#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ly4 n GLN 3 N 0.00 -1.90 0.03 1.20 0.00 -1.26 -4.87 117.38 110.59 1ly4 n GLN 3 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 57.00 56.48 1ly4 n GLN 3 Cb 0.00 -2.03 0.00 0.00 0.00 0.00 0.00 30.24 28.21 1ly4 n GLN 3 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.06 178.00 1ly4 n GLN 4 N -3.83 0.00 -1.60 2.61 7.27 -1.26 -5.15 117.38 115.41 1ly4 n GLN 4 Ca 0.03 0.00 -0.29 0.00 0.07 0.00 0.00 57.00 56.81 1ly4 n GLN 4 Cb 0.56 0.00 0.10 0.00 2.41 0.00 0.00 30.24 33.32 1ly4 n GLN 4 CO 0.00 0.00 0.00 -1.59 0.07 0.00 0.00 177.06 175.54 1ly4 s LYS 5 N -1.14 1.77 0.22 3.69 -2.85 -1.26 -5.07 119.74 115.10 1ly4 s LYS 5 Ca 0.00 0.44 -0.21 0.00 -1.00 0.00 0.00 55.97 55.20 1ly4 s LYS 5 Cb 0.00 -1.90 -0.08 0.00 -2.06 0.00 0.00 37.83 33.79 1ly4 s LYS 5 CO 0.00 -1.80 0.76 -1.12 0.10 0.00 0.00 175.35 173.29 1ly4 s SER 6 N -4.05 7.14 0.11 0.03 0.01 -1.26 -4.95 113.70 110.73 1ly4 s SER 6 Ca 0.62 1.50 0.00 0.00 1.31 0.00 0.00 55.95 59.38 1ly4 s SER 6 Cb -0.14 -2.45 -0.04 0.00 0.21 0.00 0.00 66.02 63.60 1ly4 s SER 6 CO 0.53 0.05 0.26 -0.76 0.41 0.00 0.00 173.24 173.74 1ly4 s LEU 7 N -1.84 4.34 -0.05 2.44 1.43 0.06 -4.58 118.68 120.48 1ly4 s LEU 7 Ca 0.42 0.27 0.05 0.00 -1.03 0.00 0.00 54.13 53.85 1ly4 s LEU 7 Cb -0.18 -2.99 -0.01 0.00 0.03 0.00 0.00 46.19 43.05 1ly4 s LEU 7 CO 0.22 0.10 -0.21 -0.89 0.23 0.00 0.00 176.35 175.81 1ly4 s THR 8 N -1.63 1.70 -0.20 5.49 2.01 -1.06 -2.71 115.64 119.25 1ly4 s THR 8 Ca 0.36 -0.87 -0.10 0.00 0.31 0.00 0.00 61.69 61.39 1ly4 s THR 8 Cb -0.12 -1.45 -0.05 0.00 0.01 0.00 0.00 72.50 70.89 1ly4 s THR 8 CO 0.28 0.48 0.15 -0.22 -0.69 0.00 0.00 174.62 174.62 1ly4 s LEU 9 N -0.05 4.21 -0.03 4.42 0.20 -1.01 -0.28 118.68 126.14 1ly4 s LEU 9 Ca -0.04 0.25 0.05 0.00 0.69 0.00 0.00 54.13 55.08 1ly4 s LEU 9 Cb -0.12 -2.12 -0.01 0.00 -0.43 0.00 0.00 46.19 43.51 1ly4 s LEU 9 CO 0.03 0.17 -0.19 -0.51 -0.29 0.00 0.00 176.35 175.55 1ly4 s ILE 10 N 0.41 1.56 0.06 6.68 2.07 0.62 -1.61 121.20 130.99 1ly4 s ILE 10 Ca 0.09 -0.81 -0.11 0.00 -1.41 0.00 0.00 60.65 58.40 1ly4 s ILE 10 Cb -0.11 -1.32 0.01 0.00 0.13 0.00 0.00 42.46 41.17 1ly4 s ILE 10 CO -0.01 0.44 0.24 0.54 -1.91 0.00 0.00 174.94 174.25 1ly4 s VAL 11 N -0.20 0.11 -0.21 4.00 0.11 -0.37 -4.51 120.40 119.33 1ly4 s VAL 11 Ca 0.01 -0.87 -0.01 0.00 -2.93 0.00 0.00 61.98 58.18 1ly4 s VAL 11 Cb -0.10 -1.05 0.06 0.00 -1.53 0.00 0.00 36.38 33.76 1ly4 s VAL 11 CO 0.01 -0.48 -0.01 0.00 -3.33 0.00 0.00 175.10 171.29 1ly4 s ALA 12 N -2.97 1.51 0.08 1.54 0.00 -1.26 -0.09 121.76 120.57 1ly4 s ALA 12 Ca -0.02 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 50.91 1ly4 s ALA 12 Cb 0.01 -1.30 -0.04 0.00 0.00 0.00 0.00 23.12 21.78 1ly4 s ALA 12 CO -0.06 -1.16 -0.04 -0.48 0.00 0.00 0.00 175.76 174.02 1ly4 s LEU 13 N 1.62 2.43 0.43 0.00 -0.00 -0.73 -4.68 118.68 117.74 1ly4 s LEU 13 Ca -0.03 -1.03 0.04 0.00 -0.00 0.00 0.00 54.13 53.11 1ly4 s LEU 13 Cb -0.18 0.08 0.00 0.00 -0.00 0.00 0.00 46.19 46.10 1ly4 s LEU 13 CO -0.07 -0.55 0.61 0.42 -0.00 0.00 0.00 176.35 176.76 1ly4 s THR 14 N -3.79 3.63 -0.89 5.48 -4.23 -1.00 -1.34 115.64 113.50 1ly4 s THR 14 Ca 0.11 -0.76 0.00 0.00 -1.18 0.00 0.00 61.69 59.86 1ly4 s THR 14 Cb 0.07 -3.30 0.00 0.00 1.34 0.00 0.00 72.50 70.61 1ly4 s THR 14 CO -0.06 -0.17 0.93 0.35 -0.54 0.00 0.00 174.62 175.13 1ly4 n THR 15 N -1.95 1.71 -0.06 3.99 -2.24 -1.08 -0.38 114.28 114.27 1ly4 n THR 15 Ca 0.03 0.49 0.07 0.00 -2.27 0.00 0.00 64.05 62.37 1ly4 n THR 15 Cb 0.58 -1.49 0.18 0.00 -2.10 0.00 0.00 70.33 67.50 1ly4 n THR 15 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1ly4 n SER 16 N -1.43 3.04 0.00 3.42 7.64 -1.26 -4.95 113.62 120.08 1ly4 n SER 16 Ca 0.00 -1.92 0.00 0.00 1.01 0.00 0.00 58.87 57.96 1ly4 n SER 16 Cb 0.06 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 1ly4 n SER 16 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1ly4 n TYR 17 N 0.86 0.00 -2.54 1.43 4.01 0.49 -4.89 117.16 116.52 1ly4 n TYR 17 Ca 0.14 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.47 1ly4 n TYR 17 Cb 0.46 -0.09 -0.03 0.00 -0.31 0.00 0.00 39.34 39.37 1ly4 n TYR 17 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1ly4 s GLY 18 N -2.17 2.70 0.00 2.72 0.00 -1.26 0.22 107.32 109.53 1ly4 s GLY 18 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 44.72 45.46 1ly4 s GLY 18 CO 0.00 1.80 0.00 0.29 0.00 0.00 0.00 173.10 175.19 1ly4 n ILE 19 N 3.39 0.00 -4.08 0.90 -5.35 0.18 -2.38 119.36 112.02 1ly4 n ILE 19 Ca 0.06 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.44 1ly4 n ILE 19 Cb 0.48 0.28 -0.08 0.00 -1.74 0.00 0.00 39.64 38.57 1ly4 n ILE 19 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1ly4 s GLY 20 N -1.72 0.88 -0.23 3.28 0.00 -1.14 -4.63 107.32 103.76 1ly4 s GLY 20 Ca 0.00 -1.27 -0.06 0.00 0.00 0.00 0.00 44.72 43.39 1ly4 s GLY 20 CO 0.00 -1.11 0.47 -1.60 0.00 0.00 0.00 173.10 170.86 1ly4 s ARG 21 N -4.05 0.40 -1.36 2.90 3.52 -0.69 0.16 118.95 119.83 1ly4 s ARG 21 Ca 0.25 1.04 -0.03 0.00 -0.13 0.00 0.00 55.73 56.86 1ly4 s ARG 21 Cb 0.05 0.33 0.02 0.00 -1.56 0.00 0.00 34.95 33.79 1ly4 s ARG 21 CO 0.05 -0.34 0.75 0.43 -0.81 0.00 0.00 175.30 175.38 1ly4 n SER 22 N 5.40 -1.98 -2.13 -2.12 7.64 -1.26 -2.61 113.62 116.56 1ly4 n SER 22 Ca -0.08 -0.82 -0.18 0.00 1.01 0.00 0.00 58.87 58.81 1ly4 n SER 22 Cb 0.50 -3.98 -0.03 0.00 -1.01 0.00 0.00 64.21 59.69 1ly4 n SER 22 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1ly4 n ASN 23 N -3.00 -5.08 -4.10 6.43 5.15 -1.26 -4.99 115.26 108.41 1ly4 n ASN 23 Ca -0.22 0.18 -0.10 0.00 -0.60 0.00 0.00 54.58 53.84 1ly4 n ASN 23 Cb 0.64 -4.34 -0.09 0.00 -0.53 0.00 0.00 39.78 35.46 1ly4 n ASN 23 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1ly4 s SER 24 N -2.19 0.20 -0.84 1.20 0.01 -1.07 -4.52 113.70 106.48 1ly4 s SER 24 Ca 0.00 -1.12 -0.15 0.00 1.31 0.00 0.00 55.95 55.98 1ly4 s SER 24 Cb 0.00 0.36 0.19 0.00 0.21 0.00 0.00 66.02 66.78 1ly4 s SER 24 CO 0.00 -0.80 0.85 -1.48 0.41 0.00 0.00 173.24 172.22 1ly4 s LEU 25 N -3.04 6.27 0.00 2.44 2.34 -1.26 -1.70 118.68 123.73 1ly4 s LEU 25 Ca 0.24 -2.47 0.00 0.00 0.06 0.00 0.00 54.13 51.96 1ly4 s LEU 25 Cb 0.06 -2.26 0.00 0.00 -0.56 0.00 0.00 46.19 43.43 1ly4 s LEU 25 CO 0.03 -0.72 0.00 -0.81 -1.06 0.00 0.00 176.35 173.78 1ly4 n PRO 26 N 4.74 0.00 -4.16 1.48 -0.04 -1.26 -4.68 135.00 131.07 1ly4 n PRO 26 Ca 0.15 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.51 1ly4 n PRO 26 Cb 0.47 -0.63 -0.10 0.00 -0.04 0.00 0.00 33.50 33.20 1ly4 n PRO 26 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 1ly4 s TRP 27 N 0.00 0.89 -1.09 0.54 -2.14 -1.26 -5.09 118.94 110.78 1ly4 s TRP 27 Ca 0.00 -1.09 -0.04 0.00 2.66 0.00 0.00 56.10 57.63 1ly4 s TRP 27 Cb 0.00 -0.52 0.29 0.00 -3.10 0.00 0.00 33.47 30.14 1ly4 s TRP 27 CO 0.00 -0.35 1.64 1.17 -2.66 0.00 0.00 176.95 176.75 1ly4 n LYS 28 N -0.08 4.67 -3.95 3.25 0.00 -1.26 -5.05 118.16 115.73 1ly4 n LYS 28 Ca -0.09 -4.46 -0.31 0.00 0.00 0.00 0.00 58.31 53.45 1ly4 n LYS 28 Cb 0.63 -2.54 -0.15 0.00 0.00 0.00 0.00 35.03 32.96 1ly4 n LYS 28 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1ly4 s LEU 29 N -2.95 3.22 0.10 3.14 1.02 -1.26 -4.77 118.68 117.18 1ly4 s LEU 29 Ca 0.34 -1.52 0.24 0.00 0.02 0.00 0.00 54.13 53.21 1ly4 s LEU 29 Cb 0.09 -1.31 0.30 0.00 0.02 0.00 0.00 46.19 45.29 1ly4 s LEU 29 CO 0.03 -0.29 1.27 0.29 0.02 0.00 0.00 176.35 177.68 1ly4 n LYS 30 N 4.55 0.28 0.00 1.70 5.02 -1.26 -1.45 118.16 127.00 1ly4 n LYS 30 Ca -0.07 0.07 -0.07 0.00 -2.02 0.00 0.00 58.31 56.21 1ly4 n LYS 30 Cb 0.43 -1.66 -0.13 0.00 -0.02 0.00 0.00 35.03 33.65 1ly4 n LYS 30 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 1ly4 h LYS 31 N 0.00 0.00 0.00 1.97 1.79 -1.96 -1.69 116.57 116.67 1ly4 h LYS 31 Ca 0.00 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.31 1ly4 h LYS 31 Cb 0.73 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.36 1ly4 h LYS 31 CO 0.00 0.57 -1.11 1.49 -1.08 0.00 0.00 179.45 179.32 1ly4 h GLU 32 N 0.00 0.00 0.00 3.15 4.22 -1.98 -2.39 114.58 117.58 1ly4 h GLU 32 Ca -0.21 0.00 -0.19 0.00 0.08 0.00 0.00 59.36 59.03 1ly4 h GLU 32 Cb 1.91 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 31.13 1ly4 h GLU 32 CO 0.09 0.43 -1.09 0.82 -2.18 0.00 0.00 179.01 177.08 1ly4 h ILE 33 N 0.00 1.13 -0.54 2.32 5.03 -1.33 -3.05 117.51 121.08 1ly4 h ILE 33 Ca -0.11 -2.74 -0.12 0.00 -0.12 0.00 0.00 64.86 61.77 1ly4 h ILE 33 Cb 1.57 2.52 -0.02 0.00 -3.03 0.00 0.00 36.82 37.86 1ly4 h ILE 33 CO 0.06 0.64 -0.12 0.28 -0.68 0.00 0.00 178.15 178.33 1ly4 h SER 34 N 0.00 1.03 -0.41 1.72 0.02 -1.25 -2.83 113.55 111.82 1ly4 h SER 34 Ca -0.09 -0.35 -0.12 0.00 -0.84 0.00 0.00 61.79 60.40 1ly4 h SER 34 Cb 1.69 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.94 1ly4 h SER 34 CO 0.09 1.14 -0.20 0.22 -1.14 0.00 0.00 176.83 176.94 1ly4 h TYR 35 N 0.91 0.99 -0.51 3.45 3.20 -1.45 -3.05 116.97 120.51 1ly4 h TYR 35 Ca 0.14 -0.25 0.08 0.00 3.14 0.00 0.00 58.73 61.85 1ly4 h TYR 35 Cb 0.69 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.70 1ly4 h TYR 35 CO 0.05 1.02 0.35 0.35 -1.64 0.00 0.00 178.16 178.28 1ly4 h PHE 36 N 0.68 0.35 -0.02 -3.82 3.57 -1.39 -2.01 116.94 114.30 1ly4 h PHE 36 Ca 0.09 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.54 1ly4 h PHE 36 Cb 0.76 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.39 1ly4 h PHE 36 CO 0.06 0.18 -0.24 0.87 -2.23 0.00 0.00 178.31 176.94 1ly4 h LYS 37 N 0.34 0.20 -0.33 1.11 1.57 -1.42 -2.25 116.57 115.79 1ly4 h LYS 37 Ca 0.23 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1ly4 h LYS 37 Cb 0.47 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 1ly4 h LYS 37 CO -0.06 0.88 0.20 0.07 -0.57 0.00 0.00 179.45 179.97 1ly4 h ARG 38 N -0.41 0.45 -0.01 3.15 0.11 -1.45 -2.37 114.38 113.86 1ly4 h ARG 38 Ca -0.02 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 60.02 1ly4 h ARG 38 Cb 0.95 -0.09 -0.01 0.00 1.11 0.00 0.00 29.97 31.93 1ly4 h ARG 38 CO 0.05 0.35 -0.07 0.28 0.10 0.00 0.00 179.97 180.67 1ly4 h VAL 39 N 0.43 0.00 0.00 0.08 2.07 -1.39 -1.25 116.25 116.19 1ly4 h VAL 39 Ca 0.12 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.64 1ly4 h VAL 39 Cb 0.01 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.78 1ly4 h VAL 39 CO -0.02 0.00 0.19 0.74 0.02 0.00 0.00 177.57 178.50 1ly4 h THR 40 N -0.09 0.00 0.00 2.57 2.02 -1.44 -2.87 112.91 113.11 1ly4 h THR 40 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1ly4 h THR 40 Cb 0.10 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 1ly4 h THR 40 CO -0.05 0.00 0.00 -1.54 0.37 0.00 0.00 175.52 174.30 1ly4 n SER 41 N -2.19 0.77 -4.51 4.18 3.41 -0.89 -4.77 113.62 109.63 1ly4 n SER 41 Ca -0.01 -1.35 -0.43 0.00 -0.26 0.00 0.00 58.87 56.82 1ly4 n SER 41 Cb 0.22 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.13 1ly4 n SER 41 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1ly4 s PHE 42 N -0.35 2.66 -0.09 7.33 5.36 -0.50 -4.89 117.98 127.49 1ly4 s PHE 42 Ca 0.00 -0.17 0.01 0.00 -0.96 0.00 0.00 56.93 55.81 1ly4 s PHE 42 Cb 0.00 -4.27 -0.02 0.00 -0.34 0.00 0.00 43.02 38.39 1ly4 s PHE 42 CO 0.00 -1.59 -0.12 0.14 -1.46 0.00 0.00 175.22 172.20 1ly4 s VAL 43 N 4.35 3.24 0.14 3.12 -7.23 -1.26 -4.99 120.40 117.78 1ly4 s VAL 43 Ca 0.29 -0.62 -0.34 0.00 -1.81 0.00 0.00 61.98 59.49 1ly4 s VAL 43 Cb -0.13 -2.33 -0.15 0.00 0.56 0.00 0.00 36.38 34.33 1ly4 s VAL 43 CO 0.16 0.56 1.45 -2.65 -0.31 0.00 0.00 175.10 174.31 1ly4 n PRO 44 N 2.89 1.73 -0.10 4.82 -0.02 -1.26 -4.62 135.00 138.43 1ly4 n PRO 44 Ca -0.18 0.62 0.04 0.00 -2.02 0.00 0.00 63.50 61.96 1ly4 n PRO 44 Cb 0.53 -2.32 0.07 0.00 -0.02 0.00 0.00 33.50 31.76 1ly4 n PRO 44 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1ly4 n THR 45 N 2.82 -0.12 0.07 3.45 -1.04 -1.26 -0.10 114.28 118.09 1ly4 n THR 45 Ca 0.17 0.66 -0.03 0.00 -2.04 0.00 0.00 64.05 62.80 1ly4 n THR 45 Cb 0.25 -0.95 -0.01 0.00 -1.82 0.00 0.00 70.33 67.80 1ly4 n THR 45 CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 1ly4 h PHE 46 N 0.00 -0.18 0.00 -1.42 3.57 -2.04 -3.23 116.94 113.64 1ly4 h PHE 46 Ca 0.17 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.66 1ly4 h PHE 46 Cb 0.33 0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.13 1ly4 h PHE 46 CO -0.17 -0.11 0.04 -0.25 -2.23 0.00 0.00 178.31 175.59 1ly4 n ASP 47 N -2.93 0.33 0.21 0.41 10.43 -0.63 -2.86 116.55 121.51 1ly4 n ASP 47 Ca -0.02 0.63 0.11 0.00 2.57 0.00 0.00 54.79 58.08 1ly4 n ASP 47 Cb 0.08 -0.66 0.60 0.00 1.84 0.00 0.00 41.12 42.97 1ly4 n ASP 47 CO 0.00 0.00 0.00 0.77 -1.07 0.00 0.00 177.20 176.90 1ly4 h SER 48 N 0.00 0.00 0.33 -2.24 4.64 -0.52 -1.08 113.55 114.68 1ly4 h SER 48 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1ly4 h SER 48 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1ly4 h SER 48 CO 0.00 0.00 -0.16 -0.26 -0.87 0.00 0.00 176.83 175.54 1ly4 h PHE 49 N 0.00 -0.41 0.03 4.77 -1.00 -1.75 -3.38 116.94 115.20 1ly4 h PHE 49 Ca 0.00 -0.01 -0.26 0.00 2.81 0.00 0.00 57.97 60.51 1ly4 h PHE 49 Cb 0.37 0.14 -0.03 0.00 3.61 0.00 0.00 35.95 40.04 1ly4 h PHE 49 CO 0.00 -0.26 -1.38 1.05 -1.61 0.00 0.00 178.31 176.11 1ly4 h GLU 50 N -0.58 0.06 -6.21 1.51 4.11 -1.80 -3.48 114.58 108.18 1ly4 h GLU 50 Ca -0.05 -0.10 -0.55 0.00 0.07 0.00 0.00 59.36 58.74 1ly4 h GLU 50 Cb 0.34 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 1ly4 h GLU 50 CO 0.07 0.84 0.16 -1.54 0.07 0.00 0.00 179.01 178.62 1ly4 s SER 51 N -6.55 7.15 0.02 3.06 1.04 -0.42 -2.58 113.70 115.42 1ly4 s SER 51 Ca -0.03 1.38 0.05 0.00 0.48 0.00 0.00 55.95 57.83 1ly4 s SER 51 Cb 0.09 -2.46 -0.02 0.00 0.10 0.00 0.00 66.02 63.73 1ly4 s SER 51 CO 0.83 -0.08 -0.15 0.00 0.98 0.00 0.00 173.24 174.82 1ly4 s MET 52 N 0.44 1.08 0.55 4.02 0.23 0.20 -4.70 119.30 121.11 1ly4 s MET 52 Ca 0.40 -0.68 -0.10 0.00 -1.03 0.00 0.00 55.69 54.28 1ly4 s MET 52 Cb -0.19 -1.08 -0.05 0.00 -1.53 0.00 0.00 34.83 31.98 1ly4 s MET 52 CO 0.22 0.28 0.94 -0.80 -2.03 0.00 0.00 175.02 173.62 1ly4 s ASN 53 N -0.82 6.32 -0.05 -1.18 0.01 -1.26 -1.59 114.94 116.37 1ly4 s ASN 53 Ca 0.04 1.29 0.06 0.00 -0.71 0.00 0.00 52.86 53.54 1ly4 s ASN 53 Cb -0.07 -2.40 -0.01 0.00 0.41 0.00 0.00 41.25 39.17 1ly4 s ASN 53 CO 0.01 -0.71 -0.24 -0.69 -1.51 0.00 0.00 177.10 173.95 1ly4 s VAL 54 N -2.91 2.13 -0.06 1.60 1.01 0.22 -0.13 120.40 122.26 1ly4 s VAL 54 Ca 0.53 -1.05 -0.01 0.00 0.00 0.00 0.00 61.98 61.46 1ly4 s VAL 54 Cb -0.11 -1.77 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 1ly4 s VAL 54 CO 0.46 0.57 -0.01 0.68 0.00 0.00 0.00 175.10 176.80 1ly4 s VAL 55 N -0.26 4.18 -0.01 2.92 -7.23 -0.61 0.23 120.40 119.62 1ly4 s VAL 55 Ca -0.01 -0.37 0.00 0.00 -1.81 0.00 0.00 61.98 59.79 1ly4 s VAL 55 Cb -0.13 -2.78 -0.04 0.00 0.56 0.00 0.00 36.38 34.00 1ly4 s VAL 55 CO 0.03 0.54 0.05 -0.76 -0.31 0.00 0.00 175.10 174.65 1ly4 s LEU 56 N -1.05 3.74 0.02 1.32 1.02 0.65 -2.85 118.68 121.53 1ly4 s LEU 56 Ca 0.15 0.09 -0.15 0.00 0.02 0.00 0.00 54.13 54.23 1ly4 s LEU 56 Cb -0.11 -2.15 0.03 0.00 0.02 0.00 0.00 46.19 43.97 1ly4 s LEU 56 CO 0.04 0.28 0.34 0.00 0.02 0.00 0.00 176.35 177.03 1ly4 s MET 57 N -1.63 0.79 0.54 1.70 0.23 -1.04 -1.99 119.30 117.90 1ly4 s MET 57 Ca 0.21 -0.36 -0.17 0.00 -1.03 0.00 0.00 55.69 54.34 1ly4 s MET 57 Cb -0.12 0.35 -0.06 0.00 -1.53 0.00 0.00 34.83 33.47 1ly4 s MET 57 CO 0.12 -0.25 1.02 0.20 -2.03 0.00 0.00 175.02 174.08 1ly4 s GLY 58 N -1.79 2.18 0.15 3.16 0.00 0.25 -0.55 107.32 110.72 1ly4 s GLY 58 Ca -0.08 0.34 -0.13 0.00 0.00 0.00 0.00 44.72 44.85 1ly4 s GLY 58 CO -0.00 0.64 1.67 0.07 0.00 0.00 0.00 173.10 175.48 1ly4 h ARG 59 N 0.89 0.78 -0.24 2.90 -0.00 -1.84 -1.25 114.38 115.61 1ly4 h ARG 59 Ca -0.47 -0.17 0.05 0.00 -0.00 0.00 0.00 59.98 59.39 1ly4 h ARG 59 Cb 1.20 -0.11 -0.07 0.00 -0.00 0.00 0.00 29.97 30.99 1ly4 h ARG 59 CO 0.59 0.73 -0.46 0.87 -0.00 0.00 0.00 179.97 181.70 1ly4 h LYS 60 N 0.68 -0.44 -0.95 0.08 1.57 -1.94 1.29 116.57 116.86 1ly4 h LYS 60 Ca 0.16 0.03 0.20 0.00 -1.87 0.00 0.00 60.65 59.17 1ly4 h LYS 60 Cb 0.28 0.10 -0.08 0.00 0.08 0.00 0.00 32.23 32.61 1ly4 h LYS 60 CO -0.00 -0.29 0.61 1.15 -0.57 0.00 0.00 179.45 180.34 1ly4 h THR 61 N -0.45 0.69 -0.32 -0.16 2.02 -1.89 0.21 112.91 113.01 1ly4 h THR 61 Ca 0.09 -0.19 0.07 0.00 0.77 0.00 0.00 66.41 67.15 1ly4 h THR 61 Cb 0.62 0.09 -0.08 0.00 -1.74 0.00 0.00 68.15 67.05 1ly4 h THR 61 CO -0.48 0.10 -0.21 -0.25 0.37 0.00 0.00 175.52 175.05 1ly4 h TRP 62 N 0.55 -0.54 0.47 3.16 -0.00 0.28 -1.20 115.95 118.68 1ly4 h TRP 62 Ca 0.51 0.04 -0.02 0.00 -0.00 0.00 0.00 58.89 59.43 1ly4 h TRP 62 Cb 1.06 0.29 -0.01 0.00 -0.00 0.00 0.00 29.16 30.50 1ly4 h TRP 62 CO -0.00 -0.29 -0.31 0.93 -0.00 0.00 0.00 178.44 178.78 1ly4 h GLU 63 N -0.17 -0.72 0.00 2.65 5.08 0.85 -2.54 114.58 119.72 1ly4 h GLU 63 Ca 0.17 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1ly4 h GLU 63 Cb 0.43 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1ly4 h GLU 63 CO -0.43 -0.48 0.00 0.45 -1.00 0.00 0.00 179.01 177.55 1ly4 n SER 64 N -5.44 0.00 -4.63 1.42 2.88 0.53 -4.49 113.62 103.89 1ly4 n SER 64 Ca -0.11 0.31 -0.38 0.00 -1.33 0.00 0.00 58.87 57.36 1ly4 n SER 64 Cb 0.34 -0.32 -0.10 0.00 -0.75 0.00 0.00 64.21 63.38 1ly4 n SER 64 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1ly4 s ILE 65 N -2.63 5.29 0.10 2.46 1.01 -0.48 -4.94 121.20 122.01 1ly4 s ILE 65 Ca 0.01 0.32 -0.25 0.00 0.00 0.00 0.00 60.65 60.72 1ly4 s ILE 65 Cb 0.01 -3.58 -0.14 0.00 0.01 0.00 0.00 42.46 38.76 1ly4 s ILE 65 CO 0.01 0.27 0.56 -0.81 0.00 0.00 0.00 174.94 174.97 1ly4 n PRO 66 N 4.75 0.00 -0.26 2.79 -0.04 -1.26 -4.72 135.00 136.26 1ly4 n PRO 66 Ca -0.13 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.36 1ly4 n PRO 66 Cb 0.52 -0.93 0.15 0.00 -0.04 0.00 0.00 33.50 33.20 1ly4 n PRO 66 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1ly4 h LEU 67 N 1.34 0.47 -1.16 1.53 5.85 -1.93 0.52 115.31 121.94 1ly4 h LEU 67 Ca -0.28 0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.43 1ly4 h LEU 67 Cb 1.13 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 1ly4 h LEU 67 CO 0.47 0.26 -0.24 -0.61 -0.34 0.00 0.00 178.44 177.98 1ly4 h GLN 68 N 0.61 0.30 0.00 1.25 4.15 -2.03 -3.32 115.11 116.07 1ly4 h GLN 68 Ca 0.37 -0.10 -0.15 0.00 0.77 0.00 0.00 58.65 59.54 1ly4 h GLN 68 Cb 0.42 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.06 1ly4 h GLN 68 CO -0.29 0.52 -0.73 0.74 -1.93 0.00 0.00 178.83 177.14 1ly4 h PHE 69 N 0.27 0.00 -2.01 3.99 -1.00 -0.27 -3.47 116.94 114.45 1ly4 h PHE 69 Ca 0.04 0.00 -0.45 0.00 2.81 0.00 0.00 57.97 60.38 1ly4 h PHE 69 Cb 0.57 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.13 1ly4 h PHE 69 CO 0.01 0.73 -0.35 -0.98 -1.61 0.00 0.00 178.31 176.11 1ly4 s ARG 70 N -2.95 3.24 0.61 1.51 1.70 -1.03 -4.08 118.95 117.95 1ly4 s ARG 70 Ca 0.02 -0.88 -0.18 0.00 -0.47 0.00 0.00 55.73 54.22 1ly4 s ARG 70 Cb 0.09 -2.83 -0.03 0.00 -0.57 0.00 0.00 34.95 31.62 1ly4 s ARG 70 CO 0.78 0.18 1.18 -2.14 -1.08 0.00 0.00 175.30 174.21 1ly4 s PRO 71 N -4.13 2.93 -0.14 3.89 0.02 -1.26 -4.96 135.00 131.35 1ly4 s PRO 71 Ca 0.41 1.72 -0.29 0.00 0.02 0.00 0.00 61.00 62.86 1ly4 s PRO 71 Cb -0.09 -1.94 -0.05 0.00 0.02 0.00 0.00 34.50 32.44 1ly4 s PRO 71 CO 0.31 -1.21 1.86 -0.51 -0.33 0.00 0.00 177.00 177.12 1ly4 s LEU 72 N -4.24 3.96 0.08 -5.54 1.43 -1.26 -4.88 118.68 108.23 1ly4 s LEU 72 Ca 0.75 2.00 -0.31 0.00 -1.03 0.00 0.00 54.13 55.54 1ly4 s LEU 72 Cb -0.28 -3.53 -0.08 0.00 0.03 0.00 0.00 46.19 42.34 1ly4 s LEU 72 CO 0.34 -1.35 1.52 -0.54 0.23 0.00 0.00 176.35 176.55 1ly4 s LYS 73 N 4.98 4.25 -0.40 1.70 1.02 -1.26 -3.58 119.74 126.45 1ly4 s LYS 73 Ca 0.83 2.19 -0.02 0.00 0.02 0.00 0.00 55.97 58.99 1ly4 s LYS 73 Cb -0.32 -3.42 0.00 0.00 -0.52 0.00 0.00 37.83 33.57 1ly4 s LYS 73 CO 0.34 -0.60 0.35 0.41 -0.92 0.00 0.00 175.35 174.93 1ly4 n GLY 74 N 3.75 0.48 3.63 -3.33 0.00 -1.26 -5.02 105.19 103.44 1ly4 n GLY 74 Ca 0.14 -0.39 -0.13 0.00 0.00 0.00 0.00 46.02 45.64 1ly4 n GLY 74 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ly4 s ARG 75 N -5.30 0.82 0.27 1.61 0.52 -1.24 -4.44 118.95 111.18 1ly4 s ARG 75 Ca 0.16 1.04 -0.29 0.00 -0.52 0.00 0.00 55.73 56.11 1ly4 s ARG 75 Cb -0.07 0.36 -0.10 0.00 0.52 0.00 0.00 34.95 35.67 1ly4 s ARG 75 CO 0.22 -0.11 1.28 0.42 0.02 0.00 0.00 175.30 177.13 1ly4 s ILE 76 N 0.59 3.03 -0.15 1.52 1.01 0.81 -4.78 121.20 123.24 1ly4 s ILE 76 Ca -0.02 0.95 -0.05 0.00 0.00 0.00 0.00 60.65 61.53 1ly4 s ILE 76 Cb -0.05 -3.60 -0.03 0.00 0.01 0.00 0.00 42.46 38.78 1ly4 s ILE 76 CO -0.03 0.19 0.00 0.20 0.00 0.00 0.00 174.94 175.30 1ly4 s ASN 77 N -0.18 5.13 0.05 3.58 0.01 -1.26 -1.57 114.94 120.71 1ly4 s ASN 77 Ca 0.52 -0.02 0.05 0.00 -0.71 0.00 0.00 52.86 52.70 1ly4 s ASN 77 Cb -0.37 -1.79 -0.02 0.00 0.41 0.00 0.00 41.25 39.47 1ly4 s ASN 77 CO 0.45 0.20 -0.14 -0.69 -1.51 0.00 0.00 177.10 175.41 1ly4 s VAL 78 N 0.17 1.11 -0.06 1.60 1.01 -1.13 -3.25 120.40 119.84 1ly4 s VAL 78 Ca 0.01 -1.09 0.05 0.00 0.00 0.00 0.00 61.98 60.95 1ly4 s VAL 78 Cb -0.13 -1.02 -0.00 0.00 0.00 0.00 0.00 36.38 35.22 1ly4 s VAL 78 CO 0.02 -0.07 -0.21 -0.69 0.00 0.00 0.00 175.10 174.16 1ly4 s VAL 79 N -0.98 1.73 -0.32 2.92 1.01 -0.32 -2.50 120.40 121.95 1ly4 s VAL 79 Ca 0.00 -0.87 -0.14 0.00 0.00 0.00 0.00 61.98 60.98 1ly4 s VAL 79 Cb -0.08 -1.49 -0.02 0.00 0.00 0.00 0.00 36.38 34.79 1ly4 s VAL 79 CO 0.02 0.49 0.30 -0.63 0.00 0.00 0.00 175.10 175.28 1ly4 s ILE 80 N 0.09 5.22 -0.28 2.22 1.09 0.29 -1.02 121.20 128.81 1ly4 s ILE 80 Ca -0.08 0.09 0.02 0.00 -1.10 0.00 0.00 60.65 59.58 1ly4 s ILE 80 Cb -0.14 -3.73 0.17 0.00 -1.06 0.00 0.00 42.46 37.70 1ly4 s ILE 80 CO 0.04 0.03 0.46 0.28 -0.10 0.00 0.00 174.94 175.65 1ly4 s THR 81 N 1.91 -0.75 0.40 2.92 -1.32 -1.13 -2.72 115.64 114.96 1ly4 s THR 81 Ca 0.10 -0.17 0.27 0.00 -1.21 0.00 0.00 61.69 60.68 1ly4 s THR 81 Cb -0.17 -0.97 0.43 0.00 -1.51 0.00 0.00 72.50 70.29 1ly4 s THR 81 CO 0.11 -0.17 1.54 -1.14 -2.21 0.00 0.00 174.62 172.75 1ly4 n ARG 82 N 5.38 -0.04 -2.71 7.08 0.63 -1.25 -0.78 116.66 124.96 1ly4 n ARG 82 Ca 0.01 1.28 -0.31 0.00 -0.92 0.00 0.00 57.85 57.91 1ly4 n ARG 82 Cb 0.51 -2.43 -0.01 0.00 0.45 0.00 0.00 32.46 30.98 1ly4 n ARG 82 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1ly4 n ASN 83 N -4.90 5.44 -4.52 6.15 5.15 -1.26 -4.96 115.26 116.36 1ly4 n ASN 83 Ca 0.39 -3.71 -0.27 0.00 -0.60 0.00 0.00 54.58 50.39 1ly4 n ASN 83 Cb 1.43 -0.72 -0.13 0.00 -0.53 0.00 0.00 39.78 39.82 1ly4 n ASN 83 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 1ly4 n GLU 84 N -0.27 0.33 0.00 1.20 -0.00 0.04 -4.63 120.64 117.32 1ly4 n GLU 84 Ca 0.38 -0.22 0.00 0.00 -0.00 0.00 0.00 57.16 57.32 1ly4 n GLU 84 Cb 0.39 -2.26 0.00 0.00 -0.00 0.00 0.00 31.44 29.57 1ly4 n GLU 84 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1ly4 n SER 85 N 12.01 0.00 0.00 -1.84 7.64 -1.26 -5.02 113.62 125.15 1ly4 n SER 85 Ca 0.56 0.48 0.00 0.00 1.01 0.00 0.00 58.87 60.93 1ly4 n SER 85 Cb 0.26 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 1ly4 n SER 85 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ly4 n LEU 86 N -0.72 0.00 -3.29 -3.43 -0.00 -1.26 -5.18 117.00 103.12 1ly4 n LEU 86 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 56.01 56.04 1ly4 n LEU 86 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.38 1ly4 n LEU 86 CO 0.00 0.00 0.86 -0.62 -0.00 0.00 0.00 177.39 177.63 1ly4 s ASP 87 N 1.17 -0.18 0.01 1.45 2.15 -1.26 -5.03 116.67 114.98 1ly4 s ASP 87 Ca 0.00 0.26 -0.22 0.00 0.43 0.00 0.00 52.55 53.02 1ly4 s ASP 87 Cb 0.00 1.19 -0.05 0.00 -0.30 0.00 0.00 42.92 43.76 1ly4 s ASP 87 CO 0.00 -0.04 0.64 -0.22 -0.17 0.00 0.00 175.17 175.38 1ly4 s LEU 88 N 2.00 4.42 0.00 -1.34 1.98 -1.26 -4.98 118.68 119.50 1ly4 s LEU 88 Ca -0.01 1.23 0.00 0.00 -2.89 0.00 0.00 54.13 52.46 1ly4 s LEU 88 Cb -0.02 -3.00 0.00 0.00 0.66 0.00 0.00 46.19 43.83 1ly4 s LEU 88 CO -0.16 0.07 0.00 0.61 -1.89 0.00 0.00 176.35 174.99 1ly4 n GLY 89 N 2.45 0.70 2.53 7.98 0.00 -1.26 -4.95 105.19 112.65 1ly4 n GLY 89 Ca -0.06 -0.80 -0.22 0.00 0.00 0.00 0.00 46.02 44.95 1ly4 n GLY 89 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ly4 n ASN 90 N 0.00 3.74 0.00 1.61 4.13 -1.26 -4.72 115.26 118.76 1ly4 n ASN 90 Ca 0.00 -3.42 0.00 0.00 1.68 0.00 0.00 54.58 52.84 1ly4 n ASN 90 Cb 0.00 -0.48 0.00 0.00 -1.54 0.00 0.00 39.78 37.76 1ly4 n ASN 90 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ly4 n GLY 91 N -0.35 0.99 3.07 7.41 0.00 -1.26 -5.14 105.19 109.90 1ly4 n GLY 91 Ca 0.30 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.06 1ly4 n GLY 91 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ly4 s ILE 92 N -1.21 1.31 0.50 -0.61 -1.09 -1.26 -4.81 121.20 114.02 1ly4 s ILE 92 Ca 0.00 -0.59 -0.00 0.00 -2.23 0.00 0.00 60.65 57.83 1ly4 s ILE 92 Cb 0.00 -1.17 0.01 0.00 -1.58 0.00 0.00 42.46 39.72 1ly4 s ILE 92 CO 0.00 0.39 0.73 -1.00 -1.23 0.00 0.00 174.94 173.83 1ly4 s HIS 93 N 0.53 3.13 0.03 3.97 3.76 -1.20 -4.83 115.29 120.68 1ly4 s HIS 93 Ca -0.14 0.23 0.03 0.00 -0.15 0.00 0.00 55.06 55.03 1ly4 s HIS 93 Cb -0.15 -2.49 -0.02 0.00 1.11 0.00 0.00 32.58 31.03 1ly4 s HIS 93 CO 0.04 -0.56 -0.09 -1.54 -0.85 0.00 0.00 174.74 171.74 1ly4 s SER 94 N -4.28 1.06 0.05 1.40 1.04 -1.25 -1.17 113.70 110.54 1ly4 s SER 94 Ca 0.51 -0.42 -0.08 0.00 0.48 0.00 0.00 55.95 56.45 1ly4 s SER 94 Cb -0.10 -0.03 -0.00 0.00 0.10 0.00 0.00 66.02 65.98 1ly4 s SER 94 CO 0.39 -0.07 0.15 0.00 0.98 0.00 0.00 173.24 174.70 1ly4 s ALA 95 N -0.92 -0.22 -0.16 5.32 0.00 -0.19 -4.82 121.76 120.77 1ly4 s ALA 95 Ca -0.03 -0.44 0.21 0.00 0.00 0.00 0.00 51.96 51.69 1ly4 s ALA 95 Cb -0.07 0.30 0.42 0.00 0.00 0.00 0.00 23.12 23.76 1ly4 s ALA 95 CO 0.01 -0.37 1.61 -0.22 0.00 0.00 0.00 175.76 176.79 1ly4 h LYS 96 N 3.42 0.00 -3.18 0.00 1.63 -1.88 -2.99 116.57 113.57 1ly4 h LYS 96 Ca -0.33 0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 59.42 1ly4 h LYS 96 Cb 1.19 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.80 1ly4 h LYS 96 CO 0.50 0.26 0.20 -1.54 -3.45 0.00 0.00 179.45 175.42 1ly4 s SER 97 N -6.28 0.13 0.21 4.20 1.04 -1.26 -3.89 113.70 107.85 1ly4 s SER 97 Ca 0.04 -1.17 -0.10 0.00 0.48 0.00 0.00 55.95 55.20 1ly4 s SER 97 Cb 0.07 0.81 0.17 0.00 0.10 0.00 0.00 66.02 67.17 1ly4 s SER 97 CO 0.69 -1.61 1.86 -0.07 0.98 0.00 0.00 173.24 175.09 1ly4 h LEU 98 N 2.02 0.77 -0.32 2.42 4.07 -1.98 0.28 115.31 122.58 1ly4 h LEU 98 Ca -0.31 -0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.63 1ly4 h LEU 98 Cb 1.25 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.79 1ly4 h LEU 98 CO 0.39 0.55 0.17 0.44 -1.08 0.00 0.00 178.44 178.91 1ly4 h ASP 99 N 0.92 0.40 -0.04 -0.43 3.45 -1.99 -1.72 116.42 117.00 1ly4 h ASP 99 Ca 0.27 -0.10 -0.11 0.00 0.43 0.00 0.00 57.03 57.53 1ly4 h ASP 99 Cb -0.05 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 38.61 1ly4 h ASP 99 CO -0.08 0.39 -0.30 0.45 -1.57 0.00 0.00 179.24 178.13 1ly4 h HIS 100 N 0.39 0.57 -0.58 4.55 3.86 -1.82 -2.55 115.15 119.57 1ly4 h HIS 100 Ca 0.11 -0.13 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 1ly4 h HIS 100 Cb 0.08 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.39 1ly4 h HIS 100 CO -0.03 0.75 0.31 0.00 0.86 0.00 0.00 177.93 179.82 1ly4 h ALA 101 N 1.25 0.74 -0.51 2.45 0.00 -0.18 -1.85 119.26 121.17 1ly4 h ALA 101 Ca 0.06 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1ly4 h ALA 101 Cb 0.74 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1ly4 h ALA 101 CO 0.06 0.26 0.12 -0.07 0.00 0.00 0.00 179.25 179.62 1ly4 h LEU 102 N 0.78 0.71 -0.48 0.00 3.38 -0.92 -2.47 115.31 116.32 1ly4 h LEU 102 Ca 0.20 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 1ly4 h LEU 102 Cb 0.05 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1ly4 h LEU 102 CO -0.03 0.71 0.04 -0.08 0.09 0.00 0.00 178.44 179.17 1ly4 h GLU 103 N 0.74 0.82 -0.66 1.13 4.22 -1.35 -2.55 114.58 116.93 1ly4 h GLU 103 Ca 0.17 -0.24 0.00 0.00 0.08 0.00 0.00 59.36 59.37 1ly4 h GLU 103 Cb 0.28 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 1ly4 h GLU 103 CO -0.00 0.84 0.42 1.25 -2.18 0.00 0.00 179.01 179.34 1ly4 h LEU 104 N 0.68 0.77 -0.09 1.64 6.46 -0.96 -1.86 115.31 121.95 1ly4 h LEU 104 Ca 0.14 -0.03 -0.24 0.00 -0.12 0.00 0.00 57.88 57.63 1ly4 h LEU 104 Cb 0.44 -0.19 0.00 0.00 -0.73 0.00 0.00 40.66 40.18 1ly4 h LEU 104 CO 0.02 0.58 -1.03 -0.07 -0.62 0.00 0.00 178.44 177.32 1ly4 h LEU 105 N 0.90 0.50 0.21 2.25 3.38 -1.37 -2.72 115.31 118.46 1ly4 h LEU 105 Ca 0.24 -0.43 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1ly4 h LEU 105 Cb -0.07 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.53 1ly4 h LEU 105 CO -0.05 1.26 -0.10 1.88 0.09 0.00 0.00 178.44 181.52 1ly4 h TYR 106 N 0.18 -0.26 -0.76 1.13 -1.99 -1.31 -0.13 116.97 113.83 1ly4 h TYR 106 Ca -0.10 -0.01 0.15 0.00 2.00 0.00 0.00 58.73 60.78 1ly4 h TYR 106 Cb 1.69 0.09 -0.14 0.00 2.00 0.00 0.00 36.73 40.36 1ly4 h TYR 106 CO 0.06 -0.16 -0.19 -0.09 -0.00 0.00 0.00 178.16 177.78 1ly4 h ARG 107 N -0.44 -0.00 -0.31 4.88 2.43 -1.52 -2.84 114.38 116.58 1ly4 h ARG 107 Ca -0.03 0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.02 1ly4 h ARG 107 Cb 0.21 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1ly4 h ARG 107 CO 0.05 -0.00 -0.28 1.15 -1.51 0.00 0.00 179.97 179.38 1ly4 h THR 108 N -0.00 1.30 -0.27 0.20 2.02 -1.51 -3.44 112.91 111.21 1ly4 h THR 108 Ca 0.36 -1.44 0.00 0.00 0.77 0.00 0.00 66.41 66.11 1ly4 h THR 108 Cb 0.55 1.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 1ly4 h THR 108 CO -0.78 0.46 0.00 -1.22 0.37 0.00 0.00 175.52 174.35 1ly4 n TYR 109 N -4.25 0.00 0.00 3.16 4.01 -0.06 -4.84 117.16 115.18 1ly4 n TYR 109 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 1ly4 n TYR 109 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.50 1ly4 n TYR 109 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ly4 n GLY 110 N 5.00 0.00 0.00 2.72 0.00 -1.25 -4.52 105.19 107.13 1ly4 n GLY 110 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ly4 n GLY 110 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ly4 n SER 111 N 0.00 0.00 -1.94 1.61 7.64 -1.26 -4.65 113.62 115.02 1ly4 n SER 111 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.83 1ly4 n SER 111 Cb 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.13 1ly4 n SER 111 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1ly4 n GLU 112 N 0.00 1.10 -4.37 1.43 -0.00 -1.26 -4.84 120.64 112.69 1ly4 n GLU 112 Ca 0.00 -0.40 -0.24 0.00 -0.00 0.00 0.00 57.16 56.52 1ly4 n GLU 112 Cb 0.00 -1.55 -0.13 0.00 -0.00 0.00 0.00 31.44 29.76 1ly4 n GLU 112 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 1ly4 s SER 113 N 2.17 2.46 0.02 -1.84 0.01 -1.26 -5.01 113.70 110.25 1ly4 s SER 113 Ca 0.27 -0.64 0.10 0.00 1.31 0.00 0.00 55.95 57.00 1ly4 s SER 113 Cb 0.13 -0.15 -0.22 0.00 0.21 0.00 0.00 66.02 65.98 1ly4 s SER 113 CO 0.00 0.08 0.91 0.77 0.41 0.00 0.00 173.24 175.41 1ly4 h SER 114 N 4.31 0.01 -3.68 2.44 4.64 -1.95 -3.45 113.55 115.87 1ly4 h SER 114 Ca -0.45 -0.01 -0.63 0.00 -0.47 0.00 0.00 61.79 60.24 1ly4 h SER 114 Cb 1.18 -0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.12 1ly4 h SER 114 CO 0.41 1.01 -0.17 -0.69 -0.87 0.00 0.00 176.83 176.51 1ly4 s VAL 115 N -2.64 5.14 0.05 0.95 1.01 -1.26 -4.70 120.40 118.95 1ly4 s VAL 115 Ca -0.02 0.63 0.08 0.00 0.00 0.00 0.00 61.98 62.66 1ly4 s VAL 115 Cb 0.09 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 1ly4 s VAL 115 CO 0.82 0.12 -0.20 -1.10 0.00 0.00 0.00 175.10 174.74 1ly4 s GLN 116 N 2.15 1.95 0.07 2.72 -1.52 -1.07 -3.94 119.66 120.02 1ly4 s GLN 116 Ca 0.17 -1.05 -0.09 0.00 -1.95 0.00 0.00 55.36 52.44 1ly4 s GLN 116 Cb -0.16 -2.12 -0.06 0.00 -0.22 0.00 0.00 33.01 30.45 1ly4 s GLN 116 CO 0.10 0.52 0.38 0.96 -0.25 0.00 0.00 175.29 177.00 1ly4 s ILE 117 N -0.93 5.13 0.00 1.08 -4.36 -1.26 -0.63 121.20 120.23 1ly4 s ILE 117 Ca 0.14 0.41 0.00 0.00 -0.26 0.00 0.00 60.65 60.94 1ly4 s ILE 117 Cb -0.10 -3.63 0.00 0.00 1.25 0.00 0.00 42.46 39.97 1ly4 s ILE 117 CO 0.05 0.31 0.00 -3.20 0.24 0.00 0.00 174.94 172.34 1ly4 n ASN 118 N 0.95 0.00 -4.83 4.36 4.05 -0.62 -4.84 115.26 114.33 1ly4 n ASN 118 Ca -0.09 0.00 -0.36 0.00 0.45 0.00 0.00 54.58 54.58 1ly4 n ASN 118 Cb 0.52 0.00 -0.07 0.00 1.23 0.00 0.00 39.78 41.47 1ly4 n ASN 118 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 1ly4 s ARG 119 N 0.06 3.72 -0.27 1.20 0.52 -1.26 -4.98 118.95 117.93 1ly4 s ARG 119 Ca 0.00 -0.13 -0.07 0.00 -0.52 0.00 0.00 55.73 55.01 1ly4 s ARG 119 Cb 0.00 -3.27 -0.01 0.00 0.52 0.00 0.00 34.95 32.19 1ly4 s ARG 119 CO 0.00 0.61 0.08 0.42 0.02 0.00 0.00 175.30 176.43 1ly4 s ILE 120 N -0.55 4.20 -0.06 1.52 1.01 -1.26 -0.61 121.20 125.44 1ly4 s ILE 120 Ca 0.13 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.42 1ly4 s ILE 120 Cb -0.12 -3.04 -0.03 0.00 0.01 0.00 0.00 42.46 39.28 1ly4 s ILE 120 CO 0.03 0.24 -0.04 -0.36 0.00 0.00 0.00 174.94 174.81 1ly4 s PHE 121 N 1.58 3.02 -0.26 3.97 0.08 0.14 -2.56 117.98 123.94 1ly4 s PHE 121 Ca 0.05 0.08 -0.07 0.00 0.12 0.00 0.00 56.93 57.11 1ly4 s PHE 121 Cb -0.16 -1.72 -0.02 0.00 -0.57 0.00 0.00 43.02 40.55 1ly4 s PHE 121 CO 0.03 0.40 0.07 0.08 -0.10 0.00 0.00 175.22 175.70 1ly4 s VAL 122 N -0.88 4.22 -1.01 -0.44 1.01 0.62 0.24 120.40 124.16 1ly4 s VAL 122 Ca 0.14 -0.32 0.16 0.00 0.00 0.00 0.00 61.98 61.96 1ly4 s VAL 122 Cb -0.11 -3.03 -0.11 0.00 0.00 0.00 0.00 36.38 33.13 1ly4 s VAL 122 CO 0.03 0.26 0.73 2.30 0.00 0.00 0.00 175.10 178.43 1ly4 n ILE 123 N 4.91 0.00 0.00 2.22 -5.35 -0.84 0.23 119.36 120.53 1ly4 n ILE 123 Ca -0.16 -0.21 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 1ly4 n ILE 123 Cb 0.50 1.07 0.00 0.00 -1.74 0.00 0.00 39.64 39.48 1ly4 n ILE 123 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ly4 n GLY 124 N 1.29 0.95 0.00 3.28 0.00 -1.25 -4.85 105.19 104.61 1ly4 n GLY 124 Ca 0.04 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.98 1ly4 n GLY 124 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ly4 n GLY 125 N -1.47 1.86 0.41 -0.02 0.00 -1.26 0.87 105.19 105.58 1ly4 n GLY 125 Ca 0.00 -1.92 0.21 0.00 0.00 0.00 0.00 46.02 44.32 1ly4 n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ly4 h ALA 126 N -1.03 2.25 0.09 4.61 0.00 -1.95 0.21 119.26 123.43 1ly4 h ALA 126 Ca 0.00 0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.75 1ly4 h ALA 126 Cb 0.00 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.81 1ly4 h ALA 126 CO 0.00 -0.58 -0.80 1.96 0.00 0.00 0.00 179.25 179.83 1ly4 h GLN 127 N 0.39 0.39 -0.01 0.00 4.20 -1.94 -2.98 115.11 115.17 1ly4 h GLN 127 Ca 0.52 -0.54 -0.16 0.00 0.06 0.00 0.00 58.65 58.54 1ly4 h GLN 127 Cb 1.34 0.18 -0.02 0.00 0.30 0.00 0.00 27.48 29.28 1ly4 h GLN 127 CO -0.22 1.21 -0.72 1.25 -0.67 0.00 0.00 178.83 179.68 1ly4 h LEU 128 N -0.17 0.07 -1.05 1.46 5.85 -1.64 -3.25 115.31 116.57 1ly4 h LEU 128 Ca -0.12 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.51 1ly4 h LEU 128 Cb 1.56 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.54 1ly4 h LEU 128 CO 0.15 0.77 0.22 1.88 -0.34 0.00 0.00 178.44 181.12 1ly4 h TYR 129 N 0.04 0.91 -0.28 1.25 0.05 -0.64 -2.13 116.97 116.16 1ly4 h TYR 129 Ca -0.01 -0.06 -0.08 0.00 0.05 0.00 0.00 58.73 58.62 1ly4 h TYR 129 Cb 1.28 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 38.74 1ly4 h TYR 129 CO 0.01 0.71 -0.15 -0.22 -1.05 0.00 0.00 178.16 177.46 1ly4 h LYS 130 N 0.87 0.59 -0.27 4.88 1.63 -1.56 -2.76 116.57 119.96 1ly4 h LYS 130 Ca 0.20 -0.26 -0.15 0.00 -0.85 0.00 0.00 60.65 59.58 1ly4 h LYS 130 Cb 0.21 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.82 1ly4 h LYS 130 CO -0.01 0.84 -0.46 0.00 -3.45 0.00 0.00 179.45 176.37 1ly4 h ALA 131 N 0.74 0.69 0.00 5.00 0.00 -1.58 -3.15 119.26 120.95 1ly4 h ALA 131 Ca 0.06 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.47 1ly4 h ALA 131 Cb 0.67 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1ly4 h ALA 131 CO 0.04 0.67 -0.11 0.00 0.00 0.00 0.00 179.25 179.86 1ly4 h ALA 132 N 0.93 0.98 0.00 0.00 0.00 -1.34 -3.07 119.26 116.76 1ly4 h ALA 132 Ca 0.03 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 1ly4 h ALA 132 Cb 1.01 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1ly4 h ALA 132 CO 0.10 0.13 -0.63 0.52 0.00 0.00 0.00 179.25 179.37 1ly4 h MET 133 N 0.00 0.00 -0.03 0.00 2.07 -1.53 -3.17 114.93 112.26 1ly4 h MET 133 Ca -0.00 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.63 1ly4 h MET 133 Cb 0.77 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.50 1ly4 h MET 133 CO 0.01 0.50 0.00 -0.25 1.07 0.00 0.00 176.91 178.24 1ly4 n ASP 134 N -3.19 2.81 -4.67 1.22 10.43 -1.18 -4.95 116.55 117.02 1ly4 n ASP 134 Ca 0.01 -1.94 -0.40 0.00 2.57 0.00 0.00 54.79 55.03 1ly4 n ASP 134 Cb 0.75 -0.00 -0.05 0.00 1.84 0.00 0.00 41.12 43.66 1ly4 n ASP 134 CO 0.00 0.00 0.00 -2.28 -1.07 0.00 0.00 177.20 173.85 1ly4 s HIS 135 N -1.99 3.43 -0.62 1.24 2.46 -1.17 -4.93 115.29 113.70 1ly4 s HIS 135 Ca 0.29 1.08 0.05 0.00 0.47 0.00 0.00 55.06 56.96 1ly4 s HIS 135 Cb 0.20 -2.86 0.29 0.00 -0.13 0.00 0.00 32.58 30.09 1ly4 s HIS 135 CO 0.30 -0.14 1.09 -0.35 -2.47 0.00 0.00 174.74 173.18 1ly4 n PRO 136 N 4.86 0.04 0.00 2.88 -0.04 -1.26 -2.23 135.00 139.24 1ly4 n PRO 136 Ca 0.00 0.47 0.09 0.00 -0.04 0.00 0.00 63.50 64.03 1ly4 n PRO 136 Cb 0.50 -1.71 -0.07 0.00 -0.04 0.00 0.00 33.50 32.17 1ly4 n PRO 136 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1ly4 n LYS 137 N -1.64 0.87 -2.44 0.54 4.01 -1.26 -4.87 118.16 113.37 1ly4 n LYS 137 Ca -0.00 -0.32 -0.43 0.00 -0.51 0.00 0.00 58.31 57.04 1ly4 n LYS 137 Cb 0.10 -1.41 -0.02 0.00 -0.51 0.00 0.00 35.03 33.19 1ly4 n LYS 137 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 1ly4 s LEU 138 N -2.72 3.77 0.00 -0.35 1.98 -0.94 -0.76 118.68 119.66 1ly4 s LEU 138 Ca 0.11 0.99 0.00 0.00 -2.89 0.00 0.00 54.13 52.34 1ly4 s LEU 138 Cb 0.15 -3.54 0.00 0.00 0.66 0.00 0.00 46.19 43.46 1ly4 s LEU 138 CO 0.70 -1.19 0.19 -0.90 -1.89 0.00 0.00 176.35 173.26 1ly4 n ASP 139 N 7.96 0.38 -3.82 3.68 5.75 -1.10 -4.91 116.55 124.49 1ly4 n ASP 139 Ca 0.15 -0.68 -0.12 0.00 -0.01 0.00 0.00 54.79 54.12 1ly4 n ASP 139 Cb 0.47 0.57 -0.12 0.00 -1.03 0.00 0.00 41.12 41.01 1ly4 n ASP 139 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 1ly4 s ARG 140 N -0.57 0.23 -0.15 0.11 3.52 -1.23 -1.52 118.95 119.33 1ly4 s ARG 140 Ca 0.00 0.16 0.01 0.00 -0.13 0.00 0.00 55.73 55.77 1ly4 s ARG 140 Cb 0.00 0.11 0.02 0.00 -1.56 0.00 0.00 34.95 33.52 1ly4 s ARG 140 CO 0.00 -0.03 -0.17 0.42 -0.81 0.00 0.00 175.30 174.71 1ly4 s ILE 141 N -0.08 1.73 -0.51 4.11 1.01 0.23 -2.40 121.20 125.28 1ly4 s ILE 141 Ca -0.02 -0.74 -0.19 0.00 0.00 0.00 0.00 60.65 59.70 1ly4 s ILE 141 Cb -0.02 -1.59 0.06 0.00 0.01 0.00 0.00 42.46 40.93 1ly4 s ILE 141 CO 0.00 0.49 0.62 -0.04 0.00 0.00 0.00 174.94 176.01 1ly4 s MET 142 N 1.29 3.10 -0.09 2.79 -1.94 -0.63 -0.37 119.30 123.45 1ly4 s MET 142 Ca 0.02 -0.98 0.03 0.00 -1.71 0.00 0.00 55.69 53.05 1ly4 s MET 142 Cb -0.13 -4.12 -0.01 0.00 2.01 0.00 0.00 34.83 32.57 1ly4 s MET 142 CO -0.09 -1.24 -0.17 0.00 -0.01 0.00 0.00 175.02 173.50 1ly4 s ALA 143 N 2.55 2.47 -0.21 3.03 0.00 -0.35 -1.23 121.76 128.03 1ly4 s ALA 143 Ca 0.14 -0.96 -0.08 0.00 0.00 0.00 0.00 51.96 51.06 1ly4 s ALA 143 Cb -0.20 -0.98 -0.04 0.00 0.00 0.00 0.00 23.12 21.90 1ly4 s ALA 143 CO 0.11 0.37 0.08 0.99 0.00 0.00 0.00 175.76 177.30 1ly4 s THR 144 N -0.02 4.79 -0.26 0.00 2.01 0.88 0.24 115.64 123.27 1ly4 s THR 144 Ca -0.05 -0.03 -0.08 0.00 0.31 0.00 0.00 61.69 61.84 1ly4 s THR 144 Cb -0.14 -3.19 -0.03 0.00 0.01 0.00 0.00 72.50 69.14 1ly4 s THR 144 CO 0.04 0.41 0.11 -0.63 -0.69 0.00 0.00 174.62 173.87 1ly4 s ILE 145 N 0.77 4.60 -0.46 1.82 -1.09 0.69 -1.78 121.20 125.75 1ly4 s ILE 145 Ca 0.04 -0.11 -0.11 0.00 -2.23 0.00 0.00 60.65 58.24 1ly4 s ILE 145 Cb -0.13 -3.18 0.09 0.00 -1.58 0.00 0.00 42.46 37.66 1ly4 s ILE 145 CO 0.02 0.29 0.34 -0.63 -1.23 0.00 0.00 174.94 173.73 1ly4 s ILE 146 N 1.65 4.55 -1.39 2.92 1.09 -0.45 -1.53 121.20 128.04 1ly4 s ILE 146 Ca 0.06 -1.44 -0.15 0.00 -1.10 0.00 0.00 60.65 58.02 1ly4 s ILE 146 Cb -0.16 -3.84 0.06 0.00 -1.06 0.00 0.00 42.46 37.47 1ly4 s ILE 146 CO 0.06 -0.64 2.04 -1.22 -0.10 0.00 0.00 174.94 175.08 1ly4 n TYR 147 N 5.01 3.84 -3.58 3.97 4.01 -0.74 -2.64 117.16 127.04 1ly4 n TYR 147 Ca -0.10 -2.94 -0.12 0.00 -0.16 0.00 0.00 57.90 54.58 1ly4 n TYR 147 Cb 0.42 -2.51 -0.06 0.00 -0.31 0.00 0.00 39.34 36.88 1ly4 n TYR 147 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1ly4 s LYS 148 N 3.17 0.69 -1.00 -0.72 -0.14 -1.26 -4.15 119.74 116.33 1ly4 s LYS 148 Ca 0.48 0.30 -0.01 0.00 -1.36 0.00 0.00 55.97 55.38 1ly4 s LYS 148 Cb 0.10 0.33 0.31 0.00 -1.68 0.00 0.00 37.83 36.90 1ly4 s LYS 148 CO -0.03 -0.19 1.91 -3.47 -0.76 0.00 0.00 175.35 172.81 1ly4 n ASP 149 N 1.16 7.42 -4.77 2.83 2.03 -1.26 -4.47 116.55 119.50 1ly4 n ASP 149 Ca -0.13 -3.69 -0.41 0.00 0.52 0.00 0.00 54.79 51.08 1ly4 n ASP 149 Cb 0.57 -1.16 -0.01 0.00 -0.72 0.00 0.00 41.12 39.80 1ly4 n ASP 149 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1ly4 s ILE 150 N -4.33 2.27 -0.02 5.18 1.01 -1.26 -4.99 121.20 119.06 1ly4 s ILE 150 Ca 0.43 0.26 -0.30 0.00 0.00 0.00 0.00 60.65 61.03 1ly4 s ILE 150 Cb 0.24 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.51 1ly4 s ILE 150 CO -0.19 0.05 1.12 -2.28 0.00 0.00 0.00 174.94 173.64 1ly4 s HIS 151 N -0.72 3.42 0.16 3.97 5.65 -1.26 -4.96 115.29 121.55 1ly4 s HIS 151 Ca 0.55 1.41 0.03 0.00 0.25 0.00 0.00 55.06 57.31 1ly4 s HIS 151 Cb -0.45 -3.31 -0.05 0.00 -1.18 0.00 0.00 32.58 27.60 1ly4 s HIS 151 CO 0.55 -0.82 -0.05 0.00 -0.65 0.00 0.00 174.74 173.78 1ly4 n ASP 153 N -0.23 0.48 -4.36 0.00 5.75 0.42 -4.91 116.55 113.69 1ly4 n ASP 153 Ca -0.08 -0.46 -0.32 0.00 -0.01 0.00 0.00 54.79 53.92 1ly4 n ASP 153 Cb 0.62 1.00 -0.15 0.00 -1.03 0.00 0.00 41.12 41.56 1ly4 n ASP 153 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1ly4 s VAL 154 N -1.12 2.52 0.12 2.12 1.01 -0.66 -4.98 120.40 119.40 1ly4 s VAL 154 Ca 0.00 -0.91 0.09 0.00 0.00 0.00 0.00 61.98 61.16 1ly4 s VAL 154 Cb 0.00 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1ly4 s VAL 154 CO 0.01 0.57 -0.19 -0.36 0.00 0.00 0.00 175.10 175.14 1ly4 s PHE 155 N -0.39 2.51 0.13 5.22 0.40 -1.26 0.51 117.98 125.09 1ly4 s PHE 155 Ca 0.04 -0.28 -0.30 0.00 -0.60 0.00 0.00 56.93 55.78 1ly4 s PHE 155 Cb -0.12 -1.34 -0.07 0.00 0.51 0.00 0.00 43.02 42.00 1ly4 s PHE 155 CO 0.02 0.37 1.26 0.12 0.70 0.00 0.00 175.22 177.69 1ly4 s PHE 156 N -1.12 3.37 -1.28 0.36 5.36 0.58 -4.83 117.98 120.41 1ly4 s PHE 156 Ca 0.17 1.25 0.15 0.00 -0.96 0.00 0.00 56.93 57.54 1ly4 s PHE 156 Cb -0.10 -3.51 0.74 0.00 -0.34 0.00 0.00 43.02 39.81 1ly4 s PHE 156 CO 0.09 -1.59 1.46 -0.35 -1.46 0.00 0.00 175.22 173.37 1ly4 n PRO 157 N 3.32 0.15 -3.75 10.12 -0.04 -1.26 -4.68 135.00 138.86 1ly4 n PRO 157 Ca 0.08 0.17 -0.23 0.00 -0.04 0.00 0.00 63.50 63.48 1ly4 n PRO 157 Cb 0.44 -1.50 -0.18 0.00 -0.04 0.00 0.00 33.50 32.23 1ly4 n PRO 157 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1ly4 s LEU 158 N -2.72 0.55 -1.37 1.53 2.96 -1.26 -5.05 118.68 113.33 1ly4 s LEU 158 Ca 0.12 -0.11 -0.16 0.00 -0.22 0.00 0.00 54.13 53.76 1ly4 s LEU 158 Cb 0.10 -0.40 0.05 0.00 0.50 0.00 0.00 46.19 46.44 1ly4 s LEU 158 CO 0.25 -0.21 1.98 0.29 -1.32 0.00 0.00 176.35 177.34 1ly4 n LYS 159 N 5.17 2.98 0.22 1.98 5.02 -1.26 -4.70 118.16 127.56 1ly4 n LYS 159 Ca -0.07 -2.92 0.06 0.00 -2.02 0.00 0.00 58.31 53.36 1ly4 n LYS 159 Cb 0.50 -3.40 0.56 0.00 -0.02 0.00 0.00 35.03 32.67 1ly4 n LYS 159 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1ly4 h PHE 160 N 6.87 0.06 0.00 2.13 -0.00 -1.96 -2.79 116.94 121.24 1ly4 h PHE 160 Ca 0.50 -0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.47 1ly4 h PHE 160 Cb 0.76 -0.02 0.00 0.00 -0.00 0.00 0.00 35.95 36.69 1ly4 h PHE 160 CO 1.44 0.11 -0.35 0.54 -0.00 0.00 0.00 178.31 180.06 1ly4 n ARG 161 N -4.44 0.17 -1.64 6.09 1.74 -1.26 -4.71 116.66 112.60 1ly4 n ARG 161 Ca -0.02 0.08 -0.30 0.00 -0.77 0.00 0.00 57.85 56.83 1ly4 n ARG 161 Cb 0.15 -1.64 0.07 0.00 -1.02 0.00 0.00 32.46 30.02 1ly4 n ARG 161 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1ly4 s ASP 162 N -3.80 5.02 0.18 0.55 -1.08 -1.05 -4.99 116.67 111.50 1ly4 s ASP 162 Ca 0.10 1.36 -0.13 0.00 -0.52 0.00 0.00 52.55 53.35 1ly4 s ASP 162 Cb 0.15 -2.16 0.08 0.00 -1.46 0.00 0.00 42.92 39.53 1ly4 s ASP 162 CO 0.65 -1.64 1.80 0.50 0.52 0.00 0.00 175.17 177.01 1ly4 h LYS 163 N -0.86 0.79 -0.45 4.34 3.64 -1.92 -2.72 116.57 119.38 1ly4 h LYS 163 Ca -0.46 -0.08 0.13 0.00 -1.27 0.00 0.00 60.65 58.98 1ly4 h LYS 163 Cb 1.25 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.89 1ly4 h LYS 163 CO 0.60 0.58 0.64 1.05 -2.27 0.00 0.00 179.45 180.05 1ly4 h GLU 164 N 0.77 0.00 -0.04 1.90 4.11 -1.95 -1.74 114.58 117.63 1ly4 h GLU 164 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.63 1ly4 h GLU 164 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1ly4 h GLU 164 CO -0.04 0.00 0.00 0.91 0.07 0.00 0.00 179.01 179.95 1ly4 n TRP 165 N -3.37 0.11 0.26 2.06 7.02 -1.03 -4.76 117.44 117.73 1ly4 n TRP 165 Ca 0.09 -0.83 0.15 0.00 -1.02 0.00 0.00 57.50 55.89 1ly4 n TRP 165 Cb 0.81 -0.13 0.63 0.00 -2.42 0.00 0.00 31.31 30.20 1ly4 n TRP 165 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1ly4 h SER 166 N 0.25 0.00 0.57 -0.99 4.64 -1.34 -1.91 113.55 114.77 1ly4 h SER 166 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ly4 h SER 166 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1ly4 h SER 166 CO 0.02 0.05 -0.23 -1.54 -0.87 0.00 0.00 176.83 174.27 1ly4 n SER 167 N -3.17 0.40 -0.08 4.97 3.41 -1.26 -4.46 113.62 113.43 1ly4 n SER 167 Ca 0.00 -0.20 -0.16 0.00 -0.26 0.00 0.00 58.87 58.25 1ly4 n SER 167 Cb 0.34 -0.06 -0.05 0.00 -0.26 0.00 0.00 64.21 64.18 1ly4 n SER 167 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1ly4 n VAL 168 N -1.26 0.98 -3.82 -3.33 0.24 -1.00 -5.00 118.33 105.13 1ly4 n VAL 168 Ca 0.09 -0.16 -0.36 0.00 -2.04 0.00 0.00 64.34 61.87 1ly4 n VAL 168 Cb 0.32 -1.77 -0.07 0.00 -1.47 0.00 0.00 33.84 30.85 1ly4 n VAL 168 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 1ly4 s TRP 169 N -2.34 3.55 0.01 6.34 0.52 -0.75 -4.31 118.94 121.96 1ly4 s TRP 169 Ca -0.22 0.49 0.05 0.00 0.02 0.00 0.00 56.10 56.43 1ly4 s TRP 169 Cb 0.08 -2.02 -0.02 0.00 -1.15 0.00 0.00 33.47 30.37 1ly4 s TRP 169 CO 0.29 0.61 -0.14 0.15 0.02 0.00 0.00 176.95 177.87 1ly4 s LYS 170 N -0.62 1.04 -0.16 4.98 -0.14 -0.86 -4.46 119.74 119.51 1ly4 s LYS 170 Ca 0.13 -0.63 -0.20 0.00 -1.36 0.00 0.00 55.97 53.91 1ly4 s LYS 170 Cb -0.12 -1.03 -0.03 0.00 -1.68 0.00 0.00 37.83 34.97 1ly4 s LYS 170 CO 0.03 0.27 0.59 0.21 -0.76 0.00 0.00 175.35 175.69 1ly4 s LYS 171 N -0.74 4.27 0.67 1.68 2.20 -1.26 -0.98 119.74 125.59 1ly4 s LYS 171 Ca 0.04 0.59 -0.02 0.00 -0.36 0.00 0.00 55.97 56.22 1ly4 s LYS 171 Cb -0.07 -3.53 0.09 0.00 -1.51 0.00 0.00 37.83 32.81 1ly4 s LYS 171 CO 0.00 -0.10 0.94 -1.21 -0.36 0.00 0.00 175.35 174.63 1ly4 s GLU 172 N 1.45 2.00 0.44 4.03 0.41 -0.44 -4.98 118.70 121.61 1ly4 s GLU 172 Ca 0.29 -0.81 -0.23 0.00 -0.41 0.00 0.00 54.97 53.81 1ly4 s GLU 172 Cb -0.16 -2.33 -0.08 0.00 -1.78 0.00 0.00 34.13 29.79 1ly4 s GLU 172 CO 0.11 -1.22 1.13 0.15 -0.49 0.00 0.00 175.26 174.94 1ly4 s LYS 173 N -5.08 3.89 0.21 1.61 1.02 -1.26 -4.73 119.74 115.41 1ly4 s LYS 173 Ca 0.63 1.69 -0.09 0.00 0.02 0.00 0.00 55.97 58.21 1ly4 s LYS 173 Cb -0.08 -2.45 0.26 0.00 -0.52 0.00 0.00 37.83 35.04 1ly4 s LYS 173 CO 0.43 -0.42 1.80 1.25 -0.92 0.00 0.00 175.35 177.49 1ly4 h HIS 174 N 2.19 0.66 -0.62 3.18 -0.00 -1.97 -0.13 115.15 118.47 1ly4 h HIS 174 Ca -0.49 0.03 0.10 0.00 -0.00 0.00 0.00 60.37 60.00 1ly4 h HIS 174 Cb 1.24 -0.20 -0.04 0.00 -0.00 0.00 0.00 27.41 28.41 1ly4 h HIS 174 CO 0.55 0.30 0.41 0.66 -0.00 0.00 0.00 177.93 179.85 1ly4 h SER 175 N 0.66 0.40 0.69 3.26 4.64 -1.99 0.23 113.55 121.44 1ly4 h SER 175 Ca 0.31 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1ly4 h SER 175 Cb 0.23 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1ly4 h SER 175 CO -0.20 0.24 -0.68 -0.90 -0.87 0.00 0.00 176.83 174.42 1ly4 n ASP 176 N -4.47 0.63 0.28 4.97 5.68 -0.18 -0.93 116.55 122.53 1ly4 n ASP 176 Ca 0.10 -0.04 -0.12 0.00 -0.50 0.00 0.00 54.79 54.24 1ly4 n ASP 176 Cb 0.36 0.32 -0.05 0.00 -1.14 0.00 0.00 41.12 40.60 1ly4 n ASP 176 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1ly4 h LEU 177 N 0.00 -0.64 -0.53 -2.12 5.85 0.60 -1.55 115.31 116.93 1ly4 h LEU 177 Ca 0.00 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.78 1ly4 h LEU 177 Cb 0.68 0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.84 1ly4 h LEU 177 CO 0.00 -0.26 0.29 -0.33 -0.34 0.00 0.00 178.44 177.79 1ly4 h GLU 178 N -1.14 0.54 -0.92 1.25 5.08 -1.28 -0.38 114.58 117.73 1ly4 h GLU 178 Ca -0.08 -0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.37 1ly4 h GLU 178 Cb 0.58 -0.12 -0.07 0.00 0.50 0.00 0.00 28.75 29.63 1ly4 h GLU 178 CO 0.13 0.36 0.59 1.03 -1.00 0.00 0.00 179.01 180.11 1ly4 h SER 179 N 0.56 0.78 -0.15 1.42 0.87 -1.02 -1.82 113.55 114.20 1ly4 h SER 179 Ca 0.23 0.03 -0.10 0.00 -1.23 0.00 0.00 61.79 60.72 1ly4 h SER 179 Cb 0.10 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 1ly4 h SER 179 CO -0.14 0.43 -0.28 -0.25 -0.53 0.00 0.00 176.83 176.06 1ly4 h TRP 180 N 0.85 0.57 0.00 2.24 7.01 -0.03 -3.38 115.95 123.21 1ly4 h TRP 180 Ca 0.44 -0.20 0.00 0.00 2.11 0.00 0.00 58.89 61.24 1ly4 h TRP 180 Cb 0.52 -0.11 0.00 0.00 -2.10 0.00 0.00 29.16 27.48 1ly4 h TRP 180 CO -0.00 0.91 0.00 1.33 -2.79 0.00 0.00 178.44 177.89 1ly4 n VAL 181 N -4.40 0.00 0.00 2.65 0.24 -0.70 -5.05 118.33 111.06 1ly4 n VAL 181 Ca -0.07 0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.27 1ly4 n VAL 181 Cb 0.46 -0.33 0.00 0.00 -1.47 0.00 0.00 33.84 32.50 1ly4 n VAL 181 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ly4 n GLY 182 N 2.64 -2.03 1.24 7.63 0.00 -0.71 -5.02 105.19 108.93 1ly4 n GLY 182 Ca 0.00 0.78 -0.15 0.00 0.00 0.00 0.00 46.02 46.65 1ly4 n GLY 182 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ly4 n THR 183 N 0.00 0.00 -2.31 2.61 -2.24 -1.26 -4.54 114.28 106.54 1ly4 n THR 183 Ca 0.00 -0.19 -0.41 0.00 -2.27 0.00 0.00 64.05 61.18 1ly4 n THR 183 Cb 0.00 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.20 1ly4 n THR 183 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1ly4 s LYS 184 N -0.44 4.50 -0.02 -0.78 1.02 -1.26 -4.66 119.74 118.09 1ly4 s LYS 184 Ca 0.21 1.98 0.04 0.00 0.02 0.00 0.00 55.97 58.23 1ly4 s LYS 184 Cb -0.17 -3.15 -0.01 0.00 -0.52 0.00 0.00 37.83 33.98 1ly4 s LYS 184 CO 0.26 0.00 -0.15 0.08 -0.92 0.00 0.00 175.35 174.63 1ly4 s VAL 185 N -0.97 1.19 -0.12 3.17 1.01 -1.26 -5.08 120.40 118.33 1ly4 s VAL 185 Ca 0.48 -0.63 -0.39 0.00 0.00 0.00 0.00 61.98 61.44 1ly4 s VAL 185 Cb -0.35 -1.00 -0.16 0.00 0.00 0.00 0.00 36.38 34.86 1ly4 s VAL 185 CO 0.45 0.34 1.57 -2.65 0.00 0.00 0.00 175.10 174.81 1ly4 n PRO 186 N 2.85 1.14 -0.36 2.72 -0.02 -1.26 -4.96 135.00 135.12 1ly4 n PRO 186 Ca -0.15 0.42 -0.06 0.00 -2.02 0.00 0.00 63.50 61.68 1ly4 n PRO 186 Cb 0.54 -2.08 0.05 0.00 -0.02 0.00 0.00 33.50 31.99 1ly4 n PRO 186 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1ly4 n HIS 187 N 4.16 -3.77 0.00 6.00 -0.00 -1.26 -4.79 115.22 115.56 1ly4 n HIS 187 Ca 0.23 -0.24 0.00 0.00 0.46 0.00 0.00 57.72 58.17 1ly4 n HIS 187 Cb 0.15 -0.23 0.00 0.00 -0.12 0.00 0.00 29.99 29.80 1ly4 n HIS 187 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1ly4 n GLY 188 N 2.50 0.00 3.74 1.57 0.00 -1.26 -4.74 105.19 107.01 1ly4 n GLY 188 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1ly4 n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ly4 s LYS 189 N 0.00 4.31 -0.01 1.61 1.02 -1.26 -4.59 119.74 120.82 1ly4 s LYS 189 Ca 0.00 2.20 0.05 0.00 0.02 0.00 0.00 55.97 58.24 1ly4 s LYS 189 Cb 0.00 -3.15 -0.01 0.00 -0.52 0.00 0.00 37.83 34.15 1ly4 s LYS 189 CO 0.00 -0.37 -0.16 0.42 -0.92 0.00 0.00 175.35 174.32 1ly4 s ILE 190 N 0.16 1.23 -0.05 2.17 1.09 -0.48 -4.96 121.20 120.36 1ly4 s ILE 190 Ca 0.59 -0.66 -0.02 0.00 -1.10 0.00 0.00 60.65 59.46 1ly4 s ILE 190 Cb -0.40 -1.03 0.03 0.00 -1.06 0.00 0.00 42.46 40.01 1ly4 s ILE 190 CO 0.40 0.35 0.04 0.21 -0.10 0.00 0.00 174.94 175.84 1ly4 s ASN 191 N -0.33 1.17 -0.10 3.58 3.84 -1.26 0.57 114.94 122.41 1ly4 s ASN 191 Ca 0.05 0.04 -0.05 0.00 0.21 0.00 0.00 52.86 53.11 1ly4 s ASN 191 Cb -0.06 -0.21 0.05 0.00 -0.55 0.00 0.00 41.25 40.47 1ly4 s ASN 191 CO -0.00 -0.23 0.23 -0.70 -2.79 0.00 0.00 177.10 173.61 1ly4 s GLU 192 N 2.03 0.19 -1.48 0.43 2.12 -0.93 -4.91 118.70 116.15 1ly4 s GLU 192 Ca 0.04 0.52 -0.07 0.00 0.36 0.00 0.00 54.97 55.82 1ly4 s GLU 192 Cb -0.12 -0.13 0.01 0.00 0.26 0.00 0.00 34.13 34.15 1ly4 s GLU 192 CO -0.03 -0.17 0.87 -0.25 -0.54 0.00 0.00 175.26 175.13 1ly4 n ASP 193 N 4.30 -6.27 0.00 -1.70 8.00 -1.26 -3.34 116.55 116.27 1ly4 n ASP 193 Ca -0.24 -0.40 0.00 0.00 0.71 0.00 0.00 54.79 54.85 1ly4 n ASP 193 Cb 0.53 -5.00 0.00 0.00 -0.02 0.00 0.00 41.12 36.62 1ly4 n ASP 193 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ly4 n GLY 194 N -1.75 2.15 3.75 0.44 0.00 -1.26 -5.04 105.19 103.47 1ly4 n GLY 194 Ca -0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 1ly4 n GLY 194 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ly4 s PHE 195 N -2.31 3.14 -0.21 1.61 0.40 -1.21 -5.08 117.98 114.31 1ly4 s PHE 195 Ca 0.00 0.06 -0.06 0.00 -0.60 0.00 0.00 56.93 56.32 1ly4 s PHE 195 Cb 0.00 -1.61 -0.03 0.00 0.51 0.00 0.00 43.02 41.89 1ly4 s PHE 195 CO 0.00 0.51 0.04 -0.51 0.70 0.00 0.00 175.22 175.96 1ly4 s ASP 196 N -2.31 5.17 0.12 1.36 1.01 -1.26 -2.19 116.67 118.58 1ly4 s ASP 196 Ca 0.28 -0.12 -0.01 0.00 0.71 0.00 0.00 52.55 53.41 1ly4 s ASP 196 Cb -0.12 -1.90 -0.04 0.00 1.01 0.00 0.00 42.92 41.87 1ly4 s ASP 196 CO 0.20 0.07 0.03 -0.72 0.21 0.00 0.00 175.17 174.96 1ly4 s TYR 197 N 0.99 0.86 -0.01 4.23 -0.85 0.19 -1.80 117.35 120.97 1ly4 s TYR 197 Ca 0.03 -1.17 -0.09 0.00 -0.52 0.00 0.00 57.07 55.31 1ly4 s TYR 197 Cb -0.14 -0.50 0.01 0.00 0.38 0.00 0.00 41.96 41.71 1ly4 s TYR 197 CO 0.02 -0.45 0.19 -2.00 -1.52 0.00 0.00 175.55 171.80 1ly4 s GLU 198 N -4.01 0.52 -0.25 -3.49 2.12 -0.58 -1.39 118.70 111.63 1ly4 s GLU 198 Ca 0.21 -0.29 -0.13 0.00 0.36 0.00 0.00 54.97 55.12 1ly4 s GLU 198 Cb 0.07 0.22 -0.04 0.00 0.26 0.00 0.00 34.13 34.64 1ly4 s GLU 198 CO 0.00 -0.13 0.29 -0.06 -0.54 0.00 0.00 175.26 174.83 1ly4 s PHE 199 N -1.25 3.29 0.16 5.30 0.08 -1.26 -0.22 117.98 124.08 1ly4 s PHE 199 Ca -0.13 0.37 0.06 0.00 0.12 0.00 0.00 56.93 57.34 1ly4 s PHE 199 Cb -0.06 -2.45 -0.04 0.00 -0.57 0.00 0.00 43.02 39.89 1ly4 s PHE 199 CO 0.02 -0.08 -0.13 -1.21 -0.10 0.00 0.00 175.22 173.72 1ly4 s GLU 200 N 1.55 1.14 -0.16 0.44 2.02 0.14 -5.00 118.70 118.83 1ly4 s GLU 200 Ca 0.13 -1.45 0.01 0.00 0.02 0.00 0.00 54.97 53.68 1ly4 s GLU 200 Cb -0.15 -0.86 0.02 0.00 0.10 0.00 0.00 34.13 33.24 1ly4 s GLU 200 CO 0.08 0.14 -0.18 1.41 0.02 0.00 0.00 175.26 176.73 1ly4 s MET 201 N -3.46 2.70 -0.07 1.61 -2.45 -1.26 -1.21 119.30 115.16 1ly4 s MET 201 Ca 0.17 -0.72 0.05 0.00 -1.25 0.00 0.00 55.69 53.94 1ly4 s MET 201 Cb -0.00 -2.34 -0.01 0.00 1.25 0.00 0.00 34.83 33.73 1ly4 s MET 201 CO 0.03 -0.17 -0.22 -1.58 1.05 0.00 0.00 175.02 174.13 1ly4 s TRP 202 N 1.25 2.53 0.07 4.11 0.52 0.50 -1.33 118.94 126.59 1ly4 s TRP 202 Ca 0.02 -0.67 0.02 0.00 0.02 0.00 0.00 56.10 55.49 1ly4 s TRP 202 Cb -0.13 -1.65 -0.03 0.00 -1.15 0.00 0.00 33.47 30.51 1ly4 s TRP 202 CO -0.09 -0.18 -0.07 0.95 0.02 0.00 0.00 176.95 177.57 1ly4 s THR 203 N -0.12 0.62 0.29 2.01 -4.23 -0.15 0.75 115.64 114.80 1ly4 s THR 203 Ca -0.04 -1.47 0.04 0.00 -1.18 0.00 0.00 61.69 59.04 1ly4 s THR 203 Cb -0.14 -1.10 -0.06 0.00 1.34 0.00 0.00 72.50 72.55 1ly4 s THR 203 CO 0.04 -0.60 0.04 0.00 -0.54 0.00 0.00 174.62 173.56 1ly4 s ARG 204 N -2.59 1.53 -0.10 3.99 1.70 -0.58 -2.04 118.95 120.87 1ly4 s ARG 204 Ca -0.00 -1.82 -0.02 0.00 -0.47 0.00 0.00 55.73 53.42 1ly4 s ARG 204 Cb -0.03 -0.76 -0.03 0.00 -0.57 0.00 0.00 34.95 33.56 1ly4 s ARG 204 CO -0.02 -0.15 -0.03 -0.51 -1.08 0.00 0.00 175.30 173.51 1ly4 s ASP 205 N -3.42 4.94 0.00 -2.89 1.01 -1.26 -4.84 116.67 110.22 1ly4 s ASP 205 Ca 0.34 0.01 0.31 0.00 0.71 0.00 0.00 52.55 53.93 1ly4 s ASP 205 Cb 0.07 -1.49 1.77 0.00 1.01 0.00 0.00 42.92 44.29 1ly4 s ASP 205 CO 0.13 0.31 2.15 0.18 0.21 0.00 0.00 175.17 178.15