#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e9i s SER 2 N 0.00 4.84 -0.08 1.61 0.15 -1.26 -5.05 113.70 113.92 2e9i s SER 2 Ca 0.00 0.55 -0.06 0.00 0.70 0.00 0.00 55.95 57.15 2e9i s SER 2 Cb 0.00 -1.21 -0.04 0.00 -1.71 0.00 0.00 66.02 63.07 2e9i s SER 2 CO 0.00 -1.60 -0.13 -0.24 1.20 0.00 0.00 173.24 172.46 2e9i n SER 3 N -2.97 0.93 -3.78 5.45 2.88 -1.26 -5.11 113.62 109.75 2e9i n SER 3 Ca 0.08 0.15 -0.09 0.00 -1.33 0.00 0.00 58.87 57.68 2e9i n SER 3 Cb 0.60 -0.36 -0.04 0.00 -0.75 0.00 0.00 64.21 63.67 2e9i n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2e9i s GLY 4 N -4.95 -0.02 0.19 0.46 0.00 -1.26 -5.18 107.32 96.55 2e9i s GLY 4 Ca -0.13 -0.30 -0.06 0.00 0.00 0.00 0.00 44.72 44.22 2e9i s GLY 4 CO 0.18 -0.28 0.24 -0.56 0.00 0.00 0.00 173.10 172.68 2e9i s SER 5 N -2.90 0.09 -0.06 1.64 0.01 -1.26 -5.16 113.70 106.06 2e9i s SER 5 Ca 0.11 -1.11 -0.01 0.00 1.31 0.00 0.00 55.95 56.25 2e9i s SER 5 Cb -0.02 0.43 -0.03 0.00 0.21 0.00 0.00 66.02 66.61 2e9i s SER 5 CO -0.00 -0.90 0.03 -0.55 0.41 0.00 0.00 173.24 172.22 2e9i s SER 6 N -3.05 5.39 -0.09 2.44 0.15 -1.26 -5.11 113.70 112.16 2e9i s SER 6 Ca 0.26 0.15 -0.06 0.00 0.70 0.00 0.00 55.95 57.00 2e9i s SER 6 Cb 0.04 -1.53 0.03 0.00 -1.71 0.00 0.00 66.02 62.86 2e9i s SER 6 CO 0.06 0.35 0.22 -0.83 1.20 0.00 0.00 173.24 174.24 2e9i s GLY 7 N -1.16 -0.15 -0.80 9.45 0.00 -1.26 -5.10 107.32 108.31 2e9i s GLY 7 Ca 0.16 0.76 -0.09 0.00 0.00 0.00 0.00 44.72 45.55 2e9i s GLY 7 CO 0.06 0.82 0.70 0.50 0.00 0.00 0.00 173.10 175.18 2e9i s ARG 8 N 0.60 3.32 0.17 2.90 3.00 -1.26 -5.05 118.95 122.63 2e9i s ARG 8 Ca -0.04 -2.60 0.06 0.00 0.00 0.00 0.00 55.73 53.15 2e9i s ARG 8 Cb -0.05 -4.20 -0.04 0.00 0.00 0.00 0.00 34.95 30.66 2e9i s ARG 8 CO -0.03 -1.25 0.07 0.54 0.00 0.00 0.00 175.30 174.62 2e9i s VAL 9 N -0.13 4.09 -0.03 3.52 0.11 -1.26 -5.13 120.40 121.58 2e9i s VAL 9 Ca 0.19 -1.27 -0.01 0.00 -2.93 0.00 0.00 61.98 57.97 2e9i s VAL 9 Cb -0.13 -3.08 0.03 0.00 -1.53 0.00 0.00 36.38 31.67 2e9i s VAL 9 CO -0.07 -0.12 0.05 -1.59 -3.33 0.00 0.00 175.10 170.04 2e9i s LYS 10 N -3.04 -0.02 0.20 1.54 -2.85 -1.26 -5.16 119.74 109.14 2e9i s LYS 10 Ca 0.29 0.24 0.04 0.00 -1.00 0.00 0.00 55.97 55.54 2e9i s LYS 10 Cb -0.10 -0.26 -0.03 0.00 -2.06 0.00 0.00 37.83 35.38 2e9i s LYS 10 CO 0.21 -0.18 0.30 -1.83 0.10 0.00 0.00 175.35 173.95 2e9i s GLU 11 N 1.19 3.38 -0.64 1.78 -1.05 -1.26 -5.07 118.70 117.02 2e9i s GLU 11 Ca -0.08 -0.71 -0.11 0.00 -0.15 0.00 0.00 54.97 53.92 2e9i s GLU 11 Cb -0.13 -2.89 0.17 0.00 -0.44 0.00 0.00 34.13 30.84 2e9i s GLU 11 CO -0.03 0.47 0.55 -1.54 0.95 0.00 0.00 175.26 175.66 2e9i s SER 12 N -3.59 6.12 0.02 0.83 1.04 -1.26 -5.04 113.70 111.82 2e9i s SER 12 Ca 0.34 -2.34 0.04 0.00 0.48 0.00 0.00 55.95 54.47 2e9i s SER 12 Cb -0.10 -2.10 -0.02 0.00 0.10 0.00 0.00 66.02 63.90 2e9i s SER 12 CO 0.28 -0.63 -0.12 0.27 0.98 0.00 0.00 173.24 174.02 2e9i s ILE 13 N 0.73 0.95 -0.42 -1.02 -4.36 -1.26 -5.10 121.20 110.72 2e9i s ILE 13 Ca 0.12 -0.82 -0.28 0.00 -0.26 0.00 0.00 60.65 59.40 2e9i s ILE 13 Cb -0.20 -0.86 -0.01 0.00 1.25 0.00 0.00 42.46 42.65 2e9i s ILE 13 CO -0.03 0.04 1.64 0.28 0.24 0.00 0.00 174.94 177.11 2e9i s THR 14 N -0.70 3.63 -0.30 8.37 -1.32 -1.26 -4.92 115.64 119.13 2e9i s THR 14 Ca 0.01 0.61 -0.09 0.00 -1.21 0.00 0.00 61.69 61.01 2e9i s THR 14 Cb -0.07 -3.95 0.16 0.00 -1.51 0.00 0.00 72.50 67.14 2e9i s THR 14 CO 0.01 -0.67 0.76 -0.60 -2.21 0.00 0.00 174.62 171.91 2e9i s ARG 15 N 5.59 0.46 0.34 7.08 6.06 -1.26 -4.90 118.95 132.32 2e9i s ARG 15 Ca 0.69 1.03 0.20 0.00 -2.50 0.00 0.00 55.73 55.16 2e9i s ARG 15 Cb -0.17 0.61 1.22 0.00 0.06 0.00 0.00 34.95 36.67 2e9i s ARG 15 CO 0.31 -0.29 1.41 2.41 -2.50 0.00 0.00 175.30 176.63 2e9i n THR 16 N 5.33 -0.36 -3.48 4.11 -1.04 -1.26 -4.58 114.28 113.01 2e9i n THR 16 Ca -0.08 1.79 -0.12 0.00 -2.04 0.00 0.00 64.05 63.60 2e9i n THR 16 Cb 0.51 -2.91 -0.03 0.00 -1.82 0.00 0.00 70.33 66.08 2e9i n THR 16 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2e9i s SER 17 N -4.54 -0.51 -0.27 8.00 0.01 -1.26 -5.12 113.70 110.02 2e9i s SER 17 Ca -0.08 0.16 -0.04 0.00 1.31 0.00 0.00 55.95 57.30 2e9i s SER 17 Cb 0.30 0.50 0.02 0.00 0.21 0.00 0.00 66.02 67.05 2e9i s SER 17 CO 0.70 -0.75 -0.00 -0.13 0.41 0.00 0.00 173.24 173.47 2e9i s ARG 18 N -2.90 2.88 -0.25 12.44 3.00 -1.26 -5.07 118.95 127.79 2e9i s ARG 18 Ca -0.00 -0.97 -0.27 0.00 0.00 0.00 0.00 55.73 54.49 2e9i s ARG 18 Cb -0.01 -3.15 0.15 0.00 0.00 0.00 0.00 34.95 31.94 2e9i s ARG 18 CO -0.07 -0.44 1.15 0.00 0.00 0.00 0.00 175.30 175.94 2e9i s ALA 19 N 1.38 -2.03 1.00 2.13 0.00 -1.26 -5.18 121.76 117.80 2e9i s ALA 19 Ca 0.00 1.75 -0.12 0.00 0.00 0.00 0.00 51.96 53.59 2e9i s ALA 19 Cb -0.17 -1.31 0.19 0.00 0.00 0.00 0.00 23.12 21.83 2e9i s ALA 19 CO -0.02 -0.23 1.09 -1.25 0.00 0.00 0.00 175.76 175.36 2e9i s PRO 20 N -0.37 0.41 0.34 0.00 0.04 -1.26 -5.09 135.00 129.07 2e9i s PRO 20 Ca 0.03 0.51 -0.05 0.00 0.04 0.00 0.00 61.00 61.54 2e9i s PRO 20 Cb -0.03 -1.73 0.01 0.00 0.04 0.00 0.00 34.50 32.78 2e9i s PRO 20 CO -0.06 -2.75 0.51 0.45 0.04 0.00 0.00 177.00 175.19 2e9i s SER 21 N -3.45 0.69 -0.11 6.66 0.15 -1.26 -5.16 113.70 111.22 2e9i s SER 21 Ca 0.65 -1.39 -0.03 0.00 0.70 0.00 0.00 55.95 55.88 2e9i s SER 21 Cb -0.19 0.68 0.04 0.00 -1.71 0.00 0.00 66.02 64.84 2e9i s SER 21 CO 0.58 -1.32 0.06 -0.69 1.20 0.00 0.00 173.24 173.06 2e9i s VAL 22 N -3.08 0.02 -0.12 4.45 1.01 -1.26 -5.14 120.40 116.28 2e9i s VAL 22 Ca 0.28 0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.31 2e9i s VAL 22 Cb -0.01 -0.45 -0.03 0.00 0.00 0.00 0.00 36.38 35.90 2e9i s VAL 22 CO 0.18 -0.02 -0.04 0.00 0.00 0.00 0.00 175.10 175.21 2e9i s ALA 23 N 2.10 3.02 0.24 5.51 0.00 -1.26 -4.95 121.76 126.43 2e9i s ALA 23 Ca 0.03 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.17 2e9i s ALA 23 Cb -0.14 -1.46 -0.05 0.00 0.00 0.00 0.00 23.12 21.47 2e9i s ALA 23 CO -0.06 0.35 0.08 -0.08 0.00 0.00 0.00 175.76 176.05 2e9i s THR 24 N -0.08 0.59 0.05 0.00 -1.32 -1.26 -2.78 115.64 110.83 2e9i s THR 24 Ca 0.02 -2.00 0.05 0.00 -1.21 0.00 0.00 61.69 58.55 2e9i s THR 24 Cb -0.13 -2.55 -0.04 0.00 -1.51 0.00 0.00 72.50 68.27 2e9i s THR 24 CO 0.03 -0.08 -0.09 0.54 -2.21 0.00 0.00 174.62 172.81 2e9i s VAL 25 N -3.73 3.48 -1.35 5.08 0.11 -1.19 -4.53 120.40 118.27 2e9i s VAL 25 Ca 0.36 -1.00 0.00 0.00 -2.93 0.00 0.00 61.98 58.41 2e9i s VAL 25 Cb 0.08 -2.55 0.00 0.00 -1.53 0.00 0.00 36.38 32.37 2e9i s VAL 25 CO 0.12 0.28 0.00 0.61 -3.33 0.00 0.00 175.10 172.78 2e9i n GLY 26 N 1.22 -0.22 3.20 6.54 0.00 -1.26 -4.82 105.19 109.84 2e9i n GLY 26 Ca -0.15 -0.23 -0.13 0.00 0.00 0.00 0.00 46.02 45.52 2e9i n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e9i s SER 27 N -2.31 -0.25 -0.51 1.61 0.01 -1.26 -5.10 113.70 105.89 2e9i s SER 27 Ca 0.00 0.40 -0.26 0.00 1.31 0.00 0.00 55.95 57.40 2e9i s SER 27 Cb 0.00 0.50 -0.05 0.00 0.21 0.00 0.00 66.02 66.68 2e9i s SER 27 CO 0.00 -0.22 2.21 -0.63 0.41 0.00 0.00 173.24 175.01 2e9i s ILE 28 N -0.37 3.13 -0.24 1.44 1.01 -1.26 -4.36 121.20 120.55 2e9i s ILE 28 Ca -0.05 0.08 -0.22 0.00 0.00 0.00 0.00 60.65 60.46 2e9i s ILE 28 Cb -0.03 -3.33 -0.01 0.00 0.01 0.00 0.00 42.46 39.09 2e9i s ILE 28 CO 0.02 -0.31 0.73 0.00 0.00 0.00 0.00 174.94 175.37 2e9i s ASP 30 N 1.38 6.49 -0.38 0.00 1.01 -1.26 -2.61 116.67 121.30 2e9i s ASP 30 Ca 0.31 0.50 -0.10 0.00 0.71 0.00 0.00 52.55 53.98 2e9i s ASP 30 Cb -0.15 -2.32 0.05 0.00 1.01 0.00 0.00 42.92 41.50 2e9i s ASP 30 CO 0.08 -0.40 0.21 -0.22 0.21 0.00 0.00 175.17 175.04 2e9i s LEU 31 N 2.50 4.79 -0.27 1.23 2.96 -0.08 -4.95 118.68 124.86 2e9i s LEU 31 Ca 0.24 -1.18 -0.21 0.00 -0.22 0.00 0.00 54.13 52.76 2e9i s LEU 31 Cb -0.15 -1.99 -0.01 0.00 0.50 0.00 0.00 46.19 44.54 2e9i s LEU 31 CO 0.10 -0.43 0.66 0.20 -1.32 0.00 0.00 176.35 175.57 2e9i s ASN 32 N 1.71 6.59 -0.09 3.68 0.01 -1.26 -1.75 114.94 123.83 2e9i s ASN 32 Ca 0.02 0.67 0.02 0.00 -0.71 0.00 0.00 52.86 52.85 2e9i s ASN 32 Cb -0.20 -2.35 0.02 0.00 0.41 0.00 0.00 41.25 39.12 2e9i s ASN 32 CO 0.05 -0.43 -0.13 -0.76 -1.51 0.00 0.00 177.10 174.32 2e9i s LEU 33 N 2.60 1.60 -0.83 0.60 1.43 -1.01 -5.06 118.68 118.01 2e9i s LEU 33 Ca 0.27 -0.34 -0.25 0.00 -1.03 0.00 0.00 54.13 52.78 2e9i s LEU 33 Cb -0.15 -0.92 0.04 0.00 0.03 0.00 0.00 46.19 45.19 2e9i s LEU 33 CO 0.09 0.01 1.32 -0.54 0.23 0.00 0.00 176.35 177.46 2e9i s LYS 34 N 0.93 3.32 -0.10 1.70 -0.14 -1.26 -3.21 119.74 120.97 2e9i s LYS 34 Ca -0.09 -0.58 -0.03 0.00 -1.36 0.00 0.00 55.97 53.91 2e9i s LYS 34 Cb -0.15 -4.58 -0.03 0.00 -1.68 0.00 0.00 37.83 31.39 2e9i s LYS 34 CO 0.00 -2.15 0.02 0.42 -0.76 0.00 0.00 175.35 172.89 2e9i s ILE 35 N 5.37 4.48 0.00 2.17 1.01 -1.12 -5.02 121.20 128.10 2e9i s ILE 35 Ca 0.38 -0.18 0.00 0.00 0.00 0.00 0.00 60.65 60.85 2e9i s ILE 35 Cb -0.06 -2.91 0.00 0.00 0.01 0.00 0.00 42.46 39.50 2e9i s ILE 35 CO 0.06 0.59 0.00 -0.81 0.00 0.00 0.00 174.94 174.78 2e9i n PRO 36 N 2.32 -0.58 -0.24 2.79 -0.04 -1.26 -3.68 135.00 134.31 2e9i n PRO 36 Ca -0.19 0.00 0.32 0.00 -0.04 0.00 0.00 63.50 63.59 2e9i n PRO 36 Cb 0.54 0.00 0.63 0.00 -0.04 0.00 0.00 33.50 34.62 2e9i n PRO 36 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2e9i h GLU 37 N 0.00 0.00 -5.08 0.54 4.11 -1.99 -3.42 114.58 108.74 2e9i h GLU 37 Ca 0.00 0.00 -0.74 0.00 0.07 0.00 0.00 59.36 58.69 2e9i h GLU 37 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 2e9i h GLU 37 CO 0.00 0.00 0.56 -0.89 0.07 0.00 0.00 179.01 178.75 2e9i n ILE 38 N -3.61 0.00 -0.76 -1.06 5.41 -1.26 -4.86 119.36 113.22 2e9i n ILE 38 Ca 0.23 0.00 -0.29 0.00 1.00 0.00 0.00 62.75 63.69 2e9i n ILE 38 Cb 1.36 -0.41 0.20 0.00 -0.71 0.00 0.00 39.64 40.08 2e9i n ILE 38 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 2e9i s ASN 39 N 2.44 2.19 0.06 4.38 3.84 -1.26 -4.96 114.94 121.63 2e9i s ASN 39 Ca 0.88 1.73 0.05 0.00 0.21 0.00 0.00 52.86 55.73 2e9i s ASN 39 Cb -1.26 -2.36 -0.23 0.00 -0.55 0.00 0.00 41.25 36.85 2e9i s ASN 39 CO 0.69 -3.48 1.07 0.28 -2.79 0.00 0.00 177.10 172.87 2e9i h SER 40 N -2.13 0.12 0.26 -4.21 0.02 -1.93 -3.30 113.55 102.38 2e9i h SER 40 Ca -0.53 -0.15 -0.11 0.00 -0.84 0.00 0.00 61.79 60.16 2e9i h SER 40 Cb 1.30 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.79 2e9i h SER 40 CO 0.49 1.12 -0.42 0.28 -1.14 0.00 0.00 176.83 177.16 2e9i h SER 41 N 0.02 0.22 0.33 3.07 0.02 -1.98 -2.75 113.55 112.49 2e9i h SER 41 Ca -0.12 -0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 60.67 2e9i h SER 41 Cb 1.88 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 64.35 2e9i h SER 41 CO 0.14 0.62 -0.31 0.44 -1.14 0.00 0.00 176.83 176.58 2e9i h ASP 42 N 0.18 0.00 -1.99 3.07 3.32 -1.95 -3.44 116.42 115.61 2e9i h ASP 42 Ca 0.01 0.00 -0.46 0.00 0.02 0.00 0.00 57.03 56.61 2e9i h ASP 42 Cb 0.82 0.00 0.05 0.00 0.22 0.00 0.00 39.33 40.43 2e9i h ASP 42 CO 0.06 0.31 -0.01 -0.04 -1.72 0.00 0.00 179.24 177.84 2e9i s MET 43 N -4.29 2.21 -0.23 3.56 -1.94 -1.04 -1.16 119.30 116.41 2e9i s MET 43 Ca -0.03 -1.09 -0.07 0.00 -1.71 0.00 0.00 55.69 52.79 2e9i s MET 43 Cb 0.15 -2.48 0.11 0.00 2.01 0.00 0.00 34.83 34.61 2e9i s MET 43 CO 0.71 -0.97 0.47 -1.54 -0.01 0.00 0.00 175.02 173.67 2e9i s SER 44 N -4.57 -0.42 -0.13 3.03 1.04 -0.26 -4.89 113.70 107.49 2e9i s SER 44 Ca 0.61 1.03 -0.02 0.00 0.48 0.00 0.00 55.95 58.05 2e9i s SER 44 Cb -0.08 1.54 -0.03 0.00 0.10 0.00 0.00 66.02 67.56 2e9i s SER 44 CO 0.40 -0.24 -0.06 0.00 0.98 0.00 0.00 173.24 174.33 2e9i s ALA 45 N 2.67 2.95 -0.13 5.32 0.00 -1.26 -2.18 121.76 129.13 2e9i s ALA 45 Ca -0.00 -0.84 -0.09 0.00 0.00 0.00 0.00 51.96 51.02 2e9i s ALA 45 Cb -0.12 -1.43 0.04 0.00 0.00 0.00 0.00 23.12 21.61 2e9i s ALA 45 CO -0.14 0.32 0.33 -1.01 0.00 0.00 0.00 175.76 175.26 2e9i s HIS 46 N 0.04 -0.43 -0.52 0.00 3.76 -1.05 -2.55 115.29 114.53 2e9i s HIS 46 Ca -0.01 0.99 -0.18 0.00 -0.15 0.00 0.00 55.06 55.71 2e9i s HIS 46 Cb -0.14 0.15 0.08 0.00 1.11 0.00 0.00 32.58 33.78 2e9i s HIS 46 CO 0.03 -0.24 0.58 0.08 -0.85 0.00 0.00 174.74 174.33 2e9i s VAL 47 N 0.85 4.98 -0.06 -0.90 1.01 -0.32 -1.10 120.40 124.86 2e9i s VAL 47 Ca -0.05 -0.81 -0.22 0.00 0.00 0.00 0.00 61.98 60.90 2e9i s VAL 47 Cb -0.06 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 31.98 2e9i s VAL 47 CO -0.06 -0.82 0.64 -0.89 0.00 0.00 0.00 175.10 173.97 2e9i s THR 48 N 2.32 5.03 0.58 3.92 2.01 -0.30 -1.56 115.64 127.65 2e9i s THR 48 Ca 0.11 1.32 -0.17 0.00 0.31 0.00 0.00 61.69 63.26 2e9i s THR 48 Cb -0.22 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.27 2e9i s THR 48 CO 0.09 0.31 1.07 -0.94 -0.69 0.00 0.00 174.62 174.45 2e9i s SER 49 N 0.52 5.77 0.00 3.53 1.04 0.44 -3.05 113.70 121.95 2e9i s SER 49 Ca 0.34 1.89 0.08 0.00 0.48 0.00 0.00 55.95 58.74 2e9i s SER 49 Cb -0.17 -2.54 0.50 0.00 0.10 0.00 0.00 66.02 63.90 2e9i s SER 49 CO 0.17 -1.18 0.95 -0.81 0.98 0.00 0.00 173.24 173.35 2e9i n PRO 50 N -1.87 0.49 -0.04 4.02 -0.04 -1.23 -3.55 135.00 132.79 2e9i n PRO 50 Ca 0.09 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.51 2e9i n PRO 50 Cb 0.52 -1.27 -0.01 0.00 -0.04 0.00 0.00 33.50 32.71 2e9i n PRO 50 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2e9i n SER 51 N -0.77 0.86 0.00 3.54 3.41 -1.26 -5.00 113.62 114.40 2e9i n SER 51 Ca 0.06 0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.82 2e9i n SER 51 Cb 0.03 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 63.39 2e9i n SER 51 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2e9i n GLY 52 N 1.58 0.00 3.47 5.00 0.00 -1.23 -5.17 105.19 108.84 2e9i n GLY 52 Ca -0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.70 2e9i n GLY 52 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2e9i s ARG 53 N 0.00 1.67 -0.09 1.61 0.52 -1.26 -4.99 118.95 116.41 2e9i s ARG 53 Ca 0.00 -1.54 0.01 0.00 -0.52 0.00 0.00 55.73 53.69 2e9i s ARG 53 Cb 0.00 -1.89 0.02 0.00 0.52 0.00 0.00 34.95 33.60 2e9i s ARG 53 CO 0.00 0.39 -0.11 0.08 0.02 0.00 0.00 175.30 175.68 2e9i s VAL 54 N -1.89 1.16 0.27 3.52 1.01 -1.26 -0.42 120.40 122.79 2e9i s VAL 54 Ca 0.24 -0.44 0.09 0.00 0.00 0.00 0.00 61.98 61.87 2e9i s VAL 54 Cb -0.07 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.16 2e9i s VAL 54 CO 0.12 0.37 0.01 -0.89 0.00 0.00 0.00 175.10 174.72 2e9i s THR 55 N 1.08 3.48 0.07 3.92 2.01 -0.60 -4.97 115.64 120.63 2e9i s THR 55 Ca -0.06 -1.88 0.04 0.00 0.31 0.00 0.00 61.69 60.10 2e9i s THR 55 Cb -0.14 -2.88 -0.04 0.00 0.01 0.00 0.00 72.50 69.44 2e9i s THR 55 CO -0.02 -0.36 0.01 -0.70 -0.69 0.00 0.00 174.62 172.86 2e9i s GLU 56 N -3.69 2.65 0.29 4.92 -6.30 -1.26 -1.17 118.70 114.13 2e9i s GLU 56 Ca 0.32 -0.77 0.08 0.00 -2.50 0.00 0.00 54.97 52.10 2e9i s GLU 56 Cb -0.06 -2.59 -0.06 0.00 0.00 0.00 0.00 34.13 31.42 2e9i s GLU 56 CO 0.20 0.56 -0.09 0.00 0.02 0.00 0.00 175.26 175.95 2e9i s ALA 57 N -1.27 2.52 -0.14 6.30 0.00 -1.06 -4.82 121.76 123.29 2e9i s ALA 57 Ca 0.25 -1.93 -0.05 0.00 0.00 0.00 0.00 51.96 50.23 2e9i s ALA 57 Cb -0.12 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.02 2e9i s ALA 57 CO 0.17 0.02 0.05 -2.00 0.00 0.00 0.00 175.76 174.00 2e9i s GLU 58 N -3.66 3.54 -0.77 0.00 2.12 -1.26 -4.79 118.70 113.87 2e9i s GLU 58 Ca 0.30 -0.34 -0.11 0.00 0.36 0.00 0.00 54.97 55.17 2e9i s GLU 58 Cb 0.02 -3.05 0.20 0.00 0.26 0.00 0.00 34.13 31.57 2e9i s GLU 58 CO 0.13 0.50 0.68 0.42 -0.54 0.00 0.00 175.26 176.45 2e9i s ILE 59 N -0.27 5.14 -0.01 -3.70 1.01 -1.26 -3.27 121.20 118.83 2e9i s ILE 59 Ca 0.08 -2.58 -0.30 0.00 0.00 0.00 0.00 60.65 57.84 2e9i s ILE 59 Cb -0.12 -4.21 -0.06 0.00 0.01 0.00 0.00 42.46 38.09 2e9i s ILE 59 CO 0.02 -0.99 1.50 -0.69 0.00 0.00 0.00 174.94 174.78 2e9i s VAL 60 N 0.12 3.60 -0.31 2.92 1.01 0.29 -4.84 120.40 123.18 2e9i s VAL 60 Ca 0.17 0.92 -0.29 0.00 0.00 0.00 0.00 61.98 62.79 2e9i s VAL 60 Cb -0.13 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 2e9i s VAL 60 CO -0.07 -0.03 1.68 -2.16 0.00 0.00 0.00 175.10 174.51 2e9i s PRO 61 N 2.93 3.51 -0.04 2.72 0.04 -1.26 -1.03 135.00 141.88 2e9i s PRO 61 Ca 0.67 1.41 -0.01 0.00 0.04 0.00 0.00 61.00 63.12 2e9i s PRO 61 Cb -0.33 -4.12 -0.00 0.00 0.04 0.00 0.00 34.50 30.09 2e9i s PRO 61 CO 0.27 -1.64 0.06 0.52 0.04 0.00 0.00 177.00 176.26 2e9i h MET 62 N 11.85 -0.03 0.00 4.56 2.86 -1.84 -3.48 114.93 128.85 2e9i h MET 62 Ca -0.33 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.32 2e9i h MET 62 Cb 1.15 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.82 2e9i h MET 62 CO 1.03 -0.02 0.00 0.41 1.06 0.00 0.00 176.91 179.39 2e9i n GLY 63 N 1.75 -0.53 3.61 8.32 0.00 -1.15 -4.99 105.19 112.21 2e9i n GLY 63 Ca -0.00 0.27 -0.43 0.00 0.00 0.00 0.00 46.02 45.86 2e9i n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2e9i s LYS 64 N 0.00 3.40 -1.17 1.61 -2.85 -1.26 -2.60 119.74 116.87 2e9i s LYS 64 Ca 0.00 2.08 -0.13 0.00 -1.00 0.00 0.00 55.97 56.92 2e9i s LYS 64 Cb 0.00 -4.29 0.13 0.00 -2.06 0.00 0.00 37.83 31.61 2e9i s LYS 64 CO 0.00 -1.79 0.40 0.09 0.10 0.00 0.00 175.35 174.14 2e9i n ASN 65 N 10.51 -1.97 -4.21 0.03 5.03 -1.26 -4.90 115.26 118.49 2e9i n ASN 65 Ca 0.26 -0.53 -0.25 0.00 0.87 0.00 0.00 54.58 54.94 2e9i n ASN 65 Cb 0.44 -1.73 -0.15 0.00 -1.02 0.00 0.00 39.78 37.33 2e9i n ASN 65 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 2e9i s SER 66 N -2.76 2.26 -0.09 6.41 0.01 -1.07 -2.78 113.70 115.68 2e9i s SER 66 Ca 0.49 -0.42 -0.18 0.00 1.31 0.00 0.00 55.95 57.15 2e9i s SER 66 Cb -0.28 -0.22 0.04 0.00 0.21 0.00 0.00 66.02 65.77 2e9i s SER 66 CO 0.60 0.18 0.43 -1.00 0.41 0.00 0.00 173.24 173.86 2e9i s HIS 67 N -0.62 -0.39 -0.01 2.43 3.76 -1.20 -2.67 115.29 116.59 2e9i s HIS 67 Ca 0.07 0.82 0.03 0.00 -0.15 0.00 0.00 55.06 55.83 2e9i s HIS 67 Cb -0.08 0.18 -0.01 0.00 1.11 0.00 0.00 32.58 33.78 2e9i s HIS 67 CO 0.00 -0.35 -0.11 0.00 -0.85 0.00 0.00 174.74 173.44 2e9i s VAL 69 N -0.23 2.00 -0.20 0.00 1.01 -0.71 0.10 120.40 122.37 2e9i s VAL 69 Ca 0.04 -1.12 -0.07 0.00 0.00 0.00 0.00 61.98 60.83 2e9i s VAL 69 Cb -0.04 -1.93 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 2e9i s VAL 69 CO -0.00 0.33 0.05 0.00 0.00 0.00 0.00 175.10 175.48 2e9i s ARG 70 N 1.27 3.82 0.24 2.72 1.70 -1.20 -0.90 118.95 126.58 2e9i s ARG 70 Ca 0.00 -0.42 -0.22 0.00 -0.47 0.00 0.00 55.73 54.63 2e9i s ARG 70 Cb -0.15 -3.22 0.04 0.00 -0.57 0.00 0.00 34.95 31.04 2e9i s ARG 70 CO -0.10 0.10 0.70 -0.59 -1.08 0.00 0.00 175.30 174.33 2e9i s PHE 71 N 0.84 -0.28 -0.68 5.89 -0.71 -1.07 -4.21 117.98 117.75 2e9i s PHE 71 Ca 0.03 -0.09 -0.09 0.00 -1.04 0.00 0.00 56.93 55.74 2e9i s PHE 71 Cb -0.14 0.66 0.18 0.00 -1.21 0.00 0.00 43.02 42.51 2e9i s PHE 71 CO 0.02 -1.10 0.55 0.08 -1.34 0.00 0.00 175.22 173.44 2e9i s VAL 72 N -3.82 4.57 -1.18 -2.49 1.01 -1.26 0.17 120.40 117.40 2e9i s VAL 72 Ca 0.08 -2.54 -0.23 0.00 0.00 0.00 0.00 61.98 59.30 2e9i s VAL 72 Cb -0.04 -3.91 -0.09 0.00 0.00 0.00 0.00 36.38 32.34 2e9i s VAL 72 CO 0.01 -0.92 1.93 -2.16 0.00 0.00 0.00 175.10 173.97 2e9i s PRO 73 N 0.30 2.50 -0.25 2.72 0.04 -1.26 -4.86 135.00 134.19 2e9i s PRO 73 Ca 0.15 -1.17 0.01 0.00 0.04 0.00 0.00 61.00 60.04 2e9i s PRO 73 Cb -0.18 -5.24 0.05 0.00 0.04 0.00 0.00 34.50 29.17 2e9i s PRO 73 CO -0.05 -3.98 -0.11 1.14 0.04 0.00 0.00 177.00 174.04 2e9i s GLN 74 N 6.46 2.50 0.31 4.56 -2.07 -1.26 -4.49 119.66 125.67 2e9i s GLN 74 Ca 0.68 -1.18 0.03 0.00 -1.82 0.00 0.00 55.36 53.08 2e9i s GLN 74 Cb -0.01 -2.86 -0.01 0.00 -1.09 0.00 0.00 33.01 29.04 2e9i s GLN 74 CO 0.13 -0.48 0.34 0.39 -1.32 0.00 0.00 175.29 174.35 2e9i n GLU 75 N 4.52 0.49 -0.14 9.60 4.71 -1.26 -5.04 120.64 133.53 2e9i n GLU 75 Ca -0.16 -2.80 0.10 0.00 -0.01 0.00 0.00 57.16 54.29 2e9i n GLU 75 Cb 0.45 2.46 0.30 0.00 -1.01 0.00 0.00 31.44 33.63 2e9i n GLU 75 CO 0.00 0.00 0.00 -1.33 0.09 0.00 0.00 177.13 175.89 2e9i n MET 76 N -0.55 1.97 0.00 3.49 2.81 -1.26 -4.96 117.12 118.62 2e9i n MET 76 Ca 0.04 -1.47 0.00 0.00 -1.81 0.00 0.00 57.70 54.47 2e9i n MET 76 Cb 0.54 -1.41 0.00 0.00 -0.71 0.00 0.00 33.22 31.64 2e9i n MET 76 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2e9i n GLY 77 N 1.23 2.94 3.77 3.03 0.00 -1.26 -5.08 105.19 109.82 2e9i n GLY 77 Ca 0.16 -0.08 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 2e9i n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2e9i s VAL 78 N 0.28 3.58 -0.15 1.61 0.11 -1.26 -4.75 120.40 119.82 2e9i s VAL 78 Ca 0.00 1.46 -0.06 0.00 -2.93 0.00 0.00 61.98 60.44 2e9i s VAL 78 Cb 0.00 -3.88 -0.04 0.00 -1.53 0.00 0.00 36.38 30.93 2e9i s VAL 78 CO 0.00 0.25 0.07 -1.00 -3.33 0.00 0.00 175.10 171.09 2e9i s HIS 79 N -1.32 3.34 -0.10 1.54 0.09 -1.21 -3.52 115.29 114.10 2e9i s HIS 79 Ca 0.49 0.24 0.03 0.00 -0.00 0.00 0.00 55.06 55.82 2e9i s HIS 79 Cb -0.29 -1.98 0.00 0.00 -0.00 0.00 0.00 32.58 30.31 2e9i s HIS 79 CO 0.36 0.39 -0.22 0.99 -0.00 0.00 0.00 174.74 176.26 2e9i s THR 80 N -0.27 1.90 -0.29 1.30 2.01 -1.17 -2.69 115.64 116.42 2e9i s THR 80 Ca 0.09 -0.92 -0.08 0.00 0.31 0.00 0.00 61.69 61.09 2e9i s THR 80 Cb -0.12 -1.66 -0.01 0.00 0.01 0.00 0.00 72.50 70.73 2e9i s THR 80 CO 0.01 0.52 0.11 -0.69 -0.69 0.00 0.00 174.62 173.89 2e9i s VAL 81 N 0.47 4.35 -0.47 3.82 1.01 0.41 -1.15 120.40 128.84 2e9i s VAL 81 Ca -0.16 -0.44 -0.18 0.00 0.00 0.00 0.00 61.98 61.20 2e9i s VAL 81 Cb -0.17 -3.18 0.05 0.00 0.00 0.00 0.00 36.38 33.08 2e9i s VAL 81 CO 0.07 0.14 0.52 -0.55 0.00 0.00 0.00 175.10 175.27 2e9i s SER 82 N 1.58 6.20 -0.45 3.32 0.15 -0.26 -0.30 113.70 123.94 2e9i s SER 82 Ca 0.04 -0.93 -0.05 0.00 0.70 0.00 0.00 55.95 55.72 2e9i s SER 82 Cb -0.17 -2.25 0.12 0.00 -1.71 0.00 0.00 66.02 62.01 2e9i s SER 82 CO 0.05 -0.74 0.27 -0.69 1.20 0.00 0.00 173.24 173.32 2e9i s VAL 83 N 2.26 3.63 -0.03 4.45 1.01 -1.26 -2.54 120.40 127.93 2e9i s VAL 83 Ca 0.12 -2.03 -0.02 0.00 0.00 0.00 0.00 61.98 60.05 2e9i s VAL 83 Cb -0.20 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 2e9i s VAL 83 CO 0.11 -0.73 0.11 -0.54 0.00 0.00 0.00 175.10 174.05 2e9i s LYS 84 N 1.14 3.22 -0.61 2.72 1.02 -0.93 -1.64 119.74 124.66 2e9i s LYS 84 Ca 0.08 -0.38 -0.03 0.00 0.02 0.00 0.00 55.97 55.66 2e9i s LYS 84 Cb -0.24 -2.97 0.16 0.00 -0.52 0.00 0.00 37.83 34.26 2e9i s LYS 84 CO -0.03 0.68 0.42 -0.47 -0.92 0.00 0.00 175.35 175.02 2e9i s TYR 85 N -1.19 3.42 -1.66 3.18 5.04 0.79 -1.10 117.35 125.83 2e9i s TYR 85 Ca 0.22 -2.70 0.00 0.00 -2.44 0.00 0.00 57.07 52.15 2e9i s TYR 85 Cb -0.12 -3.19 0.00 0.00 0.35 0.00 0.00 41.96 39.00 2e9i s TYR 85 CO 0.13 -0.85 0.00 0.54 -1.34 0.00 0.00 175.55 174.03 2e9i n ARG 86 N 3.57 -1.39 0.00 4.97 1.74 -0.31 -3.42 116.66 121.82 2e9i n ARG 86 Ca 0.07 0.95 0.00 0.00 -0.77 0.00 0.00 57.85 58.10 2e9i n ARG 86 Cb 0.38 -5.39 0.00 0.00 -1.02 0.00 0.00 32.46 26.43 2e9i n ARG 86 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2e9i n GLY 87 N -0.94 0.67 3.35 -0.13 0.00 -1.26 -5.12 105.19 101.76 2e9i n GLY 87 Ca -0.20 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.84 2e9i n GLY 87 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2e9i s GLN 88 N 0.67 0.45 -0.40 1.61 -0.21 -1.22 -5.11 119.66 115.45 2e9i s GLN 88 Ca 0.00 0.97 -0.27 0.00 0.02 0.00 0.00 55.36 56.08 2e9i s GLN 88 Cb 0.00 0.57 -0.06 0.00 1.00 0.00 0.00 33.01 34.52 2e9i s GLN 88 CO 0.00 -0.31 2.31 -1.01 -2.12 0.00 0.00 175.29 174.15 2e9i s HIS 89 N 2.79 1.15 0.96 0.91 3.76 -1.26 -0.15 115.29 123.45 2e9i s HIS 89 Ca 0.04 1.17 -0.16 0.00 -0.15 0.00 0.00 55.06 55.95 2e9i s HIS 89 Cb -0.11 -3.73 0.04 0.00 1.11 0.00 0.00 32.58 29.89 2e9i s HIS 89 CO -0.18 -3.06 -0.26 1.33 -0.85 0.00 0.00 174.74 171.73 2e9i n VAL 90 N 7.87 0.00 -1.77 -0.90 0.24 -0.65 -4.64 118.33 118.47 2e9i n VAL 90 Ca 0.33 -0.09 -0.41 0.00 -2.04 0.00 0.00 64.34 62.13 2e9i n VAL 90 Cb 0.51 -0.33 -0.00 0.00 -1.47 0.00 0.00 33.84 32.55 2e9i n VAL 90 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 2e9i n THR 91 N -4.00 1.83 -1.30 3.34 -1.04 -1.26 -1.66 114.28 110.18 2e9i n THR 91 Ca 0.02 -0.46 -0.10 0.00 -2.04 0.00 0.00 64.05 61.47 2e9i n THR 91 Cb 0.47 -2.00 -0.04 0.00 -1.82 0.00 0.00 70.33 66.94 2e9i n THR 91 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2e9i n GLY 92 N 0.74 1.11 3.67 3.41 0.00 -1.26 -4.97 105.19 107.89 2e9i n GLY 92 Ca 0.02 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 2e9i n GLY 92 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2e9i s SER 93 N -2.58 5.09 1.07 1.61 0.15 -0.66 -3.62 113.70 114.76 2e9i s SER 93 Ca 0.00 0.04 -0.14 0.00 0.70 0.00 0.00 55.95 56.54 2e9i s SER 93 Cb 0.00 -1.36 0.22 0.00 -1.71 0.00 0.00 66.02 63.18 2e9i s SER 93 CO 0.00 0.32 1.10 -2.16 1.20 0.00 0.00 173.24 173.70 2e9i s PRO 94 N -1.26 -0.13 -0.02 5.44 0.04 -1.26 -4.78 135.00 133.03 2e9i s PRO 94 Ca 0.17 0.33 0.00 0.00 0.04 0.00 0.00 61.00 61.54 2e9i s PRO 94 Cb -0.11 -1.69 -0.04 0.00 0.04 0.00 0.00 34.50 32.70 2e9i s PRO 94 CO 0.07 -3.06 0.03 -0.06 0.04 0.00 0.00 177.00 174.01 2e9i s PHE 95 N -2.97 3.17 -0.06 0.56 0.08 0.59 -4.92 117.98 114.42 2e9i s PHE 95 Ca 0.67 0.15 0.03 0.00 0.12 0.00 0.00 56.93 57.90 2e9i s PHE 95 Cb -0.16 -1.72 0.01 0.00 -0.57 0.00 0.00 43.02 40.58 2e9i s PHE 95 CO 0.57 0.50 -0.14 -0.65 -0.10 0.00 0.00 175.22 175.40 2e9i s GLN 96 N -1.48 1.78 -0.16 0.44 -0.21 -1.26 -0.45 119.66 118.33 2e9i s GLN 96 Ca 0.19 -0.48 -0.12 0.00 0.02 0.00 0.00 55.36 54.97 2e9i s GLN 96 Cb -0.12 -1.48 0.05 0.00 1.00 0.00 0.00 33.01 32.46 2e9i s GLN 96 CO 0.10 0.09 0.41 -0.59 -2.12 0.00 0.00 175.29 173.18 2e9i s PHE 97 N 0.48 -0.51 0.11 0.91 -0.12 -1.10 -5.06 117.98 112.70 2e9i s PHE 97 Ca -0.12 1.16 -0.23 0.00 -0.05 0.00 0.00 56.93 57.69 2e9i s PHE 97 Cb -0.15 0.19 -0.07 0.00 -0.63 0.00 0.00 43.02 42.37 2e9i s PHE 97 CO 0.04 -0.26 0.71 0.99 -0.05 0.00 0.00 175.22 176.64 2e9i s THR 98 N 0.67 4.55 0.13 -4.49 2.01 -1.26 -3.36 115.64 113.89 2e9i s THR 98 Ca -0.04 1.54 0.02 0.00 0.31 0.00 0.00 61.69 63.53 2e9i s THR 98 Cb -0.05 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 2e9i s THR 98 CO -0.04 0.50 0.24 -0.69 -0.69 0.00 0.00 174.62 173.93 2e9i s VAL 99 N -0.90 5.19 0.04 3.82 1.01 -1.26 -4.60 120.40 123.71 2e9i s VAL 99 Ca 0.34 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.66 2e9i s VAL 99 Cb -0.21 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 2e9i s VAL 99 CO 0.23 -0.04 -0.08 -0.83 0.00 0.00 0.00 175.10 174.39 2e9i s GLY 100 N -3.03 0.49 0.69 4.51 0.00 -1.12 -4.96 107.32 103.90 2e9i s GLY 100 Ca 0.34 -0.73 -0.14 0.00 0.00 0.00 0.00 44.72 44.19 2e9i s GLY 100 CO 0.27 -0.77 1.11 2.56 0.00 0.00 0.00 173.10 176.27 2e9i s PRO 101 N -1.49 2.67 -0.37 2.90 0.04 -1.26 -3.15 135.00 134.34 2e9i s PRO 101 Ca -0.09 1.33 -0.29 0.00 0.04 0.00 0.00 61.00 61.99 2e9i s PRO 101 Cb -0.09 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.52 2e9i s PRO 101 CO 0.00 -1.35 1.30 -1.17 0.04 0.00 0.00 177.00 175.83 2e9i s LEU 102 N -5.13 3.75 -0.30 -3.56 0.20 -1.26 -4.93 118.68 107.45 2e9i s LEU 102 Ca 0.65 0.96 -0.19 0.00 0.69 0.00 0.00 54.13 56.24 2e9i s LEU 102 Cb -0.20 -3.54 0.18 0.00 -0.43 0.00 0.00 46.19 42.21 2e9i s LEU 102 CO 0.45 -1.21 1.29 -0.83 -0.29 0.00 0.00 176.35 175.76 2e9i s GLY 103 N 3.06 0.14 -0.16 7.98 0.00 -1.26 -5.14 107.32 111.95 2e9i s GLY 103 Ca 0.56 3.46 -0.27 0.00 0.00 0.00 0.00 44.72 48.47 2e9i s GLY 103 CO 0.27 3.73 0.91 -0.54 0.00 0.00 0.00 173.10 177.47 2e9i s GLU 104 N 2.53 4.33 1.60 2.90 2.02 -1.26 -4.91 118.70 125.91 2e9i s GLU 104 Ca -0.06 1.17 0.00 0.00 0.02 0.00 0.00 54.97 56.10 2e9i s GLU 104 Cb -0.04 -3.57 0.00 0.00 0.10 0.00 0.00 34.13 30.61 2e9i s GLU 104 CO -0.11 -0.36 0.00 0.41 0.02 0.00 0.00 175.26 175.22 2e9i n GLY 105 N 3.33 0.10 0.00 -1.39 0.00 -1.26 -5.32 105.19 100.66 2e9i n GLY 105 Ca 0.07 -0.74 0.13 0.00 0.00 0.00 0.00 46.02 45.48 2e9i n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93