#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mnu s ILE 2 N 0.00 4.15 -0.16 0.53 1.10 -1.26 -5.01 121.20 120.55 1mnu s ILE 2 Ca 0.00 1.51 -0.12 0.00 -0.51 0.00 0.00 60.65 61.53 1mnu s ILE 2 Cb 0.00 -3.97 -0.05 0.00 0.15 0.00 0.00 42.46 38.59 1mnu s ILE 2 CO 0.00 0.04 0.25 -0.69 -2.11 0.00 0.00 174.94 172.43 1mnu s VAL 3 N 1.87 5.33 -0.19 4.00 1.01 -1.26 -4.74 120.40 126.42 1mnu s VAL 3 Ca 0.57 0.46 -0.05 0.00 0.00 0.00 0.00 61.98 62.96 1mnu s VAL 3 Cb -0.27 -3.58 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 1mnu s VAL 3 CO 0.25 0.43 0.00 -0.04 0.00 0.00 0.00 175.10 175.73 1mnu s MET 4 N 0.26 3.67 -0.28 2.72 1.00 -1.26 -0.77 119.30 124.63 1mnu s MET 4 Ca 0.15 -0.50 -0.04 0.00 0.00 0.00 0.00 55.69 55.29 1mnu s MET 4 Cb -0.13 -3.07 0.02 0.00 0.00 0.00 0.00 34.83 31.66 1mnu s MET 4 CO 0.03 0.08 0.02 0.99 0.00 0.00 0.00 175.02 176.14 1mnu s THR 5 N 0.83 3.44 0.05 2.05 2.01 0.85 -4.00 115.64 120.86 1mnu s THR 5 Ca 0.01 -0.92 -0.01 0.00 0.31 0.00 0.00 61.69 61.07 1mnu s THR 5 Cb -0.14 -2.80 -0.04 0.00 0.01 0.00 0.00 72.50 69.53 1mnu s THR 5 CO 0.02 0.09 0.21 -1.10 -0.69 0.00 0.00 174.62 173.15 1mnu s GLN 6 N 1.40 3.45 -0.09 4.92 -0.21 -1.26 -1.35 119.66 126.52 1mnu s GLN 6 Ca 0.01 -0.39 -0.15 0.00 0.02 0.00 0.00 55.36 54.85 1mnu s GLN 6 Cb -0.17 -3.05 0.03 0.00 1.00 0.00 0.00 33.01 30.82 1mnu s GLN 6 CO -0.01 0.62 0.38 0.95 -2.12 0.00 0.00 175.29 175.11 1mnu s THR 7 N -1.47 0.02 0.28 -0.19 -4.23 -0.61 -4.67 115.64 104.78 1mnu s THR 7 Ca 0.33 -0.20 -0.05 0.00 -1.18 0.00 0.00 61.69 60.60 1mnu s THR 7 Cb -0.13 -0.61 0.07 0.00 1.34 0.00 0.00 72.50 73.17 1mnu s THR 7 CO 0.25 -0.11 0.37 -0.81 -0.54 0.00 0.00 174.62 173.79 1mnu n PRO 8 N 2.08 -0.44 0.02 3.99 -0.04 -1.26 -0.36 135.00 138.99 1mnu n PRO 8 Ca -0.17 -0.58 -0.20 0.00 -0.04 0.00 0.00 63.50 62.51 1mnu n PRO 8 Cb 0.57 -0.39 -0.14 0.00 -0.04 0.00 0.00 33.50 33.49 1mnu n PRO 8 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1mnu h LEU 9 N 0.00 0.38 -8.67 1.53 5.85 -1.85 -3.42 115.31 109.13 1mnu h LEU 9 Ca -0.12 -0.90 -0.62 0.00 0.84 0.00 0.00 57.88 57.08 1mnu h LEU 9 Cb 0.34 -0.12 -0.25 0.00 0.37 0.00 0.00 40.66 41.00 1mnu h LEU 9 CO 0.09 1.46 -0.85 -0.55 -0.34 0.00 0.00 178.44 178.24 1mnu s SER 10 N -6.93 2.79 -0.31 1.25 0.15 -1.26 -1.45 113.70 107.92 1mnu s SER 10 Ca -0.17 -0.60 -0.02 0.00 0.70 0.00 0.00 55.95 55.86 1mnu s SER 10 Cb 0.02 -0.22 0.11 0.00 -1.71 0.00 0.00 66.02 64.22 1mnu s SER 10 CO 0.78 0.17 0.15 -0.22 1.20 0.00 0.00 173.24 175.33 1mnu s LEU 11 N -1.42 1.01 -0.06 3.45 2.96 0.88 -4.91 118.68 120.59 1mnu s LEU 11 Ca 0.09 -1.62 -0.30 0.00 -0.22 0.00 0.00 54.13 52.08 1mnu s LEU 11 Cb -0.09 -0.47 -0.03 0.00 0.50 0.00 0.00 46.19 46.09 1mnu s LEU 11 CO 0.03 -0.40 1.13 -2.84 -1.32 0.00 0.00 176.35 172.96 1mnu s PRO 12 N 1.70 4.39 -0.03 0.98 0.02 -1.26 -1.03 135.00 139.78 1mnu s PRO 12 Ca 0.12 1.59 -0.00 0.00 0.02 0.00 0.00 61.00 62.72 1mnu s PRO 12 Cb -0.18 -3.53 0.03 0.00 0.02 0.00 0.00 34.50 30.84 1mnu s PRO 12 CO -0.24 -0.37 0.04 0.08 -0.33 0.00 0.00 177.00 176.18 1mnu s VAL 13 N 1.98 -0.06 0.69 3.83 1.01 0.51 -4.89 120.40 123.48 1mnu s VAL 13 Ca 0.54 0.21 -0.15 0.00 0.00 0.00 0.00 61.98 62.59 1mnu s VAL 13 Cb -0.23 -0.10 0.02 0.00 0.00 0.00 0.00 36.38 36.07 1mnu s VAL 13 CO 0.22 0.09 1.14 -0.44 0.00 0.00 0.00 175.10 176.11 1mnu s SER 14 N 1.09 4.74 0.42 3.32 0.01 -1.26 -1.62 113.70 120.40 1mnu s SER 14 Ca -0.09 2.12 -0.26 0.00 1.31 0.00 0.00 55.95 59.03 1mnu s SER 14 Cb -0.13 -2.56 -0.08 0.00 0.21 0.00 0.00 66.02 63.45 1mnu s SER 14 CO -0.03 -1.88 1.34 -0.22 0.41 0.00 0.00 173.24 172.85 1mnu s LEU 15 N -5.02 4.17 0.00 2.44 2.96 -1.26 -2.31 118.68 119.66 1mnu s LEU 15 Ca 0.69 2.73 0.00 0.00 -0.22 0.00 0.00 54.13 57.33 1mnu s LEU 15 Cb -0.23 -3.93 0.00 0.00 0.50 0.00 0.00 46.19 42.53 1mnu s LEU 15 CO 0.43 -0.96 0.00 0.61 -1.32 0.00 0.00 176.35 175.11 1mnu n GLY 16 N 0.63 2.75 3.99 7.98 0.00 0.34 -4.94 105.19 115.94 1mnu n GLY 16 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 1mnu n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1mnu s ASP 17 N -3.11 3.89 0.06 1.61 1.11 -0.98 -4.45 116.67 114.80 1mnu s ASP 17 Ca 0.00 -0.37 0.01 0.00 0.18 0.00 0.00 52.55 52.37 1mnu s ASP 17 Cb 0.00 0.17 -0.04 0.00 1.07 0.00 0.00 42.92 44.12 1mnu s ASP 17 CO 0.00 -2.19 0.18 -0.75 1.18 0.00 0.00 175.17 173.59 1mnu s LYS 18 N -5.35 3.31 -0.03 8.23 2.20 -1.23 -0.75 119.74 126.12 1mnu s LYS 18 Ca 0.70 -0.49 0.03 0.00 -0.36 0.00 0.00 55.97 55.85 1mnu s LYS 18 Cb -0.04 -2.97 0.00 0.00 -1.51 0.00 0.00 37.83 33.31 1mnu s LYS 18 CO 0.47 0.60 -0.11 0.00 -0.36 0.00 0.00 175.35 175.96 1mnu s ALA 19 N -1.47 1.00 -0.10 3.13 0.00 -0.18 -4.96 121.76 119.18 1mnu s ALA 19 Ca 0.33 -0.42 0.03 0.00 0.00 0.00 0.00 51.96 51.90 1mnu s ALA 19 Cb -0.13 -0.35 0.01 0.00 0.00 0.00 0.00 23.12 22.65 1mnu s ALA 19 CO 0.26 0.18 -0.19 -1.12 0.00 0.00 0.00 175.76 174.88 1mnu s SER 20 N 0.11 2.63 -0.14 0.00 0.01 -1.26 -1.20 113.70 113.86 1mnu s SER 20 Ca -0.02 -0.47 0.01 0.00 1.31 0.00 0.00 55.95 56.78 1mnu s SER 20 Cb -0.09 -1.20 -0.00 0.00 0.21 0.00 0.00 66.02 64.94 1mnu s SER 20 CO 0.01 0.09 -0.18 -0.63 0.41 0.00 0.00 173.24 172.94 1mnu s ILE 21 N 0.58 2.45 0.07 1.44 1.01 -0.57 -4.71 121.20 121.47 1mnu s ILE 21 Ca -0.15 -0.86 -0.01 0.00 0.00 0.00 0.00 60.65 59.64 1mnu s ILE 21 Cb -0.17 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.26 1mnu s ILE 21 CO 0.05 0.53 0.24 -0.55 0.00 0.00 0.00 174.94 175.21 1mnu s SER 22 N 0.67 6.39 -0.15 3.58 0.15 0.52 -1.25 113.70 123.60 1mnu s SER 22 Ca -0.09 0.34 -0.07 0.00 0.70 0.00 0.00 55.95 56.83 1mnu s SER 22 Cb -0.16 -1.99 0.07 0.00 -1.71 0.00 0.00 66.02 62.23 1mnu s SER 22 CO 0.02 0.16 0.34 0.00 1.20 0.00 0.00 173.24 174.96 1mnu s ARG 24 N 1.92 1.72 0.14 0.00 1.81 -0.46 -1.26 118.95 122.82 1mnu s ARG 24 Ca -0.05 -1.24 0.10 0.00 -1.72 0.00 0.00 55.73 52.82 1mnu s ARG 24 Cb -0.11 -2.06 -0.04 0.00 -0.45 0.00 0.00 34.95 32.29 1mnu s ARG 24 CO -0.11 0.46 -0.22 -1.54 -0.68 0.00 0.00 175.30 173.22 1mnu s SER 25 N -2.23 3.61 0.30 0.23 1.04 -0.84 -0.11 113.70 115.70 1mnu s SER 25 Ca 0.18 -0.68 0.24 0.00 0.48 0.00 0.00 55.95 56.17 1mnu s SER 25 Cb -0.10 -0.38 1.06 0.00 0.10 0.00 0.00 66.02 66.70 1mnu s SER 25 CO 0.10 0.16 1.74 0.77 0.98 0.00 0.00 173.24 176.99 1mnu h SER 26 N 3.65 0.00 -5.07 7.02 4.64 -1.31 -3.45 113.55 119.04 1mnu h SER 26 Ca -0.50 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.75 1mnu h SER 26 Cb 1.18 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.12 1mnu h SER 26 CO 0.44 0.00 -0.16 0.00 -0.87 0.00 0.00 176.83 176.24 1mnu s GLN 27 N -3.39 0.93 0.22 4.77 -2.07 -1.26 -4.97 119.66 113.89 1mnu s GLN 27 Ca 0.03 -0.57 -0.31 0.00 -1.82 0.00 0.00 55.36 52.69 1mnu s GLN 27 Cb 0.09 0.41 -0.15 0.00 -1.09 0.00 0.00 33.01 32.27 1mnu s GLN 27 CO 0.38 -0.33 1.16 0.00 -1.32 0.00 0.00 175.29 175.18 1mnu n ALA 28 N 0.23 -0.29 0.47 2.60 0.00 -1.26 -4.81 120.51 117.44 1mnu n ALA 28 Ca -0.17 0.43 0.11 0.00 0.00 0.00 0.00 53.44 53.81 1mnu n ALA 28 Cb 0.61 -2.07 0.17 0.00 0.00 0.00 0.00 19.45 18.17 1mnu n ALA 28 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1mnu n LEU 29 N 1.80 3.23 -4.62 0.00 4.77 -0.47 -4.90 117.00 116.81 1mnu n LEU 29 Ca 0.13 -1.36 -0.43 0.00 -0.03 0.00 0.00 56.01 54.32 1mnu n LEU 29 Cb 0.28 -0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.18 1mnu n LEU 29 CO 0.61 0.66 1.12 -0.69 -1.33 0.00 0.00 177.39 177.76 1mnu s VAL 30 N -1.55 4.12 0.74 4.08 1.01 -1.26 -3.80 120.40 123.74 1mnu s VAL 30 Ca 0.34 1.21 -0.12 0.00 0.00 0.00 0.00 61.98 63.40 1mnu s VAL 30 Cb 0.21 -4.30 0.04 0.00 0.00 0.00 0.00 36.38 32.33 1mnu s VAL 30 CO 0.29 -0.68 1.11 -2.28 0.00 0.00 0.00 175.10 173.54 1mnu s HIS 31 N 4.64 2.47 0.39 5.22 2.46 0.25 -4.88 115.29 125.84 1mnu s HIS 31 Ca 0.55 1.58 0.07 0.00 0.47 0.00 0.00 55.06 57.72 1mnu s HIS 31 Cb -0.13 -3.14 0.81 0.00 -0.13 0.00 0.00 32.58 29.99 1mnu s HIS 31 CO 0.27 -1.91 2.02 0.66 -2.47 0.00 0.00 174.74 173.32 1mnu h SER 32 N -0.75 0.55 0.07 9.88 4.64 -1.94 0.18 113.55 126.18 1mnu h SER 32 Ca -0.45 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1mnu h SER 32 Cb 1.24 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1mnu h SER 32 CO 0.51 0.38 0.00 -0.46 -0.87 0.00 0.00 176.83 176.39 1mnu n ASN 33 N -4.47 0.00 0.00 4.97 0.23 -1.26 -4.84 115.26 109.90 1mnu n ASN 33 Ca 0.06 -0.33 0.00 0.00 -0.53 0.00 0.00 54.58 53.78 1mnu n ASN 33 Cb 0.12 -0.08 0.00 0.00 -2.08 0.00 0.00 39.78 37.74 1mnu n ASN 33 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1mnu n GLY 34 N -0.05 0.55 3.93 4.83 0.00 0.62 -5.07 105.19 110.00 1mnu n GLY 34 Ca 0.10 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.87 1mnu n GLY 34 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mnu s ASN 35 N -2.41 6.01 -0.30 1.61 0.01 -1.26 -4.75 114.94 113.85 1mnu s ASN 35 Ca 0.00 0.64 0.02 0.00 -0.71 0.00 0.00 52.86 52.81 1mnu s ASN 35 Cb 0.00 -1.91 0.09 0.00 0.41 0.00 0.00 41.25 39.84 1mnu s ASN 35 CO 0.00 -0.67 0.01 -0.89 -1.51 0.00 0.00 177.10 174.04 1mnu s THR 36 N -2.68 1.85 -1.30 1.60 2.01 -1.26 0.88 115.64 116.74 1mnu s THR 36 Ca 0.48 -1.82 -0.13 0.00 0.31 0.00 0.00 61.69 60.53 1mnu s THR 36 Cb -0.10 -2.25 0.13 0.00 0.01 0.00 0.00 72.50 70.29 1mnu s THR 36 CO 0.42 -0.42 1.79 -1.22 -0.69 0.00 0.00 174.62 174.50 1mnu n TYR 37 N 4.48 3.92 -4.19 4.92 4.02 -1.25 -3.92 117.16 125.15 1mnu n TYR 37 Ca -0.03 -3.00 -0.32 0.00 -0.01 0.00 0.00 57.90 54.53 1mnu n TYR 37 Cb 0.42 -2.24 -0.16 0.00 -0.02 0.00 0.00 39.34 37.35 1mnu n TYR 37 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1mnu s LEU 38 N 1.47 2.03 0.34 7.72 2.96 -1.26 -1.88 118.68 130.06 1mnu s LEU 38 Ca 0.44 -0.61 0.06 0.00 -0.22 0.00 0.00 54.13 53.81 1mnu s LEU 38 Cb 0.06 -1.41 -0.07 0.00 0.50 0.00 0.00 46.19 45.28 1mnu s LEU 38 CO -0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.35 174.03 1mnu s HIS 39 N 1.25 2.18 -0.09 5.38 3.76 0.64 -0.33 115.29 128.09 1mnu s HIS 39 Ca 0.03 -0.76 0.02 0.00 -0.15 0.00 0.00 55.06 54.19 1mnu s HIS 39 Cb -0.13 -1.42 0.02 0.00 1.11 0.00 0.00 32.58 32.15 1mnu s HIS 39 CO -0.11 0.26 -0.13 -1.58 -0.85 0.00 0.00 174.74 172.34 1mnu s TRP 40 N -2.98 1.65 0.23 1.40 0.52 0.44 0.21 118.94 120.41 1mnu s TRP 40 Ca 0.34 -0.71 0.10 0.00 0.02 0.00 0.00 56.10 55.85 1mnu s TRP 40 Cb 0.07 -1.22 -0.04 0.00 -1.15 0.00 0.00 33.47 31.13 1mnu s TRP 40 CO 0.16 -0.39 -0.08 0.71 0.02 0.00 0.00 176.95 177.36 1mnu s TYR 41 N 0.96 2.58 -0.07 -1.98 2.02 0.83 0.17 117.35 121.86 1mnu s TYR 41 Ca -0.08 -0.25 -0.00 0.00 -0.37 0.00 0.00 57.07 56.36 1mnu s TYR 41 Cb -0.15 -1.19 0.03 0.00 -0.40 0.00 0.00 41.96 40.25 1mnu s TYR 41 CO -0.00 0.59 -0.03 -1.17 -1.57 0.00 0.00 175.55 173.37 1mnu s LEU 42 N -3.28 0.92 -0.31 -1.29 1.98 -0.16 -0.94 118.68 115.61 1mnu s LEU 42 Ca 0.28 -0.14 -0.04 0.00 -2.89 0.00 0.00 54.13 51.34 1mnu s LEU 42 Cb -0.07 -0.52 0.04 0.00 0.66 0.00 0.00 46.19 46.30 1mnu s LEU 42 CO 0.17 -0.14 0.03 -1.58 -1.89 0.00 0.00 176.35 172.95 1mnu s GLN 43 N 1.60 2.62 0.44 1.98 0.74 -0.14 -0.50 119.66 126.41 1mnu s GLN 43 Ca 0.00 -1.15 -0.16 0.00 0.05 0.00 0.00 55.36 54.10 1mnu s GLN 43 Cb -0.13 -3.27 -0.08 0.00 1.10 0.00 0.00 33.01 30.63 1mnu s GLN 43 CO -0.04 -0.58 0.90 0.15 -0.55 0.00 0.00 175.29 175.16 1mnu s LYS 44 N 1.34 3.99 -0.26 1.67 1.02 -1.26 -1.55 119.74 124.69 1mnu s LYS 44 Ca -0.02 0.86 -0.41 0.00 0.02 0.00 0.00 55.97 56.41 1mnu s LYS 44 Cb -0.19 -2.24 -0.17 0.00 -0.52 0.00 0.00 37.83 34.71 1mnu s LYS 44 CO 0.00 -0.10 1.59 -2.30 -0.92 0.00 0.00 175.35 173.62 1mnu n PRO 45 N -1.12 0.75 0.00 -1.68 -0.02 -1.26 -0.80 135.00 130.87 1mnu n PRO 45 Ca 0.05 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.81 1mnu n PRO 45 Cb 0.54 -1.89 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 1mnu n PRO 45 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mnu n GLY 46 N 3.67 2.73 4.01 -1.23 0.00 -1.26 -5.00 105.19 108.12 1mnu n GLY 46 Ca 0.26 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.10 1mnu n GLY 46 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1mnu s GLN 47 N 0.00 2.64 0.47 1.61 -0.21 0.02 -5.11 119.66 119.09 1mnu s GLN 47 Ca 0.00 -1.30 -0.12 0.00 0.02 0.00 0.00 55.36 53.96 1mnu s GLN 47 Cb 0.00 -2.70 -0.06 0.00 1.00 0.00 0.00 33.01 31.25 1mnu s GLN 47 CO 0.00 -0.49 0.87 -1.12 -2.12 0.00 0.00 175.29 172.44 1mnu s SER 48 N -4.45 6.49 0.33 5.90 0.01 -1.26 -4.59 113.70 116.13 1mnu s SER 48 Ca 0.57 1.28 -0.29 0.00 1.31 0.00 0.00 55.95 58.83 1mnu s SER 48 Cb -0.09 -2.39 -0.12 0.00 0.21 0.00 0.00 66.02 63.63 1mnu s SER 48 CO 0.35 -0.54 1.52 -2.65 0.41 0.00 0.00 173.24 172.34 1mnu n PRO 49 N -1.67 2.62 -4.49 12.44 -0.02 -1.26 -4.56 135.00 138.06 1mnu n PRO 49 Ca 0.04 0.93 -0.31 0.00 -2.02 0.00 0.00 63.50 62.14 1mnu n PRO 49 Cb 0.54 -2.67 -0.17 0.00 -0.02 0.00 0.00 33.50 31.19 1mnu n PRO 49 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1mnu s LYS 50 N -1.29 2.61 0.22 -0.52 2.20 0.34 -4.91 119.74 118.38 1mnu s LYS 50 Ca 0.59 -0.70 -0.32 0.00 -0.36 0.00 0.00 55.97 55.18 1mnu s LYS 50 Cb -0.50 -2.17 -0.13 0.00 -1.51 0.00 0.00 37.83 33.52 1mnu s LYS 50 CO 0.56 -0.06 1.64 -0.11 -0.36 0.00 0.00 175.35 177.01 1mnu n LEU 51 N 4.22 3.78 -0.05 5.43 7.94 -1.26 -0.99 117.00 136.07 1mnu n LEU 51 Ca -0.19 1.09 -0.09 0.00 -1.11 0.00 0.00 56.01 55.71 1mnu n LEU 51 Cb 0.51 -1.53 -0.04 0.00 0.53 0.00 0.00 43.42 42.89 1mnu n LEU 51 CO 0.25 0.01 -0.85 0.18 -1.11 0.00 0.00 177.39 175.86 1mnu n LEU 52 N 3.30 2.03 -3.72 -1.96 4.77 0.13 -4.78 117.00 116.78 1mnu n LEU 52 Ca 0.14 0.03 -0.13 0.00 -0.03 0.00 0.00 56.01 56.02 1mnu n LEU 52 Cb 0.33 -0.34 -0.13 0.00 -2.33 0.00 0.00 43.42 40.95 1mnu n LEU 52 CO 0.64 0.48 -0.12 -0.63 -1.33 0.00 0.00 177.39 176.43 1mnu s ILE 53 N -2.20 -0.10 0.17 -0.08 1.01 -0.71 -2.94 121.20 116.35 1mnu s ILE 53 Ca -0.14 0.17 0.09 0.00 0.00 0.00 0.00 60.65 60.77 1mnu s ILE 53 Cb 0.05 -0.40 -0.04 0.00 0.01 0.00 0.00 42.46 42.08 1mnu s ILE 53 CO 0.22 0.07 -0.13 -0.72 0.00 0.00 0.00 174.94 174.38 1mnu s TYR 54 N 1.47 2.57 -0.89 3.97 1.13 0.13 0.17 117.35 125.89 1mnu s TYR 54 Ca -0.07 -0.25 -0.07 0.00 -1.41 0.00 0.00 57.07 55.27 1mnu s TYR 54 Cb -0.11 -1.27 0.00 0.00 -1.10 0.00 0.00 41.96 39.48 1mnu s TYR 54 CO -0.09 0.49 0.67 1.63 -2.51 0.00 0.00 175.55 175.75 1mnu n LYS 55 N 0.18 -1.32 0.00 -3.49 5.02 -0.96 -1.72 118.16 115.87 1mnu n LYS 55 Ca -0.12 0.83 0.00 0.00 -2.02 0.00 0.00 58.31 57.00 1mnu n LYS 55 Cb 0.55 -3.48 0.00 0.00 -0.02 0.00 0.00 35.03 32.08 1mnu n LYS 55 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 1mnu n VAL 56 N -2.89 0.00 -1.68 -0.18 3.14 0.55 -3.79 118.33 113.48 1mnu n VAL 56 Ca -0.19 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.19 1mnu n VAL 56 Cb 0.62 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.40 1mnu n VAL 56 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1mnu n SER 57 N 0.00 0.00 -4.75 6.55 3.41 -1.21 -2.46 113.62 115.16 1mnu n SER 57 Ca 0.00 -1.00 -0.37 0.00 -0.26 0.00 0.00 58.87 57.24 1mnu n SER 57 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 1mnu n SER 57 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1mnu s ASN 58 N 0.00 6.62 0.06 4.04 0.01 -0.70 -4.55 114.94 120.43 1mnu s ASN 58 Ca 0.00 0.73 -0.23 0.00 -0.71 0.00 0.00 52.86 52.65 1mnu s ASN 58 Cb 0.00 -2.24 -0.06 0.00 0.41 0.00 0.00 41.25 39.36 1mnu s ASN 58 CO 0.00 0.12 0.69 -0.13 -1.51 0.00 0.00 177.10 176.26 1mnu s ARG 59 N 0.14 4.41 0.55 -0.60 0.52 -1.26 -0.70 118.95 122.01 1mnu s ARG 59 Ca 0.22 0.94 -0.18 0.00 -0.52 0.00 0.00 55.73 56.19 1mnu s ARG 59 Cb -0.15 -3.31 -0.05 0.00 0.52 0.00 0.00 34.95 31.96 1mnu s ARG 59 CO 0.09 0.44 1.06 0.12 0.02 0.00 0.00 175.30 177.02 1mnu s PHE 60 N -0.53 2.95 0.21 -0.53 5.36 -1.15 -4.92 117.98 119.36 1mnu s PHE 60 Ca 0.34 1.54 -0.32 0.00 -0.96 0.00 0.00 56.93 57.53 1mnu s PHE 60 Cb -0.20 -3.06 -0.15 0.00 -0.34 0.00 0.00 43.02 39.27 1mnu s PHE 60 CO 0.21 -1.08 1.15 0.43 -1.46 0.00 0.00 175.22 174.48 1mnu n SER 61 N -1.61 1.46 0.00 6.13 7.64 -1.26 -1.29 113.62 124.69 1mnu n SER 61 Ca 0.09 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.12 1mnu n SER 61 Cb 0.52 -1.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.47 1mnu n SER 61 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mnu n GLY 62 N 1.86 2.75 3.64 0.23 0.00 -1.26 -5.02 105.19 107.39 1mnu n GLY 62 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 1mnu n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mnu s VAL 63 N -2.04 4.45 0.82 1.61 1.01 -0.41 -5.02 120.40 120.82 1mnu s VAL 63 Ca 0.00 1.68 -0.13 0.00 0.00 0.00 0.00 61.98 63.52 1mnu s VAL 63 Cb 0.00 -4.34 0.06 0.00 0.00 0.00 0.00 36.38 32.10 1mnu s VAL 63 CO 0.00 -0.43 0.97 -0.81 0.00 0.00 0.00 175.10 174.83 1mnu n PRO 64 N 6.88 0.09 0.11 2.72 -0.04 -1.26 -4.83 135.00 138.67 1mnu n PRO 64 Ca 0.13 0.10 0.11 0.00 -0.04 0.00 0.00 63.50 63.79 1mnu n PRO 64 Cb 0.47 -2.25 0.47 0.00 -0.04 0.00 0.00 33.50 32.14 1mnu n PRO 64 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1mnu n ASP 65 N -2.56 0.56 0.00 3.54 5.68 -1.26 -2.89 116.55 119.62 1mnu n ASP 65 Ca 0.12 0.65 0.07 0.00 -0.50 0.00 0.00 54.79 55.13 1mnu n ASP 65 Cb 0.51 -0.76 0.34 0.00 -1.14 0.00 0.00 41.12 40.06 1mnu n ASP 65 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 1mnu n ARG 66 N -2.13 0.14 -3.86 0.11 1.85 -1.26 -4.53 116.66 106.98 1mnu n ARG 66 Ca 0.02 0.19 -0.35 0.00 -1.00 0.00 0.00 57.85 56.70 1mnu n ARG 66 Cb 0.20 -1.50 -0.10 0.00 -1.05 0.00 0.00 32.46 30.01 1mnu n ARG 66 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1mnu s PHE 67 N -2.71 3.26 -0.01 2.89 0.08 -1.14 -1.67 117.98 118.68 1mnu s PHE 67 Ca 0.11 0.08 -0.18 0.00 0.12 0.00 0.00 56.93 57.07 1mnu s PHE 67 Cb 0.09 -2.15 0.03 0.00 -0.57 0.00 0.00 43.02 40.42 1mnu s PHE 67 CO 0.23 0.09 0.38 -1.54 -0.10 0.00 0.00 175.22 174.27 1mnu s SER 68 N 0.69 -0.27 0.19 1.36 1.04 -0.84 -4.96 113.70 110.90 1mnu s SER 68 Ca 0.05 0.15 0.08 0.00 0.48 0.00 0.00 55.95 56.71 1mnu s SER 68 Cb -0.13 0.36 -0.04 0.00 0.10 0.00 0.00 66.02 66.31 1mnu s SER 68 CO 0.02 -0.51 -0.16 -0.83 0.98 0.00 0.00 173.24 172.74 1mnu s GLY 69 N -1.44 1.39 0.26 7.32 0.00 -1.26 -0.48 107.32 113.11 1mnu s GLY 69 Ca -0.12 -1.58 -0.05 0.00 0.00 0.00 0.00 44.72 42.97 1mnu s GLY 69 CO 0.04 -1.66 0.43 -1.14 0.00 0.00 0.00 173.10 170.76 1mnu n SER 70 N -0.11 -1.22 0.00 1.64 3.41 -0.45 -4.31 113.62 112.58 1mnu n SER 70 Ca -0.10 -2.22 0.00 0.00 -0.26 0.00 0.00 58.87 56.29 1mnu n SER 70 Cb 0.59 2.14 0.00 0.00 -0.26 0.00 0.00 64.21 66.68 1mnu n SER 70 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1mnu n GLY 71 N -0.39 1.90 3.47 5.00 0.00 -1.26 -1.48 105.19 112.43 1mnu n GLY 71 Ca -0.02 -2.21 -0.10 0.00 0.00 0.00 0.00 46.02 43.69 1mnu n GLY 71 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1mnu s SER 72 N 0.00 -0.46 0.00 1.61 0.15 0.77 -4.94 113.70 110.83 1mnu s SER 72 Ca 0.00 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.63 1mnu s SER 72 Cb 0.00 0.50 0.00 0.00 -1.71 0.00 0.00 66.02 64.81 1mnu s SER 72 CO 0.00 -0.82 0.00 0.61 1.20 0.00 0.00 173.24 174.23 1mnu n GLY 73 N -0.32 0.24 0.00 9.45 0.00 -1.26 -1.08 105.19 112.21 1mnu n GLY 73 Ca -0.13 0.58 0.00 0.00 0.00 0.00 0.00 46.02 46.47 1mnu n GLY 73 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mnu n THR 74 N 0.00 0.00 -4.40 2.61 -2.24 -1.26 -1.37 114.28 107.62 1mnu n THR 74 Ca 0.00 -0.26 -0.34 0.00 -2.27 0.00 0.00 64.05 61.18 1mnu n THR 74 Cb 0.00 1.32 -0.15 0.00 -2.10 0.00 0.00 70.33 69.41 1mnu n THR 74 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1mnu s ASP 75 N -0.17 3.92 0.12 3.42 2.15 -0.24 -1.98 116.67 123.89 1mnu s ASP 75 Ca 0.00 -0.41 0.01 0.00 0.43 0.00 0.00 52.55 52.58 1mnu s ASP 75 Cb 0.00 -1.62 -0.04 0.00 -0.30 0.00 0.00 42.92 40.95 1mnu s ASP 75 CO 0.00 0.08 -0.02 -0.36 -0.17 0.00 0.00 175.17 174.69 1mnu s PHE 76 N 0.87 0.94 -0.16 -5.34 0.08 -0.39 -0.16 117.98 113.83 1mnu s PHE 76 Ca -0.03 -1.01 -0.09 0.00 0.12 0.00 0.00 56.93 55.91 1mnu s PHE 76 Cb -0.15 -0.55 0.05 0.00 -0.57 0.00 0.00 43.02 41.80 1mnu s PHE 76 CO -0.00 -0.25 0.38 0.99 -0.10 0.00 0.00 175.22 176.24 1mnu s THR 77 N -3.73 -0.02 -0.14 0.64 2.01 -0.55 -2.22 115.64 111.62 1mnu s THR 77 Ca 0.17 0.09 -0.06 0.00 0.31 0.00 0.00 61.69 62.19 1mnu s THR 77 Cb 0.06 -0.56 -0.04 0.00 0.01 0.00 0.00 72.50 71.97 1mnu s THR 77 CO -0.02 0.04 0.08 -0.22 -0.69 0.00 0.00 174.62 173.81 1mnu s LEU 78 N 1.20 4.00 0.04 4.42 2.96 -0.38 -1.34 118.68 129.58 1mnu s LEU 78 Ca -0.08 0.25 0.07 0.00 -0.22 0.00 0.00 54.13 54.15 1mnu s LEU 78 Cb -0.08 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.61 1mnu s LEU 78 CO -0.10 0.31 -0.21 -0.75 -1.32 0.00 0.00 176.35 174.29 1mnu s LYS 79 N -0.47 1.39 -0.39 1.98 2.20 0.37 -1.51 119.74 123.32 1mnu s LYS 79 Ca 0.10 -0.94 0.01 0.00 -0.36 0.00 0.00 55.97 54.78 1mnu s LYS 79 Cb -0.12 -1.50 0.14 0.00 -1.51 0.00 0.00 37.83 34.83 1mnu s LYS 79 CO 0.02 0.38 0.22 0.42 -0.36 0.00 0.00 175.35 176.03 1mnu s ILE 80 N -0.80 0.73 0.45 5.43 1.01 -0.34 -2.00 121.20 125.68 1mnu s ILE 80 Ca 0.07 -2.07 0.15 0.00 0.00 0.00 0.00 60.65 58.80 1mnu s ILE 80 Cb -0.09 -1.52 0.19 0.00 0.01 0.00 0.00 42.46 41.05 1mnu s ILE 80 CO 0.02 -0.94 2.00 0.77 0.00 0.00 0.00 174.94 176.79 1mnu h SER 81 N 6.93 0.00 -2.06 3.58 4.64 -1.58 -0.46 113.55 124.59 1mnu h SER 81 Ca 0.02 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.77 1mnu h SER 81 Cb 0.95 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.64 1mnu h SER 81 CO 0.37 0.18 -0.96 0.54 -0.87 0.00 0.00 176.83 176.09 1mnu n ARG 82 N -4.30 1.26 -1.52 4.77 1.74 -1.23 -3.50 116.66 113.87 1mnu n ARG 82 Ca -0.02 -3.66 -0.47 0.00 -0.77 0.00 0.00 57.85 52.92 1mnu n ARG 82 Cb 0.24 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.13 1mnu n ARG 82 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1mnu n VAL 83 N 1.23 1.62 -4.30 1.55 0.31 0.07 -4.63 118.33 114.18 1mnu n VAL 83 Ca 0.24 -0.40 -0.16 0.00 -0.01 0.00 0.00 64.34 64.00 1mnu n VAL 83 Cb 0.49 -0.59 -0.10 0.00 -0.91 0.00 0.00 33.84 32.73 1mnu n VAL 83 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1mnu s GLU 84 N -1.01 1.26 0.29 5.55 2.02 -1.26 -0.51 118.70 125.04 1mnu s GLU 84 Ca 0.66 -1.62 -0.02 0.00 0.02 0.00 0.00 54.97 54.00 1mnu s GLU 84 Cb -0.84 -0.51 0.42 0.00 0.10 0.00 0.00 34.13 33.30 1mnu s GLU 84 CO 0.57 -0.10 1.96 0.00 0.02 0.00 0.00 175.26 177.71 1mnu h ALA 85 N 2.55 1.40 0.00 5.21 0.00 -1.95 -1.80 119.26 124.67 1mnu h ALA 85 Ca -0.38 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1mnu h ALA 85 Cb 1.22 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1mnu h ALA 85 CO 0.64 0.55 0.07 1.05 0.00 0.00 0.00 179.25 181.55 1mnu h GLU 86 N 1.15 0.00 0.00 0.00 4.11 -1.96 0.02 114.58 117.89 1mnu h GLU 86 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.75 1mnu h GLU 86 Cb -0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.14 1mnu h GLU 86 CO -0.07 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 178.76 1mnu n ASP 87 N -2.90 0.00 -4.70 3.06 8.00 -0.68 -4.83 116.55 114.50 1mnu n ASP 87 Ca -0.03 -1.22 -0.42 0.00 0.71 0.00 0.00 54.79 53.83 1mnu n ASP 87 Cb 0.13 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.20 1mnu n ASP 87 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1mnu s LEU 88 N -1.54 4.36 0.00 0.64 2.96 -0.01 -4.81 118.68 120.28 1mnu s LEU 88 Ca 0.22 2.46 0.00 0.00 -0.22 0.00 0.00 54.13 56.59 1mnu s LEU 88 Cb 0.10 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.21 1mnu s LEU 88 CO 0.17 -0.81 0.00 0.61 -1.32 0.00 0.00 176.35 175.00 1mnu n GLY 89 N 3.80 0.25 3.22 7.98 0.00 -1.26 -4.56 105.19 114.63 1mnu n GLY 89 Ca 0.14 -1.49 -0.32 0.00 0.00 0.00 0.00 46.02 44.35 1mnu n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mnu s VAL 90 N -3.04 2.13 -0.07 1.61 0.11 -0.59 -1.59 120.40 118.96 1mnu s VAL 90 Ca 0.00 -0.99 -0.13 0.00 -2.93 0.00 0.00 61.98 57.93 1mnu s VAL 90 Cb 0.00 -1.82 -0.05 0.00 -1.53 0.00 0.00 36.38 32.98 1mnu s VAL 90 CO 0.00 0.56 0.34 -0.36 -3.33 0.00 0.00 175.10 172.31 1mnu s PHE 91 N 0.42 3.63 -0.07 1.54 0.40 0.00 -0.96 117.98 122.93 1mnu s PHE 91 Ca -0.17 0.81 0.03 0.00 -0.60 0.00 0.00 56.93 57.01 1mnu s PHE 91 Cb -0.17 -2.26 0.01 0.00 0.51 0.00 0.00 43.02 41.10 1mnu s PHE 91 CO 0.07 0.53 -0.15 -0.06 0.70 0.00 0.00 175.22 176.31 1mnu s PHE 92 N -0.57 1.71 0.19 0.36 0.08 -0.11 -1.01 117.98 118.63 1mnu s PHE 92 Ca 0.21 -0.64 -0.09 0.00 0.12 0.00 0.00 56.93 56.52 1mnu s PHE 92 Cb -0.15 -1.21 -0.07 0.00 -0.57 0.00 0.00 43.02 41.02 1mnu s PHE 92 CO 0.09 -0.30 0.51 0.00 -0.10 0.00 0.00 175.22 175.42 1mnu s SER 94 N -2.24 1.11 -0.05 0.00 0.15 0.13 -0.95 113.70 111.86 1mnu s SER 94 Ca 0.44 -0.69 0.02 0.00 0.70 0.00 0.00 55.95 56.42 1mnu s SER 94 Cb -0.12 0.03 0.01 0.00 -1.71 0.00 0.00 66.02 64.23 1mnu s SER 94 CO 0.21 -0.25 -0.11 -1.58 1.20 0.00 0.00 173.24 172.72 1mnu s GLN 95 N -2.22 1.39 -0.01 5.44 -0.44 -0.11 -0.26 119.66 123.45 1mnu s GLN 95 Ca -0.02 -0.35 0.10 0.00 -2.50 0.00 0.00 55.36 52.59 1mnu s GLN 95 Cb -0.06 -1.21 0.17 0.00 -1.64 0.00 0.00 33.01 30.27 1mnu s GLN 95 CO -0.00 0.04 1.07 -1.13 0.50 0.00 0.00 175.29 175.77 1mnu n SER 96 N 3.68 0.47 0.17 6.67 3.41 -0.79 -1.11 113.62 126.13 1mnu n SER 96 Ca -0.22 -2.08 0.12 0.00 -0.26 0.00 0.00 58.87 56.43 1mnu n SER 96 Cb 0.52 -0.25 0.16 0.00 -0.26 0.00 0.00 64.21 64.39 1mnu n SER 96 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1mnu h THR 97 N 6.63 0.00 -3.55 6.66 1.35 -1.86 -3.45 112.91 118.69 1mnu h THR 97 Ca -0.08 -0.90 -0.67 0.00 -0.55 0.00 0.00 66.41 64.21 1mnu h THR 97 Cb 1.55 1.76 -0.20 0.00 -1.73 0.00 0.00 68.15 69.54 1mnu h THR 97 CO 0.04 0.00 -0.84 -1.00 -0.25 0.00 0.00 175.52 173.46 1mnu s HIS 98 N -3.23 2.31 -0.12 4.73 3.76 -1.26 -4.91 115.29 116.58 1mnu s HIS 98 Ca 0.06 -0.37 -0.03 0.00 -0.15 0.00 0.00 55.06 54.58 1mnu s HIS 98 Cb 0.07 -1.20 -0.03 0.00 1.11 0.00 0.00 32.58 32.54 1mnu s HIS 98 CO 0.69 0.42 -0.03 0.08 -0.85 0.00 0.00 174.74 175.05 1mnu s VAL 99 N -1.36 3.96 0.61 -0.90 1.01 -1.26 -3.22 120.40 119.24 1mnu s VAL 99 Ca 0.17 -0.35 -0.13 0.00 0.00 0.00 0.00 61.98 61.68 1mnu s VAL 99 Cb -0.09 -2.70 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 1mnu s VAL 99 CO 0.08 0.54 1.03 -2.16 0.00 0.00 0.00 175.10 174.59 1mnu s PRO 100 N -0.12 3.50 0.36 2.72 0.04 -1.26 -4.96 135.00 135.28 1mnu s PRO 100 Ca 0.03 0.89 -0.27 0.00 0.04 0.00 0.00 61.00 61.69 1mnu s PRO 100 Cb -0.13 -2.07 -0.09 0.00 0.04 0.00 0.00 34.50 32.25 1mnu s PRO 100 CO 0.02 -0.64 1.21 -0.98 0.04 0.00 0.00 177.00 176.65 1mnu s ARG 101 N -4.77 4.22 0.14 4.56 1.70 -1.20 -4.74 118.95 118.87 1mnu s ARG 101 Ca 0.58 1.97 0.06 0.00 -0.47 0.00 0.00 55.73 57.86 1mnu s ARG 101 Cb -0.12 -2.88 -0.04 0.00 -0.57 0.00 0.00 34.95 31.34 1mnu s ARG 101 CO 0.47 -0.21 -0.12 0.95 -1.08 0.00 0.00 175.30 175.30 1mnu s THR 102 N -1.28 1.33 0.15 4.99 -4.23 -0.27 -4.97 115.64 111.35 1mnu s THR 102 Ca 0.53 -1.92 0.11 0.00 -1.18 0.00 0.00 61.69 59.22 1mnu s THR 102 Cb -0.34 -1.73 -0.04 0.00 1.34 0.00 0.00 72.50 71.73 1mnu s THR 102 CO 0.44 -0.57 -0.25 -0.36 -0.54 0.00 0.00 174.62 173.34 1mnu s PHE 103 N -2.73 2.34 0.90 3.99 0.40 -1.26 -0.94 117.98 120.69 1mnu s PHE 103 Ca 0.14 -0.36 -0.12 0.00 -0.60 0.00 0.00 56.93 55.99 1mnu s PHE 103 Cb -0.01 -1.23 0.13 0.00 0.51 0.00 0.00 43.02 42.41 1mnu s PHE 103 CO 0.03 0.39 1.12 0.20 0.70 0.00 0.00 175.22 177.66 1mnu s GLY 104 N -2.26 1.59 0.58 4.36 0.00 -0.12 -4.58 107.32 106.88 1mnu s GLY 104 Ca 0.17 -0.41 0.35 0.00 0.00 0.00 0.00 44.72 44.83 1mnu s GLY 104 CO 0.08 0.12 2.15 -1.33 0.00 0.00 0.00 173.10 174.12 1mnu h GLY 105 N -1.46 0.00 0.00 0.20 0.00 -1.91 -3.44 103.07 96.47 1mnu h GLY 105 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1mnu h GLY 105 CO 0.60 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.75 1mnu n GLY 106 N -0.60 2.43 2.86 4.60 0.00 -1.26 -5.05 105.19 108.18 1mnu n GLY 106 Ca -0.01 -1.80 -0.25 0.00 0.00 0.00 0.00 46.02 43.95 1mnu n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mnu s THR 107 N -2.35 0.81 -0.22 2.61 2.01 -0.18 -4.74 115.64 113.58 1mnu s THR 107 Ca 0.00 -0.15 -0.22 0.00 0.31 0.00 0.00 61.69 61.62 1mnu s THR 107 Cb 0.00 -0.87 -0.02 0.00 0.01 0.00 0.00 72.50 71.62 1mnu s THR 107 CO 0.00 0.33 0.71 -1.59 -0.69 0.00 0.00 174.62 173.38 1mnu s LYS 108 N 1.77 4.19 -0.34 4.92 -2.85 -0.53 -0.82 119.74 126.08 1mnu s LYS 108 Ca 0.04 0.74 -0.14 0.00 -1.00 0.00 0.00 55.97 55.61 1mnu s LYS 108 Cb -0.13 -3.61 -0.02 0.00 -2.06 0.00 0.00 37.83 32.01 1mnu s LYS 108 CO -0.07 -0.37 0.32 -1.17 0.10 0.00 0.00 175.35 174.16 1mnu s LEU 109 N 2.35 4.42 -0.10 2.77 0.20 -0.62 -0.08 118.68 127.62 1mnu s LEU 109 Ca 0.31 -0.25 -0.03 0.00 0.69 0.00 0.00 54.13 54.85 1mnu s LEU 109 Cb -0.16 -2.28 -0.03 0.00 -0.43 0.00 0.00 46.19 43.29 1mnu s LEU 109 CO 0.09 -0.29 0.04 -0.70 -0.29 0.00 0.00 176.35 175.20 1mnu s GLU 110 N 1.93 3.12 -0.19 1.98 2.12 -0.19 -4.04 118.70 123.42 1mnu s GLU 110 Ca 0.10 -0.34 -0.22 0.00 0.36 0.00 0.00 54.97 54.87 1mnu s GLU 110 Cb -0.17 -2.90 -0.02 0.00 0.26 0.00 0.00 34.13 31.30 1mnu s GLU 110 CO 0.11 0.71 0.70 0.42 -0.54 0.00 0.00 175.26 176.66 1mnu s ILE 111 N -0.89 4.97 0.25 -3.70 -1.09 -1.26 -0.36 121.20 119.12 1mnu s ILE 111 Ca 0.13 1.33 -0.30 0.00 -2.23 0.00 0.00 60.65 59.59 1mnu s ILE 111 Cb -0.12 -4.01 -0.09 0.00 -1.58 0.00 0.00 42.46 36.66 1mnu s ILE 111 CO 0.03 0.08 0.99 -0.54 -1.23 0.00 0.00 174.94 174.26 1mnu s LYS 112 N 2.02 4.79 0.18 2.79 1.02 -0.64 -4.84 119.74 125.06 1mnu s LYS 112 Ca 0.32 1.58 -0.09 0.00 0.02 0.00 0.00 55.97 57.79 1mnu s LYS 112 Cb -0.16 -3.26 -0.01 0.00 -0.52 0.00 0.00 37.83 33.89 1mnu s LYS 112 CO 0.11 0.42 0.31 -0.98 -0.92 0.00 0.00 175.35 174.29 1mnu s ARG 113 N -1.23 1.21 0.46 1.68 1.70 -1.26 -4.43 118.95 117.08 1mnu s ARG 113 Ca 0.42 -1.18 -0.25 0.00 -0.47 0.00 0.00 55.73 54.25 1mnu s ARG 113 Cb -0.28 0.39 -0.08 0.00 -0.57 0.00 0.00 34.95 34.41 1mnu s ARG 113 CO 0.35 -0.45 1.43 0.00 -1.08 0.00 0.00 175.30 175.55 1mnu n ALA 114 N -0.24 2.04 -1.73 7.88 0.00 -1.26 -4.89 120.51 122.31 1mnu n ALA 114 Ca -0.07 0.24 -0.42 0.00 0.00 0.00 0.00 53.44 53.19 1mnu n ALA 114 Cb 0.63 -2.40 -0.01 0.00 0.00 0.00 0.00 19.45 17.67 1mnu n ALA 114 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1mnu n ASP 115 N -0.25 3.35 -3.87 0.00 8.00 -1.26 -4.80 116.55 117.72 1mnu n ASP 115 Ca 0.05 1.18 -0.19 0.00 0.71 0.00 0.00 54.79 56.55 1mnu n ASP 115 Cb 0.42 -1.54 -0.16 0.00 -0.02 0.00 0.00 41.12 39.81 1mnu n ASP 115 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1mnu s ALA 116 N -0.59 0.57 0.22 2.24 0.00 0.13 -4.92 121.76 119.42 1mnu s ALA 116 Ca 0.60 0.01 -0.30 0.00 0.00 0.00 0.00 51.96 52.27 1mnu s ALA 116 Cb -0.54 -0.39 -0.09 0.00 0.00 0.00 0.00 23.12 22.11 1mnu s ALA 116 CO 0.56 -0.02 0.98 0.00 0.00 0.00 0.00 175.76 177.27 1mnu s ALA 117 N 0.92 3.34 0.76 0.00 0.00 -1.26 -0.95 121.76 124.57 1mnu s ALA 117 Ca -0.11 0.66 -0.13 0.00 0.00 0.00 0.00 51.96 52.38 1mnu s ALA 117 Cb -0.14 -3.25 0.06 0.00 0.00 0.00 0.00 23.12 19.79 1mnu s ALA 117 CO -0.00 0.10 1.17 -1.25 0.00 0.00 0.00 175.76 175.77 1mnu s PRO 118 N -0.99 2.02 -0.21 0.00 0.04 -1.26 -4.67 135.00 129.92 1mnu s PRO 118 Ca 0.43 1.59 -0.09 0.00 0.04 0.00 0.00 61.00 62.97 1mnu s PRO 118 Cb -0.27 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.39 1mnu s PRO 118 CO 0.33 -1.89 0.10 0.99 0.04 0.00 0.00 177.00 176.57 1mnu s THR 119 N -2.29 4.92 -0.07 1.26 2.01 -0.60 -4.88 115.64 115.99 1mnu s THR 119 Ca 0.70 0.02 -0.00 0.00 0.31 0.00 0.00 61.69 62.72 1mnu s THR 119 Cb -0.25 -3.26 -0.03 0.00 0.01 0.00 0.00 72.50 68.97 1mnu s THR 119 CO 0.49 0.40 -0.03 -0.69 -0.69 0.00 0.00 174.62 174.10 1mnu s VAL 120 N 0.82 4.05 -0.02 3.82 1.01 -1.26 -1.14 120.40 127.68 1mnu s VAL 120 Ca 0.05 -0.39 0.01 0.00 0.00 0.00 0.00 61.98 61.66 1mnu s VAL 120 Cb -0.13 -2.70 0.01 0.00 0.00 0.00 0.00 36.38 33.55 1mnu s VAL 120 CO 0.02 0.57 -0.05 -0.44 0.00 0.00 0.00 175.10 175.21 1mnu s SER 121 N -0.95 0.71 0.00 3.32 0.01 -0.52 -4.97 113.70 111.30 1mnu s SER 121 Ca 0.14 -0.10 0.08 0.00 1.31 0.00 0.00 55.95 57.37 1mnu s SER 121 Cb -0.11 -0.18 -0.02 0.00 0.21 0.00 0.00 66.02 65.91 1mnu s SER 121 CO 0.03 0.02 -0.24 -0.51 0.41 0.00 0.00 173.24 172.95 1mnu s ILE 122 N 0.23 2.23 -0.10 1.44 2.07 -1.26 -0.50 121.20 125.30 1mnu s ILE 122 Ca -0.02 -1.17 -0.01 0.00 -1.41 0.00 0.00 60.65 58.04 1mnu s ILE 122 Cb -0.06 -1.82 0.03 0.00 0.13 0.00 0.00 42.46 40.74 1mnu s ILE 122 CO -0.00 0.50 -0.02 -0.36 -1.91 0.00 0.00 174.94 173.15 1mnu s PHE 123 N -0.70 0.95 1.02 3.50 0.40 0.10 -4.99 117.98 118.25 1mnu s PHE 123 Ca 0.11 -0.41 -0.12 0.00 -0.60 0.00 0.00 56.93 55.91 1mnu s PHE 123 Cb -0.10 -0.95 0.20 0.00 0.51 0.00 0.00 43.02 42.68 1mnu s PHE 123 CO 0.01 -0.41 1.08 -2.14 0.70 0.00 0.00 175.22 174.45 1mnu s PRO 124 N 1.88 0.23 0.69 0.24 0.02 -1.26 -1.43 135.00 135.38 1mnu s PRO 124 Ca 0.04 0.95 -0.16 0.00 0.02 0.00 0.00 61.00 61.85 1mnu s PRO 124 Cb -0.13 -1.68 0.02 0.00 0.02 0.00 0.00 34.50 32.73 1mnu s PRO 124 CO -0.06 -2.98 1.21 -2.14 -0.33 0.00 0.00 177.00 172.70 1mnu s PRO 125 N -4.69 2.36 0.37 5.54 0.02 -1.21 -4.78 135.00 132.61 1mnu s PRO 125 Ca 0.66 1.78 -0.06 0.00 0.02 0.00 0.00 61.00 63.40 1mnu s PRO 125 Cb -0.22 -1.86 -0.05 0.00 0.02 0.00 0.00 34.50 32.39 1mnu s PRO 125 CO 0.60 -1.67 0.67 -1.54 -0.33 0.00 0.00 177.00 174.73 1mnu s SER 126 N -1.93 6.42 0.32 2.53 1.04 -1.26 -4.94 113.70 115.88 1mnu s SER 126 Ca 0.75 0.87 0.03 0.00 0.48 0.00 0.00 55.95 58.08 1mnu s SER 126 Cb -0.30 -2.21 0.63 0.00 0.10 0.00 0.00 66.02 64.24 1mnu s SER 126 CO 0.42 -0.34 1.89 0.28 0.98 0.00 0.00 173.24 176.47 1mnu h SER 127 N 1.20 0.82 -0.60 7.02 0.02 -1.99 -1.06 113.55 118.96 1mnu h SER 127 Ca -0.48 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.48 1mnu h SER 127 Cb 1.19 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 63.56 1mnu h SER 127 CO 0.64 0.49 0.30 -0.33 -1.14 0.00 0.00 176.83 176.79 1mnu h GLU 128 N 0.91 0.86 -0.34 3.45 3.07 -1.99 -0.86 114.58 119.69 1mnu h GLU 128 Ca 0.42 -0.12 -0.07 0.00 -0.50 0.00 0.00 59.36 59.08 1mnu h GLU 128 Cb 0.39 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.13 1mnu h GLU 128 CO -0.18 0.68 -0.08 0.37 -1.40 0.00 0.00 179.01 178.40 1mnu h GLN 129 N 0.82 0.65 -0.36 2.33 4.15 -1.63 -2.77 115.11 118.31 1mnu h GLN 129 Ca 0.21 -0.25 0.06 0.00 0.77 0.00 0.00 58.65 59.44 1mnu h GLN 129 Cb 0.10 -0.04 -0.06 0.00 0.21 0.00 0.00 27.48 27.69 1mnu h GLN 129 CO -0.03 0.82 0.01 -0.07 -1.93 0.00 0.00 178.83 177.63 1mnu h LEU 130 N 0.44 -0.13 -1.32 -2.39 3.38 -1.04 0.09 115.31 114.34 1mnu h LEU 130 Ca 0.09 0.08 0.19 0.00 0.09 0.00 0.00 57.88 58.32 1mnu h LEU 130 Cb 0.58 0.14 -0.08 0.00 0.09 0.00 0.00 40.66 41.39 1mnu h LEU 130 CO 0.03 -0.03 0.60 0.74 0.09 0.00 0.00 178.44 179.87 1mnu h THR 131 N 0.11 0.72 0.00 0.22 2.02 -1.01 0.65 112.91 115.61 1mnu h THR 131 Ca 0.17 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1mnu h THR 131 Cb 0.24 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.74 1mnu h THR 131 CO -0.28 0.10 0.00 -1.54 0.37 0.00 0.00 175.52 174.17 1mnu n SER 132 N -4.59 0.00 0.00 4.18 3.41 -0.01 -4.85 113.62 111.76 1mnu n SER 132 Ca 0.20 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 59.10 1mnu n SER 132 Cb 0.61 -0.41 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 1mnu n SER 132 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1mnu n GLY 133 N 0.47 0.70 3.75 5.00 0.00 0.23 -5.07 105.19 110.26 1mnu n GLY 133 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 1mnu n GLY 133 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mnu s GLY 134 N -1.45 2.69 -0.30 -0.02 0.00 -1.02 -1.98 107.32 105.24 1mnu s GLY 134 Ca 0.00 -1.22 -0.09 0.00 0.00 0.00 0.00 44.72 43.41 1mnu s GLY 134 CO 0.00 -2.08 0.69 0.00 0.00 0.00 0.00 173.10 171.71 1mnu s ALA 135 N -2.78 -2.20 -0.13 3.20 0.00 -0.88 -2.88 121.76 116.09 1mnu s ALA 135 Ca 0.23 2.21 0.02 0.00 0.00 0.00 0.00 51.96 54.42 1mnu s ALA 135 Cb 0.03 -1.89 0.00 0.00 0.00 0.00 0.00 23.12 21.26 1mnu s ALA 135 CO 0.13 -1.01 -0.20 -1.12 0.00 0.00 0.00 175.76 173.56 1mnu s SER 136 N 2.84 3.31 -0.17 0.00 0.01 -1.26 -0.32 113.70 118.11 1mnu s SER 136 Ca -0.01 -0.54 -0.09 0.00 1.31 0.00 0.00 55.95 56.62 1mnu s SER 136 Cb -0.12 -1.48 -0.05 0.00 0.21 0.00 0.00 66.02 64.59 1mnu s SER 136 CO -0.19 0.10 0.13 -0.69 0.41 0.00 0.00 173.24 173.00 1mnu s VAL 137 N 0.68 5.38 0.03 3.43 1.01 0.48 -3.29 120.40 128.11 1mnu s VAL 137 Ca -0.09 0.17 0.08 0.00 0.00 0.00 0.00 61.98 62.14 1mnu s VAL 137 Cb -0.16 -3.41 -0.03 0.00 0.00 0.00 0.00 36.38 32.78 1mnu s VAL 137 CO 0.01 0.51 -0.24 -0.69 0.00 0.00 0.00 175.10 174.69 1mnu s VAL 138 N -0.15 2.30 -0.05 2.92 1.01 -0.52 -0.71 120.40 125.20 1mnu s VAL 138 Ca 0.10 -1.26 0.00 0.00 0.00 0.00 0.00 61.98 60.83 1mnu s VAL 138 Cb -0.11 -1.89 0.02 0.00 0.00 0.00 0.00 36.38 34.40 1mnu s VAL 138 CO 0.00 0.42 -0.03 0.00 0.00 0.00 0.00 175.10 175.49 1mnu s PHE 140 N 1.15 3.04 -0.34 0.00 0.08 0.34 -0.72 117.98 121.53 1mnu s PHE 140 Ca -0.08 -0.19 0.02 0.00 0.12 0.00 0.00 56.93 56.80 1mnu s PHE 140 Cb -0.14 -1.92 0.09 0.00 -0.57 0.00 0.00 43.02 40.48 1mnu s PHE 140 CO -0.01 0.07 0.05 -0.51 -0.10 0.00 0.00 175.22 174.72 1mnu s LEU 141 N 0.11 4.62 0.02 -0.37 1.02 -0.20 -1.44 118.68 122.44 1mnu s LEU 141 Ca -0.00 -1.97 0.02 0.00 0.02 0.00 0.00 54.13 52.19 1mnu s LEU 141 Cb -0.13 -1.66 -0.04 0.00 0.02 0.00 0.00 46.19 44.38 1mnu s LEU 141 CO 0.03 -0.38 0.04 0.20 0.02 0.00 0.00 176.35 176.26 1mnu s ASN 142 N 1.13 5.34 -1.14 2.29 0.02 -0.29 -0.00 114.94 122.29 1mnu s ASN 142 Ca 0.07 0.02 -0.04 0.00 -1.02 0.00 0.00 52.86 51.88 1mnu s ASN 142 Cb -0.20 -1.43 -0.03 0.00 0.02 0.00 0.00 41.25 39.61 1mnu s ASN 142 CO -0.06 0.25 0.91 0.59 0.02 0.00 0.00 177.10 178.81 1mnu n ASN 143 N 1.06 -4.27 -4.36 -1.22 5.03 -0.14 -1.56 115.26 109.80 1mnu n ASN 143 Ca -0.13 -0.71 -0.26 0.00 0.87 0.00 0.00 54.58 54.35 1mnu n ASN 143 Cb 0.52 -4.92 -0.12 0.00 -1.02 0.00 0.00 39.78 34.24 1mnu n ASN 143 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.26 176.15 1mnu s PHE 144 N -3.42 2.09 -0.12 3.10 -0.71 -0.01 -4.50 117.98 114.41 1mnu s PHE 144 Ca 0.24 -0.40 -0.08 0.00 -1.04 0.00 0.00 56.93 55.65 1mnu s PHE 144 Cb -0.04 -1.10 0.04 0.00 -1.21 0.00 0.00 43.02 40.71 1mnu s PHE 144 CO 0.75 0.34 0.30 -0.47 -1.34 0.00 0.00 175.22 174.81 1mnu s TYR 145 N -1.38 -0.39 1.17 3.49 5.04 -0.13 -0.46 117.35 124.69 1mnu s TYR 145 Ca 0.14 0.91 -0.19 0.00 -2.44 0.00 0.00 57.07 55.48 1mnu s TYR 145 Cb -0.09 0.12 0.28 0.00 0.35 0.00 0.00 41.96 42.62 1mnu s TYR 145 CO 0.07 -0.23 1.16 -1.25 -1.34 0.00 0.00 175.55 173.96 1mnu s PRO 146 N 0.86 -0.95 0.29 4.97 0.04 -1.26 0.21 135.00 139.15 1mnu s PRO 146 Ca -0.06 -0.19 0.03 0.00 0.04 0.00 0.00 61.00 60.82 1mnu s PRO 146 Cb -0.07 -1.64 0.43 0.00 0.04 0.00 0.00 34.50 33.26 1mnu s PRO 146 CO -0.06 -3.51 1.73 -0.22 0.04 0.00 0.00 177.00 174.99 1mnu h LYS 147 N -2.43 0.47 -6.44 4.56 3.64 -1.97 -3.45 116.57 110.94 1mnu h LYS 147 Ca -0.44 -0.17 -0.61 0.00 -1.27 0.00 0.00 60.65 58.16 1mnu h LYS 147 Cb 1.28 -0.03 0.06 0.00 -0.41 0.00 0.00 32.23 33.12 1mnu h LYS 147 CO 0.33 0.68 0.70 -0.25 -2.27 0.00 0.00 179.45 178.63 1mnu n ASP 148 N -4.13 2.68 -3.61 4.20 8.00 -1.26 -4.95 116.55 117.48 1mnu n ASP 148 Ca -0.00 1.09 -0.08 0.00 0.71 0.00 0.00 54.79 56.51 1mnu n ASP 148 Cb 0.40 -1.36 -0.05 0.00 -0.02 0.00 0.00 41.12 40.08 1mnu n ASP 148 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1mnu s ILE 149 N 0.76 0.00 -0.06 0.53 2.07 -1.26 -4.68 121.20 118.56 1mnu s ILE 149 Ca 0.80 0.00 0.06 0.00 -1.41 0.00 0.00 60.65 60.10 1mnu s ILE 149 Cb -0.75 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 40.83 1mnu s ILE 149 CO 0.41 0.00 -0.24 0.21 -1.91 0.00 0.00 174.94 173.41 1mnu s ASN 150 N -0.73 2.93 -0.14 4.50 2.47 -0.57 -4.97 114.94 118.45 1mnu s ASN 150 Ca 0.02 -0.49 0.03 0.00 0.42 0.00 0.00 52.86 52.84 1mnu s ASN 150 Cb -0.02 -0.86 0.01 0.00 -1.45 0.00 0.00 41.25 38.93 1mnu s ASN 150 CO -0.04 0.22 -0.22 0.54 -3.72 0.00 0.00 177.10 173.89 1mnu s VAL 151 N -0.08 2.09 -0.10 -5.21 0.11 -1.25 0.07 120.40 116.03 1mnu s VAL 151 Ca -0.05 -0.97 0.02 0.00 -2.93 0.00 0.00 61.98 58.04 1mnu s VAL 151 Cb -0.14 -1.83 -0.01 0.00 -1.53 0.00 0.00 36.38 32.87 1mnu s VAL 151 CO 0.04 0.55 -0.16 -0.75 -3.33 0.00 0.00 175.10 171.45 1mnu s LYS 152 N 0.75 3.08 -0.15 1.54 2.20 0.19 -4.93 119.74 122.42 1mnu s LYS 152 Ca -0.09 -0.74 -0.08 0.00 -0.36 0.00 0.00 55.97 54.70 1mnu s LYS 152 Cb -0.16 -2.48 -0.04 0.00 -1.51 0.00 0.00 37.83 33.64 1mnu s LYS 152 CO -0.00 0.30 0.12 -1.58 -0.36 0.00 0.00 175.35 173.83 1mnu s TRP 153 N 0.09 3.48 -0.09 4.03 0.52 -1.26 -0.66 118.94 125.05 1mnu s TRP 153 Ca -0.07 0.40 0.02 0.00 0.02 0.00 0.00 56.10 56.47 1mnu s TRP 153 Cb -0.15 -2.01 0.01 0.00 -1.15 0.00 0.00 33.47 30.17 1mnu s TRP 153 CO 0.05 0.52 -0.14 0.15 0.02 0.00 0.00 176.95 177.55 1mnu s LYS 154 N -0.44 2.02 -0.20 4.98 1.02 -0.53 0.56 119.74 127.15 1mnu s LYS 154 Ca 0.12 -0.51 -0.03 0.00 0.02 0.00 0.00 55.97 55.57 1mnu s LYS 154 Cb -0.12 -1.69 -0.01 0.00 -0.52 0.00 0.00 37.83 35.49 1mnu s LYS 154 CO 0.02 -0.01 -0.06 0.42 -0.92 0.00 0.00 175.35 174.80 1mnu s ILE 155 N 0.81 3.34 -1.60 2.17 1.09 0.29 -1.02 121.20 126.28 1mnu s ILE 155 Ca -0.11 -0.52 -0.13 0.00 -1.10 0.00 0.00 60.65 58.79 1mnu s ILE 155 Cb -0.16 -2.49 0.11 0.00 -1.06 0.00 0.00 42.46 38.86 1mnu s ILE 155 CO 0.02 0.45 0.74 0.47 -0.10 0.00 0.00 174.94 176.51 1mnu n ASP 156 N 4.47 -2.85 0.00 3.58 8.00 -0.31 -0.83 116.55 128.61 1mnu n ASP 156 Ca -0.18 -0.97 0.00 0.00 0.71 0.00 0.00 54.79 54.35 1mnu n ASP 156 Cb 0.51 -3.05 0.00 0.00 -0.02 0.00 0.00 41.12 38.57 1mnu n ASP 156 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mnu n GLY 157 N -1.60 1.52 3.50 0.44 0.00 -1.26 -5.02 105.19 102.78 1mnu n GLY 157 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 1mnu n GLY 157 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1mnu s SER 158 N -3.26 4.80 0.15 1.61 0.15 -0.01 -5.00 113.70 112.13 1mnu s SER 158 Ca 0.00 -0.12 -0.32 0.00 0.70 0.00 0.00 55.95 56.21 1mnu s SER 158 Cb 0.00 -1.77 -0.11 0.00 -1.71 0.00 0.00 66.02 62.42 1mnu s SER 158 CO 0.00 0.17 1.80 1.21 1.20 0.00 0.00 173.24 177.63 1mnu n GLU 159 N 3.50 2.78 -3.40 5.44 2.13 -1.26 -0.55 120.64 129.27 1mnu n GLU 159 Ca -0.17 1.01 -0.38 0.00 0.66 0.00 0.00 57.16 58.27 1mnu n GLU 159 Cb 0.52 -2.89 -0.08 0.00 0.27 0.00 0.00 31.44 29.27 1mnu n GLU 159 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1mnu s ARG 160 N 2.25 4.17 0.00 5.31 6.06 0.19 -4.91 118.95 132.03 1mnu s ARG 160 Ca 0.80 0.18 0.15 0.00 -2.50 0.00 0.00 55.73 54.36 1mnu s ARG 160 Cb -0.49 -3.53 -0.16 0.00 0.06 0.00 0.00 34.95 30.83 1mnu s ARG 160 CO 0.36 -0.02 0.64 1.04 -2.50 0.00 0.00 175.30 174.81 1mnu n GLN 161 N 4.42 2.08 -4.11 5.12 6.02 -1.26 -4.39 117.38 125.26 1mnu n GLN 161 Ca -0.09 -0.02 -0.09 0.00 -0.01 0.00 0.00 57.00 56.80 1mnu n GLN 161 Cb 0.51 -1.20 -0.10 0.00 1.02 0.00 0.00 30.24 30.47 1mnu n GLN 161 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1mnu s ASN 162 N -2.39 0.73 0.00 1.08 2.20 -1.26 -4.80 114.94 110.50 1mnu s ASN 162 Ca 0.06 -0.95 0.00 0.00 -0.94 0.00 0.00 52.86 51.02 1mnu s ASN 162 Cb 0.11 0.15 0.00 0.00 -2.00 0.00 0.00 41.25 39.51 1mnu s ASN 162 CO 0.61 -0.52 0.00 0.61 -2.94 0.00 0.00 177.10 174.86 1mnu n GLY 163 N 0.19 0.81 3.50 0.45 0.00 -1.26 -4.94 105.19 103.95 1mnu n GLY 163 Ca -0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 1mnu n GLY 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mnu s VAL 164 N -2.08 4.34 -0.09 1.61 1.01 -1.26 -1.35 120.40 122.58 1mnu s VAL 164 Ca 0.00 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 61.82 1mnu s VAL 164 Cb 0.00 -2.99 -0.02 0.00 0.00 0.00 0.00 36.38 33.37 1mnu s VAL 164 CO 0.00 0.40 -0.13 -0.76 0.00 0.00 0.00 175.10 174.61 1mnu s LEU 165 N 1.08 2.76 0.08 3.92 2.01 -0.07 -4.96 118.68 123.50 1mnu s LEU 165 Ca 0.04 -0.24 0.09 0.00 0.01 0.00 0.00 54.13 54.02 1mnu s LEU 165 Cb -0.14 -1.59 -0.03 0.00 0.01 0.00 0.00 46.19 44.43 1mnu s LEU 165 CO 0.03 0.26 -0.24 0.20 1.01 0.00 0.00 176.35 177.61 1mnu s ASN 166 N -0.22 2.86 -0.06 2.29 0.02 -1.26 -0.63 114.94 117.93 1mnu s ASN 166 Ca 0.01 -0.63 -0.05 0.00 -1.02 0.00 0.00 52.86 51.17 1mnu s ASN 166 Cb -0.13 -0.21 0.02 0.00 0.02 0.00 0.00 41.25 40.95 1mnu s ASN 166 CO 0.03 0.17 0.16 -0.55 0.02 0.00 0.00 177.10 176.93 1mnu s SER 167 N -1.56 -0.16 0.07 -1.22 0.15 -0.61 -4.98 113.70 105.38 1mnu s SER 167 Ca 0.10 0.33 0.10 0.00 0.70 0.00 0.00 55.95 57.17 1mnu s SER 167 Cb -0.10 0.30 -0.03 0.00 -1.71 0.00 0.00 66.02 64.48 1mnu s SER 167 CO 0.03 -0.08 -0.26 0.26 1.20 0.00 0.00 173.24 174.40 1mnu s TRP 168 N 0.38 2.34 0.47 3.44 0.52 -1.26 -0.36 118.94 124.47 1mnu s TRP 168 Ca -0.02 -0.39 -0.02 0.00 0.02 0.00 0.00 56.10 55.69 1mnu s TRP 168 Cb -0.04 -1.36 -0.01 0.00 -1.15 0.00 0.00 33.47 30.91 1mnu s TRP 168 CO -0.02 0.20 0.72 0.95 0.02 0.00 0.00 176.95 178.82 1mnu s THR 169 N -0.89 4.23 0.86 2.01 -4.23 -0.49 -5.00 115.64 112.12 1mnu s THR 169 Ca 0.13 -0.27 -0.13 0.00 -1.18 0.00 0.00 61.69 60.23 1mnu s THR 169 Cb -0.10 -3.59 0.12 0.00 1.34 0.00 0.00 72.50 70.27 1mnu s THR 169 CO 0.03 -0.48 1.22 -0.62 -0.54 0.00 0.00 174.62 174.24 1mnu s ASP 170 N -4.19 4.03 0.22 3.99 -1.08 -1.26 -4.50 116.67 113.88 1mnu s ASP 170 Ca 0.48 0.57 -0.31 0.00 -0.52 0.00 0.00 52.55 52.77 1mnu s ASP 170 Cb -0.10 -0.91 -0.11 0.00 -1.46 0.00 0.00 42.92 40.34 1mnu s ASP 170 CO 0.40 -2.19 1.64 -1.58 0.52 0.00 0.00 175.17 173.97 1mnu s GLN 171 N -5.67 4.15 -0.28 4.34 0.74 -1.26 -4.74 119.66 116.93 1mnu s GLN 171 Ca 0.66 2.54 -0.29 0.00 0.05 0.00 0.00 55.36 58.32 1mnu s GLN 171 Cb -0.08 -3.08 -0.01 0.00 1.10 0.00 0.00 33.01 30.94 1mnu s GLN 171 CO 0.50 -0.67 1.38 0.34 -0.55 0.00 0.00 175.29 176.29 1mnu s ASP 172 N 0.94 6.59 0.16 6.67 -1.08 -0.61 -4.88 116.67 124.47 1mnu s ASP 172 Ca 0.70 1.30 -0.28 0.00 -0.52 0.00 0.00 52.55 53.75 1mnu s ASP 172 Cb -0.48 -2.54 -0.01 0.00 -1.46 0.00 0.00 42.92 38.44 1mnu s ASP 172 CO 0.37 -1.13 1.56 0.77 0.52 0.00 0.00 175.17 177.25 1mnu h SER 173 N 9.67 -1.69 -0.04 -0.34 4.64 -1.91 2.23 113.55 126.11 1mnu h SER 173 Ca -0.28 0.26 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1mnu h SER 173 Cb 1.11 0.75 0.00 0.00 -0.31 0.00 0.00 62.40 63.95 1mnu h SER 173 CO 1.03 -0.34 0.00 2.29 -0.87 0.00 0.00 176.83 178.94 1mnu n LYS 174 N -5.38 1.11 0.00 4.77 2.85 -1.26 -4.16 118.16 116.09 1mnu n LYS 174 Ca 0.01 -0.18 0.00 0.00 -1.05 0.00 0.00 58.31 57.09 1mnu n LYS 174 Cb 0.34 -1.16 0.00 0.00 -0.65 0.00 0.00 35.03 33.56 1mnu n LYS 174 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88 1mnu n ASP 175 N -0.47 1.56 -0.49 -5.58 2.03 0.24 -5.03 116.55 108.81 1mnu n ASP 175 Ca 0.07 0.00 -0.06 0.00 0.52 0.00 0.00 54.79 55.32 1mnu n ASP 175 Cb 0.07 0.07 -0.03 0.00 -0.72 0.00 0.00 41.12 40.51 1mnu n ASP 175 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1mnu n SER 176 N -1.53 -4.30 -4.86 1.67 7.64 0.73 -4.96 113.62 108.02 1mnu n SER 176 Ca 0.00 0.16 -0.26 0.00 1.01 0.00 0.00 58.87 59.78 1mnu n SER 176 Cb 0.18 -2.36 -0.03 0.00 -1.01 0.00 0.00 64.21 60.99 1mnu n SER 176 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1mnu s THR 177 N -2.06 1.81 0.33 0.44 -4.23 -1.26 -4.78 115.64 105.89 1mnu s THR 177 Ca 0.00 -1.57 0.07 0.00 -1.18 0.00 0.00 61.69 59.01 1mnu s THR 177 Cb 0.00 -2.38 -0.07 0.00 1.34 0.00 0.00 72.50 71.40 1mnu s THR 177 CO 0.00 0.00 -0.03 -0.31 -0.54 0.00 0.00 174.62 173.74 1mnu s TYR 178 N -2.72 2.17 0.06 3.99 1.51 0.40 -1.57 117.35 121.19 1mnu s TYR 178 Ca 0.33 -0.70 -0.03 0.00 -1.01 0.00 0.00 57.07 55.66 1mnu s TYR 178 Cb -0.01 -1.35 -0.03 0.00 -0.11 0.00 0.00 41.96 40.46 1mnu s TYR 178 CO 0.20 0.33 0.03 -1.12 -1.11 0.00 0.00 175.55 173.88 1mnu s SER 179 N -3.55 0.37 0.18 2.29 0.01 -1.26 -0.83 113.70 110.91 1mnu s SER 179 Ca 0.33 -0.86 -0.18 0.00 1.31 0.00 0.00 55.95 56.55 1mnu s SER 179 Cb 0.06 0.23 0.03 0.00 0.21 0.00 0.00 66.02 66.55 1mnu s SER 179 CO 0.15 -0.61 0.51 0.00 0.41 0.00 0.00 173.24 173.70 1mnu s MET 180 N -3.72 1.33 -0.02 12.44 0.23 1.00 -1.40 119.30 129.16 1mnu s MET 180 Ca 0.05 -0.80 0.07 0.00 -1.03 0.00 0.00 55.69 53.97 1mnu s MET 180 Cb 0.06 0.52 -0.02 0.00 -1.53 0.00 0.00 34.83 33.86 1mnu s MET 180 CO -0.10 -0.56 -0.22 -1.54 -2.03 0.00 0.00 175.02 170.58 1mnu s SER 181 N -2.85 2.55 -0.16 -1.18 1.04 0.51 -1.03 113.70 112.58 1mnu s SER 181 Ca 0.07 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.12 1mnu s SER 181 Cb -0.01 -0.30 0.03 0.00 0.10 0.00 0.00 66.02 65.84 1mnu s SER 181 CO -0.05 0.26 -0.14 -0.55 0.98 0.00 0.00 173.24 173.75 1mnu s SER 182 N -0.49 2.83 -0.13 7.02 0.15 0.10 -1.58 113.70 121.59 1mnu s SER 182 Ca 0.08 -0.56 0.02 0.00 0.70 0.00 0.00 55.95 56.19 1mnu s SER 182 Cb -0.08 -1.20 0.00 0.00 -1.71 0.00 0.00 66.02 63.02 1mnu s SER 182 CO -0.01 -0.07 -0.21 -0.89 1.20 0.00 0.00 173.24 173.27 1mnu s THR 183 N 1.46 2.26 -0.33 6.45 2.01 0.20 -0.58 115.64 127.11 1mnu s THR 183 Ca 0.04 -0.93 -0.08 0.00 0.31 0.00 0.00 61.69 61.03 1mnu s THR 183 Cb -0.13 -1.90 0.02 0.00 0.01 0.00 0.00 72.50 70.50 1mnu s THR 183 CO -0.10 0.54 0.12 -0.22 -0.69 0.00 0.00 174.62 174.27 1mnu s LEU 184 N 0.60 4.22 -0.28 4.42 2.96 0.11 -0.89 118.68 129.82 1mnu s LEU 184 Ca -0.11 -0.90 -0.08 0.00 -0.22 0.00 0.00 54.13 52.81 1mnu s LEU 184 Cb -0.16 -1.92 -0.02 0.00 0.50 0.00 0.00 46.19 44.59 1mnu s LEU 184 CO 0.03 -0.28 0.11 -0.89 -1.32 0.00 0.00 176.35 174.00 1mnu s THR 185 N 1.49 4.47 0.46 3.68 2.01 -0.46 -0.39 115.64 126.91 1mnu s THR 185 Ca 0.01 -0.30 0.03 0.00 0.31 0.00 0.00 61.69 61.74 1mnu s THR 185 Cb -0.18 -3.19 -0.03 0.00 0.01 0.00 0.00 72.50 69.10 1mnu s THR 185 CO 0.04 0.20 0.02 -0.76 -0.69 0.00 0.00 174.62 173.43 1mnu s LEU 186 N 1.61 2.39 0.36 4.42 1.43 0.56 -4.82 118.68 124.63 1mnu s LEU 186 Ca 0.05 -1.58 -0.06 0.00 -1.03 0.00 0.00 54.13 51.52 1mnu s LEU 186 Cb -0.16 -0.68 -0.05 0.00 0.03 0.00 0.00 46.19 45.33 1mnu s LEU 186 CO 0.05 -0.75 0.66 0.42 0.23 0.00 0.00 176.35 176.95 1mnu s THR 187 N -2.90 4.94 0.20 5.49 -4.23 -1.26 -2.07 115.64 115.80 1mnu s THR 187 Ca 0.16 0.19 -0.11 0.00 -1.18 0.00 0.00 61.69 60.75 1mnu s THR 187 Cb 0.04 -3.77 0.11 0.00 1.34 0.00 0.00 72.50 70.22 1mnu s THR 187 CO 0.09 -0.50 1.81 0.50 -0.54 0.00 0.00 174.62 175.98 1mnu h LYS 188 N 1.20 0.64 -0.70 3.99 3.64 -1.61 0.15 116.57 123.89 1mnu h LYS 188 Ca -0.48 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 58.91 1mnu h LYS 188 Cb 1.19 -0.15 -0.05 0.00 -0.41 0.00 0.00 32.23 32.82 1mnu h LYS 188 CO 0.64 0.43 0.42 -0.44 -2.27 0.00 0.00 179.45 178.22 1mnu h ASP 189 N 0.66 0.65 -0.31 4.20 3.32 -1.94 -0.51 116.42 122.49 1mnu h ASP 189 Ca 0.26 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.29 1mnu h ASP 189 Cb 0.10 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1mnu h ASP 189 CO -0.14 0.44 0.05 -0.08 -1.72 0.00 0.00 179.24 177.79 1mnu h GLU 190 N 0.79 0.51 -0.63 3.56 4.57 -1.72 -2.69 114.58 118.97 1mnu h GLU 190 Ca 0.30 -0.14 0.05 0.00 -1.18 0.00 0.00 59.36 58.39 1mnu h GLU 190 Cb 0.11 -0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 28.59 1mnu h GLU 190 CO -0.15 0.61 0.36 -0.92 -1.18 0.00 0.00 179.01 177.73 1mnu h TYR 191 N 0.34 0.66 0.00 0.92 3.20 -0.13 -1.88 116.97 120.08 1mnu h TYR 191 Ca 0.09 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.99 1mnu h TYR 191 Cb 0.34 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.40 1mnu h TYR 191 CO 0.02 0.34 0.00 0.39 -1.64 0.00 0.00 178.16 177.27 1mnu n GLU 192 N -4.78 0.14 0.00 1.82 1.02 -0.25 -2.81 120.64 115.78 1mnu n GLU 192 Ca 0.07 0.10 0.14 0.00 -0.02 0.00 0.00 57.16 57.46 1mnu n GLU 192 Cb 0.14 -1.50 0.66 0.00 -0.02 0.00 0.00 31.44 30.72 1mnu n GLU 192 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1mnu n ARG 193 N -1.41 0.94 -4.24 3.49 1.74 -0.71 -4.89 116.66 111.59 1mnu n ARG 193 Ca 0.08 -0.33 -0.13 0.00 -0.77 0.00 0.00 57.85 56.69 1mnu n ARG 193 Cb 0.22 -1.49 -0.10 0.00 -1.02 0.00 0.00 32.46 30.07 1mnu n ARG 193 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1mnu s HIS 194 N -2.28 1.19 -0.01 -1.55 3.76 -1.12 -5.11 115.29 110.16 1mnu s HIS 194 Ca 0.34 -0.95 -0.02 0.00 -0.15 0.00 0.00 55.06 54.28 1mnu s HIS 194 Cb 0.21 -0.67 -0.01 0.00 1.11 0.00 0.00 32.58 33.22 1mnu s HIS 194 CO 0.43 -0.14 -0.04 -1.71 -0.85 0.00 0.00 174.74 172.42 1mnu n ASN 195 N -0.22 0.32 -4.73 1.40 4.05 -1.26 -4.76 115.26 110.07 1mnu n ASN 195 Ca -0.08 0.05 -0.42 0.00 0.45 0.00 0.00 54.58 54.59 1mnu n ASN 195 Cb 0.62 -0.34 -0.03 0.00 1.23 0.00 0.00 39.78 41.27 1mnu n ASN 195 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 177.26 173.77 1mnu s SER 196 N -4.74 7.05 -0.17 1.20 0.01 -1.26 -1.55 113.70 114.23 1mnu s SER 196 Ca -0.03 2.19 -0.00 0.00 1.31 0.00 0.00 55.95 59.41 1mnu s SER 196 Cb 0.00 -2.60 0.04 0.00 0.21 0.00 0.00 66.02 63.68 1mnu s SER 196 CO 0.05 -0.44 -0.07 -0.31 0.41 0.00 0.00 173.24 172.88 1mnu s TYR 197 N 0.41 1.92 -0.02 2.43 2.02 -0.68 -1.16 117.35 122.28 1mnu s TYR 197 Ca 0.56 -1.21 0.06 0.00 -0.37 0.00 0.00 57.07 56.11 1mnu s TYR 197 Cb -0.32 -1.42 -0.01 0.00 -0.40 0.00 0.00 41.96 39.80 1mnu s TYR 197 CO 0.34 -0.65 -0.20 0.99 -1.57 0.00 0.00 175.55 174.46 1mnu s THR 198 N 1.56 1.61 -0.18 -0.71 2.01 -0.19 -2.35 115.64 117.39 1mnu s THR 198 Ca 0.01 -0.86 -0.01 0.00 0.31 0.00 0.00 61.69 61.14 1mnu s THR 198 Cb -0.15 -1.34 0.00 0.00 0.01 0.00 0.00 72.50 71.02 1mnu s THR 198 CO -0.08 0.46 -0.13 0.00 -0.69 0.00 0.00 174.62 174.17 1mnu s GLU 200 N 1.17 2.81 -0.17 0.00 2.02 0.16 -2.01 118.70 122.69 1mnu s GLU 200 Ca 0.02 -0.77 -0.03 0.00 0.02 0.00 0.00 54.97 54.21 1mnu s GLU 200 Cb -0.14 -2.39 -0.02 0.00 0.10 0.00 0.00 34.13 31.67 1mnu s GLU 200 CO -0.05 -0.15 -0.05 0.00 0.02 0.00 0.00 175.26 175.03 1mnu s ALA 201 N 1.16 2.90 -0.20 5.21 0.00 -0.68 0.53 121.76 130.69 1mnu s ALA 201 Ca 0.01 -0.92 -0.02 0.00 0.00 0.00 0.00 51.96 51.02 1mnu s ALA 201 Cb -0.14 -1.56 0.00 0.00 0.00 0.00 0.00 23.12 21.43 1mnu s ALA 201 CO -0.09 0.04 -0.10 0.99 0.00 0.00 0.00 175.76 176.60 1mnu s THR 202 N 0.67 2.87 0.03 0.00 2.01 0.11 -0.09 115.64 121.24 1mnu s THR 202 Ca -0.03 -0.66 0.02 0.00 0.31 0.00 0.00 61.69 61.33 1mnu s THR 202 Cb -0.15 -2.28 -0.02 0.00 0.01 0.00 0.00 72.50 70.07 1mnu s THR 202 CO 0.02 0.47 -0.07 -2.28 -0.69 0.00 0.00 174.62 172.08 1mnu s HIS 203 N 1.39 0.57 0.56 4.92 5.04 -1.26 -1.51 115.29 125.00 1mnu s HIS 203 Ca 0.05 -0.37 0.34 0.00 -1.54 0.00 0.00 55.06 53.54 1mnu s HIS 203 Cb -0.14 -0.35 1.49 0.00 0.04 0.00 0.00 32.58 33.62 1mnu s HIS 203 CO -0.07 -0.07 1.78 1.57 -2.34 0.00 0.00 174.74 175.61 1mnu h LYS 204 N 4.98 0.00 0.00 2.88 2.10 -1.96 -1.18 116.57 123.39 1mnu h LYS 204 Ca -0.33 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.32 1mnu h LYS 204 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 1mnu h LYS 204 CO 0.44 0.00 0.02 0.25 -2.00 0.00 0.00 179.45 178.16 1mnu n THR 205 N -4.00 0.65 -3.53 0.07 -2.24 -1.26 -4.68 114.28 99.29 1mnu n THR 205 Ca 0.22 0.19 -0.08 0.00 -2.27 0.00 0.00 64.05 62.10 1mnu n THR 205 Cb 1.17 -1.19 -0.03 0.00 -2.10 0.00 0.00 70.33 68.19 1mnu n THR 205 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1mnu s SER 206 N -2.25 -0.34 -0.04 3.42 0.15 -0.45 -4.97 113.70 109.23 1mnu s SER 206 Ca 0.00 0.10 -0.12 0.00 0.70 0.00 0.00 55.95 56.63 1mnu s SER 206 Cb 0.00 0.33 -0.32 0.00 -1.71 0.00 0.00 66.02 64.32 1mnu s SER 206 CO 0.00 -0.50 0.72 0.71 1.20 0.00 0.00 173.24 175.38 1mnu h THR 207 N 2.15 1.00 -3.35 6.45 1.35 -1.83 -3.41 112.91 115.27 1mnu h THR 207 Ca -0.19 -2.54 -0.57 0.00 -0.55 0.00 0.00 66.41 62.56 1mnu h THR 207 Cb 1.21 2.82 -0.07 0.00 -1.73 0.00 0.00 68.15 70.38 1mnu h THR 207 CO 0.30 0.85 0.22 -0.44 -0.25 0.00 0.00 175.52 176.20 1mnu s SER 208 N -7.35 6.93 1.05 5.36 0.01 -1.26 -4.99 113.70 113.45 1mnu s SER 208 Ca -0.15 1.14 -0.12 0.00 1.31 0.00 0.00 55.95 58.13 1mnu s SER 208 Cb 0.05 -2.42 0.22 0.00 0.21 0.00 0.00 66.02 64.08 1mnu s SER 208 CO 0.87 -0.26 1.07 -2.16 0.41 0.00 0.00 173.24 173.17 1mnu s PRO 209 N 1.54 -0.00 -0.06 12.44 0.04 -1.26 -4.91 135.00 142.79 1mnu s PRO 209 Ca 0.37 1.03 -0.18 0.00 0.04 0.00 0.00 61.00 62.26 1mnu s PRO 209 Cb -0.17 -1.65 -0.05 0.00 0.04 0.00 0.00 34.50 32.68 1mnu s PRO 209 CO 0.15 -3.16 0.50 0.42 0.04 0.00 0.00 177.00 174.95 1mnu s ILE 210 N -2.60 5.06 -0.10 0.56 -1.09 0.87 -4.89 121.20 119.01 1mnu s ILE 210 Ca 0.67 1.03 0.02 0.00 -2.23 0.00 0.00 60.65 60.15 1mnu s ILE 210 Cb -0.23 -3.84 0.01 0.00 -1.58 0.00 0.00 42.46 36.82 1mnu s ILE 210 CO 0.61 0.40 -0.17 0.68 -1.23 0.00 0.00 174.94 175.24 1mnu s VAL 211 N 0.03 1.57 -0.05 2.92 -7.23 -1.26 -1.68 120.40 114.69 1mnu s VAL 211 Ca 0.27 -0.71 0.06 0.00 -1.81 0.00 0.00 61.98 59.79 1mnu s VAL 211 Cb -0.16 -1.41 -0.01 0.00 0.56 0.00 0.00 36.38 35.36 1mnu s VAL 211 CO 0.13 0.45 -0.23 -0.54 -0.31 0.00 0.00 175.10 174.61 1mnu s LYS 212 N 0.73 2.35 0.17 4.82 -0.14 -0.85 -5.01 119.74 121.80 1mnu s LYS 212 Ca -0.12 -0.82 -0.15 0.00 -1.36 0.00 0.00 55.97 53.52 1mnu s LYS 212 Cb -0.16 -1.99 0.02 0.00 -1.68 0.00 0.00 37.83 34.02 1mnu s LYS 212 CO 0.02 0.33 0.45 0.45 -0.76 0.00 0.00 175.35 175.85 1mnu s SER 213 N -0.09 -0.19 -0.03 2.83 0.15 -1.26 -1.12 113.70 113.99 1mnu s SER 213 Ca -0.04 -0.53 -0.28 0.00 0.70 0.00 0.00 55.95 55.80 1mnu s SER 213 Cb -0.13 0.53 0.06 0.00 -1.71 0.00 0.00 66.02 64.77 1mnu s SER 213 CO 0.03 -0.98 0.62 0.72 1.20 0.00 0.00 173.24 174.83 1mnu s PHE 214 N -3.88 -0.57 -0.18 3.44 -0.12 -0.99 -5.01 117.98 110.66 1mnu s PHE 214 Ca 0.10 0.95 -0.05 0.00 -0.05 0.00 0.00 56.93 57.87 1mnu s PHE 214 Cb 0.00 0.37 -0.03 0.00 -0.63 0.00 0.00 43.02 42.73 1mnu s PHE 214 CO -0.04 -0.59 -0.01 -0.80 -0.05 0.00 0.00 175.22 173.73 1mnu s ASN 215 N -1.30 4.94 0.29 1.98 0.01 -1.26 -1.68 114.94 117.91 1mnu s ASN 215 Ca -0.11 -0.13 0.01 0.00 -0.71 0.00 0.00 52.86 51.92 1mnu s ASN 215 Cb -0.01 -1.83 0.52 0.00 0.41 0.00 0.00 41.25 40.35 1mnu s ASN 215 CO 0.08 0.13 1.88 -0.09 -1.51 0.00 0.00 177.10 177.58 1mnu h ARG 216 N 7.03 1.01 0.00 -0.60 2.43 -1.58 0.20 114.38 122.87 1mnu h ARG 216 Ca -0.34 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 1mnu h ARG 216 Cb 1.18 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.50 1mnu h ARG 216 CO 0.63 0.67 0.02 0.09 -1.51 0.00 0.00 179.97 179.87 1mnu n ASN 217 N -4.54 0.00 -0.08 -3.80 3.02 -1.26 -2.90 115.26 105.70 1mnu n ASN 217 Ca 0.16 0.42 0.02 0.00 -0.03 0.00 0.00 54.58 55.15 1mnu n ASN 217 Cb 0.26 -0.42 0.03 0.00 -0.61 0.00 0.00 39.78 39.05 1mnu n ASN 217 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1mnu n GLU 218 N -1.42 1.51 0.00 3.52 1.02 0.68 -5.24 120.64 120.71 1mnu n GLU 218 Ca 0.00 -1.41 0.00 0.00 -0.02 0.00 0.00 57.16 55.73 1mnu n GLU 218 Cb 0.02 -0.92 0.00 0.00 -0.02 0.00 0.00 31.44 30.53 1mnu n GLU 218 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31