#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 3.47 0.05 1.61 1.04 -1.26 -5.12 113.70 113.49 2e9i s SER 2 Ca 0.00 -0.99 0.03 0.00 0.48 0.00 0.00 55.95 55.47 2e9i s SER 2 Cb 0.00 -1.05 -0.02 0.00 0.10 0.00 0.00 66.02 65.05 2e9i s SER 2 CO 0.00 -0.23 -0.10 -0.55 0.98 0.00 0.00 173.24 173.34 2e9i s SER 3 N 1.51 1.15 0.61 7.02 0.15 -1.26 -5.16 113.70 117.73 2e9i s SER 3 Ca -0.03 -0.55 0.00 0.00 0.70 0.00 0.00 55.95 56.06 2e9i s SER 3 Cb -0.18 -0.00 0.00 0.00 -1.71 0.00 0.00 66.02 64.13 2e9i s SER 3 CO -0.07 -0.14 0.00 0.61 1.20 0.00 0.00 173.24 174.84 2e9i n GLY 4 N 1.47 -2.87 3.91 9.45 0.00 -1.26 -4.99 105.19 110.91 2e9i n GLY 4 Ca -0.22 -0.95 -0.27 0.00 0.00 0.00 0.00 46.02 44.58 2e9i n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2e9i s SER 5 N -1.87 5.86 0.36 1.61 0.15 -1.26 -5.10 113.70 113.45 2e9i s SER 5 Ca 0.00 0.80 0.07 0.00 0.70 0.00 0.00 55.95 57.52 2e9i s SER 5 Cb 0.00 -1.92 -0.01 0.00 -1.71 0.00 0.00 66.02 62.38 2e9i s SER 5 CO 0.00 -0.87 0.40 -0.94 1.20 0.00 0.00 173.24 173.03 2e9i s SER 6 N -4.23 5.49 0.00 5.45 1.04 -1.26 -5.10 113.70 115.10 2e9i s SER 6 Ca 0.51 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 56.50 2e9i s SER 6 Cb -0.10 -0.91 0.00 0.00 0.10 0.00 0.00 66.02 65.10 2e9i s SER 6 CO 0.45 -0.50 0.00 0.61 0.98 0.00 0.00 173.24 174.78 2e9i n GLY 7 N -1.56 4.43 3.47 7.32 0.00 -1.26 -5.07 105.19 112.52 2e9i n GLY 7 Ca 0.01 -1.43 -0.41 0.00 0.00 0.00 0.00 46.02 44.19 2e9i n GLY 7 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2e9i s ARG 8 N -3.41 3.14 -0.14 1.61 3.52 -1.26 -5.06 118.95 117.35 2e9i s ARG 8 Ca 0.00 -0.89 -0.00 0.00 -0.13 0.00 0.00 55.73 54.71 2e9i s ARG 8 Cb 0.00 -3.86 -0.01 0.00 -1.56 0.00 0.00 34.95 29.52 2e9i s ARG 8 CO 0.00 -0.62 -0.12 0.14 -0.81 0.00 0.00 175.30 173.88 2e9i s VAL 9 N 1.67 3.04 -1.56 7.11 -7.23 -1.26 -4.67 120.40 117.49 2e9i s VAL 9 Ca 0.05 -0.66 -0.07 0.00 -1.81 0.00 0.00 61.98 59.49 2e9i s VAL 9 Cb -0.18 -2.29 0.06 0.00 0.56 0.00 0.00 36.38 34.53 2e9i s VAL 9 CO 0.09 0.51 0.43 0.29 -0.31 0.00 0.00 175.10 176.11 2e9i n LYS 10 N 3.72 -2.48 -3.90 4.82 4.76 -1.26 -4.94 118.16 118.87 2e9i n LYS 10 Ca -0.18 0.30 -0.11 0.00 -2.87 0.00 0.00 58.31 55.45 2e9i n LYS 10 Cb 0.52 -4.46 -0.11 0.00 -1.84 0.00 0.00 35.03 29.14 2e9i n LYS 10 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2e9i s GLU 11 N -6.91 0.37 0.41 1.97 2.56 -1.26 -5.17 118.70 110.67 2e9i s GLU 11 Ca 0.26 -0.39 0.02 0.00 0.00 0.00 0.00 54.97 54.86 2e9i s GLU 11 Cb -0.15 0.15 -0.01 0.00 2.00 0.00 0.00 34.13 36.12 2e9i s GLU 11 CO 0.94 -0.08 0.61 -1.54 -0.56 0.00 0.00 175.26 174.63 2e9i s SER 12 N -1.18 5.92 -0.27 -1.70 1.04 -1.26 -5.04 113.70 111.21 2e9i s SER 12 Ca -0.13 0.21 -0.08 0.00 0.48 0.00 0.00 55.95 56.43 2e9i s SER 12 Cb -0.07 -1.54 -0.02 0.00 0.10 0.00 0.00 66.02 64.49 2e9i s SER 12 CO 0.00 -0.59 0.10 -0.63 0.98 0.00 0.00 173.24 173.10 2e9i s ILE 13 N -2.44 4.42 0.34 -1.02 1.09 -1.26 -5.07 121.20 117.26 2e9i s ILE 13 Ca 0.46 -0.23 -0.25 0.00 -1.10 0.00 0.00 60.65 59.53 2e9i s ILE 13 Cb -0.10 -3.12 -0.13 0.00 -1.06 0.00 0.00 42.46 38.04 2e9i s ILE 13 CO 0.36 0.26 0.77 0.35 -0.10 0.00 0.00 174.94 176.58 2e9i n THR 14 N 4.94 1.97 -1.33 2.92 -2.24 -1.26 -4.82 114.28 114.46 2e9i n THR 14 Ca -0.15 -0.50 -0.22 0.00 -2.27 0.00 0.00 64.05 60.91 2e9i n THR 14 Cb 0.51 -0.71 -0.09 0.00 -2.10 0.00 0.00 70.33 67.93 2e9i n THR 14 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2e9i n ARG 15 N 0.64 2.27 -3.51 -0.78 1.74 -1.26 -4.84 116.66 110.91 2e9i n ARG 15 Ca 0.11 -1.90 -0.14 0.00 -0.77 0.00 0.00 57.85 55.15 2e9i n ARG 15 Cb 0.35 -2.09 -0.04 0.00 -1.02 0.00 0.00 32.46 29.65 2e9i n ARG 15 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 2e9i s THR 16 N -1.18 0.01 -0.18 0.55 -1.32 -1.26 -5.09 115.64 107.18 2e9i s THR 16 Ca 0.62 -0.11 -0.12 0.00 -1.21 0.00 0.00 61.69 60.86 2e9i s THR 16 Cb 0.36 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 70.28 2e9i s THR 16 CO -0.15 -0.06 -0.28 -1.54 -2.21 0.00 0.00 174.62 170.38 2e9i n SER 17 N 0.25 1.62 -3.98 8.08 3.41 -1.26 -5.00 113.62 116.73 2e9i n SER 17 Ca -0.18 0.27 -0.24 0.00 -0.26 0.00 0.00 58.87 58.47 2e9i n SER 17 Cb 0.61 -0.65 -0.17 0.00 -0.26 0.00 0.00 64.21 63.75 2e9i n SER 17 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2e9i s ARG 18 N -2.52 1.46 0.43 4.33 6.06 -1.26 -5.14 118.95 122.32 2e9i s ARG 18 Ca -0.28 -0.32 -0.19 0.00 -2.50 0.00 0.00 55.73 52.45 2e9i s ARG 18 Cb 0.09 -1.27 -0.10 0.00 0.06 0.00 0.00 34.95 33.73 2e9i s ARG 18 CO 0.37 -0.02 0.92 0.00 -2.50 0.00 0.00 175.30 174.06 2e9i s ALA 19 N 0.81 3.10 0.72 6.12 0.00 -1.26 -5.05 121.76 126.21 2e9i s ALA 19 Ca -0.12 0.27 -0.12 0.00 0.00 0.00 0.00 51.96 51.98 2e9i s ALA 19 Cb -0.15 -3.06 0.03 0.00 0.00 0.00 0.00 23.12 19.94 2e9i s ALA 19 CO 0.02 0.07 1.10 -1.25 0.00 0.00 0.00 175.76 175.70 2e9i s PRO 20 N -3.38 2.48 -0.04 0.00 0.04 -1.26 -4.88 135.00 127.96 2e9i s PRO 20 Ca 0.60 1.27 -0.08 0.00 0.04 0.00 0.00 61.00 62.82 2e9i s PRO 20 Cb -0.09 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.54 2e9i s PRO 20 CO 0.19 -1.48 0.19 -1.12 0.04 0.00 0.00 177.00 174.81 2e9i s SER 21 N -3.04 -0.11 -0.11 6.66 0.01 -1.26 -4.97 113.70 110.87 2e9i s SER 21 Ca 0.64 0.13 -0.06 0.00 1.31 0.00 0.00 55.95 57.97 2e9i s SER 21 Cb -0.19 0.32 -0.04 0.00 0.21 0.00 0.00 66.02 66.33 2e9i s SER 21 CO 0.50 -0.23 0.11 -0.69 0.41 0.00 0.00 173.24 173.34 2e9i s VAL 22 N -0.64 5.21 0.09 3.43 1.01 -1.26 -3.27 120.40 124.97 2e9i s VAL 22 Ca -0.07 0.08 -0.24 0.00 0.00 0.00 0.00 61.98 61.75 2e9i s VAL 22 Cb -0.04 -3.26 0.06 0.00 0.00 0.00 0.00 36.38 33.14 2e9i s VAL 22 CO 0.01 0.60 0.58 0.00 0.00 0.00 0.00 175.10 176.30 2e9i s ALA 23 N -1.01 -1.52 0.26 5.51 0.00 -1.22 -4.98 121.76 118.81 2e9i s ALA 23 Ca 0.15 0.62 0.07 0.00 0.00 0.00 0.00 51.96 52.80 2e9i s ALA 23 Cb -0.12 0.60 -0.03 0.00 0.00 0.00 0.00 23.12 23.57 2e9i s ALA 23 CO 0.04 -0.63 0.25 0.99 0.00 0.00 0.00 175.76 176.41 2e9i s THR 24 N -3.00 4.51 -0.02 0.00 2.01 -1.26 -1.85 115.64 116.03 2e9i s THR 24 Ca -0.02 -1.30 0.06 0.00 0.31 0.00 0.00 61.69 60.74 2e9i s THR 24 Cb -0.00 -3.48 -0.03 0.00 0.01 0.00 0.00 72.50 69.00 2e9i s THR 24 CO -0.06 -0.32 -0.19 0.54 -0.69 0.00 0.00 174.62 173.90 2e9i s VAL 25 N -2.12 2.70 -0.64 3.82 0.11 -1.25 -4.59 120.40 118.43 2e9i s VAL 25 Ca 0.34 -0.95 -0.04 0.00 -2.93 0.00 0.00 61.98 58.41 2e9i s VAL 25 Cb -0.08 -2.05 0.00 0.00 -1.53 0.00 0.00 36.38 32.73 2e9i s VAL 25 CO 0.26 0.53 0.56 0.61 -3.33 0.00 0.00 175.10 173.73 2e9i n GLY 26 N 2.17 0.23 3.64 6.54 0.00 -1.26 -4.93 105.19 111.57 2e9i n GLY 26 Ca -0.17 -0.23 -0.07 0.00 0.00 0.00 0.00 46.02 45.55 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 -3.19 -0.63 -0.69 1.61 0.01 -1.26 -5.09 113.70 104.46 2e9i s SER 27 Ca 0.26 1.07 -0.28 0.00 1.31 0.00 0.00 55.95 58.31 2e9i s SER 27 Cb -0.11 1.19 -0.13 0.00 0.21 0.00 0.00 66.02 67.18 2e9i s SER 27 CO 0.35 -0.18 2.53 -0.38 0.41 0.00 0.00 173.24 175.97 2e9i n ILE 28 N 3.32 -0.05 -3.03 1.44 5.41 -1.26 -4.46 119.36 120.72 2e9i n ILE 28 Ca -0.17 -0.50 -0.41 0.00 1.00 0.00 0.00 62.75 62.68 2e9i n ILE 28 Cb 0.57 -1.91 -0.05 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 1.22 6.67 -0.58 0.00 -4.77 -1.26 -2.79 116.67 115.16 2e9i s ASP 30 Ca 0.32 0.68 -0.16 0.00 -3.30 0.00 0.00 52.55 50.08 2e9i s ASP 30 Cb -0.16 -2.41 0.14 0.00 -1.09 0.00 0.00 42.92 39.39 2e9i s ASP 30 CO 0.10 -0.63 0.56 -0.22 0.70 0.00 0.00 175.17 175.69 2e9i s LEU 31 N 2.98 6.12 -0.28 2.11 2.96 0.45 -4.98 118.68 128.04 2e9i s LEU 31 Ca 0.33 -1.83 -0.28 0.00 -0.22 0.00 0.00 54.13 52.12 2e9i s LEU 31 Cb -0.14 -2.23 0.01 0.00 0.50 0.00 0.00 46.19 44.34 2e9i s LEU 31 CO 0.13 -0.87 1.03 0.20 -1.32 0.00 0.00 176.35 175.51 2e9i s ASN 32 N 3.46 6.96 0.19 3.68 -0.87 -1.26 -2.87 114.94 124.23 2e9i s ASN 32 Ca 0.06 1.13 0.11 0.00 -1.57 0.00 0.00 52.86 52.58 2e9i s ASN 32 Cb -0.27 -2.53 -0.04 0.00 -0.02 0.00 0.00 41.25 38.39 2e9i s ASN 32 CO 0.02 -0.77 -0.22 -0.76 -2.57 0.00 0.00 177.10 172.80 2e9i s LEU 33 N 3.40 2.45 -0.81 0.60 1.43 -1.23 -5.05 118.68 119.46 2e9i s LEU 33 Ca 0.43 -0.88 -0.01 0.00 -1.03 0.00 0.00 54.13 52.65 2e9i s LEU 33 Cb -0.13 -1.06 0.36 0.00 0.03 0.00 0.00 46.19 45.38 2e9i s LEU 33 CO 0.12 0.07 1.88 2.29 0.23 0.00 0.00 176.35 180.93 2e9i n LYS 34 N 0.21 3.11 -2.04 1.70 2.85 -1.26 -4.22 118.16 118.51 2e9i n LYS 34 Ca -0.12 -3.78 -0.41 0.00 -1.05 0.00 0.00 58.31 52.95 2e9i n LYS 34 Cb 0.57 -2.29 -0.02 0.00 -0.65 0.00 0.00 35.03 32.64 2e9i n LYS 34 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 2e9i s ILE 35 N -5.06 2.63 0.00 0.58 1.01 -1.26 -5.02 121.20 114.08 2e9i s ILE 35 Ca 0.50 0.58 0.00 0.00 0.00 0.00 0.00 60.65 61.73 2e9i s ILE 35 Cb 0.41 -3.37 0.00 0.00 0.01 0.00 0.00 42.46 39.51 2e9i s ILE 35 CO -0.36 0.12 0.00 -0.81 0.00 0.00 0.00 174.94 173.89 2e9i n PRO 36 N 1.47 -0.01 -0.02 2.79 -0.04 -1.26 -3.93 135.00 134.00 2e9i n PRO 36 Ca 0.03 0.00 0.23 0.00 -0.04 0.00 0.00 63.50 63.72 2e9i n PRO 36 Cb 0.41 0.00 0.61 0.00 -0.04 0.00 0.00 33.50 34.48 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 -5.28 0.54 4.11 -1.95 -3.42 114.58 108.57 2e9i h GLU 37 Ca 0.00 0.00 -0.64 0.00 0.07 0.00 0.00 59.36 58.79 2e9i h GLU 37 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 2e9i h GLU 37 CO 0.00 0.00 1.36 -0.89 0.07 0.00 0.00 179.01 179.55 2e9i n ILE 38 N -3.46 0.00 -0.14 -1.06 5.41 -1.26 -4.86 119.36 114.00 2e9i n ILE 38 Ca 0.14 0.00 -0.17 0.00 1.00 0.00 0.00 62.75 63.71 2e9i n ILE 38 Cb 1.00 -0.47 0.17 0.00 -0.71 0.00 0.00 39.64 39.63 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 7.87 -3.24 -0.05 4.38 3.02 -1.26 -4.99 115.26 120.98 2e9i n ASN 39 Ca 0.54 -0.50 -0.06 0.00 -0.03 0.00 0.00 54.58 54.54 2e9i n ASN 39 Cb -0.02 -0.57 -0.07 0.00 -0.61 0.00 0.00 39.78 38.51 2e9i n ASN 39 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2e9i n SER 40 N -4.49 2.63 0.27 6.41 3.41 -1.26 -4.06 113.62 116.52 2e9i n SER 40 Ca 0.08 -0.02 0.14 0.00 -0.26 0.00 0.00 58.87 58.81 2e9i n SER 40 Cb 0.34 0.50 0.75 0.00 -0.26 0.00 0.00 64.21 65.54 2e9i n SER 40 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2e9i h SER 41 N 0.00 0.00 0.00 4.04 4.64 -1.98 0.19 113.55 120.43 2e9i h SER 41 Ca -0.28 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.83 2e9i h SER 41 Cb 1.58 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.63 2e9i h SER 41 CO -0.00 0.00 -1.97 0.47 -0.87 0.00 0.00 176.83 174.46 2e9i n ASP 42 N -2.62 1.27 -4.24 4.97 8.00 -1.26 -5.01 116.55 117.66 2e9i n ASP 42 Ca -0.02 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.18 2e9i n ASP 42 Cb 0.24 1.07 0.17 0.00 -0.02 0.00 0.00 41.12 42.59 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 0.71 -0.19 -1.24 -1.94 0.05 -3.60 119.30 110.55 2e9i s MET 43 Ca -0.07 -0.28 -0.12 0.00 -1.71 0.00 0.00 55.69 53.51 2e9i s MET 43 Cb 0.06 -1.84 0.06 0.00 2.01 0.00 0.00 34.83 35.12 2e9i s MET 43 CO 0.63 -2.39 0.47 -1.54 -0.01 0.00 0.00 175.02 172.18 2e9i s SER 44 N -4.74 -0.58 -0.13 3.03 1.04 -0.94 -4.94 113.70 106.44 2e9i s SER 44 Ca 0.72 1.00 0.02 0.00 0.48 0.00 0.00 55.95 58.17 2e9i s SER 44 Cb -0.06 0.91 0.00 0.00 0.10 0.00 0.00 66.02 66.98 2e9i s SER 44 CO 0.53 -0.19 -0.20 0.00 0.98 0.00 0.00 173.24 174.35 2e9i s ALA 45 N 1.14 2.32 -0.14 5.32 0.00 -1.26 -2.92 121.76 126.22 2e9i s ALA 45 Ca -0.07 -1.02 -0.08 0.00 0.00 0.00 0.00 51.96 50.79 2e9i s ALA 45 Cb -0.07 -1.02 0.05 0.00 0.00 0.00 0.00 23.12 22.09 2e9i s ALA 45 CO -0.10 0.10 0.33 -1.01 0.00 0.00 0.00 175.76 175.08 2e9i s HIS 46 N 0.61 -0.46 -0.45 0.00 3.76 -1.16 -0.76 115.29 116.84 2e9i s HIS 46 Ca -0.11 1.03 -0.24 0.00 -0.15 0.00 0.00 55.06 55.59 2e9i s HIS 46 Cb -0.16 0.16 0.03 0.00 1.11 0.00 0.00 32.58 33.71 2e9i s HIS 46 CO 0.03 -0.28 0.86 0.08 -0.85 0.00 0.00 174.74 174.57 2e9i s VAL 47 N 1.25 4.56 0.30 -0.90 1.01 -0.27 -1.30 120.40 125.05 2e9i s VAL 47 Ca -0.09 0.61 -0.24 0.00 0.00 0.00 0.00 61.98 62.26 2e9i s VAL 47 Cb -0.09 -4.37 -0.09 0.00 0.00 0.00 0.00 36.38 31.82 2e9i s VAL 47 CO -0.10 -0.76 0.89 -0.89 0.00 0.00 0.00 175.10 174.24 2e9i s THR 48 N 3.51 4.31 0.19 3.92 2.01 -0.12 -0.60 115.64 128.85 2e9i s THR 48 Ca 0.34 1.68 0.00 0.00 0.31 0.00 0.00 61.69 64.02 2e9i s THR 48 Cb -0.11 -3.97 -0.04 0.00 0.01 0.00 0.00 72.50 68.39 2e9i s THR 48 CO 0.24 0.16 0.36 -0.44 -0.69 0.00 0.00 174.62 174.25 2e9i s SER 49 N -1.63 6.37 0.00 3.53 0.01 0.12 -3.41 113.70 118.70 2e9i s SER 49 Ca 0.48 0.34 0.15 0.00 1.31 0.00 0.00 55.95 58.23 2e9i s SER 49 Cb -0.18 -1.98 0.74 0.00 0.21 0.00 0.00 66.02 64.81 2e9i s SER 49 CO 0.23 -0.02 1.41 -0.81 0.41 0.00 0.00 173.24 174.46 2e9i n PRO 50 N -0.62 0.21 -0.08 12.44 -0.04 -1.24 -2.45 135.00 143.21 2e9i n PRO 50 Ca -0.05 0.15 -0.07 0.00 -0.04 0.00 0.00 63.50 63.49 2e9i n PRO 50 Cb 0.54 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.36 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 -1.29 0.67 0.00 3.54 3.41 -1.26 -5.00 113.62 113.69 2e9i n SER 51 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 2e9i n SER 51 Cb 0.12 1.02 0.00 0.00 -0.26 0.00 0.00 64.21 65.09 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 1.87 1.42 3.64 5.00 0.00 -1.02 -5.13 105.19 110.96 2e9i n GLY 52 Ca -0.26 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 2e9i n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2e9i n ARG 53 N 0.00 0.15 -4.26 1.61 5.12 -1.26 -4.65 116.66 113.37 2e9i n ARG 53 Ca 0.00 0.12 -0.17 0.00 -1.93 0.00 0.00 57.85 55.87 2e9i n ARG 53 Cb 0.00 -2.32 -0.14 0.00 -1.16 0.00 0.00 32.46 28.84 2e9i n ARG 53 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2e9i s VAL 54 N -2.12 0.59 0.25 1.55 1.01 -1.26 0.14 120.40 120.55 2e9i s VAL 54 Ca 0.71 -0.40 0.10 0.00 0.00 0.00 0.00 61.98 62.40 2e9i s VAL 54 Cb -0.29 -0.51 -0.05 0.00 0.00 0.00 0.00 36.38 35.53 2e9i s VAL 54 CO 0.53 0.11 -0.12 -0.89 0.00 0.00 0.00 175.10 174.73 2e9i s THR 55 N -0.29 2.94 -0.07 3.92 2.01 0.23 -4.96 115.64 119.42 2e9i s THR 55 Ca 0.02 -2.05 -0.03 0.00 0.31 0.00 0.00 61.69 59.94 2e9i s THR 55 Cb -0.04 -2.52 -0.04 0.00 0.01 0.00 0.00 72.50 69.91 2e9i s THR 55 CO -0.00 -0.30 0.08 -0.70 -0.69 0.00 0.00 174.62 173.01 2e9i s GLU 56 N -3.34 3.20 0.19 4.92 -6.30 -1.26 -1.11 118.70 114.99 2e9i s GLU 56 Ca 0.28 -0.33 0.09 0.00 -2.50 0.00 0.00 54.97 52.51 2e9i s GLU 56 Cb -0.07 -2.97 -0.04 0.00 0.00 0.00 0.00 34.13 31.05 2e9i s GLU 56 CO 0.16 0.71 -0.17 0.00 0.02 0.00 0.00 175.26 175.98 2e9i s ALA 57 N -1.05 2.08 0.07 6.30 0.00 0.06 -4.83 121.76 124.39 2e9i s ALA 57 Ca 0.18 -1.57 0.03 0.00 0.00 0.00 0.00 51.96 50.59 2e9i s ALA 57 Cb -0.12 -0.17 -0.04 0.00 0.00 0.00 0.00 23.12 22.80 2e9i s ALA 57 CO 0.07 0.19 0.04 -2.00 0.00 0.00 0.00 175.76 174.07 2e9i s GLU 58 N -3.10 2.78 -0.20 0.00 2.12 -1.26 -4.49 118.70 114.55 2e9i s GLU 58 Ca 0.19 -0.71 -0.03 0.00 0.36 0.00 0.00 54.97 54.78 2e9i s GLU 58 Cb -0.04 -2.67 -0.01 0.00 0.26 0.00 0.00 34.13 31.67 2e9i s GLU 58 CO 0.07 0.57 -0.07 0.42 -0.54 0.00 0.00 175.26 175.71 2e9i s ILE 59 N -1.31 3.18 -0.12 -3.70 1.01 -1.26 -3.40 121.20 115.60 2e9i s ILE 59 Ca 0.26 -0.57 -0.15 0.00 0.00 0.00 0.00 60.65 60.20 2e9i s ILE 59 Cb -0.12 -2.42 -0.05 0.00 0.01 0.00 0.00 42.46 39.88 2e9i s ILE 59 CO 0.19 0.45 0.35 -0.69 0.00 0.00 0.00 174.94 175.24 2e9i s VAL 60 N 1.25 5.24 -0.29 2.92 1.01 -0.08 -4.97 120.40 125.49 2e9i s VAL 60 Ca 0.03 0.68 -0.29 0.00 0.00 0.00 0.00 61.98 62.40 2e9i s VAL 60 Cb -0.14 -3.68 -0.02 0.00 0.00 0.00 0.00 36.38 32.54 2e9i s VAL 60 CO -0.03 0.41 1.66 -2.16 0.00 0.00 0.00 175.10 174.98 2e9i s PRO 61 N 0.22 3.59 0.00 2.72 0.04 -1.26 -2.13 135.00 138.18 2e9i s PRO 61 Ca 0.20 1.47 0.00 0.00 0.04 0.00 0.00 61.00 62.71 2e9i s PRO 61 Cb -0.14 -4.10 0.00 0.00 0.04 0.00 0.00 34.50 30.30 2e9i s PRO 61 CO 0.07 -1.55 0.00 -1.33 0.04 0.00 0.00 177.00 174.23 2e9i n MET 62 N 8.02 0.00 0.00 4.56 2.81 -1.23 -4.96 117.12 126.32 2e9i n MET 62 Ca 0.20 0.19 0.00 0.00 -1.81 0.00 0.00 57.70 56.28 2e9i n MET 62 Cb 0.46 -0.62 0.00 0.00 -0.71 0.00 0.00 33.22 32.35 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 2.07 2.87 3.61 3.03 0.00 -1.24 -5.01 105.19 110.52 2e9i n GLY 63 Ca 0.00 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 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 4.74 3.75 -1.60 1.61 -2.85 -1.26 -3.31 119.74 120.81 2e9i s LYS 64 Ca 0.00 1.01 -0.04 0.00 -1.00 0.00 0.00 55.97 55.95 2e9i s LYS 64 Cb 0.00 -3.94 0.01 0.00 -2.06 0.00 0.00 37.83 31.84 2e9i s LYS 64 CO 0.00 -1.34 0.45 0.09 0.10 0.00 0.00 175.35 174.65 2e9i n ASN 65 N 8.14 -5.96 -4.12 0.03 3.02 -1.26 -4.98 115.26 110.13 2e9i n ASN 65 Ca 0.15 -0.22 -0.20 0.00 -0.03 0.00 0.00 54.58 54.28 2e9i n ASN 65 Cb 0.48 -4.86 -0.14 0.00 -0.61 0.00 0.00 39.78 34.65 2e9i n ASN 65 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2e9i s SER 66 N -2.54 1.55 -0.16 6.41 0.15 -1.21 -4.27 113.70 113.63 2e9i s SER 66 Ca 0.23 -0.40 -0.12 0.00 0.70 0.00 0.00 55.95 56.36 2e9i s SER 66 Cb -0.10 -0.11 0.05 0.00 -1.71 0.00 0.00 66.02 64.14 2e9i s SER 66 CO 0.29 0.05 0.40 -1.00 1.20 0.00 0.00 173.24 174.18 2e9i s HIS 67 N -0.73 -0.50 -0.17 3.44 3.76 -1.26 -3.46 115.29 116.37 2e9i s HIS 67 Ca 0.02 1.16 0.01 0.00 -0.15 0.00 0.00 55.06 56.09 2e9i s HIS 67 Cb -0.07 0.19 0.03 0.00 1.11 0.00 0.00 32.58 33.84 2e9i s HIS 67 CO 0.01 -0.26 -0.15 0.00 -0.85 0.00 0.00 174.74 173.49 2e9i s VAL 69 N 1.42 5.38 -0.14 0.00 1.01 -1.14 -0.90 120.40 126.04 2e9i s VAL 69 Ca 0.04 0.35 0.01 0.00 0.00 0.00 0.00 61.98 62.37 2e9i s VAL 69 Cb -0.14 -3.51 0.02 0.00 0.00 0.00 0.00 36.38 32.75 2e9i s VAL 69 CO -0.11 0.50 -0.16 -0.13 0.00 0.00 0.00 175.10 175.20 2e9i s ARG 70 N -0.18 2.46 0.25 2.72 0.52 -1.22 -0.41 118.95 123.09 2e9i s ARG 70 Ca 0.14 -0.63 -0.22 0.00 -0.52 0.00 0.00 55.73 54.50 2e9i s ARG 70 Cb -0.12 -2.14 0.03 0.00 0.52 0.00 0.00 34.95 33.24 2e9i s ARG 70 CO 0.03 -0.15 0.72 -0.59 0.02 0.00 0.00 175.30 175.32 2e9i s PHE 71 N 1.22 -0.25 -0.62 -0.53 -0.12 -1.12 -4.30 117.98 112.26 2e9i s PHE 71 Ca -0.00 -0.15 -0.13 0.00 -0.05 0.00 0.00 56.93 56.60 2e9i s PHE 71 Cb -0.14 0.68 0.16 0.00 -0.63 0.00 0.00 43.02 43.09 2e9i s PHE 71 CO -0.07 -1.14 0.54 0.08 -0.05 0.00 0.00 175.22 174.59 2e9i s VAL 72 N -3.84 4.97 -1.16 -2.49 1.01 -1.26 0.60 120.40 118.24 2e9i s VAL 72 Ca 0.09 -1.99 -0.23 0.00 0.00 0.00 0.00 61.98 59.85 2e9i s VAL 72 Cb -0.05 -4.17 -0.08 0.00 0.00 0.00 0.00 36.38 32.08 2e9i s VAL 72 CO 0.03 -0.90 1.94 -2.16 0.00 0.00 0.00 175.10 174.01 2e9i s PRO 73 N 0.96 2.50 -0.24 2.72 0.04 -1.26 -4.89 135.00 134.82 2e9i s PRO 73 Ca 0.09 -1.08 0.02 0.00 0.04 0.00 0.00 61.00 60.07 2e9i s PRO 73 Cb -0.22 -5.23 0.05 0.00 0.04 0.00 0.00 34.50 29.14 2e9i s PRO 73 CO -0.02 -3.93 -0.12 1.14 0.04 0.00 0.00 177.00 174.11 2e9i s GLN 74 N 6.52 2.48 0.22 4.56 -2.07 -1.26 -4.58 119.66 125.54 2e9i s GLN 74 Ca 0.69 -1.19 -0.03 0.00 -1.82 0.00 0.00 55.36 53.01 2e9i s GLN 74 Cb -0.01 -2.84 -0.03 0.00 -1.09 0.00 0.00 33.01 29.03 2e9i s GLN 74 CO 0.12 -0.48 0.22 -2.00 -1.32 0.00 0.00 175.29 171.83 2e9i s GLU 75 N 1.17 1.33 0.00 9.60 2.56 -1.26 -5.04 118.70 127.06 2e9i s GLU 75 Ca -0.05 -1.59 0.23 0.00 0.00 0.00 0.00 54.97 53.56 2e9i s GLU 75 Cb -0.18 0.32 0.54 0.00 2.00 0.00 0.00 34.13 36.80 2e9i s GLU 75 CO -0.07 -0.47 1.45 -1.33 -0.56 0.00 0.00 175.26 174.29 2e9i n MET 76 N -0.32 2.17 0.00 4.30 2.81 -1.26 -4.96 117.12 119.86 2e9i n MET 76 Ca 0.02 -1.75 0.00 0.00 -1.81 0.00 0.00 57.70 54.15 2e9i n MET 76 Cb 0.65 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.69 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 1.34 4.02 3.81 3.03 0.00 -1.26 -5.09 105.19 111.03 2e9i n GLY 77 Ca 0.17 -0.30 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 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 1.45 4.24 -0.10 1.61 0.11 -1.26 -4.78 120.40 121.67 2e9i s VAL 78 Ca 0.00 1.46 -0.01 0.00 -2.93 0.00 0.00 61.98 60.50 2e9i s VAL 78 Cb 0.00 -3.63 -0.03 0.00 -1.53 0.00 0.00 36.38 31.19 2e9i s VAL 78 CO 0.00 -0.24 -0.06 -1.00 -3.33 0.00 0.00 175.10 170.48 2e9i s HIS 79 N -2.06 2.98 -0.04 1.54 0.09 -1.09 -3.73 115.29 112.99 2e9i s HIS 79 Ca 0.61 -0.09 -0.01 0.00 -0.00 0.00 0.00 55.06 55.57 2e9i s HIS 79 Cb -0.12 -1.80 0.03 0.00 -0.00 0.00 0.00 32.58 30.69 2e9i s HIS 79 CO 0.16 0.21 0.04 0.99 -0.00 0.00 0.00 174.74 176.14 2e9i s THR 80 N -0.42 0.01 -0.41 1.30 2.01 -1.22 -0.98 115.64 115.93 2e9i s THR 80 Ca 0.06 0.30 -0.20 0.00 0.31 0.00 0.00 61.69 62.17 2e9i s THR 80 Cb -0.12 -0.21 0.01 0.00 0.01 0.00 0.00 72.50 72.19 2e9i s THR 80 CO 0.02 0.17 0.61 -0.69 -0.69 0.00 0.00 174.62 174.05 2e9i s VAL 81 N 1.80 4.88 -0.62 3.82 1.01 0.37 -0.95 120.40 130.71 2e9i s VAL 81 Ca 0.01 0.24 -0.23 0.00 0.00 0.00 0.00 61.98 62.00 2e9i s VAL 81 Cb -0.12 -4.13 0.06 0.00 0.00 0.00 0.00 36.38 32.19 2e9i s VAL 81 CO -0.03 -0.47 0.93 -0.44 0.00 0.00 0.00 175.10 175.09 2e9i s SER 82 N 1.91 6.21 -0.39 3.32 0.01 -0.42 -0.96 113.70 123.38 2e9i s SER 82 Ca 0.22 -0.86 -0.08 0.00 1.31 0.00 0.00 55.95 56.54 2e9i s SER 82 Cb -0.14 -2.41 0.06 0.00 0.21 0.00 0.00 66.02 63.74 2e9i s SER 82 CO 0.17 -1.35 0.21 -0.69 0.41 0.00 0.00 173.24 171.99 2e9i s VAL 83 N 3.90 4.13 0.03 3.43 1.01 -1.26 -2.97 120.40 128.67 2e9i s VAL 83 Ca 0.23 -1.26 0.05 0.00 0.00 0.00 0.00 61.98 61.00 2e9i s VAL 83 Cb -0.16 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 2e9i s VAL 83 CO 0.12 -0.38 -0.11 -0.54 0.00 0.00 0.00 175.10 174.19 2e9i s LYS 84 N 1.43 2.35 -0.44 2.72 1.02 -1.15 -1.72 119.74 123.94 2e9i s LYS 84 Ca 0.02 -0.84 0.04 0.00 0.02 0.00 0.00 55.97 55.20 2e9i s LYS 84 Cb -0.21 -2.38 0.12 0.00 -0.52 0.00 0.00 37.83 34.84 2e9i s LYS 84 CO 0.03 0.57 0.17 -0.47 -0.92 0.00 0.00 175.35 174.73 2e9i s TYR 85 N -1.00 3.45 -1.15 3.18 5.04 0.44 -2.22 117.35 125.09 2e9i s TYR 85 Ca 0.17 -3.08 -0.04 0.00 -2.44 0.00 0.00 57.07 51.68 2e9i s TYR 85 Cb -0.11 -2.89 0.00 0.00 0.35 0.00 0.00 41.96 39.32 2e9i s TYR 85 CO 0.08 -0.84 0.54 0.54 -1.34 0.00 0.00 175.55 174.53 2e9i n ARG 86 N 3.63 -4.12 -1.82 4.97 1.74 -1.24 -3.39 116.66 116.43 2e9i n ARG 86 Ca 0.04 0.68 0.00 0.00 -0.77 0.00 0.00 57.85 57.80 2e9i n ARG 86 Cb 0.37 -5.08 0.00 0.00 -1.02 0.00 0.00 32.46 26.73 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 -1.39 0.68 3.45 -0.13 0.00 -1.26 -5.08 105.19 101.46 2e9i n GLY 87 Ca -0.07 -0.47 0.01 0.00 0.00 0.00 0.00 46.02 45.49 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 -3.55 0.51 0.01 1.61 -0.21 -1.22 -5.13 119.66 111.68 2e9i s GLN 88 Ca 0.00 1.16 -0.33 0.00 0.02 0.00 0.00 55.36 56.21 2e9i s GLN 88 Cb 0.00 0.68 -0.11 0.00 1.00 0.00 0.00 33.01 34.58 2e9i s GLN 88 CO 0.00 -0.29 1.85 0.72 -2.12 0.00 0.00 175.29 175.45 2e9i n HIS 89 N 5.37 2.41 -0.73 0.91 8.25 -1.26 -0.42 115.22 129.75 2e9i n HIS 89 Ca -0.08 -0.07 -0.24 0.00 -0.26 0.00 0.00 57.72 57.07 2e9i n HIS 89 Cb 0.50 -2.69 0.21 0.00 1.12 0.00 0.00 29.99 29.14 2e9i n HIS 89 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 2e9i n VAL 90 N 4.91 0.00 -1.66 1.59 0.24 -0.70 -4.82 118.33 117.89 2e9i n VAL 90 Ca 0.21 -0.28 -0.42 0.00 -2.04 0.00 0.00 64.34 61.80 2e9i n VAL 90 Cb 0.33 -1.08 -0.00 0.00 -1.47 0.00 0.00 33.84 31.62 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 -4.66 2.17 -4.35 3.34 -1.04 -1.26 -1.93 114.28 106.54 2e9i n THR 91 Ca 0.12 -0.50 -0.37 0.00 -2.04 0.00 0.00 64.05 61.26 2e9i n THR 91 Cb 0.48 -1.38 -0.06 0.00 -1.82 0.00 0.00 70.33 67.55 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 0.94 -0.35 3.36 3.41 0.00 -1.26 -4.93 105.19 106.36 2e9i n GLY 92 Ca 0.07 0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.56 3.28 1.19 1.61 0.15 -0.81 -3.81 113.70 111.75 2e9i s SER 93 Ca 0.59 -0.50 -0.19 0.00 0.70 0.00 0.00 55.95 56.55 2e9i s SER 93 Cb -0.34 -0.39 0.28 0.00 -1.71 0.00 0.00 66.02 63.86 2e9i s SER 93 CO 0.98 0.29 1.11 -2.16 1.20 0.00 0.00 173.24 174.65 2e9i s PRO 94 N -1.02 -1.10 -0.28 5.44 0.04 -1.26 -4.76 135.00 132.06 2e9i s PRO 94 Ca 0.12 -0.02 -0.05 0.00 0.04 0.00 0.00 61.00 61.08 2e9i s PRO 94 Cb -0.10 -1.61 0.02 0.00 0.04 0.00 0.00 34.50 32.85 2e9i s PRO 94 CO 0.01 -3.64 0.02 -0.06 0.04 0.00 0.00 177.00 173.38 2e9i s PHE 95 N -3.01 3.12 0.01 0.56 0.08 -0.13 -4.91 117.98 113.69 2e9i s PHE 95 Ca 0.70 -1.23 -0.18 0.00 0.12 0.00 0.00 56.93 56.34 2e9i s PHE 95 Cb -0.10 -2.17 -0.06 0.00 -0.57 0.00 0.00 43.02 40.12 2e9i s PHE 95 CO 0.56 -0.64 0.53 -1.14 -0.10 0.00 0.00 175.22 174.43 2e9i s GLN 96 N 1.42 4.19 -0.16 0.44 0.74 -1.26 -0.48 119.66 124.55 2e9i s GLN 96 Ca 0.01 0.62 -0.20 0.00 0.05 0.00 0.00 55.36 55.85 2e9i s GLN 96 Cb -0.17 -3.29 0.05 0.00 1.10 0.00 0.00 33.01 30.70 2e9i s GLN 96 CO -0.00 0.50 0.53 -0.59 -0.55 0.00 0.00 175.29 175.18 2e9i s PHE 97 N -0.59 -0.55 -0.09 1.67 -0.71 -0.16 -4.80 117.98 112.76 2e9i s PHE 97 Ca 0.28 1.27 -0.15 0.00 -1.04 0.00 0.00 56.93 57.29 2e9i s PHE 97 Cb -0.18 0.21 -0.05 0.00 -1.21 0.00 0.00 43.02 41.80 2e9i s PHE 97 CO 0.16 -0.33 0.38 0.99 -1.34 0.00 0.00 175.22 175.07 2e9i s THR 98 N -0.07 5.18 0.26 -4.49 2.01 -1.20 -2.66 115.64 114.67 2e9i s THR 98 Ca -0.03 0.75 0.09 0.00 0.31 0.00 0.00 61.69 62.81 2e9i s THR 98 Cb -0.03 -3.70 -0.04 0.00 0.01 0.00 0.00 72.50 68.73 2e9i s THR 98 CO 0.02 0.45 0.07 -0.69 -0.69 0.00 0.00 174.62 173.79 2e9i s VAL 99 N -0.15 3.75 -0.17 3.82 1.01 -1.26 -3.45 120.40 123.96 2e9i s VAL 99 Ca 0.22 -1.74 -0.29 0.00 0.00 0.00 0.00 61.98 60.17 2e9i s VAL 99 Cb -0.15 -3.03 0.10 0.00 0.00 0.00 0.00 36.38 33.30 2e9i s VAL 99 CO 0.09 -0.36 0.87 -0.83 0.00 0.00 0.00 175.10 174.88 2e9i s GLY 100 N -3.74 -0.37 1.01 4.51 0.00 -0.77 -4.94 107.32 103.02 2e9i s GLY 100 Ca 0.32 1.96 -0.12 0.00 0.00 0.00 0.00 44.72 46.87 2e9i s GLY 100 CO 0.22 1.27 1.09 2.56 0.00 0.00 0.00 173.10 178.24 2e9i s PRO 101 N -0.65 0.36 -0.09 2.90 0.04 -1.26 -3.95 135.00 132.35 2e9i s PRO 101 Ca -0.03 0.50 -0.01 0.00 0.04 0.00 0.00 61.00 61.50 2e9i s PRO 101 Cb -0.02 -1.73 -0.03 0.00 0.04 0.00 0.00 34.50 32.76 2e9i s PRO 101 CO 0.02 -2.77 -0.02 -1.17 0.04 0.00 0.00 177.00 173.10 2e9i s LEU 102 N -6.48 3.46 -0.30 -3.56 2.96 -1.26 -4.98 118.68 108.52 2e9i s LEU 102 Ca 0.65 0.09 -0.09 0.00 -0.22 0.00 0.00 54.13 54.56 2e9i s LEU 102 Cb -0.19 -1.78 0.19 0.00 0.50 0.00 0.00 46.19 44.91 2e9i s LEU 102 CO 0.58 0.36 0.98 -0.83 -1.32 0.00 0.00 176.35 176.12 2e9i s GLY 103 N -0.78 -0.87 0.00 7.98 0.00 -1.26 -5.05 107.32 107.33 2e9i s GLY 103 Ca 0.12 2.09 0.00 0.00 0.00 0.00 0.00 44.72 46.93 2e9i s GLY 103 CO 0.02 4.00 0.00 -2.21 0.00 0.00 0.00 173.10 174.91 2e9i n GLU 104 N 5.21 0.00 0.00 2.90 2.13 -1.26 -5.10 120.64 124.52 2e9i n GLU 104 Ca 0.06 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.88 2e9i n GLU 104 Cb 0.56 -0.37 0.00 0.00 0.27 0.00 0.00 31.44 31.91 2e9i n GLU 104 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2e9i n GLY 105 N 2.22 1.00 0.59 8.31 0.00 -1.26 -5.39 105.19 110.67 2e9i n GLY 105 Ca 0.00 -0.56 0.14 0.00 0.00 0.00 0.00 46.02 45.60 2e9i n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93