#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p4s s ARG 2 N 0.00 1.98 -0.08 0.03 3.00 -1.26 -4.07 118.95 118.55 1p4s s ARG 2 Ca 0.00 -2.15 -0.14 0.00 0.00 0.00 0.00 55.73 53.44 1p4s s ARG 2 Cb 0.00 -1.57 0.03 0.00 0.00 0.00 0.00 34.95 33.41 1p4s s ARG 2 CO 0.00 -0.11 0.35 0.54 0.00 0.00 0.00 175.30 176.08 1p4s s VAL 3 N -2.78 0.02 -0.02 3.52 0.11 -0.83 -2.73 120.40 117.71 1p4s s VAL 3 Ca 0.30 -0.21 0.00 0.00 -2.93 0.00 0.00 61.98 59.15 1p4s s VAL 3 Cb 0.08 -0.57 0.02 0.00 -1.53 0.00 0.00 36.38 34.38 1p4s s VAL 3 CO 0.15 -0.11 -0.00 -1.48 -3.33 0.00 0.00 175.10 170.33 1p4s s LEU 4 N -0.50 1.50 -0.23 2.54 0.05 -0.86 -2.00 118.68 119.18 1p4s s LEU 4 Ca -0.06 -0.01 -0.06 0.00 0.05 0.00 0.00 54.13 54.05 1p4s s LEU 4 Cb -0.04 -0.13 -0.02 0.00 -2.05 0.00 0.00 46.19 43.95 1p4s s LEU 4 CO 0.02 -0.06 0.02 -0.22 -0.55 0.00 0.00 176.35 175.57 1p4s s LEU 5 N 0.58 3.23 -0.02 1.48 0.20 -0.44 -1.65 118.68 122.06 1p4s s LEU 5 Ca -0.05 -0.26 -0.04 0.00 0.69 0.00 0.00 54.13 54.47 1p4s s LEU 5 Cb -0.08 -1.84 -0.04 0.00 -0.43 0.00 0.00 46.19 43.80 1p4s s LEU 5 CO -0.01 -0.00 0.19 -0.76 -0.29 0.00 0.00 176.35 175.48 1p4s s LEU 6 N 1.40 4.37 0.00 -0.68 1.43 -0.58 -2.16 118.68 122.45 1p4s s LEU 6 Ca 0.05 0.40 0.00 0.00 -1.03 0.00 0.00 54.13 53.55 1p4s s LEU 6 Cb -0.15 -2.54 0.00 0.00 0.03 0.00 0.00 46.19 43.53 1p4s s LEU 6 CO 0.01 0.28 0.00 0.61 0.23 0.00 0.00 176.35 177.48 1p4s n GLY 7 N 1.13 2.45 3.65 -3.19 0.00 -1.26 -1.84 105.19 106.13 1p4s n GLY 7 Ca -0.12 -0.88 -0.43 0.00 0.00 0.00 0.00 46.02 44.59 1p4s n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1p4s s PRO 8 N -2.00 4.10 -0.21 1.61 0.04 -1.26 -4.96 135.00 132.33 1p4s s PRO 8 Ca 0.00 1.81 -0.29 0.00 0.04 0.00 0.00 61.00 62.57 1p4s s PRO 8 Cb 0.00 -3.90 -0.04 0.00 0.04 0.00 0.00 34.50 30.60 1p4s s PRO 8 CO 0.00 -0.90 1.88 -2.14 0.04 0.00 0.00 177.00 175.88 1p4s s PRO 9 N 3.97 3.55 0.00 0.56 0.02 -1.26 -4.63 135.00 137.22 1p4s s PRO 9 Ca 0.65 1.85 0.00 0.00 0.02 0.00 0.00 61.00 63.52 1p4s s PRO 9 Cb -0.26 -4.19 0.00 0.00 0.02 0.00 0.00 34.50 30.07 1p4s s PRO 9 CO 0.23 -1.60 0.00 0.41 -0.33 0.00 0.00 177.00 175.71 1p4s n GLY 10 N 5.13 -2.22 0.00 0.52 0.00 -1.26 -4.94 105.19 102.41 1p4s n GLY 10 Ca 0.23 0.78 0.00 0.00 0.00 0.00 0.00 46.02 47.03 1p4s n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p4s n ALA 11 N -2.37 0.00 -2.72 4.61 0.00 -1.26 -4.90 120.51 113.87 1p4s n ALA 11 Ca 0.00 -0.05 -0.43 0.00 0.00 0.00 0.00 53.44 52.95 1p4s n ALA 11 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1p4s n ALA 11 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1p4s s GLY 12 N -2.09 1.73 0.00 0.00 0.00 -1.26 -4.67 107.32 101.02 1p4s s GLY 12 Ca 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 44.72 43.11 1p4s s GLY 12 CO 0.00 1.54 0.00 0.28 0.00 0.00 0.00 173.10 174.92 1p4s n LYS 13 N 6.32 0.00 0.02 2.90 5.02 -1.26 -4.85 118.16 126.31 1p4s n LYS 13 Ca -0.05 0.00 0.21 0.00 -2.02 0.00 0.00 58.31 56.45 1p4s n LYS 13 Cb 0.46 0.00 0.72 0.00 -0.02 0.00 0.00 35.03 36.19 1p4s n LYS 13 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1p4s h GLY 14 N 0.00 0.00 0.72 0.72 0.00 -1.95 -2.08 103.07 100.48 1p4s h GLY 14 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1p4s h GLY 14 CO 0.00 0.00 -0.10 -0.84 0.00 0.00 0.00 176.54 175.60 1p4s h THR 15 N 0.00 0.86 0.00 4.70 2.02 -1.95 -2.43 112.91 116.11 1p4s h THR 15 Ca 0.25 -0.56 0.00 0.00 0.77 0.00 0.00 66.41 66.87 1p4s h THR 15 Cb 1.09 1.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.69 1p4s h THR 15 CO -0.00 0.12 0.00 0.00 0.37 0.00 0.00 175.52 176.01 1p4s n GLN 16 N -5.09 0.17 -0.05 6.66 3.00 -1.20 -2.50 117.38 118.36 1p4s n GLN 16 Ca -0.09 0.22 -0.12 0.00 -0.01 0.00 0.00 57.00 57.00 1p4s n GLN 16 Cb 0.23 -1.73 -0.07 0.00 0.00 0.00 0.00 30.24 28.67 1p4s n GLN 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1p4s h ALA 17 N 2.56 0.20 -0.57 -1.58 0.00 -1.32 -2.24 119.26 116.29 1p4s h ALA 17 Ca 0.00 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.54 1p4s h ALA 17 Cb 0.55 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1p4s h ALA 17 CO 0.00 -0.01 -0.07 -0.24 0.00 0.00 0.00 179.25 178.94 1p4s h VAL 18 N -0.05 1.27 -0.53 0.00 3.04 -1.50 -2.34 116.25 116.14 1p4s h VAL 18 Ca 0.03 -1.23 -0.02 0.00 -1.01 0.00 0.00 66.70 64.48 1p4s h VAL 18 Cb 0.54 0.89 -0.02 0.00 -2.01 0.00 0.00 31.29 30.68 1p4s h VAL 18 CO 0.02 0.44 0.26 0.11 -1.01 0.00 0.00 177.57 177.39 1p4s h LYS 19 N 0.95 0.75 -0.18 4.17 1.57 -1.61 -2.54 116.57 119.68 1p4s h LYS 19 Ca 0.15 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 1p4s h LYS 19 Cb 0.64 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 1p4s h LYS 19 CO 0.04 0.61 -0.09 1.25 -0.57 0.00 0.00 179.45 180.69 1p4s h LEU 20 N 0.70 0.26 -0.76 2.94 6.46 -1.41 -2.55 115.31 120.95 1p4s h LEU 20 Ca 0.18 -0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.90 1p4s h LEU 20 Cb 0.10 -0.07 -0.04 0.00 -0.73 0.00 0.00 40.66 39.92 1p4s h LEU 20 CO -0.02 0.38 0.48 0.00 -0.62 0.00 0.00 178.44 178.66 1p4s h ALA 21 N 1.65 0.96 -0.97 1.25 0.00 -1.34 -2.41 119.26 118.40 1p4s h ALA 21 Ca 0.06 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.95 1p4s h ALA 21 Cb 0.33 -0.31 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 1p4s h ALA 21 CO 0.02 0.40 0.63 1.49 0.00 0.00 0.00 179.25 181.79 1p4s h GLU 22 N 1.03 1.15 0.35 0.00 4.81 -1.26 -0.42 114.58 120.25 1p4s h GLU 22 Ca 0.28 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 1p4s h GLU 22 Cb -0.08 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.04 1p4s h GLU 22 CO -0.06 0.76 -0.17 0.87 -0.73 0.00 0.00 179.01 179.69 1p4s h LYS 23 N 1.19 -0.45 0.00 1.92 1.79 -1.25 -3.36 116.57 116.40 1p4s h LYS 23 Ca 0.40 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.90 1p4s h LYS 23 Cb 0.07 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 1p4s h LYS 23 CO -0.14 -0.15 -0.35 -0.07 -1.08 0.00 0.00 179.45 177.67 1p4s h LEU 24 N -0.77 0.00 -0.56 2.94 3.38 -1.52 -3.49 115.31 115.29 1p4s h LEU 24 Ca -0.05 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1p4s h LEU 24 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1p4s h LEU 24 CO 0.08 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.22 1p4s n GLY 25 N 1.14 0.97 3.77 0.83 0.00 -0.19 -5.07 105.19 106.63 1p4s n GLY 25 Ca 0.03 -0.46 -0.23 0.00 0.00 0.00 0.00 46.02 45.35 1p4s n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1p4s s ILE 26 N -2.56 4.22 -0.72 -0.61 -1.09 -1.05 -4.99 121.20 114.40 1p4s s ILE 26 Ca 0.00 -1.43 -0.25 0.00 -2.23 0.00 0.00 60.65 56.73 1p4s s ILE 26 Cb 0.00 -3.24 0.04 0.00 -1.58 0.00 0.00 42.46 37.69 1p4s s ILE 26 CO 0.00 -0.29 1.17 -2.16 -1.23 0.00 0.00 174.94 172.44 1p4s s PRO 27 N -3.59 3.17 -0.21 2.79 0.04 -1.26 -4.82 135.00 131.12 1p4s s PRO 27 Ca 0.32 -0.47 -0.29 0.00 0.04 0.00 0.00 61.00 60.60 1p4s s PRO 27 Cb -0.08 -4.22 -0.04 0.00 0.04 0.00 0.00 34.50 30.20 1p4s s PRO 27 CO 0.23 -2.04 1.96 -1.14 0.04 0.00 0.00 177.00 176.06 1p4s s GLN 28 N 5.14 3.44 -0.43 4.56 -0.44 -1.26 -4.23 119.66 126.43 1p4s s GLN 28 Ca 0.31 1.88 -0.15 0.00 -2.50 0.00 0.00 55.36 54.89 1p4s s GLN 28 Cb -0.11 -4.24 0.04 0.00 -1.64 0.00 0.00 33.01 27.06 1p4s s GLN 28 CO 0.13 -1.74 0.34 0.42 0.50 0.00 0.00 175.29 174.94 1p4s s ILE 29 N 6.84 5.24 -0.19 -2.34 -1.09 -0.35 -5.02 121.20 124.30 1p4s s ILE 29 Ca 0.88 -0.77 -0.12 0.00 -2.23 0.00 0.00 60.65 58.40 1p4s s ILE 29 Cb -0.30 -4.00 -0.05 0.00 -1.58 0.00 0.00 42.46 36.54 1p4s s ILE 29 CO 0.34 -0.40 0.23 -0.94 -1.23 0.00 0.00 174.94 172.95 1p4s s SER 30 N 1.98 6.31 0.53 3.58 1.04 -1.26 -1.96 113.70 123.92 1p4s s SER 30 Ca 0.05 0.36 0.34 0.00 0.48 0.00 0.00 55.95 57.17 1p4s s SER 30 Cb -0.21 -2.15 1.44 0.00 0.10 0.00 0.00 66.02 65.20 1p4s s SER 30 CO 0.09 0.10 1.99 0.71 0.98 0.00 0.00 173.24 177.11 1p4s h THR 31 N 4.78 0.00 0.00 2.02 1.35 -1.83 -2.65 112.91 116.58 1p4s h THR 31 Ca -0.40 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 65.04 1p4s h THR 31 Cb 1.16 1.38 0.00 0.00 -1.73 0.00 0.00 68.15 68.97 1p4s h THR 31 CO 0.74 0.00 -0.17 1.23 -0.25 0.00 0.00 175.52 177.07 1p4s h GLY 32 N 1.83 0.00 0.00 5.82 0.00 -1.92 -3.39 103.07 105.42 1p4s h GLY 32 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1p4s h GLY 32 CO 0.00 0.00 -0.10 -2.09 0.00 0.00 0.00 176.54 174.35 1p4s h GLU 33 N 0.00 0.00 -0.61 4.80 4.81 -1.90 -1.93 114.58 119.75 1p4s h GLU 33 Ca 0.00 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 1p4s h GLU 33 Cb 0.99 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.35 1p4s h GLU 33 CO 0.00 0.86 0.10 1.37 -0.73 0.00 0.00 179.01 180.61 1p4s h LEU 34 N -1.00 0.97 -0.54 1.64 -0.00 -1.82 -2.46 115.31 112.10 1p4s h LEU 34 Ca -0.03 -0.26 -0.09 0.00 -0.00 0.00 0.00 57.88 57.51 1p4s h LEU 34 Cb 0.89 -0.26 -0.02 0.00 -0.00 0.00 0.00 40.66 41.27 1p4s h LEU 34 CO -0.02 0.98 -0.02 -0.26 -0.00 0.00 0.00 178.44 179.13 1p4s h PHE 35 N 0.92 1.05 -0.74 0.17 0.04 -1.75 -1.87 116.94 114.75 1p4s h PHE 35 Ca 0.19 -0.19 0.02 0.00 2.80 0.00 0.00 57.97 60.79 1p4s h PHE 35 Cb 0.42 -0.27 -0.04 0.00 2.20 0.00 0.00 35.95 38.26 1p4s h PHE 35 CO 0.03 0.97 0.48 -0.09 -0.60 0.00 0.00 178.31 179.10 1p4s h ARG 36 N 0.84 0.93 -0.94 1.51 9.65 -1.38 -0.54 114.38 124.45 1p4s h ARG 36 Ca 0.15 -0.06 0.03 0.00 -1.10 0.00 0.00 59.98 59.00 1p4s h ARG 36 Cb 0.56 -0.21 -0.05 0.00 -1.39 0.00 0.00 29.97 28.88 1p4s h ARG 36 CO 0.03 0.62 0.62 -0.09 2.80 0.00 0.00 179.97 183.95 1p4s h ARG 37 N 0.96 1.18 0.00 0.20 2.43 -1.40 -2.41 114.38 115.33 1p4s h ARG 37 Ca 0.29 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.34 1p4s h ARG 37 Cb -0.05 -0.27 -0.01 0.00 -0.42 0.00 0.00 29.97 29.23 1p4s h ARG 37 CO -0.09 0.78 -0.21 -0.91 -1.51 0.00 0.00 179.97 178.03 1p4s h ASN 38 N 1.21 0.00 -0.04 -3.80 2.35 -1.10 -2.18 115.58 112.02 1p4s h ASN 38 Ca 0.36 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.11 1p4s h ASN 38 Cb -0.05 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.32 1p4s h ASN 38 CO -0.10 0.21 0.02 0.40 -1.65 0.00 0.00 177.43 176.31 1p4s h ILE 39 N 0.00 1.13 -0.18 2.81 2.04 -0.63 -1.12 117.51 121.57 1p4s h ILE 39 Ca -0.00 -0.40 -0.10 0.00 1.00 0.00 0.00 64.86 65.36 1p4s h ILE 39 Cb 0.65 1.32 -0.01 0.00 -0.74 0.00 0.00 36.82 38.03 1p4s h ILE 39 CO 0.03 0.11 -0.32 -0.33 0.00 0.00 0.00 178.15 177.63 1p4s h GLU 40 N -0.09 0.36 -0.08 2.37 3.07 -1.44 -3.27 114.58 115.51 1p4s h GLU 40 Ca 0.01 -0.15 -0.19 0.00 -0.50 0.00 0.00 59.36 58.53 1p4s h GLU 40 Cb 0.16 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.05 1p4s h GLU 40 CO -0.00 0.65 -0.76 0.93 -1.40 0.00 0.00 179.01 178.43 1p4s h GLU 41 N 0.31 0.47 -1.98 2.33 4.39 -1.43 -3.50 114.58 115.16 1p4s h GLU 41 Ca 0.04 -0.39 0.00 0.00 0.34 0.00 0.00 59.36 59.35 1p4s h GLU 41 Cb 0.73 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.46 1p4s h GLU 41 CO 0.06 1.03 0.00 0.41 -1.16 0.00 0.00 179.01 179.34 1p4s n GLY 42 N 0.62 -0.03 0.03 -3.84 0.00 -0.44 -5.08 105.19 96.45 1p4s n GLY 42 Ca -0.05 -0.35 -0.02 0.00 0.00 0.00 0.00 46.02 45.60 1p4s n GLY 42 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1p4s n THR 43 N -0.54 0.63 0.00 2.61 -2.24 -1.13 -5.07 114.28 108.54 1p4s n THR 43 Ca 0.00 0.37 0.00 0.00 -2.27 0.00 0.00 64.05 62.15 1p4s n THR 43 Cb 0.21 -1.89 0.00 0.00 -2.10 0.00 0.00 70.33 66.54 1p4s n THR 43 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1p4s n LYS 44 N -3.30 0.00 -0.00 -0.78 2.85 -1.26 -4.86 118.16 110.80 1p4s n LYS 44 Ca -0.03 0.00 0.05 0.00 -1.05 0.00 0.00 58.31 57.28 1p4s n LYS 44 Cb 0.12 0.00 0.30 0.00 -0.65 0.00 0.00 35.03 34.80 1p4s n LYS 44 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 177.40 178.82 1p4s n LEU 45 N 0.00 0.01 -0.09 -5.58 -0.00 -1.26 -3.80 117.00 106.28 1p4s n LEU 45 Ca 0.00 -0.00 -0.15 0.00 -0.00 0.00 0.00 56.01 55.86 1p4s n LEU 45 Cb 0.00 -0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.33 1p4s n LEU 45 CO 0.00 0.00 -0.24 1.23 -0.00 0.00 0.00 177.39 178.38 1p4s h GLY 46 N 5.68 0.00 0.00 1.47 0.00 -1.88 -3.40 103.07 104.94 1p4s h GLY 46 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1p4s h GLY 46 CO 0.00 0.00 -0.02 -0.24 0.00 0.00 0.00 176.54 176.28 1p4s h VAL 47 N -1.00 1.42 -0.32 4.60 3.04 -1.84 -1.58 116.25 120.57 1p4s h VAL 47 Ca -0.17 -2.07 -0.06 0.00 -1.01 0.00 0.00 66.70 63.38 1p4s h VAL 47 Cb 0.97 2.70 -0.01 0.00 -2.01 0.00 0.00 31.29 32.94 1p4s h VAL 47 CO -0.11 0.48 -0.04 -0.33 -1.01 0.00 0.00 177.57 176.56 1p4s h GLU 48 N -1.00 0.60 -0.04 4.17 5.08 -1.89 -2.64 114.58 118.86 1p4s h GLU 48 Ca -0.00 -0.21 -0.10 0.00 -1.00 0.00 0.00 59.36 58.05 1p4s h GLU 48 Cb 0.80 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 1p4s h GLU 48 CO -0.00 0.76 -0.43 0.00 -1.00 0.00 0.00 179.01 178.34 1p4s h ALA 49 N 0.82 1.22 -0.17 3.43 0.00 -1.77 -2.55 119.26 120.23 1p4s h ALA 49 Ca 0.09 -0.40 -0.18 0.00 0.00 0.00 0.00 54.91 54.42 1p4s h ALA 49 Cb 0.52 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1p4s h ALA 49 CO 0.03 0.56 -0.62 -0.22 0.00 0.00 0.00 179.25 179.00 1p4s h LYS 50 N 0.07 0.59 0.41 0.00 1.63 -1.36 -2.48 116.57 115.42 1p4s h LYS 50 Ca 0.00 -0.41 -0.02 0.00 -0.85 0.00 0.00 60.65 59.37 1p4s h LYS 50 Cb 0.78 0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.48 1p4s h LYS 50 CO 0.06 1.03 -0.20 -0.09 -3.45 0.00 0.00 179.45 176.80 1p4s h ARG 51 N 0.44 -0.53 -0.04 1.90 2.43 -1.34 -1.80 114.38 115.45 1p4s h ARG 51 Ca -0.01 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1p4s h ARG 51 Cb 1.18 0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.85 1p4s h ARG 51 CO 0.12 -0.28 -0.02 0.66 -1.51 0.00 0.00 179.97 178.93 1p4s n TYR 52 N -5.15 -0.02 0.02 2.20 4.01 -0.97 -3.05 117.16 114.21 1p4s n TYR 52 Ca -0.08 0.05 0.12 0.00 -0.16 0.00 0.00 57.90 57.83 1p4s n TYR 52 Cb 0.25 -0.21 0.56 0.00 -0.31 0.00 0.00 39.34 39.64 1p4s n TYR 52 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 1p4s h LEU 53 N 0.00 0.22 0.04 7.72 5.85 -1.46 -2.72 115.31 124.95 1p4s h LEU 53 Ca 0.01 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.48 1p4s h LEU 53 Cb 0.02 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1p4s h LEU 53 CO -0.04 0.14 -1.34 -0.78 -0.34 0.00 0.00 178.44 176.08 1p4s h ASP 54 N 0.24 0.13 -0.07 1.25 1.82 -1.55 -3.47 116.42 114.78 1p4s h ASP 54 Ca 0.19 -0.67 -0.21 0.00 -0.39 0.00 0.00 57.03 55.95 1p4s h ASP 54 Cb 0.44 -0.04 -0.17 0.00 0.68 0.00 0.00 39.33 40.24 1p4s h ASP 54 CO -0.04 1.55 -0.40 0.00 -1.61 0.00 0.00 179.24 178.75 1p4s n ALA 55 N -3.23 1.96 -2.73 -0.78 0.00 -1.17 -4.75 120.51 109.81 1p4s n ALA 55 Ca -0.30 -1.34 -0.09 0.00 0.00 0.00 0.00 53.44 51.71 1p4s n ALA 55 Cb 0.77 -0.93 0.09 0.00 0.00 0.00 0.00 19.45 19.38 1p4s n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p4s n GLY 56 N -0.89 0.40 7.00 0.00 0.00 -1.03 -4.62 105.19 106.05 1p4s n GLY 56 Ca -0.07 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1p4s n GLY 56 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1p4s n ASP 57 N 0.48 0.00 -3.90 1.61 2.03 -1.25 -4.38 116.55 111.13 1p4s n ASP 57 Ca 0.05 0.00 -0.21 0.00 0.52 0.00 0.00 54.79 55.15 1p4s n ASP 57 Cb 0.70 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.93 1p4s n ASP 57 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1p4s s LEU 58 N 0.00 1.33 0.09 -2.67 1.43 -1.26 -4.75 118.68 112.85 1p4s s LEU 58 Ca 0.00 -0.16 -0.18 0.00 -1.03 0.00 0.00 54.13 52.76 1p4s s LEU 58 Cb 0.00 -0.52 -0.07 0.00 0.03 0.00 0.00 46.19 45.64 1p4s s LEU 58 CO 0.00 -0.05 0.57 0.54 0.23 0.00 0.00 176.35 177.64 1p4s s VAL 59 N 0.96 4.75 0.40 -1.59 0.11 -1.26 -5.00 120.40 118.78 1p4s s VAL 59 Ca -0.10 1.16 -0.24 0.00 -2.93 0.00 0.00 61.98 59.86 1p4s s VAL 59 Cb -0.14 -3.87 -0.11 0.00 -1.53 0.00 0.00 36.38 30.72 1p4s s VAL 59 CO 0.00 0.49 0.89 -2.65 -3.33 0.00 0.00 175.10 170.50 1p4s n PRO 60 N 1.52 1.12 -0.16 1.54 -0.02 -1.26 -4.96 135.00 132.77 1p4s n PRO 60 Ca -0.09 0.40 -0.10 0.00 -2.02 0.00 0.00 63.50 61.69 1p4s n PRO 60 Cb 0.51 -1.87 -0.00 0.00 -0.02 0.00 0.00 33.50 32.12 1p4s n PRO 60 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1p4s h SER 61 N 1.38 0.78 -0.79 2.55 0.02 -1.95 -3.34 113.55 112.20 1p4s h SER 61 Ca -0.43 -0.28 0.02 0.00 -0.84 0.00 0.00 61.79 60.26 1p4s h SER 61 Cb 1.36 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 63.65 1p4s h SER 61 CO 0.56 0.87 0.52 0.44 -1.14 0.00 0.00 176.83 178.08 1p4s h ASP 62 N 0.66 0.88 -0.12 3.07 3.32 -1.98 -1.95 116.42 120.30 1p4s h ASP 62 Ca 0.14 -0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.21 1p4s h ASP 62 Cb 0.45 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.74 1p4s h ASP 62 CO 0.02 0.62 -0.15 -0.07 -1.72 0.00 0.00 179.24 177.94 1p4s h LEU 63 N 1.03 -0.45 0.06 1.55 3.38 -1.98 -1.31 115.31 117.58 1p4s h LEU 63 Ca 0.30 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.35 1p4s h LEU 63 Cb -0.06 0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1p4s h LEU 63 CO -0.07 -0.19 -0.03 0.74 0.09 0.00 0.00 178.44 178.97 1p4s h THR 64 N -0.19 1.11 0.00 0.22 2.02 -1.66 -2.42 112.91 111.99 1p4s h THR 64 Ca 0.09 -0.56 -0.00 0.00 0.77 0.00 0.00 66.41 66.71 1p4s h THR 64 Cb 0.31 1.48 -0.00 0.00 -1.74 0.00 0.00 68.15 68.20 1p4s h THR 64 CO -0.23 0.14 -0.00 0.78 0.37 0.00 0.00 175.52 176.58 1p4s h ASN 65 N -0.33 0.00 -0.07 4.18 2.35 -1.44 -2.56 115.58 117.71 1p4s h ASN 65 Ca -0.01 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.68 1p4s h ASN 65 Cb 0.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.66 1p4s h ASN 65 CO 0.01 0.00 -0.21 -0.33 -1.65 0.00 0.00 177.43 175.25 1p4s h GLU 66 N 0.00 0.26 -0.37 0.81 4.39 -0.91 -1.96 114.58 116.80 1p4s h GLU 66 Ca -0.00 -0.19 -0.00 0.00 0.34 0.00 0.00 59.36 59.50 1p4s h GLU 66 Cb 0.14 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.81 1p4s h GLU 66 CO 0.00 0.82 0.22 -0.07 -1.16 0.00 0.00 179.01 178.81 1p4s h LEU 67 N -0.24 0.46 -0.11 1.33 3.38 -1.39 -1.56 115.31 117.18 1p4s h LEU 67 Ca -0.01 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1p4s h LEU 67 Cb 0.84 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 1p4s h LEU 67 CO 0.05 0.39 0.06 0.58 0.09 0.00 0.00 178.44 179.61 1p4s h VAL 68 N 0.48 1.09 -0.47 1.22 2.07 -1.58 -2.65 116.25 116.41 1p4s h VAL 68 Ca 0.13 -0.26 -0.04 0.00 0.82 0.00 0.00 66.70 67.35 1p4s h VAL 68 Cb 0.03 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 1p4s h VAL 68 CO -0.02 0.08 0.13 -0.78 0.02 0.00 0.00 177.57 177.00 1p4s h ASP 69 N 0.08 0.64 -0.76 0.57 1.82 -1.41 -1.34 116.42 116.02 1p4s h ASP 69 Ca 0.04 -0.10 0.05 0.00 -0.39 0.00 0.00 57.03 56.63 1p4s h ASP 69 Cb 0.08 -0.17 -0.05 0.00 0.68 0.00 0.00 39.33 39.87 1p4s h ASP 69 CO -0.01 0.63 0.46 -0.78 -1.61 0.00 0.00 179.24 177.93 1p4s h ASP 70 N 0.68 0.73 1.53 2.28 3.58 -1.20 -1.82 116.42 122.21 1p4s h ASP 70 Ca 0.16 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.62 1p4s h ASP 70 Cb 0.23 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.14 1p4s h ASP 70 CO -0.01 0.48 -0.02 0.03 -2.88 0.00 0.00 179.24 176.84 1p4s h ARG 71 N 0.86 0.00 0.00 0.28 3.08 -1.34 -3.33 114.38 113.94 1p4s h ARG 71 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 1p4s h ARG 71 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1p4s h ARG 71 CO -0.15 0.00 -0.27 1.28 -1.07 0.00 0.00 179.97 179.76 1p4s n LEU 72 N -2.38 0.75 0.00 3.04 4.77 -0.52 -4.06 117.00 118.60 1p4s n LEU 72 Ca 0.05 0.42 0.01 0.00 -0.03 0.00 0.00 56.01 56.47 1p4s n LEU 72 Cb 0.45 -0.26 0.08 0.00 -2.33 0.00 0.00 43.42 41.35 1p4s n LEU 72 CO 0.31 -0.12 0.30 0.59 -1.33 0.00 0.00 177.39 177.14 1p4s n ASN 73 N -2.18 0.00 -4.74 -1.43 3.02 -0.71 -4.42 115.26 104.80 1p4s n ASN 73 Ca 0.05 -0.80 -0.41 0.00 -0.03 0.00 0.00 54.58 53.39 1p4s n ASN 73 Cb 0.43 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.56 1p4s n ASN 73 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1p4s s ASN 74 N -1.64 7.33 0.61 6.41 3.84 -1.26 -4.99 114.94 125.24 1p4s s ASN 74 Ca 0.04 2.06 0.27 0.00 0.21 0.00 0.00 52.86 55.44 1p4s s ASN 74 Cb 0.02 -2.60 1.35 0.00 -0.55 0.00 0.00 41.25 39.46 1p4s s ASN 74 CO 0.03 -0.16 1.76 -0.65 -2.79 0.00 0.00 177.10 175.29 1p4s h PRO 75 N 4.95 0.00 0.00 0.43 0.11 -1.97 -0.55 132.00 134.97 1p4s h PRO 75 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1p4s h PRO 75 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1p4s h PRO 75 CO 0.71 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 178.25 1p4s n ASP 76 N -3.43 0.09 0.22 -2.05 8.00 -1.26 -2.75 116.55 115.38 1p4s n ASP 76 Ca 0.09 0.53 0.14 0.00 0.71 0.00 0.00 54.79 56.25 1p4s n ASP 76 Cb 0.77 -0.55 0.35 0.00 -0.02 0.00 0.00 41.12 41.67 1p4s n ASP 76 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1p4s h ALA 77 N 2.19 1.00 -0.53 2.24 0.00 -1.26 -3.30 119.26 119.61 1p4s h ALA 77 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1p4s h ALA 77 Cb 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1p4s h ALA 77 CO 0.00 0.00 0.35 0.00 0.00 0.00 0.00 179.25 179.60 1p4s h ALA 78 N 2.07 1.64 -0.44 0.00 0.00 -1.74 -3.04 119.26 117.76 1p4s h ALA 78 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1p4s h ALA 78 Cb 0.81 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1p4s h ALA 78 CO 0.00 0.33 0.00 0.09 0.00 0.00 0.00 179.25 179.67 1p4s n ASN 79 N -4.46 4.29 0.00 0.00 3.02 -1.26 -4.73 115.26 112.12 1p4s n ASN 79 Ca 0.05 -2.66 0.00 0.00 -0.03 0.00 0.00 54.58 51.94 1p4s n ASN 79 Cb 0.06 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 38.71 1p4s n ASN 79 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p4s n GLY 80 N 0.33 -0.63 3.65 7.41 0.00 -1.15 -2.15 105.19 112.65 1p4s n GLY 80 Ca 0.22 -1.22 -0.01 0.00 0.00 0.00 0.00 46.02 45.01 1p4s n GLY 80 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1p4s s PHE 81 N -2.00 -0.33 -0.40 1.61 -0.12 -1.26 -4.19 117.98 111.29 1p4s s PHE 81 Ca 0.00 0.69 -0.11 0.00 -0.05 0.00 0.00 56.93 57.46 1p4s s PHE 81 Cb 0.00 0.25 0.05 0.00 -0.63 0.00 0.00 43.02 42.69 1p4s s PHE 81 CO 0.00 -0.16 0.24 0.42 -0.05 0.00 0.00 175.22 175.66 1p4s s ILE 82 N 1.01 4.54 -0.13 -4.49 -1.09 -1.26 -1.95 121.20 117.83 1p4s s ILE 82 Ca -0.06 -1.03 -0.07 0.00 -2.23 0.00 0.00 60.65 57.25 1p4s s ILE 82 Cb -0.03 -3.62 -0.04 0.00 -1.58 0.00 0.00 42.46 37.19 1p4s s ILE 82 CO -0.12 -0.35 0.14 -0.76 -1.23 0.00 0.00 174.94 172.62 1p4s s LEU 83 N 1.53 4.36 -0.08 2.97 1.43 -0.85 -1.21 118.68 126.83 1p4s s LEU 83 Ca 0.02 0.44 0.02 0.00 -1.03 0.00 0.00 54.13 53.58 1p4s s LEU 83 Cb -0.21 -2.07 0.01 0.00 0.03 0.00 0.00 46.19 43.96 1p4s s LEU 83 CO 0.05 0.38 -0.13 -0.62 0.23 0.00 0.00 176.35 176.27 1p4s s ASP 84 N -0.86 1.99 -1.00 2.29 -1.08 -0.83 -1.32 116.67 115.85 1p4s s ASP 84 Ca 0.14 -0.33 -0.02 0.00 -0.52 0.00 0.00 52.55 51.82 1p4s s ASP 84 Cb -0.12 -0.90 0.00 0.00 -1.46 0.00 0.00 42.92 40.45 1p4s s ASP 84 CO 0.03 0.02 0.30 0.61 0.52 0.00 0.00 175.17 176.64 1p4s n GLY 85 N 4.01 -0.09 0.10 2.66 0.00 -0.92 -3.00 105.19 107.95 1p4s n GLY 85 Ca -0.21 -0.24 -0.17 0.00 0.00 0.00 0.00 46.02 45.40 1p4s n GLY 85 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1p4s n TYR 86 N -4.03 0.56 -1.01 1.61 9.36 -1.26 -4.59 117.16 117.80 1p4s n TYR 86 Ca -0.09 0.24 -0.40 0.00 3.32 0.00 0.00 57.90 60.97 1p4s n TYR 86 Cb 0.59 -0.89 -0.06 0.00 -0.63 0.00 0.00 39.34 38.35 1p4s n TYR 86 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1p4s n PRO 87 N -4.44 1.38 -0.03 2.98 -0.04 -1.26 -4.66 135.00 128.94 1p4s n PRO 87 Ca -0.29 -1.68 -0.04 0.00 -0.04 0.00 0.00 63.50 61.45 1p4s n PRO 87 Cb 0.60 -2.80 0.18 0.00 -0.04 0.00 0.00 33.50 31.45 1p4s n PRO 87 CO 0.00 0.00 0.00 0.07 -0.04 0.00 0.00 175.50 175.53 1p4s h ARG 88 N 7.93 0.60 -2.95 0.54 0.11 -1.95 -3.47 114.38 115.19 1p4s h ARG 88 Ca 0.40 -0.20 -0.14 0.00 0.10 0.00 0.00 59.98 60.14 1p4s h ARG 88 Cb 0.60 -0.05 -0.24 0.00 1.11 0.00 0.00 29.97 31.39 1p4s h ARG 88 CO 1.89 0.74 -0.33 0.45 0.10 0.00 0.00 179.97 182.83 1p4s s SER 89 N -6.76 -0.32 0.53 0.08 0.15 -1.26 -4.93 113.70 101.18 1p4s s SER 89 Ca -0.08 0.59 0.23 0.00 0.70 0.00 0.00 55.95 57.40 1p4s s SER 89 Cb 0.14 0.63 1.46 0.00 -1.71 0.00 0.00 66.02 66.54 1p4s s SER 89 CO 0.80 -0.15 2.14 1.62 1.20 0.00 0.00 173.24 178.85 1p4s h VAL 90 N 4.54 0.77 -0.52 4.45 3.04 -1.91 -1.39 116.25 125.22 1p4s h VAL 90 Ca -0.27 -0.23 -0.09 0.00 -1.01 0.00 0.00 66.70 65.10 1p4s h VAL 90 Cb 1.19 1.14 -0.02 0.00 -2.01 0.00 0.00 31.29 31.58 1p4s h VAL 90 CO 0.31 0.06 -0.02 -0.08 -1.01 0.00 0.00 177.57 176.83 1p4s h GLU 91 N 0.00 0.91 -0.00 4.17 4.22 -1.97 -1.89 114.58 120.01 1p4s h GLU 91 Ca -0.00 -0.27 -0.06 0.00 0.08 0.00 0.00 59.36 59.11 1p4s h GLU 91 Cb 0.13 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1p4s h GLU 91 CO 0.01 0.91 -0.21 1.96 -2.18 0.00 0.00 179.01 179.50 1p4s h GLN 92 N 0.83 0.15 -0.10 1.92 1.08 -1.88 -3.40 115.11 113.71 1p4s h GLN 92 Ca 0.15 -0.16 -0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1p4s h GLN 92 Cb 0.52 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.99 1p4s h GLN 92 CO 0.03 0.90 0.04 0.00 -0.95 0.00 0.00 178.83 178.84 1p4s h ALA 93 N 0.26 1.89 -0.26 3.87 0.00 -1.33 -2.59 119.26 121.10 1p4s h ALA 93 Ca -0.03 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.93 1p4s h ALA 93 Cb 0.97 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1p4s h ALA 93 CO 0.04 0.10 0.19 -0.22 0.00 0.00 0.00 179.25 179.36 1p4s h LYS 94 N 0.13 0.00 -0.52 0.00 3.64 -1.55 -2.15 116.57 116.12 1p4s h LYS 94 Ca 0.04 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.31 1p4s h LYS 94 Cb 0.03 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1p4s h LYS 94 CO -0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 179.45 177.08 1p4s h ALA 95 N 1.86 0.72 -0.70 5.00 0.00 -1.70 -2.06 119.26 122.38 1p4s h ALA 95 Ca 0.12 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1p4s h ALA 95 Cb 0.51 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1p4s h ALA 95 CO -0.00 0.62 0.30 1.25 0.00 0.00 0.00 179.25 181.42 1p4s h LEU 96 N 0.86 0.93 -0.38 0.00 5.85 -1.57 -1.96 115.31 119.03 1p4s h LEU 96 Ca 0.14 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 1p4s h LEU 96 Cb 0.66 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 1p4s h LEU 96 CO 0.05 0.81 0.08 -0.74 -0.34 0.00 0.00 178.44 178.30 1p4s h HIS 97 N 1.01 0.66 -0.98 1.25 2.76 -1.44 -1.82 115.15 116.59 1p4s h HIS 97 Ca 0.24 -0.09 0.18 0.00 -2.20 0.00 0.00 60.37 58.50 1p4s h HIS 97 Cb 0.16 -0.18 -0.10 0.00 1.55 0.00 0.00 27.41 28.83 1p4s h HIS 97 CO 0.01 0.65 0.58 0.93 -1.30 0.00 0.00 177.93 178.80 1p4s h GLU 98 N 0.48 0.73 0.00 5.26 5.08 -1.30 -2.83 114.58 121.99 1p4s h GLU 98 Ca 0.12 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 1p4s h GLU 98 Cb 0.34 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1p4s h GLU 98 CO 0.00 0.48 -0.46 0.00 -1.00 0.00 0.00 179.01 178.04 1p4s h MET 99 N 0.75 0.00 0.10 2.33 -0.00 -1.31 -1.32 114.93 115.50 1p4s h MET 99 Ca 0.55 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 60.25 1p4s h MET 99 Cb 0.83 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.43 1p4s h MET 99 CO -0.37 0.00 -0.05 1.25 -0.00 0.00 0.00 176.91 177.74 1p4s h LEU 100 N 0.00 -0.12 0.15 -0.10 5.85 -1.23 -1.11 115.31 118.76 1p4s h LEU 100 Ca 0.00 -0.45 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 1p4s h LEU 100 Cb 1.00 0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.06 1p4s h LEU 100 CO 0.00 0.45 -0.07 -0.33 -0.34 0.00 0.00 178.44 178.15 1p4s h GLU 101 N -0.76 -0.20 -0.41 1.25 5.08 -1.69 0.81 114.58 118.67 1p4s h GLU 101 Ca -0.01 0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.22 1p4s h GLU 101 Cb 0.56 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 1p4s h GLU 101 CO 0.02 0.17 -0.31 -0.09 -1.00 0.00 0.00 179.01 177.80 1p4s h ARG 102 N -0.95 0.90 0.75 2.33 2.43 -1.44 -3.19 114.38 115.22 1p4s h ARG 102 Ca -0.02 -0.43 -0.04 0.00 -0.81 0.00 0.00 59.98 58.68 1p4s h ARG 102 Cb 0.46 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.01 1p4s h ARG 102 CO 0.03 1.08 -0.36 -0.09 -1.51 0.00 0.00 179.97 179.13 1p4s h ARG 103 N 0.76 -0.98 0.00 0.20 2.43 -1.21 -3.48 114.38 112.09 1p4s h ARG 103 Ca 0.08 0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1p4s h ARG 103 Cb 0.88 0.22 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 1p4s h ARG 103 CO 0.08 -0.63 0.00 0.41 -1.51 0.00 0.00 179.97 178.32 1p4s n GLY 104 N -1.19 0.86 3.87 2.80 0.00 -0.46 -5.00 105.19 106.07 1p4s n GLY 104 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 1p4s n GLY 104 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1p4s s THR 105 N -0.95 5.22 0.12 2.61 -4.23 0.16 -5.01 115.64 113.56 1p4s s THR 105 Ca 0.00 -0.31 -0.31 0.00 -1.18 0.00 0.00 61.69 59.89 1p4s s THR 105 Cb 0.00 -3.46 -0.08 0.00 1.34 0.00 0.00 72.50 70.29 1p4s s THR 105 CO 0.00 0.27 1.42 -1.81 -0.54 0.00 0.00 174.62 173.96 1p4s s ASP 106 N -2.07 6.78 -0.73 3.99 1.01 -1.26 -4.56 116.67 119.84 1p4s s ASP 106 Ca 0.28 2.38 -0.23 0.00 0.71 0.00 0.00 52.55 55.69 1p4s s ASP 106 Cb -0.13 -2.59 0.06 0.00 1.01 0.00 0.00 42.92 41.28 1p4s s ASP 106 CO 0.20 -0.68 1.10 -0.51 0.21 0.00 0.00 175.17 175.48 1p4s s ILE 107 N 1.10 4.17 -0.04 0.77 1.10 -1.26 -4.41 121.20 122.62 1p4s s ILE 107 Ca 0.65 -0.28 -0.04 0.00 -0.51 0.00 0.00 60.65 60.48 1p4s s ILE 107 Cb -0.38 -4.78 -0.01 0.00 0.15 0.00 0.00 42.46 37.44 1p4s s ILE 107 CO 0.30 -1.60 -0.07 -0.67 -2.11 0.00 0.00 174.94 170.79 1p4s n ASP 108 N 8.14 0.43 -3.66 4.50 -0.08 -1.26 -4.99 116.55 119.62 1p4s n ASP 108 Ca 0.03 0.14 -0.11 0.00 -1.51 0.00 0.00 54.79 53.33 1p4s n ASP 108 Cb 0.47 -0.56 -0.11 0.00 2.34 0.00 0.00 41.12 43.25 1p4s n ASP 108 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1p4s s ALA 109 N -2.97 -0.83 -0.43 -1.67 0.00 -1.10 -5.00 121.76 109.74 1p4s s ALA 109 Ca -0.06 1.21 -0.19 0.00 0.00 0.00 0.00 51.96 52.92 1p4s s ALA 109 Cb 0.01 -1.13 0.02 0.00 0.00 0.00 0.00 23.12 22.02 1p4s s ALA 109 CO 0.08 -0.66 0.55 0.08 0.00 0.00 0.00 175.76 175.82 1p4s s VAL 110 N 2.41 4.94 -0.28 0.00 1.01 -1.26 -2.02 120.40 125.21 1p4s s VAL 110 Ca -0.01 -0.12 -0.08 0.00 0.00 0.00 0.00 61.98 61.76 1p4s s VAL 110 Cb -0.12 -4.14 -0.02 0.00 0.00 0.00 0.00 36.38 32.10 1p4s s VAL 110 CO -0.11 -0.53 0.11 -0.76 0.00 0.00 0.00 175.10 173.81 1p4s s LEU 111 N 2.51 3.77 0.02 3.92 1.43 -0.66 -1.24 118.68 128.44 1p4s s LEU 111 Ca 0.18 -0.35 -0.21 0.00 -1.03 0.00 0.00 54.13 52.73 1p4s s LEU 111 Cb -0.16 -1.97 -0.06 0.00 0.03 0.00 0.00 46.19 44.04 1p4s s LEU 111 CO 0.16 -0.11 0.60 -1.83 0.23 0.00 0.00 176.35 175.40 1p4s s GLU 112 N 1.62 4.30 -0.37 1.70 -1.05 -0.84 -1.53 118.70 122.54 1p4s s GLU 112 Ca 0.05 0.76 -0.13 0.00 -0.15 0.00 0.00 54.97 55.50 1p4s s GLU 112 Cb -0.16 -3.32 0.01 0.00 -0.44 0.00 0.00 34.13 30.22 1p4s s GLU 112 CO 0.05 0.43 0.24 -0.06 0.95 0.00 0.00 175.26 176.88 1p4s s PHE 113 N -0.41 3.23 -0.66 4.83 0.40 -0.77 -1.19 117.98 123.41 1p4s s PHE 113 Ca 0.31 -0.56 -0.25 0.00 -0.60 0.00 0.00 56.93 55.83 1p4s s PHE 113 Cb -0.19 -2.49 0.05 0.00 0.51 0.00 0.00 43.02 40.89 1p4s s PHE 113 CO 0.18 -0.52 1.10 0.50 0.70 0.00 0.00 175.22 177.19 1p4s s ARG 114 N 1.66 3.23 -0.11 0.44 6.06 0.01 -4.54 118.95 125.70 1p4s s ARG 114 Ca 0.05 -0.37 -0.05 0.00 -2.50 0.00 0.00 55.73 52.86 1p4s s ARG 114 Cb -0.18 -4.15 0.05 0.00 0.06 0.00 0.00 34.95 30.73 1p4s s ARG 114 CO 0.09 -1.86 0.24 0.54 -2.50 0.00 0.00 175.30 171.81 1p4s s VAL 115 N 4.77 -0.24 0.42 7.11 0.11 -1.26 -1.75 120.40 129.55 1p4s s VAL 115 Ca 0.31 0.24 -0.26 0.00 -2.93 0.00 0.00 61.98 59.34 1p4s s VAL 115 Cb -0.12 -0.39 -0.09 0.00 -1.53 0.00 0.00 36.38 34.25 1p4s s VAL 115 CO 0.16 0.10 1.41 -0.44 -3.33 0.00 0.00 175.10 173.00 1p4s s SER 116 N 1.93 6.09 0.33 3.54 0.01 -1.26 -4.93 113.70 119.41 1p4s s SER 116 Ca -0.03 2.89 0.06 0.00 1.31 0.00 0.00 55.95 60.18 1p4s s SER 116 Cb -0.11 -2.65 0.71 0.00 0.21 0.00 0.00 66.02 64.18 1p4s s SER 116 CO -0.08 -1.03 1.86 -0.33 0.41 0.00 0.00 173.24 174.07 1p4s h GLU 117 N 2.57 0.79 -0.31 12.44 5.08 -2.00 -2.99 114.58 130.15 1p4s h GLU 117 Ca -0.51 -0.05 -0.17 0.00 -1.00 0.00 0.00 59.36 57.63 1p4s h GLU 117 Cb 1.25 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.32 1p4s h GLU 117 CO 0.62 0.52 -0.48 1.49 -1.00 0.00 0.00 179.01 180.16 1p4s h GLU 118 N 0.81 0.86 -0.23 2.33 4.81 -1.98 -2.57 114.58 118.61 1p4s h GLU 118 Ca 0.47 -0.51 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1p4s h GLU 118 Cb 0.62 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 1p4s h GLU 118 CO -0.23 1.14 0.15 -0.24 -0.73 0.00 0.00 179.01 179.10 1p4s h VAL 119 N 0.68 1.08 -0.36 0.32 3.04 -1.92 -1.34 116.25 117.74 1p4s h VAL 119 Ca 0.03 -0.19 -0.07 0.00 -1.01 0.00 0.00 66.70 65.46 1p4s h VAL 119 Cb 1.08 0.79 -0.01 0.00 -2.01 0.00 0.00 31.29 31.13 1p4s h VAL 119 CO 0.11 0.08 -0.06 0.17 -1.01 0.00 0.00 177.57 176.85 1p4s h LEU 120 N 0.30 0.69 -1.41 3.16 8.10 -1.66 -2.59 115.31 121.90 1p4s h LEU 120 Ca 0.08 -0.35 0.00 0.00 0.11 0.00 0.00 57.88 57.73 1p4s h LEU 120 Cb 0.00 -0.19 -0.03 0.00 -0.44 0.00 0.00 40.66 40.01 1p4s h LEU 120 CO -0.02 0.88 0.35 -0.07 -4.11 0.00 0.00 178.44 175.47 1p4s h LEU 121 N 0.49 0.66 -0.66 0.17 4.07 -1.50 -2.65 115.31 115.87 1p4s h LEU 121 Ca 0.10 -0.03 -0.00 0.00 0.08 0.00 0.00 57.88 58.03 1p4s h LEU 121 Cb 0.56 -0.16 -0.03 0.00 1.08 0.00 0.00 40.66 42.11 1p4s h LEU 121 CO 0.03 0.49 0.40 -0.33 -1.08 0.00 0.00 178.44 177.96 1p4s h GLU 122 N 0.76 0.90 -0.22 1.13 4.39 -1.12 -2.37 114.58 118.04 1p4s h GLU 122 Ca 0.20 -0.08 0.03 0.00 0.34 0.00 0.00 59.36 59.85 1p4s h GLU 122 Cb -0.05 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 28.38 1p4s h GLU 122 CO -0.04 0.64 0.05 -0.09 -1.16 0.00 0.00 179.01 178.41 1p4s h ARG 123 N 0.90 0.14 -0.62 2.33 2.43 -1.29 -2.54 114.38 115.72 1p4s h ARG 123 Ca 0.24 -0.01 0.13 0.00 -0.81 0.00 0.00 59.98 59.53 1p4s h ARG 123 Cb -0.03 -0.03 -0.10 0.00 -0.42 0.00 0.00 29.97 29.38 1p4s h ARG 123 CO -0.05 0.09 0.01 -0.07 -1.51 0.00 0.00 179.97 178.44 1p4s h LEU 124 N 0.14 -0.26 0.47 3.80 -0.00 -1.43 -2.47 115.31 115.55 1p4s h LEU 124 Ca 0.10 0.15 -0.02 0.00 -0.00 0.00 0.00 57.88 58.11 1p4s h LEU 124 Cb 0.09 0.27 0.00 0.00 -0.00 0.00 0.00 40.66 41.02 1p4s h LEU 124 CO -0.13 -0.11 -0.23 0.50 -0.00 0.00 0.00 178.44 178.48 1p4s h LYS 125 N 0.12 -0.61 -2.29 1.13 3.64 -1.35 -3.37 116.57 113.84 1p4s h LYS 125 Ca 0.32 0.04 -0.68 0.00 -1.27 0.00 0.00 60.65 59.07 1p4s h LYS 125 Cb 0.52 0.14 -0.36 0.00 -0.41 0.00 0.00 32.23 32.12 1p4s h LYS 125 CO -0.52 -0.34 0.01 0.41 -2.27 0.00 0.00 179.45 176.73 1p4s n GLY 126 N -1.00 5.76 0.00 5.01 0.00 -0.97 -4.85 105.19 109.14 1p4s n GLY 126 Ca -0.11 -2.71 0.00 0.00 0.00 0.00 0.00 46.02 43.20 1p4s n GLY 126 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1p4s n ARG 127 N -0.08 0.00 0.00 1.61 0.63 -0.93 -4.88 116.66 113.01 1p4s n ARG 127 Ca 0.37 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.30 1p4s n ARG 127 Cb 0.34 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.25 1p4s n ARG 127 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1p4s n GLY 128 N 0.00 -0.26 0.00 5.14 0.00 -1.26 -4.33 105.19 104.47 1p4s n GLY 128 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1p4s n GLY 128 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1p4s n ARG 129 N 0.00 0.00 0.00 1.61 0.63 -1.26 -4.98 116.66 112.66 1p4s n ARG 129 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1p4s n ARG 129 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 1p4s n ARG 129 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1p4s n ALA 130 N 0.00 1.09 -3.16 5.13 0.00 -1.26 -5.02 120.51 117.28 1p4s n ALA 130 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 1p4s n ALA 130 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1p4s n ALA 130 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1p4s n ASP 131 N -1.99 1.41 -3.08 0.00 8.00 -1.26 -4.80 116.55 114.83 1p4s n ASP 131 Ca 0.00 -3.09 -0.28 0.00 0.71 0.00 0.00 54.79 52.13 1p4s n ASP 131 Cb 0.00 -0.61 -0.04 0.00 -0.02 0.00 0.00 41.12 40.45 1p4s n ASP 131 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1p4s n ASP 132 N 0.36 4.68 0.00 -2.24 2.03 -1.26 -4.95 116.55 115.17 1p4s n ASP 132 Ca 0.26 -3.65 0.00 0.00 0.52 0.00 0.00 54.79 51.91 1p4s n ASP 132 Cb 0.59 -0.64 0.00 0.00 -0.72 0.00 0.00 41.12 40.36 1p4s n ASP 132 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 1p4s n THR 133 N -0.07 0.00 -0.20 5.18 -2.24 -1.26 -4.91 114.28 110.79 1p4s n THR 133 Ca 0.32 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 62.08 1p4s n THR 133 Cb 0.38 0.00 0.08 0.00 -2.10 0.00 0.00 70.33 68.70 1p4s n THR 133 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1p4s h ASP 134 N 0.00 0.37 -0.36 3.42 3.32 -1.94 -1.30 116.42 119.93 1p4s h ASP 134 Ca 0.00 0.05 -0.12 0.00 0.02 0.00 0.00 57.03 56.98 1p4s h ASP 134 Cb 0.00 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1p4s h ASP 134 CO 0.00 0.24 -0.20 0.44 -1.72 0.00 0.00 179.24 178.00 1p4s h ASP 135 N 0.51 0.85 -0.45 6.45 3.32 -1.96 -2.12 116.42 123.02 1p4s h ASP 135 Ca 0.27 -0.30 -0.09 0.00 0.02 0.00 0.00 57.03 56.93 1p4s h ASP 135 Cb 0.24 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 1p4s h ASP 135 CO -0.22 1.03 -0.06 0.58 -1.72 0.00 0.00 179.24 178.86 1p4s h VAL 136 N 0.74 1.26 0.00 -1.35 2.07 -1.82 -2.55 116.25 114.60 1p4s h VAL 136 Ca 0.10 -1.14 -0.08 0.00 0.82 0.00 0.00 66.70 66.40 1p4s h VAL 136 Cb 0.72 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1p4s h VAL 136 CO 0.06 0.40 -0.40 -0.29 0.02 0.00 0.00 177.57 177.36 1p4s h ILE 137 N 0.81 0.81 0.08 4.57 6.09 -1.28 -1.94 117.51 126.65 1p4s h ILE 137 Ca 0.14 -1.72 -0.00 0.00 -1.37 0.00 0.00 64.86 61.90 1p4s h ILE 137 Cb 0.56 2.10 0.00 0.00 0.47 0.00 0.00 36.82 39.95 1p4s h ILE 137 CO 0.03 0.39 -0.04 -0.07 -3.07 0.00 0.00 178.15 175.40 1p4s h LEU 138 N 0.00 -0.09 -0.69 2.19 3.38 -1.28 -1.53 115.31 117.29 1p4s h LEU 138 Ca -0.00 -0.27 -0.10 0.00 0.09 0.00 0.00 57.88 57.60 1p4s h LEU 138 Cb 1.06 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 1p4s h LEU 138 CO 0.05 0.23 -0.07 -1.13 0.09 0.00 0.00 178.44 177.61 1p4s h ASN 139 N -0.41 0.92 -0.08 -0.43 -1.24 -1.56 -2.62 115.58 110.16 1p4s h ASN 139 Ca -0.01 -0.28 -0.04 0.00 0.71 0.00 0.00 56.30 56.68 1p4s h ASN 139 Cb 0.35 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 39.14 1p4s h ASN 139 CO 0.02 1.02 -0.04 0.03 -1.29 0.00 0.00 177.43 177.17 1p4s h ARG 140 N 0.84 0.31 -0.07 6.67 3.08 -1.44 -2.67 114.38 121.11 1p4s h ARG 140 Ca 0.14 -0.06 -0.15 0.00 0.07 0.00 0.00 59.98 59.98 1p4s h ARG 140 Cb 0.60 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 1p4s h ARG 140 CO 0.04 0.38 -0.64 0.52 -1.07 0.00 0.00 179.97 179.20 1p4s h MET 141 N 0.30 0.25 0.14 0.04 2.86 -1.21 -2.02 114.93 115.29 1p4s h MET 141 Ca 0.07 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 1p4s h MET 141 Cb 0.28 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.97 1p4s h MET 141 CO 0.01 0.80 -0.07 0.87 1.06 0.00 0.00 176.91 179.59 1p4s h LYS 142 N 0.18 -0.18 -0.31 1.72 1.57 -1.33 -2.29 116.57 115.93 1p4s h LYS 142 Ca -0.01 0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1p4s h LYS 142 Cb 1.16 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 1p4s h LYS 142 CO 0.10 -0.04 -0.03 -0.24 -0.57 0.00 0.00 179.45 178.67 1p4s h VAL 143 N -0.28 1.20 -0.47 0.50 3.04 -1.59 -2.84 116.25 115.81 1p4s h VAL 143 Ca -0.02 -0.82 0.08 0.00 -1.01 0.00 0.00 66.70 64.93 1p4s h VAL 143 Cb 0.22 1.00 -0.07 0.00 -2.01 0.00 0.00 31.29 30.43 1p4s h VAL 143 CO 0.03 0.28 0.05 0.22 -1.01 0.00 0.00 177.57 177.14 1p4s h TYR 144 N 0.47 0.07 -0.85 3.17 3.20 -1.36 -3.12 116.97 118.55 1p4s h TYR 144 Ca 0.10 0.03 0.07 0.00 3.14 0.00 0.00 58.73 62.07 1p4s h TYR 144 Cb 0.36 0.04 -0.05 0.00 1.54 0.00 0.00 36.73 38.62 1p4s h TYR 144 CO 0.01 -0.05 0.55 -0.09 -1.64 0.00 0.00 178.16 176.95 1p4s h ARG 145 N 0.17 0.91 -0.83 1.82 2.43 -1.18 -2.72 114.38 114.98 1p4s h ARG 145 Ca 0.23 -0.05 0.18 0.00 -0.81 0.00 0.00 59.98 59.53 1p4s h ARG 145 Cb 0.33 -0.20 -0.06 0.00 -0.42 0.00 0.00 29.97 29.62 1p4s h ARG 145 CO -0.34 0.60 0.56 -0.44 -1.51 0.00 0.00 179.97 178.83 1p4s h ASP 146 N 0.93 0.36 0.00 -3.80 3.32 -1.45 -3.38 116.42 112.40 1p4s h ASP 146 Ca 0.36 0.03 -0.14 0.00 0.02 0.00 0.00 57.03 57.30 1p4s h ASP 146 Cb 0.23 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 1p4s h ASP 146 CO -0.13 0.16 -1.61 -1.84 -1.72 0.00 0.00 179.24 174.10 1p4s n GLU 147 N -4.48 2.14 0.19 3.56 -0.00 -1.13 -4.86 120.64 116.07 1p4s n GLU 147 Ca 0.17 -0.02 0.05 0.00 -0.00 0.00 0.00 57.16 57.36 1p4s n GLU 147 Cb 0.65 -1.24 0.48 0.00 -0.00 0.00 0.00 31.44 31.33 1p4s n GLU 147 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.13 178.28 1p4s h THR 148 N 0.00 1.14 0.54 3.84 2.02 -1.66 0.52 112.91 119.30 1p4s h THR 148 Ca -0.21 -0.62 -0.03 0.00 0.77 0.00 0.00 66.41 66.32 1p4s h THR 148 Cb 1.40 1.26 0.01 0.00 -1.74 0.00 0.00 68.15 69.07 1p4s h THR 148 CO 0.01 0.18 -0.26 0.00 0.37 0.00 0.00 175.52 175.83 1p4s h ALA 149 N 1.78 -0.82 -0.21 6.16 0.00 -1.89 -1.72 119.26 122.57 1p4s h ALA 149 Ca 0.02 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 1p4s h ALA 149 Cb 0.31 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1p4s h ALA 149 CO 0.02 -0.76 -0.15 -1.00 0.00 0.00 0.00 179.25 177.36 1p4s h PRO 150 N -1.04 0.35 0.44 0.00 0.13 -1.87 -2.59 132.00 127.41 1p4s h PRO 150 Ca -0.07 -0.10 -0.02 0.00 -0.87 0.00 0.00 66.00 64.94 1p4s h PRO 150 Cb 0.55 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.65 1p4s h PRO 150 CO 0.12 0.50 -0.21 1.25 -0.23 0.00 0.00 178.00 179.43 1p4s h LEU 151 N 0.33 -0.50 -2.17 1.56 6.46 -1.05 -2.34 115.31 117.60 1p4s h LEU 151 Ca 0.06 -0.06 0.06 0.00 -0.12 0.00 0.00 57.88 57.82 1p4s h LEU 151 Cb 0.47 0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 40.52 1p4s h LEU 151 CO 0.03 -0.24 0.18 0.17 -0.62 0.00 0.00 178.44 177.96 1p4s h LEU 152 N -0.74 0.00 -0.12 2.25 8.10 -1.18 -0.49 115.31 123.13 1p4s h LEU 152 Ca -0.06 0.00 -0.18 0.00 0.11 0.00 0.00 57.88 57.75 1p4s h LEU 152 Cb 0.53 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.75 1p4s h LEU 152 CO 0.10 0.00 -0.63 -0.33 -4.11 0.00 0.00 178.44 173.47 1p4s h GLU 153 N 0.00 0.64 0.39 0.17 4.39 -1.48 -1.09 114.58 117.60 1p4s h GLU 153 Ca 0.09 -0.53 -0.02 0.00 0.34 0.00 0.00 59.36 59.25 1p4s h GLU 153 Cb 0.46 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 1p4s h GLU 153 CO -0.00 1.15 -0.19 -0.92 -1.16 0.00 0.00 179.01 177.89 1p4s h TYR 154 N 0.31 -0.49 0.02 4.33 5.03 -0.59 -3.00 116.97 122.58 1p4s h TYR 154 Ca -0.04 -0.01 -0.22 0.00 2.58 0.00 0.00 58.73 61.03 1p4s h TYR 154 Cb 1.27 0.16 -0.03 0.00 1.55 0.00 0.00 36.73 39.69 1p4s h TYR 154 CO 0.10 -0.16 -1.07 1.88 -1.32 0.00 0.00 178.16 177.60 1p4s h TYR 155 N -0.87 0.07 -0.21 -3.82 0.05 -1.35 -3.02 116.97 107.82 1p4s h TYR 155 Ca -0.05 -0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.64 1p4s h TYR 155 Cb 0.54 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.27 1p4s h TYR 155 CO 0.02 1.04 -0.02 -0.09 -1.05 0.00 0.00 178.16 178.06 1p4s h ARG 156 N 0.01 0.32 -0.42 4.88 2.43 -1.32 0.19 114.38 120.46 1p4s h ARG 156 Ca -0.04 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 58.95 1p4s h ARG 156 Cb 1.81 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 31.30 1p4s h ARG 156 CO 0.14 0.36 -0.21 0.22 -1.51 0.00 0.00 179.97 178.97 1p4s h ASP 157 N 0.31 0.92 0.87 -3.80 3.58 -1.59 -3.39 116.42 113.32 1p4s h ASP 157 Ca 0.07 -0.41 -0.03 0.00 0.42 0.00 0.00 57.03 57.08 1p4s h ASP 157 Cb 0.25 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 1p4s h ASP 157 CO 0.01 1.12 -1.15 0.00 -2.88 0.00 0.00 179.24 176.34 1p4s n GLN 158 N -4.19 0.61 -1.67 0.28 6.02 -1.00 -5.08 117.38 112.35 1p4s n GLN 158 Ca -0.01 0.12 -0.25 0.00 -0.01 0.00 0.00 57.00 56.85 1p4s n GLN 158 Cb 0.44 -1.80 0.17 0.00 1.02 0.00 0.00 30.24 30.07 1p4s n GLN 158 CO 0.00 0.00 0.00 1.47 -1.01 0.00 0.00 177.06 177.52 1p4s n LEU 159 N -2.69 0.00 -4.09 1.08 -0.00 0.62 -4.82 117.00 107.11 1p4s n LEU 159 Ca -0.02 -1.29 -0.20 0.00 -0.00 0.00 0.00 56.01 54.50 1p4s n LEU 159 Cb 0.60 -0.85 -0.14 0.00 -0.00 0.00 0.00 43.42 43.03 1p4s n LEU 159 CO 0.41 -1.29 -0.46 -0.54 -0.00 0.00 0.00 177.39 175.52 1p4s s LYS 160 N -5.44 0.94 -0.02 1.47 1.02 -0.37 -4.96 119.74 112.38 1p4s s LYS 160 Ca 0.64 -0.50 -0.03 0.00 0.02 0.00 0.00 55.97 56.10 1p4s s LYS 160 Cb -0.02 -0.91 -0.04 0.00 -0.52 0.00 0.00 37.83 36.34 1p4s s LYS 160 CO 0.45 0.24 0.18 0.99 -0.92 0.00 0.00 175.35 176.29 1p4s s THR 161 N -0.43 5.44 -0.04 2.17 2.01 -1.26 -1.98 115.64 121.55 1p4s s THR 161 Ca 0.04 -0.12 0.02 0.00 0.31 0.00 0.00 61.69 61.93 1p4s s THR 161 Cb -0.05 -3.53 0.01 0.00 0.01 0.00 0.00 72.50 68.94 1p4s s THR 161 CO -0.00 0.36 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.53 1p4s s VAL 162 N -1.29 0.69 -0.07 3.82 1.01 -0.33 -4.86 120.40 119.36 1p4s s VAL 162 Ca 0.26 -0.25 -0.12 0.00 0.00 0.00 0.00 61.98 61.87 1p4s s VAL 162 Cb -0.13 -0.65 -0.05 0.00 0.00 0.00 0.00 36.38 35.55 1p4s s VAL 162 CO 0.17 0.24 0.29 -0.62 0.00 0.00 0.00 175.10 175.19 1p4s s ASP 163 N 0.58 6.60 0.00 3.32 2.15 -1.26 -0.81 116.67 127.25 1p4s s ASP 163 Ca -0.09 0.72 0.00 0.00 0.43 0.00 0.00 52.55 53.61 1p4s s ASP 163 Cb -0.12 -2.18 0.00 0.00 -0.30 0.00 0.00 42.92 40.32 1p4s s ASP 163 CO 0.01 0.32 0.00 0.00 -0.17 0.00 0.00 175.17 175.33 1p4s n ALA 164 N 2.15 0.00 -0.73 3.66 0.00 -0.72 -4.85 120.51 120.02 1p4s n ALA 164 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1p4s n ALA 164 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1p4s n ALA 164 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1p4s n VAL 165 N 0.00 -2.90 0.00 0.00 0.31 -1.26 -4.71 118.33 109.77 1p4s n VAL 165 Ca 0.00 1.06 0.00 0.00 -0.01 0.00 0.00 64.34 65.39 1p4s n VAL 165 Cb 0.00 -1.78 0.00 0.00 -0.91 0.00 0.00 33.84 31.15 1p4s n VAL 165 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1p4s n GLY 166 N -0.41 2.12 3.74 2.92 0.00 -1.26 -4.89 105.19 107.41 1p4s n GLY 166 Ca 0.00 0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 1p4s n GLY 166 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1p4s s THR 167 N 0.00 4.78 -0.09 2.61 -4.23 -1.26 -5.03 115.64 112.42 1p4s s THR 167 Ca 0.00 1.60 -0.04 0.00 -1.18 0.00 0.00 61.69 62.07 1p4s s THR 167 Cb 0.00 -4.10 -0.01 0.00 1.34 0.00 0.00 72.50 69.73 1p4s s THR 167 CO 0.00 0.35 -0.07 0.24 -0.54 0.00 0.00 174.62 174.60 1p4s h MET 168 N 5.79 0.00 -0.24 3.99 0.00 -1.99 -3.31 114.93 119.17 1p4s h MET 168 Ca -0.44 0.00 -0.14 0.00 0.00 0.00 0.00 59.70 59.12 1p4s h MET 168 Cb 1.20 0.00 -0.01 0.00 0.00 0.00 0.00 31.60 32.80 1p4s h MET 168 CO 0.71 0.00 -0.43 -0.44 0.00 0.00 0.00 176.91 176.75 1p4s h ASP 169 N -0.71 0.63 0.23 1.22 3.32 -1.99 -2.71 116.42 116.41 1p4s h ASP 169 Ca 0.00 -0.29 -0.01 0.00 0.02 0.00 0.00 57.03 56.75 1p4s h ASP 169 Cb 0.21 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.58 1p4s h ASP 169 CO 0.00 0.98 -0.11 -0.33 -1.72 0.00 0.00 179.24 178.06 1p4s h GLU 170 N 0.48 -0.30 -0.85 3.56 5.08 -2.01 -2.48 114.58 118.05 1p4s h GLU 170 Ca 0.03 0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.48 1p4s h GLU 170 Cb 0.95 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 30.22 1p4s h GLU 170 CO 0.09 -0.15 0.55 0.28 -1.00 0.00 0.00 179.01 178.78 1p4s h VAL 171 N -0.38 1.06 -0.34 3.13 2.07 -1.65 -1.73 116.25 118.40 1p4s h VAL 171 Ca -0.03 -0.33 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 1p4s h VAL 171 Cb 0.29 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.07 1p4s h VAL 171 CO 0.05 0.17 0.11 0.15 0.02 0.00 0.00 177.57 178.08 1p4s h PHE 172 N 0.95 0.49 0.23 1.57 3.57 -1.50 -2.32 116.94 119.93 1p4s h PHE 172 Ca 0.36 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.83 1p4s h PHE 172 Cb 0.21 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 38.80 1p4s h PHE 172 CO -0.00 0.41 -0.11 0.00 -2.23 0.00 0.00 178.31 176.37 1p4s h ALA 173 N 1.64 -0.31 0.00 2.41 0.00 -0.83 -2.64 119.26 119.53 1p4s h ALA 173 Ca 0.12 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1p4s h ALA 173 Cb 0.14 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1p4s h ALA 173 CO -0.01 -0.53 -0.27 0.07 0.00 0.00 0.00 179.25 178.51 1p4s h ARG 174 N -0.60 0.00 -0.38 0.00 0.11 -1.59 -2.55 114.38 109.37 1p4s h ARG 174 Ca -0.03 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.04 1p4s h ARG 174 Cb 0.44 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.50 1p4s h ARG 174 CO 0.05 0.27 0.20 0.00 0.10 0.00 0.00 179.97 180.60 1p4s h ALA 175 N 1.73 0.48 -0.56 0.08 0.00 -1.47 -2.11 119.26 117.40 1p4s h ALA 175 Ca -0.00 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1p4s h ALA 175 Cb 0.49 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 1p4s h ALA 175 CO 0.04 0.01 0.34 1.25 0.00 0.00 0.00 179.25 180.89 1p4s h LEU 176 N 0.48 0.57 -0.76 0.00 5.85 -1.42 -2.45 115.31 117.58 1p4s h LEU 176 Ca 0.13 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.93 1p4s h LEU 176 Cb 0.07 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 40.91 1p4s h LEU 176 CO -0.02 0.40 0.43 0.03 -0.34 0.00 0.00 178.44 178.94 1p4s h ARG 177 N 0.69 0.72 -0.79 1.25 2.47 -1.43 0.32 114.38 117.60 1p4s h ARG 177 Ca 0.22 -0.04 -0.04 0.00 -1.26 0.00 0.00 59.98 58.86 1p4s h ARG 177 Cb 0.00 -0.16 -0.04 0.00 -1.65 0.00 0.00 29.97 28.12 1p4s h ARG 177 CO -0.09 0.48 0.35 0.00 0.56 0.00 0.00 179.97 181.27 1p4s h ALA 178 N 1.41 1.12 0.04 0.04 0.00 -1.26 -3.29 119.26 117.32 1p4s h ALA 178 Ca 0.36 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1p4s h ALA 178 Cb 0.29 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1p4s h ALA 178 CO -0.22 0.65 -0.02 1.25 0.00 0.00 0.00 179.25 180.90 1p4s h LEU 179 N 1.14 -0.05 0.00 0.00 6.46 -1.33 -3.49 115.31 118.04 1p4s h LEU 179 Ca 0.27 -0.62 0.00 0.00 -0.12 0.00 0.00 57.88 57.41 1p4s h LEU 179 Cb 0.16 0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.11 1p4s h LEU 179 CO -0.03 0.65 0.00 0.61 -0.62 0.00 0.00 178.44 179.05 1p4s n GLY 180 N 0.93 -0.87 0.00 3.75 0.00 -0.08 -4.94 105.19 103.99 1p4s n GLY 180 Ca -0.08 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1p4s n GLY 180 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49