#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ee2 s SER 2 N 0.00 3.03 0.30 1.61 0.01 -1.26 -5.16 113.70 112.24 2ee2 s SER 2 Ca 0.00 -1.08 -0.20 0.00 1.31 0.00 0.00 55.95 55.98 2ee2 s SER 2 Cb 0.00 -0.21 0.03 0.00 0.21 0.00 0.00 66.02 66.05 2ee2 s SER 2 CO 0.00 -0.16 0.74 -0.94 0.41 0.00 0.00 173.24 173.29 2ee2 s SER 3 N -3.43 -0.20 -0.44 2.44 1.04 -1.26 -5.12 113.70 106.73 2ee2 s SER 3 Ca 0.27 -0.74 0.02 0.00 0.48 0.00 0.00 55.95 55.99 2ee2 s SER 3 Cb -0.00 0.76 0.23 0.00 0.10 0.00 0.00 66.02 67.11 2ee2 s SER 3 CO 0.11 -1.43 0.97 0.61 0.98 0.00 0.00 173.24 174.49 2ee2 n GLY 4 N -0.48 -0.78 3.37 7.32 0.00 -1.26 -5.13 105.19 108.23 2ee2 n GLY 4 Ca -0.05 0.59 -0.36 0.00 0.00 0.00 0.00 46.02 46.20 2ee2 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ee2 s SER 5 N -0.44 4.66 -0.39 1.61 0.15 -1.26 -5.07 113.70 112.96 2ee2 s SER 5 Ca 0.29 -0.31 -0.23 0.00 0.70 0.00 0.00 55.95 56.40 2ee2 s SER 5 Cb 0.16 -1.82 0.01 0.00 -1.71 0.00 0.00 66.02 62.67 2ee2 s SER 5 CO -0.15 -0.03 0.78 -0.94 1.20 0.00 0.00 173.24 174.11 2ee2 s SER 6 N 1.53 6.51 -0.68 5.45 1.04 -1.26 -4.38 113.70 121.91 2ee2 s SER 6 Ca 0.06 0.21 -0.02 0.00 0.48 0.00 0.00 55.95 56.68 2ee2 s SER 6 Cb -0.15 -2.39 0.00 0.00 0.10 0.00 0.00 66.02 63.58 2ee2 s SER 6 CO -0.00 -0.79 0.66 0.61 0.98 0.00 0.00 173.24 174.70 2ee2 n GLY 7 N 4.68 -1.22 3.79 7.32 0.00 -1.26 -4.98 105.19 113.51 2ee2 n GLY 7 Ca 0.03 0.55 -0.38 0.00 0.00 0.00 0.00 46.02 46.21 2ee2 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ee2 s VAL 8 N -2.94 4.42 -0.30 1.61 0.11 -1.26 -5.05 120.40 116.98 2ee2 s VAL 8 Ca 0.03 1.58 -0.15 0.00 -2.93 0.00 0.00 61.98 60.51 2ee2 s VAL 8 Cb -0.01 -4.04 0.16 0.00 -1.53 0.00 0.00 36.38 30.96 2ee2 s VAL 8 CO 0.73 0.40 0.97 0.00 -3.33 0.00 0.00 175.10 173.87 2ee2 s ALA 9 N -1.30 -2.60 -0.24 1.54 0.00 -1.26 -5.14 121.76 112.76 2ee2 s ALA 9 Ca 0.39 2.09 -0.22 0.00 0.00 0.00 0.00 51.96 54.22 2ee2 s ALA 9 Cb -0.21 -1.98 -0.01 0.00 0.00 0.00 0.00 23.12 20.92 2ee2 s ALA 9 CO 0.24 -0.83 0.71 0.08 0.00 0.00 0.00 175.76 175.96 2ee2 s VAL 10 N 2.25 4.93 -0.19 0.00 1.01 -1.26 -4.99 120.40 122.15 2ee2 s VAL 10 Ca -0.04 1.33 -0.37 0.00 0.00 0.00 0.00 61.98 62.90 2ee2 s VAL 10 Cb -0.06 -4.01 -0.14 0.00 0.00 0.00 0.00 36.38 32.17 2ee2 s VAL 10 CO -0.17 0.00 1.82 -0.38 0.00 0.00 0.00 175.10 176.38 2ee2 n ILE 11 N 5.11 0.45 -4.11 2.22 5.41 -1.26 -4.95 119.36 122.23 2ee2 n ILE 11 Ca 0.02 -0.08 -0.11 0.00 1.00 0.00 0.00 62.75 63.57 2ee2 n ILE 11 Cb 0.49 -1.56 -0.11 0.00 -0.71 0.00 0.00 39.64 37.75 2ee2 n ILE 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2ee2 s ASN 12 N 3.89 0.92 0.11 4.38 4.22 -1.26 -5.17 114.94 122.04 2ee2 s ASN 12 Ca 0.96 -0.77 -0.11 0.00 -2.14 0.00 0.00 52.86 50.80 2ee2 s ASN 12 Cb -0.88 0.07 0.01 0.00 1.28 0.00 0.00 41.25 41.73 2ee2 s ASN 12 CO 0.59 -0.34 0.27 -0.44 -2.04 0.00 0.00 177.10 175.13 2ee2 s SER 13 N -2.28 0.01 -0.15 3.54 0.01 -1.26 -5.18 113.70 108.39 2ee2 s SER 13 Ca -0.00 -0.59 -0.29 0.00 1.31 0.00 0.00 55.95 56.38 2ee2 s SER 13 Cb -0.02 0.39 0.11 0.00 0.21 0.00 0.00 66.02 66.71 2ee2 s SER 13 CO -0.02 -0.79 0.90 0.00 0.41 0.00 0.00 173.24 173.74 2ee2 s ALA 14 N -3.86 -1.89 0.08 1.44 0.00 -1.26 -5.03 121.76 111.24 2ee2 s ALA 14 Ca 0.06 1.57 -0.24 0.00 0.00 0.00 0.00 51.96 53.36 2ee2 s ALA 14 Cb 0.04 -0.64 -0.16 0.00 0.00 0.00 0.00 23.12 22.36 2ee2 s ALA 14 CO -0.10 -0.32 1.69 -0.56 0.00 0.00 0.00 175.76 176.48 2ee2 h GLN 15 N 2.99 -0.04 0.00 0.00 3.07 -1.99 -3.48 115.11 115.66 2ee2 h GLN 15 Ca -0.22 0.00 0.21 0.00 0.09 0.00 0.00 58.65 58.73 2ee2 h GLN 15 Cb 1.16 0.01 -0.04 0.00 0.08 0.00 0.00 27.48 28.69 2ee2 h GLN 15 CO 0.29 0.02 0.65 -3.47 0.09 0.00 0.00 178.83 176.42 2ee2 n ASP 16 N -5.09 -1.50 -3.89 0.06 -0.08 -1.26 -5.10 116.55 99.70 2ee2 n ASP 16 Ca -0.07 -1.68 -0.11 0.00 -1.51 0.00 0.00 54.79 51.42 2ee2 n ASP 16 Cb 0.06 2.41 -0.12 0.00 2.34 0.00 0.00 41.12 45.82 2ee2 n ASP 16 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2ee2 s ALA 17 N -1.98 -0.14 0.32 -1.67 0.00 -1.26 -1.91 121.76 115.12 2ee2 s ALA 17 Ca 0.24 -0.08 -0.28 0.00 0.00 0.00 0.00 51.96 51.84 2ee2 s ALA 17 Cb -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 23.12 23.00 2ee2 s ALA 17 CO 0.03 -0.11 1.22 -1.25 0.00 0.00 0.00 175.76 175.66 2ee2 s PRO 18 N -0.70 4.41 0.00 0.00 0.04 -1.26 -4.94 135.00 132.56 2ee2 s PRO 18 Ca -0.08 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.00 2ee2 s PRO 18 Cb -0.05 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.43 2ee2 s PRO 18 CO 0.00 -0.07 0.00 0.43 0.04 0.00 0.00 177.00 177.40 2ee2 n SER 19 N 0.83 3.13 -4.80 6.66 7.64 -1.26 -4.54 113.62 121.29 2ee2 n SER 19 Ca 0.00 -0.09 -0.33 0.00 1.01 0.00 0.00 58.87 59.47 2ee2 n SER 19 Cb 0.43 0.81 -0.07 0.00 -1.01 0.00 0.00 64.21 64.37 2ee2 n SER 19 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2ee2 s GLU 20 N -1.43 3.09 0.04 1.43 2.12 -1.26 -4.98 118.70 117.71 2ee2 s GLU 20 Ca 0.00 -0.49 0.05 0.00 0.36 0.00 0.00 54.97 54.89 2ee2 s GLU 20 Cb 0.00 -2.87 -0.04 0.00 0.26 0.00 0.00 34.13 31.48 2ee2 s GLU 20 CO 0.00 0.64 -0.10 0.00 -0.54 0.00 0.00 175.26 175.26 2ee2 s ALA 21 N -1.24 2.93 -0.28 6.30 0.00 -1.26 -4.92 121.76 123.28 2ee2 s ALA 21 Ca 0.25 -1.12 -0.29 0.00 0.00 0.00 0.00 51.96 50.79 2ee2 s ALA 21 Cb -0.12 -0.98 -0.02 0.00 0.00 0.00 0.00 23.12 22.00 2ee2 s ALA 21 CO 0.16 0.62 1.66 -1.25 0.00 0.00 0.00 175.76 176.94 2ee2 s PRO 22 N -1.69 3.60 0.52 0.00 0.04 -1.26 -4.95 135.00 131.26 2ee2 s PRO 22 Ca 0.18 1.49 0.06 0.00 0.04 0.00 0.00 61.00 62.77 2ee2 s PRO 22 Cb -0.11 -4.09 0.04 0.00 0.04 0.00 0.00 34.50 30.38 2ee2 s PRO 22 CO 0.09 -1.53 0.71 0.99 0.04 0.00 0.00 177.00 177.31 2ee2 s THR 23 N 5.83 2.64 -1.26 1.26 2.01 -1.26 -4.53 115.64 120.33 2ee2 s THR 23 Ca 0.73 -0.87 -0.06 0.00 0.31 0.00 0.00 61.69 61.80 2ee2 s THR 23 Cb -0.23 -2.78 0.01 0.00 0.01 0.00 0.00 72.50 69.51 2ee2 s THR 23 CO 0.31 0.00 0.82 -0.62 -0.69 0.00 0.00 174.62 174.45 2ee2 n GLU 24 N -2.17 -5.84 -3.45 4.92 1.02 -1.26 -3.07 120.64 110.80 2ee2 n GLU 24 Ca 0.10 0.75 -0.38 0.00 -0.02 0.00 0.00 57.16 57.61 2ee2 n GLU 24 Cb 0.60 -5.44 -0.09 0.00 -0.02 0.00 0.00 31.44 26.49 2ee2 n GLU 24 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2ee2 s VAL 25 N -3.20 5.22 0.25 2.62 0.11 -1.26 -4.32 120.40 119.81 2ee2 s VAL 25 Ca 0.41 0.49 0.06 0.00 -2.93 0.00 0.00 61.98 60.01 2ee2 s VAL 25 Cb -0.18 -3.65 -0.05 0.00 -1.53 0.00 0.00 36.38 30.96 2ee2 s VAL 25 CO 0.51 0.21 -0.06 -0.83 -3.33 0.00 0.00 175.10 171.59 2ee2 s GLY 26 N 1.48 1.66 -0.17 6.54 0.00 -0.30 -4.99 107.32 111.54 2ee2 s GLY 26 Ca 0.14 -1.81 0.01 0.00 0.00 0.00 0.00 44.72 43.06 2ee2 s GLY 26 CO 0.09 -1.77 -0.19 -1.34 0.00 0.00 0.00 173.10 169.89 2ee2 s VAL 27 N -3.11 1.94 -0.10 1.40 -7.23 -1.26 -1.61 120.40 110.42 2ee2 s VAL 27 Ca 0.27 -0.87 -0.09 0.00 -1.81 0.00 0.00 61.98 59.48 2ee2 s VAL 27 Cb 0.03 -1.76 -0.04 0.00 0.56 0.00 0.00 36.38 35.17 2ee2 s VAL 27 CO 0.10 0.52 0.20 -0.75 -0.31 0.00 0.00 175.10 174.86 2ee2 s LYS 28 N 1.26 3.61 -0.52 4.82 2.20 0.97 -4.97 119.74 127.11 2ee2 s LYS 28 Ca 0.03 -0.01 -0.21 0.00 -0.36 0.00 0.00 55.97 55.42 2ee2 s LYS 28 Cb -0.13 -3.22 0.05 0.00 -1.51 0.00 0.00 37.83 33.02 2ee2 s LYS 28 CO -0.11 0.71 0.73 0.08 -0.36 0.00 0.00 175.35 176.41 2ee2 s VAL 29 N -0.91 4.71 -0.10 4.02 1.01 -1.26 -1.14 120.40 126.74 2ee2 s VAL 29 Ca 0.17 -0.23 -0.09 0.00 0.00 0.00 0.00 61.98 61.82 2ee2 s VAL 29 Cb -0.13 -4.38 -0.07 0.00 0.00 0.00 0.00 36.38 31.80 2ee2 s VAL 29 CO 0.06 -0.91 0.30 -0.07 0.00 0.00 0.00 175.10 174.47 2ee2 h LEU 30 N 10.14 -0.07 -8.41 3.92 3.38 -1.69 -3.49 115.31 119.10 2ee2 h LEU 30 Ca -0.27 -0.22 -0.21 0.00 0.09 0.00 0.00 57.88 57.27 2ee2 h LEU 30 Cb 1.09 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.79 2ee2 h LEU 30 CO 1.01 0.52 -0.09 -0.44 0.09 0.00 0.00 178.44 179.53 2ee2 s SER 31 N -5.60 0.69 0.50 -0.43 0.01 -0.45 -4.93 113.70 103.49 2ee2 s SER 31 Ca -0.06 -1.39 0.26 0.00 1.31 0.00 0.00 55.95 56.07 2ee2 s SER 31 Cb -0.00 0.70 1.34 0.00 0.21 0.00 0.00 66.02 68.27 2ee2 s SER 31 CO 0.20 -1.37 1.91 0.77 0.41 0.00 0.00 173.24 175.15 2ee2 h SER 32 N 2.09 0.12 -0.30 2.44 4.64 -1.91 -1.09 113.55 119.55 2ee2 h SER 32 Ca -0.29 0.01 -0.24 0.00 -0.47 0.00 0.00 61.79 60.81 2ee2 h SER 32 Cb 1.24 -0.01 -0.26 0.00 -0.31 0.00 0.00 62.40 63.06 2ee2 h SER 32 CO 0.39 0.05 -0.78 -1.20 -0.87 0.00 0.00 176.83 174.42 2ee2 n SER 33 N -4.37 2.59 -3.75 4.97 7.64 -1.26 -3.85 113.62 115.59 2ee2 n SER 33 Ca 0.16 -3.28 -0.12 0.00 1.01 0.00 0.00 58.87 56.64 2ee2 n SER 33 Cb 0.79 -0.42 -0.11 0.00 -1.01 0.00 0.00 64.21 63.45 2ee2 n SER 33 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2ee2 s GLU 34 N -2.89 0.33 -0.25 1.43 0.41 -0.41 -3.42 118.70 113.89 2ee2 s GLU 34 Ca 0.40 0.50 -0.11 0.00 -0.41 0.00 0.00 54.97 55.36 2ee2 s GLU 34 Cb 0.38 0.08 0.10 0.00 -1.78 0.00 0.00 34.13 32.91 2ee2 s GLU 34 CO -0.05 -0.09 0.57 0.42 -0.49 0.00 0.00 175.26 175.62 2ee2 s ILE 35 N 0.58 -0.51 -0.13 -1.63 1.01 -0.89 -1.34 121.20 118.29 2ee2 s ILE 35 Ca -0.03 0.05 -0.10 0.00 0.00 0.00 0.00 60.65 60.57 2ee2 s ILE 35 Cb -0.05 -0.86 -0.05 0.00 0.01 0.00 0.00 42.46 41.51 2ee2 s ILE 35 CO -0.03 0.02 0.19 -0.55 0.00 0.00 0.00 174.94 174.57 2ee2 s SER 36 N 2.28 6.40 -0.29 3.58 0.15 -0.29 0.68 113.70 126.21 2ee2 s SER 36 Ca -0.07 0.47 -0.01 0.00 0.70 0.00 0.00 55.95 57.05 2ee2 s SER 36 Cb -0.10 -2.12 0.05 0.00 -1.71 0.00 0.00 66.02 62.15 2ee2 s SER 36 CO -0.17 0.29 -0.03 -0.69 1.20 0.00 0.00 173.24 173.84 2ee2 s VAL 37 N -0.43 2.79 -0.06 4.45 1.01 0.16 -0.02 120.40 128.31 2ee2 s VAL 37 Ca 0.14 -1.41 -0.03 0.00 0.00 0.00 0.00 61.98 60.69 2ee2 s VAL 37 Cb -0.12 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 2ee2 s VAL 37 CO 0.04 -0.06 0.08 -1.00 0.00 0.00 0.00 175.10 174.15 2ee2 s HIS 38 N 1.22 3.34 0.21 5.22 3.76 -0.63 -0.01 115.29 128.40 2ee2 s HIS 38 Ca -0.06 0.29 -0.05 0.00 -0.15 0.00 0.00 55.06 55.09 2ee2 s HIS 38 Cb -0.20 -1.81 -0.03 0.00 1.11 0.00 0.00 32.58 31.66 2ee2 s HIS 38 CO -0.02 0.58 0.25 1.67 -0.85 0.00 0.00 174.74 176.36 2ee2 s TRP 39 N -1.07 0.84 0.25 1.40 -2.14 -0.57 -1.15 118.94 116.51 2ee2 s TRP 39 Ca 0.18 -1.12 -0.07 0.00 2.66 0.00 0.00 56.10 57.75 2ee2 s TRP 39 Cb -0.12 -0.28 -0.06 0.00 -3.10 0.00 0.00 33.47 29.91 2ee2 s TRP 39 CO 0.08 -0.75 0.54 -2.00 -2.66 0.00 0.00 176.95 172.16 2ee2 s GLU 40 N -4.10 3.72 0.04 3.25 2.56 -1.17 -4.69 118.70 118.30 2ee2 s GLU 40 Ca 0.31 0.14 -0.30 0.00 0.00 0.00 0.00 54.97 55.13 2ee2 s GLU 40 Cb 0.04 -2.66 -0.04 0.00 2.00 0.00 0.00 34.13 33.48 2ee2 s GLU 40 CO 0.10 0.28 0.97 -1.01 -0.56 0.00 0.00 175.26 175.03 2ee2 s HIS 41 N -1.93 3.71 0.37 5.30 3.76 -1.26 -4.61 115.29 120.64 2ee2 s HIS 41 Ca 0.46 1.73 -0.22 0.00 -0.15 0.00 0.00 55.06 56.88 2ee2 s HIS 41 Cb -0.11 -3.09 -0.10 0.00 1.11 0.00 0.00 32.58 30.39 2ee2 s HIS 41 CO 0.25 0.07 0.91 0.14 -0.85 0.00 0.00 174.74 175.26 2ee2 s VAL 42 N 0.66 4.39 -0.21 -0.90 -7.23 -1.26 -4.92 120.40 110.93 2ee2 s VAL 42 Ca 0.50 1.50 0.17 0.00 -1.81 0.00 0.00 61.98 62.34 2ee2 s VAL 42 Cb -0.22 -3.73 0.17 0.00 0.56 0.00 0.00 36.38 33.17 2ee2 s VAL 42 CO 0.28 -0.15 1.50 0.00 -0.31 0.00 0.00 175.10 176.43 2ee2 n LEU 43 N -0.20 0.45 -4.63 1.32 -0.00 -1.26 -4.41 117.00 108.27 2ee2 n LEU 43 Ca 0.05 0.68 -0.40 0.00 -0.00 0.00 0.00 56.01 56.34 2ee2 n LEU 43 Cb 0.53 -0.71 -0.07 0.00 -0.00 0.00 0.00 43.42 43.16 2ee2 n LEU 43 CO 0.40 -0.84 0.26 -1.61 -0.00 0.00 0.00 177.39 175.60 2ee2 s GLU 44 N -3.43 4.10 0.00 1.47 0.41 -1.26 -4.93 118.70 115.06 2ee2 s GLU 44 Ca -0.02 0.37 0.23 0.00 -0.41 0.00 0.00 54.97 55.14 2ee2 s GLU 44 Cb 0.05 -3.63 0.47 0.00 -1.78 0.00 0.00 34.13 29.24 2ee2 s GLU 44 CO 0.16 -0.31 1.42 1.63 -0.49 0.00 0.00 175.26 177.66 2ee2 n LYS 45 N 5.40 2.32 0.17 1.61 5.02 -1.26 -4.13 118.16 127.28 2ee2 n LYS 45 Ca -0.04 -1.97 0.05 0.00 -2.02 0.00 0.00 58.31 54.33 2ee2 n LYS 45 Cb 0.50 -1.48 0.13 0.00 -0.02 0.00 0.00 35.03 34.15 2ee2 n LYS 45 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 2ee2 h ILE 46 N 4.04 0.68 -1.24 -0.18 3.07 -1.95 -3.45 117.51 118.48 2ee2 h ILE 46 Ca 0.00 -1.83 -0.68 0.00 1.55 0.00 0.00 64.86 63.90 2ee2 h ILE 46 Cb 0.88 2.24 -0.01 0.00 -0.27 0.00 0.00 36.82 39.66 2ee2 h ILE 46 CO 0.00 0.37 1.31 1.33 -1.05 0.00 0.00 178.15 180.11 2ee2 n VAL 47 N -3.24 0.24 -0.16 0.16 0.24 -1.26 -4.67 118.33 109.65 2ee2 n VAL 47 Ca 0.02 -0.21 -0.02 0.00 -2.04 0.00 0.00 64.34 62.09 2ee2 n VAL 47 Cb 0.65 -1.59 0.05 0.00 -1.47 0.00 0.00 33.84 31.48 2ee2 n VAL 47 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 2ee2 h GLU 48 N 11.27 0.07 -2.08 7.34 4.11 -1.88 -3.47 114.58 129.95 2ee2 h GLU 48 Ca -0.32 -0.00 0.23 0.00 0.07 0.00 0.00 59.36 59.33 2ee2 h GLU 48 Cb 1.32 -0.02 -0.09 0.00 0.50 0.00 0.00 28.75 30.46 2ee2 h GLU 48 CO 1.00 0.05 0.62 -1.54 0.07 0.00 0.00 179.01 179.21 2ee2 s SER 49 N -5.24 -0.11 -0.39 3.06 1.04 -1.26 -4.42 113.70 106.38 2ee2 s SER 49 Ca -0.14 -0.35 -0.11 0.00 0.48 0.00 0.00 55.95 55.83 2ee2 s SER 49 Cb 0.16 0.38 0.04 0.00 0.10 0.00 0.00 66.02 66.70 2ee2 s SER 49 CO 0.72 -0.71 0.23 -0.31 0.98 0.00 0.00 173.24 174.15 2ee2 s TYR 50 N -2.84 3.26 -0.27 5.02 2.02 -1.25 -3.75 117.35 119.54 2ee2 s TYR 50 Ca 0.15 -1.03 -0.20 0.00 -0.37 0.00 0.00 57.07 55.62 2ee2 s TYR 50 Cb 0.00 -2.56 -0.02 0.00 -0.40 0.00 0.00 41.96 38.99 2ee2 s TYR 50 CO 0.01 -0.68 0.63 -1.14 -1.57 0.00 0.00 175.55 172.79 2ee2 s GLN 51 N 1.55 4.03 -0.47 -0.62 0.74 -1.24 -3.72 119.66 119.93 2ee2 s GLN 51 Ca 0.02 0.46 -0.13 0.00 0.05 0.00 0.00 55.36 55.76 2ee2 s GLN 51 Cb -0.20 -3.68 0.10 0.00 1.10 0.00 0.00 33.01 30.33 2ee2 s GLN 51 CO 0.06 -0.47 0.38 0.42 -0.55 0.00 0.00 175.29 175.13 2ee2 s ILE 52 N 2.55 4.80 -0.08 -2.34 1.09 -0.47 -3.78 121.20 122.96 2ee2 s ILE 52 Ca 0.26 -1.38 -0.21 0.00 -1.10 0.00 0.00 60.65 58.22 2ee2 s ILE 52 Cb -0.15 -3.98 -0.04 0.00 -1.06 0.00 0.00 42.46 37.23 2ee2 s ILE 52 CO 0.10 -0.66 0.61 -0.60 -0.10 0.00 0.00 174.94 174.28 2ee2 s ARG 53 N 1.53 4.39 0.02 2.79 3.52 -1.13 -1.15 118.95 128.92 2ee2 s ARG 53 Ca 0.04 0.70 0.00 0.00 -0.13 0.00 0.00 55.73 56.35 2ee2 s ARG 53 Cb -0.26 -3.44 -0.02 0.00 -1.56 0.00 0.00 34.95 29.68 2ee2 s ARG 53 CO 0.03 0.12 -0.03 1.52 -0.81 0.00 0.00 175.30 176.13 2ee2 s TYR 54 N 0.67 0.28 -0.19 5.12 1.13 -1.12 -2.55 117.35 120.69 2ee2 s TYR 54 Ca 0.33 -0.41 -0.29 0.00 -1.41 0.00 0.00 57.07 55.28 2ee2 s TYR 54 Cb -0.17 -0.19 0.13 0.00 -1.10 0.00 0.00 41.96 40.64 2ee2 s TYR 54 CO 0.15 -0.13 1.04 1.67 -2.51 0.00 0.00 175.55 175.77 2ee2 s TRP 55 N -1.13 -0.35 0.59 -3.49 -2.14 -1.24 -1.92 118.94 109.25 2ee2 s TRP 55 Ca -0.12 0.65 -0.20 0.00 2.66 0.00 0.00 56.10 59.09 2ee2 s TRP 55 Cb -0.08 0.44 -0.03 0.00 -3.10 0.00 0.00 33.47 30.70 2ee2 s TRP 55 CO -0.01 -0.29 1.32 0.00 -2.66 0.00 0.00 176.95 175.31 2ee2 s ALA 56 N -0.88 2.64 0.54 2.67 0.00 -1.26 -2.18 121.76 123.29 2ee2 s ALA 56 Ca -0.00 1.26 0.31 0.00 0.00 0.00 0.00 51.96 53.54 2ee2 s ALA 56 Cb -0.01 -3.55 1.48 0.00 0.00 0.00 0.00 23.12 21.04 2ee2 s ALA 56 CO -0.01 -1.43 1.89 0.00 0.00 0.00 0.00 175.76 176.21 2ee2 h ALA 57 N 1.09 2.83 0.18 0.00 0.00 -1.77 0.16 119.26 121.75 2ee2 h ALA 57 Ca -0.51 -0.03 -0.30 0.00 0.00 0.00 0.00 54.91 54.07 2ee2 h ALA 57 Cb 1.31 0.07 0.02 0.00 0.00 0.00 0.00 17.79 19.19 2ee2 h ALA 57 CO 0.56 -1.09 -1.39 1.12 0.00 0.00 0.00 179.25 178.45 2ee2 h HIS 58 N 0.00 0.68 -4.27 0.00 2.07 -1.89 -3.46 115.15 108.28 2ee2 h HIS 58 Ca 0.42 -0.50 -0.52 0.00 -2.85 0.00 0.00 60.37 56.92 2ee2 h HIS 58 Cb 1.68 -0.03 0.18 0.00 2.57 0.00 0.00 27.41 31.82 2ee2 h HIS 58 CO 0.00 1.41 0.26 -0.51 -3.07 0.00 0.00 177.93 176.02 2ee2 s ASP 59 N -7.30 3.32 0.38 3.10 1.01 0.56 -5.04 116.67 112.71 2ee2 s ASP 59 Ca -0.07 2.16 0.07 0.00 0.71 0.00 0.00 52.55 55.42 2ee2 s ASP 59 Cb 0.06 -2.56 -0.01 0.00 1.01 0.00 0.00 42.92 41.41 2ee2 s ASP 59 CO 0.90 -2.84 0.43 -0.54 0.21 0.00 0.00 175.17 173.33 2ee2 s LYS 60 N -4.60 2.78 0.50 8.23 -0.14 -1.26 -4.77 119.74 120.48 2ee2 s LYS 60 Ca 0.67 -1.29 0.24 0.00 -1.36 0.00 0.00 55.97 54.23 2ee2 s LYS 60 Cb -0.23 -2.59 1.33 0.00 -1.68 0.00 0.00 37.83 34.66 2ee2 s LYS 60 CO 0.56 -0.09 2.05 1.49 -0.76 0.00 0.00 175.35 178.60 2ee2 h GLU 61 N 0.95 0.00 -0.40 1.68 4.81 -1.96 -0.71 114.58 118.96 2ee2 h GLU 61 Ca -0.43 0.00 -0.14 0.00 -0.13 0.00 0.00 59.36 58.67 2ee2 h GLU 61 Cb 1.26 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.63 2ee2 h GLU 61 CO 0.53 0.14 -0.30 1.05 -0.73 0.00 0.00 179.01 179.71 2ee2 h GLU 62 N 0.00 0.86 -0.16 1.92 4.11 -2.02 -2.87 114.58 116.42 2ee2 h GLU 62 Ca -0.00 -0.40 0.00 0.00 0.07 0.00 0.00 59.36 59.03 2ee2 h GLU 62 Cb 0.34 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2ee2 h GLU 62 CO 0.02 1.04 0.00 0.00 0.07 0.00 0.00 179.01 180.14 2ee2 n ALA 63 N -2.52 2.49 -1.77 1.06 0.00 -0.93 -4.95 120.51 113.90 2ee2 n ALA 63 Ca -0.01 -0.67 -0.40 0.00 0.00 0.00 0.00 53.44 52.36 2ee2 n ALA 63 Cb 0.49 -0.98 -0.02 0.00 0.00 0.00 0.00 19.45 18.94 2ee2 n ALA 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ee2 s ALA 64 N -1.81 3.44 0.76 0.00 0.00 -0.32 -4.90 121.76 118.93 2ee2 s ALA 64 Ca 0.34 1.23 -0.04 0.00 0.00 0.00 0.00 51.96 53.50 2ee2 s ALA 64 Cb 0.20 -3.47 0.13 0.00 0.00 0.00 0.00 23.12 19.98 2ee2 s ALA 64 CO 0.30 -0.66 0.82 0.09 0.00 0.00 0.00 175.76 176.32 2ee2 n ASN 65 N 0.66 0.72 -3.56 0.00 3.02 -0.81 -4.94 115.26 110.35 2ee2 n ASN 65 Ca 0.01 -1.70 -0.01 0.00 -0.03 0.00 0.00 54.58 52.85 2ee2 n ASN 65 Cb 0.42 -0.57 -0.05 0.00 -0.61 0.00 0.00 39.78 38.98 2ee2 n ASN 65 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ee2 s ARG 66 N -4.65 0.46 -0.23 3.52 1.70 -1.26 -2.78 118.95 115.70 2ee2 s ARG 66 Ca 0.52 1.06 -0.07 0.00 -0.47 0.00 0.00 55.73 56.76 2ee2 s ARG 66 Cb -0.02 0.52 -0.03 0.00 -0.57 0.00 0.00 34.95 34.84 2ee2 s ARG 66 CO 0.35 -0.14 0.07 0.08 -1.08 0.00 0.00 175.30 174.58 2ee2 s VAL 67 N 2.36 4.47 -0.08 4.99 1.01 -0.30 -4.89 120.40 127.96 2ee2 s VAL 67 Ca -0.06 -0.13 -0.04 0.00 0.00 0.00 0.00 61.98 61.76 2ee2 s VAL 67 Cb -0.08 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 2ee2 s VAL 67 CO -0.18 0.37 0.07 -1.58 0.00 0.00 0.00 175.10 173.78 2ee2 s GLN 68 N 1.28 3.19 0.21 2.72 -0.44 -1.26 -1.37 119.66 123.98 2ee2 s GLN 68 Ca 0.05 -0.31 -0.01 0.00 -2.50 0.00 0.00 55.36 52.59 2ee2 s GLN 68 Cb -0.15 -2.97 -0.04 0.00 -1.64 0.00 0.00 33.01 28.22 2ee2 s GLN 68 CO 0.04 0.72 0.13 0.14 0.50 0.00 0.00 175.29 176.82 2ee2 s VAL 69 N -1.01 0.02 0.31 1.34 -7.23 -1.24 -5.05 120.40 107.54 2ee2 s VAL 69 Ca 0.16 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.04 2ee2 s VAL 69 Cb -0.12 -2.51 -0.10 0.00 0.56 0.00 0.00 36.38 34.22 2ee2 s VAL 69 CO 0.05 0.00 1.31 0.42 -0.31 0.00 0.00 175.10 176.58 2ee2 s THR 70 N -4.11 2.78 0.53 5.32 -4.23 -1.26 -3.89 115.64 110.77 2ee2 s THR 70 Ca 0.39 0.76 0.25 0.00 -1.18 0.00 0.00 61.69 61.91 2ee2 s THR 70 Cb 0.07 -3.48 0.25 0.00 1.34 0.00 0.00 72.50 70.67 2ee2 s THR 70 CO 0.13 0.17 1.73 0.77 -0.54 0.00 0.00 174.62 176.88 2ee2 h SER 71 N 3.73 0.00 0.47 3.99 4.64 -1.90 0.44 113.55 124.93 2ee2 h SER 71 Ca -0.48 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.65 2ee2 h SER 71 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 2ee2 h SER 71 CO 0.68 0.00 -0.82 1.56 -0.87 0.00 0.00 176.83 177.37 2ee2 h GLN 72 N 0.00 0.26 -5.91 4.77 1.08 -1.96 -3.42 115.11 109.92 2ee2 h GLN 72 Ca 0.00 -0.25 -0.51 0.00 -1.45 0.00 0.00 58.65 56.44 2ee2 h GLN 72 Cb 0.73 0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 28.21 2ee2 h GLN 72 CO 0.00 0.94 1.44 -1.21 -0.95 0.00 0.00 178.83 179.05 2ee2 s GLU 73 N -3.36 2.60 0.27 1.46 0.41 0.15 -4.80 118.70 115.45 2ee2 s GLU 73 Ca -0.04 1.08 0.20 0.00 -0.41 0.00 0.00 54.97 55.80 2ee2 s GLU 73 Cb 0.10 -4.42 1.02 0.00 -1.78 0.00 0.00 34.13 29.06 2ee2 s GLU 73 CO 0.83 -2.73 1.61 0.66 -0.49 0.00 0.00 175.26 175.14 2ee2 n TYR 74 N 13.29 0.67 -4.12 1.61 4.01 -1.26 -4.74 117.16 126.63 2ee2 n TYR 74 Ca 0.26 0.33 -0.16 0.00 -0.16 0.00 0.00 57.90 58.18 2ee2 n TYR 74 Cb 0.52 -1.03 -0.04 0.00 -0.31 0.00 0.00 39.34 38.47 2ee2 n TYR 74 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 2ee2 s SER 75 N -3.97 1.10 0.27 7.72 1.04 -1.26 -1.50 113.70 117.09 2ee2 s SER 75 Ca -0.01 -1.55 0.01 0.00 0.48 0.00 0.00 55.95 54.88 2ee2 s SER 75 Cb 0.06 0.66 -0.03 0.00 0.10 0.00 0.00 66.02 66.82 2ee2 s SER 75 CO 0.22 -1.29 0.25 0.00 0.98 0.00 0.00 173.24 173.40 2ee2 s ALA 76 N -3.02 1.27 -0.01 5.32 0.00 0.98 -4.96 121.76 121.34 2ee2 s ALA 76 Ca 0.32 -1.76 0.03 0.00 0.00 0.00 0.00 51.96 50.56 2ee2 s ALA 76 Cb -0.00 1.37 -0.01 0.00 0.00 0.00 0.00 23.12 24.48 2ee2 s ALA 76 CO 0.22 -0.66 -0.11 0.50 0.00 0.00 0.00 175.76 175.71 2ee2 s ARG 77 N -3.77 0.95 -0.11 0.00 3.52 -1.26 -0.66 118.95 117.62 2ee2 s ARG 77 Ca 0.37 -0.41 -0.01 0.00 -0.13 0.00 0.00 55.73 55.56 2ee2 s ARG 77 Cb 0.04 -0.92 -0.02 0.00 -1.56 0.00 0.00 34.95 32.49 2ee2 s ARG 77 CO 0.18 0.24 -0.08 -0.51 -0.81 0.00 0.00 175.30 174.32 2ee2 s LEU 78 N -0.22 3.03 0.16 -0.88 1.43 0.21 -4.97 118.68 117.44 2ee2 s LEU 78 Ca 0.04 -0.15 0.03 0.00 -1.03 0.00 0.00 54.13 53.01 2ee2 s LEU 78 Cb -0.05 -1.68 -0.05 0.00 0.03 0.00 0.00 46.19 44.44 2ee2 s LEU 78 CO -0.00 0.25 -0.04 -1.61 0.23 0.00 0.00 176.35 175.17 2ee2 s GLU 79 N -0.14 1.08 -0.70 1.70 2.02 -1.26 -2.09 118.70 119.31 2ee2 s GLU 79 Ca 0.01 -1.50 -0.01 0.00 0.02 0.00 0.00 54.97 53.49 2ee2 s GLU 79 Cb -0.13 -0.42 -0.01 0.00 0.10 0.00 0.00 34.13 33.66 2ee2 s GLU 79 CO 0.03 -0.04 0.60 0.09 0.02 0.00 0.00 175.26 175.95 2ee2 n ASN 80 N -0.22 -3.00 -4.85 -0.19 5.03 -1.22 -5.01 115.26 105.80 2ee2 n ASN 80 Ca -0.08 -0.40 -0.26 0.00 0.87 0.00 0.00 54.58 54.71 2ee2 n ASN 80 Cb 0.62 -3.36 -0.03 0.00 -1.02 0.00 0.00 39.78 35.99 2ee2 n ASN 80 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2ee2 s LEU 81 N -4.60 2.85 -0.06 3.41 1.43 -1.26 -5.10 118.68 115.36 2ee2 s LEU 81 Ca 0.10 -1.18 -0.04 0.00 -1.03 0.00 0.00 54.13 51.98 2ee2 s LEU 81 Cb -0.01 -1.32 -0.04 0.00 0.03 0.00 0.00 46.19 44.84 2ee2 s LEU 81 CO 0.45 -0.90 0.14 -0.76 0.23 0.00 0.00 176.35 175.52 2ee2 s LEU 82 N -4.14 4.28 0.31 1.79 1.43 -1.26 -4.63 118.68 116.45 2ee2 s LEU 82 Ca 0.35 0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 53.52 2ee2 s LEU 82 Cb -0.01 -2.31 -0.10 0.00 0.03 0.00 0.00 46.19 43.81 2ee2 s LEU 82 CO 0.21 0.33 1.23 -2.16 0.23 0.00 0.00 176.35 176.18 2ee2 s PRO 83 N -1.48 4.47 -1.30 1.29 0.04 -1.25 -3.59 135.00 133.17 2ee2 s PRO 83 Ca 0.21 2.05 -0.13 0.00 0.04 0.00 0.00 61.00 63.18 2ee2 s PRO 83 Cb -0.12 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.30 2ee2 s PRO 83 CO 0.11 -0.03 0.55 -3.47 0.04 0.00 0.00 177.00 174.20 2ee2 n ASP 84 N 1.00 -2.47 -3.86 6.66 2.03 0.23 -4.88 116.55 115.25 2ee2 n ASP 84 Ca -0.00 -1.08 -0.16 0.00 0.52 0.00 0.00 54.79 54.06 2ee2 n ASP 84 Cb 0.43 -2.82 -0.15 0.00 -0.72 0.00 0.00 41.12 37.85 2ee2 n ASP 84 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2ee2 s THR 85 N -3.76 0.24 0.22 5.18 2.01 -1.24 -4.91 115.64 113.38 2ee2 s THR 85 Ca 0.24 -0.01 -0.30 0.00 0.31 0.00 0.00 61.69 61.93 2ee2 s THR 85 Cb -0.10 -0.28 -0.09 0.00 0.01 0.00 0.00 72.50 72.04 2ee2 s THR 85 CO 0.90 0.12 1.25 -1.58 -0.69 0.00 0.00 174.62 174.62 2ee2 s GLN 86 N 0.61 4.45 -0.08 4.92 2.00 -1.26 -3.14 119.66 127.15 2ee2 s GLN 86 Ca -0.06 1.99 -0.01 0.00 -2.00 0.00 0.00 55.36 55.27 2ee2 s GLN 86 Cb -0.09 -3.19 0.03 0.00 0.80 0.00 0.00 33.01 30.55 2ee2 s GLN 86 CO -0.01 -0.13 -0.02 0.71 -0.50 0.00 0.00 175.29 175.34 2ee2 s TYR 87 N -0.27 0.87 -0.61 1.67 1.51 0.19 -1.92 117.35 118.80 2ee2 s TYR 87 Ca 0.53 -0.31 -0.27 0.00 -1.01 0.00 0.00 57.07 56.01 2ee2 s TYR 87 Cb -0.35 -0.91 0.03 0.00 -0.11 0.00 0.00 41.96 40.62 2ee2 s TYR 87 CO 0.40 -0.38 1.14 -0.06 -1.11 0.00 0.00 175.55 175.55 2ee2 s PHE 88 N 1.91 2.58 -0.11 2.71 0.08 -0.93 -1.68 117.98 122.56 2ee2 s PHE 88 Ca 0.05 0.18 -0.06 0.00 0.12 0.00 0.00 56.93 57.22 2ee2 s PHE 88 Cb -0.12 -4.43 -0.04 0.00 -0.57 0.00 0.00 43.02 37.86 2ee2 s PHE 88 CO -0.06 -1.64 0.14 0.42 -0.10 0.00 0.00 175.22 173.98 2ee2 s ILE 89 N 4.85 5.47 -0.08 0.64 1.01 0.11 -3.72 121.20 129.49 2ee2 s ILE 89 Ca 0.38 0.15 -0.04 0.00 0.00 0.00 0.00 60.65 61.14 2ee2 s ILE 89 Cb -0.09 -3.40 0.04 0.00 0.01 0.00 0.00 42.46 39.02 2ee2 s ILE 89 CO 0.21 0.58 0.17 -0.70 0.00 0.00 0.00 174.94 175.21 2ee2 s GLU 90 N -1.14 0.13 -0.29 2.79 -6.30 -1.06 -1.71 118.70 111.12 2ee2 s GLU 90 Ca 0.16 0.41 -0.01 0.00 -2.50 0.00 0.00 54.97 53.03 2ee2 s GLU 90 Cb -0.12 -0.16 0.05 0.00 0.00 0.00 0.00 34.13 33.90 2ee2 s GLU 90 CO 0.06 -0.16 -0.01 0.08 0.02 0.00 0.00 175.26 175.24 2ee2 s VAL 91 N 1.17 2.92 -0.06 3.70 1.01 -1.26 -2.83 120.40 125.05 2ee2 s VAL 91 Ca -0.09 -1.38 0.01 0.00 0.00 0.00 0.00 61.98 60.53 2ee2 s VAL 91 Cb -0.11 -2.67 0.02 0.00 0.00 0.00 0.00 36.38 33.62 2ee2 s VAL 91 CO -0.06 -0.08 -0.07 -0.83 0.00 0.00 0.00 175.10 174.06 2ee2 s GLY 92 N 1.25 0.58 -0.04 4.51 0.00 -1.25 -3.39 107.32 108.98 2ee2 s GLY 92 Ca -0.05 -0.21 -0.25 0.00 0.00 0.00 0.00 44.72 44.21 2ee2 s GLY 92 CO -0.02 0.40 0.76 0.00 0.00 0.00 0.00 173.10 174.25 2ee2 s ALA 93 N 0.95 3.31 -0.23 3.20 0.00 -1.26 -3.72 121.76 124.00 2ee2 s ALA 93 Ca -0.10 0.23 -0.16 0.00 0.00 0.00 0.00 51.96 51.92 2ee2 s ALA 93 Cb -0.15 -3.03 0.07 0.00 0.00 0.00 0.00 23.12 20.01 2ee2 s ALA 93 CO 0.00 -0.10 0.58 0.00 0.00 0.00 0.00 175.76 176.24 2ee2 s ASN 95 N 1.01 5.62 0.62 0.00 4.22 -1.21 -3.83 114.94 121.37 2ee2 s ASN 95 Ca -0.06 0.00 0.28 0.00 -2.14 0.00 0.00 52.86 50.94 2ee2 s ASN 95 Cb -0.05 -1.53 1.41 0.00 1.28 0.00 0.00 41.25 42.36 2ee2 s ASN 95 CO -0.09 0.15 1.82 -1.28 -2.04 0.00 0.00 177.10 175.66 2ee2 h SER 96 N 3.12 0.00 0.00 3.54 0.87 -1.97 -2.83 113.55 116.29 2ee2 h SER 96 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 2ee2 h SER 96 Cb 1.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.13 2ee2 h SER 96 CO 0.66 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.96 2ee2 n ALA 97 N -2.16 -0.15 -2.57 6.23 0.00 -1.26 -4.93 120.51 115.67 2ee2 n ALA 97 Ca 0.06 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.27 2ee2 n ALA 97 Cb 0.66 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.05 2ee2 n ALA 97 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2ee2 s GLY 98 N -0.96 1.82 -0.01 0.00 0.00 -0.80 -4.86 107.32 102.50 2ee2 s GLY 98 Ca 0.00 -1.73 -0.05 0.00 0.00 0.00 0.00 44.72 42.93 2ee2 s GLY 98 CO 0.00 -1.70 0.23 0.00 0.00 0.00 0.00 173.10 171.63 2ee2 s GLY 100 N -1.73 0.87 0.24 0.00 0.00 -1.26 -4.38 107.32 101.07 2ee2 s GLY 100 Ca 0.26 -0.99 -0.30 0.00 0.00 0.00 0.00 44.72 43.70 2ee2 s GLY 100 CO 0.16 -1.01 1.28 2.56 0.00 0.00 0.00 173.10 176.08 2ee2 s PRO 101 N -1.69 4.42 0.78 2.90 0.04 -1.26 -4.89 135.00 135.30 2ee2 s PRO 101 Ca -0.01 2.05 -0.11 0.00 0.04 0.00 0.00 61.00 62.97 2ee2 s PRO 101 Cb -0.10 -3.16 0.06 0.00 0.04 0.00 0.00 34.50 31.34 2ee2 s PRO 101 CO 0.02 -0.16 1.09 -1.25 0.04 0.00 0.00 177.00 176.74 2ee2 s PRO 102 N -0.72 2.18 0.76 0.56 0.04 -1.26 -4.71 135.00 131.84 2ee2 s PRO 102 Ca 0.53 1.15 -0.13 0.00 0.04 0.00 0.00 61.00 62.59 2ee2 s PRO 102 Cb -0.37 -1.89 0.19 0.00 0.04 0.00 0.00 34.50 32.47 2ee2 s PRO 102 CO 0.42 -1.69 0.75 -1.13 0.04 0.00 0.00 177.00 175.39 2ee2 n SER 103 N -3.55 -1.26 -4.65 6.66 3.41 -1.22 -4.94 113.62 108.07 2ee2 n SER 103 Ca 0.09 -1.03 -0.43 0.00 -0.26 0.00 0.00 58.87 57.24 2ee2 n SER 103 Cb 0.53 -0.66 -0.02 0.00 -0.26 0.00 0.00 64.21 63.80 2ee2 n SER 103 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 2ee2 s ASP 104 N -3.62 6.71 -0.34 4.04 1.11 -1.26 -4.87 116.67 118.43 2ee2 s ASP 104 Ca 0.47 1.73 -0.39 0.00 0.18 0.00 0.00 52.55 54.53 2ee2 s ASP 104 Cb -0.04 -2.54 -0.15 0.00 1.07 0.00 0.00 42.92 41.27 2ee2 s ASP 104 CO 0.35 -0.96 1.96 0.80 1.18 0.00 0.00 175.17 178.50 2ee2 n MET 105 N 7.08 0.92 -4.42 8.23 0.00 -1.26 -4.88 117.12 122.78 2ee2 n MET 105 Ca 0.16 0.30 -0.32 0.00 -0.00 0.00 0.00 57.70 57.84 2ee2 n MET 105 Cb 0.45 -2.12 -0.10 0.00 0.00 0.00 0.00 33.22 31.45 2ee2 n MET 105 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 2ee2 s ILE 106 N 5.23 3.77 0.11 1.12 1.01 -0.69 -5.01 121.20 126.74 2ee2 s ILE 106 Ca 1.06 -0.72 0.07 0.00 0.00 0.00 0.00 60.65 61.06 2ee2 s ILE 106 Cb -1.08 -2.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 2ee2 s ILE 106 CO 0.61 0.40 -0.10 -1.83 0.00 0.00 0.00 174.94 174.01 2ee2 s GLU 107 N -1.43 2.12 0.02 2.79 -1.05 -1.26 0.06 118.70 119.95 2ee2 s GLU 107 Ca 0.17 -1.05 -0.01 0.00 -0.15 0.00 0.00 54.97 53.93 2ee2 s GLU 107 Cb -0.11 -2.29 -0.02 0.00 -0.44 0.00 0.00 34.13 31.27 2ee2 s GLU 107 CO 0.08 0.50 0.00 0.00 0.95 0.00 0.00 175.26 176.79 2ee2 s ALA 108 N -1.26 0.06 -0.24 -0.84 0.00 -0.67 -4.93 121.76 113.88 2ee2 s ALA 108 Ca 0.22 -0.55 0.02 0.00 0.00 0.00 0.00 51.96 51.65 2ee2 s ALA 108 Cb -0.11 0.15 0.06 0.00 0.00 0.00 0.00 23.12 23.22 2ee2 s ALA 108 CO 0.14 -0.18 -0.09 -0.06 0.00 0.00 0.00 175.76 175.56 2ee2 s PHE 109 N -1.61 2.76 1.15 0.00 0.40 -1.26 -0.64 117.98 118.78 2ee2 s PHE 109 Ca -0.14 -1.95 -0.13 0.00 -0.60 0.00 0.00 56.93 54.11 2ee2 s PHE 109 Cb -0.08 -1.74 0.28 0.00 0.51 0.00 0.00 43.02 41.98 2ee2 s PHE 109 CO -0.01 -0.81 1.03 0.95 0.70 0.00 0.00 175.22 177.08 2ee2 s THR 110 N 1.27 2.02 0.97 0.64 -4.23 -1.19 -4.91 115.64 110.21 2ee2 s THR 110 Ca -0.06 0.01 -0.15 0.00 -1.18 0.00 0.00 61.69 60.31 2ee2 s THR 110 Cb -0.19 -2.07 0.22 0.00 1.34 0.00 0.00 72.50 71.80 2ee2 s THR 110 CO -0.06 -0.01 1.32 -0.54 -0.54 0.00 0.00 174.62 174.79 2ee2 s LYS 111 N -4.48 0.47 -0.16 3.99 -0.14 -1.26 -3.77 119.74 114.38 2ee2 s LYS 111 Ca 0.68 -0.59 -0.17 0.00 -1.36 0.00 0.00 55.97 54.54 2ee2 s LYS 111 Cb -0.25 -1.87 -0.04 0.00 -1.68 0.00 0.00 37.83 33.99 2ee2 s LYS 111 CO 0.64 -2.49 0.42 0.15 -0.76 0.00 0.00 175.35 173.31 2ee2 s LYS 112 N -5.88 4.25 -0.87 1.68 1.02 -1.26 0.78 119.74 119.46 2ee2 s LYS 112 Ca 0.76 0.30 -0.26 0.00 0.02 0.00 0.00 55.97 56.79 2ee2 s LYS 112 Cb -0.02 -3.48 -0.14 0.00 -0.52 0.00 0.00 37.83 33.66 2ee2 s LYS 112 CO 0.53 0.06 2.30 0.00 -0.92 0.00 0.00 175.35 177.32 2ee2 s ALA 113 N 0.96 0.77 0.57 5.17 0.00 -1.26 -4.91 121.76 123.06 2ee2 s ALA 113 Ca 0.22 -1.03 -0.20 0.00 0.00 0.00 0.00 51.96 50.94 2ee2 s ALA 113 Cb -0.15 -4.60 -0.04 0.00 0.00 0.00 0.00 23.12 18.33 2ee2 s ALA 113 CO 0.08 -5.99 1.24 -1.12 0.00 0.00 0.00 175.76 169.97 2ee2 s SER 114 N 10.04 5.33 0.42 0.00 0.01 -1.26 -5.04 113.70 123.20 2ee2 s SER 114 Ca 0.88 2.47 0.03 0.00 1.31 0.00 0.00 55.95 60.63 2ee2 s SER 114 Cb -0.10 -2.61 -0.02 0.00 0.21 0.00 0.00 66.02 63.49 2ee2 s SER 114 CO 0.09 -1.51 0.11 -0.83 0.41 0.00 0.00 173.24 171.51 2ee2 s GLY 115 N -1.42 2.67 -0.23 3.44 0.00 -1.26 -5.10 107.32 105.42 2ee2 s GLY 115 Ca 0.74 -1.13 -0.29 0.00 0.00 0.00 0.00 44.72 44.04 2ee2 s GLY 115 CO 0.37 -1.89 1.62 2.56 0.00 0.00 0.00 173.10 175.76 2ee2 s PRO 116 N -3.73 3.76 0.00 2.90 0.04 -1.26 -4.87 135.00 131.84 2ee2 s PRO 116 Ca 0.21 1.63 0.19 0.00 0.04 0.00 0.00 61.00 63.07 2ee2 s PRO 116 Cb 0.02 -4.05 0.91 0.00 0.04 0.00 0.00 34.50 31.43 2ee2 s PRO 116 CO 0.13 -1.34 1.61 -1.13 0.04 0.00 0.00 177.00 176.32 2ee2 n SER 117 N 8.57 0.81 -3.92 6.66 3.41 -1.26 -4.54 113.62 123.35 2ee2 n SER 117 Ca 0.19 -1.57 -0.30 0.00 -0.26 0.00 0.00 58.87 56.92 2ee2 n SER 117 Cb 0.45 -0.05 -0.14 0.00 -0.26 0.00 0.00 64.21 64.21 2ee2 n SER 117 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2ee2 s SER 118 N -1.56 4.36 0.00 4.04 0.01 -1.26 -5.37 113.70 113.92 2ee2 s SER 118 Ca 0.29 -2.52 0.00 0.00 1.31 0.00 0.00 55.95 55.03 2ee2 s SER 118 Cb 0.15 -1.48 0.00 0.00 0.21 0.00 0.00 66.02 64.90 2ee2 s SER 118 CO 0.23 -0.31 0.01 0.61 0.41 0.00 0.00 173.24 174.19