#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g6n s SER -2 N 0.00 0.40 -0.14 1.61 1.04 -1.26 -5.16 113.70 110.19 3g6n s SER -2 Ca 0.00 -1.05 -0.32 0.00 0.48 0.00 0.00 55.95 55.06 3g6n s SER -2 Cb 0.00 0.25 0.13 0.00 0.10 0.00 0.00 66.02 66.50 3g6n s SER -2 CO 0.00 -0.66 1.09 -1.38 0.98 0.00 0.00 173.24 173.27 3g6n s HIS -1 N -3.96 -0.23 0.45 5.02 0.00 -1.26 -5.17 115.29 110.13 3g6n s HIS -1 Ca 0.13 0.23 0.01 0.00 -3.00 0.00 0.00 55.06 52.43 3g6n s HIS -1 Cb 0.08 0.51 -0.00 0.00 -4.00 0.00 0.00 32.58 29.16 3g6n s HIS -1 CO -0.06 -0.31 0.66 -1.64 -1.00 0.00 0.00 174.74 172.39 3g6n s MET 0 N -2.21 3.03 -0.08 -0.38 1.00 -1.26 -5.11 119.30 114.30 3g6n s MET 0 Ca 0.06 -0.56 0.03 0.00 0.00 0.00 0.00 55.69 55.22 3g6n s MET 0 Cb -0.01 -2.58 0.01 0.00 0.00 0.00 0.00 34.83 32.25 3g6n s MET 0 CO -0.05 -0.28 -0.17 -1.64 0.00 0.00 0.00 175.02 172.89 3g6n s MET 1 N -4.54 2.19 0.08 2.03 1.00 -1.26 -4.90 119.30 113.90 3g6n s MET 1 Ca 0.49 -0.59 -0.30 0.00 0.00 0.00 0.00 55.69 55.29 3g6n s MET 1 Cb -0.10 -1.73 -0.06 0.00 0.00 0.00 0.00 34.83 32.94 3g6n s MET 1 CO 0.37 0.09 1.12 0.42 0.00 0.00 0.00 175.02 177.03 3g6n s ILE 2 N 0.53 4.18 0.24 2.53 1.01 -1.26 -5.03 121.20 123.40 3g6n s ILE 2 Ca -0.16 1.64 0.10 0.00 0.00 0.00 0.00 60.65 62.23 3g6n s ILE 2 Cb -0.16 -4.05 -0.04 0.00 0.01 0.00 0.00 42.46 38.21 3g6n s ILE 2 CO 0.06 0.17 -0.11 0.28 0.00 0.00 0.00 174.94 175.33 3g6n s THR 3 N 0.72 2.97 0.58 2.92 -1.32 -1.26 -4.96 115.64 115.29 3g6n s THR 3 Ca 0.55 -2.01 0.28 0.00 -1.21 0.00 0.00 61.69 59.30 3g6n s THR 3 Cb -0.27 -2.53 0.38 0.00 -1.51 0.00 0.00 72.50 68.56 3g6n s THR 3 CO 0.30 -0.29 1.97 0.24 -2.21 0.00 0.00 174.62 174.64 3g6n h MET 4 N 2.40 0.00 0.00 7.08 0.00 -1.88 0.11 114.93 122.65 3g6n h MET 4 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.26 3g6n h MET 4 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.84 3g6n h MET 4 CO 0.57 0.00 0.00 -0.25 0.00 0.00 0.00 176.91 177.23 3g6n n ASP 5 N -3.86 0.47 0.08 1.22 8.00 -1.26 -2.58 116.55 118.62 3g6n n ASP 5 Ca 0.07 0.57 0.13 0.00 0.71 0.00 0.00 54.79 56.26 3g6n n ASP 5 Cb 0.56 -0.68 0.35 0.00 -0.02 0.00 0.00 41.12 41.33 3g6n n ASP 5 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3g6n n ASP 6 N -1.96 0.70 -4.55 -2.24 8.00 0.39 -4.71 116.55 112.18 3g6n n ASP 6 Ca 0.05 0.41 -0.42 0.00 0.71 0.00 0.00 54.79 55.54 3g6n n ASP 6 Cb 0.33 -0.47 -0.06 0.00 -0.02 0.00 0.00 41.12 40.90 3g6n n ASP 6 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3g6n s ILE 7 N -3.11 4.79 0.76 0.53 1.01 -1.07 -4.40 121.20 119.71 3g6n s ILE 7 Ca 0.10 0.43 -0.12 0.00 0.00 0.00 0.00 60.65 61.06 3g6n s ILE 7 Cb 0.13 -4.19 0.05 0.00 0.01 0.00 0.00 42.46 38.46 3g6n s ILE 7 CO 0.63 -0.52 1.10 0.27 0.00 0.00 0.00 174.94 176.42 3g6n s ILE 8 N 2.93 3.17 0.21 2.92 -4.36 0.21 -4.97 121.20 121.31 3g6n s ILE 8 Ca 0.26 0.42 0.08 0.00 -0.26 0.00 0.00 60.65 61.15 3g6n s ILE 8 Cb -0.14 -2.88 -0.04 0.00 1.25 0.00 0.00 42.46 40.65 3g6n s ILE 8 CO 0.18 -0.45 0.02 -0.13 0.24 0.00 0.00 174.94 174.80 3g6n s ARG 9 N -4.66 2.44 0.14 0.37 1.81 -1.26 -4.48 118.95 113.31 3g6n s ARG 9 Ca 0.63 -1.19 -0.34 0.00 -1.72 0.00 0.00 55.73 53.12 3g6n s ARG 9 Cb -0.19 -2.33 -0.17 0.00 -0.45 0.00 0.00 34.95 31.81 3g6n s ARG 9 CO 0.52 0.42 1.08 -1.91 -0.68 0.00 0.00 175.30 174.73 3g6n n GLU 10 N -0.48 0.80 0.00 3.54 2.13 0.52 -1.62 120.64 125.54 3g6n n GLU 10 Ca -0.08 0.29 0.00 0.00 0.66 0.00 0.00 57.16 58.02 3g6n n GLU 10 Cb 0.57 -1.73 0.00 0.00 0.27 0.00 0.00 31.44 30.54 3g6n n GLU 10 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3g6n n GLY 11 N 1.95 0.78 3.66 8.31 0.00 -1.26 -5.05 105.19 113.58 3g6n n GLY 11 Ca 0.16 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 3g6n n GLY 11 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3g6n s ASN 12 N -0.77 6.94 0.58 1.61 3.84 -0.64 -4.91 114.94 121.59 3g6n s ASN 12 Ca 0.00 1.75 0.28 0.00 0.21 0.00 0.00 52.86 55.10 3g6n s ASN 12 Cb 0.00 -2.54 1.50 0.00 -0.55 0.00 0.00 41.25 39.65 3g6n s ASN 12 CO 0.00 -0.75 1.95 1.55 -2.79 0.00 0.00 177.10 177.06 3g6n h PRO 13 N 8.17 0.00 -0.28 0.43 0.13 -1.97 -2.02 132.00 136.47 3g6n h PRO 13 Ca -0.28 0.00 0.07 0.00 -0.87 0.00 0.00 66.00 64.92 3g6n h PRO 13 Cb 1.12 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 3g6n h PRO 13 CO 0.96 0.00 0.20 1.15 -0.23 0.00 0.00 178.00 180.07 3g6n h THR 14 N 0.00 0.88 0.00 1.56 2.02 -1.93 0.85 112.91 116.29 3g6n h THR 14 Ca 0.22 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.38 3g6n h THR 14 Cb 1.07 0.84 0.00 0.00 -1.74 0.00 0.00 68.15 68.33 3g6n h THR 14 CO -0.00 0.01 0.00 -0.07 0.37 0.00 0.00 175.52 175.82 3g6n h LEU 15 N 0.04 0.00 -1.70 2.58 3.38 -1.63 -2.79 115.31 115.19 3g6n h LEU 15 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3g6n h LEU 15 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3g6n h LEU 15 CO -0.01 0.00 -0.02 0.54 0.09 0.00 0.00 178.44 179.04 3g6n n ARG 16 N -2.38 1.69 -3.31 1.13 5.12 0.29 -4.26 116.66 114.94 3g6n n ARG 16 Ca 0.01 -1.61 -0.33 0.00 -1.93 0.00 0.00 57.85 54.00 3g6n n ARG 16 Cb 0.21 -1.37 -0.06 0.00 -1.16 0.00 0.00 32.46 30.08 3g6n n ARG 16 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3g6n s GLU 17 N -1.65 3.91 -0.27 5.56 2.02 -1.05 -4.57 118.70 122.65 3g6n s GLU 17 Ca 0.22 0.46 -0.29 0.00 0.02 0.00 0.00 54.97 55.38 3g6n s GLU 17 Cb 0.16 -2.63 0.01 0.00 0.10 0.00 0.00 34.13 31.77 3g6n s GLU 17 CO 0.26 0.29 1.06 0.08 0.02 0.00 0.00 175.26 176.97 3g6n s VAL 18 N -1.80 4.58 0.86 2.63 1.01 -1.26 -3.10 120.40 123.32 3g6n s VAL 18 Ca 0.48 1.87 -0.11 0.00 0.00 0.00 0.00 61.98 64.23 3g6n s VAL 18 Cb -0.12 -4.36 0.12 0.00 0.00 0.00 0.00 36.38 32.02 3g6n s VAL 18 CO 0.20 -0.33 1.14 0.00 0.00 0.00 0.00 175.10 176.10 3g6n s ALA 19 N 3.44 1.72 0.10 5.51 0.00 0.76 -4.99 121.76 128.30 3g6n s ALA 19 Ca 0.45 0.54 -0.19 0.00 0.00 0.00 0.00 51.96 52.76 3g6n s ALA 19 Cb -0.14 -3.41 -0.07 0.00 0.00 0.00 0.00 23.12 19.50 3g6n s ALA 19 CO 0.11 -2.45 0.60 0.15 0.00 0.00 0.00 175.76 174.17 3g6n s LYS 20 N -4.64 4.22 0.30 0.00 -0.14 0.25 -4.70 119.74 115.03 3g6n s LYS 20 Ca 0.66 0.77 -0.29 0.00 -1.36 0.00 0.00 55.97 55.75 3g6n s LYS 20 Cb -0.22 -3.19 -0.10 0.00 -1.68 0.00 0.00 37.83 32.64 3g6n s LYS 20 CO 0.56 0.60 1.38 -2.00 -0.76 0.00 0.00 175.35 175.13 3g6n s GLU 21 N -1.25 4.30 0.20 1.68 2.56 -1.26 -1.02 118.70 123.90 3g6n s GLU 21 Ca 0.31 2.28 -0.04 0.00 0.00 0.00 0.00 54.97 57.53 3g6n s GLU 21 Cb -0.19 -3.08 -0.05 0.00 2.00 0.00 0.00 34.13 32.81 3g6n s GLU 21 CO 0.20 -0.31 0.43 0.14 -0.56 0.00 0.00 175.26 175.16 3g6n s VAL 22 N -0.70 5.13 0.34 3.70 -7.23 -1.26 -4.90 120.40 115.49 3g6n s VAL 22 Ca 0.53 -0.04 -0.20 0.00 -1.81 0.00 0.00 61.98 60.46 3g6n s VAL 22 Cb -0.41 -3.68 -0.10 0.00 0.56 0.00 0.00 36.38 32.75 3g6n s VAL 22 CO 0.50 -0.11 0.84 -0.44 -0.31 0.00 0.00 175.10 175.59 3g6n s SER 23 N -2.79 6.97 0.02 4.85 0.01 -1.26 -4.97 113.70 116.53 3g6n s SER 23 Ca 0.41 1.54 0.08 0.00 1.31 0.00 0.00 55.95 59.29 3g6n s SER 23 Cb -0.11 -2.47 -0.03 0.00 0.21 0.00 0.00 66.02 63.62 3g6n s SER 23 CO 0.27 -0.20 -0.24 -0.76 0.41 0.00 0.00 173.24 172.72 3g6n s LEU 24 N -2.73 2.24 0.61 2.44 1.43 -1.26 -3.58 118.68 117.83 3g6n s LEU 24 Ca 0.54 -0.51 -0.17 0.00 -1.03 0.00 0.00 54.13 52.96 3g6n s LEU 24 Cb -0.12 -1.36 -0.02 0.00 0.03 0.00 0.00 46.19 44.72 3g6n s LEU 24 CO 0.17 0.28 1.16 -2.16 0.23 0.00 0.00 176.35 176.03 3g6n s PRO 25 N -1.06 2.92 0.32 1.29 0.04 -1.26 -5.09 135.00 132.16 3g6n s PRO 25 Ca 0.12 1.64 -0.29 0.00 0.04 0.00 0.00 61.00 62.50 3g6n s PRO 25 Cb -0.10 -1.94 -0.11 0.00 0.04 0.00 0.00 34.50 32.38 3g6n s PRO 25 CO 0.02 -1.20 1.57 1.28 0.04 0.00 0.00 177.00 178.71 3g6n n LEU 26 N -1.88 4.52 -4.75 -3.56 4.77 -1.23 -5.00 117.00 109.86 3g6n n LEU 26 Ca 0.12 1.17 -0.29 0.00 -0.03 0.00 0.00 56.01 56.98 3g6n n LEU 26 Cb 0.51 -1.61 0.16 0.00 -2.33 0.00 0.00 43.42 40.15 3g6n n LEU 26 CO 0.45 0.18 0.70 -0.94 -1.33 0.00 0.00 177.39 176.45 3g6n s SER 27 N 0.33 2.98 0.37 -1.43 1.04 -1.26 -4.88 113.70 110.85 3g6n s SER 27 Ca 0.61 0.91 0.20 0.00 0.48 0.00 0.00 55.95 58.16 3g6n s SER 27 Cb -0.48 -1.43 0.23 0.00 0.10 0.00 0.00 66.02 64.43 3g6n s SER 27 CO 0.53 -2.88 1.51 -0.33 0.98 0.00 0.00 173.24 173.05 3g6n h GLU 28 N -1.72 0.00 -0.41 4.02 4.39 -1.98 -2.34 114.58 116.53 3g6n h GLU 28 Ca -0.50 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.13 3g6n h GLU 28 Cb 1.32 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.96 3g6n h GLU 28 CO 0.56 0.15 -0.00 1.49 -1.16 0.00 0.00 179.01 180.05 3g6n h GLU 29 N 0.00 0.73 -0.15 2.33 4.81 -1.99 -0.58 114.58 119.73 3g6n h GLU 29 Ca -0.01 -0.23 -0.17 0.00 -0.13 0.00 0.00 59.36 58.82 3g6n h GLU 29 Cb 1.13 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.44 3g6n h GLU 29 CO 0.02 0.81 -0.63 -0.44 -0.73 0.00 0.00 179.01 178.04 3g6n h ASP 30 N 0.56 0.61 -0.37 1.04 3.32 -1.91 -1.55 116.42 118.12 3g6n h ASP 30 Ca 0.12 -0.35 -0.09 0.00 0.02 0.00 0.00 57.03 56.72 3g6n h ASP 30 Cb 0.48 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 3g6n h ASP 30 CO 0.02 1.08 -0.12 0.40 -1.72 0.00 0.00 179.24 178.90 3g6n h ILE 31 N 0.39 1.28 -0.43 0.35 2.04 -1.29 -2.53 117.51 117.32 3g6n h ILE 31 Ca -0.01 -1.21 -0.09 0.00 1.00 0.00 0.00 64.86 64.54 3g6n h ILE 31 Cb 1.19 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 38.55 3g6n h ILE 31 CO 0.12 0.40 -0.12 0.28 0.00 0.00 0.00 178.15 178.83 3g6n h SER 32 N 0.53 0.76 -0.79 1.72 0.02 -1.05 -2.28 113.55 112.45 3g6n h SER 32 Ca 0.09 -0.23 -0.04 0.00 -0.84 0.00 0.00 61.79 60.78 3g6n h SER 32 Cb 0.64 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.94 3g6n h SER 32 CO 0.04 0.90 0.36 0.25 -1.14 0.00 0.00 176.83 177.24 3g6n h LEU 33 N 0.69 1.06 -0.09 5.07 5.85 -1.19 -1.22 115.31 125.48 3g6n h LEU 33 Ca 0.12 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 3g6n h LEU 33 Cb 0.59 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 3g6n h LEU 33 CO 0.04 0.91 0.03 1.23 -0.34 0.00 0.00 178.44 180.31 3g6n h GLY 34 N 1.16 0.15 1.45 3.75 0.00 -1.12 0.03 103.07 108.48 3g6n h GLY 34 Ca 0.27 -0.08 0.03 0.00 0.00 0.00 0.00 47.33 47.55 3g6n h GLY 34 CO -0.03 0.08 0.30 0.50 0.00 0.00 0.00 176.54 177.39 3g6n h LYS 35 N -0.03 0.48 -0.28 4.80 1.57 -1.20 0.08 116.57 121.98 3g6n h LYS 35 Ca 0.03 -0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 3g6n h LYS 35 Cb 0.20 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 3g6n h LYS 35 CO -0.00 0.31 -0.35 1.49 -0.57 0.00 0.00 179.45 180.33 3g6n h GLU 36 N 0.49 0.74 -0.61 3.15 4.81 -0.88 -0.32 114.58 121.97 3g6n h GLU 36 Ca 0.18 -0.42 -0.10 0.00 -0.13 0.00 0.00 59.36 58.89 3g6n h GLU 36 Cb 0.12 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 3g6n h GLU 36 CO -0.05 1.04 -0.02 0.52 -0.73 0.00 0.00 179.01 179.78 3g6n h MET 37 N 0.49 1.08 -0.13 1.92 2.86 -0.03 -2.45 114.93 118.67 3g6n h MET 37 Ca 0.04 -0.35 -0.19 0.00 -2.06 0.00 0.00 59.70 57.13 3g6n h MET 37 Cb 0.94 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 32.50 3g6n h MET 37 CO 0.08 1.06 -0.70 1.25 1.06 0.00 0.00 176.91 179.66 3g6n h LEU 38 N 0.98 0.65 -1.28 1.22 6.46 -0.97 -2.96 115.31 119.41 3g6n h LEU 38 Ca 0.17 -0.41 -0.04 0.00 -0.12 0.00 0.00 57.88 57.49 3g6n h LEU 38 Cb 0.58 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.31 3g6n h LEU 38 CO 0.03 1.16 0.08 -0.08 -0.62 0.00 0.00 178.44 179.01 3g6n h GLU 39 N 0.39 0.57 0.72 1.25 4.81 -0.96 -2.65 114.58 118.71 3g6n h GLU 39 Ca -0.03 -0.10 -0.04 0.00 -0.13 0.00 0.00 59.36 59.07 3g6n h GLU 39 Cb 1.29 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 30.58 3g6n h GLU 39 CO 0.13 0.54 -0.35 0.35 -0.73 0.00 0.00 179.01 178.95 3g6n h PHE 40 N 0.56 -0.90 -0.54 0.92 3.57 -1.33 -0.06 116.94 119.17 3g6n h PHE 40 Ca 0.13 -0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.70 3g6n h PHE 40 Cb 0.24 0.30 -0.07 0.00 2.79 0.00 0.00 35.95 39.20 3g6n h PHE 40 CO 0.01 -0.55 0.13 -0.07 -2.23 0.00 0.00 178.31 175.60 3g6n h LEU 41 N -1.01 0.04 -0.42 0.59 3.38 -1.41 0.29 115.31 116.76 3g6n h LEU 41 Ca -0.10 0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 3g6n h LEU 41 Cb 0.75 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 3g6n h LEU 41 CO 0.16 0.04 0.18 0.11 0.09 0.00 0.00 178.44 179.03 3g6n h LYS 42 N 0.27 0.62 -0.41 1.13 1.57 -1.44 -2.60 116.57 115.72 3g6n h LYS 42 Ca 0.27 -0.11 -0.06 0.00 -1.87 0.00 0.00 60.65 58.89 3g6n h LYS 42 Cb 0.37 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 3g6n h LYS 42 CO -0.34 0.57 0.01 -0.91 -0.57 0.00 0.00 179.45 178.21 3g6n h ASN 43 N 0.54 0.61 0.91 0.86 2.35 0.14 -2.31 115.58 118.68 3g6n h ASN 43 Ca 0.14 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3g6n h ASN 43 Cb 0.17 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.38 3g6n h ASN 43 CO -0.01 0.67 0.00 0.77 -1.65 0.00 0.00 177.43 177.21 3g6n h SER 44 N 0.61 0.00 -0.39 5.81 4.64 -0.21 -2.47 113.55 121.54 3g6n h SER 44 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3g6n h SER 44 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 3g6n h SER 44 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 3g6n n GLN 45 N -2.64 2.47 -3.78 4.77 6.02 -0.88 -3.86 117.38 119.48 3g6n n GLN 45 Ca 0.02 -2.27 -0.37 0.00 -0.01 0.00 0.00 57.00 54.37 3g6n n GLN 45 Cb 0.28 -1.50 -0.13 0.00 1.02 0.00 0.00 30.24 29.91 3g6n n GLN 45 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3g6n s ASP 46 N -1.43 5.05 0.12 1.08 2.15 -1.05 -5.02 116.67 117.57 3g6n s ASP 46 Ca 0.38 -0.65 -0.28 0.00 0.43 0.00 0.00 52.55 52.42 3g6n s ASP 46 Cb 0.22 -1.87 -0.09 0.00 -0.30 0.00 0.00 42.92 40.89 3g6n s ASP 46 CO 0.31 -0.17 1.48 -0.65 -0.17 0.00 0.00 175.17 175.97 3g6n h PRO 47 N 8.22 -0.25 -0.06 4.34 0.11 -1.88 0.50 132.00 142.98 3g6n h PRO 47 Ca -0.33 0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.84 3g6n h PRO 47 Cb 1.13 0.06 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 3g6n h PRO 47 CO 0.60 -0.16 -0.19 0.82 -0.21 0.00 0.00 178.00 178.86 3g6n h ILE 48 N -0.26 0.54 0.35 4.15 2.04 -1.95 -1.21 117.51 121.18 3g6n h ILE 48 Ca 0.08 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.93 3g6n h ILE 48 Cb 0.48 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 3g6n h ILE 48 CO -0.60 0.00 -0.17 0.11 0.00 0.00 0.00 178.15 177.49 3g6n h LYS 49 N -0.27 -0.45 -0.97 2.37 1.57 -1.73 -1.98 116.57 115.11 3g6n h LYS 49 Ca 0.08 0.03 0.19 0.00 -1.87 0.00 0.00 60.65 59.08 3g6n h LYS 49 Cb 0.37 0.10 -0.11 0.00 0.08 0.00 0.00 32.23 32.68 3g6n h LYS 49 CO -0.22 -0.18 0.57 0.00 -0.57 0.00 0.00 179.45 179.05 3g6n h ALA 50 N -0.08 1.61 0.09 3.86 0.00 0.44 0.21 119.26 125.39 3g6n h ALA 50 Ca -0.05 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3g6n h ALA 50 Cb 0.47 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3g6n h ALA 50 CO 0.08 -0.10 -0.04 0.93 0.00 0.00 0.00 179.25 180.11 3g6n h GLU 51 N 0.70 -0.12 -0.25 0.00 5.08 -1.11 0.23 114.58 119.10 3g6n h GLU 51 Ca 0.57 0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.88 3g6n h GLU 51 Cb 0.91 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 3g6n h GLU 51 CO -0.40 0.25 -0.11 0.93 -1.00 0.00 0.00 179.01 178.68 3g6n h GLU 52 N -0.51 0.41 -0.29 2.33 4.39 -0.75 -2.26 114.58 117.90 3g6n h GLU 52 Ca -0.01 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 59.58 3g6n h GLU 52 Cb 0.42 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 3g6n h GLU 52 CO 0.02 0.53 0.00 1.28 -1.16 0.00 0.00 179.01 179.68 3g6n n LEU 53 N -4.23 2.32 -3.74 1.33 4.77 0.69 -4.96 117.00 113.17 3g6n n LEU 53 Ca 0.00 -1.02 -0.28 0.00 -0.03 0.00 0.00 56.01 54.68 3g6n n LEU 53 Cb 0.30 -0.19 0.01 0.00 -2.33 0.00 0.00 43.42 41.21 3g6n n LEU 53 CO 0.39 0.51 -0.11 1.41 -1.33 0.00 0.00 177.39 178.26 3g6n n HIS 54 N 0.75 -1.98 -4.76 -1.77 8.25 -0.19 -4.83 115.22 110.68 3g6n n HIS 54 Ca 0.17 0.61 -0.30 0.00 -0.26 0.00 0.00 57.72 57.94 3g6n n HIS 54 Cb 0.42 -3.09 -0.14 0.00 1.12 0.00 0.00 29.99 28.30 3g6n n HIS 54 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3g6n s LEU 55 N -5.75 2.34 -0.21 2.41 1.43 0.63 -4.61 118.68 114.93 3g6n s LEU 55 Ca 0.22 -0.55 -0.15 0.00 -1.03 0.00 0.00 54.13 52.62 3g6n s LEU 55 Cb -0.10 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.71 3g6n s LEU 55 CO 0.89 0.25 0.36 -0.60 0.23 0.00 0.00 176.35 177.48 3g6n s ARG 56 N -1.40 4.16 0.31 1.70 3.52 -1.26 -4.74 118.95 121.24 3g6n s ARG 56 Ca 0.13 0.13 -0.28 0.00 -0.13 0.00 0.00 55.73 55.58 3g6n s ARG 56 Cb -0.10 -3.54 -0.13 0.00 -1.56 0.00 0.00 34.95 29.62 3g6n s ARG 56 CO 0.04 -0.02 1.13 0.41 -0.81 0.00 0.00 175.30 176.04 3g6n n GLY 57 N 3.98 0.11 3.24 8.12 0.00 -1.25 -4.90 105.19 114.48 3g6n n GLY 57 Ca -0.09 0.33 -0.10 0.00 0.00 0.00 0.00 46.02 46.15 3g6n n GLY 57 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3g6n s GLY 58 N -0.43 -0.06 0.00 -0.02 0.00 -1.26 -4.96 107.32 100.59 3g6n s GLY 58 Ca 0.58 -0.22 0.04 0.00 0.00 0.00 0.00 44.72 45.11 3g6n s GLY 58 CO 0.60 -0.43 0.22 3.33 0.00 0.00 0.00 173.10 176.83 3g6n n VAL 59 N 0.30 0.00 -3.70 1.40 0.24 -1.26 -4.78 118.33 110.53 3g6n n VAL 59 Ca -0.17 -0.42 -0.13 0.00 -2.04 0.00 0.00 64.34 61.57 3g6n n VAL 59 Cb 0.61 1.01 -0.07 0.00 -1.47 0.00 0.00 33.84 33.92 3g6n n VAL 59 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3g6n s GLY 60 N -1.22 -0.24 -0.06 7.63 0.00 -1.26 -0.73 107.32 111.44 3g6n s GLY 60 Ca 0.02 0.38 -0.14 0.00 0.00 0.00 0.00 44.72 44.97 3g6n s GLY 60 CO 0.14 0.13 0.34 -2.27 0.00 0.00 0.00 173.10 171.44 3g6n s LEU 61 N -1.69 0.73 0.03 0.66 2.96 0.14 -4.96 118.68 116.55 3g6n s LEU 61 Ca -0.09 0.35 0.07 0.00 -0.22 0.00 0.00 54.13 54.24 3g6n s LEU 61 Cb -0.02 1.29 -0.02 0.00 0.50 0.00 0.00 46.19 47.93 3g6n s LEU 61 CO 0.01 -0.33 -0.20 0.00 -1.32 0.00 0.00 176.35 174.51 3g6n s ALA 62 N -0.74 1.71 0.31 5.97 0.00 -1.26 -0.50 121.76 127.25 3g6n s ALA 62 Ca -0.08 -1.00 0.07 0.00 0.00 0.00 0.00 51.96 50.94 3g6n s ALA 62 Cb -0.04 -0.35 0.76 0.00 0.00 0.00 0.00 23.12 23.49 3g6n s ALA 62 CO 0.03 0.39 1.79 0.00 0.00 0.00 0.00 175.76 177.96 3g6n h ALA 63 N 5.05 1.72 -0.24 0.00 0.00 -1.52 0.22 119.26 124.48 3g6n h ALA 63 Ca -0.41 0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.64 3g6n h ALA 63 Cb 1.16 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 3g6n h ALA 63 CO 0.45 -0.08 0.19 -1.35 0.00 0.00 0.00 179.25 178.46 3g6n h PRO 64 N 0.74 0.00 0.00 0.00 0.11 -1.70 0.35 132.00 131.51 3g6n h PRO 64 Ca 0.57 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.68 3g6n h PRO 64 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 3g6n h PRO 64 CO -0.36 0.00 0.00 1.96 -0.21 0.00 0.00 178.00 179.39 3g6n h GLN 65 N 0.00 0.00 -0.71 1.05 4.20 -1.25 0.17 115.11 118.57 3g6n h GLN 65 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 3g6n h GLN 65 Cb 0.50 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.28 3g6n h GLN 65 CO -0.00 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 179.44 3g6n n LEU 66 N -2.72 4.12 -0.84 1.46 4.77 0.12 -0.62 117.00 123.28 3g6n n LEU 66 Ca 0.01 -2.09 -0.09 0.00 -0.03 0.00 0.00 56.01 53.81 3g6n n LEU 66 Cb 0.24 -0.51 -0.02 0.00 -2.33 0.00 0.00 43.42 40.80 3g6n n LEU 66 CO 0.23 0.95 -0.10 -0.67 -1.33 0.00 0.00 177.39 176.47 3g6n n ASP 67 N 1.52 -3.55 -4.05 -1.43 2.03 0.05 -4.90 116.55 106.23 3g6n n ASP 67 Ca 0.25 0.10 -0.32 0.00 0.52 0.00 0.00 54.79 55.33 3g6n n ASP 67 Cb 0.68 -2.35 -0.14 0.00 -0.72 0.00 0.00 41.12 38.59 3g6n n ASP 67 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3g6n s ILE 68 N -2.38 2.56 -0.70 5.18 1.01 -0.80 -4.98 121.20 121.08 3g6n s ILE 68 Ca 0.00 -2.24 -0.07 0.00 0.00 0.00 0.00 60.65 58.35 3g6n s ILE 68 Cb 0.00 -2.83 -0.06 0.00 0.01 0.00 0.00 42.46 39.58 3g6n s ILE 68 CO 0.00 -0.60 1.86 -0.24 0.00 0.00 0.00 174.94 175.96 3g6n n SER 69 N 4.35 3.65 -4.24 3.58 2.88 -1.26 -2.47 113.62 120.11 3g6n n SER 69 Ca 0.02 -2.30 -0.23 0.00 -1.33 0.00 0.00 58.87 55.02 3g6n n SER 69 Cb 0.42 -0.97 -0.13 0.00 -0.75 0.00 0.00 64.21 62.78 3g6n n SER 69 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 3g6n s LYS 70 N 3.96 1.15 -1.39 -1.46 1.02 -1.26 -0.58 119.74 121.17 3g6n s LYS 70 Ca 0.34 -1.00 -0.15 0.00 0.02 0.00 0.00 55.97 55.18 3g6n s LYS 70 Cb 0.09 -1.30 0.03 0.00 -0.52 0.00 0.00 37.83 36.13 3g6n s LYS 70 CO -0.00 0.31 2.14 0.54 -0.92 0.00 0.00 175.35 177.42 3g6n n ARG 71 N 1.50 2.81 -4.39 1.68 1.74 -0.19 -4.43 116.66 115.38 3g6n n ARG 71 Ca -0.19 -2.65 -0.22 0.00 -0.77 0.00 0.00 57.85 54.03 3g6n n ARG 71 Cb 0.54 -3.30 -0.16 0.00 -1.02 0.00 0.00 32.46 28.51 3g6n n ARG 71 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3g6n s ILE 72 N 3.52 0.82 0.06 0.55 1.01 -1.26 -0.67 121.20 125.24 3g6n s ILE 72 Ca 0.49 -0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.82 3g6n s ILE 72 Cb 0.12 -0.77 -0.03 0.00 0.01 0.00 0.00 42.46 41.80 3g6n s ILE 72 CO -0.05 0.27 -0.06 0.27 0.00 0.00 0.00 174.94 175.37 3g6n s ILE 73 N 0.53 0.47 0.02 2.92 -4.36 -0.81 -1.62 121.20 118.36 3g6n s ILE 73 Ca -0.09 -1.53 0.03 0.00 -0.26 0.00 0.00 60.65 58.81 3g6n s ILE 73 Cb -0.13 -1.15 -0.02 0.00 1.25 0.00 0.00 42.46 42.42 3g6n s ILE 73 CO 0.01 -0.71 -0.10 0.00 0.24 0.00 0.00 174.94 174.39 3g6n s ALA 74 N -2.75 0.81 -0.00 2.27 0.00 0.35 -0.30 121.76 122.14 3g6n s ALA 74 Ca 0.01 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.35 3g6n s ALA 74 Cb -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.00 3g6n s ALA 74 CO -0.04 0.14 -0.01 0.14 0.00 0.00 0.00 175.76 175.99 3g6n s VAL 75 N -0.72 0.07 -0.41 0.00 -7.23 -0.73 -0.68 120.40 110.69 3g6n s VAL 75 Ca -0.01 -0.01 0.04 0.00 -1.81 0.00 0.00 61.98 60.19 3g6n s VAL 75 Cb -0.06 -0.08 0.17 0.00 0.56 0.00 0.00 36.38 36.96 3g6n s VAL 75 CO 0.00 0.03 0.33 -2.28 -0.31 0.00 0.00 175.10 172.88 3g6n s HIS 76 N 0.13 1.11 -0.25 2.82 2.46 0.09 -1.56 115.29 120.09 3g6n s HIS 76 Ca -0.01 -2.29 -0.26 0.00 0.47 0.00 0.00 55.06 52.97 3g6n s HIS 76 Cb -0.02 -0.96 -0.00 0.00 -0.13 0.00 0.00 32.58 31.47 3g6n s HIS 76 CO -0.00 -0.82 0.88 0.08 -2.47 0.00 0.00 174.74 172.40 3g6n s VAL 77 N 0.11 4.79 0.00 0.89 1.01 0.24 -4.64 120.40 122.80 3g6n s VAL 77 Ca 0.31 1.63 0.00 0.00 0.00 0.00 0.00 61.98 63.92 3g6n s VAL 77 Cb 0.01 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.22 3g6n s VAL 77 CO -0.18 -0.13 0.43 -0.81 0.00 0.00 0.00 175.10 174.42 3g6n n PRO 78 N 6.13 0.00 -1.65 2.72 -0.04 -1.26 -3.41 135.00 137.49 3g6n n PRO 78 Ca 0.07 -0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 3g6n n PRO 78 Cb 0.47 -1.36 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 3g6n n PRO 78 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3g6n n SER 79 N 2.81 -6.73 -3.69 3.54 2.88 -1.26 -5.06 113.62 106.12 3g6n n SER 79 Ca 0.00 1.01 -0.13 0.00 -1.33 0.00 0.00 58.87 58.42 3g6n n SER 79 Cb 0.00 -3.72 -0.13 0.00 -0.75 0.00 0.00 64.21 59.61 3g6n n SER 79 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 3g6n s SER 88 N -0.36 0.10 -0.09 -3.46 0.01 -1.26 -5.19 113.70 103.46 3g6n s SER 88 Ca 0.00 0.55 -0.02 0.00 1.31 0.00 0.00 55.95 57.79 3g6n s SER 88 Cb 0.00 0.54 0.03 0.00 0.21 0.00 0.00 66.02 66.80 3g6n s SER 88 CO 0.00 -0.21 0.01 -0.22 0.41 0.00 0.00 173.24 173.23 3g6n s LEU 89 N 1.89 0.65 -0.28 2.44 2.96 -1.22 -5.04 118.68 120.08 3g6n s LEU 89 Ca -0.03 -0.16 -0.02 0.00 -0.22 0.00 0.00 54.13 53.69 3g6n s LEU 89 Cb -0.11 -0.46 0.11 0.00 0.50 0.00 0.00 46.19 46.23 3g6n s LEU 89 CO -0.08 -0.21 0.21 -0.55 -1.32 0.00 0.00 176.35 174.40 3g6n s SER 90 N 1.96 2.48 0.16 3.68 0.15 -1.25 -0.59 113.70 120.29 3g6n s SER 90 Ca 0.04 -0.94 -0.25 0.00 0.70 0.00 0.00 55.95 55.51 3g6n s SER 90 Cb -0.13 0.10 0.06 0.00 -1.71 0.00 0.00 66.02 64.34 3g6n s SER 90 CO -0.06 -0.40 0.91 0.28 1.20 0.00 0.00 173.24 175.17 3g6n s THR 91 N 2.24 0.00 -0.07 6.45 -1.32 -0.60 -5.01 115.64 117.33 3g6n s THR 91 Ca 0.09 -0.64 0.01 0.00 -1.21 0.00 0.00 61.69 59.94 3g6n s THR 91 Cb -0.15 -1.89 -0.03 0.00 -1.51 0.00 0.00 72.50 68.92 3g6n s THR 91 CO -0.32 0.00 -0.09 -0.69 -2.21 0.00 0.00 174.62 171.31 3g6n s VAL 92 N -3.37 3.54 -0.16 5.08 1.01 -1.26 -1.77 120.40 123.47 3g6n s VAL 92 Ca 0.11 -0.54 0.01 0.00 0.00 0.00 0.00 61.98 61.57 3g6n s VAL 92 Cb -0.02 -2.44 0.02 0.00 0.00 0.00 0.00 36.38 33.93 3g6n s VAL 92 CO 0.02 0.59 -0.20 -0.04 0.00 0.00 0.00 175.10 175.46 3g6n s MET 93 N -0.69 3.01 -0.18 2.72 -1.94 0.59 -4.57 119.30 118.24 3g6n s MET 93 Ca 0.10 -0.83 -0.09 0.00 -1.71 0.00 0.00 55.69 53.16 3g6n s MET 93 Cb -0.11 -2.53 -0.05 0.00 2.01 0.00 0.00 34.83 34.16 3g6n s MET 93 CO 0.01 -0.13 0.13 0.71 -0.01 0.00 0.00 175.02 175.74 3g6n s TYR 94 N 1.10 3.46 -1.25 -0.03 1.51 0.11 -1.92 117.35 120.33 3g6n s TYR 94 Ca 0.00 0.39 -0.11 0.00 -1.01 0.00 0.00 57.07 56.34 3g6n s TYR 94 Cb -0.14 -2.10 -0.00 0.00 -0.11 0.00 0.00 41.96 39.61 3g6n s TYR 94 CO -0.08 0.42 0.65 0.09 -1.11 0.00 0.00 175.55 175.51 3g6n n ASN 95 N 3.09 -2.99 -4.76 2.29 3.02 0.16 -1.63 115.26 114.42 3g6n n ASN 95 Ca -0.17 -0.98 -0.34 0.00 -0.03 0.00 0.00 54.58 53.06 3g6n n ASN 95 Cb 0.53 -3.37 0.04 0.00 -0.61 0.00 0.00 39.78 36.37 3g6n n ASN 95 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3g6n s PRO 96 N -6.17 2.82 -0.27 3.52 0.04 -1.26 -4.58 135.00 129.09 3g6n s PRO 96 Ca 0.24 1.50 -0.15 0.00 0.04 0.00 0.00 61.00 62.63 3g6n s PRO 96 Cb -0.09 -1.94 0.08 0.00 0.04 0.00 0.00 34.50 32.59 3g6n s PRO 96 CO 0.86 -1.25 0.66 0.21 0.04 0.00 0.00 177.00 177.52 3g6n s LYS 97 N -3.88 0.67 -0.23 4.56 2.36 -0.45 -4.99 119.74 117.77 3g6n s LYS 97 Ca 0.69 1.21 -0.25 0.00 -2.55 0.00 0.00 55.97 55.07 3g6n s LYS 97 Cb -0.23 0.17 -0.01 0.00 -1.05 0.00 0.00 37.83 36.72 3g6n s LYS 97 CO 0.39 -0.15 0.83 0.42 1.55 0.00 0.00 175.35 178.39 3g6n s ILE 98 N 1.70 4.84 -0.08 5.43 1.01 -1.26 -0.96 121.20 131.88 3g6n s ILE 98 Ca -0.10 1.59 -0.07 0.00 0.00 0.00 0.00 60.65 62.07 3g6n s ILE 98 Cb -0.06 -4.12 -0.28 0.00 0.01 0.00 0.00 42.46 38.01 3g6n s ILE 98 CO -0.19 -0.06 0.53 -0.07 0.00 0.00 0.00 174.94 175.14 3g6n h LEU 99 N 9.09 0.48 -8.29 2.97 3.38 -1.07 -3.49 115.31 118.37 3g6n h LEU 99 Ca -0.24 -0.88 -0.10 0.00 0.09 0.00 0.00 57.88 56.75 3g6n h LEU 99 Cb 1.10 -0.15 -0.09 0.00 0.09 0.00 0.00 40.66 41.61 3g6n h LEU 99 CO 0.87 1.77 -0.13 -0.94 0.09 0.00 0.00 178.44 180.10 3g6n s SER 100 N -7.09 0.10 0.18 -0.43 1.04 -1.24 -5.00 113.70 101.25 3g6n s SER 100 Ca -0.18 -1.06 -0.21 0.00 0.48 0.00 0.00 55.95 54.98 3g6n s SER 100 Cb 0.06 0.61 0.05 0.00 0.10 0.00 0.00 66.02 66.84 3g6n s SER 100 CO 0.81 -1.19 0.57 -1.38 0.98 0.00 0.00 173.24 173.04 3g6n s HIS 101 N -3.76 -0.38 0.69 5.02 -3.43 -1.26 -1.74 115.29 110.44 3g6n s HIS 101 Ca 0.24 0.10 -0.11 0.00 -0.80 0.00 0.00 55.06 54.49 3g6n s HIS 101 Cb -0.01 0.51 0.01 0.00 -1.43 0.00 0.00 32.58 31.66 3g6n s HIS 101 CO 0.11 -0.89 1.08 -1.54 -2.00 0.00 0.00 174.74 171.50 3g6n s SER 102 N -2.80 5.54 -0.01 7.38 1.04 -0.35 -4.97 113.70 119.52 3g6n s SER 102 Ca 0.04 1.27 -0.20 0.00 0.48 0.00 0.00 55.95 57.54 3g6n s SER 102 Cb -0.01 -2.13 -0.27 0.00 0.10 0.00 0.00 66.02 63.70 3g6n s SER 102 CO -0.09 -1.30 1.02 0.58 0.98 0.00 0.00 173.24 174.43 3g6n h VAL 103 N -0.62 1.45 -2.30 5.02 2.07 -2.01 -3.44 116.25 116.41 3g6n h VAL 103 Ca -0.45 -2.30 -0.62 0.00 0.82 0.00 0.00 66.70 64.15 3g6n h VAL 103 Cb 1.23 2.85 0.08 0.00 -1.52 0.00 0.00 31.29 33.94 3g6n h VAL 103 CO 0.62 0.66 0.41 1.67 0.02 0.00 0.00 177.57 180.96 3g6n n GLN 104 N -4.14 1.56 -4.10 1.57 -0.06 -1.26 -4.89 117.38 106.06 3g6n n GLN 104 Ca -0.12 0.56 -0.22 0.00 -2.00 0.00 0.00 57.00 55.21 3g6n n GLN 104 Cb 0.76 -2.12 -0.05 0.00 -4.06 0.00 0.00 30.24 24.77 3g6n n GLN 104 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 3g6n s ASP 105 N 0.09 4.98 0.24 1.69 1.01 -1.26 -1.63 116.67 121.80 3g6n s ASP 105 Ca 0.70 -0.55 -0.13 0.00 0.71 0.00 0.00 52.55 53.28 3g6n s ASP 105 Cb -0.75 -0.98 -0.00 0.00 1.01 0.00 0.00 42.92 42.19 3g6n s ASP 105 CO 0.52 -0.16 0.47 0.00 0.21 0.00 0.00 175.17 176.20 3g6n s ALA 106 N -2.30 -0.26 0.09 5.23 0.00 0.40 -1.42 121.76 123.50 3g6n s ALA 106 Ca 0.35 -0.84 -0.25 0.00 0.00 0.00 0.00 51.96 51.22 3g6n s ALA 106 Cb -0.06 1.05 0.08 0.00 0.00 0.00 0.00 23.12 24.19 3g6n s ALA 106 CO 0.23 -0.84 0.67 0.00 0.00 0.00 0.00 175.76 175.82 3g6n s LEU 108 N -2.41 4.09 0.53 0.00 1.43 -1.26 -0.13 118.68 120.92 3g6n s LEU 108 Ca -0.00 0.57 0.20 0.00 -1.03 0.00 0.00 54.13 53.86 3g6n s LEU 108 Cb -0.01 -3.09 1.34 0.00 0.03 0.00 0.00 46.19 44.46 3g6n s LEU 108 CO -0.08 -0.67 2.11 1.23 0.23 0.00 0.00 176.35 179.16 3g6n h GLY 109 N 9.60 0.00 0.75 -3.19 0.00 -1.50 0.08 103.07 108.81 3g6n h GLY 109 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.09 3g6n h GLY 109 CO 0.90 0.00 -0.21 -2.21 0.00 0.00 0.00 176.54 175.02 3g6n n GLU 110 N -4.45 0.60 0.00 4.80 4.07 -1.26 -5.04 120.64 119.37 3g6n n GLU 110 Ca 0.01 -0.28 0.00 0.00 -0.06 0.00 0.00 57.16 56.83 3g6n n GLU 110 Cb 0.25 -1.49 0.00 0.00 -0.06 0.00 0.00 31.44 30.14 3g6n n GLU 110 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3g6n n GLY 111 N 1.35 -0.74 3.76 8.31 0.00 0.01 -4.97 105.19 112.91 3g6n n GLY 111 Ca 0.12 -1.57 -0.39 0.00 0.00 0.00 0.00 46.02 44.18 3g6n n GLY 111 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g6n s GLU 112 N -3.41 4.34 0.58 1.61 2.02 -1.26 -4.94 118.70 117.63 3g6n s GLU 112 Ca 0.00 0.77 -0.01 0.00 0.02 0.00 0.00 54.97 55.76 3g6n s GLU 112 Cb 0.00 -3.34 0.04 0.00 0.10 0.00 0.00 34.13 30.92 3g6n s GLU 112 CO 0.00 0.36 0.82 0.20 0.02 0.00 0.00 175.26 176.66 3g6n s GLY 113 N -0.19 1.78 -0.30 -1.39 0.00 -1.26 -5.02 107.32 100.94 3g6n s GLY 113 Ca 0.32 -1.21 -0.06 0.00 0.00 0.00 0.00 44.72 43.77 3g6n s GLY 113 CO 0.18 -0.91 0.75 0.00 0.00 0.00 0.00 173.10 173.13 3g6n h LEU 115 N 7.96 0.00 0.00 0.00 -0.00 -1.92 -1.07 115.31 120.28 3g6n h LEU 115 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.69 3g6n h LEU 115 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.81 3g6n h LEU 115 CO 0.14 0.00 -0.89 -1.20 -0.00 0.00 0.00 178.44 176.48 3g6n n SER 116 N -2.26 0.71 -4.23 -0.43 7.64 -1.26 -4.81 113.62 108.98 3g6n n SER 116 Ca -0.01 0.11 -0.34 0.00 1.01 0.00 0.00 58.87 59.63 3g6n n SER 116 Cb 0.26 0.47 -0.15 0.00 -1.01 0.00 0.00 64.21 63.78 3g6n n SER 116 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3g6n s VAL 117 N -3.25 2.85 -0.17 0.44 0.11 -0.41 -0.36 120.40 119.63 3g6n s VAL 117 Ca 0.03 -0.68 0.18 0.00 -2.93 0.00 0.00 61.98 58.57 3g6n s VAL 117 Cb 0.12 -2.28 -0.05 0.00 -1.53 0.00 0.00 36.38 32.65 3g6n s VAL 117 CO 0.77 0.46 1.03 0.44 -3.33 0.00 0.00 175.10 174.47 3g6n h ASP 118 N 8.04 0.00 -4.34 3.54 3.32 -1.87 -3.43 116.42 121.68 3g6n h ASP 118 Ca -0.43 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.11 3g6n h ASP 118 Cb 1.15 0.00 0.09 0.00 0.22 0.00 0.00 39.33 40.79 3g6n h ASP 118 CO 0.62 0.42 0.38 0.00 -1.72 0.00 0.00 179.24 178.93 3g6n s ARG 119 N -3.03 2.96 -0.11 3.56 1.70 -1.26 -5.03 118.95 117.75 3g6n s ARG 119 Ca -0.01 0.89 -0.15 0.00 -0.47 0.00 0.00 55.73 56.00 3g6n s ARG 119 Cb 0.08 -2.00 -0.05 0.00 -0.57 0.00 0.00 34.95 32.42 3g6n s ARG 119 CO 0.79 -1.06 0.37 -2.00 -1.08 0.00 0.00 175.30 172.31 3g6n s GLU 120 N -5.08 4.15 -0.29 3.89 -6.30 -1.26 -5.06 118.70 108.75 3g6n s GLU 120 Ca 0.58 0.26 0.02 0.00 -2.50 0.00 0.00 54.97 53.33 3g6n s GLU 120 Cb -0.14 -3.37 0.08 0.00 0.00 0.00 0.00 34.13 30.71 3g6n s GLU 120 CO 0.55 0.36 0.01 0.08 0.02 0.00 0.00 175.26 176.27 3g6n s VAL 121 N 0.05 1.77 0.63 3.70 1.01 -1.26 -5.12 120.40 121.19 3g6n s VAL 121 Ca 0.21 -1.73 -0.18 0.00 0.00 0.00 0.00 61.98 60.28 3g6n s VAL 121 Cb -0.14 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.05 3g6n s VAL 121 CO 0.08 -0.38 1.21 -2.84 0.00 0.00 0.00 175.10 173.16 3g6n s PRO 122 N 1.21 2.76 0.00 2.72 0.02 -1.26 -4.95 135.00 135.50 3g6n s PRO 122 Ca 0.03 1.79 0.00 0.00 0.02 0.00 0.00 61.00 62.84 3g6n s PRO 122 Cb -0.19 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.43 3g6n s PRO 122 CO -0.10 -1.37 0.00 0.41 -0.33 0.00 0.00 177.00 175.61 3g6n n GLY 123 N 0.43 1.75 3.46 0.52 0.00 -1.26 -4.89 105.19 105.20 3g6n n GLY 123 Ca 0.13 -2.11 -0.31 0.00 0.00 0.00 0.00 46.02 43.73 3g6n n GLY 123 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3g6n s TYR 124 N -1.44 2.60 -0.30 1.61 4.12 0.08 -4.65 117.35 119.37 3g6n s TYR 124 Ca 0.00 -0.23 -0.04 0.00 0.02 0.00 0.00 57.07 56.82 3g6n s TYR 124 Cb 0.00 -1.51 0.03 0.00 -1.52 0.00 0.00 41.96 38.96 3g6n s TYR 124 CO 0.00 0.23 0.02 0.08 0.02 0.00 0.00 175.55 175.90 3g6n s VAL 125 N -0.87 3.32 0.06 0.71 1.01 -1.26 -4.67 120.40 118.70 3g6n s VAL 125 Ca 0.14 -1.12 -0.30 0.00 0.00 0.00 0.00 61.98 60.70 3g6n s VAL 125 Cb -0.11 -2.82 -0.05 0.00 0.00 0.00 0.00 36.38 33.41 3g6n s VAL 125 CO 0.04 -0.02 1.02 -0.69 0.00 0.00 0.00 175.10 175.44 3g6n s VAL 126 N 1.35 4.56 0.31 2.92 1.01 -1.26 -4.43 120.40 124.85 3g6n s VAL 126 Ca -0.02 1.94 0.04 0.00 0.00 0.00 0.00 61.98 63.94 3g6n s VAL 126 Cb -0.19 -4.24 -0.03 0.00 0.00 0.00 0.00 36.38 31.92 3g6n s VAL 126 CO -0.00 0.21 0.20 -0.13 0.00 0.00 0.00 175.10 175.37 3g6n s ARG 127 N 0.59 1.62 0.01 2.72 0.52 0.35 -4.97 118.95 119.78 3g6n s ARG 127 Ca 0.51 -1.93 -0.30 0.00 -0.52 0.00 0.00 55.73 53.49 3g6n s ARG 127 Cb -0.24 0.07 -0.04 0.00 0.52 0.00 0.00 34.95 35.27 3g6n s ARG 127 CO 0.29 -0.52 1.06 -1.01 0.02 0.00 0.00 175.30 175.14 3g6n s HIS 128 N -3.61 3.56 0.18 -0.53 3.76 -1.26 -0.45 115.29 116.95 3g6n s HIS 128 Ca 0.37 1.55 -0.13 0.00 -0.15 0.00 0.00 55.06 56.70 3g6n s HIS 128 Cb 0.04 -3.23 0.09 0.00 1.11 0.00 0.00 32.58 30.59 3g6n s HIS 128 CO 0.20 -0.47 1.84 0.00 -0.85 0.00 0.00 174.74 175.46 3g6n h ALA 129 N 6.85 0.76 -3.96 -1.40 0.00 -1.55 -3.43 119.26 116.52 3g6n h ALA 129 Ca -0.40 -0.05 -0.58 0.00 0.00 0.00 0.00 54.91 53.88 3g6n h ALA 129 Cb 1.21 -0.24 -0.25 0.00 0.00 0.00 0.00 17.79 18.51 3g6n h ALA 129 CO 0.78 0.21 -0.84 0.15 0.00 0.00 0.00 179.25 179.55 3g6n s LYS 130 N -6.08 1.33 0.11 0.00 1.02 -1.26 -0.89 119.74 113.97 3g6n s LYS 130 Ca -0.13 -1.01 -0.07 0.00 0.02 0.00 0.00 55.97 54.78 3g6n s LYS 130 Cb 0.13 -1.49 -0.01 0.00 -0.52 0.00 0.00 37.83 35.94 3g6n s LYS 130 CO 0.76 0.37 0.19 0.96 -0.92 0.00 0.00 175.35 176.71 3g6n s ILE 131 N -0.90 0.12 -0.17 2.17 -4.36 -0.66 -1.21 121.20 116.20 3g6n s ILE 131 Ca 0.07 -1.36 0.01 0.00 -0.26 0.00 0.00 60.65 59.11 3g6n s ILE 131 Cb -0.09 -1.56 0.03 0.00 1.25 0.00 0.00 42.46 42.09 3g6n s ILE 131 CO 0.02 -0.57 -0.14 -0.89 0.24 0.00 0.00 174.94 173.60 3g6n s THR 132 N -3.91 1.70 -0.06 8.37 2.01 -0.71 -0.60 115.64 122.44 3g6n s THR 132 Ca 0.10 -0.79 0.03 0.00 0.31 0.00 0.00 61.69 61.34 3g6n s THR 132 Cb 0.05 -1.62 -0.02 0.00 0.01 0.00 0.00 72.50 70.91 3g6n s THR 132 CO -0.07 0.41 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.44 3g6n s VAL 133 N 1.42 3.09 -0.08 3.82 1.01 -0.11 -0.35 120.40 129.20 3g6n s VAL 133 Ca 0.03 -0.71 0.04 0.00 0.00 0.00 0.00 61.98 61.35 3g6n s VAL 133 Cb -0.14 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.01 3g6n s VAL 133 CO -0.11 0.58 -0.21 -0.55 0.00 0.00 0.00 175.10 174.82 3g6n s SER 134 N -0.60 3.39 0.35 3.32 0.15 -0.13 -0.94 113.70 119.24 3g6n s SER 134 Ca 0.09 -0.44 -0.17 0.00 0.70 0.00 0.00 55.95 56.13 3g6n s SER 134 Cb -0.11 -1.09 0.06 0.00 -1.71 0.00 0.00 66.02 63.17 3g6n s SER 134 CO 0.01 0.23 0.82 -0.72 1.20 0.00 0.00 173.24 174.78 3g6n s TYR 135 N -0.06 0.09 -0.06 3.44 -0.85 -0.62 -1.35 117.35 117.94 3g6n s TYR 135 Ca -0.06 -0.71 0.05 0.00 -0.52 0.00 0.00 57.07 55.83 3g6n s TYR 135 Cb -0.14 0.81 -0.02 0.00 0.38 0.00 0.00 41.96 42.99 3g6n s TYR 135 CO 0.05 -1.45 -0.20 0.71 -1.52 0.00 0.00 175.55 173.14 3g6n s TYR 136 N -2.41 2.56 0.57 -3.49 1.51 -0.65 -0.46 117.35 114.98 3g6n s TYR 136 Ca 0.16 -0.46 -0.03 0.00 -1.01 0.00 0.00 57.07 55.73 3g6n s TYR 136 Cb -0.05 -1.63 0.12 0.00 -0.11 0.00 0.00 41.96 40.30 3g6n s TYR 136 CO 0.10 -0.04 0.77 -0.40 -1.11 0.00 0.00 175.55 174.87 3g6n n ASP 137 N 2.71 0.73 0.27 2.29 5.68 -0.37 -0.71 116.55 127.15 3g6n n ASP 137 Ca -0.17 -1.69 0.14 0.00 -0.50 0.00 0.00 54.79 52.56 3g6n n ASP 137 Cb 0.52 -0.53 0.76 0.00 -1.14 0.00 0.00 41.12 40.73 3g6n n ASP 137 CO 0.00 0.00 0.00 0.24 -1.33 0.00 0.00 177.20 176.11 3g6n h MET 138 N 0.00 0.00 -0.01 0.11 2.86 -1.90 -1.89 114.93 114.11 3g6n h MET 138 Ca -0.25 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.39 3g6n h MET 138 Cb 0.86 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.52 3g6n h MET 138 CO 0.24 0.10 -0.07 0.09 1.06 0.00 0.00 176.91 178.34 3g6n n ASN 139 N -3.58 0.60 0.00 1.22 3.02 -1.26 -4.91 115.26 110.35 3g6n n ASN 139 Ca -0.02 -0.86 0.00 0.00 -0.03 0.00 0.00 54.58 53.67 3g6n n ASN 139 Cb 0.23 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 3g6n n ASN 139 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3g6n n GLY 140 N 1.20 1.25 3.77 7.41 0.00 -0.71 -5.04 105.19 113.07 3g6n n GLY 140 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 3g6n n GLY 140 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g6n s GLU 141 N -0.57 4.07 0.06 1.61 2.02 -1.26 -4.71 118.70 119.91 3g6n s GLU 141 Ca 0.00 2.19 -0.07 0.00 0.02 0.00 0.00 54.97 57.11 3g6n s GLU 141 Cb 0.00 -2.84 -0.05 0.00 0.10 0.00 0.00 34.13 31.34 3g6n s GLU 141 CO 0.00 -0.42 0.33 0.21 0.02 0.00 0.00 175.26 175.40 3g6n s LYS 142 N -2.13 3.63 0.08 1.61 2.20 -1.26 -1.24 119.74 122.63 3g6n s LYS 142 Ca 0.55 -0.02 0.02 0.00 -0.36 0.00 0.00 55.97 56.15 3g6n s LYS 142 Cb -0.39 -3.00 -0.04 0.00 -1.51 0.00 0.00 37.83 32.89 3g6n s LYS 142 CO 0.50 0.58 -0.07 -1.01 -0.36 0.00 0.00 175.35 175.00 3g6n s HIS 143 N -1.41 0.80 -0.18 4.03 3.76 0.40 -4.98 115.29 117.70 3g6n s HIS 143 Ca 0.32 -0.77 -0.04 0.00 -0.15 0.00 0.00 55.06 54.42 3g6n s HIS 143 Cb -0.13 -0.47 0.08 0.00 1.11 0.00 0.00 32.58 33.17 3g6n s HIS 143 CO 0.19 -0.13 0.16 0.21 -0.85 0.00 0.00 174.74 174.32 3g6n s LYS 144 N -3.00 0.13 0.08 1.40 2.20 -1.25 -1.59 119.74 117.70 3g6n s LYS 144 Ca 0.04 0.12 0.07 0.00 -0.36 0.00 0.00 55.97 55.84 3g6n s LYS 144 Cb -0.00 -1.37 -0.03 0.00 -1.51 0.00 0.00 37.83 34.91 3g6n s LYS 144 CO -0.03 -0.63 -0.19 0.96 -0.36 0.00 0.00 175.35 175.10 3g6n s ILE 145 N 2.25 1.56 -0.18 5.43 -4.36 -0.12 -4.95 121.20 120.83 3g6n s ILE 145 Ca 0.05 -1.39 -0.11 0.00 -0.26 0.00 0.00 60.65 58.94 3g6n s ILE 145 Cb -0.16 -1.41 -0.05 0.00 1.25 0.00 0.00 42.46 42.10 3g6n s ILE 145 CO -0.10 -0.02 0.19 -0.13 0.24 0.00 0.00 174.94 175.12 3g6n s ARG 146 N -1.66 4.19 0.24 0.37 1.81 -1.26 -0.94 118.95 121.70 3g6n s ARG 146 Ca 0.05 -0.09 0.08 0.00 -1.72 0.00 0.00 55.73 54.04 3g6n s ARG 146 Cb -0.10 -3.41 -0.05 0.00 -0.45 0.00 0.00 34.95 30.94 3g6n s ARG 146 CO 0.03 0.29 -0.11 -0.51 -0.68 0.00 0.00 175.30 174.32 3g6n s LEU 147 N 0.35 2.52 0.15 2.53 1.43 0.23 -5.00 118.68 120.90 3g6n s LEU 147 Ca 0.12 -1.09 -0.17 0.00 -1.03 0.00 0.00 54.13 51.96 3g6n s LEU 147 Cb -0.12 -0.68 0.03 0.00 0.03 0.00 0.00 46.19 45.45 3g6n s LEU 147 CO 0.01 -0.23 0.44 -1.59 0.23 0.00 0.00 176.35 175.21 3g6n s LYS 148 N -3.67 1.17 5.36 1.70 -2.85 -1.26 -1.66 119.74 118.53 3g6n s LYS 148 Ca 0.26 -0.76 0.00 0.00 -1.00 0.00 0.00 55.97 54.47 3g6n s LYS 148 Cb 0.01 0.49 0.00 0.00 -2.06 0.00 0.00 37.83 36.26 3g6n s LYS 148 CO 0.09 -0.47 0.00 0.09 0.10 0.00 0.00 175.35 175.16 3g6n n ASN 149 N -0.27 0.00 0.08 0.03 5.03 -0.07 -2.89 115.26 117.18 3g6n n ASN 149 Ca -0.14 0.00 -0.12 0.00 0.87 0.00 0.00 54.58 55.19 3g6n n ASN 149 Cb 0.63 0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 39.34 3g6n n ASN 149 CO 0.00 0.00 0.00 0.22 -1.83 0.00 0.00 177.26 175.65 3g6n h TYR 150 N 0.00 -0.53 -0.73 3.10 3.20 -1.99 -0.14 116.97 119.89 3g6n h TYR 150 Ca 0.00 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.91 3g6n h TYR 150 Cb 0.00 0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.46 3g6n h TYR 150 CO 0.00 -0.29 0.48 0.93 -1.64 0.00 0.00 178.16 177.64 3g6n h GLU 151 N -0.35 0.90 -0.59 1.82 5.08 -1.94 0.10 114.58 119.59 3g6n h GLU 151 Ca 0.04 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 3g6n h GLU 151 Cb 0.40 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 3g6n h GLU 151 CO -0.15 0.59 0.05 1.03 -1.00 0.00 0.00 179.01 179.54 3g6n h SER 152 N 0.92 0.97 -0.35 1.42 0.87 -1.31 -1.80 113.55 114.28 3g6n h SER 152 Ca 0.28 -0.28 -0.05 0.00 -1.23 0.00 0.00 61.79 60.51 3g6n h SER 152 Cb -0.00 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.68 3g6n h SER 152 CO -0.07 1.01 0.03 0.40 -0.53 0.00 0.00 176.83 177.67 3g6n h ILE 153 N 0.90 1.25 0.27 2.23 2.04 0.08 -1.36 117.51 122.92 3g6n h ILE 153 Ca 0.17 -0.90 -0.00 0.00 1.00 0.00 0.00 64.86 65.13 3g6n h ILE 153 Cb 0.49 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 3g6n h ILE 153 CO 0.02 0.30 -0.21 0.58 0.00 0.00 0.00 178.15 178.84 3g6n h VAL 154 N 0.42 0.55 -0.94 1.67 2.07 -0.66 0.85 116.25 120.20 3g6n h VAL 154 Ca 0.10 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.69 3g6n h VAL 154 Cb 0.40 0.55 -0.06 0.00 -1.52 0.00 0.00 31.29 30.66 3g6n h VAL 154 CO 0.01 0.00 0.61 0.58 0.02 0.00 0.00 177.57 178.79 3g6n h VAL 155 N -0.49 1.08 -0.45 2.57 2.07 -1.31 -0.03 116.25 119.68 3g6n h VAL 155 Ca -0.02 -0.38 -0.09 0.00 0.82 0.00 0.00 66.70 67.04 3g6n h VAL 155 Cb 0.43 -0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 3g6n h VAL 155 CO -0.01 0.20 -0.07 1.56 0.02 0.00 0.00 177.57 179.26 3g6n h GLN 156 N 1.09 0.79 -0.56 1.57 4.20 -0.79 0.70 115.11 122.12 3g6n h GLN 156 Ca 0.40 -0.25 -0.10 0.00 0.06 0.00 0.00 58.65 58.76 3g6n h GLN 156 Cb 0.17 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 3g6n h GLN 156 CO -0.15 0.85 -0.05 1.25 -0.67 0.00 0.00 178.83 180.06 3g6n h HIS 157 N 0.72 1.13 -0.22 2.96 2.76 0.45 -2.21 115.15 120.75 3g6n h HIS 157 Ca 0.13 -0.21 -0.13 0.00 -2.20 0.00 0.00 60.37 57.96 3g6n h HIS 157 Cb 0.55 -0.29 -0.00 0.00 1.55 0.00 0.00 27.41 29.22 3g6n h HIS 157 CO 0.03 1.03 -0.35 0.93 -1.30 0.00 0.00 177.93 178.27 3g6n h GLU 158 N 0.91 0.63 -0.26 5.26 4.39 -0.67 -3.06 114.58 121.78 3g6n h GLU 158 Ca 0.15 -0.38 -0.05 0.00 0.34 0.00 0.00 59.36 59.42 3g6n h GLU 158 Cb 0.61 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.28 3g6n h GLU 158 CO 0.04 0.99 -0.05 0.82 -1.16 0.00 0.00 179.01 179.65 3g6n h ILE 159 N 0.33 1.19 -0.88 3.13 2.04 -0.87 -1.12 117.51 121.33 3g6n h ILE 159 Ca 0.02 -0.76 0.08 0.00 1.00 0.00 0.00 64.86 65.19 3g6n h ILE 159 Cb 0.94 1.04 -0.06 0.00 -0.74 0.00 0.00 36.82 38.00 3g6n h ILE 159 CO 0.08 0.25 0.57 0.44 0.00 0.00 0.00 178.15 179.49 3g6n h ASP 160 N 0.39 0.84 -0.60 1.72 3.32 -1.32 -1.83 116.42 118.94 3g6n h ASP 160 Ca 0.08 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.17 3g6n h ASP 160 Cb 0.34 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.68 3g6n h ASP 160 CO 0.01 0.52 0.37 0.45 -1.72 0.00 0.00 179.24 178.88 3g6n h HIS 161 N 0.94 0.70 0.00 4.55 3.86 -1.10 0.11 115.15 124.20 3g6n h HIS 161 Ca 0.39 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.62 3g6n h HIS 161 Cb 0.28 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.52 3g6n h HIS 161 CO -0.00 0.40 0.00 0.44 0.86 0.00 0.00 177.93 179.63 3g6n n ILE 162 N -4.73 0.37 -0.33 2.45 -5.35 -0.71 -1.72 119.36 109.34 3g6n n ILE 162 Ca 0.05 0.09 0.06 0.00 -0.27 0.00 0.00 62.75 62.68 3g6n n ILE 162 Cb 0.08 -0.78 0.15 0.00 -1.74 0.00 0.00 39.64 37.34 3g6n n ILE 162 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3g6n n ASN 163 N -1.25 2.97 -0.89 7.28 3.02 -0.49 -0.17 115.26 125.74 3g6n n ASN 163 Ca 0.10 -2.22 -0.09 0.00 -0.03 0.00 0.00 54.58 52.34 3g6n n ASN 163 Cb 0.14 -0.27 -0.02 0.00 -0.61 0.00 0.00 39.78 39.02 3g6n n ASN 163 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3g6n n GLY 164 N 0.14 0.44 3.42 7.41 0.00 -0.70 -4.60 105.19 111.30 3g6n n GLY 164 Ca 0.12 -0.56 -0.33 0.00 0.00 0.00 0.00 46.02 45.25 3g6n n GLY 164 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g6n s VAL 165 N -2.40 3.34 0.17 1.61 1.01 0.26 -4.50 120.40 119.89 3g6n s VAL 165 Ca 0.00 -0.56 -0.02 0.00 0.00 0.00 0.00 61.98 61.41 3g6n s VAL 165 Cb 0.00 -2.43 -0.05 0.00 0.00 0.00 0.00 36.38 33.91 3g6n s VAL 165 CO 0.00 0.51 0.36 -0.04 0.00 0.00 0.00 175.10 175.94 3g6n s MET 166 N 0.34 3.53 0.40 2.72 -1.94 -1.26 -3.56 119.30 119.53 3g6n s MET 166 Ca -0.08 -0.30 0.08 0.00 -1.71 0.00 0.00 55.69 53.68 3g6n s MET 166 Cb -0.15 -2.87 0.86 0.00 2.01 0.00 0.00 34.83 34.68 3g6n s MET 166 CO 0.05 0.45 2.03 0.27 -0.01 0.00 0.00 175.02 177.81 3g6n h PHE 167 N 2.35 0.55 0.00 -0.03 -5.15 -1.97 -1.68 116.94 111.00 3g6n h PHE 167 Ca -0.47 0.01 0.00 0.00 -0.20 0.00 0.00 57.97 57.31 3g6n h PHE 167 Cb 1.18 -0.18 0.00 0.00 0.22 0.00 0.00 35.95 37.17 3g6n h PHE 167 CO 0.57 0.33 0.00 2.48 -2.00 0.00 0.00 178.31 179.69 3g6n n TYR 168 N -4.47 0.85 0.32 6.09 0.18 -1.26 -2.09 117.16 116.78 3g6n n TYR 168 Ca 0.05 0.32 0.21 0.00 1.88 0.00 0.00 57.90 60.37 3g6n n TYR 168 Cb 0.13 -1.02 1.07 0.00 -0.38 0.00 0.00 39.34 39.13 3g6n n TYR 168 CO 0.00 0.00 0.00 -0.44 -2.08 0.00 0.00 176.86 174.34 3g6n h ASP 169 N 0.00 0.00 0.44 9.48 3.32 -1.71 0.36 116.42 128.31 3g6n h ASP 169 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3g6n h ASP 169 Cb 0.41 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.96 3g6n h ASP 169 CO 0.00 0.00 -0.42 1.41 -1.72 0.00 0.00 179.24 178.51 3g6n n HIS 170 N -3.06 0.00 -3.40 4.55 8.25 -0.89 -4.84 115.22 115.83 3g6n n HIS 170 Ca -0.02 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.04 3g6n n HIS 170 Cb 0.13 -0.22 -0.09 0.00 1.12 0.00 0.00 29.99 30.93 3g6n n HIS 170 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3g6n s ILE 171 N -2.86 5.17 -0.35 1.59 1.01 0.11 -4.75 121.20 121.12 3g6n s ILE 171 Ca 0.15 0.18 -0.28 0.00 0.00 0.00 0.00 60.65 60.70 3g6n s ILE 171 Cb 0.18 -3.79 -0.03 0.00 0.01 0.00 0.00 42.46 38.84 3g6n s ILE 171 CO 0.65 -0.03 1.89 0.21 0.00 0.00 0.00 174.94 177.66 3g6n s ASN 172 N 1.72 5.70 0.56 3.58 3.84 -1.26 -4.85 114.94 124.22 3g6n s ASN 172 Ca 0.13 1.28 0.27 0.00 0.21 0.00 0.00 52.86 54.74 3g6n s ASN 172 Cb -0.16 -2.52 1.50 0.00 -0.55 0.00 0.00 41.25 39.51 3g6n s ASN 172 CO 0.11 -1.87 2.02 -0.78 -2.79 0.00 0.00 177.10 173.79 3g6n h ASP 173 N 13.72 0.00 0.29 -4.21 1.82 -1.95 -0.21 116.42 125.88 3g6n h ASP 173 Ca -0.33 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.31 3g6n h ASP 173 Cb 1.18 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.19 3g6n h ASP 173 CO 1.05 0.00 -1.42 0.00 -1.61 0.00 0.00 179.24 177.25 3g6n n GLN 174 N -4.05 0.46 -3.19 0.28 6.02 -1.26 -4.44 117.38 111.20 3g6n n GLN 174 Ca 0.06 -0.06 -0.22 0.00 -0.01 0.00 0.00 57.00 56.76 3g6n n GLN 174 Cb 0.49 -1.59 -0.05 0.00 1.02 0.00 0.00 30.24 30.11 3g6n n GLN 174 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 3g6n n ASN 175 N -2.14 1.14 -0.27 1.08 2.85 -0.73 -5.00 115.26 112.19 3g6n n ASN 175 Ca -0.01 -2.97 0.17 0.00 -0.11 0.00 0.00 54.58 51.66 3g6n n ASN 175 Cb 0.50 -0.63 0.45 0.00 1.24 0.00 0.00 39.78 41.34 3g6n n ASN 175 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3g6n h PRO 176 N 3.53 0.52 -0.42 1.20 0.11 -1.28 -2.69 132.00 132.97 3g6n h PRO 176 Ca 0.10 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.09 3g6n h PRO 176 Cb 0.86 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 31.80 3g6n h PRO 176 CO 0.54 0.34 0.06 1.19 -0.21 0.00 0.00 178.00 179.92 3g6n n PHE 177 N -4.57 1.44 -1.77 0.65 3.72 -1.26 -0.74 117.46 114.93 3g6n n PHE 177 Ca 0.20 -1.09 -0.42 0.00 -0.05 0.00 0.00 57.45 56.09 3g6n n PHE 177 Cb 0.64 -0.46 -0.03 0.00 -0.94 0.00 0.00 39.48 38.69 3g6n n PHE 177 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3g6n s ALA 178 N -2.95 3.88 -0.04 4.37 0.00 -1.01 -4.88 121.76 121.12 3g6n s ALA 178 Ca 0.47 1.52 -0.01 0.00 0.00 0.00 0.00 51.96 53.93 3g6n s ALA 178 Cb 0.39 -3.69 0.03 0.00 0.00 0.00 0.00 23.12 19.85 3g6n s ALA 178 CO 0.09 -0.94 0.09 -0.51 0.00 0.00 0.00 175.76 174.49 3g6n s LEU 179 N 1.40 0.87 1.14 0.00 1.43 -1.26 -4.90 118.68 117.36 3g6n s LEU 179 Ca 0.75 0.17 -0.17 0.00 -1.03 0.00 0.00 54.13 53.84 3g6n s LEU 179 Cb -0.48 0.14 0.26 0.00 0.03 0.00 0.00 46.19 46.14 3g6n s LEU 179 CO 0.32 -0.14 1.12 -0.54 0.23 0.00 0.00 176.35 177.35 3g6n s LYS 180 N 1.15 -0.70 0.21 1.70 -0.14 -1.26 -4.95 119.74 115.75 3g6n s LYS 180 Ca -0.09 0.02 -0.30 0.00 -1.36 0.00 0.00 55.97 54.24 3g6n s LYS 180 Cb -0.12 -1.65 -0.09 0.00 -1.68 0.00 0.00 37.83 34.29 3g6n s LYS 180 CO -0.04 -3.38 1.26 -2.00 -0.76 0.00 0.00 175.35 170.43 3g6n s GLU 181 N -5.36 4.43 0.00 1.68 2.12 -1.26 -3.60 118.70 116.71 3g6n s GLU 181 Ca 0.70 1.99 0.00 0.00 0.36 0.00 0.00 54.97 58.02 3g6n s GLU 181 Cb -0.11 -3.20 0.00 0.00 0.26 0.00 0.00 34.13 31.08 3g6n s GLU 181 CO 0.56 -0.18 0.00 0.41 -0.54 0.00 0.00 175.26 175.51 3g6n n GLY 182 N 2.16 0.51 3.73 -1.50 0.00 -1.26 -5.01 105.19 103.83 3g6n n GLY 182 Ca 0.05 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 3g6n n GLY 182 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g6n s VAL 183 N -2.00 3.87 -0.23 1.61 1.01 -1.24 -4.59 120.40 118.84 3g6n s VAL 183 Ca 0.00 1.57 -0.22 0.00 0.00 0.00 0.00 61.98 63.33 3g6n s VAL 183 Cb 0.00 -4.00 -0.02 0.00 0.00 0.00 0.00 36.38 32.36 3g6n s VAL 183 CO 0.00 0.25 0.70 -0.22 0.00 0.00 0.00 175.10 175.83 3g6n s LEU 184 N -0.16 4.09 -0.23 3.92 2.96 -0.51 -4.95 118.68 123.81 3g6n s LEU 184 Ca 0.51 0.87 -0.09 0.00 -0.22 0.00 0.00 54.13 55.19 3g6n s LEU 184 Cb -0.30 -2.99 -0.04 0.00 0.50 0.00 0.00 46.19 43.36 3g6n s LEU 184 CO 0.34 -0.39 0.12 0.68 -1.32 0.00 0.00 176.35 175.78 3g6n s VAL 185 N 2.43 5.05 -0.19 1.68 -7.23 -1.26 -0.86 120.40 120.01 3g6n s VAL 185 Ca 0.30 0.07 -0.11 0.00 -1.81 0.00 0.00 61.98 60.43 3g6n s VAL 185 Cb -0.16 -3.33 -0.05 0.00 0.56 0.00 0.00 36.38 33.40 3g6n s VAL 185 CO 0.09 0.37 0.17 -0.63 -0.31 0.00 0.00 175.10 174.79 3g6n s ILE 186 N 0.96 5.38 0.00 -0.62 1.01 0.81 -4.83 121.20 123.92 3g6n s ILE 186 Ca 0.06 0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.98 3g6n s ILE 186 Cb -0.13 -3.51 0.00 0.00 0.01 0.00 0.00 42.46 38.83 3g6n s ILE 186 CO 0.03 0.42 0.00 -1.84 0.00 0.00 0.00 174.94 173.55