.18 -0.40 -2.27 2.02 -1.75 -0.04 112.91 112.61 2ri1 h THR 153 Ca 0.30 -0.54 -0.02 0.00 0.77 0.00 0.00 66.41 66.92 2ri1 h THR 153 Cb -0.01 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.49 2ri1 h THR 153 CO -0.10 0.18 0.17 0.40 0.37 0.00 0.00 175.52 176.54 2ri1 h ILE 154 N 0.21 1.19 -0.48 3.11 2.04 -1.23 -0.14 117.51 122.22 2ri1 h ILE 154 Ca 0.08 -0.56 -0.00 0.00 1.00 0.00 0.00 64.86 65.37 2ri1 h ILE 154 Cb 0.20 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 2ri1 h ILE 154 CO -0.00 0.21 0.28 0.00 0.00 0.00 0.00 178.15 178.63 2ri1 h ALA 155 N 1.02 0.61 -0.36 1.87 0.00 -1.22 0.38 119.26 121.56 2ri1 h ALA 155 Ca 0.14 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2ri1 h ALA 155 Cb 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2ri1 h ALA 155 CO -0.01 0.10 0.23 0.00 0.00 0.00 0.00 179.25 179.57 2ri1 h ALA 156 N 1.13 0.46 0.00 0.00 0.00 -0.86 -3.12 119.26 116.87 2ri1 h ALA 156 Ca 0.17 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2ri1 h ALA 156 Cb 0.01 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 2ri1 h ALA 156 CO -0.03 -0.06 -0.12 -0.91 0.00 0.00 0.00 179.25 178.13 2ri1 h ASN 157 N 0.48 0.00 -0.52 0.00 2.35 -0.58 -3.20 115.58 114.11 2ri1 h ASN 157 Ca 0.13 0.00 0.07 0.00 -0.55 0.00 0.00 56.30 55.95 2ri1 h ASN 157 Cb -0.02 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.32 2ri1 h ASN 157 CO -0.03 0.12 0.35 0.28 -1.65 0.00 0.00 177.43 176.50 2ri1 h SER 158 N 0.00 0.36 0.00 5.81 0.02 -0.17 -2.33 113.55 117.25 2ri1 h SER 158 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ri1 h SER 158 Cb 0.95 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.42 2ri1 h SER 158 CO 0.02 0.23 0.10 0.03 -1.14 0.00 0.00 176.83 176.07 2ri1 h ARG 159 N 0.41 0.00 -0.63 3.45 2.47 -1.66 -2.66 114.38 115.75 2ri1 h ARG 159 Ca 0.23 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.95 2ri1 h ARG 159 Cb 0.39 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.71 2ri1 h ARG 159 CO -0.06 0.00 0.00 1.19 0.56 0.00 0.00 179.97 181.66 2ri1 n PHE 160 N -2.99 0.84 -4.19 3.04 3.72 -0.87 -4.92 117.46 112.09 2ri1 n PHE 160 Ca -0.03 -0.48 -0.26 0.00 -0.05 0.00 0.00 57.45 56.63 2ri1 n PHE 160 Cb 0.16 -0.01 -0.17 0.00 -0.94 0.00 0.00 39.48 38.53 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 1.46 0.21 1.38 0.40 -1.00 -4.99 117.98 114.41 2ri1 s PHE 161 Ca 0.43 -0.65 -0.11 0.00 -0.60 0.00 0.00 56.93 56.00 2ri1 s PHE 161 Cb 0.23 -1.16 0.28 0.00 0.51 0.00 0.00 43.02 42.88 2ri1 s PHE 161 CO 0.30 -0.41 1.69 0.93 0.70 0.00 0.00 175.22 178.42 2ri1 h GLU 162 N 7.65 0.19 -6.34 0.44 4.39 -1.91 -3.42 114.58 115.57 2ri1 h GLU 162 Ca -0.31 -0.01 -0.69 0.00 0.34 0.00 0.00 59.36 58.69 2ri1 h GLU 162 Cb 1.15 -0.04 -0.22 0.00 -0.10 0.00 0.00 28.75 29.54 2ri1 h GLU 162 CO 0.44 0.12 -0.76 0.21 -1.16 0.00 0.00 179.01 177.86 2ri1 s LYS 163 N -6.13 2.47 0.31 2.33 2.20 -1.26 -5.04 119.74 114.62 2ri1 s LYS 163 Ca -0.13 -0.72 0.04 0.00 -0.36 0.00 0.00 55.97 54.79 2ri1 s LYS 163 Cb 0.18 -2.38 0.50 0.00 -1.51 0.00 0.00 37.83 34.62 2ri1 s LYS 163 CO 0.74 0.61 1.77 0.00 -0.36 0.00 0.00 175.35 178.11 2ri1 h ALA 164 N 5.16 1.20 0.00 3.13 0.00 -1.94 -1.99 119.26 124.82 2ri1 h ALA 164 Ca -0.47 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.14 2ri1 h ALA 164 Cb 1.15 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2ri1 h ALA 164 CO 0.50 0.51 0.00 0.39 0.00 0.00 0.00 179.25 180.66 2ri1 n GLU 165 N -4.16 0.02 0.00 0.00 -0.58 -1.26 -2.13 120.64 112.52 2ri1 n GLU 165 Ca -0.00 0.35 0.11 0.00 -0.42 0.00 0.00 57.16 57.20 2ri1 n GLU 165 Cb 0.36 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.74 2ri1 n GLU 165 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2ri1 n ASP 166 N -1.46 2.13 -4.67 1.62 8.00 -0.75 -4.95 116.55 116.48 2ri1 n ASP 166 Ca 0.02 -1.57 -0.43 0.00 0.71 0.00 0.00 54.79 53.53 2ri1 n ASP 166 Cb 0.08 0.43 -0.02 0.00 -0.02 0.00 0.00 41.12 41.58 2ri1 n ASP 166 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2ri1 s VAL 167 N -2.41 4.68 0.19 2.53 1.01 -0.91 -5.00 120.40 120.50 2ri1 s VAL 167 Ca 0.19 1.99 -0.33 0.00 0.00 0.00 0.00 61.98 63.84 2ri1 s VAL 167 Cb 0.18 -4.28 -0.14 0.00 0.00 0.00 0.00 36.38 32.14 2ri1 s VAL 167 CO 0.54 -0.10 1.44 -2.65 0.00 0.00 0.00 175.10 174.33 2ri1 n PRO 168 N 5.80 1.92 0.00 2.72 -0.02 -1.26 -4.91 135.00 139.25 2ri1 n PRO 168 Ca 0.11 0.69 0.10 0.00 -2.02 0.00 0.00 63.50 62.38 2ri1 n PRO 168 Cb 0.47 -2.37 -0.03 0.00 -0.02 0.00 0.00 33.50 31.55 2ri1 n PRO 168 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2ri1 n LYS 169 N 2.54 1.04 -3.94 -0.52 4.76 -1.26 -4.84 118.16 115.94 2ri1 n LYS 169 Ca 0.14 -0.73 -0.09 0.00 -2.87 0.00 0.00 58.31 54.76 2ri1 n LYS 169 Cb 0.29 -1.45 -0.08 0.00 -1.84 0.00 0.00 35.03 31.95 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 -2.52 0.92 0.05 1.97 -0.21 -1.26 -0.96 119.66 117.66 2ri1 s GLN 170 Ca 0.15 -1.09 -0.02 0.00 0.02 0.00 0.00 55.36 54.42 2ri1 s GLN 170 Cb 0.17 0.33 -0.03 0.00 1.00 0.00 0.00 33.01 34.48 2ri1 s GLN 170 CO 0.62 -0.30 0.01 0.00 -2.12 0.00 0.00 175.29 173.50 2ri1 s ALA 171 N -3.92 0.32 -0.24 6.09 0.00 -0.33 -1.79 121.76 121.89 2ri1 s ALA 171 Ca 0.11 -1.02 -0.08 0.00 0.00 0.00 0.00 51.96 50.96 2ri1 s ALA 171 Cb 0.05 0.29 -0.04 0.00 0.00 0.00 0.00 23.12 23.43 2ri1 s ALA 171 CO -0.06 -0.37 0.10 0.42 0.00 0.00 0.00 175.76 175.84 2ri1 s ILE 172 N -3.64 4.69 -0.01 0.00 1.01 0.04 -0.91 121.20 122.38 2ri1 s ILE 172 Ca 0.04 -0.05 0.01 0.00 0.00 0.00 0.00 60.65 60.65 2ri1 s ILE 172 Cb 0.06 -3.19 0.01 0.00 0.01 0.00 0.00 42.46 39.35 2ri1 s ILE 172 CO -0.09 0.34 -0.02 -0.44 0.00 0.00 0.00 174.94 174.73 2ri1 s SER 173 N 1.41 0.38 0.21 3.58 0.01 -0.50 -1.83 113.70 116.95 2ri1 s SER 173 Ca 0.06 -0.04 -0.32 0.00 1.31 0.00 0.00 55.95 56.95 2ri1 s SER 173 Cb -0.15 -0.11 -0.14 0.00 0.21 0.00 0.00 66.02 65.83 2ri1 s SER 173 CO 0.05 -0.02 1.39 0.23 0.41 0.00 0.00 173.24 175.30 2ri1 n MET 174 N 3.45 1.85 -0.58 12.44 2.81 0.18 -0.81 117.12 136.45 2ri1 n MET 174 Ca -0.18 0.66 -0.01 0.00 -1.81 0.00 0.00 57.70 56.36 2ri1 n MET 174 Cb 0.56 -2.30 0.00 0.00 -0.71 0.00 0.00 33.22 30.76 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 2.34 0.51 0.26 3.03 0.00 -0.81 -4.85 105.19 105.67 2ri1 n GLY 175 Ca 0.13 -1.92 -0.13 0.00 0.00 0.00 0.00 46.02 44.11 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 0.94 -0.34 0.99 3.38 -1.75 -1.78 115.31 116.75 2ri1 h LEU 176 Ca -0.01 -0.44 -0.05 0.00 0.09 0.00 0.00 57.88 57.46 2ri1 h LEU 176 Cb 0.03 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2ri1 h LEU 176 CO 0.01 1.18 0.00 0.00 0.09 0.00 0.00 178.44 179.72 2ri1 h ALA 177 N 0.78 0.46 -0.56 1.53 0.00 -1.10 -1.12 119.26 119.25 2ri1 h ALA 177 Ca 0.07 -0.24 0.07 0.00 0.00 0.00 0.00 54.91 54.81 2ri1 h ALA 177 Cb 0.88 -0.13 -0.10 0.00 0.00 0.00 0.00 17.79 18.45 2ri1 h ALA 177 CO 0.08 0.22 -0.51 0.77 0.00 0.00 0.00 179.25 179.81 2ri1 h SER 178 N 0.41 -1.75 -0.30 0.00 0.02 -1.48 -2.90 113.55 107.56 2ri1 h SER 178 Ca 0.10 0.26 -0.04 0.00 -0.84 0.00 0.00 61.79 61.26 2ri1 h SER 178 Cb 0.45 0.76 -0.01 0.00 0.14 0.00 0.00 62.40 63.73 2ri1 h SER 178 CO 0.02 -0.35 0.03 0.40 -1.14 0.00 0.00 176.83 175.78 2ri1 h ILE 179 N -0.27 1.25 0.00 3.27 2.04 -1.23 -2.82 117.51 119.75 2ri1 h ILE 179 Ca 0.13 -0.87 0.00 0.00 1.00 0.00 0.00 64.86 65.12 2ri1 h ILE 179 Cb 0.56 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.87 2ri1 h ILE 179 CO -0.69 0.28 0.16 0.24 0.00 0.00 0.00 178.15 178.15 2ri1 h MET 180 N 0.32 0.00 0.00 2.37 2.86 -1.09 -2.55 114.93 116.84 2ri1 h MET 180 Ca 0.09 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 2ri1 h MET 180 Cb 0.39 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.05 2ri1 h MET 180 CO 0.01 0.00 0.00 0.43 1.06 0.00 0.00 176.91 178.41 2ri1 n SER 181 N -2.74 0.48 -4.76 1.22 7.64 -1.06 -4.82 113.62 109.58 2ri1 n SER 181 Ca -0.02 0.60 -0.39 0.00 1.01 0.00 0.00 58.87 60.07 2ri1 n SER 181 Cb 0.21 -0.71 0.02 0.00 -1.01 0.00 0.00 64.21 62.73 2ri1 n SER 181 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ri1 s ALA 182 N -3.19 3.10 0.32 -0.43 0.00 -0.96 -4.73 121.76 115.87 2ri1 s ALA 182 Ca 0.07 1.42 0.06 0.00 0.00 0.00 0.00 51.96 53.50 2ri1 s ALA 182 Cb 0.10 -3.58 0.55 0.00 0.00 0.00 0.00 23.12 20.19 2ri1 s ALA 182 CO 0.40 -1.24 1.79 0.87 0.00 0.00 0.00 175.76 177.58 2ri1 h LYS 183 N 2.05 0.36 -3.01 0.00 1.57 -1.31 -3.44 116.57 112.78 2ri1 h LYS 183 Ca -0.51 -0.12 -0.16 0.00 -1.87 0.00 0.00 60.65 57.99 2ri1 h LYS 183 Cb 1.28 -0.03 -0.27 0.00 0.08 0.00 0.00 32.23 33.29 2ri1 h LYS 183 CO 0.60 0.57 -0.41 1.41 -0.57 0.00 0.00 179.45 181.05 2ri1 s MET 184 N -4.53 0.30 -0.12 3.15 0.00 -0.80 -4.52 119.30 112.77 2ri1 s MET 184 Ca -0.06 0.46 0.02 0.00 0.00 0.00 0.00 55.69 56.11 2ri1 s MET 184 Cb 0.14 0.06 -0.00 0.00 0.00 0.00 0.00 34.83 35.03 2ri1 s MET 184 CO 0.77 -0.09 -0.19 0.42 0.00 0.00 0.00 175.02 175.93 2ri1 s ILE 185 N 0.58 2.48 -0.25 10.11 1.01 -0.63 -0.85 121.20 133.65 2ri1 s ILE 185 Ca -0.04 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 59.76 2ri1 s ILE 185 Cb -0.05 -2.00 0.04 0.00 0.01 0.00 0.00 42.46 40.47 2ri1 s ILE 185 CO -0.03 0.54 -0.09 -0.22 0.00 0.00 0.00 174.94 175.14 2ri1 s LEU 186 N 0.42 3.27 -0.13 2.97 2.96 -0.09 -0.15 118.68 127.94 2ri1 s LEU 186 Ca -0.14 -1.13 -0.03 0.00 -0.22 0.00 0.00 54.13 52.61 2ri1 s LEU 186 Cb -0.17 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 44.89 2ri1 s LEU 186 CO 0.06 -0.16 -0.02 -0.22 -1.32 0.00 0.00 176.35 174.69 2ri1 s LEU 187 N 1.21 3.37 -0.04 -0.68 0.20 0.09 -1.26 118.68 121.57 2ri1 s LEU 187 Ca -0.04 -0.03 0.07 0.00 0.69 0.00 0.00 54.13 54.82 2ri1 s LEU 187 Cb -0.18 -1.80 -0.02 0.00 -0.43 0.00 0.00 46.19 43.77 2ri1 s LEU 187 CO -0.05 0.25 -0.25 -0.04 -0.29 0.00 0.00 176.35 175.96 2ri1 s MET 188 N -0.10 2.31 -0.16 1.98 -1.94 -0.25 -0.64 119.30 120.51 2ri1 s MET 188 Ca 0.03 -0.91 -0.04 0.00 -1.71 0.00 0.00 55.69 53.05 2ri1 s MET 188 Cb -0.13 -2.08 0.08 0.00 2.01 0.00 0.00 34.83 34.71 2ri1 s MET 188 CO 0.02 0.47 0.27 0.00 -0.01 0.00 0.00 175.02 175.76 2ri1 s ALA 189 N -0.38 -0.54 0.06 3.03 0.00 -0.88 -3.85 121.76 119.20 2ri1 s ALA 189 Ca 0.03 0.78 0.07 0.00 0.00 0.00 0.00 51.96 52.84 2ri1 s ALA 189 Cb -0.12 -1.15 -0.03 0.00 0.00 0.00 0.00 23.12 21.82 2ri1 s ALA 189 CO 0.01 -0.83 -0.18 -0.06 0.00 0.00 0.00 175.76 174.70 2ri1 s PHE 190 N 2.41 1.57 0.00 0.00 0.08 -1.26 -2.94 117.98 117.84 2ri1 s PHE 190 Ca 0.04 -0.39 0.00 0.00 0.12 0.00 0.00 56.93 56.70 2ri1 s PHE 190 Cb -0.13 -0.91 0.00 0.00 -0.57 0.00 0.00 43.02 41.41 2ri1 s PHE 190 CO -0.10 0.10 0.00 0.41 -0.10 0.00 0.00 175.22 175.53 2ri1 n GLY 191 N 1.61 -1.23 0.38 4.36 0.00 -1.26 -4.61 105.19 104.43 2ri1 n GLY 191 Ca -0.18 -1.44 0.18 0.00 0.00 0.00 0.00 46.02 44.57 2ri1 n GLY 191 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2ri1 h GLU 192 N 0.00 0.17 0.00 1.61 4.81 -1.96 -1.07 114.58 118.14 2ri1 h GLU 192 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2ri1 h GLU 192 Cb 0.00 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.34 2ri1 h GLU 192 CO 0.00 0.11 0.03 1.05 -0.73 0.00 0.00 179.01 179.47 2ri1 h GLU 193 N 0.17 0.00 -0.01 1.92 4.11 -1.91 -2.26 114.58 116.60 2ri1 h GLU 193 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.73 2ri1 h GLU 193 Cb 0.95 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.20 2ri1 h GLU 193 CO -0.05 0.00 -0.60 1.63 0.07 0.00 0.00 179.01 180.06 2ri1 n LYS 194 N -2.84 0.90 -0.20 1.06 4.76 -0.41 -4.62 118.16 116.82 2ri1 n LYS 194 Ca -0.03 -0.74 -0.07 0.00 -2.87 0.00 0.00 58.31 54.60 2ri1 n LYS 194 Cb 0.09 -1.48 0.03 0.00 -1.84 0.00 0.00 35.03 31.82 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 3.66 0.72 -0.25 7.82 0.00 -1.51 -0.06 119.26 129.64 2ri1 h ALA 195 Ca 0.00 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 2ri1 h ALA 195 Cb 0.69 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 2ri1 h ALA 195 CO 0.00 0.22 -0.32 1.49 0.00 0.00 0.00 179.25 180.65 2ri1 h GLU 196 N 0.76 0.66 -0.48 0.00 4.81 -1.82 -2.22 114.58 116.28 2ri1 h GLU 196 Ca 0.20 -0.37 -0.06 0.00 -0.13 0.00 0.00 59.36 59.00 2ri1 h GLU 196 Cb 0.02 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 2ri1 h GLU 196 CO -0.03 0.98 0.06 0.00 -0.73 0.00 0.00 179.01 179.29 2ri1 h ALA 197 N 0.66 0.64 -0.22 2.92 0.00 -1.62 -2.64 119.26 119.00 2ri1 h ALA 197 Ca 0.03 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.76 2ri1 h ALA 197 Cb 0.89 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 2ri1 h ALA 197 CO 0.07 0.38 -0.17 0.28 0.00 0.00 0.00 179.25 179.82 2ri1 h VAL 198 N 0.67 0.53 -0.40 0.00 2.07 -1.02 -1.44 116.25 116.65 2ri1 h VAL 198 Ca 0.14 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.70 2ri1 h VAL 198 Cb 0.42 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 2ri1 h VAL 198 CO 0.01 0.00 0.20 0.00 0.02 0.00 0.00 177.57 177.80 2ri1 h ALA 199 N 0.96 0.50 -0.84 1.67 0.00 -1.32 -2.34 119.26 117.89 2ri1 h ALA 199 Ca 0.13 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2ri1 h ALA 199 Cb 0.36 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 2ri1 h ALA 199 CO -0.32 -0.16 0.56 0.00 0.00 0.00 0.00 179.25 179.32 2ri1 h ALA 200 N 1.21 1.40 -0.62 0.00 0.00 -1.39 0.94 119.26 120.82 2ri1 h ALA 200 Ca 0.17 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 2ri1 h ALA 200 Cb 0.08 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 2ri1 h ALA 200 CO -0.12 0.55 0.18 1.98 0.00 0.00 0.00 179.25 181.84 2ri1 h MET 201 N 1.14 0.96 0.11 0.00 -1.53 -0.99 -2.54 114.93 112.08 2ri1 h MET 201 Ca 0.31 -0.21 -0.27 0.00 -3.44 0.00 0.00 59.70 56.08 2ri1 h MET 201 Cb -0.13 -0.14 -0.00 0.00 -0.55 0.00 0.00 31.60 30.78 2ri1 h MET 201 CO -0.07 0.86 -1.38 0.28 0.14 0.00 0.00 176.91 176.75 2ri1 h VAL 202 N 0.88 1.05 0.00 -5.77 2.07 -1.13 -3.40 116.25 109.95 2ri1 h VAL 202 Ca 0.20 -2.40 -0.13 0.00 0.82 0.00 0.00 66.70 65.19 2ri1 h VAL 202 Cb 0.31 2.72 -0.03 0.00 -1.52 0.00 0.00 31.29 32.78 2ri1 h VAL 202 CO -0.00 0.70 -1.86 0.29 0.02 0.00 0.00 177.57 176.71 2ri1 n LYS 203 N -3.94 1.04 -1.50 1.57 5.02 0.32 -5.01 118.16 115.66 2ri1 n LYS 203 Ca -0.25 -0.08 -0.29 0.00 -2.02 0.00 0.00 58.31 55.67 2ri1 n LYS 203 Cb 0.89 -1.37 0.18 0.00 -0.02 0.00 0.00 35.03 34.71 2ri1 n LYS 203 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2ri1 s GLY 204 N -4.30 1.63 0.90 0.72 0.00 -0.96 -5.00 107.32 100.31 2ri1 s GLY 204 Ca -0.06 -0.82 -0.11 0.00 0.00 0.00 0.00 44.72 43.72 2ri1 s GLY 204 CO 0.63 -0.11 1.09 2.56 0.00 0.00 0.00 173.10 177.27 2ri1 s PRO 205 N -5.47 1.23 -0.59 2.90 0.04 -1.26 -4.93 135.00 126.92 2ri1 s PRO 205 Ca 0.69 1.00 -0.28 0.00 0.04 0.00 0.00 61.00 62.45 2ri1 s PRO 205 Cb -0.11 -1.79 0.03 0.00 0.04 0.00 0.00 34.50 32.68 2ri1 s PRO 205 CO 0.54 -2.31 1.16 0.08 0.04 0.00 0.00 177.00 176.51 2ri1 s VAL 206 N -2.84 4.05 -0.01 -0.36 1.01 -1.26 -4.87 120.40 116.12 2ri1 s VAL 206 Ca 0.64 0.77 -0.04 0.00 0.00 0.00 0.00 61.98 63.36 2ri1 s VAL 206 Cb -0.19 -4.71 0.00 0.00 0.00 0.00 0.00 36.38 31.47 2ri1 s VAL 206 CO 0.58 -1.35 0.08 -0.89 0.00 0.00 0.00 175.10 173.52 2ri1 s THR 207 N 4.86 0.05 -0.34 3.92 2.01 -1.26 -5.03 115.64 119.84 2ri1 s THR 207 Ca 0.40 -0.40 0.19 0.00 0.31 0.00 0.00 61.69 62.20 2ri1 s THR 207 Cb -0.08 -0.24 0.19 0.00 0.01 0.00 0.00 72.50 72.37 2ri1 s THR 207 CO 0.24 -0.22 1.58 -0.62 -0.69 0.00 0.00 174.62 174.91 2ri1 n GLU 208 N 2.27 0.13 0.26 4.92 4.71 -1.26 -1.77 120.64 129.90 2ri1 n GLU 208 Ca -0.18 0.59 0.13 0.00 -0.01 0.00 0.00 57.16 57.70 2ri1 n GLU 208 Cb 0.57 -1.89 0.71 0.00 -1.01 0.00 0.00 31.44 29.83 2ri1 n GLU 208 CO 0.00 0.00 0.00 0.93 0.09 0.00 0.00 177.13 178.15 2ri1 h GLU 209 N 0.00 0.00 -3.54 3.49 4.39 -1.92 0.84 114.58 117.85 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 0.04 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 28.29 2ri1 h GLU 209 CO 0.00 0.12 -0.73 0.42 -1.16 0.00 0.00 179.01 177.66 2ri1 s ILE 210 N -4.09 1.56 0.30 3.13 -1.09 -0.73 -4.53 121.20 115.76 2ri1 s ILE 210 Ca -0.02 -2.26 0.04 0.00 -2.23 0.00 0.00 60.65 56.18 2ri1 s ILE 210 Cb 0.12 -2.13 0.29 0.00 -1.58 0.00 0.00 42.46 39.17 2ri1 s ILE 210 CO 0.58 -0.76 1.83 -0.65 -1.23 0.00 0.00 174.94 174.71 2ri1 h PRO 211 N 7.29 0.87 0.00 2.79 0.11 -1.71 -2.23 132.00 139.12 2ri1 h PRO 211 Ca -0.06 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.99 2ri1 h PRO 211 Cb 0.97 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.88 2ri1 h PRO 211 CO 0.51 0.57 0.00 0.00 -0.21 0.00 0.00 178.00 178.88 2ri1 h ALA 212 N 1.57 1.00 0.00 -0.75 0.00 -1.80 -3.11 119.26 116.17 2ri1 h ALA 212 Ca 0.51 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.41 2ri1 h ALA 212 Cb 0.63 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2ri1 h ALA 212 CO -0.28 0.00 -0.03 0.66 0.00 0.00 0.00 179.25 179.59 2ri1 h SER 213 N 0.00 0.00 0.24 0.00 4.64 -1.61 -1.72 113.55 115.11 2ri1 h SER 213 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2ri1 h SER 213 Cb 0.32 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2ri1 h SER 213 CO 0.00 0.03 -0.06 -0.29 -0.87 0.00 0.00 176.83 175.64 2ri1 h ILE 214 N 0.00 0.43 0.00 0.95 2.10 -1.74 -2.18 117.51 117.08 2ri1 h ILE 214 Ca -0.00 -0.29 -0.01 0.00 1.08 0.00 0.00 64.86 65.63 2ri1 h ILE 214 Cb 0.23 1.20 -0.00 0.00 -1.09 0.00 0.00 36.82 37.16 2ri1 h ILE 214 CO 0.00 0.06 -0.06 -0.07 -1.08 0.00 0.00 178.15 177.00 2ri1 h LEU 215 N 0.00 0.00 -2.67 2.19 3.38 -1.56 -1.25 115.31 115.41 2ri1 h LEU 215 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ri1 h LEU 215 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2ri1 h LEU 215 CO 0.01 0.06 0.09 1.56 0.09 0.00 0.00 178.44 180.25 2ri1 h GLN 216 N 0.00 0.00 -0.01 1.13 4.20 -1.56 -2.51 115.11 116.37 2ri1 h GLN 216 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2ri1 h GLN 216 Cb 0.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.09 2ri1 h GLN 216 CO 0.01 0.00 -0.50 0.25 -0.67 0.00 0.00 178.83 177.92 2ri1 n THR 217 N -2.99 0.00 -2.31 -0.54 -2.24 -0.47 -4.77 114.28 100.96 2ri1 n THR 217 Ca -0.03 -0.25 -0.41 0.00 -2.27 0.00 0.00 64.05 61.09 2ri1 n THR 217 Cb 0.15 1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 69.45 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 -2.12 3.35 -0.52 4.78 5.04 -0.95 -4.47 115.29 120.41 2ri1 s HIS 218 Ca 0.10 1.38 0.21 0.00 -1.54 0.00 0.00 55.06 55.22 2ri1 s HIS 218 Cb 0.12 -3.49 0.94 0.00 0.04 0.00 0.00 32.58 30.19 2ri1 s HIS 218 CO 0.50 -1.42 1.65 -0.35 -2.34 0.00 0.00 174.74 172.78 2ri1 n PRO 219 N 2.29 0.16 -2.93 2.88 -0.04 -1.26 -3.01 135.00 133.08 2ri1 n PRO 219 Ca 0.04 0.44 -0.13 0.00 -0.04 0.00 0.00 63.50 63.80 2ri1 n PRO 219 Cb 0.44 -1.83 -0.00 0.00 -0.04 0.00 0.00 33.50 32.06 2ri1 n PRO 219 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2ri1 n LYS 220 N -2.13 0.66 -4.09 0.54 4.81 -1.24 -3.69 118.16 113.02 2ri1 n LYS 220 Ca 0.02 -2.32 -0.35 0.00 -0.87 0.00 0.00 58.31 54.79 2ri1 n LYS 220 Cb 0.19 -1.42 -0.10 0.00 0.02 0.00 0.00 35.03 33.72 2ri1 n LYS 220 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2ri1 s VAL 221 N 0.17 4.69 -0.19 3.15 1.01 -0.88 -1.61 120.40 126.74 2ri1 s VAL 221 Ca 0.33 -0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.24 2ri1 s VAL 221 Cb 0.16 -3.08 0.03 0.00 0.00 0.00 0.00 36.38 33.49 2ri1 s VAL 221 CO -0.17 0.50 -0.15 -0.63 0.00 0.00 0.00 175.10 174.65 2ri1 s ILE 222 N 0.03 1.88 -0.27 2.22 1.09 0.79 -2.25 121.20 124.70 2ri1 s ILE 222 Ca 0.05 -1.01 -0.14 0.00 -1.10 0.00 0.00 60.65 58.46 2ri1 s ILE 222 Cb -0.12 -1.82 -0.04 0.00 -1.06 0.00 0.00 42.46 39.42 2ri1 s ILE 222 CO 0.01 0.35 0.31 -0.22 -0.10 0.00 0.00 174.94 175.29 2ri1 s LEU 223 N 1.32 4.05 -0.19 2.97 2.96 -0.16 -0.74 118.68 128.89 2ri1 s LEU 223 Ca 0.01 0.21 -0.04 0.00 -0.22 0.00 0.00 54.13 54.09 2ri1 s LEU 223 Cb -0.15 -2.32 -0.02 0.00 0.50 0.00 0.00 46.19 44.20 2ri1 s LEU 223 CO -0.10 -0.12 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.15 2ri1 s ILE 224 N 1.87 3.68 -0.08 6.68 1.01 0.19 0.49 121.20 135.05 2ri1 s ILE 224 Ca 0.12 -0.41 -0.05 0.00 0.00 0.00 0.00 60.65 60.32 2ri1 s ILE 224 Cb -0.16 -2.65 0.03 0.00 0.01 0.00 0.00 42.46 39.70 2ri1 s ILE 224 CO 0.10 0.44 0.19 0.54 0.00 0.00 0.00 174.94 176.21 2ri1 s VAL 225 N 1.00 -0.03 0.87 2.92 0.11 -0.60 -2.06 120.40 122.61 2ri1 s VAL 225 Ca 0.01 0.11 -0.12 0.00 -2.93 0.00 0.00 61.98 59.05 2ri1 s VAL 225 Cb -0.15 -0.29 0.11 0.00 -1.53 0.00 0.00 36.38 34.53 2ri1 s VAL 225 CO 0.01 0.04 1.11 1.51 -3.33 0.00 0.00 175.10 174.45 2ri1 s ASP 226 N 0.82 3.84 0.30 3.54 -4.77 -1.15 -0.70 116.67 118.55 2ri1 s ASP 226 Ca -0.06 1.16 0.05 0.00 -3.30 0.00 0.00 52.55 50.40 2ri1 s ASP 226 Cb -0.08 -1.82 0.73 0.00 -1.09 0.00 0.00 42.92 40.66 2ri1 s ASP 226 CO -0.05 -2.36 1.75 -0.33 0.70 0.00 0.00 175.17 174.88 2ri1 h GLU 227 N -1.36 0.63 -0.18 2.11 4.39 -0.89 -2.32 114.58 116.95 2ri1 h GLU 227 Ca -0.49 -0.04 -0.06 0.00 0.34 0.00 0.00 59.36 59.11 2ri1 h GLU 227 Cb 1.30 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 29.81 2ri1 h GLU 227 CO 0.60 0.41 -0.12 0.87 -1.16 0.00 0.00 179.01 179.61 2ri1 h LYS 228 N 0.64 0.40 0.00 2.33 1.79 -1.88 -2.62 116.57 117.24 2ri1 h LYS 228 Ca 0.57 -0.19 -0.01 0.00 -2.18 0.00 0.00 60.65 58.84 2ri1 h LYS 228 Cb 0.94 -0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.58 2ri1 h LYS 228 CO -0.42 0.73 -0.06 0.00 -1.08 0.00 0.00 179.45 178.62 2ri1 h ALA 229 N 0.66 1.01 -0.49 3.86 0.00 -1.52 -2.85 119.26 119.93 2ri1 h ALA 229 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2ri1 h ALA 229 Cb 0.63 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2ri1 h ALA 229 CO 0.03 0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.76 2ri1 n GLY 230 N 0.07 1.81 0.32 0.00 0.00 -0.90 -3.93 105.19 102.55 2ri1 n GLY 230 Ca 0.00 -0.72 0.14 0.00 0.00 0.00 0.00 46.02 45.45 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 4.37 1.54 0.00 4.61 0.00 -1.21 -1.69 119.26 126.87 2ri1 h ALA 231 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2ri1 h ALA 231 Cb 0.92 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2ri1 h ALA 231 CO 0.00 -0.29 0.00 0.41 0.00 0.00 0.00 179.25 179.37 2ri1 n GLY 232 N -1.33 -0.86 0.00 0.00 0.00 -1.26 -5.12 105.19 96.63 2ri1 n GLY 232 Ca 0.23 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2ri1 n GLY 232 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61