#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 2.61 0.05 1.61 1.04 -1.26 -5.15 113.70 112.61 2ee2 s SER 2 Ca 0.00 -0.56 -0.02 0.00 0.48 0.00 0.00 55.95 55.85 2ee2 s SER 2 Cb 0.00 -0.21 -0.03 0.00 0.10 0.00 0.00 66.02 65.88 2ee2 s SER 2 CO 0.00 0.16 -0.00 -0.94 0.98 0.00 0.00 173.24 173.44 2ee2 s SER 3 N -1.33 0.41 -0.30 7.02 1.04 -1.26 -5.14 113.70 114.15 2ee2 s SER 3 Ca 0.08 -0.89 -0.11 0.00 0.48 0.00 0.00 55.95 55.51 2ee2 s SER 3 Cb -0.09 0.21 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 2ee2 s SER 3 CO 0.02 -0.58 0.19 -0.83 0.98 0.00 0.00 173.24 173.02 2ee2 s GLY 4 N -2.73 1.92 -0.35 7.32 0.00 -1.26 -5.04 107.32 107.18 2ee2 s GLY 4 Ca 0.04 -1.19 -0.29 0.00 0.00 0.00 0.00 44.72 43.28 2ee2 s GLY 4 CO -0.09 0.68 1.58 -1.35 0.00 0.00 0.00 173.10 173.92 2ee2 s SER 5 N 1.73 6.19 -1.44 1.64 1.04 -1.26 -3.70 113.70 117.90 2ee2 s SER 5 Ca 0.07 1.14 -0.10 0.00 0.48 0.00 0.00 55.95 57.53 2ee2 s SER 5 Cb -0.16 -2.53 0.10 0.00 0.10 0.00 0.00 66.02 63.53 2ee2 s SER 5 CO 0.10 -1.49 0.26 -0.24 0.98 0.00 0.00 173.24 172.85 2ee2 n SER 6 N 9.25 -0.41 -2.62 7.02 2.88 -1.26 -4.81 113.62 123.67 2ee2 n SER 6 Ca 0.19 -1.06 -0.22 0.00 -1.33 0.00 0.00 58.87 56.46 2ee2 n SER 6 Cb 0.47 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.60 2ee2 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ee2 n GLY 7 N -1.62 4.66 3.16 0.46 0.00 -1.24 -5.04 105.19 105.56 2ee2 n GLY 7 Ca -0.08 -2.33 -0.30 0.00 0.00 0.00 0.00 46.02 43.31 2ee2 n GLY 7 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ee2 s VAL 8 N -4.61 1.82 -0.29 1.61 1.01 -1.26 -4.96 120.40 113.72 2ee2 s VAL 8 Ca 0.42 -0.87 -0.25 0.00 0.00 0.00 0.00 61.98 61.29 2ee2 s VAL 8 Cb 0.40 -1.59 0.14 0.00 0.00 0.00 0.00 36.38 35.32 2ee2 s VAL 8 CO -0.12 0.51 1.11 0.00 0.00 0.00 0.00 175.10 176.60 2ee2 s ALA 9 N 0.53 -2.04 0.32 5.51 0.00 -1.26 -5.18 121.76 119.64 2ee2 s ALA 9 Ca -0.15 1.85 0.07 0.00 0.00 0.00 0.00 51.96 53.73 2ee2 s ALA 9 Cb -0.17 -1.52 -0.02 0.00 0.00 0.00 0.00 23.12 21.40 2ee2 s ALA 9 CO 0.06 -0.21 0.35 0.14 0.00 0.00 0.00 175.76 176.09 2ee2 s VAL 10 N 0.24 3.91 -0.36 0.00 -7.23 -1.26 -5.01 120.40 110.69 2ee2 s VAL 10 Ca 0.03 -1.23 0.05 0.00 -1.81 0.00 0.00 61.98 59.02 2ee2 s VAL 10 Cb -0.05 -3.32 0.52 0.00 0.56 0.00 0.00 36.38 34.09 2ee2 s VAL 10 CO -0.09 -0.20 1.62 2.30 -0.31 0.00 0.00 175.10 178.43 2ee2 n ILE 11 N -1.44 2.49 -3.61 -0.62 -5.35 -1.26 -4.79 119.36 104.78 2ee2 n ILE 11 Ca -0.02 -1.33 -0.20 0.00 -0.27 0.00 0.00 62.75 60.93 2ee2 n ILE 11 Cb 0.59 -0.54 -0.16 0.00 -1.74 0.00 0.00 39.64 37.79 2ee2 n ILE 11 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 2ee2 s ASN 12 N -0.67 1.38 0.69 7.28 -0.87 -1.26 -5.14 114.94 116.35 2ee2 s ASN 12 Ca 0.42 -0.09 -0.16 0.00 -1.57 0.00 0.00 52.86 51.46 2ee2 s ASN 12 Cb 0.34 0.11 0.02 0.00 -0.02 0.00 0.00 41.25 41.71 2ee2 s ASN 12 CO 0.09 -0.29 1.18 -0.94 -2.57 0.00 0.00 177.10 174.57 2ee2 s SER 13 N 2.25 4.55 0.35 -1.22 1.04 -1.26 -5.05 113.70 114.35 2ee2 s SER 13 Ca 0.04 2.28 0.04 0.00 0.48 0.00 0.00 55.95 58.79 2ee2 s SER 13 Cb -0.14 -2.58 -0.07 0.00 0.10 0.00 0.00 66.02 63.33 2ee2 s SER 13 CO -0.08 -2.02 0.05 0.00 0.98 0.00 0.00 173.24 172.17 2ee2 s ALA 14 N -2.01 2.56 0.00 5.32 0.00 -1.26 -4.91 121.76 121.47 2ee2 s ALA 14 Ca 0.73 -2.08 0.00 0.00 0.00 0.00 0.00 51.96 50.61 2ee2 s ALA 14 Cb -0.27 0.55 0.00 0.00 0.00 0.00 0.00 23.12 23.40 2ee2 s ALA 14 CO 0.43 -0.27 0.00 0.00 0.00 0.00 0.00 175.76 175.92 2ee2 n GLN 15 N -0.76 0.00 -2.84 0.00 10.64 -1.26 -5.14 117.38 118.02 2ee2 n GLN 15 Ca -0.03 0.00 -0.07 0.00 -1.83 0.00 0.00 57.00 55.07 2ee2 n GLN 15 Cb 0.67 -0.65 0.00 0.00 -0.86 0.00 0.00 30.24 29.40 2ee2 n GLN 15 CO 0.00 0.00 0.00 -3.47 -1.83 0.00 0.00 177.06 171.76 2ee2 n ASP 16 N -2.55 -1.20 -3.81 2.61 2.03 -1.26 -5.13 116.55 107.25 2ee2 n ASP 16 Ca 0.00 -2.06 -0.12 0.00 0.52 0.00 0.00 54.79 53.13 2ee2 n ASP 16 Cb 0.38 2.06 -0.11 0.00 -0.72 0.00 0.00 41.12 42.74 2ee2 n ASP 16 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ee2 s ALA 17 N -1.92 -0.53 0.15 -1.67 0.00 -1.26 -2.92 121.76 113.61 2ee2 s ALA 17 Ca 0.13 0.33 -0.31 0.00 0.00 0.00 0.00 51.96 52.11 2ee2 s ALA 17 Cb -0.02 -0.13 -0.08 0.00 0.00 0.00 0.00 23.12 22.89 2ee2 s ALA 17 CO 0.10 -0.17 1.34 -1.25 0.00 0.00 0.00 175.76 175.77 2ee2 s PRO 18 N -0.65 4.36 -0.06 0.00 0.04 -1.26 -4.92 135.00 132.51 2ee2 s PRO 18 Ca -0.07 2.04 0.04 0.00 0.04 0.00 0.00 61.00 63.04 2ee2 s PRO 18 Cb -0.04 -3.23 -0.06 0.00 0.04 0.00 0.00 34.50 31.20 2ee2 s PRO 18 CO 0.01 -0.34 0.00 0.45 0.04 0.00 0.00 177.00 177.17 2ee2 n SER 19 N 3.38 3.60 -4.87 6.66 2.88 -1.26 -4.51 113.62 119.49 2ee2 n SER 19 Ca 0.09 -0.01 -0.37 0.00 -1.33 0.00 0.00 58.87 57.26 2ee2 n SER 19 Cb 0.43 0.48 -0.06 0.00 -0.75 0.00 0.00 64.21 64.31 2ee2 n SER 19 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 2ee2 s GLU 20 N -2.14 3.62 0.10 -1.46 2.56 -1.26 -4.91 118.70 115.22 2ee2 s GLU 20 Ca -0.04 0.04 0.09 0.00 0.00 0.00 0.00 54.97 55.06 2ee2 s GLU 20 Cb 0.02 -3.16 -0.03 0.00 2.00 0.00 0.00 34.13 32.95 2ee2 s GLU 20 CO 0.21 0.71 -0.23 0.00 -0.56 0.00 0.00 175.26 175.39 2ee2 s ALA 21 N -1.13 2.03 -0.54 6.30 0.00 -1.26 -4.89 121.76 122.27 2ee2 s ALA 21 Ca 0.21 -1.30 -0.27 0.00 0.00 0.00 0.00 51.96 50.60 2ee2 s ALA 21 Cb -0.14 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.64 2ee2 s ALA 21 CO 0.10 0.44 1.82 -1.25 0.00 0.00 0.00 175.76 176.87 2ee2 s PRO 22 N -1.81 2.84 0.55 0.00 0.04 -1.26 -4.98 135.00 130.39 2ee2 s PRO 22 Ca 0.10 0.81 0.09 0.00 0.04 0.00 0.00 61.00 62.04 2ee2 s PRO 22 Cb -0.10 -4.32 0.08 0.00 0.04 0.00 0.00 34.50 30.19 2ee2 s PRO 22 CO 0.04 -2.47 0.76 0.99 0.04 0.00 0.00 177.00 176.37 2ee2 s THR 23 N 8.37 2.25 -1.52 1.26 2.01 -1.26 -4.46 115.64 122.28 2ee2 s THR 23 Ca 0.70 -1.00 -0.13 0.00 0.31 0.00 0.00 61.69 61.56 2ee2 s THR 23 Cb -0.15 -2.26 0.09 0.00 0.01 0.00 0.00 72.50 70.19 2ee2 s THR 23 CO 0.24 0.00 0.89 -0.62 -0.69 0.00 0.00 174.62 174.44 2ee2 n GLU 24 N -2.19 -5.03 -1.44 4.92 1.02 -1.26 -4.45 120.64 112.21 2ee2 n GLU 24 Ca 0.15 0.58 -0.31 0.00 -0.02 0.00 0.00 57.16 57.55 2ee2 n GLU 24 Cb 0.61 -5.44 0.07 0.00 -0.02 0.00 0.00 31.44 26.67 2ee2 n GLU 24 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2ee2 s VAL 25 N -3.24 3.52 0.13 2.62 1.01 -1.26 -4.84 120.40 118.33 2ee2 s VAL 25 Ca 0.63 0.53 0.08 0.00 0.00 0.00 0.00 61.98 63.22 2ee2 s VAL 25 Cb -0.32 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 2ee2 s VAL 25 CO 0.77 -0.61 -0.19 -0.83 0.00 0.00 0.00 175.10 174.25 2ee2 s GLY 26 N -3.36 1.26 -0.08 4.51 0.00 0.65 -5.01 107.32 105.29 2ee2 s GLY 26 Ca 0.61 -1.33 -0.00 0.00 0.00 0.00 0.00 44.72 43.99 2ee2 s GLY 26 CO 0.53 -1.36 -0.04 -1.34 0.00 0.00 0.00 173.10 170.89 2ee2 s VAL 27 N -1.64 0.63 -0.15 1.40 -7.23 -1.26 -1.22 120.40 110.92 2ee2 s VAL 27 Ca 0.10 -0.07 -0.05 0.00 -1.81 0.00 0.00 61.98 60.15 2ee2 s VAL 27 Cb -0.08 -0.71 -0.03 0.00 0.56 0.00 0.00 36.38 36.12 2ee2 s VAL 27 CO 0.05 0.29 0.00 -0.75 -0.31 0.00 0.00 175.10 174.38 2ee2 s LYS 28 N 1.62 3.69 -1.02 4.82 2.20 -0.34 -4.95 119.74 125.76 2ee2 s LYS 28 Ca 0.01 -0.44 -0.17 0.00 -0.36 0.00 0.00 55.97 55.00 2ee2 s LYS 28 Cb -0.13 -3.01 0.14 0.00 -1.51 0.00 0.00 37.83 33.32 2ee2 s LYS 28 CO -0.05 0.32 1.24 0.08 -0.36 0.00 0.00 175.35 176.58 2ee2 s VAL 29 N 0.18 4.77 0.10 4.02 1.01 -1.26 -0.12 120.40 129.09 2ee2 s VAL 29 Ca 0.01 -1.86 -0.28 0.00 0.00 0.00 0.00 61.98 59.85 2ee2 s VAL 29 Cb -0.13 -4.84 -0.12 0.00 0.00 0.00 0.00 36.38 31.29 2ee2 s VAL 29 CO 0.02 -1.57 1.65 -0.07 0.00 0.00 0.00 175.10 175.13 2ee2 h LEU 30 N 10.35 -0.62 0.00 3.92 3.38 -1.38 -3.47 115.31 127.49 2ee2 h LEU 30 Ca 0.21 0.06 -0.12 0.00 0.09 0.00 0.00 57.88 58.12 2ee2 h LEU 30 Cb 0.98 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 2ee2 h LEU 30 CO 1.17 -0.34 0.05 -1.20 0.09 0.00 0.00 178.44 178.21 2ee2 n SER 31 N -5.36 -1.41 -0.34 -0.43 7.64 0.33 -4.95 113.62 109.11 2ee2 n SER 31 Ca -0.08 -2.33 0.09 0.00 1.01 0.00 0.00 58.87 57.56 2ee2 n SER 31 Cb 0.27 2.45 0.29 0.00 -1.01 0.00 0.00 64.21 66.20 2ee2 n SER 31 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2ee2 h SER 32 N 1.51 0.84 -0.85 6.43 4.64 -1.91 -2.28 113.55 121.94 2ee2 h SER 32 Ca -0.23 0.05 -0.55 0.00 -0.47 0.00 0.00 61.79 60.59 2ee2 h SER 32 Cb 0.93 -0.11 -0.43 0.00 -0.31 0.00 0.00 62.40 62.48 2ee2 h SER 32 CO 0.30 0.42 -0.82 -1.54 -0.87 0.00 0.00 176.83 174.33 2ee2 n SER 33 N -4.63 4.82 -3.58 4.97 3.41 -1.26 -4.03 113.62 113.33 2ee2 n SER 33 Ca 0.19 -3.71 -0.03 0.00 -0.26 0.00 0.00 58.87 55.06 2ee2 n SER 33 Cb 0.42 -0.36 -0.06 0.00 -0.26 0.00 0.00 64.21 63.95 2ee2 n SER 33 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2ee2 s GLU 34 N -3.59 0.48 -0.02 4.33 2.02 -0.86 -3.42 118.70 117.63 2ee2 s GLU 34 Ca 0.50 1.21 0.00 0.00 0.02 0.00 0.00 54.97 56.70 2ee2 s GLU 34 Cb 0.41 0.58 0.03 0.00 0.10 0.00 0.00 34.13 35.24 2ee2 s GLU 34 CO 0.01 -0.29 0.01 0.42 0.02 0.00 0.00 175.26 175.43 2ee2 s ILE 35 N 2.78 0.08 0.10 -1.63 1.01 -0.98 -0.51 121.20 122.04 2ee2 s ILE 35 Ca -0.00 0.13 -0.05 0.00 0.00 0.00 0.00 60.65 60.73 2ee2 s ILE 35 Cb -0.13 -0.19 -0.05 0.00 0.01 0.00 0.00 42.46 42.11 2ee2 s ILE 35 CO -0.17 0.12 0.33 -0.55 0.00 0.00 0.00 174.94 174.67 2ee2 s SER 36 N 0.99 6.48 -0.33 3.58 0.15 0.82 0.08 113.70 125.48 2ee2 s SER 36 Ca -0.09 0.55 0.01 0.00 0.70 0.00 0.00 55.95 57.11 2ee2 s SER 36 Cb -0.13 -2.08 0.10 0.00 -1.71 0.00 0.00 66.02 62.21 2ee2 s SER 36 CO -0.02 0.12 0.10 -0.69 1.20 0.00 0.00 173.24 173.96 2ee2 s VAL 37 N -1.54 1.28 -0.26 4.45 1.01 -0.65 -1.20 120.40 123.49 2ee2 s VAL 37 Ca 0.37 -1.77 -0.11 0.00 0.00 0.00 0.00 61.98 60.47 2ee2 s VAL 37 Cb -0.13 -1.96 -0.05 0.00 0.00 0.00 0.00 36.38 34.25 2ee2 s VAL 37 CO 0.23 -0.68 0.17 -1.00 0.00 0.00 0.00 175.10 173.81 2ee2 s HIS 38 N 1.29 3.24 0.27 5.22 3.76 -0.35 -1.50 115.29 127.22 2ee2 s HIS 38 Ca 0.11 0.11 0.01 0.00 -0.15 0.00 0.00 55.06 55.13 2ee2 s HIS 38 Cb -0.19 -2.33 0.01 0.00 1.11 0.00 0.00 32.58 31.18 2ee2 s HIS 38 CO -0.18 -0.10 0.04 -2.67 -0.85 0.00 0.00 174.74 170.98 2ee2 n TRP 39 N 4.80 0.28 -4.32 1.40 2.14 -1.11 -0.25 117.44 120.38 2ee2 n TRP 39 Ca -0.14 -1.31 -0.34 0.00 2.07 0.00 0.00 57.50 57.78 2ee2 n TRP 39 Cb 0.52 -0.19 -0.11 0.00 -0.81 0.00 0.00 31.31 30.72 2ee2 n TRP 39 CO 0.00 0.00 0.00 -2.00 2.07 0.00 0.00 177.69 177.76 2ee2 s GLU 40 N -3.02 3.65 0.33 -2.67 2.12 -1.26 -4.82 118.70 113.03 2ee2 s GLU 40 Ca 0.03 -0.47 -0.29 0.00 0.36 0.00 0.00 54.97 54.60 2ee2 s GLU 40 Cb -0.00 -2.96 -0.11 0.00 0.26 0.00 0.00 34.13 31.32 2ee2 s GLU 40 CO 0.02 0.31 1.57 -1.01 -0.54 0.00 0.00 175.26 175.61 2ee2 s HIS 41 N 0.21 2.67 0.02 5.30 3.76 -1.26 -4.42 115.29 121.57 2ee2 s HIS 41 Ca -0.01 0.90 -0.14 0.00 -0.15 0.00 0.00 55.06 55.66 2ee2 s HIS 41 Cb -0.13 -4.08 -0.06 0.00 1.11 0.00 0.00 32.58 29.42 2ee2 s HIS 41 CO 0.02 -3.46 0.42 0.14 -0.85 0.00 0.00 174.74 171.01 2ee2 s VAL 42 N -0.40 5.02 0.63 -0.90 -7.23 -1.26 -4.95 120.40 111.30 2ee2 s VAL 42 Ca 0.60 0.79 0.28 0.00 -1.81 0.00 0.00 61.98 61.84 2ee2 s VAL 42 Cb -0.48 -3.71 0.33 0.00 0.56 0.00 0.00 36.38 33.08 2ee2 s VAL 42 CO 0.54 0.51 1.85 0.17 -0.31 0.00 0.00 175.10 177.86 2ee2 h LEU 43 N 4.47 0.00 -8.70 1.32 8.10 -1.94 -3.38 115.31 115.18 2ee2 h LEU 43 Ca -0.51 0.00 -0.56 0.00 0.11 0.00 0.00 57.88 56.92 2ee2 h LEU 43 Cb 1.21 0.00 -0.05 0.00 -0.44 0.00 0.00 40.66 41.38 2ee2 h LEU 43 CO 0.63 0.00 1.12 -1.61 -4.11 0.00 0.00 178.44 174.47 2ee2 s GLU 44 N -4.35 3.38 0.00 0.17 0.41 -1.26 -4.84 118.70 112.21 2ee2 s GLU 44 Ca -0.04 0.79 0.17 0.00 -0.41 0.00 0.00 54.97 55.49 2ee2 s GLU 44 Cb 0.12 -4.10 0.71 0.00 -1.78 0.00 0.00 34.13 29.07 2ee2 s GLU 44 CO 0.40 -1.81 1.50 1.17 -0.49 0.00 0.00 175.26 176.02 2ee2 n LYS 45 N 8.41 1.55 0.15 1.61 3.00 -1.26 -3.71 118.16 127.91 2ee2 n LYS 45 Ca 0.16 -0.84 0.03 0.00 -0.00 0.00 0.00 58.31 57.66 2ee2 n LYS 45 Cb 0.49 -1.33 0.08 0.00 0.00 0.00 0.00 35.03 34.26 2ee2 n LYS 45 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.40 176.56 2ee2 h ILE 46 N 1.61 0.89 -2.22 3.15 3.07 -1.93 -3.46 117.51 118.62 2ee2 h ILE 46 Ca 0.00 -2.14 -0.62 0.00 1.55 0.00 0.00 64.86 63.65 2ee2 h ILE 46 Cb 0.36 2.35 0.07 0.00 -0.27 0.00 0.00 36.82 39.33 2ee2 h ILE 46 CO 0.00 0.49 0.50 1.33 -1.05 0.00 0.00 178.15 179.42 2ee2 n VAL 47 N -3.28 0.66 0.06 0.16 0.24 -1.24 -4.64 118.33 110.28 2ee2 n VAL 47 Ca 0.02 -0.16 -0.20 0.00 -2.04 0.00 0.00 64.34 61.95 2ee2 n VAL 47 Cb 0.70 -1.17 -0.15 0.00 -1.47 0.00 0.00 33.84 31.75 2ee2 n VAL 47 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 2ee2 h GLU 48 N 4.22 0.31 -2.61 7.34 4.39 -1.88 -3.47 114.58 122.87 2ee2 h GLU 48 Ca -0.45 -0.53 0.08 0.00 0.34 0.00 0.00 59.36 58.80 2ee2 h GLU 48 Cb 1.30 0.20 -0.11 0.00 -0.10 0.00 0.00 28.75 30.04 2ee2 h GLU 48 CO 0.76 1.20 0.37 -1.54 -1.16 0.00 0.00 179.01 178.63 2ee2 s SER 49 N -7.10 -0.36 -0.37 1.42 1.04 -1.24 -3.99 113.70 103.11 2ee2 s SER 49 Ca -0.14 -0.20 -0.10 0.00 0.48 0.00 0.00 55.95 56.00 2ee2 s SER 49 Cb 0.06 0.53 0.03 0.00 0.10 0.00 0.00 66.02 66.74 2ee2 s SER 49 CO 0.84 -0.91 0.18 -0.31 0.98 0.00 0.00 173.24 174.03 2ee2 s TYR 50 N -3.47 3.25 -0.14 5.02 2.02 -1.25 -2.99 117.35 119.79 2ee2 s TYR 50 Ca 0.07 -1.10 -0.28 0.00 -0.37 0.00 0.00 57.07 55.38 2ee2 s TYR 50 Cb -0.02 -2.40 -0.01 0.00 -0.40 0.00 0.00 41.96 39.14 2ee2 s TYR 50 CO -0.05 -0.67 0.96 -1.14 -1.57 0.00 0.00 175.55 173.07 2ee2 s GLN 51 N 1.51 4.36 -0.45 -0.62 0.74 -1.10 -3.84 119.66 120.26 2ee2 s GLN 51 Ca 0.01 1.27 -0.04 0.00 0.05 0.00 0.00 55.36 56.65 2ee2 s GLN 51 Cb -0.19 -3.56 0.12 0.00 1.10 0.00 0.00 33.01 30.47 2ee2 s GLN 51 CO 0.06 -0.36 0.27 0.42 -0.55 0.00 0.00 175.29 175.13 2ee2 s ILE 52 N 2.20 3.50 0.83 -2.34 1.09 -0.77 -2.01 121.20 123.69 2ee2 s ILE 52 Ca 0.45 -2.17 -0.12 0.00 -1.10 0.00 0.00 60.65 57.71 2ee2 s ILE 52 Cb -0.17 -3.36 0.09 0.00 -1.06 0.00 0.00 42.46 37.95 2ee2 s ILE 52 CO 0.15 -0.74 1.11 -0.13 -0.10 0.00 0.00 174.94 175.23 2ee2 s ARG 53 N 0.97 1.78 -0.29 2.79 0.52 0.15 -1.58 118.95 123.29 2ee2 s ARG 53 Ca 0.09 0.57 -0.21 0.00 -0.52 0.00 0.00 55.73 55.66 2ee2 s ARG 53 Cb -0.23 -1.89 0.18 0.00 0.52 0.00 0.00 34.95 33.53 2ee2 s ARG 53 CO -0.04 -1.82 1.24 1.52 0.02 0.00 0.00 175.30 176.23 2ee2 s TYR 54 N -3.17 -0.22 0.08 -0.53 1.13 0.27 -2.44 117.35 112.47 2ee2 s TYR 54 Ca 0.62 0.49 -0.27 0.00 -1.41 0.00 0.00 57.07 56.50 2ee2 s TYR 54 Cb -0.15 0.31 0.08 0.00 -1.10 0.00 0.00 41.96 41.10 2ee2 s TYR 54 CO 0.54 -0.11 0.95 1.67 -2.51 0.00 0.00 175.55 176.09 2ee2 s TRP 55 N 0.59 -0.21 0.47 -3.49 -2.14 -1.21 -1.75 118.94 111.20 2ee2 s TRP 55 Ca -0.01 -0.01 -0.20 0.00 2.66 0.00 0.00 56.10 58.54 2ee2 s TRP 55 Cb -0.04 0.59 -0.09 0.00 -3.10 0.00 0.00 33.47 30.83 2ee2 s TRP 55 CO -0.12 -0.69 1.00 0.00 -2.66 0.00 0.00 176.95 174.48 2ee2 s ALA 56 N -3.18 2.95 0.44 2.67 0.00 -1.26 -1.48 121.76 121.91 2ee2 s ALA 56 Ca 0.09 0.46 0.23 0.00 0.00 0.00 0.00 51.96 52.74 2ee2 s ALA 56 Cb -0.01 -3.19 1.23 0.00 0.00 0.00 0.00 23.12 21.14 2ee2 s ALA 56 CO -0.03 -0.16 1.80 0.00 0.00 0.00 0.00 175.76 177.38 2ee2 h ALA 57 N 1.55 2.46 -0.09 0.00 0.00 -1.92 0.21 119.26 121.46 2ee2 h ALA 57 Ca -0.49 0.03 -0.23 0.00 0.00 0.00 0.00 54.91 54.22 2ee2 h ALA 57 Cb 1.20 0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.04 2ee2 h ALA 57 CO 0.60 -0.82 -0.85 1.12 0.00 0.00 0.00 179.25 179.30 2ee2 h HIS 58 N 0.28 0.97 -4.18 0.00 -0.00 -1.91 -3.45 115.15 106.86 2ee2 h HIS 58 Ca 0.55 -0.46 -0.51 0.00 -0.00 0.00 0.00 60.37 59.95 2ee2 h HIS 58 Cb 1.61 -0.14 0.19 0.00 -0.00 0.00 0.00 27.41 29.07 2ee2 h HIS 58 CO -0.00 1.28 0.22 -0.51 -0.00 0.00 0.00 177.93 178.92 2ee2 s ASP 59 N -7.14 3.01 0.24 3.10 1.01 0.73 -5.03 116.67 112.58 2ee2 s ASP 59 Ca -0.09 2.04 0.06 0.00 0.71 0.00 0.00 52.55 55.27 2ee2 s ASP 59 Cb 0.08 -2.52 -0.03 0.00 1.01 0.00 0.00 42.92 41.46 2ee2 s ASP 59 CO 0.90 -3.02 0.27 -0.54 0.21 0.00 0.00 175.17 172.99 2ee2 s LYS 60 N -4.69 3.18 0.50 8.23 1.02 -1.26 -4.78 119.74 121.94 2ee2 s LYS 60 Ca 0.66 -0.89 0.16 0.00 0.02 0.00 0.00 55.97 55.92 2ee2 s LYS 60 Cb -0.22 -2.73 1.20 0.00 -0.52 0.00 0.00 37.83 35.55 2ee2 s LYS 60 CO 0.58 0.42 2.09 1.05 -0.92 0.00 0.00 175.35 178.58 2ee2 h GLU 61 N 1.42 0.00 -0.19 1.68 9.09 -1.95 -1.01 114.58 123.62 2ee2 h GLU 61 Ca -0.50 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 58.82 2ee2 h GLU 61 Cb 1.23 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.32 2ee2 h GLU 61 CO 0.61 0.07 -0.27 1.05 0.05 0.00 0.00 179.01 180.52 2ee2 h GLU 62 N 0.00 0.35 -0.60 1.06 4.11 -2.04 -2.61 114.58 114.86 2ee2 h GLU 62 Ca -0.00 -0.13 0.00 0.00 0.07 0.00 0.00 59.36 59.30 2ee2 h GLU 62 Cb 0.13 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2ee2 h GLU 62 CO 0.01 0.60 0.00 0.00 0.07 0.00 0.00 179.01 179.69 2ee2 n ALA 63 N -2.48 2.82 -2.63 1.06 0.00 -0.62 -4.96 120.51 113.70 2ee2 n ALA 63 Ca -0.01 -1.54 -0.42 0.00 0.00 0.00 0.00 53.44 51.47 2ee2 n ALA 63 Cb 0.40 -0.90 -0.03 0.00 0.00 0.00 0.00 19.45 18.92 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 -1.65 3.24 0.60 0.00 0.00 -0.48 -4.84 121.76 118.63 2ee2 s ALA 64 Ca 0.47 0.60 -0.11 0.00 0.00 0.00 0.00 51.96 52.92 2ee2 s ALA 64 Cb 0.29 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 2ee2 s ALA 64 CO 0.24 -0.32 1.01 -0.80 0.00 0.00 0.00 175.76 175.88 2ee2 s ASN 65 N 1.04 6.26 -0.03 0.00 0.01 -0.72 -4.77 114.94 116.75 2ee2 s ASN 65 Ca 0.53 1.39 -0.20 0.00 -0.71 0.00 0.00 52.86 53.88 2ee2 s ASN 65 Cb -0.23 -2.46 0.04 0.00 0.41 0.00 0.00 41.25 39.01 2ee2 s ASN 65 CO 0.27 -0.83 0.43 0.00 -1.51 0.00 0.00 177.10 175.47 2ee2 s ARG 66 N -5.06 0.79 -0.11 -0.60 1.70 -1.26 0.97 118.95 115.39 2ee2 s ARG 66 Ca 0.55 -0.04 0.02 0.00 -0.47 0.00 0.00 55.73 55.78 2ee2 s ARG 66 Cb -0.11 0.36 -0.01 0.00 -0.57 0.00 0.00 34.95 34.62 2ee2 s ARG 66 CO 0.52 -0.23 -0.16 0.08 -1.08 0.00 0.00 175.30 174.42 2ee2 s VAL 67 N -1.28 2.76 -0.46 4.99 1.01 -0.62 -4.89 120.40 121.92 2ee2 s VAL 67 Ca -0.13 -0.78 -0.12 0.00 0.00 0.00 0.00 61.98 60.96 2ee2 s VAL 67 Cb -0.04 -2.12 0.09 0.00 0.00 0.00 0.00 36.38 34.32 2ee2 s VAL 67 CO 0.06 0.54 0.34 -1.58 0.00 0.00 0.00 175.10 174.47 2ee2 s GLN 68 N 0.18 2.72 0.53 2.72 0.74 -1.26 -1.85 119.66 123.44 2ee2 s GLN 68 Ca -0.09 -1.53 0.08 0.00 0.05 0.00 0.00 55.36 53.87 2ee2 s GLN 68 Cb -0.16 -3.97 0.06 0.00 1.10 0.00 0.00 33.01 30.04 2ee2 s GLN 68 CO 0.06 -1.07 0.65 0.14 -0.55 0.00 0.00 175.29 174.51 2ee2 s VAL 69 N 1.49 2.24 0.17 1.34 -7.23 -1.25 -5.00 120.40 112.15 2ee2 s VAL 69 Ca 0.04 -1.12 -0.31 0.00 -1.81 0.00 0.00 61.98 58.77 2ee2 s VAL 69 Cb -0.25 -2.36 -0.09 0.00 0.56 0.00 0.00 36.38 34.24 2ee2 s VAL 69 CO 0.03 0.00 1.48 0.42 -0.31 0.00 0.00 175.10 176.72 2ee2 s THR 70 N -2.62 2.86 0.58 5.32 -4.23 -1.26 -3.84 115.64 112.46 2ee2 s THR 70 Ca 0.54 0.64 0.30 0.00 -1.18 0.00 0.00 61.69 61.99 2ee2 s THR 70 Cb -0.06 -3.41 0.42 0.00 1.34 0.00 0.00 72.50 70.80 2ee2 s THR 70 CO 0.34 0.06 1.77 -1.28 -0.54 0.00 0.00 174.62 174.96 2ee2 h SER 71 N 6.43 0.00 -0.02 3.99 0.87 -1.92 0.65 113.55 123.54 2ee2 h SER 71 Ca -0.43 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.04 2ee2 h SER 71 Cb 1.21 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.15 2ee2 h SER 71 CO 0.87 0.00 -0.23 1.56 -0.53 0.00 0.00 176.83 178.50 2ee2 h GLN 72 N 0.00 0.42 -5.96 2.24 1.08 -1.91 -3.41 115.11 107.57 2ee2 h GLN 72 Ca 0.34 -0.15 -0.51 0.00 -1.45 0.00 0.00 58.65 56.89 2ee2 h GLN 72 Cb 1.74 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 29.11 2ee2 h GLN 72 CO -0.00 0.63 1.40 -1.21 -0.95 0.00 0.00 178.83 178.70 2ee2 s GLU 73 N -4.53 2.66 0.58 1.46 0.41 0.23 -4.81 118.70 114.69 2ee2 s GLU 73 Ca -0.06 0.97 0.28 0.00 -0.41 0.00 0.00 54.97 55.75 2ee2 s GLU 73 Cb 0.14 -4.39 1.60 0.00 -1.78 0.00 0.00 34.13 29.69 2ee2 s GLU 73 CO 0.78 -2.67 2.06 1.88 -0.49 0.00 0.00 175.26 176.81 2ee2 h TYR 74 N 15.57 0.00 -4.58 1.61 -1.99 -1.84 -3.43 116.97 122.30 2ee2 h TYR 74 Ca -0.27 0.00 -0.24 0.00 2.00 0.00 0.00 58.73 60.21 2ee2 h TYR 74 Cb 1.19 0.00 -0.15 0.00 2.00 0.00 0.00 36.73 39.77 2ee2 h TYR 74 CO 1.01 0.00 -0.62 -1.54 -0.00 0.00 0.00 178.16 177.01 2ee2 s SER 75 N -5.74 0.17 0.31 3.88 1.04 -1.26 -2.76 113.70 109.34 2ee2 s SER 75 Ca -0.05 -1.39 0.04 0.00 0.48 0.00 0.00 55.95 55.03 2ee2 s SER 75 Cb 0.16 0.38 -0.01 0.00 0.10 0.00 0.00 66.02 66.64 2ee2 s SER 75 CO 0.56 -0.84 0.13 0.00 0.98 0.00 0.00 173.24 174.08 2ee2 n ALA 76 N -0.28 0.47 -2.82 5.32 0.00 -0.56 -4.96 120.51 117.68 2ee2 n ALA 76 Ca 0.02 -1.60 -0.14 0.00 0.00 0.00 0.00 53.44 51.72 2ee2 n ALA 76 Cb 0.66 1.12 -0.13 0.00 0.00 0.00 0.00 19.45 21.10 2ee2 n ALA 76 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2ee2 s ARG 77 N -3.19 0.35 0.11 0.00 3.52 -1.26 -1.64 118.95 116.85 2ee2 s ARG 77 Ca 0.19 -0.32 0.09 0.00 -0.13 0.00 0.00 55.73 55.56 2ee2 s ARG 77 Cb 0.01 -0.26 -0.04 0.00 -1.56 0.00 0.00 34.95 33.10 2ee2 s ARG 77 CO 0.13 0.06 -0.19 -0.51 -0.81 0.00 0.00 175.30 173.99 2ee2 s LEU 78 N -0.55 2.67 0.20 -0.88 1.43 0.11 -4.97 118.68 116.69 2ee2 s LEU 78 Ca -0.03 -0.56 -0.05 0.00 -1.03 0.00 0.00 54.13 52.47 2ee2 s LEU 78 Cb -0.04 -1.53 -0.03 0.00 0.03 0.00 0.00 46.19 44.63 2ee2 s LEU 78 CO -0.00 0.18 0.22 -1.61 0.23 0.00 0.00 176.35 175.37 2ee2 s GLU 79 N -2.09 1.24 -0.86 1.70 2.02 -1.26 -2.32 118.70 117.14 2ee2 s GLU 79 Ca 0.17 -1.46 -0.02 0.00 0.02 0.00 0.00 54.97 53.68 2ee2 s GLU 79 Cb -0.11 0.33 0.00 0.00 0.10 0.00 0.00 34.13 34.45 2ee2 s GLU 79 CO 0.10 -0.44 0.73 0.09 0.02 0.00 0.00 175.26 175.76 2ee2 n ASN 80 N -0.27 -3.06 -4.69 -0.19 3.02 -1.22 -4.97 115.26 103.89 2ee2 n ASN 80 Ca -0.01 -0.41 -0.24 0.00 -0.03 0.00 0.00 54.58 53.89 2ee2 n ASN 80 Cb 0.64 -3.65 -0.07 0.00 -0.61 0.00 0.00 39.78 36.09 2ee2 n ASN 80 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2ee2 s LEU 81 N -5.11 3.38 0.26 3.41 1.43 -1.26 -5.08 118.68 115.71 2ee2 s LEU 81 Ca 0.14 -0.45 -0.23 0.00 -1.03 0.00 0.00 54.13 52.57 2ee2 s LEU 81 Cb -0.06 -1.96 -0.09 0.00 0.03 0.00 0.00 46.19 44.11 2ee2 s LEU 81 CO 0.50 0.04 0.82 -0.76 0.23 0.00 0.00 176.35 177.18 2ee2 s LEU 82 N -3.36 4.35 0.59 1.79 1.43 -1.26 -4.22 118.68 118.01 2ee2 s LEU 82 Ca 0.30 1.61 -0.17 0.00 -1.03 0.00 0.00 54.13 54.83 2ee2 s LEU 82 Cb -0.08 -3.76 -0.03 0.00 0.03 0.00 0.00 46.19 42.35 2ee2 s LEU 82 CO 0.20 -0.00 1.12 -2.16 0.23 0.00 0.00 176.35 175.74 2ee2 s PRO 83 N -1.97 3.11 -1.17 1.29 0.04 -1.26 -3.65 135.00 131.39 2ee2 s PRO 83 Ca 0.46 1.51 -0.05 0.00 0.04 0.00 0.00 61.00 62.96 2ee2 s PRO 83 Cb -0.18 -1.98 0.01 0.00 0.04 0.00 0.00 34.50 32.39 2ee2 s PRO 83 CO 0.22 -1.02 0.10 -3.47 0.04 0.00 0.00 177.00 172.87 2ee2 n ASP 84 N -1.79 0.04 -4.03 6.66 2.03 1.00 -4.89 116.55 115.57 2ee2 n ASP 84 Ca 0.11 -1.01 -0.20 0.00 0.52 0.00 0.00 54.79 54.21 2ee2 n ASP 84 Cb 0.51 -1.25 -0.15 0.00 -0.72 0.00 0.00 41.12 39.51 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 -4.05 0.79 0.10 5.18 2.01 -1.24 -4.88 115.64 113.56 2ee2 s THR 85 Ca 0.07 -0.41 -0.31 0.00 0.31 0.00 0.00 61.69 61.35 2ee2 s THR 85 Cb -0.04 -0.67 -0.07 0.00 0.01 0.00 0.00 72.50 71.73 2ee2 s THR 85 CO 0.79 0.23 1.29 -1.58 -0.69 0.00 0.00 174.62 174.65 2ee2 s GLN 86 N -0.13 4.39 -0.13 4.92 0.74 -1.26 -3.30 119.66 124.89 2ee2 s GLN 86 Ca 0.02 1.93 -0.02 0.00 0.05 0.00 0.00 55.36 57.34 2ee2 s GLN 86 Cb -0.05 -3.28 0.04 0.00 1.10 0.00 0.00 33.01 30.82 2ee2 s GLN 86 CO -0.00 -0.32 0.02 0.71 -0.55 0.00 0.00 175.29 175.16 2ee2 s TYR 87 N 0.91 0.79 -0.55 1.67 1.51 -0.57 -2.80 117.35 118.30 2ee2 s TYR 87 Ca 0.60 -0.48 -0.26 0.00 -1.01 0.00 0.00 57.07 55.92 2ee2 s TYR 87 Cb -0.33 -0.89 0.03 0.00 -0.11 0.00 0.00 41.96 40.66 2ee2 s TYR 87 CO 0.31 -0.47 1.07 -0.06 -1.11 0.00 0.00 175.55 175.29 2ee2 s PHE 88 N 1.94 2.72 -0.12 2.71 0.08 -0.55 -1.76 117.98 123.00 2ee2 s PHE 88 Ca 0.02 0.27 -0.10 0.00 0.12 0.00 0.00 56.93 57.24 2ee2 s PHE 88 Cb -0.15 -4.30 -0.05 0.00 -0.57 0.00 0.00 43.02 37.96 2ee2 s PHE 88 CO -0.07 -1.43 0.22 0.42 -0.10 0.00 0.00 175.22 174.26 2ee2 s ILE 89 N 4.44 5.36 -0.03 0.64 1.01 -0.24 -3.35 121.20 129.03 2ee2 s ILE 89 Ca 0.38 0.39 0.02 0.00 0.00 0.00 0.00 60.65 61.44 2ee2 s ILE 89 Cb -0.10 -3.52 0.01 0.00 0.01 0.00 0.00 42.46 38.87 2ee2 s ILE 89 CO 0.24 0.53 -0.07 -0.70 0.00 0.00 0.00 174.94 174.94 2ee2 s GLU 90 N -0.47 0.93 -0.16 2.79 2.56 -1.02 -2.84 118.70 120.48 2ee2 s GLU 90 Ca 0.16 -0.23 0.01 0.00 0.00 0.00 0.00 54.97 54.91 2ee2 s GLU 90 Cb -0.13 -0.88 0.02 0.00 2.00 0.00 0.00 34.13 35.14 2ee2 s GLU 90 CO 0.04 0.03 -0.18 0.08 -0.56 0.00 0.00 175.26 174.67 2ee2 s VAL 91 N 0.48 1.90 -0.08 3.70 1.01 -1.26 0.33 120.40 126.48 2ee2 s VAL 91 Ca -0.07 -0.85 -0.04 0.00 0.00 0.00 0.00 61.98 61.02 2ee2 s VAL 91 Cb -0.11 -1.72 0.04 0.00 0.00 0.00 0.00 36.38 34.59 2ee2 s VAL 91 CO 0.01 0.51 0.18 -0.83 0.00 0.00 0.00 175.10 174.97 2ee2 s GLY 92 N 1.25 -0.07 0.59 4.51 0.00 -0.85 -1.74 107.32 111.01 2ee2 s GLY 92 Ca 0.03 0.79 -0.16 0.00 0.00 0.00 0.00 44.72 45.37 2ee2 s GLY 92 CO -0.10 1.11 1.06 0.00 0.00 0.00 0.00 173.10 175.18 2ee2 s ALA 93 N 1.25 2.72 -0.29 3.20 0.00 -1.26 -2.71 121.76 124.67 2ee2 s ALA 93 Ca -0.09 0.45 -0.16 0.00 0.00 0.00 0.00 51.96 52.16 2ee2 s ALA 93 Cb -0.11 -3.25 0.15 0.00 0.00 0.00 0.00 23.12 19.91 2ee2 s ALA 93 CO -0.07 -0.81 0.98 0.00 0.00 0.00 0.00 175.76 175.86 2ee2 s ASN 95 N 1.35 5.00 0.59 0.00 4.22 -0.95 -3.34 114.94 121.81 2ee2 s ASN 95 Ca -0.09 -0.37 0.29 0.00 -2.14 0.00 0.00 52.86 50.54 2ee2 s ASN 95 Cb -0.04 -1.13 1.47 0.00 1.28 0.00 0.00 41.25 42.83 2ee2 s ASN 95 CO -0.15 0.04 1.88 -1.28 -2.04 0.00 0.00 177.10 175.56 2ee2 h SER 96 N 2.25 0.00 0.00 3.54 0.87 -1.98 -2.97 113.55 115.26 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 1.22 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 2ee2 h SER 96 CO 0.60 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.90 2ee2 n ALA 97 N -2.33 -0.06 -2.42 6.23 0.00 -1.26 -4.95 120.51 115.71 2ee2 n ALA 97 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.24 2ee2 n ALA 97 Cb 0.68 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 20.00 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 -1.33 1.51 0.20 0.00 0.00 -1.12 -4.94 107.32 101.64 2ee2 s GLY 98 Ca 0.00 -1.42 -0.03 0.00 0.00 0.00 0.00 44.72 43.26 2ee2 s GLY 98 CO 0.00 -1.40 0.42 0.00 0.00 0.00 0.00 173.10 172.12 2ee2 s GLY 100 N -2.86 1.63 0.45 0.00 0.00 -1.23 -4.41 107.32 100.90 2ee2 s GLY 100 Ca 0.41 -1.75 -0.23 0.00 0.00 0.00 0.00 44.72 43.15 2ee2 s GLY 100 CO 0.27 -1.84 1.17 2.56 0.00 0.00 0.00 173.10 175.26 2ee2 s PRO 101 N -3.54 3.80 0.78 2.90 0.04 -1.26 -4.79 135.00 132.93 2ee2 s PRO 101 Ca 0.25 1.79 -0.11 0.00 0.04 0.00 0.00 61.00 62.98 2ee2 s PRO 101 Cb -0.03 -2.45 0.06 0.00 0.04 0.00 0.00 34.50 32.12 2ee2 s PRO 101 CO 0.10 -0.52 1.09 -1.25 0.04 0.00 0.00 177.00 176.47 2ee2 s PRO 102 N -2.63 2.16 0.55 0.56 0.04 -1.26 -4.60 135.00 129.82 2ee2 s PRO 102 Ca 0.63 1.13 -0.09 0.00 0.04 0.00 0.00 61.00 62.71 2ee2 s PRO 102 Cb -0.29 -1.89 0.13 0.00 0.04 0.00 0.00 34.50 32.49 2ee2 s PRO 102 CO 0.35 -1.70 0.64 -1.13 0.04 0.00 0.00 177.00 175.20 2ee2 n SER 103 N -3.56 -0.60 -4.73 6.66 3.41 -0.71 -4.96 113.62 109.14 2ee2 n SER 103 Ca 0.09 -1.08 -0.42 0.00 -0.26 0.00 0.00 58.87 57.20 2ee2 n SER 103 Cb 0.53 -0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 63.93 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 -3.31 6.66 -0.22 4.04 1.01 -1.26 -4.82 116.67 118.77 2ee2 s ASP 104 Ca 0.38 2.57 -0.31 0.00 0.71 0.00 0.00 52.55 55.89 2ee2 s ASP 104 Cb -0.02 -2.60 -0.08 0.00 1.01 0.00 0.00 42.92 41.23 2ee2 s ASP 104 CO 0.27 -0.75 2.14 0.80 0.21 0.00 0.00 175.17 177.85 2ee2 n MET 105 N 3.49 1.81 -4.44 8.23 0.00 -1.26 -4.84 117.12 120.10 2ee2 n MET 105 Ca 0.11 0.54 -0.34 0.00 -0.00 0.00 0.00 57.70 58.02 2ee2 n MET 105 Cb 0.40 -2.90 -0.10 0.00 0.00 0.00 0.00 33.22 30.62 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 7.06 4.08 -0.06 1.12 1.01 -1.13 -5.03 121.20 128.24 2ee2 s ILE 106 Ca 1.01 -0.39 0.04 0.00 0.00 0.00 0.00 60.65 61.31 2ee2 s ILE 106 Cb -0.55 -2.72 -0.02 0.00 0.01 0.00 0.00 42.46 39.18 2ee2 s ILE 106 CO 0.42 0.56 -0.17 -1.83 0.00 0.00 0.00 174.94 173.93 2ee2 s GLU 107 N -0.98 2.60 0.14 2.79 1.03 -1.26 -1.08 118.70 121.93 2ee2 s GLU 107 Ca 0.14 -0.75 0.08 0.00 0.03 0.00 0.00 54.97 54.47 2ee2 s GLU 107 Cb -0.11 -2.35 -0.04 0.00 -0.80 0.00 0.00 34.13 30.83 2ee2 s GLU 107 CO 0.03 0.52 -0.18 0.00 -1.33 0.00 0.00 175.26 174.31 2ee2 s ALA 108 N -0.48 1.83 -0.19 -0.84 0.00 -0.72 -4.97 121.76 116.38 2ee2 s ALA 108 Ca 0.06 -1.39 -0.01 0.00 0.00 0.00 0.00 51.96 50.63 2ee2 s ALA 108 Cb -0.12 -0.17 0.05 0.00 0.00 0.00 0.00 23.12 22.89 2ee2 s ALA 108 CO 0.01 0.23 -0.02 -0.06 0.00 0.00 0.00 175.76 175.92 2ee2 s PHE 109 N -1.88 1.70 1.10 0.00 0.40 -1.26 -1.52 117.98 116.51 2ee2 s PHE 109 Ca 0.12 -1.21 -0.14 0.00 -0.60 0.00 0.00 56.93 55.10 2ee2 s PHE 109 Cb -0.06 -1.30 0.24 0.00 0.51 0.00 0.00 43.02 42.41 2ee2 s PHE 109 CO 0.05 -0.66 1.07 0.95 0.70 0.00 0.00 175.22 177.33 2ee2 s THR 110 N 1.63 1.91 0.57 0.64 -4.23 -1.21 -4.91 115.64 110.05 2ee2 s THR 110 Ca -0.02 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 60.52 2ee2 s THR 110 Cb -0.17 -2.37 0.06 0.00 1.34 0.00 0.00 72.50 71.36 2ee2 s THR 110 CO -0.07 0.00 0.79 -0.54 -0.54 0.00 0.00 174.62 174.26 2ee2 s LYS 111 N -4.91 2.36 -0.24 3.99 -0.14 -1.26 -3.18 119.74 116.36 2ee2 s LYS 111 Ca 0.67 -1.07 -0.29 0.00 -1.36 0.00 0.00 55.97 53.92 2ee2 s LYS 111 Cb -0.19 -2.52 -0.00 0.00 -1.68 0.00 0.00 37.83 33.44 2ee2 s LYS 111 CO 0.59 -0.83 1.26 0.15 -0.76 0.00 0.00 175.35 175.76 2ee2 s LYS 112 N -4.76 4.08 -0.69 1.68 1.02 -1.26 -0.00 119.74 119.81 2ee2 s LYS 112 Ca 0.60 1.44 -0.26 0.00 0.02 0.00 0.00 55.97 57.76 2ee2 s LYS 112 Cb -0.08 -3.81 -0.12 0.00 -0.52 0.00 0.00 37.83 33.30 2ee2 s LYS 112 CO 0.39 -0.90 2.42 0.00 -0.92 0.00 0.00 175.35 176.34 2ee2 n ALA 113 N 7.06 0.49 -3.58 5.17 0.00 -1.26 -4.84 120.51 123.55 2ee2 n ALA 113 Ca 0.14 -1.24 -0.14 0.00 0.00 0.00 0.00 53.44 52.20 2ee2 n ALA 113 Cb 0.46 -3.25 -0.06 0.00 0.00 0.00 0.00 19.45 16.59 2ee2 n ALA 113 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2ee2 s SER 114 N 11.31 -0.61 0.00 0.00 0.15 -1.26 -5.12 113.70 118.17 2ee2 s SER 114 Ca 0.95 0.94 0.00 0.00 0.70 0.00 0.00 55.95 58.55 2ee2 s SER 114 Cb -0.15 0.87 0.00 0.00 -1.71 0.00 0.00 66.02 65.03 2ee2 s SER 114 CO 0.15 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.82 2ee2 n GLY 115 N 1.70 1.06 3.70 9.45 0.00 -1.26 -5.05 105.19 114.79 2ee2 n GLY 115 Ca -0.15 -2.13 -0.29 0.00 0.00 0.00 0.00 46.02 43.44 2ee2 n GLY 115 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ee2 s PRO 116 N -1.41 0.95 -0.48 1.61 0.04 -1.26 -4.88 135.00 129.57 2ee2 s PRO 116 Ca 0.00 0.71 -0.26 0.00 0.04 0.00 0.00 61.00 61.49 2ee2 s PRO 116 Cb 0.00 -1.78 -0.06 0.00 0.04 0.00 0.00 34.50 32.70 2ee2 s PRO 116 CO 0.00 -2.42 2.26 -1.54 0.04 0.00 0.00 177.00 175.33 2ee2 s SER 117 N -3.43 4.75 0.19 6.66 1.04 -1.26 -4.95 113.70 116.71 2ee2 s SER 117 Ca 0.64 1.02 -0.01 0.00 0.48 0.00 0.00 55.95 58.07 2ee2 s SER 117 Cb -0.18 -2.51 -0.04 0.00 0.10 0.00 0.00 66.02 63.39 2ee2 s SER 117 CO 0.57 -2.65 0.39 -0.55 0.98 0.00 0.00 173.24 171.98 2ee2 s SER 118 N 10.77 6.40 0.00 7.02 0.15 -1.26 -5.30 113.70 131.48 2ee2 s SER 118 Ca 0.91 0.43 0.00 0.00 0.70 0.00 0.00 55.95 57.99 2ee2 s SER 118 Cb -0.18 -2.02 0.00 0.00 -1.71 0.00 0.00 66.02 62.11 2ee2 s SER 118 CO 0.26 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.28