#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n0s n ALA 0 N 0.00 0.00 0.00 5.41 0.00 -1.26 -4.95 120.51 119.71 3n0s n ALA 0 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3n0s n ALA 0 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3n0s n ALA 0 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3n0s n ASN 2 N 0.00 0.00 -0.19 0.00 6.94 -1.26 -2.10 115.26 118.65 3n0s n ASN 2 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 54.58 54.47 3n0s n ASN 2 Cb 0.00 0.00 0.02 0.00 -2.36 0.00 0.00 39.78 37.44 3n0s n ASN 2 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 3n0s h ASP 3 N 0.00 0.91 -0.37 0.53 3.32 -1.98 -1.68 116.42 117.15 3n0s h ASP 3 Ca 0.00 -0.28 -0.00 0.00 0.02 0.00 0.00 57.03 56.77 3n0s h ASP 3 Cb 0.00 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 3n0s h ASP 3 CO 0.00 0.96 0.21 0.40 -1.72 0.00 0.00 179.24 179.10 3n0s h ILE 4 N 0.83 1.13 -0.04 0.35 2.04 -1.79 -1.32 117.51 118.71 3n0s h ILE 4 Ca 0.16 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.70 3n0s h ILE 4 Cb 0.46 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.22 3n0s h ILE 4 CO 0.02 0.14 0.03 0.58 0.00 0.00 0.00 178.15 178.91 3n0s h VAL 5 N 0.48 1.03 0.00 1.67 2.07 -1.83 -2.71 116.25 116.96 3n0s h VAL 5 Ca 0.13 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 3n0s h VAL 5 Cb 0.03 1.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 3n0s h VAL 5 CO -0.02 0.02 -0.05 0.00 0.02 0.00 0.00 177.57 177.54 3n0s h ALA 6 N 1.00 1.08 -0.06 1.67 0.00 -1.13 -1.09 119.26 120.73 3n0s h ALA 6 Ca 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3n0s h ALA 6 Cb 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3n0s h ALA 6 CO -0.00 0.07 0.00 -1.13 0.00 0.00 0.00 179.25 178.18 3n0s n SER 7 N -3.27 1.24 -4.39 0.00 3.41 -0.51 -4.84 113.62 105.27 3n0s n SER 7 Ca -0.01 -1.49 -0.33 0.00 -0.26 0.00 0.00 58.87 56.78 3n0s n SER 7 Cb 0.24 -0.03 -0.14 0.00 -0.26 0.00 0.00 64.21 64.02 3n0s n SER 7 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3n0s s THR 8 N -1.94 3.17 -0.06 6.66 2.01 -0.42 -4.98 115.64 120.09 3n0s s THR 8 Ca 0.37 -0.62 -0.17 0.00 0.31 0.00 0.00 61.69 61.58 3n0s s THR 8 Cb 0.19 -2.34 -0.12 0.00 0.01 0.00 0.00 72.50 70.24 3n0s s THR 8 CO 0.31 0.52 0.70 1.56 -0.69 0.00 0.00 174.62 177.02 3n0s h GLN 9 N 6.73 -0.26 -5.03 4.92 1.08 -1.88 -3.47 115.11 117.19 3n0s h GLN 9 Ca -0.27 0.02 -0.33 0.00 -1.45 0.00 0.00 58.65 56.62 3n0s h GLN 9 Cb 1.21 0.06 -0.17 0.00 -0.05 0.00 0.00 27.48 28.52 3n0s h GLN 9 CO 0.57 0.09 -0.73 -0.51 -0.95 0.00 0.00 178.83 177.29 3n0s s LEU 10 N -8.93 2.42 0.37 1.46 1.43 -1.26 -5.13 118.68 109.04 3n0s s LEU 10 Ca -0.10 -0.84 -0.28 0.00 -1.03 0.00 0.00 54.13 51.88 3n0s s LEU 10 Cb 0.00 -0.34 -0.11 0.00 0.03 0.00 0.00 46.19 45.77 3n0s s LEU 10 CO 0.37 -0.26 1.47 -2.84 0.23 0.00 0.00 176.35 175.33 3n0s s PRO 11 N -2.89 4.14 0.33 1.29 0.02 -1.26 -4.90 135.00 131.72 3n0s s PRO 11 Ca 0.07 2.53 -0.27 0.00 0.02 0.00 0.00 61.00 63.35 3n0s s PRO 11 Cb -0.02 -2.98 -0.09 0.00 0.02 0.00 0.00 34.50 31.42 3n0s s PRO 11 CO 0.00 -0.50 1.07 -0.80 -0.33 0.00 0.00 177.00 176.44 3n0s s ASN 12 N -0.14 7.06 0.28 2.53 0.01 -0.22 -4.96 114.94 119.51 3n0s s ASN 12 Ca 0.53 2.16 0.03 0.00 -0.71 0.00 0.00 52.86 54.87 3n0s s ASN 12 Cb -0.46 -2.61 -0.04 0.00 0.41 0.00 0.00 41.25 38.56 3n0s s ASN 12 CO 0.61 -0.28 0.17 0.42 -1.51 0.00 0.00 177.10 176.51 3n0s s THR 13 N -1.37 0.17 0.19 1.60 -4.23 -1.26 -1.49 115.64 109.25 3n0s s THR 13 Ca 0.50 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.89 3n0s s THR 13 Cb -0.28 -2.51 0.13 0.00 1.34 0.00 0.00 72.50 71.18 3n0s s THR 13 CO 0.35 0.00 1.72 0.40 -0.54 0.00 0.00 174.62 176.55 3n0s h ILE 14 N 2.32 0.71 -0.30 2.99 2.04 -1.83 0.10 117.51 123.55 3n0s h ILE 14 Ca -0.33 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 3n0s h ILE 14 Cb 1.25 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 3n0s h ILE 14 CO 0.49 0.05 0.17 0.11 0.00 0.00 0.00 178.15 178.97 3n0s h LYS 15 N 0.27 0.42 -0.11 2.37 1.57 -1.95 -0.30 116.57 118.83 3n0s h LYS 15 Ca 0.27 -0.05 -0.19 0.00 -1.87 0.00 0.00 60.65 58.82 3n0s h LYS 15 Cb 0.37 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 3n0s h LYS 15 CO -0.34 0.35 -0.72 1.79 -0.57 0.00 0.00 179.45 179.97 3n0s h THR 16 N 0.37 1.35 -0.50 -0.16 1.35 -1.84 -1.88 112.91 111.61 3n0s h THR 16 Ca 0.11 -2.06 -0.06 0.00 -0.55 0.00 0.00 66.41 63.85 3n0s h THR 16 Cb 0.05 2.04 -0.02 0.00 -1.73 0.00 0.00 68.15 68.49 3n0s h THR 16 CO -0.02 0.63 0.09 0.40 -0.25 0.00 0.00 175.52 176.37 3n0s h ILE 17 N 0.35 1.25 -0.36 6.82 2.04 -0.77 -2.04 117.51 124.80 3n0s h ILE 17 Ca -0.03 -0.92 0.03 0.00 1.00 0.00 0.00 64.86 64.94 3n0s h ILE 17 Cb 1.30 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 38.22 3n0s h ILE 17 CO 0.13 0.33 0.15 0.74 0.00 0.00 0.00 178.15 179.50 3n0s h THR 18 N 0.70 0.94 -0.39 -0.27 2.02 -0.96 0.00 112.91 114.96 3n0s h THR 18 Ca 0.15 -0.11 0.07 0.00 0.77 0.00 0.00 66.41 67.29 3n0s h THR 18 Cb 0.39 0.59 -0.06 0.00 -1.74 0.00 0.00 68.15 67.33 3n0s h THR 18 CO 0.01 0.06 0.02 -1.13 0.37 0.00 0.00 175.52 174.85 3n0s h ASN 19 N 0.32 -0.11 -0.33 4.18 -0.00 -1.31 -1.34 115.58 117.00 3n0s h ASN 19 Ca 0.16 0.08 -0.04 0.00 -0.00 0.00 0.00 56.30 56.50 3n0s h ASN 19 Cb 0.10 0.14 -0.02 0.00 -0.00 0.00 0.00 38.32 38.54 3n0s h ASN 19 CO -0.14 -0.02 0.09 0.44 -0.00 0.00 0.00 177.43 177.81 3n0s h ASP 20 N 0.13 0.56 -0.42 1.15 3.32 -0.88 -0.53 116.42 119.75 3n0s h ASP 20 Ca 0.19 -0.08 -0.12 0.00 0.02 0.00 0.00 57.03 57.04 3n0s h ASP 20 Cb 0.26 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3n0s h ASP 20 CO -0.29 0.56 -0.21 -0.07 -1.72 0.00 0.00 179.24 177.51 3n0s h LEU 21 N 0.59 0.90 -0.34 1.55 3.38 -0.61 -2.32 115.31 118.46 3n0s h LEU 21 Ca 0.14 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 3n0s h LEU 21 Cb 0.23 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 3n0s h LEU 21 CO -0.00 1.11 0.21 0.03 0.09 0.00 0.00 178.44 179.88 3n0s h ARG 22 N 0.69 0.46 -0.59 1.13 3.08 -0.89 -1.38 114.38 116.88 3n0s h ARG 22 Ca 0.09 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.12 3n0s h ARG 22 Cb 0.77 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.69 3n0s h ARG 22 CO 0.06 0.34 0.39 0.87 -1.07 0.00 0.00 179.97 180.56 3n0s h LYS 23 N 0.45 0.75 0.00 0.04 1.57 -1.05 -1.23 116.57 117.11 3n0s h LYS 23 Ca 0.12 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.81 3n0s h LYS 23 Cb -0.01 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 3n0s h LYS 23 CO -0.02 0.50 -0.24 1.25 -0.57 0.00 0.00 179.45 180.37 3n0s h LEU 24 N 0.78 0.00 0.00 2.94 5.85 -1.21 -3.47 115.31 120.20 3n0s h LEU 24 Ca 0.22 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.94 3n0s h LEU 24 Cb -0.05 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.98 3n0s h LEU 24 CO -0.05 0.24 0.00 0.61 -0.34 0.00 0.00 178.44 178.89 3n0s n GLY 25 N -0.55 0.71 3.76 3.75 0.00 -0.46 -4.94 105.19 107.47 3n0s n GLY 25 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 3n0s n GLY 25 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3n0s s LEU 26 N 0.00 4.39 0.03 0.99 2.96 -0.55 -5.00 118.68 121.51 3n0s s LEU 26 Ca 0.00 2.76 -0.01 0.00 -0.22 0.00 0.00 54.13 56.65 3n0s s LEU 26 Cb 0.00 -3.64 -0.02 0.00 0.50 0.00 0.00 46.19 43.02 3n0s s LEU 26 CO 0.00 -0.67 -0.00 -0.54 -1.32 0.00 0.00 176.35 173.82 3n0s s LYS 27 N -1.32 0.44 0.24 1.98 1.02 -1.26 -4.37 119.74 116.47 3n0s s LYS 27 Ca 0.54 -0.79 -0.31 0.00 0.02 0.00 0.00 55.97 55.42 3n0s s LYS 27 Cb -0.42 0.16 -0.12 0.00 -0.52 0.00 0.00 37.83 36.93 3n0s s LYS 27 CO 0.51 -0.08 1.61 1.17 -0.92 0.00 0.00 175.35 177.64 3n0s n LYS 28 N 1.06 2.55 -0.32 1.68 4.81 -1.09 -4.48 118.16 122.38 3n0s n LYS 28 Ca -0.20 0.91 0.00 0.00 -0.87 0.00 0.00 58.31 58.15 3n0s n LYS 28 Cb 0.57 -2.69 0.00 0.00 0.02 0.00 0.00 35.03 32.93 3n0s n LYS 28 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3n0s n GLY 29 N 2.93 0.60 2.78 3.14 0.00 -0.81 -4.95 105.19 108.88 3n0s n GLY 29 Ca 0.13 -0.63 -0.21 0.00 0.00 0.00 0.00 46.02 45.30 3n0s n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3n0s s THR 31 N -2.21 0.29 -0.04 2.61 2.01 -1.26 -4.36 115.64 112.68 3n0s s THR 31 Ca 0.00 0.14 -0.01 0.00 0.31 0.00 0.00 61.69 62.12 3n0s s THR 31 Cb 0.00 -0.44 0.03 0.00 0.01 0.00 0.00 72.50 72.10 3n0s s THR 31 CO 0.00 0.23 0.08 0.54 -0.69 0.00 0.00 174.62 174.78 3n0s s VAL 32 N 1.74 -0.05 -0.09 3.82 0.11 -0.36 -0.26 120.40 125.30 3n0s s VAL 32 Ca 0.01 0.17 -0.22 0.00 -2.93 0.00 0.00 61.98 59.01 3n0s s VAL 32 Cb -0.13 -0.14 -0.04 0.00 -1.53 0.00 0.00 36.38 34.54 3n0s s VAL 32 CO -0.04 0.07 0.66 -0.51 -3.33 0.00 0.00 175.10 171.95 3n0s s ILE 33 N 0.96 5.06 -0.08 7.04 2.07 -0.47 -0.33 121.20 135.45 3n0s s ILE 33 Ca -0.08 1.33 0.04 0.00 -1.41 0.00 0.00 60.65 60.54 3n0s s ILE 33 Cb -0.11 -3.99 -0.01 0.00 0.13 0.00 0.00 42.46 38.48 3n0s s ILE 33 CO -0.04 0.24 -0.21 -0.69 -1.91 0.00 0.00 174.94 172.33 3n0s s VAL 34 N 0.94 2.35 -0.03 4.00 1.01 -0.33 -1.21 120.40 127.13 3n0s s VAL 34 Ca 0.34 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.44 3n0s s VAL 34 Cb -0.17 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 3n0s s VAL 34 CO 0.16 0.56 -0.19 -1.00 0.00 0.00 0.00 175.10 174.63 3n0s s HIS 35 N -0.01 1.80 0.05 5.22 3.76 -0.61 -4.60 115.29 120.89 3n0s s HIS 35 Ca -0.07 -0.43 -0.18 0.00 -0.15 0.00 0.00 55.06 54.23 3n0s s HIS 35 Cb -0.15 -1.18 0.04 0.00 1.11 0.00 0.00 32.58 32.40 3n0s s HIS 35 CO 0.05 -0.10 0.42 -1.54 -0.85 0.00 0.00 174.74 172.72 3n0s s SER 36 N -0.24 -0.29 -0.26 1.40 1.04 -1.26 -0.84 113.70 113.25 3n0s s SER 36 Ca 0.02 -0.00 0.01 0.00 0.48 0.00 0.00 55.95 56.46 3n0s s SER 36 Cb -0.10 0.43 0.05 0.00 0.10 0.00 0.00 66.02 66.50 3n0s s SER 36 CO 0.01 -0.67 -0.09 -0.55 0.98 0.00 0.00 173.24 172.92 3n0s s SER 37 N -2.02 4.39 0.20 7.02 0.15 -0.60 -4.84 113.70 118.00 3n0s s SER 37 Ca -0.05 -1.23 -0.11 0.00 0.70 0.00 0.00 55.95 55.27 3n0s s SER 37 Cb -0.01 -1.59 0.13 0.00 -1.71 0.00 0.00 66.02 62.84 3n0s s SER 37 CO -0.03 -0.18 1.84 0.25 1.20 0.00 0.00 173.24 176.33 3n0s h LEU 38 N 7.87 0.85 -1.58 3.45 5.85 -1.96 -2.82 115.31 126.96 3n0s h LEU 38 Ca -0.24 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.41 3n0s h LEU 38 Cb 1.06 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.86 3n0s h LEU 38 CO 0.51 0.66 0.14 0.77 -0.34 0.00 0.00 178.44 180.18 3n0s h SER 39 N 0.96 0.37 0.66 1.25 4.64 -1.96 -2.68 113.55 116.80 3n0s h SER 39 Ca 0.25 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.52 3n0s h SER 39 Cb -0.03 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 61.96 3n0s h SER 39 CO -0.05 0.33 -0.13 0.77 -0.87 0.00 0.00 176.83 176.87 3n0s h SER 40 N 0.42 0.00 0.26 4.97 4.64 -1.84 -2.55 113.55 119.45 3n0s h SER 40 Ca 0.11 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.38 3n0s h SER 40 Cb 0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.14 3n0s h SER 40 CO -0.01 0.13 -0.21 0.40 -0.87 0.00 0.00 176.83 176.27 3n0s h ILE 41 N 0.00 1.03 0.00 0.95 2.04 -1.57 -3.00 117.51 116.96 3n0s h ILE 41 Ca -0.00 -0.74 0.00 0.00 1.00 0.00 0.00 64.86 65.12 3n0s h ILE 41 Cb 0.50 1.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.99 3n0s h ILE 41 CO 0.02 0.20 0.00 0.61 0.00 0.00 0.00 178.15 178.98 3n0s n GLY 42 N -0.83 0.18 3.72 5.37 0.00 -0.96 -0.06 105.19 112.60 3n0s n GLY 42 Ca -0.02 -2.00 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 3n0s n GLY 42 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 3n0s s TRP 43 N -1.10 3.24 -0.04 1.61 -0.00 -1.26 -4.88 118.94 116.51 3n0s s TRP 43 Ca 0.00 0.96 0.07 0.00 -0.00 0.00 0.00 56.10 57.13 3n0s s TRP 43 Cb 0.00 -3.68 -0.01 0.00 -0.00 0.00 0.00 33.47 29.78 3n0s s TRP 43 CO 0.00 -2.37 -0.24 0.42 -0.00 0.00 0.00 176.95 174.76 3n0s s ILE 44 N 1.04 1.97 -0.42 5.86 1.01 -1.26 -1.06 121.20 128.34 3n0s s ILE 44 Ca 0.64 -1.04 -0.24 0.00 0.00 0.00 0.00 60.65 60.01 3n0s s ILE 44 Cb -0.37 -1.66 0.02 0.00 0.01 0.00 0.00 42.46 40.46 3n0s s ILE 44 CO 0.31 0.55 0.84 -0.55 0.00 0.00 0.00 174.94 176.09 3n0s s SER 45 N -0.30 6.50 0.00 3.58 0.15 -0.55 -2.61 113.70 120.47 3n0s s SER 45 Ca 0.01 0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.81 3n0s s SER 45 Cb -0.12 -2.42 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 3n0s s SER 45 CO 0.02 -0.91 0.00 0.61 1.20 0.00 0.00 173.24 174.16 3n0s n GLY 46 N 4.80 0.75 6.41 9.45 0.00 -1.26 -4.66 105.19 120.68 3n0s n GLY 46 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3n0s n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n0s n GLY 47 N -2.04 2.22 0.34 -0.02 0.00 -1.07 -1.62 105.19 102.99 3n0s n GLY 47 Ca 0.00 0.10 -0.06 0.00 0.00 0.00 0.00 46.02 46.06 3n0s n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n0s h ALA 48 N 0.00 1.03 -0.75 4.61 0.00 -1.92 -1.87 119.26 120.35 3n0s h ALA 48 Ca 0.00 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 54.85 3n0s h ALA 48 Cb 0.00 -0.31 -0.09 0.00 0.00 0.00 0.00 17.79 17.39 3n0s h ALA 48 CO 0.00 0.65 0.32 0.28 0.00 0.00 0.00 179.25 180.51 3n0s h VAL 49 N 1.15 0.70 -0.72 0.00 2.07 -1.67 -1.19 116.25 116.59 3n0s h VAL 49 Ca 0.26 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 67.57 3n0s h VAL 49 Cb 0.22 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.13 3n0s h VAL 49 CO -0.02 0.09 0.29 0.00 0.02 0.00 0.00 177.57 177.94 3n0s h ALA 50 N 1.53 0.93 -0.59 1.67 0.00 -0.68 -1.23 119.26 120.89 3n0s h ALA 50 Ca 0.41 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 3n0s h ALA 50 Cb 0.58 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3n0s h ALA 50 CO -0.37 0.56 0.07 0.28 0.00 0.00 0.00 179.25 179.78 3n0s h VAL 51 N 1.03 1.26 -0.32 0.00 2.07 -1.16 -1.57 116.25 117.56 3n0s h VAL 51 Ca 0.24 -1.03 -0.05 0.00 0.82 0.00 0.00 66.70 66.68 3n0s h VAL 51 Cb 0.21 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 3n0s h VAL 51 CO -0.02 0.38 -0.01 0.58 0.02 0.00 0.00 177.57 178.51 3n0s h VAL 52 N 0.89 1.26 -0.46 2.57 2.07 -1.03 -1.77 116.25 119.79 3n0s h VAL 52 Ca 0.18 -0.98 -0.04 0.00 0.82 0.00 0.00 66.70 66.67 3n0s h VAL 52 Cb 0.45 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 3n0s h VAL 52 CO 0.02 0.32 0.11 -0.33 0.02 0.00 0.00 177.57 177.70 3n0s h GLU 53 N 0.36 0.69 -0.33 1.57 4.39 -1.15 -2.85 114.58 117.26 3n0s h GLU 53 Ca 0.09 -0.13 -0.10 0.00 0.34 0.00 0.00 59.36 59.56 3n0s h GLU 53 Cb 0.46 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 3n0s h GLU 53 CO 0.02 0.63 -0.20 0.00 -1.16 0.00 0.00 179.01 178.30 3n0s h ALA 54 N 1.45 0.47 0.00 3.43 0.00 -1.06 0.75 119.26 124.31 3n0s h ALA 54 Ca 0.15 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3n0s h ALA 54 Cb 0.26 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3n0s h ALA 54 CO -0.00 0.42 0.00 1.28 0.00 0.00 0.00 179.25 180.95 3n0s n LEU 55 N -4.31 0.37 0.00 0.00 4.77 -0.68 -2.23 117.00 114.93 3n0s n LEU 55 Ca -0.03 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 3n0s n LEU 55 Cb 0.42 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3n0s n LEU 55 CO 0.44 0.07 0.00 1.21 -1.33 0.00 0.00 177.39 177.77 3n0s n GLU 57 N 0.82 0.00 0.00 3.23 4.07 0.26 -1.38 120.64 127.64 3n0s n GLU 57 Ca 0.00 0.00 -0.21 0.00 -0.06 0.00 0.00 57.16 56.89 3n0s n GLU 57 Cb 0.07 0.00 -0.14 0.00 -0.06 0.00 0.00 31.44 31.31 3n0s n GLU 57 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 3n0s h VAL 58 N 0.00 1.05 -0.12 6.31 2.07 -1.71 -3.37 116.25 120.48 3n0s h VAL 58 Ca 0.00 -2.39 -0.18 0.00 0.82 0.00 0.00 66.70 64.95 3n0s h VAL 58 Cb 0.00 2.71 0.01 0.00 -1.52 0.00 0.00 31.29 32.49 3n0s h VAL 58 CO 0.00 0.68 -0.64 0.40 0.02 0.00 0.00 177.57 178.03 3n0s h ILE 59 N -0.36 1.33 -3.27 4.57 1.08 -1.45 -2.88 117.51 116.53 3n0s h ILE 59 Ca -0.30 -1.91 0.37 0.00 -0.39 0.00 0.00 64.86 62.64 3n0s h ILE 59 Cb 1.72 2.12 -0.12 0.00 -3.07 0.00 0.00 36.82 37.46 3n0s h ILE 59 CO 0.05 0.59 -0.74 0.35 -0.69 0.00 0.00 178.15 177.70 3n0s n THR 60 N -4.10 0.00 0.32 -0.27 -2.24 -1.26 -1.92 114.28 104.81 3n0s n THR 60 Ca -0.08 0.29 0.21 0.00 -2.27 0.00 0.00 64.05 62.20 3n0s n THR 60 Cb 0.67 -0.77 1.07 0.00 -2.10 0.00 0.00 70.33 69.21 3n0s n THR 60 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 3n0s h GLU 61 N -1.36 0.00 0.00 -0.78 5.08 -1.96 -0.75 114.58 114.80 3n0s h GLU 61 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3n0s h GLU 61 Cb 1.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.61 3n0s h GLU 61 CO 0.03 0.00 0.00 0.39 -1.00 0.00 0.00 179.01 178.43 3n0s n GLU 62 N -3.06 0.18 -1.83 2.33 -0.58 -1.26 -2.16 120.64 114.27 3n0s n GLU 62 Ca -0.02 0.23 -0.05 0.00 -0.42 0.00 0.00 57.16 56.91 3n0s n GLU 62 Cb 0.13 -1.75 0.00 0.00 -0.57 0.00 0.00 31.44 29.25 3n0s n GLU 62 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3n0s n GLY 63 N 0.90 2.74 2.91 0.62 0.00 -0.29 -4.53 105.19 107.55 3n0s n GLY 63 Ca 0.05 -2.18 -0.16 0.00 0.00 0.00 0.00 46.02 43.72 3n0s n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3n0s s THR 64 N -0.34 0.31 -0.16 2.61 2.01 -1.26 -1.13 115.64 117.69 3n0s s THR 64 Ca 0.08 -0.12 -0.02 0.00 0.31 0.00 0.00 61.69 61.94 3n0s s THR 64 Cb -0.01 -0.30 -0.02 0.00 0.01 0.00 0.00 72.50 72.18 3n0s s THR 64 CO 0.05 0.12 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.39 3n0s s ILE 65 N 0.23 3.45 0.35 1.82 1.01 0.03 -1.23 121.20 126.87 3n0s s ILE 65 Ca -0.02 -0.51 0.01 0.00 0.00 0.00 0.00 60.65 60.13 3n0s s ILE 65 Cb -0.05 -2.50 0.01 0.00 0.01 0.00 0.00 42.46 39.93 3n0s s ILE 65 CO -0.00 0.49 0.11 -0.38 0.00 0.00 0.00 174.94 175.15 3n0s n ILE 66 N 3.79 0.00 -4.75 2.92 -0.00 0.55 -1.04 119.36 120.83 3n0s n ILE 66 Ca -0.18 -1.56 -0.33 0.00 -0.00 0.00 0.00 62.75 60.68 3n0s n ILE 66 Cb 0.52 0.13 -0.12 0.00 -0.00 0.00 0.00 39.64 40.16 3n0s n ILE 66 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 3n0s s PRO 68 N -3.34 2.77 -0.36 0.38 0.04 -1.26 -1.19 135.00 132.03 3n0s s PRO 68 Ca 0.08 -0.63 0.12 0.00 0.04 0.00 0.00 61.00 60.62 3n0s s PRO 68 Cb -0.01 -2.52 0.45 0.00 0.04 0.00 0.00 34.50 32.46 3n0s s PRO 68 CO 0.05 0.57 1.05 0.25 0.04 0.00 0.00 177.00 178.96 3n0s n THR 69 N 2.49 1.67 -1.82 1.26 -2.24 0.12 -4.81 114.28 110.94 3n0s n THR 69 Ca -0.18 -3.87 -0.39 0.00 -2.27 0.00 0.00 64.05 57.35 3n0s n THR 69 Cb 0.53 -0.18 0.03 0.00 -2.10 0.00 0.00 70.33 68.61 3n0s n THR 69 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3n0s s GLN 70 N -3.38 3.36 -0.43 -0.78 -0.21 -1.23 -4.25 119.66 112.74 3n0s s GLN 70 Ca 0.37 2.27 0.09 0.00 0.02 0.00 0.00 55.36 58.11 3n0s s GLN 70 Cb 0.42 -2.40 0.30 0.00 1.00 0.00 0.00 33.01 32.33 3n0s s GLN 70 CO -0.06 -1.03 0.68 -1.13 -2.12 0.00 0.00 175.29 171.63 3n0s n SER 71 N -0.71 1.31 0.30 5.90 3.41 -0.69 -0.84 113.62 122.30 3n0s n SER 71 Ca 0.08 -3.01 0.18 0.00 -0.26 0.00 0.00 58.87 55.87 3n0s n SER 71 Cb 0.44 -0.63 0.95 0.00 -0.26 0.00 0.00 64.21 64.71 3n0s n SER 71 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3n0s h SER 72 N 3.51 0.00 -1.65 4.04 4.64 -1.87 -1.65 113.55 120.57 3n0s h SER 72 Ca 0.10 0.00 0.49 0.00 -0.47 0.00 0.00 61.79 61.91 3n0s h SER 72 Cb 0.85 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.86 3n0s h SER 72 CO 0.56 0.03 1.17 -0.78 -0.87 0.00 0.00 176.83 176.94 3n0s h ASP 73 N 0.00 0.06 -0.30 4.97 3.58 -1.94 -1.67 116.42 121.12 3n0s h ASP 73 Ca -0.00 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.48 3n0s h ASP 73 Cb 0.20 0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.28 3n0s h ASP 73 CO 0.00 -0.04 0.00 0.18 -2.88 0.00 0.00 179.24 176.51 3n0s n LEU 74 N -4.16 2.06 -4.90 2.28 4.32 -0.62 -4.98 117.00 111.00 3n0s n LEU 74 Ca 0.38 -0.95 -0.29 0.00 -0.02 0.00 0.00 56.01 55.13 3n0s n LEU 74 Cb 1.71 -0.20 0.05 0.00 -1.62 0.00 0.00 43.42 43.36 3n0s n LEU 74 CO 0.39 0.48 0.69 -0.94 -1.22 0.00 0.00 177.39 176.78 3n0s s SER 75 N -1.28 5.40 0.08 -1.43 1.04 -0.63 -4.28 113.70 112.59 3n0s s SER 75 Ca 0.30 0.96 -0.31 0.00 0.48 0.00 0.00 55.95 57.39 3n0s s SER 75 Cb 0.16 -1.79 -0.09 0.00 0.10 0.00 0.00 66.02 64.41 3n0s s SER 75 CO 0.23 -1.31 1.69 -0.62 0.98 0.00 0.00 173.24 174.20 3n0s s ASP 76 N -4.37 6.57 0.05 7.02 -1.08 -1.16 -4.85 116.67 118.84 3n0s s ASP 76 Ca 0.57 2.54 0.12 0.00 -0.52 0.00 0.00 52.55 55.26 3n0s s ASP 76 Cb -0.11 -2.56 0.53 0.00 -1.46 0.00 0.00 42.92 39.32 3n0s s ASP 76 CO 0.49 -0.91 1.38 -0.81 0.52 0.00 0.00 175.17 175.85 3n0s n PRO 77 N 5.62 0.03 0.14 4.34 -0.04 -1.26 -2.47 135.00 141.36 3n0s n PRO 77 Ca 0.16 0.36 0.06 0.00 -0.04 0.00 0.00 63.50 64.04 3n0s n PRO 77 Cb 0.40 -1.57 0.52 0.00 -0.04 0.00 0.00 33.50 32.81 3n0s n PRO 77 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 3n0s h LYS 78 N 0.00 0.23 -0.59 0.54 2.10 -1.94 -2.54 116.57 114.37 3n0s h LYS 78 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 3n0s h LYS 78 Cb 0.18 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.46 3n0s h LYS 78 CO 0.00 0.19 0.00 0.72 -2.00 0.00 0.00 179.45 178.36 3n0s n HIS 79 N -4.47 0.83 -2.78 0.07 8.25 -1.03 -5.00 115.22 111.09 3n0s n HIS 79 Ca -0.00 -0.40 -0.40 0.00 -0.26 0.00 0.00 57.72 56.65 3n0s n HIS 79 Cb 0.11 -0.03 -0.05 0.00 1.12 0.00 0.00 29.99 31.14 3n0s n HIS 79 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 3n0s s TRP 80 N -1.29 3.89 0.00 4.41 0.51 -0.96 -4.94 118.94 120.56 3n0s s TRP 80 Ca 0.39 1.81 0.00 0.00 -2.12 0.00 0.00 56.10 56.18 3n0s s TRP 80 Cb 0.21 -2.98 0.00 0.00 -0.81 0.00 0.00 33.47 29.89 3n0s s TRP 80 CO 0.26 0.35 0.00 -1.13 -0.51 0.00 0.00 176.95 175.91 3n0s n SER 81 N 2.14 1.15 -3.62 2.95 3.41 -1.26 -4.09 113.62 114.30 3n0s n SER 81 Ca -0.01 -0.19 -0.27 0.00 -0.26 0.00 0.00 58.87 58.14 3n0s n SER 81 Cb 0.48 0.60 -0.11 0.00 -0.26 0.00 0.00 64.21 64.93 3n0s n SER 81 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3n0s n ARG 82 N -0.72 1.03 -2.89 4.33 1.85 -1.26 -4.06 116.66 114.94 3n0s n ARG 82 Ca 0.00 -3.83 -0.21 0.00 -1.00 0.00 0.00 57.85 52.81 3n0s n ARG 82 Cb 0.00 -1.96 0.09 0.00 -1.05 0.00 0.00 32.46 29.54 3n0s n ARG 82 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 3n0s s PRO 83 N -0.75 1.98 0.58 2.89 0.04 -1.26 -5.16 135.00 133.32 3n0s s PRO 83 Ca 0.29 -1.54 -0.03 0.00 0.04 0.00 0.00 61.00 59.77 3n0s s PRO 83 Cb 0.01 -2.52 0.03 0.00 0.04 0.00 0.00 34.50 32.05 3n0s s PRO 83 CO -0.18 -1.17 0.85 -1.25 0.04 0.00 0.00 177.00 175.29 3n0s s PRO 84 N -4.88 2.68 0.12 0.56 0.04 -1.26 -4.84 135.00 127.42 3n0s s PRO 84 Ca 0.65 -0.37 0.06 0.00 0.04 0.00 0.00 61.00 61.38 3n0s s PRO 84 Cb -0.05 -2.36 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 3n0s s PRO 84 CO 0.42 -0.75 -0.15 0.14 0.04 0.00 0.00 177.00 176.70 3n0s s VAL 85 N -2.90 1.37 0.58 -0.36 -7.23 -1.26 -5.02 120.40 105.58 3n0s s VAL 85 Ca 0.55 -1.68 -0.18 0.00 -1.81 0.00 0.00 61.98 58.86 3n0s s VAL 85 Cb -0.10 -1.51 -0.07 0.00 0.56 0.00 0.00 36.38 35.26 3n0s s VAL 85 CO 0.42 -0.37 0.72 -2.65 -0.31 0.00 0.00 175.10 172.91 3n0s n PRO 86 N 0.62 0.68 0.12 4.82 -0.02 -1.26 -4.90 135.00 135.06 3n0s n PRO 86 Ca -0.16 0.26 0.01 0.00 -2.02 0.00 0.00 63.50 61.59 3n0s n PRO 86 Cb 0.56 -1.90 0.31 0.00 -0.02 0.00 0.00 33.50 32.46 3n0s n PRO 86 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3n0s h GLU 87 N 0.35 0.21 0.00 -0.52 4.81 -2.00 -2.08 114.58 115.35 3n0s h GLU 87 Ca -0.47 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 3n0s h GLU 87 Cb 1.38 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.75 3n0s h GLU 87 CO 0.49 0.48 0.00 -0.85 -0.73 0.00 0.00 179.01 178.39 3n0s n GLU 88 N -4.14 0.09 0.16 1.92 0.00 -1.26 -1.76 120.64 115.64 3n0s n GLU 88 Ca -0.01 0.42 0.11 0.00 0.00 0.00 0.00 57.16 57.68 3n0s n GLU 88 Cb 0.38 -1.70 0.07 0.00 0.00 0.00 0.00 31.44 30.19 3n0s n GLU 88 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.13 175.64 3n0s h TRP 89 N 0.00 0.00 -0.51 -1.84 4.06 -1.72 -3.41 115.95 112.53 3n0s h TRP 89 Ca 0.00 0.00 0.04 0.00 2.06 0.00 0.00 58.89 60.99 3n0s h TRP 89 Cb 0.20 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.32 3n0s h TRP 89 CO 0.00 0.02 0.27 -1.49 -3.56 0.00 0.00 178.44 173.68 3n0s h TRP 90 N 0.00 0.50 0.01 0.49 4.06 -1.44 -0.56 115.95 119.01 3n0s h TRP 90 Ca -0.00 0.02 -0.23 0.00 2.06 0.00 0.00 58.89 60.74 3n0s h TRP 90 Cb 1.02 -0.15 0.00 0.00 -1.00 0.00 0.00 29.16 29.03 3n0s h TRP 90 CO 0.00 0.26 -0.96 0.37 -3.56 0.00 0.00 178.44 174.55 3n0s h GLN 91 N 0.53 0.39 -0.56 0.49 5.75 -1.79 -1.45 115.11 118.46 3n0s h GLN 91 Ca 0.22 -0.43 0.05 0.00 -0.15 0.00 0.00 58.65 58.33 3n0s h GLN 91 Cb 0.09 0.13 -0.05 0.00 1.07 0.00 0.00 27.48 28.72 3n0s h GLN 91 CO -0.13 1.11 0.30 0.82 -2.65 0.00 0.00 178.83 178.28 3n0s h ILE 92 N 0.21 0.97 -0.44 2.39 2.04 -1.66 -0.53 117.51 120.50 3n0s h ILE 92 Ca -0.08 -0.20 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 3n0s h ILE 92 Cb 1.61 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 3n0s h ILE 92 CO 0.16 0.11 0.18 0.40 0.00 0.00 0.00 178.15 179.00 3n0s h ILE 93 N 0.58 1.20 -0.76 -0.67 2.04 -0.92 -1.67 117.51 117.31 3n0s h ILE 93 Ca 0.25 -0.60 0.07 0.00 1.00 0.00 0.00 64.86 65.57 3n0s h ILE 93 Cb 0.13 0.78 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 3n0s h ILE 93 CO -0.16 0.22 0.50 0.03 0.00 0.00 0.00 178.15 178.75 3n0s h ARG 94 N 0.57 0.78 0.00 2.37 3.08 -0.77 -1.02 114.38 119.38 3n0s h ARG 94 Ca 0.15 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.15 3n0s h ARG 94 Cb 0.18 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3n0s h ARG 94 CO -0.01 0.51 -0.25 -0.25 -1.07 0.00 0.00 179.97 178.90 3n0s n ASP 95 N -4.48 0.31 0.00 7.04 8.00 -0.25 -4.54 116.55 122.62 3n0s n ASP 95 Ca 0.11 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.79 3n0s n ASP 95 Cb 0.23 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.16 3n0s n ASP 95 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3n0s n ASN 96 N -1.60 2.96 -4.74 -2.24 3.02 -0.66 -5.05 115.26 106.95 3n0s n ASN 96 Ca 0.06 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.20 3n0s n ASN 96 Cb 0.35 0.56 -0.02 0.00 -0.61 0.00 0.00 39.78 40.06 3n0s n ASN 96 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3n0s s VAL 97 N -1.23 2.32 0.38 2.41 0.11 -0.46 -4.89 120.40 119.04 3n0s s VAL 97 Ca 0.00 0.27 -0.27 0.00 -2.93 0.00 0.00 61.98 59.05 3n0s s VAL 97 Cb 0.00 -3.17 -0.10 0.00 -1.53 0.00 0.00 36.38 31.58 3n0s s VAL 97 CO 0.00 0.04 1.37 -2.84 -3.33 0.00 0.00 175.10 170.34 3n0s s PRO 98 N -0.29 4.07 0.76 1.54 0.02 -1.26 -4.90 135.00 134.95 3n0s s PRO 98 Ca 0.63 2.32 -0.15 0.00 0.02 0.00 0.00 61.00 63.82 3n0s s PRO 98 Cb -0.45 -2.88 0.03 0.00 0.02 0.00 0.00 34.50 31.21 3n0s s PRO 98 CO 0.44 -0.46 1.01 0.00 -0.33 0.00 0.00 177.00 177.66 3n0s n ALA 99 N 0.35 -0.30 -1.84 -1.55 0.00 -1.26 -4.86 120.51 111.05 3n0s n ALA 99 Ca 0.02 -0.26 -0.41 0.00 0.00 0.00 0.00 53.44 52.79 3n0s n ALA 99 Cb 0.42 -2.14 -0.02 0.00 0.00 0.00 0.00 19.45 17.70 3n0s n ALA 99 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3n0s s PHE 100 N -1.94 3.00 -0.16 0.00 5.36 -0.81 -4.95 117.98 118.48 3n0s s PHE 100 Ca 0.72 1.16 -0.04 0.00 -0.96 0.00 0.00 56.93 57.82 3n0s s PHE 100 Cb -0.32 -3.78 0.08 0.00 -0.34 0.00 0.00 43.02 38.65 3n0s s PHE 100 CO 0.51 -2.42 0.23 -1.21 -1.46 0.00 0.00 175.22 170.87 3n0s s GLU 101 N -0.92 0.16 0.44 10.12 2.02 -1.26 -4.40 118.70 124.85 3n0s s GLU 101 Ca 0.56 0.43 0.10 0.00 0.02 0.00 0.00 54.97 56.08 3n0s s GLU 101 Cb -0.41 -0.69 0.97 0.00 0.10 0.00 0.00 34.13 34.10 3n0s s GLU 101 CO 0.47 -0.49 2.07 -1.00 0.02 0.00 0.00 175.26 176.34 3n0s h PRO 102 N 8.31 0.35 0.00 0.39 0.13 -1.94 -0.70 132.00 138.55 3n0s h PRO 102 Ca -0.16 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 3n0s h PRO 102 Cb 1.14 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.19 3n0s h PRO 102 CO 0.21 0.26 0.00 0.72 -0.23 0.00 0.00 178.00 178.96 3n0s n HIS 103 N -4.47 0.00 0.00 1.56 8.25 -1.26 -4.40 115.22 114.90 3n0s n HIS 103 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 3n0s n HIS 103 Cb 0.09 -0.29 0.00 0.00 1.12 0.00 0.00 29.99 30.91 3n0s n HIS 103 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 3n0s n ILE 104 N -1.29 0.00 -1.74 1.59 5.41 -0.44 -5.06 119.36 117.83 3n0s n ILE 104 Ca 0.11 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.44 3n0s n ILE 104 Cb 0.19 -0.49 -0.03 0.00 -0.71 0.00 0.00 39.64 38.61 3n0s n ILE 104 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 3n0s s THR 105 N -1.65 2.98 0.52 1.39 2.01 -0.40 -4.96 115.64 115.53 3n0s s THR 105 Ca 0.00 0.15 -0.18 0.00 0.31 0.00 0.00 61.69 61.97 3n0s s THR 105 Cb 0.00 -3.10 -0.07 0.00 0.01 0.00 0.00 72.50 69.34 3n0s s THR 105 CO 0.00 -0.01 1.03 -2.16 -0.69 0.00 0.00 174.62 172.79 3n0s s PRO 106 N 3.88 3.71 0.62 4.92 0.04 -1.26 -5.00 135.00 141.92 3n0s s PRO 106 Ca 0.84 1.22 -0.11 0.00 0.04 0.00 0.00 61.00 62.99 3n0s s PRO 106 Cb -0.42 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 31.99 3n0s s PRO 106 CO 0.38 -0.49 1.03 0.95 0.04 0.00 0.00 177.00 178.91 3n0s s THR 107 N -2.26 4.65 -0.10 1.26 -4.23 -1.26 -4.70 115.64 109.00 3n0s s THR 107 Ca 0.64 0.86 -0.01 0.00 -1.18 0.00 0.00 61.69 62.01 3n0s s THR 107 Cb -0.14 -3.85 0.03 0.00 1.34 0.00 0.00 72.50 69.87 3n0s s THR 107 CO 0.27 -1.12 -0.06 -0.60 -0.54 0.00 0.00 174.62 172.56 3n0s s ARG 108 N -5.19 1.32 -0.39 3.99 3.52 -0.02 -4.98 118.95 117.19 3n0s s ARG 108 Ca 0.55 -0.17 -0.02 0.00 -0.13 0.00 0.00 55.73 55.96 3n0s s ARG 108 Cb -0.11 -1.45 0.00 0.00 -1.56 0.00 0.00 34.95 31.83 3n0s s ARG 108 CO 0.54 -0.28 0.39 0.00 -0.81 0.00 0.00 175.30 175.14 3n0s n ALA 109 N 4.99 -2.24 -3.38 6.12 0.00 -1.26 -4.78 120.51 119.95 3n0s n ALA 109 Ca -0.11 0.12 -0.09 0.00 0.00 0.00 0.00 53.44 53.37 3n0s n ALA 109 Cb 0.50 -1.10 -0.04 0.00 0.00 0.00 0.00 19.45 18.81 3n0s n ALA 109 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3n0s s GLY 111 N -2.45 0.26 0.34 0.00 0.00 -1.26 -5.11 107.32 99.09 3n0s s GLY 111 Ca 0.03 -0.61 0.08 0.00 0.00 0.00 0.00 44.72 44.22 3n0s s GLY 111 CO 0.43 -0.42 1.79 0.50 0.00 0.00 0.00 173.10 175.40 3n0s h LYS 112 N 2.18 0.21 -0.38 2.90 1.79 -1.99 -1.89 116.57 119.38 3n0s h LYS 112 Ca -0.25 -0.08 -0.01 0.00 -2.18 0.00 0.00 60.65 58.13 3n0s h LYS 112 Cb 1.25 -0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.87 3n0s h LYS 112 CO 0.32 0.50 0.19 0.28 -1.08 0.00 0.00 179.45 179.66 3n0s h VAL 113 N 0.19 1.17 -0.35 0.50 2.07 -1.92 -1.46 116.25 116.45 3n0s h VAL 113 Ca 0.03 -0.48 -0.03 0.00 0.82 0.00 0.00 66.70 67.04 3n0s h VAL 113 Cb 0.63 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 3n0s h VAL 113 CO 0.05 0.18 0.09 0.58 0.02 0.00 0.00 177.57 178.48 3n0s h VAL 114 N 0.48 1.22 -0.97 2.57 2.07 -1.84 0.18 116.25 119.97 3n0s h VAL 114 Ca 0.13 -0.75 0.07 0.00 0.82 0.00 0.00 66.70 66.97 3n0s h VAL 114 Cb 0.11 1.05 -0.07 0.00 -1.52 0.00 0.00 31.29 30.86 3n0s h VAL 114 CO -0.02 0.25 0.62 -0.33 0.02 0.00 0.00 177.57 178.11 3n0s h GLU 115 N 0.41 1.07 0.61 1.57 4.39 -1.31 0.38 114.58 121.71 3n0s h GLU 115 Ca 0.11 -0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.72 3n0s h GLU 115 Cb 0.30 -0.24 0.01 0.00 -0.10 0.00 0.00 28.75 28.71 3n0s h GLU 115 CO 0.00 0.71 -0.29 0.00 -1.16 0.00 0.00 179.01 178.27 3n0s h PHE 117 N -1.02 -0.10 0.00 0.00 3.57 -0.22 -2.30 116.94 116.86 3n0s h PHE 117 Ca -0.08 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 3n0s h PHE 117 Cb 0.68 0.13 -0.00 0.00 2.79 0.00 0.00 35.95 39.55 3n0s h PHE 117 CO -0.00 -0.17 -0.06 0.07 -2.23 0.00 0.00 178.31 175.92 3n0s h ARG 118 N 0.09 0.00 -0.01 1.11 0.11 -0.33 -1.43 114.38 113.92 3n0s h ARG 118 Ca 0.28 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.36 3n0s h ARG 118 Cb 0.45 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.53 3n0s h ARG 118 CO -0.50 0.06 -0.20 0.25 0.10 0.00 0.00 179.97 179.67 3n0s n THR 119 N -4.28 0.00 -1.63 0.08 -2.24 -0.88 -4.86 114.28 100.48 3n0s n THR 119 Ca -0.03 -0.11 -0.37 0.00 -2.27 0.00 0.00 64.05 61.27 3n0s n THR 119 Cb 0.14 0.24 0.07 0.00 -2.10 0.00 0.00 70.33 68.68 3n0s n THR 119 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3n0s n TYR 120 N -0.72 1.25 -0.03 4.78 4.01 -0.54 -4.93 117.16 120.97 3n0s n TYR 120 Ca 0.13 0.42 -0.09 0.00 -0.16 0.00 0.00 57.90 58.21 3n0s n TYR 120 Cb 0.33 -2.18 -0.03 0.00 -0.31 0.00 0.00 39.34 37.15 3n0s n TYR 120 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 3n0s h PRO 121 N 0.37 -0.03 -0.69 -0.72 0.11 -1.91 -2.61 132.00 126.52 3n0s h PRO 121 Ca -0.49 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.35 3n0s h PRO 121 Cb 1.35 0.01 -0.16 0.00 0.11 0.00 0.00 31.00 32.31 3n0s h PRO 121 CO 0.51 -0.02 0.28 0.09 -0.21 0.00 0.00 178.00 178.65 3n0s n ASN 122 N -5.21 4.04 -4.75 -2.05 3.02 -1.26 -4.95 115.26 104.11 3n0s n ASN 122 Ca -0.03 -3.41 -0.40 0.00 -0.03 0.00 0.00 54.58 50.72 3n0s n ASN 122 Cb 0.13 -0.73 -0.05 0.00 -0.61 0.00 0.00 39.78 38.52 3n0s n ASN 122 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3n0s s VAL 123 N -3.11 4.77 0.04 2.41 1.01 -0.99 -4.68 120.40 119.86 3n0s s VAL 123 Ca 0.53 1.54 0.05 0.00 0.00 0.00 0.00 61.98 64.10 3n0s s VAL 123 Cb 0.44 -4.07 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 3n0s s VAL 123 CO 0.10 0.38 -0.12 0.68 0.00 0.00 0.00 175.10 176.14 3n0s s VAL 124 N -0.10 3.23 0.04 2.92 -7.23 -0.33 -4.94 120.40 114.00 3n0s s VAL 124 Ca 0.37 -1.03 0.09 0.00 -1.81 0.00 0.00 61.98 59.59 3n0s s VAL 124 Cb -0.20 -2.41 -0.03 0.00 0.56 0.00 0.00 36.38 34.31 3n0s s VAL 124 CO 0.22 0.32 -0.25 -0.60 -0.31 0.00 0.00 175.10 174.48 3n0s s ARG 125 N -1.55 1.86 0.83 4.82 3.52 -1.26 -0.51 118.95 126.65 3n0s s ARG 125 Ca 0.17 -1.08 -0.12 0.00 -0.13 0.00 0.00 55.73 54.56 3n0s s ARG 125 Cb -0.11 -2.02 0.09 0.00 -1.56 0.00 0.00 34.95 31.35 3n0s s ARG 125 CO 0.08 0.52 1.14 -1.54 -0.81 0.00 0.00 175.30 174.68 3n0s s SER 126 N -1.25 4.32 0.00 -2.12 1.04 -0.39 -4.97 113.70 110.33 3n0s s SER 126 Ca 0.12 0.98 0.27 0.00 0.48 0.00 0.00 55.95 57.80 3n0s s SER 126 Cb -0.10 -1.58 0.92 0.00 0.10 0.00 0.00 66.02 65.36 3n0s s SER 126 CO 0.02 -2.04 1.67 -3.20 0.98 0.00 0.00 173.24 170.67 3n0s n ASN 127 N -3.44 1.56 -4.75 7.02 5.15 -1.26 -4.66 115.26 114.88 3n0s n ASN 127 Ca 0.07 -1.45 -0.41 0.00 -0.60 0.00 0.00 54.58 52.19 3n0s n ASN 127 Cb 0.59 0.03 -0.03 0.00 -0.53 0.00 0.00 39.78 39.83 3n0s n ASN 127 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 3n0s s HIS 128 N -2.08 3.39 -0.86 1.20 2.46 -1.26 -4.92 115.29 113.21 3n0s s HIS 128 Ca 0.35 1.51 0.24 0.00 0.47 0.00 0.00 55.06 57.63 3n0s s HIS 128 Cb 0.21 -3.44 0.96 0.00 -0.13 0.00 0.00 32.58 30.17 3n0s s HIS 128 CO 0.36 -1.15 1.75 -0.35 -2.47 0.00 0.00 174.74 172.89 3n0s n PRO 129 N 1.65 0.09 0.00 2.88 -0.04 -1.26 -3.73 135.00 134.58 3n0s n PRO 129 Ca 0.01 0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 3n0s n PRO 129 Cb 0.44 -1.62 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 3n0s n PRO 129 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3n0s n LEU 130 N -1.78 1.56 -2.43 1.53 4.77 -1.26 -4.60 117.00 114.80 3n0s n LEU 130 Ca 0.05 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.81 3n0s n LEU 130 Cb 0.30 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.41 3n0s n LEU 130 CO 0.23 0.26 0.13 0.61 -1.33 0.00 0.00 177.39 177.30 3n0s n GLY 131 N 2.65 5.22 3.81 -0.72 0.00 -1.26 -1.70 105.19 113.18 3n0s n GLY 131 Ca 0.00 -2.44 -0.30 0.00 0.00 0.00 0.00 46.02 43.28 3n0s n GLY 131 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3n0s s SER 132 N -3.51 4.62 0.02 1.61 1.04 -1.24 -4.86 113.70 111.39 3n0s s SER 132 Ca 0.44 1.34 0.03 0.00 0.48 0.00 0.00 55.95 58.25 3n0s s SER 132 Cb 0.41 -2.10 -0.02 0.00 0.10 0.00 0.00 66.02 64.41 3n0s s SER 132 CO -0.10 -1.89 -0.09 -0.36 0.98 0.00 0.00 173.24 171.78 3n0s s PHE 133 N -3.14 0.79 0.05 5.02 0.08 -1.26 -0.71 117.98 118.81 3n0s s PHE 133 Ca 0.60 -0.32 0.04 0.00 0.12 0.00 0.00 56.93 57.38 3n0s s PHE 133 Cb -0.14 -0.48 -0.04 0.00 -0.57 0.00 0.00 43.02 41.79 3n0s s PHE 133 CO 0.54 -0.02 -0.04 0.00 -0.10 0.00 0.00 175.22 175.60 3n0s s ALA 134 N -0.79 3.16 0.02 5.36 0.00 -1.26 -1.27 121.76 126.98 3n0s s ALA 134 Ca -0.02 -1.09 -0.04 0.00 0.00 0.00 0.00 51.96 50.81 3n0s s ALA 134 Cb -0.07 -1.15 -0.01 0.00 0.00 0.00 0.00 23.12 21.90 3n0s s ALA 134 CO 0.00 0.66 0.06 0.00 0.00 0.00 0.00 175.76 176.49 3n0s s ALA 135 N -1.17 -0.08 -0.02 0.00 0.00 0.33 -4.35 121.76 116.47 3n0s s ALA 135 Ca 0.22 -0.42 0.02 0.00 0.00 0.00 0.00 51.96 51.77 3n0s s ALA 135 Cb -0.11 0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.17 3n0s s ALA 135 CO 0.13 -0.22 -0.06 -0.46 0.00 0.00 0.00 175.76 175.15 3n0s s TRP 136 N -1.76 0.63 0.00 0.00 -0.00 -0.21 -1.18 118.94 116.42 3n0s s TRP 136 Ca -0.12 -0.14 0.00 0.00 -0.00 0.00 0.00 56.10 55.84 3n0s s TRP 136 Cb -0.07 -0.47 0.00 0.00 -0.00 0.00 0.00 33.47 32.94 3n0s s TRP 136 CO -0.01 -0.07 0.00 0.41 -0.00 0.00 0.00 176.95 177.28 3n0s n GLY 137 N 3.28 -0.16 0.26 5.86 0.00 -1.26 -0.79 105.19 112.38 3n0s n GLY 137 Ca -0.17 -2.23 -0.01 0.00 0.00 0.00 0.00 46.02 43.61 3n0s n GLY 137 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3n0s h ARG 138 N 2.13 0.65 -0.39 1.61 2.43 -0.61 -2.74 114.38 117.47 3n0s h ARG 138 Ca 0.00 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.08 3n0s h ARG 138 Cb 0.00 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.37 3n0s h ARG 138 CO 0.00 0.43 0.03 0.72 -1.51 0.00 0.00 179.97 179.64 3n0s n HIS 139 N -4.80 1.35 -0.26 2.20 8.25 -1.26 -4.67 115.22 116.02 3n0s n HIS 139 Ca 0.09 -1.00 -0.00 0.00 -0.26 0.00 0.00 57.72 56.54 3n0s n HIS 139 Cb 0.18 -0.42 0.12 0.00 1.12 0.00 0.00 29.99 30.99 3n0s n HIS 139 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3n0s h ALA 140 N 2.13 1.01 -0.05 -1.41 0.00 -1.76 -0.88 119.26 118.31 3n0s h ALA 140 Ca 0.07 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 3n0s h ALA 140 Cb 1.68 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 19.33 3n0s h ALA 140 CO 0.36 0.12 -0.57 0.93 0.00 0.00 0.00 179.25 180.09 3n0s h GLU 141 N 0.78 0.47 -0.46 0.00 3.07 -1.83 -2.56 114.58 114.05 3n0s h GLU 141 Ca 0.33 -0.44 -0.13 0.00 -0.50 0.00 0.00 59.36 58.62 3n0s h GLU 141 Cb 0.20 0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 3n0s h GLU 141 CO -0.19 1.08 -0.23 1.05 -1.40 0.00 0.00 179.01 179.33 3n0s h GLU 142 N 0.01 0.95 -0.53 2.33 4.11 -1.85 -0.84 114.58 118.76 3n0s h GLU 142 Ca -0.06 -0.41 -0.04 0.00 0.07 0.00 0.00 59.36 58.92 3n0s h GLU 142 Cb 1.25 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.44 3n0s h GLU 142 CO 0.11 1.08 0.18 0.82 0.07 0.00 0.00 179.01 181.26 3n0s h ILE 143 N 0.82 1.21 0.00 -1.06 2.04 -1.21 -3.23 117.51 116.07 3n0s h ILE 143 Ca 0.10 -0.69 0.00 0.00 1.00 0.00 0.00 64.86 65.27 3n0s h ILE 143 Cb 0.80 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 3n0s h ILE 143 CO 0.07 0.26 -1.28 0.35 0.00 0.00 0.00 178.15 177.55 3n0s n THR 144 N -4.31 0.03 -2.42 -0.27 -2.24 -0.96 -3.99 114.28 100.11 3n0s n THR 144 Ca 0.04 -0.20 -0.41 0.00 -2.27 0.00 0.00 64.05 61.22 3n0s n THR 144 Cb 0.19 0.53 -0.04 0.00 -2.10 0.00 0.00 70.33 68.91 3n0s n THR 144 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3n0s s VAL 145 N -3.19 3.52 -1.24 2.28 0.11 -0.34 -4.16 120.40 117.38 3n0s s VAL 145 Ca 0.03 1.41 -0.05 0.00 -2.93 0.00 0.00 61.98 60.43 3n0s s VAL 145 Cb 0.15 -3.90 0.01 0.00 -1.53 0.00 0.00 36.38 31.11 3n0s s VAL 145 CO 0.86 0.29 1.06 0.59 -3.33 0.00 0.00 175.10 174.57 3n0s n ASN 146 N 1.76 -4.46 -4.72 3.54 5.03 -1.26 -4.96 115.26 110.19 3n0s n ASN 146 Ca 0.01 -0.55 -0.42 0.00 0.87 0.00 0.00 54.58 54.49 3n0s n ASN 146 Cb 0.45 -4.88 -0.03 0.00 -1.02 0.00 0.00 39.78 34.30 3n0s n ASN 146 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 3n0s s GLN 147 N -5.86 4.25 0.52 3.52 0.74 -1.26 -4.89 119.66 116.69 3n0s s GLN 147 Ca 0.33 2.27 -0.17 0.00 0.05 0.00 0.00 55.36 57.84 3n0s s GLN 147 Cb -0.14 -3.18 -0.07 0.00 1.10 0.00 0.00 33.01 30.71 3n0s s GLN 147 CO 0.70 -0.55 1.00 -1.54 -0.55 0.00 0.00 175.29 174.34 3n0s s SER 148 N 1.11 6.48 -0.05 6.67 1.04 -1.13 -4.81 113.70 123.01 3n0s s SER 148 Ca 0.68 1.63 -0.25 0.00 0.48 0.00 0.00 55.95 58.49 3n0s s SER 148 Cb -0.42 -2.52 -0.19 0.00 0.10 0.00 0.00 66.02 62.99 3n0s s SER 148 CO 0.31 -0.69 1.05 0.25 0.98 0.00 0.00 173.24 175.15 3n0s h LEU 149 N 0.89 -0.08 -8.02 2.42 5.85 -1.94 -3.40 115.31 111.02 3n0s h LEU 149 Ca -0.47 -0.51 -0.41 0.00 0.84 0.00 0.00 57.88 57.34 3n0s h LEU 149 Cb 1.19 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 42.19 3n0s h LEU 149 CO 0.61 0.51 1.23 -0.44 -0.34 0.00 0.00 178.44 180.01 3n0s s SER 150 N -5.67 5.48 0.00 1.25 0.01 -1.26 -4.84 113.70 108.67 3n0s s SER 150 Ca -0.15 -1.58 0.00 0.00 1.31 0.00 0.00 55.95 55.52 3n0s s SER 150 Cb 0.01 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.66 3n0s s SER 150 CO 0.60 -2.56 0.00 -1.54 0.41 0.00 0.00 173.24 170.16 3n0s n SER 152 N 12.83 1.91 -1.40 2.44 3.41 -1.26 -4.92 113.62 126.62 3n0s n SER 152 Ca 0.44 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 59.01 3n0s n SER 152 Cb 0.47 0.20 0.24 0.00 -0.26 0.00 0.00 64.21 64.85 3n0s n SER 152 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3n0s n LEU 153 N -1.05 4.82 0.00 1.04 4.77 -1.26 -4.57 117.00 120.74 3n0s n LEU 153 Ca 0.00 -3.43 0.00 0.00 -0.03 0.00 0.00 56.01 52.55 3n0s n LEU 153 Cb 0.18 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 3n0s n LEU 153 CO 0.00 0.97 0.00 0.61 -1.33 0.00 0.00 177.39 177.64 3n0s n GLY 154 N -0.75 2.17 0.12 -0.72 0.00 -1.26 -4.14 105.19 100.61 3n0s n GLY 154 Ca 0.35 -1.81 0.12 0.00 0.00 0.00 0.00 46.02 44.69 3n0s n GLY 154 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3n0s n GLU 155 N 0.00 0.23 -0.92 1.61 -0.58 -1.26 -1.61 120.64 118.11 3n0s n GLU 155 Ca 0.00 0.34 -0.09 0.00 -0.42 0.00 0.00 57.16 56.99 3n0s n GLU 155 Cb 0.00 -1.85 0.20 0.00 -0.57 0.00 0.00 31.44 29.22 3n0s n GLU 155 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3n0s n GLU 156 N -2.26 2.06 -4.05 3.49 -0.58 -1.26 -4.81 120.64 113.22 3n0s n GLU 156 Ca 0.03 -3.13 -0.23 0.00 -0.42 0.00 0.00 57.16 53.42 3n0s n GLU 156 Cb 0.31 -1.93 -0.06 0.00 -0.57 0.00 0.00 31.44 29.19 3n0s n GLU 156 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3n0s s SER 157 N -2.13 4.76 0.44 1.62 1.04 -0.64 -2.86 113.70 115.93 3n0s s SER 157 Ca 0.48 -0.74 0.27 0.00 0.48 0.00 0.00 55.95 56.45 3n0s s SER 157 Cb 0.43 -0.76 1.34 0.00 0.10 0.00 0.00 66.02 67.13 3n0s s SER 157 CO 0.03 -0.31 1.69 -0.65 0.98 0.00 0.00 173.24 174.98 3n0s h PRO 158 N 1.50 0.17 -0.87 4.02 0.11 -1.86 -2.13 132.00 132.95 3n0s h PRO 158 Ca -0.44 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.69 3n0s h PRO 158 Cb 1.25 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 32.28 3n0s h PRO 158 CO 0.63 0.12 0.57 -0.07 -0.21 0.00 0.00 178.00 179.03 3n0s h LEU 159 N 0.18 0.96 -0.37 2.35 3.38 -1.89 -1.66 115.31 118.26 3n0s h LEU 159 Ca 0.73 -0.02 -0.19 0.00 0.09 0.00 0.00 57.88 58.50 3n0s h LEU 159 Cb 2.23 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 42.75 3n0s h LEU 159 CO -0.33 0.67 -0.66 -0.09 0.09 0.00 0.00 178.44 178.12 3n0s h ARG 160 N 1.12 0.61 -0.01 1.13 9.65 -1.57 -2.00 114.38 123.31 3n0s h ARG 160 Ca 0.34 -0.44 -0.11 0.00 -1.10 0.00 0.00 59.98 58.67 3n0s h ARG 160 Cb -0.03 0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.61 3n0s h ARG 160 CO -0.09 1.06 -0.50 0.87 2.80 0.00 0.00 179.97 184.11 3n0s h LYS 161 N 0.44 0.01 -0.28 0.20 1.57 -1.27 0.17 116.57 117.41 3n0s h LYS 161 Ca -0.02 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.69 3n0s h LYS 161 Cb 1.24 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.54 3n0s h LYS 161 CO 0.13 0.51 -0.08 0.82 -0.57 0.00 0.00 179.45 180.25 3n0s h ILE 162 N 0.01 1.29 -0.59 1.86 2.04 -1.23 -2.22 117.51 118.67 3n0s h ILE 162 Ca -0.00 -1.12 0.08 0.00 1.00 0.00 0.00 64.86 64.81 3n0s h ILE 162 Cb 0.88 1.45 -0.07 0.00 -0.74 0.00 0.00 36.82 38.34 3n0s h ILE 162 CO 0.07 0.36 0.24 0.22 0.00 0.00 0.00 178.15 179.03 3n0s h TYR 163 N 0.30 0.42 0.00 1.37 3.20 -0.78 -0.64 116.97 120.85 3n0s h TYR 163 Ca 0.07 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 3n0s h TYR 163 Cb 0.57 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.74 3n0s h TYR 163 CO 0.05 0.14 -0.11 -0.44 -1.64 0.00 0.00 178.16 176.16 3n0s h ASP 164 N 0.44 0.00 -0.25 -2.11 3.32 -0.49 -1.38 116.42 115.96 3n0s h ASP 164 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 3n0s h ASP 164 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 3n0s h ASP 164 CO -0.27 0.11 0.00 0.18 -1.72 0.00 0.00 179.24 177.54 3n0s n LEU 165 N -3.41 2.11 -3.88 1.55 4.77 -0.31 -4.93 117.00 112.90 3n0s n LEU 165 Ca -0.01 -0.91 -0.25 0.00 -0.03 0.00 0.00 56.01 54.80 3n0s n LEU 165 Cb 0.28 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 3n0s n LEU 165 CO 0.29 0.46 -0.12 -0.67 -1.33 0.00 0.00 177.39 176.02 3n0s n ASP 166 N 0.62 -1.30 -3.30 -1.43 2.03 -0.52 -4.93 116.55 107.72 3n0s n ASP 166 Ca 0.16 -0.92 -0.21 0.00 0.52 0.00 0.00 54.79 54.35 3n0s n ASP 166 Cb 0.39 -3.49 0.16 0.00 -0.72 0.00 0.00 41.12 37.47 3n0s n ASP 166 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3n0s n GLY 167 N -1.76 -2.04 3.42 0.27 0.00 -0.84 -4.84 105.19 99.40 3n0s n GLY 167 Ca -0.24 -1.59 -0.23 0.00 0.00 0.00 0.00 46.02 43.95 3n0s n GLY 167 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3n0s s TYR 168 N -2.74 2.14 -0.15 1.61 2.02 0.64 -1.05 117.35 119.82 3n0s s TYR 168 Ca 0.52 -0.39 0.01 0.00 -0.37 0.00 0.00 57.07 56.84 3n0s s TYR 168 Cb -0.03 -0.98 0.00 0.00 -0.40 0.00 0.00 41.96 40.55 3n0s s TYR 168 CO 0.38 0.57 -0.18 0.42 -1.57 0.00 0.00 175.55 175.17 3n0s s ILE 169 N -2.36 2.40 -0.22 2.71 1.01 -1.26 -1.37 121.20 122.11 3n0s s ILE 169 Ca 0.25 -0.86 -0.03 0.00 0.00 0.00 0.00 60.65 60.01 3n0s s ILE 169 Cb -0.05 -1.99 -0.00 0.00 0.01 0.00 0.00 42.46 40.42 3n0s s ILE 169 CO 0.12 0.53 -0.05 -0.22 0.00 0.00 0.00 174.94 175.32 3n0s s LEU 170 N 0.83 2.92 -0.22 2.97 2.96 -0.35 -4.05 118.68 123.74 3n0s s LEU 170 Ca -0.06 -0.48 -0.05 0.00 -0.22 0.00 0.00 54.13 53.32 3n0s s LEU 170 Cb -0.15 -1.72 -0.02 0.00 0.50 0.00 0.00 46.19 44.80 3n0s s LEU 170 CO -0.01 -0.04 -0.01 -0.76 -1.32 0.00 0.00 176.35 174.21 3n0s s LEU 171 N 1.45 3.11 -0.34 -0.68 1.43 0.18 -1.57 118.68 122.26 3n0s s LEU 171 Ca 0.05 -0.29 -0.03 0.00 -1.03 0.00 0.00 54.13 52.83 3n0s s LEU 171 Cb -0.15 -1.80 0.07 0.00 0.03 0.00 0.00 46.19 44.34 3n0s s LEU 171 CO -0.04 0.01 0.08 -0.63 0.23 0.00 0.00 176.35 176.00 3n0s s ILE 172 N 1.34 3.18 -1.59 -0.59 1.01 -0.02 -1.40 121.20 123.13 3n0s s ILE 172 Ca 0.04 -1.60 0.00 0.00 0.00 0.00 0.00 60.65 59.09 3n0s s ILE 172 Cb -0.15 -2.96 0.00 0.00 0.01 0.00 0.00 42.46 39.37 3n0s s ILE 172 CO -0.00 -0.32 0.00 0.61 0.00 0.00 0.00 174.94 175.23 3n0s n GLY 173 N 4.63 1.53 3.29 6.18 0.00 -0.64 -1.56 105.19 118.62 3n0s n GLY 173 Ca -0.09 -0.29 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 3n0s n GLY 173 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3n0s s VAL 174 N -2.54 1.11 0.13 1.61 -7.23 -1.26 -4.60 120.40 107.62 3n0s s VAL 174 Ca 0.00 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 58.14 3n0s s VAL 174 Cb 0.00 -2.11 0.02 0.00 0.56 0.00 0.00 36.38 34.85 3n0s s VAL 174 CO 0.00 -0.53 0.17 0.61 -0.31 0.00 0.00 175.10 175.04 3n0s n GLY 175 N -0.31 2.13 0.17 2.32 0.00 -1.26 -4.91 105.19 103.32 3n0s n GLY 175 Ca -0.07 -2.16 0.14 0.00 0.00 0.00 0.00 46.02 43.92 3n0s n GLY 175 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3n0s h TYR 176 N 0.12 0.00 0.00 1.61 0.05 -1.94 -1.82 116.97 114.99 3n0s h TYR 176 Ca -0.06 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.72 3n0s h TYR 176 Cb 0.29 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.03 3n0s h TYR 176 CO 0.00 0.00 0.00 -0.40 -1.05 0.00 0.00 178.16 176.71 3n0s n ASP 177 N -2.51 0.58 -0.96 3.88 5.75 -1.26 -1.12 116.55 120.91 3n0s n ASP 177 Ca 0.02 0.67 0.11 0.00 -0.01 0.00 0.00 54.79 55.58 3n0s n ASP 177 Cb 0.28 -0.78 0.26 0.00 -1.03 0.00 0.00 41.12 39.85 3n0s n ASP 177 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 3n0s n SER 178 N -2.17 2.87 -4.49 -1.12 7.64 -0.68 -4.84 113.62 110.82 3n0s n SER 178 Ca 0.01 -1.91 -0.43 0.00 1.01 0.00 0.00 58.87 57.55 3n0s n SER 178 Cb 0.18 -0.20 -0.02 0.00 -1.01 0.00 0.00 64.21 63.15 3n0s n SER 178 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 3n0s s ASN 179 N -1.50 6.67 0.35 6.43 3.84 -0.27 -4.83 114.94 125.62 3n0s s ASN 179 Ca 0.36 -2.03 0.07 0.00 0.21 0.00 0.00 52.86 51.47 3n0s s ASN 179 Cb 0.21 -2.46 0.76 0.00 -0.55 0.00 0.00 41.25 39.20 3n0s s ASN 179 CO 0.30 -1.15 1.92 0.74 -2.79 0.00 0.00 177.10 176.11 3n0s h THR 180 N 5.93 0.95 -1.21 -5.21 2.02 -1.88 -2.34 112.91 111.17 3n0s h THR 180 Ca 0.21 -0.26 0.34 0.00 0.77 0.00 0.00 66.41 67.48 3n0s h THR 180 Cb 0.99 0.13 -0.07 0.00 -1.74 0.00 0.00 68.15 67.46 3n0s h THR 180 CO 1.24 0.14 0.84 0.28 0.37 0.00 0.00 175.52 178.38 3n0s h SER 181 N 0.75 0.15 0.48 4.18 0.02 -1.97 -0.88 113.55 116.27 3n0s h SER 181 Ca 0.38 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 61.34 3n0s h SER 181 Cb 0.45 0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.00 3n0s h SER 181 CO -0.15 0.01 -0.10 0.58 -1.14 0.00 0.00 176.83 176.03 3n0s h VAL 182 N 0.12 0.42 -0.77 2.27 2.07 -1.80 -0.37 116.25 118.19 3n0s h VAL 182 Ca 0.62 -0.53 0.17 0.00 0.82 0.00 0.00 66.70 67.78 3n0s h VAL 182 Cb 2.17 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 33.27 3n0s h VAL 182 CO -0.13 0.10 0.52 0.00 0.02 0.00 0.00 177.57 178.09 3n0s h ALA 183 N 1.90 2.23 -0.50 1.67 0.00 -1.35 -1.14 119.26 122.07 3n0s h ALA 183 Ca -0.00 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3n0s h ALA 183 Cb 0.37 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3n0s h ALA 183 CO 0.01 -0.46 0.11 1.25 0.00 0.00 0.00 179.25 180.17 3n0s h LEU 184 N 0.33 0.71 -0.78 0.00 5.85 -1.21 -0.94 115.31 119.28 3n0s h LEU 184 Ca 0.38 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 3n0s h LEU 184 Cb 1.01 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.82 3n0s h LEU 184 CO -0.11 0.71 0.40 0.28 -0.34 0.00 0.00 178.44 179.37 3n0s h SER 185 N 0.74 1.00 -0.30 1.25 0.02 -1.32 -1.31 113.55 113.63 3n0s h SER 185 Ca 0.16 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 3n0s h SER 185 Cb 0.28 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 3n0s h SER 185 CO -0.00 0.83 0.15 -0.33 -1.14 0.00 0.00 176.83 176.34 3n0s h GLU 186 N 1.09 0.43 -0.46 3.45 5.08 -1.06 -2.06 114.58 121.05 3n0s h GLU 186 Ca 0.27 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.60 3n0s h GLU 186 Cb 0.08 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 3n0s h GLU 186 CO -0.04 0.39 0.25 0.28 -1.00 0.00 0.00 179.01 178.90 3n0s h VAL 187 N 0.36 1.00 0.00 3.13 2.07 -1.00 -2.51 116.25 119.30 3n0s h VAL 187 Ca 0.11 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.45 3n0s h VAL 187 Cb 0.10 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 3n0s h VAL 187 CO -0.01 0.09 0.00 0.54 0.02 0.00 0.00 177.57 178.21 3n0s n ARG 188 N -4.87 0.19 -0.01 1.57 1.74 -0.51 -3.26 116.66 111.52 3n0s n ARG 188 Ca 0.03 0.38 0.08 0.00 -0.77 0.00 0.00 57.85 57.56 3n0s n ARG 188 Cb 0.09 -1.83 -0.11 0.00 -1.02 0.00 0.00 32.46 29.59 3n0s n ARG 188 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3n0s n SER 189 N -2.18 1.16 0.00 0.55 3.41 -0.79 -5.00 113.62 110.77 3n0s n SER 189 Ca 0.03 -0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.37 3n0s n SER 189 Cb 0.25 1.51 0.00 0.00 -0.26 0.00 0.00 64.21 65.71 3n0s n SER 189 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3n0s n GLY 190 N 1.52 0.54 0.40 5.00 0.00 -0.97 -4.92 105.19 106.77 3n0s n GLY 190 Ca -0.01 -0.66 0.14 0.00 0.00 0.00 0.00 46.02 45.48 3n0s n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n0s n ALA 191 N 0.34 2.59 -2.32 4.61 0.00 -1.09 -4.75 120.51 119.88 3n0s n ALA 191 Ca 0.00 -0.41 -0.17 0.00 0.00 0.00 0.00 53.44 52.86 3n0s n ALA 191 Cb 0.00 -1.22 -0.10 0.00 0.00 0.00 0.00 19.45 18.13 3n0s n ALA 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3n0s s GLU 193 N -3.72 3.21 0.17 0.00 2.02 -1.26 -4.86 118.70 114.26 3n0s s GLU 193 Ca 0.22 1.30 -0.17 0.00 0.02 0.00 0.00 54.97 56.34 3n0s s GLU 193 Cb 0.02 -2.01 -0.07 0.00 0.10 0.00 0.00 34.13 32.16 3n0s s GLU 193 CO 0.06 -0.91 0.62 -0.51 0.02 0.00 0.00 175.26 174.54 3n0s s LEU 194 N -4.47 4.36 0.16 1.80 1.43 -1.26 -1.13 118.68 119.57 3n0s s LEU 194 Ca 0.65 1.22 0.07 0.00 -1.03 0.00 0.00 54.13 55.05 3n0s s LEU 194 Cb -0.18 -3.34 -0.04 0.00 0.03 0.00 0.00 46.19 42.66 3n0s s LEU 194 CO 0.36 0.10 -0.14 0.27 0.23 0.00 0.00 176.35 177.17 3n0s s ILE 195 N -1.44 1.54 -0.35 -0.59 -4.36 0.13 -4.83 121.20 111.30 3n0s s ILE 195 Ca 0.39 -1.97 -0.22 0.00 -0.26 0.00 0.00 60.65 58.59 3n0s s ILE 195 Cb -0.16 -1.81 0.01 0.00 1.25 0.00 0.00 42.46 41.75 3n0s s ILE 195 CO 0.20 -0.50 0.73 -0.54 0.24 0.00 0.00 174.94 175.07 3n0s s LYS 196 N -3.16 3.75 0.44 0.37 1.02 -1.26 -1.28 119.74 119.62 3n0s s LYS 196 Ca 0.16 0.25 0.05 0.00 0.02 0.00 0.00 55.97 56.45 3n0s s LYS 196 Cb -0.03 -3.80 -0.06 0.00 -0.52 0.00 0.00 37.83 33.43 3n0s s LYS 196 CO 0.05 -0.79 0.01 0.14 -0.92 0.00 0.00 175.35 173.84 3n0s s VAL 197 N 2.94 1.73 0.14 3.17 -7.23 0.33 -4.98 120.40 116.51 3n0s s VAL 197 Ca 0.29 -1.99 -0.13 0.00 -1.81 0.00 0.00 61.98 58.33 3n0s s VAL 197 Cb -0.14 -2.72 0.02 0.00 0.56 0.00 0.00 36.38 34.10 3n0s s VAL 197 CO 0.16 0.00 0.36 -0.83 -0.31 0.00 0.00 175.10 174.48 3n0s s GLY 198 N -3.77 0.00 -0.02 2.32 0.00 -1.26 -1.05 107.32 103.54 3n0s s GLY 198 Ca 0.26 -0.38 -0.29 0.00 0.00 0.00 0.00 44.72 44.31 3n0s s GLY 198 CO 0.13 -0.51 0.78 0.00 0.00 0.00 0.00 173.10 173.51 3n0s s ALA 199 N -3.87 -1.78 -0.05 3.20 0.00 -0.21 -3.00 121.76 116.04 3n0s s ALA 199 Ca 0.08 1.13 -0.23 0.00 0.00 0.00 0.00 51.96 52.95 3n0s s ALA 199 Cb 0.02 0.12 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 3n0s s ALA 199 CO -0.07 -0.51 0.67 -1.25 0.00 0.00 0.00 175.76 174.59 3n0s s PRO 200 N -2.16 4.41 0.16 0.00 0.04 -1.26 -0.77 135.00 135.42 3n0s s PRO 200 Ca -0.03 0.83 0.01 0.00 0.04 0.00 0.00 61.00 61.85 3n0s s PRO 200 Cb -0.01 -3.42 -0.04 0.00 0.04 0.00 0.00 34.50 31.07 3n0s s PRO 200 CO -0.01 0.14 0.01 0.96 0.04 0.00 0.00 177.00 178.13 3n0s s ILE 201 N 0.56 0.54 -0.33 0.56 -4.36 -0.61 -1.92 121.20 115.65 3n0s s ILE 201 Ca 0.35 -1.96 -0.19 0.00 -0.26 0.00 0.00 60.65 58.59 3n0s s ILE 201 Cb -0.18 -2.06 -0.01 0.00 1.25 0.00 0.00 42.46 41.47 3n0s s ILE 201 CO 0.18 -0.51 0.59 -0.63 0.24 0.00 0.00 174.94 174.80 3n0s s ILE 202 N -3.74 4.96 -0.15 8.37 -1.09 -1.26 -1.12 121.20 127.17 3n0s s ILE 202 Ca 0.23 0.64 0.01 0.00 -2.23 0.00 0.00 60.65 59.30 3n0s s ILE 202 Cb 0.06 -3.99 0.02 0.00 -1.58 0.00 0.00 42.46 36.97 3n0s s ILE 202 CO 0.02 -0.19 -0.18 -0.70 -1.23 0.00 0.00 174.94 172.67 3n0s s GLU 203 N 2.55 2.63 -1.66 2.79 2.12 0.13 -4.69 118.70 122.56 3n0s s GLU 203 Ca 0.23 -0.70 -0.15 0.00 0.36 0.00 0.00 54.97 54.71 3n0s s GLU 203 Cb -0.15 -2.26 0.13 0.00 0.26 0.00 0.00 34.13 32.11 3n0s s GLU 203 CO 0.13 -0.15 0.70 0.09 -0.54 0.00 0.00 175.26 175.49 3n0s n ASN 204 N 4.47 -2.70 0.00 -1.70 3.02 -1.26 -0.86 115.26 116.23 3n0s n ASN 204 Ca -0.19 -1.03 0.00 0.00 -0.03 0.00 0.00 54.58 53.33 3n0s n ASN 204 Cb 0.51 -2.74 0.00 0.00 -0.61 0.00 0.00 39.78 36.94 3n0s n ASN 204 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3n0s n GLY 205 N -1.52 0.89 3.25 7.41 0.00 -1.26 -5.03 105.19 108.93 3n0s n GLY 205 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 3n0s n GLY 205 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3n0s s GLU 206 N -0.12 2.50 0.14 1.61 2.56 -0.04 -5.08 118.70 120.27 3n0s s GLU 206 Ca 0.00 -0.88 -0.31 0.00 0.00 0.00 0.00 54.97 53.78 3n0s s GLU 206 Cb 0.00 -2.11 -0.09 0.00 2.00 0.00 0.00 34.13 33.93 3n0s s GLU 206 CO 0.00 0.36 1.48 0.50 -0.56 0.00 0.00 175.26 177.04 3n0s s ARG 207 N -0.12 4.27 0.01 4.30 3.52 -1.26 0.19 118.95 129.86 3n0s s ARG 207 Ca -0.04 2.22 0.01 0.00 -0.13 0.00 0.00 55.73 57.78 3n0s s ARG 207 Cb -0.14 -3.22 -0.01 0.00 -1.56 0.00 0.00 34.95 30.03 3n0s s ARG 207 CO 0.04 -0.53 -0.03 0.14 -0.81 0.00 0.00 175.30 174.11 3n0s s VAL 208 N 1.18 0.19 -0.69 7.11 -7.23 -0.27 -4.90 120.40 115.79 3n0s s VAL 208 Ca 0.67 -0.45 -0.23 0.00 -1.81 0.00 0.00 61.98 60.17 3n0s s VAL 208 Cb -0.40 -0.23 0.07 0.00 0.56 0.00 0.00 36.38 36.38 3n0s s VAL 208 CO 0.31 -0.17 1.02 0.86 -0.31 0.00 0.00 175.10 176.80 3n0s s TRP 209 N -0.62 2.65 0.06 2.82 -0.11 -1.26 -1.57 118.94 120.91 3n0s s TRP 209 Ca -0.05 -0.55 -0.17 0.00 1.22 0.00 0.00 56.10 56.54 3n0s s TRP 209 Cb -0.05 -4.34 -0.06 0.00 -1.50 0.00 0.00 33.47 27.52 3n0s s TRP 209 CO -0.00 -1.69 0.52 0.21 -4.62 0.00 0.00 176.95 171.36 3n0s s LYS 210 N 4.19 4.09 0.05 5.86 2.47 0.05 -4.87 119.74 131.58 3n0s s LYS 210 Ca 0.24 0.61 0.04 0.00 -1.56 0.00 0.00 55.97 55.31 3n0s s LYS 210 Cb -0.15 -3.20 -0.04 0.00 -1.46 0.00 0.00 37.83 32.98 3n0s s LYS 210 CO 0.09 0.64 -0.04 -1.21 0.16 0.00 0.00 175.35 174.99 3n0s s GLU 211 N -1.19 2.51 0.03 4.03 2.02 -1.26 -1.05 118.70 123.79 3n0s s GLU 211 Ca 0.28 -0.80 -0.01 0.00 0.02 0.00 0.00 54.97 54.46 3n0s s GLU 211 Cb -0.18 -2.51 0.01 0.00 0.10 0.00 0.00 34.13 31.55 3n0s s GLU 211 CO 0.17 0.57 0.07 1.97 0.02 0.00 0.00 175.26 178.06 3n0s n PHE 212 N 1.04 -1.01 -4.60 1.61 1.16 -0.21 -4.98 117.46 110.46 3n0s n PHE 212 Ca -0.13 -0.15 -0.28 0.00 -1.87 0.00 0.00 57.45 55.02 3n0s n PHE 212 Cb 0.52 0.07 -0.17 0.00 -1.61 0.00 0.00 39.48 38.30 3n0s n PHE 212 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 3n0s s VAL 213 N -2.84 1.50 0.00 1.97 1.01 -1.26 -0.51 120.40 120.28 3n0s s VAL 213 Ca 0.01 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.33 3n0s s VAL 213 Cb -0.00 -1.36 0.00 0.00 0.00 0.00 0.00 36.38 35.02 3n0s s VAL 213 CO 0.01 0.44 0.00 -0.67 0.00 0.00 0.00 175.10 174.88 3n0s n ASP 214 N 4.01 0.00 -3.42 3.32 -0.08 -0.41 -4.39 116.55 115.58 3n0s n ASP 214 Ca -0.20 0.00 -0.26 0.00 -1.51 0.00 0.00 54.79 52.82 3n0s n ASP 214 Cb 0.52 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.89 3n0s n ASP 214 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 3n0s n ASP 216 N 0.00 2.13 -4.74 1.67 2.03 -0.28 0.21 116.55 117.57 3n0s n ASP 216 Ca 0.00 -3.07 -0.42 0.00 0.52 0.00 0.00 54.79 51.82 3n0s n ASP 216 Cb 0.00 -0.66 -0.02 0.00 -0.72 0.00 0.00 41.12 39.72 3n0s n ASP 216 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 3n0s s TYR 217 N -1.67 2.78 -0.33 -0.67 1.51 -1.26 -4.68 117.35 113.04 3n0s s TYR 217 Ca 0.35 0.65 0.04 0.00 -1.01 0.00 0.00 57.07 57.10 3n0s s TYR 217 Cb 0.11 -4.10 0.09 0.00 -0.11 0.00 0.00 41.96 37.96 3n0s s TYR 217 CO -0.09 -3.83 0.03 0.34 -1.11 0.00 0.00 175.55 170.89 3n0s s ASP 218 N 0.69 4.67 0.04 2.29 2.15 -1.26 -4.97 116.67 120.27 3n0s s ASP 218 Ca 0.67 -2.01 0.21 0.00 0.43 0.00 0.00 52.55 51.84 3n0s s ASP 218 Cb -0.49 -1.57 0.88 0.00 -0.30 0.00 0.00 42.92 41.45 3n0s s ASP 218 CO 0.44 -0.35 1.67 -1.54 -0.17 0.00 0.00 175.17 175.21 3n0s n SER 219 N 4.32 0.11 -0.25 -0.34 3.41 -1.26 -3.34 113.62 116.27 3n0s n SER 219 Ca 0.01 0.52 -0.06 0.00 -0.26 0.00 0.00 58.87 59.08 3n0s n SER 219 Cb 0.42 -0.55 0.05 0.00 -0.26 0.00 0.00 64.21 63.87 3n0s n SER 219 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 3n0s h ASP 220 N 0.00 0.86 0.64 4.04 3.58 -1.93 0.37 116.42 123.98 3n0s h ASP 220 Ca 0.00 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.36 3n0s h ASP 220 Cb 0.38 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.21 3n0s h ASP 220 CO 0.00 0.70 0.00 0.11 -2.88 0.00 0.00 179.24 177.17 3n0s h LYS 221 N 0.95 0.00 -0.19 0.28 1.57 -2.00 -3.24 116.57 113.93 3n0s h LYS 221 Ca 0.24 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.94 3n0s h LYS 221 Cb 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 3n0s h LYS 221 CO -0.04 0.00 -0.23 0.74 -0.57 0.00 0.00 179.45 179.35 3n0s h PHE 222 N 0.00 0.37 -0.49 -1.35 -1.00 -1.10 -1.19 116.94 112.18 3n0s h PHE 222 Ca 0.00 -0.07 -0.06 0.00 2.81 0.00 0.00 57.97 60.65 3n0s h PHE 222 Cb 0.32 -0.09 -0.02 0.00 3.61 0.00 0.00 35.95 39.77 3n0s h PHE 222 CO 0.00 0.55 0.04 0.28 -1.61 0.00 0.00 178.31 177.57 3n0s h VAL 223 N 0.30 1.23 -0.16 -0.55 2.07 -1.66 0.10 116.25 117.59 3n0s h VAL 223 Ca 0.05 -0.92 -0.04 0.00 0.82 0.00 0.00 66.70 66.61 3n0s h VAL 223 Cb 0.58 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 3n0s h VAL 223 CO 0.04 0.33 -0.04 -0.08 0.02 0.00 0.00 177.57 177.84 3n0s h GLU 224 N 0.74 0.31 -1.00 1.57 4.81 -1.48 -1.02 114.58 118.51 3n0s h GLU 224 Ca 0.15 -0.12 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 3n0s h GLU 224 Cb 0.39 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.69 3n0s h GLU 224 CO 0.01 0.59 0.65 0.82 -0.73 0.00 0.00 179.01 180.35 3n0s h ILE 225 N 0.01 1.11 -0.50 2.32 2.04 -1.07 -2.73 117.51 118.70 3n0s h ILE 225 Ca 0.04 -0.41 -0.04 0.00 1.00 0.00 0.00 64.86 65.45 3n0s h ILE 225 Cb 0.47 -0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 36.34 3n0s h ILE 225 CO 0.02 0.22 0.15 1.23 0.00 0.00 0.00 178.15 179.77 3n0s h GLY 226 N 1.20 0.83 0.97 5.37 0.00 -0.40 0.21 103.07 111.25 3n0s h GLY 226 Ca 0.42 -0.50 0.00 0.00 0.00 0.00 0.00 47.33 47.26 3n0s h GLY 226 CO -0.16 0.46 0.05 -2.08 0.00 0.00 0.00 176.54 174.81 3n0s h VAL 227 N 0.67 1.00 -0.30 4.60 2.07 -1.07 -1.97 116.25 121.26 3n0s h VAL 227 Ca 0.16 -0.04 -0.11 0.00 0.82 0.00 0.00 66.70 67.53 3n0s h VAL 227 Cb 0.28 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3n0s h VAL 227 CO -0.00 0.02 -0.27 -0.33 0.02 0.00 0.00 177.57 177.01 3n0s h GLU 228 N 0.11 0.59 -0.33 1.57 5.08 -1.32 -2.80 114.58 117.49 3n0s h GLU 228 Ca 0.04 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.11 3n0s h GLU 228 Cb 0.00 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 3n0s h GLU 228 CO -0.02 0.80 0.02 0.35 -1.00 0.00 0.00 179.01 179.16 3n0s h PHE 229 N 0.52 0.51 0.00 4.33 3.57 -0.34 -2.49 116.94 123.04 3n0s h PHE 229 Ca 0.07 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 3n0s h PHE 229 Cb 0.73 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.31 3n0s h PHE 229 CO 0.03 0.49 -0.21 0.93 -2.23 0.00 0.00 178.31 177.33 3n0s h GLU 230 N 0.48 0.00 0.00 1.11 5.08 -1.11 0.78 114.58 120.93 3n0s h GLU 230 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 3n0s h GLU 230 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3n0s h GLU 230 CO 0.01 0.21 -0.09 1.04 -1.00 0.00 0.00 179.01 179.17 3n0s n GLN 231 N -3.25 0.19 0.00 2.33 6.02 -0.97 -4.57 117.38 117.13 3n0s n GLN 231 Ca 0.01 0.14 0.00 0.00 -0.01 0.00 0.00 57.00 57.14 3n0s n GLN 231 Cb 0.50 -1.70 0.00 0.00 1.02 0.00 0.00 30.24 30.05 3n0s n GLN 231 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3n0s n LYS 232 N -2.03 2.35 -4.37 -1.09 5.02 -0.98 -5.11 118.16 111.95 3n0s n LYS 232 Ca 0.06 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 56.05 3n0s n LYS 232 Cb 0.41 -0.24 -0.05 0.00 -0.02 0.00 0.00 35.03 35.13 3n0s n LYS 232 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3n0s s GLY 233 N -0.28 2.72 -0.36 0.72 0.00 0.27 -5.05 107.32 105.35 3n0s s GLY 233 Ca 0.00 -0.83 -0.18 0.00 0.00 0.00 0.00 44.72 43.71 3n0s s GLY 233 CO 0.00 -2.08 0.51 -1.59 0.00 0.00 0.00 173.10 169.94 3n0s s THR 234 N -2.82 5.02 -0.09 0.90 2.01 -1.26 -4.79 115.64 114.61 3n0s s THR 234 Ca 0.19 0.29 -0.11 0.00 0.31 0.00 0.00 61.69 62.37 3n0s s THR 234 Cb 0.00 -3.97 0.03 0.00 0.01 0.00 0.00 72.50 68.57 3n0s s THR 234 CO 0.11 -0.23 0.29 0.54 -0.69 0.00 0.00 174.62 174.64 3n0s s VAL 235 N 2.37 0.01 0.37 3.82 0.11 -1.26 -4.51 120.40 121.31 3n0s s VAL 235 Ca 0.18 -0.09 0.05 0.00 -2.93 0.00 0.00 61.98 59.19 3n0s s VAL 235 Cb -0.16 -0.44 0.06 0.00 -1.53 0.00 0.00 36.38 34.32 3n0s s VAL 235 CO 0.13 -0.05 0.51 0.41 -3.33 0.00 0.00 175.10 172.78 3n0s n THR 236 N 2.65 0.00 -0.75 5.04 -1.04 -0.19 -4.97 114.28 115.02 3n0s n THR 236 Ca -0.14 -1.18 0.00 0.00 -2.04 0.00 0.00 64.05 60.68 3n0s n THR 236 Cb 0.58 -0.74 0.00 0.00 -1.82 0.00 0.00 70.33 68.35 3n0s n THR 236 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3n0s n GLY 238 N 0.55 0.58 3.07 3.41 0.00 -0.92 -1.33 105.19 110.55 3n0s n GLY 238 Ca 0.10 -1.63 -0.20 0.00 0.00 0.00 0.00 46.02 44.29 3n0s n GLY 238 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n0s s LYS 239 N -2.00 0.93 -0.33 1.61 -0.14 -1.26 -0.42 119.74 118.13 3n0s s LYS 239 Ca 0.00 -0.45 0.01 0.00 -1.36 0.00 0.00 55.97 54.17 3n0s s LYS 239 Cb 0.00 -0.90 0.08 0.00 -1.68 0.00 0.00 37.83 35.33 3n0s s LYS 239 CO 0.00 0.24 0.05 0.42 -0.76 0.00 0.00 175.35 175.30 3n0s s ILE 240 N -0.34 2.66 0.00 2.17 -1.09 -0.99 -4.84 121.20 118.77 3n0s s ILE 240 Ca 0.04 -1.94 0.00 0.00 -2.23 0.00 0.00 60.65 56.52 3n0s s ILE 240 Cb -0.05 -2.76 0.00 0.00 -1.58 0.00 0.00 42.46 38.07 3n0s s ILE 240 CO -0.00 -0.41 0.00 0.61 -1.23 0.00 0.00 174.94 173.90 3n0s n GLY 241 N 4.45 2.21 0.21 6.18 0.00 -1.26 -1.70 105.19 115.28 3n0s n GLY 241 Ca -0.05 -0.36 0.14 0.00 0.00 0.00 0.00 46.02 45.76 3n0s n GLY 241 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3n0s n ASN 242 N 5.65 0.72 -4.73 1.61 3.02 0.91 -4.94 115.26 117.51 3n0s n ASN 242 Ca 0.00 -1.00 -0.41 0.00 -0.03 0.00 0.00 54.58 53.14 3n0s n ASN 242 Cb 0.00 -0.02 -0.04 0.00 -0.61 0.00 0.00 39.78 39.11 3n0s n ASN 242 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3n0s s ALA 243 N -2.20 3.25 -0.24 5.41 0.00 -0.69 -4.89 121.76 122.41 3n0s s ALA 243 Ca 0.36 0.50 -0.24 0.00 0.00 0.00 0.00 51.96 52.59 3n0s s ALA 243 Cb 0.21 -3.23 -0.01 0.00 0.00 0.00 0.00 23.12 20.09 3n0s s ALA 243 CO 0.41 -0.05 0.81 0.21 0.00 0.00 0.00 175.76 177.13 3n0s s LYS 244 N 0.19 4.18 0.15 0.00 2.36 -1.26 -2.35 119.74 123.01 3n0s s LYS 244 Ca 0.46 0.91 0.09 0.00 -2.55 0.00 0.00 55.97 54.88 3n0s s LYS 244 Cb -0.22 -3.64 -0.04 0.00 -1.05 0.00 0.00 37.83 32.88 3n0s s LYS 244 CO 0.28 -0.49 -0.21 0.00 1.55 0.00 0.00 175.35 176.48 3n0s s ARG 246 N -2.46 1.14 0.15 0.00 0.52 -0.49 -2.18 118.95 115.63 3n0s s ARG 246 Ca 0.14 -0.45 0.09 0.00 -0.52 0.00 0.00 55.73 54.98 3n0s s ARG 246 Cb -0.08 -1.08 -0.04 0.00 0.52 0.00 0.00 34.95 34.28 3n0s s ARG 246 CO 0.07 0.24 -0.20 -1.17 0.02 0.00 0.00 175.30 174.26 3n0s s LEU 247 N -0.15 2.39 -0.15 2.53 2.96 -0.44 -0.64 118.68 125.17 3n0s s LEU 247 Ca 0.02 -0.80 -0.10 0.00 -0.22 0.00 0.00 54.13 53.04 3n0s s LEU 247 Cb -0.07 -0.89 -0.05 0.00 0.50 0.00 0.00 46.19 45.69 3n0s s LEU 247 CO 0.00 0.02 0.17 -0.54 -1.32 0.00 0.00 176.35 174.68 3n0s s LYS 249 N -2.46 3.88 0.29 1.98 -0.14 -1.26 -1.02 119.74 121.01 3n0s s LYS 249 Ca 0.13 -0.11 -0.02 0.00 -1.36 0.00 0.00 55.97 54.61 3n0s s LYS 249 Cb -0.07 -3.32 0.43 0.00 -1.68 0.00 0.00 37.83 33.19 3n0s s LYS 249 CO 0.06 0.51 1.94 0.37 -0.76 0.00 0.00 175.35 177.47 3n0s h GLN 250 N 5.88 1.12 -0.32 1.68 4.15 -1.39 -2.32 115.11 123.92 3n0s h GLN 250 Ca -0.47 -0.07 -0.10 0.00 0.77 0.00 0.00 58.65 58.79 3n0s h GLN 250 Cb 1.19 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 28.61 3n0s h GLN 250 CO 0.68 0.74 -0.20 0.00 -1.93 0.00 0.00 178.83 178.12 3n0s h ARG 251 N 1.15 0.59 -0.07 1.69 3.08 -1.91 0.31 114.38 119.22 3n0s h ARG 251 Ca 0.35 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 3n0s h ARG 251 Cb -0.03 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 29.98 3n0s h ARG 251 CO -0.10 0.76 0.02 -0.44 -1.07 0.00 0.00 179.97 179.15 3n0s h ASP 252 N 0.53 0.10 -0.19 7.04 3.32 -1.81 -0.76 116.42 124.65 3n0s h ASP 252 Ca 0.08 -0.19 -0.18 0.00 0.02 0.00 0.00 57.03 56.76 3n0s h ASP 252 Cb 0.64 -0.03 0.01 0.00 0.22 0.00 0.00 39.33 40.17 3n0s h ASP 252 CO 0.05 0.26 -0.60 -0.29 -1.72 0.00 0.00 179.24 176.94 3n0s h ILE 253 N -0.07 1.30 -0.32 0.35 6.09 -1.35 -1.96 117.51 121.55 3n0s h ILE 253 Ca 0.02 -1.82 0.05 0.00 -1.37 0.00 0.00 64.86 61.75 3n0s h ILE 253 Cb 0.20 1.91 -0.05 0.00 0.47 0.00 0.00 36.82 39.35 3n0s h ILE 253 CO -0.00 0.57 0.01 0.58 -3.07 0.00 0.00 178.15 176.24 3n0s h VAL 254 N 0.46 0.78 -0.40 2.19 2.07 -0.94 0.95 116.25 121.35 3n0s h VAL 254 Ca -0.02 -0.04 -0.14 0.00 0.82 0.00 0.00 66.70 67.32 3n0s h VAL 254 Cb 1.23 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 3n0s h VAL 254 CO 0.13 0.02 -0.31 0.44 0.02 0.00 0.00 177.57 177.86 3n0s h ASP 255 N 0.10 0.97 -0.89 0.57 3.32 -1.15 -1.28 116.42 118.06 3n0s h ASP 255 Ca 0.15 -0.44 -0.01 0.00 0.02 0.00 0.00 57.03 56.75 3n0s h ASP 255 Cb 0.20 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.44 3n0s h ASP 255 CO -0.25 1.21 0.50 0.15 -1.72 0.00 0.00 179.24 179.13 3n0s h PHE 256 N 0.74 1.21 -0.39 4.55 3.57 -1.20 -2.05 116.94 123.37 3n0s h PHE 256 Ca 0.07 -0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.44 3n0s h PHE 256 Cb 0.90 -0.39 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 3n0s h PHE 256 CO 0.06 0.83 -0.22 0.78 -2.23 0.00 0.00 178.31 177.53 3n0s h GLY 257 N 1.24 0.84 0.80 2.40 0.00 -0.33 -0.87 103.07 107.15 3n0s h GLY 257 Ca 0.31 -0.71 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 3n0s h GLY 257 CO -0.05 0.65 -0.06 -0.84 0.00 0.00 0.00 176.54 176.24 3n0s h THR 258 N 0.68 0.99 -0.84 4.70 2.02 -0.94 -1.93 112.91 117.58 3n0s h THR 258 Ca 0.09 -0.44 0.11 0.00 0.77 0.00 0.00 66.41 66.95 3n0s h THR 258 Cb 0.73 1.26 -0.06 0.00 -1.74 0.00 0.00 68.15 68.34 3n0s h THR 258 CO 0.06 0.11 0.55 -0.08 0.37 0.00 0.00 175.52 176.52 3n0s h GLU 259 N -0.37 0.74 -0.26 6.66 4.57 -1.30 -2.86 114.58 121.75 3n0s h GLU 259 Ca -0.02 -0.04 -0.09 0.00 -1.18 0.00 0.00 59.36 58.03 3n0s h GLU 259 Cb 0.30 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.72 3n0s h GLU 259 CO 0.03 0.49 -0.20 2.35 -1.18 0.00 0.00 179.01 180.49 3n0s h TRP 260 N 0.76 0.71 -0.24 0.92 7.01 -0.69 -2.93 115.95 121.48 3n0s h TRP 260 Ca 0.40 -0.20 0.07 0.00 2.11 0.00 0.00 58.89 61.27 3n0s h TRP 260 Cb 0.51 -0.16 -0.01 0.00 -2.10 0.00 0.00 29.16 27.40 3n0s h TRP 260 CO -0.00 0.89 0.21 0.74 -2.79 0.00 0.00 178.44 177.48 3n0s h PHE 261 N 0.33 0.00 -2.45 2.65 0.04 -1.14 -3.29 116.94 113.08 3n0s h PHE 261 Ca 0.05 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 60.22 3n0s h PHE 261 Cb 0.74 0.00 -0.41 0.00 2.20 0.00 0.00 35.95 38.49 3n0s h PHE 261 CO 0.07 0.00 -0.77 2.89 -0.60 0.00 0.00 178.31 179.90 3n0s n ARG 262 N -4.11 1.48 0.00 1.51 1.85 -1.11 -4.97 116.66 111.31 3n0s n ARG 262 Ca 0.03 -4.02 0.00 0.00 -1.00 0.00 0.00 57.85 52.86 3n0s n ARG 262 Cb 0.35 -1.93 0.00 0.00 -1.05 0.00 0.00 32.46 29.82 3n0s n ARG 262 CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 177.63 178.79