#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n13 s MET 55 N 0.00 3.99 0.61 0.38 -2.45 -0.34 -4.94 119.30 116.55 1n13 s MET 55 Ca 0.00 0.40 -0.19 0.00 -1.25 0.00 0.00 55.69 54.66 1n13 s MET 55 Cb 0.00 -3.70 -0.03 0.00 1.25 0.00 0.00 34.83 32.35 1n13 s MET 55 CO 0.00 -0.51 1.14 -2.30 1.05 0.00 0.00 175.02 174.40 1n13 n PRO 56 N 5.81 1.07 -1.65 4.11 -0.02 -1.26 -0.76 135.00 142.31 1n13 n PRO 56 Ca -0.01 0.42 -0.42 0.00 -2.02 0.00 0.00 63.50 61.47 1n13 n PRO 56 Cb 0.49 -2.35 0.01 0.00 -0.02 0.00 0.00 33.50 31.62 1n13 n PRO 56 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1n13 n PRO 57 N -1.34 1.63 -0.65 0.52 -0.02 -1.26 -1.49 135.00 132.38 1n13 n PRO 57 Ca 0.14 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1n13 n PRO 57 Cb 0.47 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 1n13 n PRO 57 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1n13 n GLU 58 N 0.25 0.00 -1.18 -0.52 1.02 -1.25 -4.98 120.64 113.99 1n13 n GLU 58 Ca 0.08 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 56.91 1n13 n GLU 58 Cb 0.38 -3.53 0.10 0.00 -0.02 0.00 0.00 31.44 28.37 1n13 n GLU 58 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1n13 s ALA 59 N -2.30 2.13 0.03 0.62 0.00 -0.56 -5.04 121.76 116.63 1n13 s ALA 59 Ca 0.00 0.30 0.05 0.00 0.00 0.00 0.00 51.96 52.32 1n13 s ALA 59 Cb 0.00 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.80 1n13 s ALA 59 CO 0.00 -1.92 -0.16 -2.00 0.00 0.00 0.00 175.76 171.68 1n13 s GLU 60 N -4.87 1.10 -0.23 0.00 2.12 -1.26 -5.00 118.70 110.56 1n13 s GLU 60 Ca 0.62 -0.74 -0.27 0.00 0.36 0.00 0.00 54.97 54.94 1n13 s GLU 60 Cb -0.18 -1.13 0.00 0.00 0.26 0.00 0.00 34.13 33.09 1n13 s GLU 60 CO 0.56 0.29 0.94 0.42 -0.54 0.00 0.00 175.26 176.93 1n13 s ILE 61 N -0.71 4.76 0.17 -3.70 1.01 -1.26 -5.02 121.20 116.45 1n13 s ILE 61 Ca 0.04 1.81 0.02 0.00 0.00 0.00 0.00 60.65 62.53 1n13 s ILE 61 Cb -0.07 -4.22 -0.05 0.00 0.01 0.00 0.00 42.46 38.13 1n13 s ILE 61 CO 0.01 -0.12 -0.02 0.68 0.00 0.00 0.00 174.94 175.49 1n13 s VAL 62 N 2.96 0.79 0.76 2.92 -7.23 -1.26 -5.14 120.40 114.20 1n13 s VAL 62 Ca 0.40 -1.99 -0.13 0.00 -1.81 0.00 0.00 61.98 58.44 1n13 s VAL 62 Cb -0.15 -2.06 0.06 0.00 0.56 0.00 0.00 36.38 34.79 1n13 s VAL 62 CO 0.07 -0.54 1.16 -2.84 -0.31 0.00 0.00 175.10 172.64 1n13 s PRO 63 N -3.88 2.04 -0.01 4.82 0.02 -1.26 -4.86 135.00 131.88 1n13 s PRO 63 Ca 0.22 1.59 -0.34 0.00 0.02 0.00 0.00 61.00 62.48 1n13 s PRO 63 Cb 0.05 -1.84 -0.13 0.00 0.02 0.00 0.00 34.50 32.61 1n13 s PRO 63 CO 0.03 -1.87 1.77 -0.11 -0.33 0.00 0.00 177.00 176.49 1n13 n LEU 64 N -3.06 3.27 -4.73 -5.54 7.94 -1.26 -4.95 117.00 108.67 1n13 n LEU 64 Ca 0.12 1.01 -0.29 0.00 -1.11 0.00 0.00 56.01 55.75 1n13 n LEU 64 Cb 0.51 -1.38 0.15 0.00 0.53 0.00 0.00 43.42 43.24 1n13 n LEU 64 CO 0.49 -0.16 0.67 -2.84 -1.11 0.00 0.00 177.39 174.44 1n13 s PRO 65 N 2.98 0.88 -0.68 1.96 0.02 -1.26 -4.93 135.00 133.97 1n13 s PRO 65 Ca 0.88 0.49 -0.27 0.00 0.02 0.00 0.00 61.00 62.12 1n13 s PRO 65 Cb -0.70 -1.79 0.03 0.00 0.02 0.00 0.00 34.50 32.05 1n13 s PRO 65 CO 0.48 -2.42 1.29 0.21 -0.33 0.00 0.00 177.00 176.23 1n13 s LYS 66 N -5.07 3.26 0.01 5.54 2.20 -1.26 -4.99 119.74 119.43 1n13 s LYS 66 Ca 0.64 -0.03 -0.22 0.00 -0.36 0.00 0.00 55.97 56.00 1n13 s LYS 66 Cb -0.17 -4.14 -0.05 0.00 -1.51 0.00 0.00 37.83 31.96 1n13 s LYS 66 CO 0.56 -2.04 0.66 -0.51 -0.36 0.00 0.00 175.35 173.66 1n13 s LEU 67 N 5.69 4.42 0.25 5.43 1.43 -1.26 -5.04 118.68 129.60 1n13 s LEU 67 Ca 0.40 1.26 -0.30 0.00 -1.03 0.00 0.00 54.13 54.46 1n13 s LEU 67 Cb -0.08 -3.04 -0.10 0.00 0.03 0.00 0.00 46.19 43.01 1n13 s LEU 67 CO 0.19 0.06 1.35 -2.84 0.23 0.00 0.00 176.35 175.33 1n13 s PRO 68 N -0.08 4.35 0.30 1.29 0.02 -1.26 -4.92 135.00 134.69 1n13 s PRO 68 Ca 0.34 2.17 -0.30 0.00 0.02 0.00 0.00 61.00 63.23 1n13 s PRO 68 Cb -0.19 -3.14 -0.12 0.00 0.02 0.00 0.00 34.50 31.08 1n13 s PRO 68 CO 0.19 -0.28 1.54 -1.33 -0.33 0.00 0.00 177.00 176.80 1n13 n MET 69 N 2.04 2.58 -0.21 5.54 2.81 -1.26 -1.90 117.12 126.72 1n13 n MET 69 Ca 0.05 0.91 0.00 0.00 -1.81 0.00 0.00 57.70 56.85 1n13 n MET 69 Cb 0.42 -2.66 0.00 0.00 -0.71 0.00 0.00 33.22 30.26 1n13 n MET 69 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1n13 n GLY 70 N 1.92 1.21 3.67 3.03 0.00 -1.26 -5.03 105.19 108.72 1n13 n GLY 70 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1n13 n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n13 n ALA 71 N -0.76 0.83 -2.99 4.61 0.00 -0.80 -4.91 120.51 116.49 1n13 n ALA 71 Ca 0.00 0.19 -0.44 0.00 0.00 0.00 0.00 53.44 53.19 1n13 n ALA 71 Cb 0.00 -2.20 -0.03 0.00 0.00 0.00 0.00 19.45 17.22 1n13 n ALA 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1n13 s LEU 72 N -1.68 5.09 -0.34 0.00 1.43 -1.26 -5.01 118.68 116.92 1n13 s LEU 72 Ca 0.66 -1.63 -0.12 0.00 -1.03 0.00 0.00 54.13 52.00 1n13 s LEU 72 Cb -0.49 -2.36 -0.01 0.00 0.03 0.00 0.00 46.19 43.35 1n13 s LEU 72 CO 0.54 -1.15 0.23 -0.69 0.23 0.00 0.00 176.35 175.51 1n13 s VAL 73 N 2.87 5.16 -0.02 -1.59 1.01 -1.26 -5.05 120.40 121.52 1n13 s VAL 73 Ca 0.23 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.65 1n13 s VAL 73 Cb -0.14 -3.65 -0.07 0.00 0.00 0.00 0.00 36.38 32.52 1n13 s VAL 73 CO 0.00 -0.00 1.77 -2.84 0.00 0.00 0.00 175.10 174.03 1n13 s PRO 74 N 1.70 4.16 -0.02 2.72 0.02 -1.25 -4.89 135.00 137.44 1n13 s PRO 74 Ca 0.06 2.35 0.00 0.00 0.02 0.00 0.00 61.00 63.42 1n13 s PRO 74 Cb -0.17 -4.05 0.02 0.00 0.02 0.00 0.00 34.50 30.32 1n13 s PRO 74 CO 0.10 -0.89 0.02 0.99 -0.33 0.00 0.00 177.00 176.88 1n13 s THR 75 N 4.22 -0.01 -0.16 0.99 2.01 -1.26 -0.69 115.64 120.75 1n13 s THR 75 Ca 0.79 0.15 -0.13 0.00 0.31 0.00 0.00 61.69 62.81 1n13 s THR 75 Cb -0.37 -0.10 -0.05 0.00 0.01 0.00 0.00 72.50 72.00 1n13 s THR 75 CO 0.34 0.08 0.27 0.00 -0.69 0.00 0.00 174.62 174.62 1n13 s ALA 76 N 0.84 3.62 0.12 7.40 0.00 -0.56 -4.95 121.76 128.24 1n13 s ALA 76 Ca -0.07 -0.48 -0.16 0.00 0.00 0.00 0.00 51.96 51.24 1n13 s ALA 76 Cb -0.10 -2.34 0.04 0.00 0.00 0.00 0.00 23.12 20.71 1n13 s ALA 76 CO -0.02 0.14 0.40 1.52 0.00 0.00 0.00 175.76 177.80 1n13 s TYR 77 N 0.30 -0.21 0.02 0.00 -0.85 -1.26 -0.40 117.35 114.96 1n13 s TYR 77 Ca 0.16 -0.11 0.03 0.00 -0.52 0.00 0.00 57.07 56.63 1n13 s TYR 77 Cb -0.13 0.26 -0.02 0.00 0.38 0.00 0.00 41.96 42.45 1n13 s TYR 77 CO 0.04 -0.70 -0.10 0.20 -1.52 0.00 0.00 175.55 173.46 1n13 s GLY 78 N -2.80 0.58 0.11 5.49 0.00 -0.20 -4.95 107.32 105.54 1n13 s GLY 78 Ca 0.03 -0.64 -0.15 0.00 0.00 0.00 0.00 44.72 43.96 1n13 s GLY 78 CO -0.12 -0.62 0.37 -2.52 0.00 0.00 0.00 173.10 170.20 1n13 s TYR 79 N -0.75 -0.15 -0.08 1.90 -0.85 -1.26 -1.42 117.35 114.74 1n13 s TYR 79 Ca -0.01 -0.17 -0.06 0.00 -0.52 0.00 0.00 57.07 56.32 1n13 s TYR 79 Cb -0.07 0.20 0.03 0.00 0.38 0.00 0.00 41.96 42.51 1n13 s TYR 79 CO 0.01 -0.67 0.20 -1.50 -1.52 0.00 0.00 175.55 172.07 1n13 s ILE 80 N -3.72 -0.02 -0.03 -3.49 2.07 -0.47 -4.89 121.20 110.65 1n13 s ILE 80 Ca 0.03 0.08 0.07 0.00 -1.41 0.00 0.00 60.65 59.41 1n13 s ILE 80 Cb 0.02 -0.30 -0.02 0.00 0.13 0.00 0.00 42.46 42.30 1n13 s ILE 80 CO -0.11 0.03 -0.23 -0.63 -1.91 0.00 0.00 174.94 172.09 1n13 s ILE 81 N 0.65 1.86 -0.04 2.00 1.01 -1.26 -1.24 121.20 124.19 1n13 s ILE 81 Ca -0.05 -0.99 -0.07 0.00 0.00 0.00 0.00 60.65 59.55 1n13 s ILE 81 Cb -0.06 -1.56 0.01 0.00 0.01 0.00 0.00 42.46 40.86 1n13 s ILE 81 CO -0.04 0.53 0.16 -0.55 0.00 0.00 0.00 174.94 175.04 1n13 s SER 82 N -0.41 -0.09 -0.17 3.58 0.15 -0.64 -5.02 113.70 111.10 1n13 s SER 82 Ca 0.05 0.11 0.17 0.00 0.70 0.00 0.00 55.95 56.99 1n13 s SER 82 Cb -0.10 0.29 0.45 0.00 -1.71 0.00 0.00 66.02 64.94 1n13 s SER 82 CO 0.00 -0.19 1.33 -0.90 1.20 0.00 0.00 173.24 174.68 1n13 n ASP 83 N 2.34 3.26 -4.50 5.45 5.68 -1.26 -1.56 116.55 125.96 1n13 n ASP 83 Ca -0.17 -3.10 -0.43 0.00 -0.50 0.00 0.00 54.79 50.60 1n13 n ASP 83 Cb 0.57 -0.51 -0.08 0.00 -1.14 0.00 0.00 41.12 39.96 1n13 n ASP 83 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1n13 s VAL 84 N -2.88 5.04 0.27 2.12 1.01 -1.26 -4.81 120.40 119.89 1n13 s VAL 84 Ca 0.39 -0.16 -0.30 0.00 0.00 0.00 0.00 61.98 61.91 1n13 s VAL 84 Cb 0.33 -4.05 -0.13 0.00 0.00 0.00 0.00 36.38 32.53 1n13 s VAL 84 CO 0.06 -0.41 1.39 -2.65 0.00 0.00 0.00 175.10 173.49 1n13 n PRO 85 N 5.73 2.12 0.00 2.72 -0.02 -1.26 -2.01 135.00 142.27 1n13 n PRO 85 Ca -0.06 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1n13 n PRO 85 Cb 0.48 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.56 1n13 n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n13 n GLY 86 N 1.77 2.98 3.76 -1.23 0.00 0.21 -4.98 105.19 107.70 1n13 n GLY 86 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1n13 n GLY 86 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1n13 s GLU 87 N 0.00 4.51 -0.23 1.61 2.12 -0.85 -4.66 118.70 121.20 1n13 s GLU 87 Ca 0.00 1.95 -0.10 0.00 0.36 0.00 0.00 54.97 57.18 1n13 s GLU 87 Cb 0.00 -3.17 -0.05 0.00 0.26 0.00 0.00 34.13 31.17 1n13 s GLU 87 CO 0.00 0.01 0.15 0.99 -0.54 0.00 0.00 175.26 175.86 1n13 s THR 88 N -0.83 5.27 0.08 -1.70 2.01 -1.26 -0.41 115.64 118.80 1n13 s THR 88 Ca 0.48 0.15 0.08 0.00 0.31 0.00 0.00 61.69 62.71 1n13 s THR 88 Cb -0.35 -3.45 -0.03 0.00 0.01 0.00 0.00 72.50 68.68 1n13 s THR 88 CO 0.43 0.36 -0.21 0.27 -0.69 0.00 0.00 174.62 174.78 1n13 s ILE 89 N 0.99 1.74 0.06 1.82 -4.36 -0.10 -3.26 121.20 118.09 1n13 s ILE 89 Ca 0.07 -1.42 0.00 0.00 -0.26 0.00 0.00 60.65 59.04 1n13 s ILE 89 Cb -0.13 -1.55 -0.04 0.00 1.25 0.00 0.00 42.46 41.99 1n13 s ILE 89 CO 0.04 0.06 -0.04 -0.44 0.24 0.00 0.00 174.94 174.79 1n13 s SER 90 N -1.63 0.69 -0.01 4.36 0.01 -0.20 -0.29 113.70 116.63 1n13 s SER 90 Ca 0.07 -0.96 -0.02 0.00 1.31 0.00 0.00 55.95 56.35 1n13 s SER 90 Cb -0.10 0.16 0.00 0.00 0.21 0.00 0.00 66.02 66.29 1n13 s SER 90 CO 0.03 -0.53 0.04 0.00 0.41 0.00 0.00 173.24 173.20 1n13 s ALA 91 N -3.62 -0.09 0.04 1.44 0.00 -0.58 -1.77 121.76 117.18 1n13 s ALA 91 Ca 0.07 0.01 -0.06 0.00 0.00 0.00 0.00 51.96 51.99 1n13 s ALA 91 Cb 0.06 -0.03 -0.01 0.00 0.00 0.00 0.00 23.12 23.13 1n13 s ALA 91 CO -0.08 -0.05 0.10 0.00 0.00 0.00 0.00 175.76 175.73 1n13 s ALA 92 N -0.27 -0.05 0.01 0.00 0.00 0.32 -1.25 121.76 120.52 1n13 s ALA 92 Ca -0.03 -0.60 0.01 0.00 0.00 0.00 0.00 51.96 51.34 1n13 s ALA 92 Cb -0.02 0.28 -0.01 0.00 0.00 0.00 0.00 23.12 23.37 1n13 s ALA 92 CO -0.00 -0.35 -0.05 -1.50 0.00 0.00 0.00 175.76 173.87 1n13 s ILE 93 N -2.85 0.36 0.04 0.00 1.10 -0.46 -1.39 121.20 118.00 1n13 s ILE 93 Ca -0.03 -0.39 -0.01 0.00 -0.51 0.00 0.00 60.65 59.71 1n13 s ILE 93 Cb 0.00 -0.34 -0.03 0.00 0.15 0.00 0.00 42.46 42.24 1n13 s ILE 93 CO -0.06 -0.03 -0.02 -0.94 -2.11 0.00 0.00 174.94 171.79 1n13 s SER 94 N -0.45 0.38 -0.09 4.50 1.04 -0.24 -1.79 113.70 117.04 1n13 s SER 94 Ca -0.02 -0.79 -0.03 0.00 0.48 0.00 0.00 55.95 55.59 1n13 s SER 94 Cb -0.04 0.17 0.04 0.00 0.10 0.00 0.00 66.02 66.30 1n13 s SER 94 CO -0.00 -0.50 0.10 0.54 0.98 0.00 0.00 173.24 174.36 1n13 s VAL 95 N -3.02 -0.15 -0.18 5.02 0.11 0.34 -0.94 120.40 121.59 1n13 s VAL 95 Ca -0.01 0.25 -0.21 0.00 -2.93 0.00 0.00 61.98 59.08 1n13 s VAL 95 Cb 0.01 -0.30 -0.03 0.00 -1.53 0.00 0.00 36.38 34.53 1n13 s VAL 95 CO -0.07 0.05 0.62 0.00 -3.33 0.00 0.00 175.10 172.37 1n13 s ALA 96 N 2.20 3.52 -0.19 1.54 0.00 0.25 -1.47 121.76 127.60 1n13 s ALA 96 Ca 0.04 -0.23 -0.08 0.00 0.00 0.00 0.00 51.96 51.69 1n13 s ALA 96 Cb -0.13 -2.94 -0.04 0.00 0.00 0.00 0.00 23.12 20.01 1n13 s ALA 96 CO -0.05 -0.46 0.07 0.42 0.00 0.00 0.00 175.76 175.74 1n13 s ILE 97 N 1.68 4.83 0.47 0.00 1.01 0.60 -1.25 121.20 128.54 1n13 s ILE 97 Ca 0.29 -0.01 -0.20 0.00 0.00 0.00 0.00 60.65 60.73 1n13 s ILE 97 Cb -0.16 -3.19 -0.09 0.00 0.01 0.00 0.00 42.46 39.03 1n13 s ILE 97 CO 0.11 0.44 1.00 -2.16 0.00 0.00 0.00 174.94 174.33 1n13 s PRO 98 N 0.52 3.95 0.11 2.79 0.04 -1.26 -0.36 135.00 140.78 1n13 s PRO 98 Ca 0.04 1.24 -0.14 0.00 0.04 0.00 0.00 61.00 62.18 1n13 s PRO 98 Cb -0.13 -2.13 -0.09 0.00 0.04 0.00 0.00 34.50 32.20 1n13 s PRO 98 CO 0.01 -0.29 1.42 -0.22 0.04 0.00 0.00 177.00 177.95 1n13 h LYS 99 N 1.61 0.75 -6.67 4.56 3.64 -1.68 -3.40 116.57 115.38 1n13 h LYS 99 Ca -0.49 -0.41 -0.56 0.00 -1.27 0.00 0.00 60.65 57.92 1n13 h LYS 99 Cb 1.20 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.98 1n13 h LYS 99 CO 0.60 1.04 0.96 0.34 -2.27 0.00 0.00 179.45 180.11 1n13 s ASP 100 N -6.64 6.55 0.00 4.20 -1.08 -1.26 -4.90 116.67 113.54 1n13 s ASP 100 Ca -0.12 0.41 0.10 0.00 -0.52 0.00 0.00 52.55 52.42 1n13 s ASP 100 Cb 0.09 -2.55 0.44 0.00 -1.46 0.00 0.00 42.92 39.44 1n13 s ASP 100 CO 0.84 -1.33 1.27 0.29 0.52 0.00 0.00 175.17 176.76 1n13 n LYS 101 N 8.02 0.05 0.05 4.34 4.76 -1.26 -1.66 118.16 132.46 1n13 n LYS 101 Ca 0.12 0.28 0.13 0.00 -2.87 0.00 0.00 58.31 55.97 1n13 n LYS 101 Cb 0.49 -1.50 0.36 0.00 -1.84 0.00 0.00 35.03 32.54 1n13 n LYS 101 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1n13 n SER 102 N -1.42 0.54 -4.96 4.39 3.41 -1.26 -3.76 113.62 110.55 1n13 n SER 102 Ca 0.03 0.28 -0.22 0.00 -0.26 0.00 0.00 58.87 58.71 1n13 n SER 102 Cb 0.10 -0.27 0.04 0.00 -0.26 0.00 0.00 64.21 63.82 1n13 n SER 102 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1n13 s LEU 103 N -3.83 3.28 0.36 1.04 1.43 -0.67 -4.84 118.68 115.46 1n13 s LEU 103 Ca 0.10 0.09 0.05 0.00 -1.03 0.00 0.00 54.13 53.35 1n13 s LEU 103 Cb 0.15 -2.95 -0.01 0.00 0.03 0.00 0.00 46.19 43.42 1n13 s LEU 103 CO 0.64 -1.12 0.51 0.00 0.23 0.00 0.00 176.35 176.61 1n13 s GLY 105 N -4.19 1.78 -0.18 0.00 0.00 0.06 -4.42 107.32 100.36 1n13 s GLY 105 Ca 0.46 -0.60 -0.02 0.00 0.00 0.00 0.00 44.72 44.56 1n13 s GLY 105 CO 0.32 -0.50 -0.10 -2.27 0.00 0.00 0.00 173.10 170.56 1n13 s LEU 106 N -3.69 2.71 -0.19 0.66 2.96 -0.38 -1.20 118.68 119.55 1n13 s LEU 106 Ca 0.43 -0.41 -0.09 0.00 -0.22 0.00 0.00 54.13 53.84 1n13 s LEU 106 Cb -0.11 -1.65 -0.05 0.00 0.50 0.00 0.00 46.19 44.88 1n13 s LEU 106 CO 0.31 0.05 0.12 -0.63 -1.32 0.00 0.00 176.35 174.88 1n13 s ILE 107 N 1.05 5.35 0.08 6.68 1.01 -1.26 -0.58 121.20 133.53 1n13 s ILE 107 Ca -0.00 0.17 0.07 0.00 0.00 0.00 0.00 60.65 60.88 1n13 s ILE 107 Cb -0.15 -3.43 -0.03 0.00 0.01 0.00 0.00 42.46 38.87 1n13 s ILE 107 CO -0.02 0.46 -0.18 -0.04 0.00 0.00 0.00 174.94 175.17 1n13 s MET 108 N 0.19 1.03 0.09 2.79 -1.94 -0.11 -4.76 119.30 116.59 1n13 s MET 108 Ca 0.08 -1.03 0.05 0.00 -1.71 0.00 0.00 55.69 53.09 1n13 s MET 108 Cb -0.11 -1.16 -0.03 0.00 2.01 0.00 0.00 34.83 35.53 1n13 s MET 108 CO -0.01 0.27 -0.14 -1.83 -0.01 0.00 0.00 175.02 173.30 1n13 s GLU 109 N -1.69 0.90 -0.04 2.03 1.03 -1.26 -1.08 118.70 118.58 1n13 s GLU 109 Ca 0.03 -1.07 -0.13 0.00 0.03 0.00 0.00 54.97 53.82 1n13 s GLU 109 Cb -0.10 -0.85 0.02 0.00 -0.80 0.00 0.00 34.13 32.40 1n13 s GLU 109 CO 0.03 0.18 0.30 -0.47 -1.33 0.00 0.00 175.26 173.97 1n13 s TYR 110 N -1.65 -0.21 -0.02 4.83 5.04 -0.48 -4.98 117.35 119.88 1n13 s TYR 110 Ca 0.03 0.40 -0.15 0.00 -2.44 0.00 0.00 57.07 54.91 1n13 s TYR 110 Cb -0.08 0.09 0.02 0.00 0.35 0.00 0.00 41.96 42.35 1n13 s TYR 110 CO 0.02 -0.33 0.31 -1.83 -1.34 0.00 0.00 175.55 172.39 1n13 s GLU 111 N -0.93 0.65 0.00 4.97 1.03 -1.26 -0.52 118.70 122.64 1n13 s GLU 111 Ca -0.10 -0.16 0.00 0.00 0.03 0.00 0.00 54.97 54.74 1n13 s GLU 111 Cb -0.05 0.29 0.00 0.00 -0.80 0.00 0.00 34.13 33.57 1n13 s GLU 111 CO 0.03 -0.18 0.00 0.41 -1.33 0.00 0.00 175.26 174.19 1n13 n GLY 112 N 1.36 -0.31 3.29 -3.83 0.00 -0.73 -5.01 105.19 99.95 1n13 n GLY 112 Ca -0.21 -0.98 -0.44 0.00 0.00 0.00 0.00 46.02 44.39 1n13 n GLY 112 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n13 n LYS 113 N -0.17 3.50 -3.60 1.61 5.02 -1.26 -1.03 118.16 122.23 1n13 n LYS 113 Ca 0.00 -3.87 -0.11 0.00 -2.02 0.00 0.00 58.31 52.31 1n13 n LYS 113 Cb 0.00 -2.94 -0.01 0.00 -0.02 0.00 0.00 35.03 32.07 1n13 n LYS 113 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n13 s SER 115 N -2.88 5.20 0.20 0.00 1.04 -1.26 -3.64 113.70 112.36 1n13 s SER 115 Ca 0.21 0.95 -0.11 0.00 0.48 0.00 0.00 55.95 57.48 1n13 s SER 115 Cb -0.02 -1.69 0.15 0.00 0.10 0.00 0.00 66.02 64.56 1n13 s SER 115 CO 0.15 -1.46 1.87 0.50 0.98 0.00 0.00 173.24 175.28 1n13 h LYS 116 N -0.68 0.91 -0.24 4.02 3.64 -1.92 -1.14 116.57 121.16 1n13 h LYS 116 Ca -0.45 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 1n13 h LYS 116 Cb 1.28 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 1n13 h LYS 116 CO 0.64 0.60 0.16 -0.22 -2.27 0.00 0.00 179.45 178.35 1n13 h LYS 117 N 0.94 0.32 -0.42 1.90 3.64 -1.96 -1.60 116.57 119.39 1n13 h LYS 117 Ca 0.26 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.52 1n13 h LYS 117 Cb -0.08 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 1n13 h LYS 117 CO -0.07 0.22 -0.16 0.93 -2.27 0.00 0.00 179.45 178.11 1n13 h GLU 118 N 0.32 0.78 -0.50 1.90 4.39 -1.87 -1.97 114.58 117.63 1n13 h GLU 118 Ca 0.09 -0.29 -0.06 0.00 0.34 0.00 0.00 59.36 59.44 1n13 h GLU 118 Cb -0.02 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 1n13 h GLU 118 CO -0.02 0.90 0.08 0.00 -1.16 0.00 0.00 179.01 178.81 1n13 h ALA 119 N 1.12 0.66 -0.43 3.43 0.00 -1.04 -1.71 119.26 121.29 1n13 h ALA 119 Ca 0.11 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 1n13 h ALA 119 Cb 0.66 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1n13 h ALA 119 CO 0.05 0.40 -0.22 1.49 0.00 0.00 0.00 179.25 180.97 1n13 h GLU 120 N 0.71 0.87 -0.43 0.00 4.81 -1.19 -1.46 114.58 117.89 1n13 h GLU 120 Ca 0.15 -0.36 -0.02 0.00 -0.13 0.00 0.00 59.36 59.00 1n13 h GLU 120 Cb 0.40 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 1n13 h GLU 120 CO 0.01 1.00 0.18 -0.22 -0.73 0.00 0.00 179.01 179.25 1n13 h LYS 121 N 0.76 0.63 -0.13 1.92 3.64 -1.22 -1.59 116.57 120.58 1n13 h LYS 121 Ca 0.10 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1n13 h LYS 121 Cb 0.76 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 1n13 h LYS 121 CO 0.06 0.57 0.06 1.15 -2.27 0.00 0.00 179.45 179.02 1n13 h THR 122 N 0.54 1.13 -0.15 1.00 2.02 -1.17 -2.05 112.91 114.23 1n13 h THR 122 Ca 0.14 -0.39 -0.07 0.00 0.77 0.00 0.00 66.41 66.87 1n13 h THR 122 Cb 0.17 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 1n13 h THR 122 CO -0.01 0.12 -0.20 1.62 0.37 0.00 0.00 175.52 177.42 1n13 h VAL 123 N 0.07 1.22 -0.44 3.16 3.04 -1.19 -0.92 116.25 121.18 1n13 h VAL 123 Ca 0.04 -0.99 -0.10 0.00 -1.01 0.00 0.00 66.70 64.65 1n13 h VAL 123 Cb 0.14 1.32 -0.01 0.00 -2.01 0.00 0.00 31.29 30.73 1n13 h VAL 123 CO -0.00 0.30 -0.11 0.03 -1.01 0.00 0.00 177.57 176.78 1n13 h ARG 124 N 0.24 0.86 -0.73 4.17 3.08 -1.13 -2.39 114.38 118.48 1n13 h ARG 124 Ca 0.04 -0.33 -0.04 0.00 0.07 0.00 0.00 59.98 59.72 1n13 h ARG 124 Cb 0.49 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 1n13 h ARG 124 CO 0.03 0.96 0.29 1.49 -1.07 0.00 0.00 179.97 181.67 1n13 h GLU 125 N 0.69 1.09 -0.86 0.04 4.57 -0.83 -2.27 114.58 117.01 1n13 h GLU 125 Ca 0.11 -0.20 -0.01 0.00 -1.18 0.00 0.00 59.36 58.08 1n13 h GLU 125 Cb 0.65 -0.18 -0.04 0.00 -0.16 0.00 0.00 28.75 29.02 1n13 h GLU 125 CO 0.04 0.90 0.51 0.52 -1.18 0.00 0.00 179.01 179.80 1n13 h MET 126 N 1.04 1.18 -0.49 1.92 2.86 -1.00 0.20 114.93 120.63 1n13 h MET 126 Ca 0.24 -0.11 -0.12 0.00 -2.06 0.00 0.00 59.70 57.65 1n13 h MET 126 Cb 0.22 -0.24 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 1n13 h MET 126 CO -0.02 0.83 -0.14 0.00 1.06 0.00 0.00 176.91 178.64 1n13 h ALA 127 N 1.36 0.68 -0.72 6.32 0.00 -1.18 -2.21 119.26 123.51 1n13 h ALA 127 Ca 0.31 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1n13 h ALA 127 Cb -0.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1n13 h ALA 127 CO -0.06 0.62 0.19 -0.22 0.00 0.00 0.00 179.25 179.78 1n13 h LYS 128 N 0.83 1.14 -0.64 0.00 3.64 -0.81 -2.23 116.57 118.51 1n13 h LYS 128 Ca 0.12 -0.27 -0.02 0.00 -1.27 0.00 0.00 60.65 59.22 1n13 h LYS 128 Cb 0.71 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.34 1n13 h LYS 128 CO 0.05 0.99 0.31 0.82 -2.27 0.00 0.00 179.45 179.36 1n13 h ILE 129 N 1.09 1.20 -0.65 2.00 2.04 -0.83 -1.12 117.51 121.24 1n13 h ILE 129 Ca 0.23 -0.57 -0.04 0.00 1.00 0.00 0.00 64.86 65.48 1n13 h ILE 129 Cb 0.35 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 1n13 h ILE 129 CO -0.00 0.24 0.24 1.23 0.00 0.00 0.00 178.15 179.85 1n13 h GLY 130 N 0.97 1.04 1.61 5.37 0.00 -0.81 -0.56 103.07 110.69 1n13 h GLY 130 Ca 0.22 -0.56 -0.17 0.00 0.00 0.00 0.00 47.33 46.83 1n13 h GLY 130 CO -0.03 0.53 -0.64 0.74 0.00 0.00 0.00 176.54 177.13 1n13 h PHE 131 N 0.94 0.52 -0.62 5.60 -1.00 -1.00 -2.86 116.94 118.52 1n13 h PHE 131 Ca 0.22 -0.21 -0.07 0.00 2.81 0.00 0.00 57.97 60.71 1n13 h PHE 131 Cb 0.22 -0.09 -0.03 0.00 3.61 0.00 0.00 35.95 39.66 1n13 h PHE 131 CO 0.02 0.93 0.09 1.49 -1.61 0.00 0.00 178.31 179.23 1n13 h GLU 132 N 0.29 1.02 -0.14 1.51 4.81 -0.63 0.24 114.58 121.68 1n13 h GLU 132 Ca -0.01 -0.26 -0.07 0.00 -0.13 0.00 0.00 59.36 58.88 1n13 h GLU 132 Cb 1.19 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.43 1n13 h GLU 132 CO 0.11 0.94 -0.23 0.52 -0.73 0.00 0.00 179.01 179.62 1n13 h MET 133 N 0.96 0.24 0.00 1.92 2.86 -1.06 -2.73 114.93 117.12 1n13 h MET 133 Ca 0.19 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.73 1n13 h MET 133 Cb 0.42 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.06 1n13 h MET 133 CO 0.01 0.47 -0.85 0.00 1.06 0.00 0.00 176.91 177.60 1n13 h ARG 134 N 0.22 0.00 -0.86 1.72 3.08 -1.25 -3.48 114.38 113.81 1n13 h ARG 134 Ca 0.04 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 1n13 h ARG 134 Cb 0.54 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.59 1n13 h ARG 134 CO 0.04 0.05 -0.07 0.41 -1.07 0.00 0.00 179.97 179.33 1n13 n GLY 135 N 1.19 0.46 3.85 0.04 0.00 0.69 -5.05 105.19 106.39 1n13 n GLY 135 Ca -0.00 -0.69 -0.37 0.00 0.00 0.00 0.00 46.02 44.96 1n13 n GLY 135 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1n13 s TRP 136 N -2.49 3.54 0.35 1.61 0.51 -0.40 -5.03 118.94 117.04 1n13 s TRP 136 Ca 0.03 0.48 -0.27 0.00 -2.12 0.00 0.00 56.10 54.23 1n13 s TRP 136 Cb -0.01 -1.92 -0.09 0.00 -0.81 0.00 0.00 33.47 30.64 1n13 s TRP 136 CO 0.04 0.70 1.13 -1.21 -0.51 0.00 0.00 176.95 177.10 1n13 s GLU 137 N -1.01 4.31 -0.17 4.98 2.02 -1.26 -4.67 118.70 122.90 1n13 s GLU 137 Ca 0.15 1.79 -0.09 0.00 0.02 0.00 0.00 54.97 56.84 1n13 s GLU 137 Cb -0.12 -2.86 -0.05 0.00 0.10 0.00 0.00 34.13 31.21 1n13 s GLU 137 CO 0.04 -0.09 0.13 -1.17 0.02 0.00 0.00 175.26 174.20 1n13 s LEU 138 N -2.10 4.28 -0.13 1.80 2.96 -1.26 -2.14 118.68 122.08 1n13 s LEU 138 Ca 0.52 0.32 -0.08 0.00 -0.22 0.00 0.00 54.13 54.67 1n13 s LEU 138 Cb -0.30 -2.08 -0.03 0.00 0.50 0.00 0.00 46.19 44.28 1n13 s LEU 138 CO 0.38 0.27 -0.16 -0.78 -1.32 0.00 0.00 176.35 174.74 1n13 h ASP 139 N 6.02 0.00 -5.28 3.68 1.82 -0.92 -3.41 116.42 118.33 1n13 h ASP 139 Ca -0.46 0.00 0.18 0.00 -0.39 0.00 0.00 57.03 56.36 1n13 h ASP 139 Cb 1.18 0.00 -0.09 0.00 0.68 0.00 0.00 39.33 41.10 1n13 h ASP 139 CO 0.69 0.70 0.51 0.00 -1.61 0.00 0.00 179.24 179.53 1n13 s ARG 140 N -2.13 1.11 -0.11 0.28 1.70 -1.15 -5.00 118.95 113.64 1n13 s ARG 140 Ca -0.13 -0.60 0.01 0.00 -0.47 0.00 0.00 55.73 54.54 1n13 s ARG 140 Cb 0.02 0.39 0.02 0.00 -0.57 0.00 0.00 34.95 34.81 1n13 s ARG 140 CO 0.19 -0.51 -0.13 0.42 -1.08 0.00 0.00 175.30 174.20 1n13 s ILE 141 N -3.22 1.38 -0.10 4.99 1.01 -1.26 -0.30 121.20 123.70 1n13 s ILE 141 Ca 0.12 -0.55 -0.03 0.00 0.00 0.00 0.00 60.65 60.19 1n13 s ILE 141 Cb -0.01 -1.29 -0.03 0.00 0.01 0.00 0.00 42.46 41.14 1n13 s ILE 141 CO 0.01 0.42 0.03 -1.61 0.00 0.00 0.00 174.94 173.79 1n13 s GLU 142 N 1.22 3.16 0.19 2.79 2.02 -0.54 -4.93 118.70 122.61 1n13 s GLU 142 Ca -0.02 -0.35 -0.15 0.00 0.02 0.00 0.00 54.97 54.46 1n13 s GLU 142 Cb -0.14 -2.90 0.02 0.00 0.10 0.00 0.00 34.13 31.20 1n13 s GLU 142 CO -0.05 0.67 0.46 -1.54 0.02 0.00 0.00 175.26 174.82 1n13 s SER 143 N -0.78 -0.16 0.06 -0.19 1.04 -1.26 -0.50 113.70 111.91 1n13 s SER 143 Ca 0.12 -0.62 -0.17 0.00 0.48 0.00 0.00 55.95 55.76 1n13 s SER 143 Cb -0.12 0.54 0.03 0.00 0.10 0.00 0.00 66.02 66.58 1n13 s SER 143 CO 0.02 -1.02 0.40 0.27 0.98 0.00 0.00 173.24 173.90 1n13 s ILE 144 N -3.91 0.06 0.20 -1.02 -4.36 -0.74 -5.01 121.20 106.42 1n13 s ILE 144 Ca 0.12 -0.50 -0.07 0.00 -0.26 0.00 0.00 60.65 59.94 1n13 s ILE 144 Cb 0.00 -0.99 -0.02 0.00 1.25 0.00 0.00 42.46 42.70 1n13 s ILE 144 CO -0.01 -0.28 0.29 0.00 0.24 0.00 0.00 174.94 175.19 1n13 s ALA 145 N -2.72 0.32 -0.07 2.27 0.00 -1.26 -1.35 121.76 118.95 1n13 s ALA 145 Ca -0.04 -1.17 -0.18 0.00 0.00 0.00 0.00 51.96 50.57 1n13 s ALA 145 Cb -0.00 1.10 0.04 0.00 0.00 0.00 0.00 23.12 24.26 1n13 s ALA 145 CO -0.04 -0.70 0.43 0.54 0.00 0.00 0.00 175.76 175.99 1n13 s VAL 146 N -4.05 0.03 0.16 0.00 0.11 -0.38 -5.00 120.40 111.27 1n13 s VAL 146 Ca 0.26 -0.23 0.07 0.00 -2.93 0.00 0.00 61.98 59.15 1n13 s VAL 146 Cb 0.03 -0.70 -0.04 0.00 -1.53 0.00 0.00 36.38 34.15 1n13 s VAL 146 CO 0.07 -0.13 -0.15 -1.83 -3.33 0.00 0.00 175.10 169.73 1n13 s GLU 147 N -0.80 1.17 -0.08 1.54 -1.05 -1.26 -1.52 118.70 116.70 1n13 s GLU 147 Ca -0.09 -1.39 -0.04 0.00 -0.15 0.00 0.00 54.97 53.30 1n13 s GLU 147 Cb -0.04 -1.06 0.04 0.00 -0.44 0.00 0.00 34.13 32.63 1n13 s GLU 147 CO 0.04 0.20 0.19 -1.58 0.95 0.00 0.00 175.26 175.06 1n13 s HIS 148 N -2.41 -0.23 -0.40 4.83 2.46 0.60 -4.98 115.29 115.15 1n13 s HIS 148 Ca 0.15 0.59 -0.15 0.00 0.47 0.00 0.00 55.06 56.12 1n13 s HIS 148 Cb -0.03 -0.00 0.01 0.00 -0.13 0.00 0.00 32.58 32.42 1n13 s HIS 148 CO 0.05 -0.18 0.33 0.99 -2.47 0.00 0.00 174.74 173.46 1n13 s THR 149 N 0.98 5.22 0.15 0.89 2.01 -1.26 -0.92 115.64 122.70 1n13 s THR 149 Ca -0.07 -0.49 -0.31 0.00 0.31 0.00 0.00 61.69 61.13 1n13 s THR 149 Cb -0.09 -3.92 -0.11 0.00 0.01 0.00 0.00 72.50 68.39 1n13 s THR 149 CO -0.06 -0.29 1.79 -0.69 -0.69 0.00 0.00 174.62 174.68 1n13 s VAL 150 N 1.82 2.37 -0.21 3.82 1.01 0.45 -4.86 120.40 124.80 1n13 s VAL 150 Ca 0.07 0.05 -0.16 0.00 0.00 0.00 0.00 61.98 61.94 1n13 s VAL 150 Cb -0.18 -3.03 -0.11 0.00 0.00 0.00 0.00 36.38 33.06 1n13 s VAL 150 CO 0.11 0.00 -0.16 -0.62 0.00 0.00 0.00 175.10 174.43 1n13 n GLU 151 N 5.10 0.54 0.02 2.72 1.02 -1.26 0.68 120.64 129.45 1n13 n GLU 151 Ca 0.17 0.39 0.00 0.00 -0.02 0.00 0.00 57.16 57.70 1n13 n GLU 151 Cb 0.37 -1.59 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 1n13 n GLU 151 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1n13 n LYS 152 N -4.43 0.00 -3.33 3.49 3.00 -1.26 -4.47 118.16 111.17 1n13 n LYS 152 Ca -0.29 0.00 -0.02 0.00 -0.00 0.00 0.00 58.31 58.00 1n13 n LYS 152 Cb 0.61 -0.23 -0.04 0.00 0.00 0.00 0.00 35.03 35.37 1n13 n LYS 152 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 1n13 s LEU 153 N -5.74 -1.08 0.26 3.14 0.20 -1.26 -4.40 118.68 109.81 1n13 s LEU 153 Ca 0.00 0.81 0.04 0.00 0.69 0.00 0.00 54.13 55.67 1n13 s LEU 153 Cb 0.00 1.82 -0.06 0.00 -0.43 0.00 0.00 46.19 47.52 1n13 s LEU 153 CO 0.00 -0.26 -0.00 -0.83 -0.29 0.00 0.00 176.35 174.96 1n13 s GLY 154 N 2.76 1.73 -0.01 7.98 0.00 -0.60 -4.99 107.32 114.18 1n13 s GLY 154 Ca 0.13 -1.86 0.00 0.00 0.00 0.00 0.00 44.72 42.99 1n13 s GLY 154 CO -0.18 -1.74 0.01 0.00 0.00 0.00 0.00 173.10 171.19 1n13 s ALA 156 N 0.56 2.89 -0.02 0.00 0.00 -0.37 -4.95 121.76 119.87 1n13 s ALA 156 Ca -0.05 -0.88 -0.01 0.00 0.00 0.00 0.00 51.96 51.02 1n13 s ALA 156 Cb -0.07 -1.28 0.01 0.00 0.00 0.00 0.00 23.12 21.78 1n13 s ALA 156 CO -0.01 0.42 0.04 0.12 0.00 0.00 0.00 175.76 176.33 1n13 s PHE 157 N -0.30 -0.03 -0.00 0.00 5.36 -1.26 -1.36 117.98 120.38 1n13 s PHE 157 Ca 0.04 0.11 0.00 0.00 -0.96 0.00 0.00 56.93 56.12 1n13 s PHE 157 Cb -0.13 -0.03 0.01 0.00 -0.34 0.00 0.00 43.02 42.53 1n13 s PHE 157 CO 0.02 -0.04 0.00 0.00 -1.46 0.00 0.00 175.22 173.75 1n13 s ALA 158 N 0.22 0.04 0.13 11.12 0.00 -0.51 -4.85 121.76 127.92 1n13 s ALA 158 Ca -0.02 0.04 -0.11 0.00 0.00 0.00 0.00 51.96 51.88 1n13 s ALA 158 Cb -0.03 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.05 1n13 s ALA 158 CO -0.01 -0.01 0.29 0.00 0.00 0.00 0.00 175.76 176.03 1n13 s ALA 159 N 0.19 -0.33 -0.26 0.00 0.00 -1.26 -1.04 121.76 119.07 1n13 s ALA 159 Ca -0.02 -0.58 0.02 0.00 0.00 0.00 0.00 51.96 51.38 1n13 s ALA 159 Cb -0.02 0.68 0.06 0.00 0.00 0.00 0.00 23.12 23.84 1n13 s ALA 159 CO -0.01 -0.60 -0.06 0.00 0.00 0.00 0.00 175.76 175.09 1n13 s ALA 160 N -3.89 2.27 -0.24 0.00 0.00 0.46 -4.96 121.76 115.41 1n13 s ALA 160 Ca 0.09 -1.63 -0.14 0.00 0.00 0.00 0.00 51.96 50.28 1n13 s ALA 160 Cb 0.03 -1.55 -0.04 0.00 0.00 0.00 0.00 23.12 21.57 1n13 s ALA 160 CO -0.07 -1.25 0.34 0.00 0.00 0.00 0.00 175.76 174.78 1n13 s ALA 161 N 1.24 3.57 -0.12 0.00 0.00 -1.26 -1.50 121.76 123.69 1n13 s ALA 161 Ca -0.05 -0.72 -0.16 0.00 0.00 0.00 0.00 51.96 51.03 1n13 s ALA 161 Cb -0.19 -2.61 -0.05 0.00 0.00 0.00 0.00 23.12 20.28 1n13 s ALA 161 CO -0.06 -0.43 0.40 -0.51 0.00 0.00 0.00 175.76 175.16 1n13 s LEU 162 N 1.57 4.29 0.00 0.00 1.02 0.14 -5.02 118.68 120.68 1n13 s LEU 162 Ca 0.15 0.72 0.00 0.00 0.02 0.00 0.00 54.13 55.02 1n13 s LEU 162 Cb -0.15 -2.56 0.00 0.00 0.02 0.00 0.00 46.19 43.50 1n13 s LEU 162 CO 0.08 0.08 0.00 1.87 0.02 0.00 0.00 176.35 178.41 1n13 n TRP 163 N 3.37 -0.10 -4.62 0.29 -0.00 -1.26 -3.96 117.44 111.17 1n13 n TRP 163 Ca -0.10 0.00 -0.22 0.00 -0.00 0.00 0.00 57.50 57.18 1n13 n TRP 163 Cb 0.52 0.00 -0.15 0.00 -0.00 0.00 0.00 31.31 31.68 1n13 n TRP 163 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 177.69 178.40 1n13 s TYR 164 N -2.36 1.21 -2.00 5.87 2.02 -1.26 -5.10 117.35 115.73 1n13 s TYR 164 Ca 0.00 -0.23 0.03 0.00 -0.37 0.00 0.00 57.07 56.49 1n13 s TYR 164 Cb 0.00 -0.78 0.15 0.00 -0.40 0.00 0.00 41.96 40.93 1n13 s TYR 164 CO 0.00 -0.03 0.64 1.63 -1.57 0.00 0.00 175.55 176.22