#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 7.22 0.10 1.61 0.15 -1.26 -4.99 113.70 116.53 2e9i s SER 2 Ca 0.00 1.69 -0.25 0.00 0.70 0.00 0.00 55.95 58.09 2e9i s SER 2 Cb 0.00 -2.52 -0.08 0.00 -1.71 0.00 0.00 66.02 61.71 2e9i s SER 2 CO 0.00 -0.05 1.41 0.28 1.20 0.00 0.00 173.24 176.08 2e9i h SER 3 N 3.18 -1.40 0.00 5.45 0.02 -2.13 -3.46 113.55 115.21 2e9i h SER 3 Ca -0.47 0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 2e9i h SER 3 Cb 1.19 0.57 0.00 0.00 0.14 0.00 0.00 62.40 64.31 2e9i h SER 3 CO 0.65 -0.30 0.00 0.61 -1.14 0.00 0.00 176.83 176.65 2e9i n GLY 4 N -1.28 1.14 2.94 -3.77 0.00 -1.26 -5.14 105.19 97.82 2e9i n GLY 4 Ca -0.03 0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 2e9i n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2e9i s SER 5 N 0.00 4.13 0.07 1.61 1.04 -1.26 -5.09 113.70 114.20 2e9i s SER 5 Ca 0.00 -1.48 -0.26 0.00 0.48 0.00 0.00 55.95 54.69 2e9i s SER 5 Cb 0.00 -1.26 0.09 0.00 0.10 0.00 0.00 66.02 64.94 2e9i s SER 5 CO 0.00 -0.29 0.74 -0.55 0.98 0.00 0.00 173.24 174.12 2e9i s SER 6 N 1.29 -0.48 -1.12 7.02 0.15 -1.26 -5.05 113.70 114.26 2e9i s SER 6 Ca -0.00 0.05 -0.12 0.00 0.70 0.00 0.00 55.95 56.58 2e9i s SER 6 Cb -0.19 0.49 -0.07 0.00 -1.71 0.00 0.00 66.02 64.55 2e9i s SER 6 CO -0.09 -0.78 2.27 0.61 1.20 0.00 0.00 173.24 176.45 2e9i n GLY 7 N -0.22 3.43 3.37 9.45 0.00 -1.26 -4.86 105.19 115.10 2e9i n GLY 7 Ca -0.13 -1.19 -0.23 0.00 0.00 0.00 0.00 46.02 44.46 2e9i n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2e9i s ARG 8 N 3.47 1.38 -0.38 1.61 0.52 -1.26 -5.06 118.95 119.23 2e9i s ARG 8 Ca 0.51 -1.48 -0.38 0.00 -0.52 0.00 0.00 55.73 53.86 2e9i s ARG 8 Cb 0.13 -1.49 -0.14 0.00 0.52 0.00 0.00 34.95 33.97 2e9i s ARG 8 CO -0.01 0.30 2.12 0.28 0.02 0.00 0.00 175.30 178.01 2e9i n VAL 9 N 0.17 0.15 -4.58 3.52 0.31 -1.26 -4.92 118.33 111.73 2e9i n VAL 9 Ca -0.12 -0.17 -0.27 0.00 -0.01 0.00 0.00 64.34 63.77 2e9i n VAL 9 Cb 0.57 -1.30 -0.09 0.00 -0.91 0.00 0.00 33.84 32.12 2e9i n VAL 9 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2e9i s LYS 10 N 5.83 1.95 0.62 5.55 1.02 -1.26 -5.14 119.74 128.30 2e9i s LYS 10 Ca 1.11 -2.18 -0.14 0.00 0.02 0.00 0.00 55.97 54.79 2e9i s LYS 10 Cb -1.05 -1.03 -0.03 0.00 -0.52 0.00 0.00 37.83 35.21 2e9i s LYS 10 CO 0.56 -0.34 1.05 -1.21 -0.92 0.00 0.00 175.35 174.48 2e9i s GLU 11 N -3.80 3.30 0.27 1.68 2.02 -1.26 -4.96 118.70 115.96 2e9i s GLU 11 Ca 0.23 1.04 -0.28 0.00 0.02 0.00 0.00 54.97 55.98 2e9i s GLU 11 Cb 0.04 -2.04 -0.15 0.00 0.10 0.00 0.00 34.13 32.09 2e9i s GLU 11 CO 0.12 -0.81 0.88 0.43 0.02 0.00 0.00 175.26 175.89 2e9i n SER 12 N -2.41 0.61 -4.66 -0.19 7.64 -1.26 -4.81 113.62 108.55 2e9i n SER 12 Ca 0.08 1.16 -0.42 0.00 1.01 0.00 0.00 58.87 60.70 2e9i n SER 12 Cb 0.53 -1.20 -0.03 0.00 -1.01 0.00 0.00 64.21 62.51 2e9i n SER 12 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 2e9i s ILE 13 N -1.05 3.28 0.49 0.44 2.07 -1.26 -4.86 121.20 120.30 2e9i s ILE 13 Ca 0.60 0.33 0.15 0.00 -1.41 0.00 0.00 60.65 60.32 2e9i s ILE 13 Cb -0.76 -3.22 0.23 0.00 0.13 0.00 0.00 42.46 38.84 2e9i s ILE 13 CO 0.59 -0.04 2.08 0.00 -1.91 0.00 0.00 174.94 175.66 2e9i h THR 14 N 5.71 1.06 -5.43 4.00 1.03 -2.05 -3.46 112.91 113.77 2e9i h THR 14 Ca -0.44 -0.26 -0.41 0.00 -0.01 0.00 0.00 66.41 65.29 2e9i h THR 14 Cb 1.21 1.12 0.10 0.00 -1.07 0.00 0.00 68.15 69.51 2e9i h THR 14 CO 0.95 0.07 -0.66 -1.14 -0.01 0.00 0.00 175.52 174.73 2e9i n ARG 15 N -4.45 -6.76 -4.28 0.00 3.00 -1.26 -2.01 116.66 100.90 2e9i n ARG 15 Ca -0.03 0.84 -0.38 0.00 -0.00 0.00 0.00 57.85 58.29 2e9i n ARG 15 Cb 0.15 -5.82 -0.03 0.00 0.00 0.00 0.00 32.46 26.76 2e9i n ARG 15 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 2e9i n THR 16 N -4.82 -0.86 -4.15 5.15 -2.24 -1.26 -0.81 114.28 105.28 2e9i n THR 16 Ca -0.03 -0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.43 2e9i n THR 16 Cb 0.58 -1.50 -0.08 0.00 -2.10 0.00 0.00 70.33 67.23 2e9i n THR 16 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2e9i n SER 17 N -2.62 -0.13 -4.55 3.42 2.88 -0.85 -4.46 113.62 107.30 2e9i n SER 17 Ca 0.09 -1.13 -0.37 0.00 -1.33 0.00 0.00 58.87 56.13 2e9i n SER 17 Cb 0.48 -1.41 -0.03 0.00 -0.75 0.00 0.00 64.21 62.50 2e9i n SER 17 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 2e9i s ARG 18 N -6.76 2.23 0.26 -1.46 6.06 0.01 -4.94 118.95 114.34 2e9i s ARG 18 Ca 0.30 1.40 -0.10 0.00 -2.50 0.00 0.00 55.73 54.83 2e9i s ARG 18 Cb -0.17 -4.55 -0.07 0.00 0.06 0.00 0.00 34.95 30.21 2e9i s ARG 18 CO 0.90 -3.14 0.59 0.00 -2.50 0.00 0.00 175.30 171.15 2e9i s ALA 19 N 11.65 3.52 -0.87 6.12 0.00 -1.26 -4.99 121.76 135.93 2e9i s ALA 19 Ca 0.95 -0.24 -0.25 0.00 0.00 0.00 0.00 51.96 52.43 2e9i s ALA 19 Cb -0.18 -2.49 -0.04 0.00 0.00 0.00 0.00 23.12 20.41 2e9i s ALA 19 CO 0.26 0.43 1.94 -1.25 0.00 0.00 0.00 175.76 177.15 2e9i s PRO 20 N -2.95 2.56 -0.20 0.00 0.04 -1.26 -4.87 135.00 128.32 2e9i s PRO 20 Ca 0.48 -0.19 -0.28 0.00 0.04 0.00 0.00 61.00 61.06 2e9i s PRO 20 Cb -0.11 -4.99 0.10 0.00 0.04 0.00 0.00 34.50 29.55 2e9i s PRO 20 CO 0.22 -3.31 0.88 -1.54 0.04 0.00 0.00 177.00 173.29 2e9i s SER 21 N 8.05 -0.54 -0.24 6.66 1.04 -1.26 -5.15 113.70 122.25 2e9i s SER 21 Ca 0.70 0.86 -0.09 0.00 0.48 0.00 0.00 55.95 57.89 2e9i s SER 21 Cb -0.07 0.80 -0.04 0.00 0.10 0.00 0.00 66.02 66.81 2e9i s SER 21 CO 0.02 -0.32 0.13 -0.69 0.98 0.00 0.00 173.24 173.36 2e9i s VAL 22 N -0.36 4.99 -0.18 5.02 1.01 -1.26 -5.05 120.40 124.57 2e9i s VAL 22 Ca -0.02 0.06 -0.13 0.00 0.00 0.00 0.00 61.98 61.89 2e9i s VAL 22 Cb -0.03 -3.33 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 2e9i s VAL 22 CO 0.01 0.33 0.24 0.00 0.00 0.00 0.00 175.10 175.68 2e9i s ALA 23 N 1.29 3.62 0.35 5.51 0.00 -1.26 -5.08 121.76 126.19 2e9i s ALA 23 Ca 0.06 -0.54 0.06 0.00 0.00 0.00 0.00 51.96 51.54 2e9i s ALA 23 Cb -0.14 -2.33 -0.01 0.00 0.00 0.00 0.00 23.12 20.64 2e9i s ALA 23 CO 0.06 0.09 0.49 0.99 0.00 0.00 0.00 175.76 177.39 2e9i s THR 24 N 0.48 4.00 -0.09 0.00 2.01 -1.26 -2.00 115.64 118.78 2e9i s THR 24 Ca 0.14 -0.96 0.01 0.00 0.31 0.00 0.00 61.69 61.18 2e9i s THR 24 Cb -0.12 -3.39 -0.02 0.00 0.01 0.00 0.00 72.50 68.97 2e9i s THR 24 CO 0.02 -0.16 -0.10 0.54 -0.69 0.00 0.00 174.62 174.24 2e9i s VAL 25 N -2.21 3.42 -0.75 3.82 0.11 -1.19 -4.67 120.40 118.92 2e9i s VAL 25 Ca 0.46 -0.56 -0.01 0.00 -2.93 0.00 0.00 61.98 58.94 2e9i s VAL 25 Cb -0.10 -2.41 -0.01 0.00 -1.53 0.00 0.00 36.38 32.33 2e9i s VAL 25 CO 0.32 0.56 0.63 0.61 -3.33 0.00 0.00 175.10 173.89 2e9i n GLY 26 N 2.77 -0.15 3.64 6.54 0.00 -1.26 -4.92 105.19 111.81 2e9i n GLY 26 Ca -0.18 -0.03 -0.06 0.00 0.00 0.00 0.00 46.02 45.76 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 -3.74 -0.47 -0.65 1.61 0.01 -1.26 -5.09 113.70 104.11 2e9i s SER 27 Ca 0.06 0.83 -0.29 0.00 1.31 0.00 0.00 55.95 57.86 2e9i s SER 27 Cb -0.01 0.99 -0.13 0.00 0.21 0.00 0.00 66.02 67.08 2e9i s SER 27 CO 0.47 -0.14 2.50 -0.38 0.41 0.00 0.00 173.24 176.10 2e9i n ILE 28 N 2.82 -0.03 -3.16 1.44 5.41 -1.26 -4.47 119.36 120.12 2e9i n ILE 28 Ca -0.15 -0.47 -0.40 0.00 1.00 0.00 0.00 62.75 62.73 2e9i n ILE 28 Cb 0.57 -1.90 -0.06 0.00 -0.71 0.00 0.00 39.64 37.53 2e9i n ILE 28 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2e9i s ASP 30 N 1.30 6.33 -0.69 0.00 -4.77 -1.26 -3.13 116.67 114.45 2e9i s ASP 30 Ca 0.26 -0.43 -0.18 0.00 -3.30 0.00 0.00 52.55 48.90 2e9i s ASP 30 Cb -0.16 -2.39 0.13 0.00 -1.09 0.00 0.00 42.92 39.42 2e9i s ASP 30 CO 0.09 -1.08 0.78 -0.22 0.70 0.00 0.00 175.17 175.44 2e9i s LEU 31 N 3.48 5.64 -0.28 2.11 2.96 0.59 -4.95 118.68 128.23 2e9i s LEU 31 Ca 0.27 -1.80 -0.29 0.00 -0.22 0.00 0.00 54.13 52.09 2e9i s LEU 31 Cb -0.14 -2.30 0.01 0.00 0.50 0.00 0.00 46.19 44.27 2e9i s LEU 31 CO 0.18 -0.99 1.06 0.21 -1.32 0.00 0.00 176.35 175.50 2e9i s ASN 32 N 3.35 6.99 -0.05 3.68 2.47 -1.26 -2.53 114.94 127.59 2e9i s ASN 32 Ca 0.16 1.18 0.06 0.00 0.42 0.00 0.00 52.86 54.68 2e9i s ASN 32 Cb -0.19 -2.54 -0.01 0.00 -1.45 0.00 0.00 41.25 37.06 2e9i s ASN 32 CO 0.01 -0.80 -0.23 -0.76 -3.72 0.00 0.00 177.10 171.60 2e9i s LEU 33 N 3.48 2.21 -1.13 3.21 1.43 -1.18 -5.04 118.68 121.66 2e9i s LEU 33 Ca 0.45 -0.45 -0.06 0.00 -1.03 0.00 0.00 54.13 53.05 2e9i s LEU 33 Cb -0.13 -1.41 0.06 0.00 0.03 0.00 0.00 46.19 44.74 2e9i s LEU 33 CO 0.12 0.27 2.61 0.29 0.23 0.00 0.00 176.35 179.86 2e9i n LYS 34 N 2.80 3.93 -2.21 1.70 4.76 -1.26 -3.69 118.16 124.19 2e9i n LYS 34 Ca -0.17 -2.94 -0.41 0.00 -2.87 0.00 0.00 58.31 51.92 2e9i n LYS 34 Cb 0.52 -2.53 -0.03 0.00 -1.84 0.00 0.00 35.03 31.15 2e9i n LYS 34 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2e9i s ILE 35 N -0.78 2.99 0.00 -0.18 1.01 -1.26 -5.01 121.20 117.97 2e9i s ILE 35 Ca 0.58 0.94 0.00 0.00 0.00 0.00 0.00 60.65 62.17 2e9i s ILE 35 Cb 0.23 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 39.10 2e9i s ILE 35 CO -0.11 0.20 0.00 -0.81 0.00 0.00 0.00 174.94 174.22 2e9i n PRO 36 N 1.44 -0.10 0.09 2.79 -0.04 -1.26 -3.75 135.00 134.17 2e9i n PRO 36 Ca 0.02 0.00 0.20 0.00 -0.04 0.00 0.00 63.50 63.68 2e9i n PRO 36 Cb 0.43 0.00 0.69 0.00 -0.04 0.00 0.00 33.50 34.58 2e9i n PRO 36 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2e9i h GLU 37 N 0.00 0.00 -4.90 0.54 4.39 -1.96 -3.41 114.58 109.25 2e9i h GLU 37 Ca 0.00 0.00 -0.62 0.00 0.34 0.00 0.00 59.36 59.08 2e9i h GLU 37 Cb 0.00 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.61 2e9i h GLU 37 CO 0.00 0.00 1.12 -0.89 -1.16 0.00 0.00 179.01 178.08 2e9i n ILE 38 N -3.49 0.00 -0.48 3.13 5.41 -1.26 -4.85 119.36 117.83 2e9i n ILE 38 Ca 0.08 0.00 -0.23 0.00 1.00 0.00 0.00 62.75 63.61 2e9i n ILE 38 Cb 0.73 -0.41 0.19 0.00 -0.71 0.00 0.00 39.64 39.43 2e9i n ILE 38 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2e9i n ASN 39 N 6.42 -3.14 -0.10 4.38 3.02 -1.26 -4.96 115.26 119.61 2e9i n ASN 39 Ca 0.46 -0.45 -0.20 0.00 -0.03 0.00 0.00 54.58 54.36 2e9i n ASN 39 Cb -0.03 -0.85 -0.08 0.00 -0.61 0.00 0.00 39.78 38.21 2e9i n ASN 39 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2e9i n SER 40 N -2.39 1.68 0.07 6.41 2.88 -1.26 -3.95 113.62 117.06 2e9i n SER 40 Ca 0.07 0.17 0.17 0.00 -1.33 0.00 0.00 58.87 57.95 2e9i n SER 40 Cb 0.44 -0.54 0.42 0.00 -0.75 0.00 0.00 64.21 63.78 2e9i n SER 40 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2e9i h SER 41 N -0.58 0.00 0.12 -3.46 0.87 -1.98 0.88 113.55 109.40 2e9i h SER 41 Ca -0.51 0.00 -0.36 0.00 -1.23 0.00 0.00 61.79 59.69 2e9i h SER 41 Cb 1.50 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.42 2e9i h SER 41 CO -0.26 0.00 -2.16 0.47 -0.53 0.00 0.00 176.83 174.34 2e9i n ASP 42 N -3.06 1.63 -4.62 6.23 8.00 -1.26 -4.97 116.55 118.49 2e9i n ASP 42 Ca 0.10 0.10 -0.29 0.00 0.71 0.00 0.00 54.79 55.41 2e9i n ASP 42 Cb 1.05 -0.36 0.20 0.00 -0.02 0.00 0.00 41.12 41.99 2e9i n ASP 42 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 2e9i s MET 43 N -2.54 0.05 -0.08 -1.24 -1.94 0.30 -3.87 119.30 109.98 2e9i s MET 43 Ca -0.22 0.64 -0.06 0.00 -1.71 0.00 0.00 55.69 54.34 2e9i s MET 43 Cb 0.08 -1.68 0.03 0.00 2.01 0.00 0.00 34.83 35.26 2e9i s MET 43 CO 0.73 -3.02 0.21 -1.12 -0.01 0.00 0.00 175.02 171.81 2e9i s SER 44 N -3.17 -0.21 -0.07 3.03 0.01 -0.89 -4.95 113.70 107.45 2e9i s SER 44 Ca 0.66 0.43 -0.00 0.00 1.31 0.00 0.00 55.95 58.35 2e9i s SER 44 Cb -0.20 0.38 0.02 0.00 0.21 0.00 0.00 66.02 66.43 2e9i s SER 44 CO 0.60 -0.11 -0.04 0.00 0.41 0.00 0.00 173.24 174.09 2e9i s ALA 45 N 0.66 0.87 -0.15 1.44 0.00 -1.25 -2.40 121.76 120.94 2e9i s ALA 45 Ca -0.05 -0.22 -0.07 0.00 0.00 0.00 0.00 51.96 51.62 2e9i s ALA 45 Cb -0.06 -0.67 0.06 0.00 0.00 0.00 0.00 23.12 22.45 2e9i s ALA 45 CO -0.04 -0.28 0.34 -1.01 0.00 0.00 0.00 175.76 174.78 2e9i s HIS 46 N 1.50 -0.52 -0.29 0.00 3.76 -0.91 -1.69 115.29 117.15 2e9i s HIS 46 Ca -0.01 1.12 -0.25 0.00 -0.15 0.00 0.00 55.06 55.77 2e9i s HIS 46 Cb -0.13 0.17 0.00 0.00 1.11 0.00 0.00 32.58 33.73 2e9i s HIS 46 CO -0.04 -0.33 0.86 0.08 -0.85 0.00 0.00 174.74 174.46 2e9i s VAL 47 N 1.61 4.76 0.26 -0.90 1.01 -0.78 0.07 120.40 126.42 2e9i s VAL 47 Ca -0.07 1.41 -0.11 0.00 0.00 0.00 0.00 61.98 63.21 2e9i s VAL 47 Cb -0.10 -4.19 -0.08 0.00 0.00 0.00 0.00 36.38 32.02 2e9i s VAL 47 CO -0.11 -0.23 0.60 -0.89 0.00 0.00 0.00 175.10 174.46 2e9i s THR 48 N 3.04 4.87 0.19 3.92 2.01 0.25 -0.66 115.64 129.26 2e9i s THR 48 Ca 0.36 0.57 0.05 0.00 0.31 0.00 0.00 61.69 62.98 2e9i s THR 48 Cb -0.14 -3.62 -0.04 0.00 0.01 0.00 0.00 72.50 68.71 2e9i s THR 48 CO 0.11 -0.12 0.22 -0.44 -0.69 0.00 0.00 174.62 173.71 2e9i s SER 49 N -2.38 5.88 0.00 3.53 0.01 0.16 -3.23 113.70 117.67 2e9i s SER 49 Ca 0.49 -0.04 0.12 0.00 1.31 0.00 0.00 55.95 57.83 2e9i s SER 49 Cb -0.11 -1.63 0.69 0.00 0.21 0.00 0.00 66.02 65.18 2e9i s SER 49 CO 0.21 0.02 1.12 -0.81 0.41 0.00 0.00 173.24 174.19 2e9i n PRO 50 N -0.72 0.49 -0.08 12.44 -0.04 -1.24 -2.63 135.00 143.22 2e9i n PRO 50 Ca -0.08 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.28 2e9i n PRO 50 Cb 0.55 -1.37 -0.08 0.00 -0.04 0.00 0.00 33.50 32.56 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 -0.87 2.48 0.00 3.54 3.41 -1.26 -5.01 113.62 115.91 2e9i n SER 51 Ca 0.09 -0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 2e9i n SER 51 Cb 0.04 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 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 2.58 0.70 3.80 5.00 0.00 -1.08 -5.14 105.19 111.05 2e9i n GLY 52 Ca -0.28 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.41 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 3.75 -0.00 1.61 3.00 -1.26 -4.77 118.95 121.28 2e9i s ARG 53 Ca 0.00 1.34 0.02 0.00 0.00 0.00 0.00 55.73 57.09 2e9i s ARG 53 Cb 0.00 -2.09 -0.01 0.00 0.00 0.00 0.00 34.95 32.86 2e9i s ARG 53 CO 0.00 -0.47 -0.07 0.08 0.00 0.00 0.00 175.30 174.84 2e9i s VAL 54 N -2.03 0.56 0.25 3.52 1.01 -1.26 0.41 120.40 122.85 2e9i s VAL 54 Ca 0.67 -0.35 0.09 0.00 0.00 0.00 0.00 61.98 62.38 2e9i s VAL 54 Cb -0.16 -0.48 -0.04 0.00 0.00 0.00 0.00 36.38 35.70 2e9i s VAL 54 CO 0.22 0.12 0.06 -0.89 0.00 0.00 0.00 175.10 174.61 2e9i s THR 55 N -0.24 3.79 -0.20 3.92 2.01 0.16 -4.96 115.64 120.12 2e9i s THR 55 Ca 0.02 -1.70 -0.09 0.00 0.31 0.00 0.00 61.69 60.23 2e9i s THR 55 Cb -0.03 -3.02 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 2e9i s THR 55 CO -0.00 -0.34 0.10 -0.70 -0.69 0.00 0.00 174.62 172.99 2e9i s GLU 56 N -3.65 4.04 0.01 4.92 2.12 -1.26 -1.86 118.70 123.02 2e9i s GLU 56 Ca 0.31 -0.30 0.01 0.00 0.36 0.00 0.00 54.97 55.35 2e9i s GLU 56 Cb -0.07 -3.34 -0.04 0.00 0.26 0.00 0.00 34.13 30.94 2e9i s GLU 56 CO 0.21 0.22 0.07 0.00 -0.54 0.00 0.00 175.26 175.21 2e9i s ALA 57 N 0.57 3.53 -0.04 6.30 0.00 -0.68 -4.94 121.76 126.49 2e9i s ALA 57 Ca 0.05 -0.92 -0.10 0.00 0.00 0.00 0.00 51.96 51.00 2e9i s ALA 57 Cb -0.12 -1.51 -0.05 0.00 0.00 0.00 0.00 23.12 21.44 2e9i s ALA 57 CO 0.01 0.70 0.27 -2.00 0.00 0.00 0.00 175.76 174.74 2e9i s GLU 58 N -1.85 3.65 -0.52 0.00 2.56 -1.26 -4.64 118.70 116.64 2e9i s GLU 58 Ca 0.24 0.09 -0.12 0.00 0.00 0.00 0.00 54.97 55.17 2e9i s GLU 58 Cb -0.12 -3.17 0.13 0.00 2.00 0.00 0.00 34.13 32.97 2e9i s GLU 58 CO 0.15 0.71 0.44 0.42 -0.56 0.00 0.00 175.26 176.42 2e9i s ILE 59 N -1.12 4.74 0.24 -3.70 1.01 -1.26 -3.97 121.20 117.14 2e9i s ILE 59 Ca 0.21 -1.71 -0.30 0.00 0.00 0.00 0.00 60.65 58.86 2e9i s ILE 59 Cb -0.14 -4.07 -0.09 0.00 0.01 0.00 0.00 42.46 38.17 2e9i s ILE 59 CO 0.10 -0.84 1.33 -0.69 0.00 0.00 0.00 174.94 174.85 2e9i s VAL 60 N 1.39 3.00 -0.56 2.92 1.01 -0.80 -4.93 120.40 122.43 2e9i s VAL 60 Ca 0.05 0.87 -0.27 0.00 0.00 0.00 0.00 61.98 62.63 2e9i s VAL 60 Cb -0.27 -3.55 -0.02 0.00 0.00 0.00 0.00 36.38 32.54 2e9i s VAL 60 CO 0.01 0.15 1.83 -2.16 0.00 0.00 0.00 175.10 174.93 2e9i s PRO 61 N -0.54 2.78 0.00 2.72 0.04 -1.26 -3.42 135.00 135.31 2e9i s PRO 61 Ca 0.55 0.75 0.00 0.00 0.04 0.00 0.00 61.00 62.34 2e9i s PRO 61 Cb -0.38 -4.34 0.00 0.00 0.04 0.00 0.00 34.50 29.82 2e9i s PRO 61 CO 0.42 -2.55 0.00 -1.33 0.04 0.00 0.00 177.00 173.58 2e9i n MET 62 N 9.02 0.00 0.00 4.56 2.81 -1.25 -5.02 117.12 127.24 2e9i n MET 62 Ca 0.21 0.25 0.00 0.00 -1.81 0.00 0.00 57.70 56.34 2e9i n MET 62 Cb 0.51 -0.72 0.00 0.00 -0.71 0.00 0.00 33.22 32.30 2e9i n MET 62 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2e9i n GLY 63 N 2.19 -0.90 3.64 3.03 0.00 -1.23 -5.01 105.19 106.92 2e9i n GLY 63 Ca 0.00 0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.05 3.95 -1.77 1.61 -2.85 -1.26 -3.03 119.74 116.34 2e9i s LYS 64 Ca 0.00 2.05 -0.18 0.00 -1.00 0.00 0.00 55.97 56.83 2e9i s LYS 64 Cb 0.00 -4.06 0.17 0.00 -2.06 0.00 0.00 37.83 31.88 2e9i s LYS 64 CO 0.00 -1.13 0.58 0.27 0.10 0.00 0.00 175.35 175.17 2e9i n ASN 65 N 8.04 -1.88 -4.07 0.03 6.94 -1.26 -4.92 115.26 118.14 2e9i n ASN 65 Ca 0.19 -1.17 -0.19 0.00 -0.02 0.00 0.00 54.58 53.39 2e9i n ASN 65 Cb 0.44 -2.03 -0.14 0.00 -2.36 0.00 0.00 39.78 35.69 2e9i n ASN 65 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 2e9i s SER 66 N -3.45 1.29 -0.05 0.53 0.01 -1.17 -4.05 113.70 106.81 2e9i s SER 66 Ca 0.67 -0.28 -0.14 0.00 1.31 0.00 0.00 55.95 57.51 2e9i s SER 66 Cb -0.38 -0.11 0.03 0.00 0.21 0.00 0.00 66.02 65.76 2e9i s SER 66 CO 0.99 0.08 0.31 -1.00 0.41 0.00 0.00 173.24 174.03 2e9i s HIS 67 N -0.49 -0.24 -0.06 2.43 3.76 -1.24 -3.49 115.29 115.96 2e9i s HIS 67 Ca 0.02 0.46 0.00 0.00 -0.15 0.00 0.00 55.06 55.39 2e9i s HIS 67 Cb -0.05 0.10 0.02 0.00 1.11 0.00 0.00 32.58 33.76 2e9i s HIS 67 CO 0.00 -0.32 -0.04 0.00 -0.85 0.00 0.00 174.74 173.53 2e9i s VAL 69 N 1.37 4.15 -0.12 0.00 1.01 -1.05 -1.91 120.40 123.85 2e9i s VAL 69 Ca -0.04 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.68 2e9i s VAL 69 Cb -0.13 -2.82 0.02 0.00 0.00 0.00 0.00 36.38 33.45 2e9i s VAL 69 CO -0.03 0.51 -0.11 0.00 0.00 0.00 0.00 175.10 175.47 2e9i s ARG 70 N 0.14 1.85 0.25 2.72 1.70 -1.25 -0.30 118.95 124.06 2e9i s ARG 70 Ca 0.00 -0.40 -0.20 0.00 -0.47 0.00 0.00 55.73 54.67 2e9i s ARG 70 Cb -0.13 -1.75 0.02 0.00 -0.57 0.00 0.00 34.95 32.52 2e9i s ARG 70 CO 0.02 -0.20 0.65 -0.59 -1.08 0.00 0.00 175.30 174.10 2e9i s PHE 71 N 1.43 -0.15 -0.66 5.89 -0.12 -1.18 -4.49 117.98 118.69 2e9i s PHE 71 Ca 0.01 -0.25 -0.11 0.00 -0.05 0.00 0.00 56.93 56.53 2e9i s PHE 71 Cb -0.13 0.58 0.17 0.00 -0.63 0.00 0.00 43.02 43.01 2e9i s PHE 71 CO -0.07 -1.12 0.57 0.08 -0.05 0.00 0.00 175.22 174.63 2e9i s VAL 72 N -3.91 4.89 -1.16 -2.49 1.01 -1.26 -0.94 120.40 116.55 2e9i s VAL 72 Ca 0.11 -2.25 -0.23 0.00 0.00 0.00 0.00 61.98 59.61 2e9i s VAL 72 Cb -0.04 -4.10 -0.08 0.00 0.00 0.00 0.00 36.38 32.15 2e9i s VAL 72 CO 0.04 -0.92 1.94 -2.16 0.00 0.00 0.00 175.10 173.99 2e9i s PRO 73 N 0.62 2.49 -0.24 2.72 0.04 -1.26 -4.87 135.00 134.51 2e9i s PRO 73 Ca 0.13 -1.08 0.02 0.00 0.04 0.00 0.00 61.00 60.11 2e9i s PRO 73 Cb -0.19 -5.22 0.05 0.00 0.04 0.00 0.00 34.50 29.17 2e9i s PRO 73 CO -0.04 -3.93 -0.13 1.14 0.04 0.00 0.00 177.00 174.08 2e9i s GLN 74 N 6.53 2.49 0.35 4.56 -2.07 -1.26 -4.19 119.66 126.07 2e9i s GLN 74 Ca 0.69 -1.18 0.04 0.00 -1.82 0.00 0.00 55.36 53.08 2e9i s GLN 74 Cb -0.01 -2.82 -0.01 0.00 -1.09 0.00 0.00 33.01 29.07 2e9i s GLN 74 CO 0.12 -0.46 0.38 -1.21 -1.32 0.00 0.00 175.29 172.80 2e9i s GLU 75 N 1.17 1.89 -0.00 9.60 2.02 -1.26 -5.04 118.70 127.08 2e9i s GLU 75 Ca -0.04 -1.94 0.21 0.00 0.02 0.00 0.00 54.97 53.21 2e9i s GLU 75 Cb -0.18 0.38 0.59 0.00 0.10 0.00 0.00 34.13 35.03 2e9i s GLU 75 CO -0.07 -0.74 1.49 -1.33 0.02 0.00 0.00 175.26 174.63 2e9i n MET 76 N -0.63 2.55 0.00 1.61 2.81 -1.26 -4.96 117.12 117.25 2e9i n MET 76 Ca 0.05 -2.41 0.00 0.00 -1.81 0.00 0.00 57.70 53.52 2e9i n MET 76 Cb 0.62 -1.52 0.00 0.00 -0.71 0.00 0.00 33.22 31.61 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 1.57 2.92 3.88 3.03 0.00 -1.26 -5.06 105.19 110.27 2e9i n GLY 77 Ca 0.22 0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.99 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 0.98 4.80 -0.03 1.61 0.11 -1.26 -4.73 120.40 121.88 2e9i s VAL 78 Ca 0.00 0.59 0.04 0.00 -2.93 0.00 0.00 61.98 59.68 2e9i s VAL 78 Cb 0.00 -3.74 -0.03 0.00 -1.53 0.00 0.00 36.38 31.08 2e9i s VAL 78 CO 0.00 -0.54 -0.14 -1.00 -3.33 0.00 0.00 175.10 170.09 2e9i s HIS 79 N -2.39 2.69 -0.04 1.54 0.09 -1.07 -3.68 115.29 112.44 2e9i s HIS 79 Ca 0.51 -0.17 0.00 0.00 -0.00 0.00 0.00 55.06 55.40 2e9i s HIS 79 Cb -0.10 -1.59 0.03 0.00 -0.00 0.00 0.00 32.58 30.91 2e9i s HIS 79 CO 0.32 0.22 -0.00 0.99 -0.00 0.00 0.00 174.74 176.27 2e9i s THR 80 N -0.80 0.22 -0.06 1.30 2.01 -1.20 -1.23 115.64 115.89 2e9i s THR 80 Ca 0.13 0.08 -0.22 0.00 0.31 0.00 0.00 61.69 61.99 2e9i s THR 80 Cb -0.11 -0.32 -0.04 0.00 0.01 0.00 0.00 72.50 72.04 2e9i s THR 80 CO 0.02 0.17 0.63 -0.69 -0.69 0.00 0.00 174.62 174.06 2e9i s VAL 81 N 1.15 5.03 -0.76 3.82 1.01 -0.41 -0.58 120.40 129.66 2e9i s VAL 81 Ca -0.08 1.30 -0.13 0.00 0.00 0.00 0.00 61.98 63.08 2e9i s VAL 81 Cb -0.13 -3.97 0.20 0.00 0.00 0.00 0.00 36.38 32.47 2e9i s VAL 81 CO -0.02 0.31 0.68 -0.44 0.00 0.00 0.00 175.10 175.63 2e9i s SER 82 N 0.50 6.47 -0.45 3.32 0.01 0.11 -1.83 113.70 121.83 2e9i s SER 82 Ca 0.34 -2.58 -0.09 0.00 1.31 0.00 0.00 55.95 54.92 2e9i s SER 82 Cb -0.17 -2.16 0.10 0.00 0.21 0.00 0.00 66.02 64.00 2e9i s SER 82 CO 0.16 -0.58 0.31 -0.69 0.41 0.00 0.00 173.24 172.85 2e9i s VAL 83 N 0.34 4.20 -0.08 3.43 1.01 -1.26 -2.14 120.40 125.91 2e9i s VAL 83 Ca 0.16 -1.65 0.05 0.00 0.00 0.00 0.00 61.98 60.53 2e9i s VAL 83 Cb -0.14 -3.70 -0.00 0.00 0.00 0.00 0.00 36.38 32.53 2e9i s VAL 83 CO -0.07 -0.68 -0.23 -0.54 0.00 0.00 0.00 175.10 173.58 2e9i s LYS 84 N 1.38 2.75 -0.43 2.72 1.02 -1.01 -1.57 119.74 124.60 2e9i s LYS 84 Ca 0.05 -0.85 -0.12 0.00 0.02 0.00 0.00 55.97 55.07 2e9i s LYS 84 Cb -0.25 -2.17 0.07 0.00 -0.52 0.00 0.00 37.83 34.96 2e9i s LYS 84 CO 0.00 0.24 0.30 -0.47 -0.92 0.00 0.00 175.35 174.51 2e9i s TYR 85 N 0.17 3.28 -1.56 3.18 5.04 0.39 -2.09 117.35 125.76 2e9i s TYR 85 Ca -0.13 -1.18 -0.05 0.00 -2.44 0.00 0.00 57.07 53.28 2e9i s TYR 85 Cb -0.16 -2.94 0.01 0.00 0.35 0.00 0.00 41.96 39.21 2e9i s TYR 85 CO 0.07 -0.79 0.64 0.54 -1.34 0.00 0.00 175.55 174.67 2e9i n ARG 86 N 5.05 -5.07 -1.96 4.97 1.74 -1.25 -2.36 116.66 117.77 2e9i n ARG 86 Ca -0.11 0.91 0.00 0.00 -0.77 0.00 0.00 57.85 57.88 2e9i n ARG 86 Cb 0.44 -5.79 0.00 0.00 -1.02 0.00 0.00 32.46 26.09 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 -1.55 0.78 2.80 -0.13 0.00 -1.26 -5.06 105.19 100.77 2e9i n GLY 87 Ca -0.11 -0.68 -0.15 0.00 0.00 0.00 0.00 46.02 45.08 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 -3.99 0.26 -0.03 1.61 -1.52 -0.99 -5.12 119.66 109.89 2e9i s GLN 88 Ca 0.00 0.26 -0.35 0.00 -1.95 0.00 0.00 55.36 53.31 2e9i s GLN 88 Cb 0.00 -0.90 -0.14 0.00 -0.22 0.00 0.00 33.01 31.75 2e9i s GLN 88 CO 0.00 -0.71 1.70 0.72 -0.25 0.00 0.00 175.29 176.75 2e9i n HIS 89 N 5.33 2.16 -0.98 0.91 8.25 -1.26 -0.47 115.22 129.16 2e9i n HIS 89 Ca -0.04 0.25 -0.30 0.00 -0.26 0.00 0.00 57.72 57.37 2e9i n HIS 89 Cb 0.49 -2.55 0.25 0.00 1.12 0.00 0.00 29.99 29.30 2e9i n HIS 89 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2e9i s VAL 90 N 2.60 1.53 0.45 1.59 -7.23 -0.61 -4.83 120.40 113.90 2e9i s VAL 90 Ca 0.89 0.00 -0.22 0.00 -1.81 0.00 0.00 61.98 60.83 2e9i s VAL 90 Cb -0.79 -2.43 -0.11 0.00 0.56 0.00 0.00 36.38 33.61 2e9i s VAL 90 CO 0.49 0.00 0.76 0.41 -0.31 0.00 0.00 175.10 176.45 2e9i n THR 91 N -4.90 2.26 -4.25 5.32 -1.04 -1.26 -1.80 114.28 108.60 2e9i n THR 91 Ca 0.13 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.05 61.31 2e9i n THR 91 Cb 0.60 -0.84 -0.08 0.00 -1.82 0.00 0.00 70.33 68.18 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 1.51 -0.22 3.28 3.41 0.00 -1.26 -4.91 105.19 106.99 2e9i n GLY 92 Ca 0.11 0.12 -0.28 0.00 0.00 0.00 0.00 46.02 45.97 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 -3.78 2.72 0.93 1.61 0.15 -0.75 -3.61 113.70 110.98 2e9i s SER 93 Ca 0.33 -0.49 -0.12 0.00 0.70 0.00 0.00 55.95 56.37 2e9i s SER 93 Cb -0.19 -0.26 0.15 0.00 -1.71 0.00 0.00 66.02 64.00 2e9i s SER 93 CO 0.94 0.23 1.09 -2.16 1.20 0.00 0.00 173.24 174.55 2e9i s PRO 94 N -0.93 0.96 -0.40 5.44 0.04 -1.26 -4.78 135.00 134.07 2e9i s PRO 94 Ca 0.09 0.71 -0.15 0.00 0.04 0.00 0.00 61.00 61.70 2e9i s PRO 94 Cb -0.09 -1.78 0.01 0.00 0.04 0.00 0.00 34.50 32.68 2e9i s PRO 94 CO 0.01 -2.42 0.31 -0.06 0.04 0.00 0.00 177.00 174.88 2e9i s PHE 95 N -2.94 3.23 0.12 0.56 0.08 -0.76 -4.86 117.98 113.40 2e9i s PHE 95 Ca 0.64 -0.49 -0.24 0.00 0.12 0.00 0.00 56.93 56.96 2e9i s PHE 95 Cb -0.18 -2.61 -0.07 0.00 -0.57 0.00 0.00 43.02 39.59 2e9i s PHE 95 CO 0.57 -0.56 0.73 -1.14 -0.10 0.00 0.00 175.22 174.72 2e9i s GLN 96 N 1.75 4.48 -0.20 0.44 0.74 -1.26 -1.29 119.66 124.31 2e9i s GLN 96 Ca 0.06 1.05 -0.16 0.00 0.05 0.00 0.00 55.36 56.35 2e9i s GLN 96 Cb -0.18 -3.28 0.06 0.00 1.10 0.00 0.00 33.01 30.70 2e9i s GLN 96 CO 0.11 0.51 0.53 -0.59 -0.55 0.00 0.00 175.29 175.29 2e9i s PHE 97 N -0.86 -0.64 -0.00 1.67 -0.12 -0.36 -4.86 117.98 112.80 2e9i s PHE 97 Ca 0.35 1.48 -0.16 0.00 -0.05 0.00 0.00 56.93 58.55 2e9i s PHE 97 Cb -0.22 0.26 -0.06 0.00 -0.63 0.00 0.00 43.02 42.38 2e9i s PHE 97 CO 0.24 -0.32 0.44 0.99 -0.05 0.00 0.00 175.22 176.52 2e9i s THR 98 N 0.64 5.00 -0.04 -4.49 2.01 -1.26 -2.59 115.64 114.91 2e9i s THR 98 Ca -0.03 0.91 -0.01 0.00 0.31 0.00 0.00 61.69 62.87 2e9i s THR 98 Cb -0.05 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.67 2e9i s THR 98 CO -0.04 0.55 0.04 -0.69 -0.69 0.00 0.00 174.62 173.78 2e9i s VAL 99 N -0.91 4.47 0.09 3.82 1.01 -1.26 -4.31 120.40 123.31 2e9i s VAL 99 Ca 0.25 -0.38 0.08 0.00 0.00 0.00 0.00 61.98 61.93 2e9i s VAL 99 Cb -0.17 -2.97 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 2e9i s VAL 99 CO 0.14 0.46 -0.15 -0.83 0.00 0.00 0.00 175.10 174.71 2e9i s GLY 100 N -1.37 1.70 0.34 4.51 0.00 -0.85 -4.94 107.32 106.71 2e9i s GLY 100 Ca 0.18 -1.27 -0.06 0.00 0.00 0.00 0.00 44.72 43.58 2e9i s GLY 100 CO 0.08 -1.22 0.31 -1.55 0.00 0.00 0.00 173.10 170.72 2e9i n PRO 101 N 0.99 -1.61 -2.73 2.90 -0.04 -1.26 -3.18 135.00 130.07 2e9i n PRO 101 Ca -0.15 -0.49 -0.28 0.00 -0.04 0.00 0.00 63.50 62.54 2e9i n PRO 101 Cb 0.52 -0.46 -0.01 0.00 -0.04 0.00 0.00 33.50 33.52 2e9i n PRO 101 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2e9i s LEU 102 N 0.00 3.70 0.57 1.53 1.43 -1.26 -4.86 118.68 119.78 2e9i s LEU 102 Ca 0.20 0.94 0.02 0.00 -1.03 0.00 0.00 54.13 54.26 2e9i s LEU 102 Cb -0.02 -3.88 0.05 0.00 0.03 0.00 0.00 46.19 42.37 2e9i s LEU 102 CO 0.15 -0.52 0.79 -0.83 0.23 0.00 0.00 176.35 176.17 2e9i s GLY 103 N -3.88 1.82 0.06 -3.19 0.00 -1.26 -5.12 107.32 95.75 2e9i s GLY 103 Ca 0.48 -1.45 0.07 0.00 0.00 0.00 0.00 44.72 43.82 2e9i s GLY 103 CO 0.41 -1.13 -0.20 -0.54 0.00 0.00 0.00 173.10 171.65 2e9i s GLU 104 N -4.78 1.27 0.00 2.90 0.41 -1.26 -5.10 118.70 112.14 2e9i s GLU 104 Ca 0.59 -0.97 0.00 0.00 -0.41 0.00 0.00 54.97 54.17 2e9i s GLU 104 Cb -0.09 -1.41 0.00 0.00 -1.78 0.00 0.00 34.13 30.85 2e9i s GLU 104 CO 0.39 0.35 0.00 0.41 -0.49 0.00 0.00 175.26 175.92 2e9i n GLY 105 N 1.67 0.88 0.00 -1.39 0.00 -1.26 -5.36 105.19 99.73 2e9i n GLY 105 Ca -0.18 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 43.87 2e9i n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93