#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n5d s VAL 2 N 0.00 2.75 0.14 2.53 -7.23 -0.58 -5.03 120.40 112.99 3n5d s VAL 2 Ca 0.00 -2.24 0.03 0.00 -1.81 0.00 0.00 61.98 57.96 3n5d s VAL 2 Cb 0.00 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.40 3n5d s VAL 2 CO 0.00 -0.37 -0.07 -0.44 -0.31 0.00 0.00 175.10 173.91 3n5d s SER 3 N -3.57 1.50 -0.28 4.85 0.01 -1.26 0.02 113.70 114.97 3n5d s SER 3 Ca 0.31 -1.05 -0.17 0.00 1.31 0.00 0.00 55.95 56.34 3n5d s SER 3 Cb -0.05 0.05 0.08 0.00 0.21 0.00 0.00 66.02 66.31 3n5d s SER 3 CO 0.17 -0.43 0.71 0.12 0.41 0.00 0.00 173.24 174.22 3n5d s PHE 4 N -3.48 -1.00 -0.18 2.43 5.36 -0.44 -4.77 117.98 115.90 3n5d s PHE 4 Ca 0.17 2.05 0.00 0.00 -0.96 0.00 0.00 56.93 58.19 3n5d s PHE 4 Cb 0.04 0.58 0.01 0.00 -0.34 0.00 0.00 43.02 43.31 3n5d s PHE 4 CO 0.00 -0.49 -0.17 1.03 -1.46 0.00 0.00 175.22 174.13 3n5d s ARG 5 N 1.46 3.11 0.49 10.12 0.52 -1.26 -1.73 118.95 131.66 3n5d s ARG 5 Ca -0.09 -0.78 0.28 0.00 -0.52 0.00 0.00 55.73 54.63 3n5d s ARG 5 Cb -0.05 -2.64 0.97 0.00 0.52 0.00 0.00 34.95 33.75 3n5d s ARG 5 CO -0.17 -0.14 1.84 -0.07 0.02 0.00 0.00 175.30 176.78 3n5d h LEU 6 N 7.77 0.00 -8.93 2.53 -0.00 -1.57 -3.33 115.31 111.77 3n5d h LEU 6 Ca -0.41 0.00 -0.57 0.00 -0.00 0.00 0.00 57.88 56.90 3n5d h LEU 6 Cb 1.16 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.79 3n5d h LEU 6 CO 0.61 0.06 1.15 -0.55 -0.00 0.00 0.00 178.44 179.70 3n5d s SER 7 N -5.95 6.25 0.00 -0.43 0.15 -1.26 -1.71 113.70 110.75 3n5d s SER 7 Ca 0.03 1.35 0.00 0.00 0.70 0.00 0.00 55.95 58.02 3n5d s SER 7 Cb 0.08 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.86 3n5d s SER 7 CO 0.60 -1.41 0.00 0.61 1.20 0.00 0.00 173.24 174.24 3n5d n GLY 8 N 4.94 0.92 3.53 9.45 0.00 -1.26 -5.01 105.19 117.75 3n5d n GLY 8 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 3n5d n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n5d n ALA 9 N 0.95 -0.78 -2.99 4.61 0.00 -0.70 -4.98 120.51 116.63 3n5d n ALA 9 Ca 0.00 0.24 -0.11 0.00 0.00 0.00 0.00 53.44 53.57 3n5d n ALA 9 Cb 0.00 -1.91 -0.05 0.00 0.00 0.00 0.00 19.45 17.49 3n5d n ALA 9 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 3n5d s ASP 10 N -0.82 0.28 0.58 0.00 -4.77 -1.26 -5.02 116.67 105.66 3n5d s ASP 10 Ca 0.63 -1.18 0.29 0.00 -3.30 0.00 0.00 52.55 48.98 3n5d s ASP 10 Cb -0.62 0.60 1.48 0.00 -1.09 0.00 0.00 42.92 43.29 3n5d s ASP 10 CO 0.58 -1.18 1.91 -0.65 0.70 0.00 0.00 175.17 176.53 3n5d h PRO 11 N 2.24 0.00 0.28 2.11 0.11 -1.95 -2.13 132.00 132.66 3n5d h PRO 11 Ca -0.28 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 3n5d h PRO 11 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3n5d h PRO 11 CO 0.39 0.00 -0.13 1.03 -0.21 0.00 0.00 178.00 179.07 3n5d h SER 12 N 0.00 -0.32 -0.59 -2.05 0.87 -1.97 -2.10 113.55 107.39 3n5d h SER 12 Ca 0.23 0.01 0.10 0.00 -1.23 0.00 0.00 61.79 60.90 3n5d h SER 12 Cb 1.18 0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 63.18 3n5d h SER 12 CO -0.00 0.07 0.40 0.77 -0.53 0.00 0.00 176.83 177.54 3n5d h SER 13 N -0.97 0.36 0.14 6.23 4.64 -1.87 0.09 113.55 122.17 3n5d h SER 13 Ca -0.04 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.28 3n5d h SER 13 Cb 0.29 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 3n5d h SER 13 CO 0.06 0.21 -0.07 0.22 -0.87 0.00 0.00 176.83 176.39 3n5d h TYR 14 N 0.40 -0.18 -0.82 4.77 3.20 -1.49 -1.11 116.97 121.74 3n5d h TYR 14 Ca 0.27 -0.00 0.19 0.00 3.14 0.00 0.00 58.73 62.33 3n5d h TYR 14 Cb 0.55 0.06 -0.12 0.00 1.54 0.00 0.00 36.73 38.76 3n5d h TYR 14 CO -0.00 0.09 0.28 0.78 -1.64 0.00 0.00 178.16 177.67 3n5d h GLY 15 N -0.44 1.26 1.01 1.82 0.00 -0.51 0.18 103.07 106.39 3n5d h GLY 15 Ca -0.02 -0.10 -0.00 0.00 0.00 0.00 0.00 47.33 47.21 3n5d h GLY 15 CO 0.03 -0.23 0.47 -0.33 0.00 0.00 0.00 176.54 176.48 3n5d h MET 16 N 0.34 1.05 -0.48 4.80 2.86 -0.86 -0.63 114.93 122.01 3n5d h MET 16 Ca 0.48 -0.09 -0.07 0.00 -2.06 0.00 0.00 59.70 57.96 3n5d h MET 16 Cb 0.87 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 32.29 3n5d h MET 16 CO -0.52 0.74 0.03 0.35 1.06 0.00 0.00 176.91 178.57 3n5d h PHE 17 N 1.06 0.89 -0.74 -0.22 3.57 0.60 0.36 116.94 122.46 3n5d h PHE 17 Ca 0.28 -0.14 -0.06 0.00 3.53 0.00 0.00 57.97 61.57 3n5d h PHE 17 Cb -0.04 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.43 3n5d h PHE 17 CO -0.01 0.84 0.23 0.82 -2.23 0.00 0.00 178.31 177.96 3n5d h ILE 18 N 0.69 1.26 -0.61 1.41 1.08 -0.86 0.27 117.51 120.75 3n5d h ILE 18 Ca 0.14 -0.92 0.02 0.00 -0.39 0.00 0.00 64.86 63.71 3n5d h ILE 18 Cb 0.46 0.44 -0.04 0.00 -3.07 0.00 0.00 36.82 34.62 3n5d h ILE 18 CO 0.02 0.36 0.38 0.50 -0.69 0.00 0.00 178.15 178.72 3n5d h LYS 19 N 1.11 0.74 -0.72 2.37 3.64 -0.82 -0.60 116.57 122.30 3n5d h LYS 19 Ca 0.24 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 3n5d h LYS 19 Cb 0.31 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 31.93 3n5d h LYS 19 CO -0.01 0.49 0.47 -0.44 -2.27 0.00 0.00 179.45 177.69 3n5d h ASP 20 N 0.76 0.83 0.18 4.20 3.32 -0.37 -1.92 116.42 123.43 3n5d h ASP 20 Ca 0.24 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.26 3n5d h ASP 20 Cb -0.02 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 3n5d h ASP 20 CO -0.08 0.61 -0.17 0.25 -1.72 0.00 0.00 179.24 178.13 3n5d h LEU 21 N 0.97 -0.46 -1.30 1.55 5.85 0.13 -0.89 115.31 121.17 3n5d h LEU 21 Ca 0.26 0.04 0.09 0.00 0.84 0.00 0.00 57.88 59.11 3n5d h LEU 21 Cb -0.10 0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.04 3n5d h LEU 21 CO -0.05 -0.26 0.53 0.03 -0.34 0.00 0.00 178.44 178.34 3n5d h ARG 22 N -0.38 0.77 0.00 1.25 3.08 -0.99 -2.58 114.38 115.53 3n5d h ARG 22 Ca -0.00 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 3n5d h ARG 22 Cb 0.36 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 3n5d h ARG 22 CO -0.04 0.51 -0.13 -0.91 -1.07 0.00 0.00 179.97 178.34 3n5d h ASN 23 N 0.80 0.00 1.23 7.04 -0.26 -0.81 -2.43 115.58 121.15 3n5d h ASN 23 Ca 0.37 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.11 3n5d h ASN 23 Cb 0.38 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.64 3n5d h ASN 23 CO -0.14 0.13 0.00 0.00 -1.06 0.00 0.00 177.43 176.36 3n5d h ALA 24 N 1.87 1.00 -2.50 -0.83 0.00 -0.76 -3.45 119.26 114.60 3n5d h ALA 24 Ca -0.00 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.33 3n5d h ALA 24 Cb 1.03 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.75 3n5d h ALA 24 CO 0.02 0.00 0.25 -0.51 0.00 0.00 0.00 179.25 179.01 3n5d s LEU 25 N -5.05 4.19 0.39 0.00 1.43 -0.92 -5.03 118.68 113.69 3n5d s LEU 25 Ca 0.06 1.08 -0.05 0.00 -1.03 0.00 0.00 54.13 54.19 3n5d s LEU 25 Cb 0.10 -3.11 -0.05 0.00 0.03 0.00 0.00 46.19 43.16 3n5d s LEU 25 CO 0.53 -0.31 0.67 -2.16 0.23 0.00 0.00 176.35 175.31 3n5d s PRO 26 N 1.82 3.60 0.18 1.29 0.04 -1.26 -5.04 135.00 135.63 3n5d s PRO 26 Ca 0.35 0.09 -0.22 0.00 0.04 0.00 0.00 61.00 61.26 3n5d s PRO 26 Cb -0.17 -2.51 0.06 0.00 0.04 0.00 0.00 34.50 31.92 3n5d s PRO 26 CO 0.13 0.02 0.60 -3.38 0.04 0.00 0.00 177.00 174.41 3n5d s HIS 27 N -2.40 -0.44 0.00 0.56 -3.43 -1.26 -3.82 115.29 104.50 3n5d s HIS 27 Ca 0.46 0.17 0.00 0.00 -0.80 0.00 0.00 55.06 54.89 3n5d s HIS 27 Cb -0.10 0.56 0.00 0.00 -1.43 0.00 0.00 32.58 31.61 3n5d s HIS 27 CO 0.36 -0.91 0.10 0.25 -2.00 0.00 0.00 174.74 172.54 3n5d n THR 28 N -0.38 0.00 -4.13 -5.38 -2.24 -1.26 -5.05 114.28 95.84 3n5d n THR 28 Ca -0.14 -0.43 -0.13 0.00 -2.27 0.00 0.00 64.05 61.07 3n5d n THR 28 Cb 0.64 1.03 -0.11 0.00 -2.10 0.00 0.00 70.33 69.79 3n5d n THR 28 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3n5d s GLU 29 N -0.66 0.71 0.08 -0.78 2.12 -1.26 -5.10 118.70 113.81 3n5d s GLU 29 Ca 0.00 -1.00 0.08 0.00 0.36 0.00 0.00 54.97 54.40 3n5d s GLU 29 Cb 0.00 -0.40 -0.04 0.00 0.26 0.00 0.00 34.13 33.96 3n5d s GLU 29 CO 0.00 0.06 -0.15 0.15 -0.54 0.00 0.00 175.26 174.78 3n5d s LYS 30 N -2.38 2.01 -0.15 4.30 1.02 -1.26 -1.67 119.74 121.60 3n5d s LYS 30 Ca -0.01 -1.05 0.01 0.00 0.02 0.00 0.00 55.97 54.95 3n5d s LYS 30 Cb -0.05 -2.21 0.02 0.00 -0.52 0.00 0.00 37.83 35.07 3n5d s LYS 30 CO -0.01 0.51 -0.18 0.08 -0.92 0.00 0.00 175.35 174.84 3n5d s VAL 31 N -1.09 1.84 -1.44 3.17 1.01 -0.38 -4.55 120.40 118.96 3n5d s VAL 31 Ca 0.18 -0.82 -0.13 0.00 0.00 0.00 0.00 61.98 61.21 3n5d s VAL 31 Cb -0.11 -1.67 0.11 0.00 0.00 0.00 0.00 36.38 34.71 3n5d s VAL 31 CO 0.09 0.50 0.64 -1.22 0.00 0.00 0.00 175.10 175.12 3n5d n TYR 32 N 4.50 -1.82 -0.99 5.22 4.01 -1.26 -0.60 117.16 126.23 3n5d n TYR 32 Ca -0.19 0.63 0.00 0.00 -0.16 0.00 0.00 57.90 58.17 3n5d n TYR 32 Cb 0.50 -2.99 0.00 0.00 -0.31 0.00 0.00 39.34 36.55 3n5d n TYR 32 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3n5d n ASN 33 N -2.46 -2.73 -4.50 7.72 5.15 -1.26 -4.99 115.26 112.19 3n5d n ASN 33 Ca 0.03 0.00 -0.36 0.00 -0.60 0.00 0.00 54.58 53.65 3n5d n ASN 33 Cb 0.52 -0.75 -0.12 0.00 -0.53 0.00 0.00 39.78 38.90 3n5d n ASN 33 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3n5d s ILE 34 N -2.21 4.38 0.14 -1.44 1.01 0.23 -5.02 121.20 118.29 3n5d s ILE 34 Ca 0.00 -0.16 -0.34 0.00 0.00 0.00 0.00 60.65 60.15 3n5d s ILE 34 Cb 0.00 -3.01 -0.17 0.00 0.01 0.00 0.00 42.46 39.29 3n5d s ILE 34 CO 0.00 0.39 1.14 -2.65 0.00 0.00 0.00 174.94 173.82 3n5d n PRO 35 N 4.38 0.93 -3.52 2.79 -0.02 -1.26 -1.25 135.00 137.05 3n5d n PRO 35 Ca -0.16 0.33 -0.41 0.00 -2.02 0.00 0.00 63.50 61.24 3n5d n PRO 35 Cb 0.52 -1.82 -0.10 0.00 -0.02 0.00 0.00 33.50 32.07 3n5d n PRO 35 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3n5d s LEU 36 N 0.71 4.56 0.56 2.45 2.96 -0.67 -2.08 118.68 127.17 3n5d s LEU 36 Ca 0.77 -0.45 -0.21 0.00 -0.22 0.00 0.00 54.13 54.02 3n5d s LEU 36 Cb -0.93 -2.15 -0.04 0.00 0.50 0.00 0.00 46.19 43.57 3n5d s LEU 36 CO 0.52 -0.26 1.33 -0.76 -1.32 0.00 0.00 176.35 175.87 3n5d s LEU 37 N 1.73 3.82 0.69 -0.68 1.43 -0.18 -4.32 118.68 121.17 3n5d s LEU 37 Ca 0.06 2.71 -0.16 0.00 -1.03 0.00 0.00 54.13 55.71 3n5d s LEU 37 Cb -0.17 -4.33 0.02 0.00 0.03 0.00 0.00 46.19 41.73 3n5d s LEU 37 CO 0.11 -1.59 1.22 -0.76 0.23 0.00 0.00 176.35 175.55 3n5d s LEU 38 N -3.62 3.43 0.29 1.79 1.43 -1.25 -4.10 118.68 116.64 3n5d s LEU 38 Ca 0.73 2.39 -0.01 0.00 -1.03 0.00 0.00 54.13 56.20 3n5d s LEU 38 Cb -0.39 -4.59 0.43 0.00 0.03 0.00 0.00 46.19 41.67 3n5d s LEU 38 CO 0.45 -2.06 1.88 -0.65 0.23 0.00 0.00 176.35 176.20 3n5d h PRO 39 N 0.08 0.90 -2.22 1.29 0.11 -1.93 -3.44 132.00 126.78 3n5d h PRO 39 Ca -0.49 -0.13 0.14 0.00 0.11 0.00 0.00 66.00 65.64 3n5d h PRO 39 Cb 1.30 -0.16 -0.13 0.00 0.11 0.00 0.00 31.00 32.12 3n5d h PRO 39 CO 0.51 0.72 0.52 -1.54 -0.21 0.00 0.00 178.00 178.01 3n5d s SER 40 N -6.50 -0.29 -0.04 -2.05 1.04 -1.26 -4.85 113.70 99.76 3n5d s SER 40 Ca -0.10 -0.12 -0.03 0.00 0.48 0.00 0.00 55.95 56.17 3n5d s SER 40 Cb 0.16 0.39 0.01 0.00 0.10 0.00 0.00 66.02 66.69 3n5d s SER 40 CO 0.80 -0.67 0.10 -0.69 0.98 0.00 0.00 173.24 173.76 3n5d s VAL 41 N -3.10 -0.01 -0.10 5.02 1.01 -1.26 -5.07 120.40 116.88 3n5d s VAL 41 Ca 0.08 0.03 -0.09 0.00 0.00 0.00 0.00 61.98 61.99 3n5d s VAL 41 Cb -0.01 -0.16 -0.04 0.00 0.00 0.00 0.00 36.38 36.17 3n5d s VAL 41 CO -0.05 0.01 0.20 -0.44 0.00 0.00 0.00 175.10 174.81 3n5d s SER 42 N 0.20 6.47 0.52 3.32 0.01 -1.26 -4.56 113.70 118.39 3n5d s SER 42 Ca -0.01 0.56 0.00 0.00 1.31 0.00 0.00 55.95 57.81 3n5d s SER 42 Cb -0.02 -2.11 0.00 0.00 0.21 0.00 0.00 66.02 64.10 3n5d s SER 42 CO -0.01 0.37 0.00 0.61 0.41 0.00 0.00 173.24 174.63 3n5d n GLY 43 N 2.07 1.15 0.19 3.44 0.00 -1.26 -3.83 105.19 106.96 3n5d n GLY 43 Ca -0.18 -0.73 0.04 0.00 0.00 0.00 0.00 46.02 45.15 3n5d n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n5d h ALA 44 N -0.52 1.33 0.00 4.61 0.00 -1.94 -2.82 119.26 119.92 3n5d h ALA 44 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3n5d h ALA 44 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3n5d h ALA 44 CO 0.00 0.43 0.00 0.41 0.00 0.00 0.00 179.25 180.09 3n5d n GLY 45 N -0.41 -0.93 0.19 0.00 0.00 -1.25 -2.00 105.19 100.79 3n5d n GLY 45 Ca -0.02 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 46.08 3n5d n GLY 45 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3n5d h ARG 46 N 0.00 0.00 -5.15 1.61 2.43 -1.71 -3.44 114.38 108.11 3n5d h ARG 46 Ca 0.00 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 58.50 3n5d h ARG 46 Cb 0.21 0.00 -0.34 0.00 -0.42 0.00 0.00 29.97 29.42 3n5d h ARG 46 CO 0.00 0.00 -0.86 0.71 -1.51 0.00 0.00 179.97 178.31 3n5d s TYR 47 N -3.53 2.72 0.02 2.20 2.02 -0.85 -0.32 117.35 119.60 3n5d s TYR 47 Ca 0.01 -1.40 -0.17 0.00 -0.37 0.00 0.00 57.07 55.14 3n5d s TYR 47 Cb 0.09 -1.86 -0.06 0.00 -0.40 0.00 0.00 41.96 39.73 3n5d s TYR 47 CO 0.39 -0.66 0.48 -1.17 -1.57 0.00 0.00 175.55 173.02 3n5d s LEU 48 N 0.97 4.48 -0.30 -1.29 2.96 0.21 -4.84 118.68 120.88 3n5d s LEU 48 Ca -0.03 1.07 -0.13 0.00 -0.22 0.00 0.00 54.13 54.82 3n5d s LEU 48 Cb -0.15 -2.73 -0.03 0.00 0.50 0.00 0.00 46.19 43.78 3n5d s LEU 48 CO -0.05 0.27 0.28 -0.76 -1.32 0.00 0.00 176.35 174.77 3n5d s LEU 49 N -0.90 4.19 -0.31 -0.68 1.43 -1.26 0.76 118.68 121.91 3n5d s LEU 49 Ca 0.26 -0.04 -0.14 0.00 -1.03 0.00 0.00 54.13 53.18 3n5d s LEU 49 Cb -0.18 -2.25 -0.03 0.00 0.03 0.00 0.00 46.19 43.77 3n5d s LEU 49 CO 0.15 -0.17 0.31 -0.04 0.23 0.00 0.00 176.35 176.83 3n5d s MET 50 N 1.89 3.77 -0.38 1.70 -1.94 0.43 -1.53 119.30 123.23 3n5d s MET 50 Ca 0.10 -0.29 -0.21 0.00 -1.71 0.00 0.00 55.69 53.58 3n5d s MET 50 Cb -0.16 -3.73 0.01 0.00 2.01 0.00 0.00 34.83 32.96 3n5d s MET 50 CO 0.11 -0.37 0.64 -1.01 -0.01 0.00 0.00 175.02 174.38 3n5d s HIS 51 N 1.94 3.12 0.02 -0.03 0.09 0.10 -0.47 115.29 120.06 3n5d s HIS 51 Ca 0.11 0.21 0.04 0.00 -0.00 0.00 0.00 55.06 55.42 3n5d s HIS 51 Cb -0.16 -3.22 -0.03 0.00 -0.00 0.00 0.00 32.58 29.17 3n5d s HIS 51 CO 0.11 -0.71 -0.08 -0.51 -0.00 0.00 0.00 174.74 173.55 3n5d s LEU 52 N 2.76 3.10 -0.14 0.89 1.43 -0.31 -1.33 118.68 125.07 3n5d s LEU 52 Ca 0.24 -0.20 -0.01 0.00 -1.03 0.00 0.00 54.13 53.13 3n5d s LEU 52 Cb -0.14 -1.80 0.04 0.00 0.03 0.00 0.00 46.19 44.32 3n5d s LEU 52 CO 0.16 0.27 -0.04 -0.36 0.23 0.00 0.00 176.35 176.61 3n5d s PHE 53 N -1.02 1.40 1.13 0.29 0.08 -0.71 -1.85 117.98 117.31 3n5d s PHE 53 Ca 0.17 -0.80 -0.16 0.00 0.12 0.00 0.00 56.93 56.26 3n5d s PHE 53 Cb -0.11 -1.18 0.25 0.00 -0.57 0.00 0.00 43.02 41.41 3n5d s PHE 53 CO 0.08 -0.54 1.09 0.54 -0.10 0.00 0.00 175.22 176.30 3n5d s ASN 54 N 1.73 1.52 0.30 1.36 2.20 -0.11 -1.79 114.94 120.14 3n5d s ASN 54 Ca 0.03 0.90 0.03 0.00 -0.94 0.00 0.00 52.86 52.87 3n5d s ASN 54 Cb -0.14 -1.35 0.63 0.00 -2.00 0.00 0.00 41.25 38.39 3n5d s ASN 54 CO -0.07 -3.78 1.82 0.22 -2.94 0.00 0.00 177.10 172.34 3n5d h TYR 55 N -2.34 1.10 -0.00 1.54 3.20 -1.87 0.39 116.97 118.99 3n5d h TYR 55 Ca -0.50 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.40 3n5d h TYR 55 Cb 1.31 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 39.24 3n5d h TYR 55 CO -1.05 0.38 -0.01 -0.25 -1.64 0.00 0.00 178.16 175.60 3n5d n ASP 56 N -4.65 0.10 0.00 -2.11 8.00 -1.26 -4.46 116.55 112.17 3n5d n ASP 56 Ca 0.20 -0.83 0.00 0.00 0.71 0.00 0.00 54.79 54.87 3n5d n ASP 56 Cb 0.43 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.46 3n5d n ASP 56 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3n5d n GLY 57 N 1.08 0.76 3.83 0.44 0.00 0.14 -5.06 105.19 106.39 3n5d n GLY 57 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 3n5d n GLY 57 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3n5d s ASN 58 N -2.35 6.25 0.03 1.61 0.01 -1.26 -4.78 114.94 114.44 3n5d s ASN 58 Ca 0.00 1.61 0.03 0.00 -0.71 0.00 0.00 52.86 53.79 3n5d s ASN 58 Cb 0.00 -2.51 -0.02 0.00 0.41 0.00 0.00 41.25 39.13 3n5d s ASN 58 CO 0.00 -0.85 -0.09 0.28 -1.51 0.00 0.00 177.10 174.93 3n5d s THR 59 N -2.70 0.66 0.25 1.60 -1.32 -1.26 -0.94 115.64 111.92 3n5d s THR 59 Ca 0.59 -0.86 0.11 0.00 -1.21 0.00 0.00 61.69 60.32 3n5d s THR 59 Cb -0.12 -0.65 -0.05 0.00 -1.51 0.00 0.00 72.50 70.17 3n5d s THR 59 CO 0.38 -0.17 -0.19 0.27 -2.21 0.00 0.00 174.62 172.71 3n5d s ILE 60 N -0.95 2.25 -0.15 5.08 -4.36 -0.77 -4.48 121.20 117.82 3n5d s ILE 60 Ca -0.04 -2.30 -0.01 0.00 -0.26 0.00 0.00 60.65 58.04 3n5d s ILE 60 Cb -0.08 -2.20 -0.01 0.00 1.25 0.00 0.00 42.46 41.43 3n5d s ILE 60 CO 0.01 -0.42 -0.13 -0.89 0.24 0.00 0.00 174.94 173.75 3n5d s THR 61 N -2.53 2.98 -0.15 8.37 2.01 -0.53 -1.17 115.64 124.61 3n5d s THR 61 Ca 0.27 -0.67 -0.03 0.00 0.31 0.00 0.00 61.69 61.56 3n5d s THR 61 Cb -0.04 -2.27 -0.03 0.00 0.01 0.00 0.00 72.50 70.18 3n5d s THR 61 CO 0.12 0.51 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.82 3n5d s VAL 62 N 0.63 3.75 -0.14 3.82 1.01 0.38 0.51 120.40 130.36 3n5d s VAL 62 Ca -0.07 -0.41 -0.21 0.00 0.00 0.00 0.00 61.98 61.29 3n5d s VAL 62 Cb -0.15 -2.63 -0.03 0.00 0.00 0.00 0.00 36.38 33.56 3n5d s VAL 62 CO 0.03 0.50 0.63 0.00 0.00 0.00 0.00 175.10 176.25 3n5d s ALA 63 N 0.36 3.46 -0.10 5.51 0.00 -0.31 -0.43 121.76 130.25 3n5d s ALA 63 Ca -0.05 -0.11 0.03 0.00 0.00 0.00 0.00 51.96 51.83 3n5d s ALA 63 Cb -0.14 -2.91 0.01 0.00 0.00 0.00 0.00 23.12 20.07 3n5d s ALA 63 CO 0.03 -0.30 -0.21 0.08 0.00 0.00 0.00 175.76 175.37 3n5d s VAL 64 N 1.30 1.83 -0.30 0.00 1.01 0.23 -1.05 120.40 123.43 3n5d s VAL 64 Ca 0.31 -0.88 -0.29 0.00 0.00 0.00 0.00 61.98 61.13 3n5d s VAL 64 Cb -0.16 -1.61 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 3n5d s VAL 64 CO 0.13 0.51 1.55 -0.62 0.00 0.00 0.00 175.10 176.67 3n5d s ASP 65 N 0.55 6.32 0.03 3.32 -1.08 -0.61 0.68 116.67 125.88 3n5d s ASP 65 Ca -0.15 1.31 0.12 0.00 -0.52 0.00 0.00 52.55 53.32 3n5d s ASP 65 Cb -0.17 -2.53 0.52 0.00 -1.46 0.00 0.00 42.92 39.28 3n5d s ASP 65 CO 0.05 -1.36 1.39 1.33 0.52 0.00 0.00 175.17 177.10 3n5d n VAL 66 N 6.73 1.21 0.07 1.11 0.24 0.56 -0.34 118.33 127.91 3n5d n VAL 66 Ca 0.18 0.31 0.05 0.00 -2.04 0.00 0.00 64.34 62.85 3n5d n VAL 66 Cb 0.46 -1.14 -0.04 0.00 -1.47 0.00 0.00 33.84 31.66 3n5d n VAL 66 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 3n5d h THR 67 N 0.00 0.27 0.00 3.34 1.35 -1.86 -3.42 112.91 112.60 3n5d h THR 67 Ca 0.00 -1.53 0.00 0.00 -0.55 0.00 0.00 66.41 64.33 3n5d h THR 67 Cb 0.20 1.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 3n5d h THR 67 CO 0.00 0.16 0.00 -0.46 -0.25 0.00 0.00 175.52 174.97 3n5d n ASN 68 N -2.81 0.19 -2.30 5.36 0.23 -1.03 -4.65 115.26 110.25 3n5d n ASN 68 Ca -0.05 -0.97 -0.18 0.00 -0.53 0.00 0.00 54.58 52.85 3n5d n ASN 68 Cb 0.70 0.01 0.01 0.00 -2.08 0.00 0.00 39.78 38.42 3n5d n ASN 68 CO 0.00 0.00 0.00 0.52 -0.93 0.00 0.00 177.26 176.85 3n5d n VAL 69 N -0.01 -1.31 -3.56 3.53 0.31 0.54 -4.98 118.33 112.86 3n5d n VAL 69 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.97 3n5d n VAL 69 Cb 0.20 -2.86 -0.07 0.00 -0.91 0.00 0.00 33.84 30.20 3n5d n VAL 69 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 3n5d s TYR 70 N -2.98 3.49 0.05 3.52 4.12 -1.23 -4.83 117.35 119.49 3n5d s TYR 70 Ca 0.14 0.61 -0.31 0.00 0.02 0.00 0.00 57.07 57.54 3n5d s TYR 70 Cb -0.06 -2.30 -0.06 0.00 -1.52 0.00 0.00 41.96 38.01 3n5d s TYR 70 CO 0.17 0.31 1.33 0.42 0.02 0.00 0.00 175.55 177.80 3n5d s ILE 71 N 0.24 3.70 -0.15 2.71 1.01 -1.26 -1.57 121.20 125.88 3n5d s ILE 71 Ca 0.17 1.17 0.02 0.00 0.00 0.00 0.00 60.65 62.01 3n5d s ILE 71 Cb -0.13 -3.75 -0.23 0.00 0.01 0.00 0.00 42.46 38.35 3n5d s ILE 71 CO 0.04 0.05 0.25 0.23 0.00 0.00 0.00 174.94 175.52 3n5d n MET 72 N 4.51 0.70 -3.56 2.79 2.81 -0.21 -4.93 117.12 119.23 3n5d n MET 72 Ca 0.11 0.21 0.00 0.00 -1.81 0.00 0.00 57.70 56.22 3n5d n MET 72 Cb 0.44 -1.66 0.00 0.00 -0.71 0.00 0.00 33.22 31.29 3n5d n MET 72 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3n5d n GLY 73 N 1.94 -1.77 3.56 3.03 0.00 -1.24 -2.22 105.19 108.50 3n5d n GLY 73 Ca -0.32 -1.12 -0.09 0.00 0.00 0.00 0.00 46.02 44.48 3n5d n GLY 73 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3n5d s TYR 74 N -2.45 -0.00 -0.12 1.61 1.13 -0.55 -1.16 117.35 115.81 3n5d s TYR 74 Ca 0.00 -0.36 0.03 0.00 -1.41 0.00 0.00 57.07 55.32 3n5d s TYR 74 Cb 0.00 0.36 0.01 0.00 -1.10 0.00 0.00 41.96 41.23 3n5d s TYR 74 CO 0.00 -0.96 -0.20 -1.17 -2.51 0.00 0.00 175.55 170.71 3n5d s LEU 75 N -2.91 2.00 -0.31 -3.49 2.96 0.18 -1.09 118.68 116.02 3n5d s LEU 75 Ca 0.12 -0.55 0.02 0.00 -0.22 0.00 0.00 54.13 53.51 3n5d s LEU 75 Cb -0.01 -1.34 0.09 0.00 0.50 0.00 0.00 46.19 45.43 3n5d s LEU 75 CO 0.01 0.08 0.03 0.00 -1.32 0.00 0.00 176.35 175.15 3n5d s ALA 76 N 0.77 2.38 0.00 5.97 0.00 -0.47 -1.45 121.76 128.96 3n5d s ALA 76 Ca -0.09 -2.07 0.00 0.00 0.00 0.00 0.00 51.96 49.79 3n5d s ALA 76 Cb -0.16 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.19 3n5d s ALA 76 CO 0.00 -1.57 0.00 -0.11 0.00 0.00 0.00 175.76 174.09 3n5d n LEU 77 N 4.48 0.00 -1.54 0.00 7.94 -1.26 -2.37 117.00 124.25 3n5d n LEU 77 Ca -0.01 0.00 0.04 0.00 -1.11 0.00 0.00 56.01 54.92 3n5d n LEU 77 Cb 0.42 0.00 0.32 0.00 0.53 0.00 0.00 43.42 44.69 3n5d n LEU 77 CO 0.19 0.00 0.85 0.35 -1.11 0.00 0.00 177.39 177.66 3n5d n THR 78 N 0.00 2.64 -4.76 1.96 -2.24 -1.26 -4.89 114.28 105.73 3n5d n THR 78 Ca 0.00 -1.71 -0.26 0.00 -2.27 0.00 0.00 64.05 59.81 3n5d n THR 78 Cb 0.00 -0.29 -0.17 0.00 -2.10 0.00 0.00 70.33 67.77 3n5d n THR 78 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3n5d s THR 79 N -2.88 1.37 0.20 4.28 2.01 -1.00 -0.89 115.64 118.73 3n5d s THR 79 Ca 0.50 -0.63 0.04 0.00 0.31 0.00 0.00 61.69 61.91 3n5d s THR 79 Cb 0.40 -1.21 -0.03 0.00 0.01 0.00 0.00 72.50 71.66 3n5d s THR 79 CO 0.12 0.40 0.28 -0.94 -0.69 0.00 0.00 174.62 173.80 3n5d s SER 80 N 0.46 6.14 -0.01 3.53 1.04 -0.72 -1.37 113.70 122.77 3n5d s SER 80 Ca -0.13 0.05 0.01 0.00 0.48 0.00 0.00 55.95 56.37 3n5d s SER 80 Cb -0.15 -1.78 0.00 0.00 0.10 0.00 0.00 66.02 64.19 3n5d s SER 80 CO 0.04 -0.00 -0.05 -0.31 0.98 0.00 0.00 173.24 173.91 3n5d s TYR 81 N -1.87 0.48 0.01 5.02 1.51 -0.25 -1.04 117.35 121.20 3n5d s TYR 81 Ca 0.34 -0.09 -0.01 0.00 -1.01 0.00 0.00 57.07 56.29 3n5d s TYR 81 Cb -0.10 -0.34 -0.01 0.00 -0.11 0.00 0.00 41.96 41.40 3n5d s TYR 81 CO 0.28 -0.03 0.01 -0.06 -1.11 0.00 0.00 175.55 174.63 3n5d s PHE 82 N 0.07 0.14 0.89 2.71 0.08 -0.70 -1.48 117.98 119.69 3n5d s PHE 82 Ca -0.00 -0.28 -0.12 0.00 0.12 0.00 0.00 56.93 56.64 3n5d s PHE 82 Cb -0.04 -0.11 0.08 0.00 -0.57 0.00 0.00 43.02 42.38 3n5d s PHE 82 CO -0.00 -0.15 0.85 1.19 -0.10 0.00 0.00 175.22 177.01 3n5d n PHE 83 N 2.05 -0.00 -2.94 0.36 3.72 -0.94 -0.71 117.46 119.00 3n5d n PHE 83 Ca -0.20 0.34 -0.44 0.00 -0.05 0.00 0.00 57.45 57.10 3n5d n PHE 83 Cb 0.57 -1.94 0.00 0.00 -0.94 0.00 0.00 39.48 37.17 3n5d n PHE 83 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3n5d n ASN 84 N -2.70 5.35 -3.56 4.37 4.05 0.40 -4.49 115.26 118.69 3n5d n ASN 84 Ca 0.10 -3.04 -0.17 0.00 0.45 0.00 0.00 54.58 51.92 3n5d n ASN 84 Cb 0.52 -1.49 -0.06 0.00 1.23 0.00 0.00 39.78 39.97 3n5d n ASN 84 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 177.26 172.38 3n5d s GLU 85 N 0.45 1.00 0.25 1.20 -1.05 -1.26 -3.73 118.70 115.55 3n5d s GLU 85 Ca 0.39 0.20 -0.05 0.00 -0.15 0.00 0.00 54.97 55.36 3n5d s GLU 85 Cb -0.02 0.47 0.31 0.00 -0.44 0.00 0.00 34.13 34.46 3n5d s GLU 85 CO -0.01 -0.31 1.89 -1.35 0.95 0.00 0.00 175.26 176.43 3n5d h PRO 86 N 3.14 1.13 -0.63 -4.83 0.11 -1.99 0.20 132.00 129.13 3n5d h PRO 86 Ca -0.27 -0.07 0.04 0.00 0.11 0.00 0.00 66.00 65.81 3n5d h PRO 86 Cb 1.15 -0.26 -0.05 0.00 0.11 0.00 0.00 31.00 31.95 3n5d h PRO 86 CO 0.39 0.75 0.37 0.00 -0.21 0.00 0.00 178.00 179.30 3n5d h ALA 87 N 1.40 0.84 -0.50 -0.75 0.00 -1.98 0.31 119.26 118.58 3n5d h ALA 87 Ca 0.38 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 55.16 3n5d h ALA 87 Cb 0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3n5d h ALA 87 CO -0.13 0.08 -0.18 0.00 0.00 0.00 0.00 179.25 179.01 3n5d h ALA 88 N 1.30 0.69 -0.51 0.00 0.00 -1.54 -1.65 119.26 117.56 3n5d h ALA 88 Ca 0.27 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3n5d h ALA 88 Cb 0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3n5d h ALA 88 CO -0.14 0.66 0.31 0.22 0.00 0.00 0.00 179.25 180.31 3n5d h ASP 89 N 0.87 0.61 -0.58 0.00 3.58 -0.28 -0.54 116.42 120.08 3n5d h ASP 89 Ca 0.12 -0.05 0.03 0.00 0.42 0.00 0.00 57.03 57.55 3n5d h ASP 89 Cb 0.76 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 41.62 3n5d h ASP 89 CO 0.06 0.48 0.34 0.25 -2.88 0.00 0.00 179.24 177.49 3n5d h LEU 90 N 0.69 0.53 -1.78 2.28 5.85 -0.34 -2.09 115.31 120.46 3n5d h LEU 90 Ca 0.18 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 3n5d h LEU 90 Cb -0.02 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 3n5d h LEU 90 CO -0.04 0.37 0.08 0.00 -0.34 0.00 0.00 178.44 178.51 3n5d h ALA 91 N 1.27 1.83 0.00 1.25 0.00 -0.53 -1.48 119.26 121.60 3n5d h ALA 91 Ca 0.24 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3n5d h ALA 91 Cb 0.07 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3n5d h ALA 91 CO -0.12 0.14 0.00 -1.13 0.00 0.00 0.00 179.25 178.14 3n5d n SER 92 N -4.48 0.61 0.24 0.00 3.41 -0.28 -0.48 113.62 112.63 3n5d n SER 92 Ca -0.01 0.73 0.14 0.00 -0.26 0.00 0.00 58.87 59.48 3n5d n SER 92 Cb 0.10 -0.83 0.41 0.00 -0.26 0.00 0.00 64.21 63.64 3n5d n SER 92 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 3n5d h GLN 93 N 0.00 0.00 0.00 4.33 4.20 -1.25 -3.39 115.11 119.00 3n5d h GLN 93 Ca 0.00 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 3n5d h GLN 93 Cb 0.14 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 3n5d h GLN 93 CO 0.00 0.00 -1.39 0.66 -0.67 0.00 0.00 178.83 177.43 3n5d n TYR 94 N -3.06 0.00 -4.47 2.96 4.01 0.37 -4.98 117.16 111.99 3n5d n TYR 94 Ca 0.02 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.45 3n5d n TYR 94 Cb 0.42 -0.27 -0.11 0.00 -0.31 0.00 0.00 39.34 39.07 3n5d n TYR 94 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 3n5d s VAL 95 N -2.14 3.41 -1.19 -0.72 -7.23 -0.59 -4.65 120.40 107.29 3n5d s VAL 95 Ca -0.06 -0.95 0.00 0.00 -1.81 0.00 0.00 61.98 59.16 3n5d s VAL 95 Cb 0.02 -2.49 0.00 0.00 0.56 0.00 0.00 36.38 34.47 3n5d s VAL 95 CO 0.19 0.33 0.00 0.49 -0.31 0.00 0.00 175.10 175.81 3n5d n PHE 96 N 1.41 -0.01 0.10 2.82 3.72 -1.26 -4.71 117.46 119.52 3n5d n PHE 96 Ca -0.15 0.00 0.18 0.00 -0.05 0.00 0.00 57.45 57.43 3n5d n PHE 96 Cb 0.52 -2.12 0.73 0.00 -0.94 0.00 0.00 39.48 37.68 3n5d n PHE 96 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3n5d h ARG 97 N 0.00 0.00 -0.28 -1.08 2.47 -1.85 -1.45 114.38 112.18 3n5d h ARG 97 Ca -0.23 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.49 3n5d h ARG 97 Cb 0.74 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.06 3n5d h ARG 97 CO 0.34 0.00 0.00 -1.13 0.56 0.00 0.00 179.97 179.74 3n5d n SER 98 N -4.14 1.33 -4.76 7.04 3.41 -1.26 -4.88 113.62 110.36 3n5d n SER 98 Ca 0.06 -2.02 -0.38 0.00 -0.26 0.00 0.00 58.87 56.26 3n5d n SER 98 Cb 0.48 -0.19 0.03 0.00 -0.26 0.00 0.00 64.21 64.27 3n5d n SER 98 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3n5d s ALA 99 N -1.68 2.90 0.32 7.33 0.00 -0.55 -4.93 121.76 125.15 3n5d s ALA 99 Ca 0.15 1.25 0.07 0.00 0.00 0.00 0.00 51.96 53.44 3n5d s ALA 99 Cb 0.08 -3.53 0.54 0.00 0.00 0.00 0.00 23.12 20.22 3n5d s ALA 99 CO 0.10 -1.19 1.76 0.00 0.00 0.00 0.00 175.76 176.43 3n5d h ARG 100 N 1.69 0.23 -3.89 0.00 3.08 -1.35 -3.45 114.38 110.68 3n5d h ARG 100 Ca -0.50 -0.09 -0.10 0.00 0.07 0.00 0.00 59.98 59.35 3n5d h ARG 100 Cb 1.28 -0.01 -0.13 0.00 0.08 0.00 0.00 29.97 31.19 3n5d h ARG 100 CO 0.58 0.55 -0.34 -0.98 -1.07 0.00 0.00 179.97 178.71 3n5d s ARG 101 N -4.29 1.08 -0.10 0.04 1.70 -1.21 -5.07 118.95 111.10 3n5d s ARG 101 Ca -0.05 -1.14 0.01 0.00 -0.47 0.00 0.00 55.73 54.08 3n5d s ARG 101 Cb 0.14 0.36 0.02 0.00 -0.57 0.00 0.00 34.95 34.90 3n5d s ARG 101 CO 0.76 -0.38 -0.11 0.21 -1.08 0.00 0.00 175.30 174.70 3n5d s LYS 102 N -3.95 1.74 -0.14 3.89 2.20 -1.26 -1.75 119.74 120.46 3n5d s LYS 102 Ca 0.15 -0.38 -0.04 0.00 -0.36 0.00 0.00 55.97 55.34 3n5d s LYS 102 Cb 0.04 -1.60 -0.03 0.00 -1.51 0.00 0.00 37.83 34.72 3n5d s LYS 102 CO -0.02 -0.13 0.01 0.42 -0.36 0.00 0.00 175.35 175.26 3n5d s ILE 103 N 1.22 4.33 -0.05 5.43 1.01 -0.20 -4.97 121.20 127.96 3n5d s ILE 103 Ca -0.04 -0.21 -0.19 0.00 0.00 0.00 0.00 60.65 60.21 3n5d s ILE 103 Cb -0.14 -2.89 -0.05 0.00 0.01 0.00 0.00 42.46 39.39 3n5d s ILE 103 CO -0.03 0.52 0.54 -0.89 0.00 0.00 0.00 174.94 175.07 3n5d s THR 104 N -0.00 5.04 0.75 2.92 2.01 -1.26 -1.72 115.64 123.37 3n5d s THR 104 Ca 0.03 1.11 -0.15 0.00 0.31 0.00 0.00 61.69 62.99 3n5d s THR 104 Cb -0.13 -3.87 0.02 0.00 0.01 0.00 0.00 72.50 68.53 3n5d s THR 104 CO 0.02 0.38 0.97 0.18 -0.69 0.00 0.00 174.62 175.48 3n5d n LEU 105 N 3.09 3.40 -0.65 4.42 4.77 0.11 -4.88 117.00 127.27 3n5d n LEU 105 Ca -0.07 0.63 0.01 0.00 -0.03 0.00 0.00 56.01 56.55 3n5d n LEU 105 Cb 0.51 -1.41 0.07 0.00 -2.33 0.00 0.00 43.42 40.26 3n5d n LEU 105 CO 0.43 -2.09 0.39 -0.81 -1.33 0.00 0.00 177.39 173.98 3n5d n PRO 106 N -2.09 1.59 -3.85 3.23 -0.04 -1.26 -4.08 135.00 128.49 3n5d n PRO 106 Ca 0.13 -0.51 -0.10 0.00 -0.04 0.00 0.00 63.50 62.97 3n5d n PRO 106 Cb 0.50 -1.54 -0.08 0.00 -0.04 0.00 0.00 33.50 32.34 3n5d n PRO 106 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3n5d s TYR 107 N -1.39 0.08 0.51 0.54 -0.85 -1.26 -4.97 117.35 110.01 3n5d s TYR 107 Ca 0.09 -0.34 -0.08 0.00 -0.52 0.00 0.00 57.07 56.22 3n5d s TYR 107 Cb 0.06 -0.04 0.12 0.00 0.38 0.00 0.00 41.96 42.48 3n5d s TYR 107 CO 0.03 -0.44 0.69 -1.13 -1.52 0.00 0.00 175.55 173.18 3n5d n SER 108 N 0.57 0.16 -0.85 -0.18 3.41 -1.24 -0.45 113.62 115.03 3n5d n SER 108 Ca -0.18 -1.32 0.12 0.00 -0.26 0.00 0.00 58.87 57.23 3n5d n SER 108 Cb 0.59 -0.52 0.28 0.00 -0.26 0.00 0.00 64.21 64.30 3n5d n SER 108 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3n5d n GLY 109 N 0.37 0.93 3.87 5.00 0.00 -1.26 -4.53 105.19 109.56 3n5d n GLY 109 Ca 0.09 -0.60 -0.31 0.00 0.00 0.00 0.00 46.02 45.21 3n5d n GLY 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n5d s ASN 110 N -1.67 6.42 0.18 1.61 2.20 -1.26 -4.87 114.94 117.55 3n5d s ASN 110 Ca 0.35 1.34 -0.15 0.00 -0.94 0.00 0.00 52.86 53.46 3n5d s ASN 110 Cb 0.20 -2.42 0.15 0.00 -2.00 0.00 0.00 41.25 37.18 3n5d s ASN 110 CO 0.30 -0.64 1.70 1.88 -2.94 0.00 0.00 177.10 177.40 3n5d h TYR 111 N 0.47 0.03 -0.20 1.54 0.05 -1.99 -1.30 116.97 115.58 3n5d h TYR 111 Ca -0.46 0.03 0.06 0.00 0.05 0.00 0.00 58.73 58.41 3n5d h TYR 111 Cb 1.19 0.05 -0.07 0.00 1.01 0.00 0.00 36.73 38.91 3n5d h TYR 111 CO 0.63 -0.06 -0.27 0.93 -1.05 0.00 0.00 178.16 178.34 3n5d h GLU 112 N 0.15 -0.29 -0.62 4.88 4.39 -1.99 -1.05 114.58 120.05 3n5d h GLU 112 Ca 0.22 0.02 -0.08 0.00 0.34 0.00 0.00 59.36 59.86 3n5d h GLU 112 Cb 0.31 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.00 3n5d h GLU 112 CO -0.34 -0.19 0.07 0.00 -1.16 0.00 0.00 179.01 177.39 3n5d h ARG 113 N -0.30 1.04 -0.20 2.33 2.47 -1.79 -1.48 114.38 116.44 3n5d h ARG 113 Ca 0.12 -0.28 -0.08 0.00 -1.26 0.00 0.00 59.98 58.48 3n5d h ARG 113 Cb 0.49 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.68 3n5d h ARG 113 CO -0.38 0.97 -0.23 -0.07 0.56 0.00 0.00 179.97 180.83 3n5d h LEU 114 N 0.97 0.35 -0.24 3.04 3.38 -0.88 -1.70 115.31 120.23 3n5d h LEU 114 Ca 0.19 -0.11 -0.21 0.00 0.09 0.00 0.00 57.88 57.84 3n5d h LEU 114 Cb 0.46 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.12 3n5d h LEU 114 CO 0.02 0.59 -0.75 1.56 0.09 0.00 0.00 178.44 179.95 3n5d h GLN 115 N 0.32 0.71 0.14 1.13 4.20 -0.85 0.61 115.11 121.37 3n5d h GLN 115 Ca 0.05 -0.56 -0.00 0.00 0.06 0.00 0.00 58.65 58.20 3n5d h GLN 115 Cb 0.58 0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.47 3n5d h GLN 115 CO 0.04 1.18 -0.10 0.82 -0.67 0.00 0.00 178.83 180.10 3n5d h ILE 116 N 0.49 0.79 -0.56 2.54 2.04 -1.17 -0.75 117.51 120.90 3n5d h ILE 116 Ca -0.04 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.85 3n5d h ILE 116 Cb 1.36 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 38.19 3n5d h ILE 116 CO 0.15 0.00 0.32 0.00 0.00 0.00 0.00 178.15 178.62 3n5d h ALA 117 N 0.61 0.72 0.00 1.87 0.00 -1.08 -2.27 119.26 119.11 3n5d h ALA 117 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3n5d h ALA 117 Cb 0.21 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3n5d h ALA 117 CO 0.01 0.02 -0.10 0.00 0.00 0.00 0.00 179.25 179.17 3n5d h ALA 118 N 1.27 1.00 0.00 0.00 0.00 -0.82 -3.45 119.26 117.26 3n5d h ALA 118 Ca 0.23 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3n5d h ALA 118 Cb 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3n5d h ALA 118 CO -0.12 0.12 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3n5d n GLY 119 N 0.24 0.43 3.56 0.00 0.00 -0.34 -4.89 105.19 104.19 3n5d n GLY 119 Ca 0.01 -0.99 -0.09 0.00 0.00 0.00 0.00 46.02 44.95 3n5d n GLY 119 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3n5d s LYS 120 N -2.21 0.61 0.66 1.61 -2.85 -0.86 -5.04 119.74 111.65 3n5d s LYS 120 Ca 0.00 -0.01 -0.11 0.00 -1.00 0.00 0.00 55.97 54.85 3n5d s LYS 120 Cb 0.00 0.28 -0.02 0.00 -2.06 0.00 0.00 37.83 36.04 3n5d s LYS 120 CO 0.00 -0.22 1.05 -1.25 0.10 0.00 0.00 175.35 175.03 3n5d s PRO 121 N -1.81 3.27 0.00 1.78 0.04 -1.26 -4.57 135.00 132.44 3n5d s PRO 121 Ca 0.02 0.80 0.23 0.00 0.04 0.00 0.00 61.00 62.08 3n5d s PRO 121 Cb -0.01 -2.04 0.97 0.00 0.04 0.00 0.00 34.50 33.46 3n5d s PRO 121 CO -0.02 -0.82 1.72 2.89 0.04 0.00 0.00 177.00 180.81 3n5d n ARG 122 N -2.92 0.00 0.17 4.56 1.85 -1.26 -1.76 116.66 117.30 3n5d n ARG 122 Ca 0.07 0.11 0.19 0.00 -1.00 0.00 0.00 57.85 57.21 3n5d n ARG 122 Cb 0.54 -1.50 0.79 0.00 -1.05 0.00 0.00 32.46 31.24 3n5d n ARG 122 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 3n5d h GLU 123 N 0.00 0.00 -0.26 2.89 3.07 -1.92 -2.47 114.58 115.88 3n5d h GLU 123 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3n5d h GLU 123 Cb 0.39 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.30 3n5d h GLU 123 CO 0.00 0.00 0.00 1.63 -1.40 0.00 0.00 179.01 179.24 3n5d n LYS 124 N -3.56 2.30 -3.74 2.33 5.02 -0.72 -4.66 118.16 115.12 3n5d n LYS 124 Ca 0.04 -1.82 -0.38 0.00 -2.02 0.00 0.00 58.31 54.13 3n5d n LYS 124 Cb 0.49 -1.25 -0.12 0.00 -0.02 0.00 0.00 35.03 34.12 3n5d n LYS 124 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3n5d s ILE 125 N -0.98 3.97 0.57 -0.18 1.01 -0.93 -4.99 121.20 119.67 3n5d s ILE 125 Ca 0.20 -0.89 -0.21 0.00 0.00 0.00 0.00 60.65 59.75 3n5d s ILE 125 Cb 0.11 -3.15 -0.04 0.00 0.01 0.00 0.00 42.46 39.40 3n5d s ILE 125 CO 0.15 -0.06 1.35 -2.84 0.00 0.00 0.00 174.94 173.53 3n5d s PRO 126 N 1.47 3.01 0.19 2.79 0.02 -1.26 -4.43 135.00 136.78 3n5d s PRO 126 Ca 0.01 2.20 0.06 0.00 0.02 0.00 0.00 61.00 63.29 3n5d s PRO 126 Cb -0.18 -2.17 -0.05 0.00 0.02 0.00 0.00 34.50 32.12 3n5d s PRO 126 CO 0.03 -1.28 -0.12 0.96 -0.33 0.00 0.00 177.00 176.26 3n5d s ILE 127 N -1.32 1.47 -5.00 2.83 -4.36 -0.46 -4.85 121.20 109.51 3n5d s ILE 127 Ca 0.74 -2.14 0.00 0.00 -0.26 0.00 0.00 60.65 58.99 3n5d s ILE 127 Cb -0.40 -2.00 0.00 0.00 1.25 0.00 0.00 42.46 41.31 3n5d s ILE 127 CO 0.46 -0.63 0.00 0.61 0.24 0.00 0.00 174.94 175.62 3n5d n GLY 128 N -0.32 -1.83 0.25 6.27 0.00 -1.26 -1.64 105.19 106.66 3n5d n GLY 128 Ca -0.09 -1.45 -0.11 0.00 0.00 0.00 0.00 46.02 44.37 3n5d n GLY 128 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3n5d h LEU 129 N 0.00 0.87 -1.02 0.99 3.38 -1.62 -1.26 115.31 116.64 3n5d h LEU 129 Ca 0.00 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.56 3n5d h LEU 129 Cb 0.00 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 3n5d h LEU 129 CO 0.00 1.03 0.20 -0.65 0.09 0.00 0.00 178.44 179.11 3n5d h PRO 130 N 0.69 0.91 -0.61 1.13 0.11 -1.77 -1.24 132.00 131.22 3n5d h PRO 130 Ca 0.11 -0.17 -0.05 0.00 0.11 0.00 0.00 66.00 66.01 3n5d h PRO 130 Cb 0.65 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.58 3n5d h PRO 130 CO 0.04 0.77 0.19 0.00 -0.21 0.00 0.00 178.00 178.80 3n5d h ALA 131 N 1.33 1.18 -0.67 -0.75 0.00 -1.84 -2.13 119.26 116.38 3n5d h ALA 131 Ca 0.20 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 54.98 3n5d h ALA 131 Cb 0.24 -0.25 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 3n5d h ALA 131 CO -0.01 0.57 0.37 1.25 0.00 0.00 0.00 179.25 181.43 3n5d h LEU 132 N 0.90 0.54 -1.00 0.00 5.85 -0.80 0.65 115.31 121.45 3n5d h LEU 132 Ca 0.20 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.97 3n5d h LEU 132 Cb 0.26 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.17 3n5d h LEU 132 CO -0.01 0.35 0.66 -0.78 -0.34 0.00 0.00 178.44 178.32 3n5d h ASP 133 N 0.68 1.13 0.31 1.25 3.58 -0.61 -0.86 116.42 121.90 3n5d h ASP 133 Ca 0.31 -0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.72 3n5d h ASP 133 Cb 0.21 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 40.99 3n5d h ASP 133 CO -0.19 0.80 -0.15 0.74 -2.88 0.00 0.00 179.24 177.56 3n5d h THR 134 N 1.32 0.70 -0.49 2.25 2.02 -1.02 -2.10 112.91 115.61 3n5d h THR 134 Ca 0.38 -0.06 0.05 0.00 0.77 0.00 0.00 66.41 67.55 3n5d h THR 134 Cb -0.10 0.74 -0.09 0.00 -1.74 0.00 0.00 68.15 66.96 3n5d h THR 134 CO -0.10 0.01 -0.56 0.00 0.37 0.00 0.00 175.52 175.25 3n5d h ALA 135 N 0.24 -0.75 -0.59 6.16 0.00 -0.59 0.10 119.26 123.83 3n5d h ALA 135 Ca -0.04 0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.00 3n5d h ALA 135 Cb 0.34 1.16 -0.11 0.00 0.00 0.00 0.00 17.79 19.19 3n5d h ALA 135 CO 0.07 -1.04 -0.09 0.82 0.00 0.00 0.00 179.25 179.01 3n5d h ILE 136 N -0.34 0.45 -0.62 0.00 2.04 -1.16 -1.84 117.51 116.05 3n5d h ILE 136 Ca 0.08 -0.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.89 3n5d h ILE 136 Cb 0.57 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 3n5d h ILE 136 CO -0.64 0.01 0.21 0.28 0.00 0.00 0.00 178.15 178.01 3n5d h SER 137 N 0.04 0.89 -0.95 1.72 0.02 -0.42 -2.30 113.55 112.54 3n5d h SER 137 Ca 0.29 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3n5d h SER 137 Cb 0.46 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.72 3n5d h SER 137 CO -0.57 0.85 0.59 0.74 -1.14 0.00 0.00 176.83 177.30 3n5d h THR 138 N 0.88 1.25 0.00 -2.27 2.02 -0.38 -2.48 112.91 111.94 3n5d h THR 138 Ca 0.20 -0.52 0.00 0.00 0.77 0.00 0.00 66.41 66.86 3n5d h THR 138 Cb 0.26 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.57 3n5d h THR 138 CO -0.01 0.26 0.00 0.18 0.37 0.00 0.00 175.52 176.32 3n5d n LEU 139 N -4.36 0.77 0.26 2.58 4.77 -0.73 -2.36 117.00 117.92 3n5d n LEU 139 Ca 0.11 0.63 0.11 0.00 -0.03 0.00 0.00 56.01 56.82 3n5d n LEU 139 Cb 0.04 -0.45 0.69 0.00 -2.33 0.00 0.00 43.42 41.37 3n5d n LEU 139 CO 0.38 -0.39 0.98 -0.07 -1.33 0.00 0.00 177.39 176.96 3n5d h LEU 140 N 0.00 0.00 -7.84 2.23 3.38 -1.11 -3.42 115.31 108.56 3n5d h LEU 140 Ca 0.00 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.58 3n5d h LEU 140 Cb 0.55 0.00 -0.32 0.00 0.09 0.00 0.00 40.66 40.98 3n5d h LEU 140 CO 0.00 0.11 -0.77 -1.00 0.09 0.00 0.00 178.44 176.87 3n5d s HIS 141 N -4.46 0.69 0.11 1.13 3.76 -1.00 -4.88 115.29 110.64 3n5d s HIS 141 Ca -0.04 -0.17 -0.31 0.00 -0.15 0.00 0.00 55.06 54.40 3n5d s HIS 141 Cb 0.15 -0.55 -0.10 0.00 1.11 0.00 0.00 32.58 33.18 3n5d s HIS 141 CO 0.62 -0.11 1.87 0.98 -0.85 0.00 0.00 174.74 177.24 3n5d n TYR 142 N 3.57 2.61 -3.28 1.40 9.36 -1.26 -4.93 117.16 124.62 3n5d n TYR 142 Ca -0.21 -0.19 -0.08 0.00 3.32 0.00 0.00 57.90 60.75 3n5d n TYR 142 Cb 0.53 -2.75 -0.05 0.00 -0.63 0.00 0.00 39.34 36.45 3n5d n TYR 142 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 3n5d s ASP 143 N 3.02 0.06 0.38 2.98 -1.08 -1.26 -5.06 116.67 115.70 3n5d s ASP 143 Ca 0.83 -0.56 0.05 0.00 -0.52 0.00 0.00 52.55 52.35 3n5d s ASP 143 Cb -0.47 1.22 0.75 0.00 -1.46 0.00 0.00 42.92 42.96 3n5d s ASP 143 CO 0.38 -0.31 2.02 0.77 0.52 0.00 0.00 175.17 178.55 3n5d h SER 144 N 7.83 0.61 -0.03 -0.34 4.64 -1.98 0.18 113.55 124.46 3n5d h SER 144 Ca -0.04 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 3n5d h SER 144 Cb 1.12 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 63.06 3n5d h SER 144 CO 0.22 0.43 -0.00 0.74 -0.87 0.00 0.00 176.83 177.35 3n5d h THR 145 N 0.72 1.27 -0.28 2.95 2.02 -1.97 -2.39 112.91 115.23 3n5d h THR 145 Ca 0.22 -0.83 -0.10 0.00 0.77 0.00 0.00 66.41 66.47 3n5d h THR 145 Cb -0.01 1.77 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 3n5d h THR 145 CO -0.05 0.22 -0.26 0.00 0.37 0.00 0.00 175.52 175.80 3n5d h ALA 146 N 0.67 1.02 -0.42 6.16 0.00 -1.80 -2.77 119.26 122.13 3n5d h ALA 146 Ca 0.01 -0.36 0.04 0.00 0.00 0.00 0.00 54.91 54.60 3n5d h ALA 146 Cb 0.36 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3n5d h ALA 146 CO 0.00 0.59 0.28 0.00 0.00 0.00 0.00 179.25 180.12 3n5d h ALA 147 N 1.23 1.88 -0.28 0.00 0.00 -0.59 -1.55 119.26 119.95 3n5d h ALA 147 Ca 0.07 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3n5d h ALA 147 Cb 0.71 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3n5d h ALA 147 CO 0.05 0.06 0.08 0.00 0.00 0.00 0.00 179.25 179.44 3n5d h ALA 148 N 1.76 0.37 -0.44 0.00 0.00 -1.12 0.42 119.26 120.24 3n5d h ALA 148 Ca 0.18 -0.16 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 3n5d h ALA 148 Cb 0.19 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3n5d h ALA 148 CO -0.04 0.02 -0.17 0.78 0.00 0.00 0.00 179.25 179.84 3n5d h GLY 149 N 0.29 0.92 0.96 0.00 0.00 -1.60 -1.63 103.07 102.01 3n5d h GLY 149 Ca 0.09 -0.75 -0.02 0.00 0.00 0.00 0.00 47.33 46.65 3n5d h GLY 149 CO -0.00 0.69 0.22 0.00 0.00 0.00 0.00 176.54 177.45 3n5d h ALA 150 N 1.06 0.58 -0.74 3.60 0.00 -0.83 -2.03 119.26 120.89 3n5d h ALA 150 Ca 0.11 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3n5d h ALA 150 Cb 0.69 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 3n5d h ALA 150 CO 0.05 0.14 0.27 -0.07 0.00 0.00 0.00 179.25 179.65 3n5d h LEU 151 N 0.59 1.03 -0.83 0.00 3.38 -0.78 0.13 115.31 118.83 3n5d h LEU 151 Ca 0.16 -0.17 0.11 0.00 0.09 0.00 0.00 57.88 58.06 3n5d h LEU 151 Cb 0.11 -0.27 -0.08 0.00 0.09 0.00 0.00 40.66 40.52 3n5d h LEU 151 CO -0.02 0.93 0.46 -0.07 0.09 0.00 0.00 178.44 179.84 3n5d h LEU 152 N 1.08 0.64 -0.16 1.67 3.38 -0.99 0.11 115.31 121.05 3n5d h LEU 152 Ca 0.25 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.23 3n5d h LEU 152 Cb 0.24 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 3n5d h LEU 152 CO -0.02 0.35 -0.07 0.58 0.09 0.00 0.00 178.44 179.37 3n5d h VAL 153 N 0.75 1.31 -0.60 1.22 2.07 -0.66 -2.79 116.25 117.55 3n5d h VAL 153 Ca 0.41 -1.11 -0.06 0.00 0.82 0.00 0.00 66.70 66.76 3n5d h VAL 153 Cb 0.42 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 3n5d h VAL 153 CO -0.27 0.33 0.11 0.25 0.02 0.00 0.00 177.57 178.01 3n5d h LEU 154 N 0.02 0.90 -0.06 2.57 5.85 -0.32 -1.57 115.31 122.69 3n5d h LEU 154 Ca 0.04 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.56 3n5d h LEU 154 Cb 0.54 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.33 3n5d h LEU 154 CO 0.02 0.89 0.01 0.40 -0.34 0.00 0.00 178.44 179.43 3n5d h ILE 155 N 0.90 1.22 -0.85 4.05 2.04 -0.81 -2.13 117.51 121.93 3n5d h ILE 155 Ca 0.19 -0.66 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 3n5d h ILE 155 Cb 0.37 1.54 -0.04 0.00 -0.74 0.00 0.00 36.82 37.95 3n5d h ILE 155 CO 0.01 0.18 0.50 1.56 0.00 0.00 0.00 178.15 180.40 3n5d h GLN 156 N -0.14 1.16 -0.01 2.37 4.20 -1.35 -0.65 115.11 120.69 3n5d h GLN 156 Ca 0.02 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.62 3n5d h GLN 156 Cb 0.28 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 27.82 3n5d h GLN 156 CO 0.00 0.82 -0.13 0.25 -0.67 0.00 0.00 178.83 179.10 3n5d n THR 157 N -4.36 0.00 0.04 -0.54 -2.24 -0.60 -2.67 114.28 103.91 3n5d n THR 157 Ca 0.09 -0.13 -0.00 0.00 -2.27 0.00 0.00 64.05 61.74 3n5d n THR 157 Cb 0.07 0.19 -0.00 0.00 -2.10 0.00 0.00 70.33 68.49 3n5d n THR 157 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3n5d n THR 158 N -0.58 1.17 0.01 4.28 -2.24 -0.81 -4.72 114.28 111.39 3n5d n THR 158 Ca 0.15 0.38 -0.18 0.00 -2.27 0.00 0.00 64.05 62.13 3n5d n THR 158 Cb 0.31 -1.57 -0.11 0.00 -2.10 0.00 0.00 70.33 66.85 3n5d n THR 158 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3n5d h ALA 159 N -0.03 0.08 -0.28 6.98 0.00 -1.35 -2.16 119.26 122.50 3n5d h ALA 159 Ca 0.00 -0.60 -0.15 0.00 0.00 0.00 0.00 54.91 54.17 3n5d h ALA 159 Cb 0.03 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3n5d h ALA 159 CO 0.00 0.42 -0.43 0.93 0.00 0.00 0.00 179.25 180.17 3n5d h GLU 160 N -0.02 0.68 -0.92 0.00 4.39 -1.40 -1.64 114.58 115.68 3n5d h GLU 160 Ca -0.09 -0.37 0.00 0.00 0.34 0.00 0.00 59.36 59.25 3n5d h GLU 160 Cb 1.40 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 30.02 3n5d h GLU 160 CO 0.14 0.98 0.58 0.00 -1.16 0.00 0.00 179.01 179.54 3n5d h ALA 161 N 0.97 1.17 -0.41 3.43 0.00 -1.59 -1.60 119.26 121.23 3n5d h ALA 161 Ca 0.04 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 3n5d h ALA 161 Cb 0.96 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3n5d h ALA 161 CO 0.09 0.61 0.01 0.00 0.00 0.00 0.00 179.25 179.95 3n5d h ALA 162 N 1.32 1.25 -0.10 0.00 0.00 -1.01 -3.13 119.26 117.58 3n5d h ALA 162 Ca 0.33 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.83 3n5d h ALA 162 Cb -0.09 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 3n5d h ALA 162 CO -0.07 0.50 -0.70 0.00 0.00 0.00 0.00 179.25 178.99 3n5d h ARG 163 N 0.62 0.44 -4.01 0.00 3.08 -0.97 -3.41 114.38 110.14 3n5d h ARG 163 Ca 0.13 -0.35 -0.42 0.00 0.07 0.00 0.00 59.98 59.41 3n5d h ARG 163 Cb 0.38 0.07 -0.35 0.00 0.08 0.00 0.00 29.97 30.15 3n5d h ARG 163 CO 0.01 0.98 -0.78 -0.06 -1.07 0.00 0.00 179.97 179.05 3n5d s PHE 164 N -3.69 0.81 0.32 3.04 0.08 -0.63 0.10 117.98 118.00 3n5d s PHE 164 Ca -0.06 -0.24 0.05 0.00 0.12 0.00 0.00 56.93 56.80 3n5d s PHE 164 Cb 0.11 -0.74 0.53 0.00 -0.57 0.00 0.00 43.02 42.35 3n5d s PHE 164 CO 0.84 -0.23 1.78 -0.22 -0.10 0.00 0.00 175.22 177.29 3n5d h LYS 165 N 7.41 0.39 -0.69 0.44 3.64 -0.71 0.42 116.57 127.47 3n5d h LYS 165 Ca -0.34 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 3n5d h LYS 165 Cb 1.15 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.90 3n5d h LYS 165 CO 0.43 0.59 0.43 -0.92 -2.27 0.00 0.00 179.45 177.71 3n5d h TYR 166 N 0.35 0.88 0.04 1.91 3.20 -1.91 -1.54 116.97 119.90 3n5d h TYR 166 Ca 0.06 0.01 -0.23 0.00 3.14 0.00 0.00 58.73 61.71 3n5d h TYR 166 Cb 0.58 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.54 3n5d h TYR 166 CO 0.01 0.58 -1.01 0.82 -1.64 0.00 0.00 178.16 176.92 3n5d h ILE 167 N 0.94 1.51 -0.53 1.81 2.04 -1.22 -0.04 117.51 122.02 3n5d h ILE 167 Ca 0.25 -2.82 0.04 0.00 1.00 0.00 0.00 64.86 63.33 3n5d h ILE 167 Cb -0.07 2.65 -0.04 0.00 -0.74 0.00 0.00 36.82 38.62 3n5d h ILE 167 CO -0.05 0.82 0.28 -0.08 0.00 0.00 0.00 178.15 179.12 3n5d h GLU 168 N 0.10 0.52 -0.66 2.37 4.81 -1.09 -1.70 114.58 118.94 3n5d h GLU 168 Ca -0.07 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.05 3n5d h GLU 168 Cb 1.69 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.93 3n5d h GLU 168 CO 0.16 0.35 0.11 1.96 -0.73 0.00 0.00 179.01 180.86 3n5d h GLN 169 N 0.54 1.07 -0.47 1.92 4.20 -0.60 -1.26 115.11 120.50 3n5d h GLN 169 Ca 0.23 -0.28 0.08 0.00 0.06 0.00 0.00 58.65 58.74 3n5d h GLN 169 Cb 0.12 -0.13 -0.06 0.00 0.30 0.00 0.00 27.48 27.71 3n5d h GLN 169 CO -0.15 0.98 0.11 1.96 -0.67 0.00 0.00 178.83 181.06 3n5d h GLN 170 N 1.01 0.24 -0.61 1.46 1.08 -0.56 -0.77 115.11 116.95 3n5d h GLN 170 Ca 0.20 -0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.33 3n5d h GLN 170 Cb 0.42 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.77 3n5d h GLN 170 CO 0.01 0.16 0.17 0.82 -0.95 0.00 0.00 178.83 179.05 3n5d h ILE 171 N 0.25 1.25 -0.27 2.54 1.08 -0.86 -2.26 117.51 119.24 3n5d h ILE 171 Ca 0.23 -0.87 -0.03 0.00 -0.39 0.00 0.00 64.86 63.80 3n5d h ILE 171 Cb 0.29 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 34.68 3n5d h ILE 171 CO -0.29 0.33 0.02 1.56 -0.69 0.00 0.00 178.15 179.08 3n5d h GLN 172 N 0.88 0.40 0.00 2.37 4.20 -0.95 0.67 115.11 122.69 3n5d h GLN 172 Ca 0.20 -0.07 -0.06 0.00 0.06 0.00 0.00 58.65 58.78 3n5d h GLN 172 Cb 0.32 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 3n5d h GLN 172 CO -0.00 0.41 -0.26 0.93 -0.67 0.00 0.00 178.83 179.23 3n5d h GLU 173 N 0.39 0.00 -0.84 1.46 5.08 -0.63 -2.88 114.58 117.16 3n5d h GLU 173 Ca 0.09 0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 57.97 3n5d h GLU 173 Cb 0.23 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 29.21 3n5d h GLU 173 CO 0.00 0.26 0.45 0.54 -1.00 0.00 0.00 179.01 179.27 3n5d n ARG 174 N -3.71 2.34 0.24 2.33 1.74 0.20 -4.69 116.66 115.12 3n5d n ARG 174 Ca -0.01 -3.19 0.08 0.00 -0.77 0.00 0.00 57.85 53.96 3n5d n ARG 174 Cb 0.37 -2.13 0.61 0.00 -1.02 0.00 0.00 32.46 30.29 3n5d n ARG 174 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3n5d h ALA 175 N 1.31 1.65 0.00 7.54 0.00 -1.25 -2.27 119.26 126.24 3n5d h ALA 175 Ca 0.52 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3n5d h ALA 175 Cb 2.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.80 3n5d h ALA 175 CO 1.04 0.15 0.00 0.66 0.00 0.00 0.00 179.25 181.10 3n5d n TYR 176 N -4.18 0.00 -3.57 0.00 4.01 -1.26 -4.31 117.16 107.84 3n5d n TYR 176 Ca -0.02 -0.03 -0.11 0.00 -0.16 0.00 0.00 57.90 57.58 3n5d n TYR 176 Cb 0.20 -0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.12 3n5d n TYR 176 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 3n5d s ARG 177 N -0.05 0.26 0.67 -0.72 3.52 -1.25 -4.94 118.95 116.45 3n5d s ARG 177 Ca 0.00 0.76 -0.15 0.00 -0.13 0.00 0.00 55.73 56.20 3n5d s ARG 177 Cb 0.00 -0.11 0.01 0.00 -1.56 0.00 0.00 34.95 33.29 3n5d s ARG 177 CO 0.00 -0.39 1.14 -0.51 -0.81 0.00 0.00 175.30 174.73 3n5d s ASP 178 N 2.51 4.86 -0.01 -2.12 1.01 -1.26 -4.46 116.67 117.20 3n5d s ASP 178 Ca 0.03 2.12 -0.17 0.00 0.71 0.00 0.00 52.55 55.24 3n5d s ASP 178 Cb -0.13 -2.56 0.03 0.00 1.01 0.00 0.00 42.92 41.26 3n5d s ASP 178 CO -0.12 -1.80 0.36 -0.70 0.21 0.00 0.00 175.17 173.11 3n5d s GLU 179 N -3.99 0.74 0.67 8.23 2.12 -0.65 -4.87 118.70 120.94 3n5d s GLU 179 Ca 0.69 -0.18 -0.17 0.00 0.36 0.00 0.00 54.97 55.67 3n5d s GLU 179 Cb -0.23 0.33 -0.00 0.00 0.26 0.00 0.00 34.13 34.49 3n5d s GLU 179 CO 0.42 -0.21 1.18 1.33 -0.54 0.00 0.00 175.26 177.44 3n5d n VAL 180 N 1.12 4.12 -2.08 3.70 0.24 -1.26 -1.36 118.33 122.81 3n5d n VAL 180 Ca -0.21 -0.44 -0.36 0.00 -2.04 0.00 0.00 64.34 61.29 3n5d n VAL 180 Cb 0.57 -1.35 0.02 0.00 -1.47 0.00 0.00 33.84 31.61 3n5d n VAL 180 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3n5d s PRO 181 N -3.37 3.08 0.78 7.34 0.04 -1.26 -4.82 135.00 136.80 3n5d s PRO 181 Ca 0.79 1.77 -0.11 0.00 0.04 0.00 0.00 61.00 63.50 3n5d s PRO 181 Cb -0.37 -1.95 0.06 0.00 0.04 0.00 0.00 34.50 32.28 3n5d s PRO 181 CO 0.44 -1.10 1.10 -1.54 0.04 0.00 0.00 177.00 175.93 3n5d s SER 182 N -1.64 4.38 0.49 6.66 1.04 -1.26 -4.87 113.70 118.51 3n5d s SER 182 Ca 0.76 1.86 0.23 0.00 0.48 0.00 0.00 55.95 59.28 3n5d s SER 182 Cb -0.29 -2.53 1.27 0.00 0.10 0.00 0.00 66.02 64.58 3n5d s SER 182 CO 0.31 -2.12 2.03 0.77 0.98 0.00 0.00 173.24 175.21 3n5d h SER 183 N -1.16 0.00 -0.57 7.02 4.64 -1.94 -1.56 113.55 119.98 3n5d h SER 183 Ca -0.44 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 60.95 3n5d h SER 183 Cb 1.23 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.27 3n5d h SER 183 CO 0.51 0.16 0.26 0.00 -0.87 0.00 0.00 176.83 176.88 3n5d h ALA 184 N 1.84 0.74 -0.23 5.18 0.00 -1.79 0.12 119.26 125.13 3n5d h ALA 184 Ca -0.00 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.97 3n5d h ALA 184 Cb 0.36 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3n5d h ALA 184 CO 0.02 -0.12 0.12 1.15 0.00 0.00 0.00 179.25 180.42 3n5d h THR 185 N 0.48 1.01 -0.13 0.00 2.02 -1.62 0.23 112.91 114.90 3n5d h THR 185 Ca 0.27 -0.09 0.04 0.00 0.77 0.00 0.00 66.41 67.40 3n5d h THR 185 Cb 0.26 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.36 3n5d h THR 185 CO -0.23 0.05 -0.10 0.40 0.37 0.00 0.00 175.52 176.00 3n5d h ILE 186 N 0.25 0.70 -0.30 3.11 1.08 -1.18 -1.91 117.51 119.27 3n5d h ILE 186 Ca 0.09 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.63 3n5d h ILE 186 Cb 0.01 0.70 -0.07 0.00 -3.07 0.00 0.00 36.82 34.39 3n5d h ILE 186 CO -0.05 0.00 -0.21 -1.28 -0.69 0.00 0.00 178.15 175.92 3n5d h SER 187 N -0.12 -0.67 -0.19 1.72 0.87 -0.40 -0.50 113.55 114.25 3n5d h SER 187 Ca 0.08 0.14 0.01 0.00 -1.23 0.00 0.00 61.79 60.79 3n5d h SER 187 Cb 0.24 0.34 -0.01 0.00 -0.44 0.00 0.00 62.40 62.52 3n5d h SER 187 CO -0.20 -0.24 0.10 -0.07 -0.53 0.00 0.00 176.83 175.89 3n5d h LEU 188 N -0.18 0.16 -0.44 2.23 3.38 -0.79 -0.81 115.31 118.86 3n5d h LEU 188 Ca 0.16 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.22 3n5d h LEU 188 Cb 0.42 -0.03 -0.09 0.00 0.09 0.00 0.00 40.66 41.05 3n5d h LEU 188 CO -0.40 0.12 -0.15 -0.33 0.09 0.00 0.00 178.44 177.77 3n5d h GLU 189 N 0.22 -0.05 0.00 1.13 5.08 -1.17 -1.14 114.58 118.64 3n5d h GLU 189 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3n5d h GLU 189 Cb 0.00 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3n5d h GLU 189 CO -0.04 -0.03 0.00 -0.91 -1.00 0.00 0.00 179.01 177.02 3n5d h ASN 190 N -0.05 0.00 -0.25 1.42 2.35 -0.45 -3.17 115.58 115.43 3n5d h ASN 190 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 3n5d h ASN 190 Cb 0.38 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.75 3n5d h ASN 190 CO -0.48 0.00 0.00 -1.20 -1.65 0.00 0.00 177.43 174.10 3n5d n SER 191 N -2.95 2.89 -0.02 5.81 7.64 -0.37 -4.70 113.62 121.91 3n5d n SER 191 Ca -0.00 -1.85 -0.11 0.00 1.01 0.00 0.00 58.87 57.93 3n5d n SER 191 Cb 0.22 -0.16 -0.04 0.00 -1.01 0.00 0.00 64.21 63.21 3n5d n SER 191 CO 0.00 0.00 0.00 -0.25 -3.01 0.00 0.00 175.04 171.78 3n5d h TRP 192 N 3.30 0.19 0.24 1.43 7.01 -1.38 0.27 115.95 127.01 3n5d h TRP 192 Ca 0.00 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.00 3n5d h TRP 192 Cb 0.78 -0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 27.77 3n5d h TRP 192 CO 0.16 0.14 -0.20 1.03 -2.79 0.00 0.00 178.44 176.78 3n5d h SER 193 N 0.19 -0.52 -0.69 2.65 0.87 -1.85 -1.06 113.55 113.14 3n5d h SER 193 Ca 0.05 0.04 0.11 0.00 -1.23 0.00 0.00 61.79 60.77 3n5d h SER 193 Cb -0.00 0.17 -0.08 0.00 -0.44 0.00 0.00 62.40 62.05 3n5d h SER 193 CO -0.01 -0.30 0.29 1.23 -0.53 0.00 0.00 176.83 177.50 3n5d h GLY 194 N -0.45 1.02 1.02 5.77 0.00 -1.76 -1.18 103.07 107.49 3n5d h GLY 194 Ca -0.01 -0.16 -0.08 0.00 0.00 0.00 0.00 47.33 47.08 3n5d h GLY 194 CO -0.02 -0.02 0.01 1.41 0.00 0.00 0.00 176.54 177.91 3n5d h LEU 195 N 0.48 0.89 -0.72 3.11 3.38 -0.41 -1.80 115.31 120.24 3n5d h LEU 195 Ca 0.36 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 58.04 3n5d h LEU 195 Cb 0.46 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 3n5d h LEU 195 CO -0.33 0.98 0.47 0.28 0.09 0.00 0.00 178.44 179.93 3n5d h SER 196 N 0.78 0.80 -0.39 -0.43 0.02 -0.85 -1.17 113.55 112.32 3n5d h SER 196 Ca 0.15 -0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.01 3n5d h SER 196 Cb 0.52 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 3n5d h SER 196 CO 0.03 0.57 -0.04 0.50 -1.14 0.00 0.00 176.83 176.74 3n5d h LYS 197 N 0.94 0.71 -0.00 3.45 3.64 -1.07 -2.65 116.57 121.59 3n5d h LYS 197 Ca 0.27 -0.25 -0.11 0.00 -1.27 0.00 0.00 60.65 59.30 3n5d h LYS 197 Cb -0.06 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 3n5d h LYS 197 CO -0.08 0.83 -0.52 1.96 -2.27 0.00 0.00 179.45 179.37 3n5d h GLN 198 N 0.52 0.01 -0.26 1.90 1.08 -1.11 -0.74 115.11 116.51 3n5d h GLN 198 Ca 0.10 -0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.17 3n5d h GLN 198 Cb 0.53 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.96 3n5d h GLN 198 CO 0.03 0.53 -0.32 0.82 -0.95 0.00 0.00 178.83 178.93 3n5d h ILE 199 N 0.01 1.31 -0.51 2.54 2.04 -1.23 -1.86 117.51 119.81 3n5d h ILE 199 Ca -0.00 -1.51 -0.10 0.00 1.00 0.00 0.00 64.86 64.25 3n5d h ILE 199 Cb 0.93 1.66 -0.02 0.00 -0.74 0.00 0.00 36.82 38.65 3n5d h ILE 199 CO 0.07 0.48 -0.07 1.56 0.00 0.00 0.00 178.15 180.18 3n5d h GLN 200 N 0.41 0.92 0.00 2.37 4.20 -1.12 -2.92 115.11 118.98 3n5d h GLN 200 Ca 0.03 -0.31 -0.04 0.00 0.06 0.00 0.00 58.65 58.40 3n5d h GLN 200 Cb 0.90 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.60 3n5d h GLN 200 CO 0.08 0.96 -0.18 -0.07 -0.67 0.00 0.00 178.83 178.95 3n5d h LEU 201 N 0.84 0.00 -1.00 1.46 3.38 -1.07 -2.49 115.31 116.42 3n5d h LEU 201 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3n5d h LEU 201 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3n5d h LEU 201 CO 0.04 0.18 0.00 0.00 0.09 0.00 0.00 178.44 178.75 3n5d h ALA 202 N 1.82 1.00 -0.82 1.53 0.00 -1.13 -3.24 119.26 118.42 3n5d h ALA 202 Ca -0.00 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.92 3n5d h ALA 202 Cb 0.64 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 3n5d h ALA 202 CO 0.02 0.00 0.54 1.96 0.00 0.00 0.00 179.25 181.78 3n5d h GLN 203 N 0.00 1.05 -0.40 0.00 4.20 -1.51 -0.16 115.11 118.29 3n5d h GLN 203 Ca 0.00 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.58 3n5d h GLN 203 Cb 0.41 -0.24 -0.04 0.00 0.30 0.00 0.00 27.48 27.91 3n5d h GLN 203 CO 0.00 0.69 0.04 0.41 -0.67 0.00 0.00 178.83 179.31 3n5d n GLY 204 N -1.41 4.00 1.08 3.46 0.00 -1.22 -4.43 105.19 106.66 3n5d n GLY 204 Ca 0.10 -1.05 0.05 0.00 0.00 0.00 0.00 46.02 45.11 3n5d n GLY 204 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3n5d n ASN 205 N -0.43 1.26 -3.02 1.61 4.05 -0.45 -4.98 115.26 113.31 3n5d n ASN 205 Ca 0.28 -2.74 -0.22 0.00 0.45 0.00 0.00 54.58 52.34 3n5d n ASN 205 Cb 1.04 -0.38 0.04 0.00 1.23 0.00 0.00 39.78 41.71 3n5d n ASN 205 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 3n5d n ASN 206 N -0.18 -6.14 0.00 1.20 3.02 -1.06 -2.07 115.26 110.02 3n5d n ASN 206 Ca 0.11 -0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.36 3n5d n ASN 206 Cb 0.94 -4.94 0.00 0.00 -0.61 0.00 0.00 39.78 35.17 3n5d n ASN 206 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3n5d n GLY 207 N -1.55 0.50 3.74 7.41 0.00 -0.20 -4.99 105.19 110.10 3n5d n GLY 207 Ca -0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 3n5d n GLY 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3n5d s VAL 208 N -2.20 5.30 0.24 1.61 1.01 -0.88 -0.91 120.40 124.58 3n5d s VAL 208 Ca 0.00 0.54 -0.31 0.00 0.00 0.00 0.00 61.98 62.22 3n5d s VAL 208 Cb 0.00 -3.62 -0.11 0.00 0.00 0.00 0.00 36.38 32.65 3n5d s VAL 208 CO 0.00 0.42 1.54 -0.36 0.00 0.00 0.00 175.10 176.70 3n5d s PHE 209 N 0.27 2.94 0.19 5.22 0.40 -0.16 -4.15 117.98 122.69 3n5d s PHE 209 Ca 0.17 0.79 -0.11 0.00 -0.60 0.00 0.00 56.93 57.17 3n5d s PHE 209 Cb -0.13 -3.95 0.11 0.00 0.51 0.00 0.00 43.02 39.56 3n5d s PHE 209 CO 0.04 -3.28 1.80 0.00 0.70 0.00 0.00 175.22 174.49 3n5d h ARG 210 N 5.59 0.91 -4.89 0.44 2.47 -1.88 -3.42 114.38 113.60 3n5d h ARG 210 Ca -0.45 -0.11 -0.60 0.00 -1.26 0.00 0.00 59.98 57.56 3n5d h ARG 210 Cb 1.21 -0.18 -0.34 0.00 -1.65 0.00 0.00 29.97 29.02 3n5d h ARG 210 CO 0.83 0.69 -0.84 0.99 0.56 0.00 0.00 179.97 182.20 3n5d s THR 211 N -5.85 1.59 0.45 2.04 2.01 -1.26 -5.13 115.64 109.49 3n5d s THR 211 Ca -0.13 -0.73 -0.25 0.00 0.31 0.00 0.00 61.69 60.90 3n5d s THR 211 Cb 0.14 -1.42 -0.08 0.00 0.01 0.00 0.00 72.50 71.15 3n5d s THR 211 CO 0.78 0.46 1.34 -2.84 -0.69 0.00 0.00 174.62 173.67 3n5d s PRO 212 N 0.66 3.71 -0.22 4.92 0.02 -1.26 -4.93 135.00 137.91 3n5d s PRO 212 Ca -0.13 2.23 -0.09 0.00 0.02 0.00 0.00 61.00 63.03 3n5d s PRO 212 Cb -0.16 -2.61 -0.04 0.00 0.02 0.00 0.00 34.50 31.71 3n5d s PRO 212 CO 0.04 -0.73 0.10 0.99 -0.33 0.00 0.00 177.00 177.07 3n5d s THR 213 N -1.27 4.93 -0.24 0.99 2.01 -0.66 -4.93 115.64 116.47 3n5d s THR 213 Ca 0.61 0.03 -0.20 0.00 0.31 0.00 0.00 61.69 62.44 3n5d s THR 213 Cb -0.40 -3.27 -0.02 0.00 0.01 0.00 0.00 72.50 68.82 3n5d s THR 213 CO 0.50 0.39 0.60 -0.69 -0.69 0.00 0.00 174.62 174.73 3n5d s VAL 214 N 0.85 5.02 0.34 3.82 1.01 -1.26 0.15 120.40 130.32 3n5d s VAL 214 Ca 0.05 1.07 0.09 0.00 0.00 0.00 0.00 61.98 63.19 3n5d s VAL 214 Cb -0.13 -3.90 -0.06 0.00 0.00 0.00 0.00 36.38 32.29 3n5d s VAL 214 CO 0.03 0.06 -0.04 -0.76 0.00 0.00 0.00 175.10 174.38 3n5d s LEU 215 N 2.33 2.86 -0.17 3.92 1.43 0.74 -4.95 118.68 124.84 3n5d s LEU 215 Ca 0.25 -1.07 -0.11 0.00 -1.03 0.00 0.00 54.13 52.17 3n5d s LEU 215 Cb -0.16 -1.20 -0.05 0.00 0.03 0.00 0.00 46.19 44.81 3n5d s LEU 215 CO 0.09 -0.20 0.20 -0.69 0.23 0.00 0.00 176.35 175.98 3n5d s VAL 216 N -2.55 5.37 0.72 -1.59 1.01 -1.26 0.62 120.40 122.71 3n5d s VAL 216 Ca 0.33 0.35 -0.03 0.00 0.00 0.00 0.00 61.98 62.64 3n5d s VAL 216 Cb 0.01 -3.53 0.11 0.00 0.00 0.00 0.00 36.38 32.96 3n5d s VAL 216 CO 0.18 0.45 1.00 1.51 0.00 0.00 0.00 175.10 178.23 3n5d s ASP 217 N 0.16 4.44 0.24 3.32 1.47 0.20 -4.24 116.67 122.27 3n5d s ASP 217 Ca 0.13 -0.10 -0.04 0.00 1.18 0.00 0.00 52.55 53.71 3n5d s ASP 217 Cb -0.12 -0.37 0.42 0.00 -0.34 0.00 0.00 42.92 42.51 3n5d s ASP 217 CO 0.02 -1.79 1.78 0.28 0.68 0.00 0.00 175.17 176.13 3n5d h SER 218 N -0.56 0.54 0.33 2.11 0.02 -1.97 0.37 113.55 114.38 3n5d h SER 218 Ca -0.40 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 3n5d h SER 218 Cb 1.28 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.79 3n5d h SER 218 CO 0.45 0.28 0.00 1.17 -1.14 0.00 0.00 176.83 177.59 3n5d n LYS 219 N -4.83 0.06 -0.31 3.45 3.00 -1.26 -4.82 118.16 113.46 3n5d n LYS 219 Ca 0.14 0.26 0.00 0.00 -0.00 0.00 0.00 58.31 58.70 3n5d n LYS 219 Cb 0.33 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.86 3n5d n LYS 219 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3n5d n GLY 220 N -0.30 0.84 3.77 3.14 0.00 0.13 -5.07 105.19 107.69 3n5d n GLY 220 Ca 0.04 -0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 3n5d n GLY 220 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3n5d s ASN 221 N -2.04 6.65 0.06 1.61 0.01 -1.24 -4.79 114.94 115.20 3n5d s ASN 221 Ca 0.00 0.77 -0.30 0.00 -0.71 0.00 0.00 52.86 52.62 3n5d s ASN 221 Cb 0.00 -2.24 -0.05 0.00 0.41 0.00 0.00 41.25 39.37 3n5d s ASN 221 CO 0.00 0.15 1.16 -0.60 -1.51 0.00 0.00 177.10 176.30 3n5d s ARG 222 N -0.07 4.46 0.02 -0.60 3.52 -1.26 0.59 118.95 125.61 3n5d s ARG 222 Ca 0.22 1.71 0.00 0.00 -0.13 0.00 0.00 55.73 57.54 3n5d s ARG 222 Cb -0.15 -3.36 -0.02 0.00 -1.56 0.00 0.00 34.95 29.86 3n5d s ARG 222 CO 0.09 -0.21 -0.04 0.54 -0.81 0.00 0.00 175.30 174.88 3n5d s VAL 223 N 1.01 0.17 -0.18 7.11 0.11 0.20 -4.93 120.40 123.90 3n5d s VAL 223 Ca 0.57 -0.87 -0.11 0.00 -2.93 0.00 0.00 61.98 58.64 3n5d s VAL 223 Cb -0.28 -0.30 -0.05 0.00 -1.53 0.00 0.00 36.38 34.22 3n5d s VAL 223 CO 0.29 -0.44 0.20 -1.10 -3.33 0.00 0.00 175.10 170.72 3n5d s GLN 224 N -1.37 4.16 -0.21 1.54 -0.21 -1.26 -0.19 119.66 122.12 3n5d s GLN 224 Ca -0.14 -0.08 -0.09 0.00 0.02 0.00 0.00 55.36 55.07 3n5d s GLN 224 Cb -0.09 -3.40 -0.05 0.00 1.00 0.00 0.00 33.01 30.47 3n5d s GLN 224 CO -0.01 0.32 0.11 0.42 -2.12 0.00 0.00 175.29 174.01 3n5d s ILE 225 N 0.28 5.11 0.00 1.08 -1.09 0.12 -4.97 121.20 121.73 3n5d s ILE 225 Ca 0.12 0.09 0.00 0.00 -2.23 0.00 0.00 60.65 58.63 3n5d s ILE 225 Cb -0.12 -3.34 0.00 0.00 -1.58 0.00 0.00 42.46 37.42 3n5d s ILE 225 CO 0.01 0.41 0.06 0.35 -1.23 0.00 0.00 174.94 174.53 3n5d n THR 226 N 3.90 0.00 -3.73 2.92 -2.24 -1.26 -1.65 114.28 112.22 3n5d n THR 226 Ca -0.16 -0.32 -0.06 0.00 -2.27 0.00 0.00 64.05 61.24 3n5d n THR 226 Cb 0.52 1.06 -0.02 0.00 -2.10 0.00 0.00 70.33 69.80 3n5d n THR 226 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3n5d s ASN 227 N -0.53 -0.26 0.00 3.42 2.20 -1.26 -0.98 114.94 117.53 3n5d s ASN 227 Ca 0.00 -0.38 0.18 0.00 -0.94 0.00 0.00 52.86 51.71 3n5d s ASN 227 Cb 0.00 0.56 1.05 0.00 -2.00 0.00 0.00 41.25 40.85 3n5d s ASN 227 CO 0.00 -1.01 1.46 1.33 -2.94 0.00 0.00 177.10 175.94 3n5d n VAL 228 N -0.43 0.00 0.79 3.54 0.24 -0.08 -2.85 118.33 119.53 3n5d n VAL 228 Ca -0.07 0.00 0.13 0.00 -2.04 0.00 0.00 64.34 62.37 3n5d n VAL 228 Cb 0.61 -0.66 0.48 0.00 -1.47 0.00 0.00 33.84 32.80 3n5d n VAL 228 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3n5d n THR 229 N -0.96 0.33 -1.95 3.34 -2.24 -1.26 -4.35 114.28 107.18 3n5d n THR 229 Ca 0.13 -0.16 -0.37 0.00 -2.27 0.00 0.00 64.05 61.39 3n5d n THR 229 Cb 0.06 -0.51 0.04 0.00 -2.10 0.00 0.00 70.33 67.82 3n5d n THR 229 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3n5d s SER 230 N -3.85 5.17 0.45 3.42 0.01 -1.13 -4.82 113.70 112.95 3n5d s SER 230 Ca 0.12 2.48 0.11 0.00 1.31 0.00 0.00 55.95 59.97 3n5d s SER 230 Cb 0.15 -2.61 1.02 0.00 0.21 0.00 0.00 66.02 64.79 3n5d s SER 230 CO 0.58 -1.62 2.09 0.78 0.41 0.00 0.00 173.24 175.48 3n5d h ASN 231 N 1.00 0.29 -0.60 2.44 2.35 -1.93 -1.20 115.58 117.93 3n5d h ASN 231 Ca -0.51 -0.01 0.10 0.00 -0.55 0.00 0.00 56.30 55.33 3n5d h ASN 231 Cb 1.30 -0.07 -0.07 0.00 0.05 0.00 0.00 38.32 39.53 3n5d h ASN 231 CO 0.55 0.21 0.21 0.58 -1.65 0.00 0.00 177.43 177.34 3n5d h VAL 232 N 0.35 0.76 -0.06 2.81 2.07 -1.96 0.88 116.25 121.09 3n5d h VAL 232 Ca 0.11 -0.13 -0.14 0.00 0.82 0.00 0.00 66.70 67.35 3n5d h VAL 232 Cb 0.00 0.33 0.01 0.00 -1.52 0.00 0.00 31.29 30.12 3n5d h VAL 232 CO -0.02 0.07 -0.52 0.58 0.02 0.00 0.00 177.57 177.70 3n5d h VAL 233 N 0.39 1.39 0.03 2.57 2.07 -1.68 -0.85 116.25 120.17 3n5d h VAL 233 Ca 0.31 -1.91 -0.22 0.00 0.82 0.00 0.00 66.70 65.70 3n5d h VAL 233 Cb 0.39 2.35 -0.01 0.00 -1.52 0.00 0.00 31.29 32.50 3n5d h VAL 233 CO -0.31 0.56 -0.98 0.71 0.02 0.00 0.00 177.57 177.57 3n5d h THR 234 N 0.01 1.52 0.00 2.57 1.35 -1.07 -3.42 112.91 113.88 3n5d h THR 234 Ca -0.05 -2.82 0.00 0.00 -0.55 0.00 0.00 66.41 62.99 3n5d h THR 234 Cb 1.19 2.63 0.00 0.00 -1.73 0.00 0.00 68.15 70.24 3n5d h THR 234 CO 0.11 0.82 -0.97 -1.54 -0.25 0.00 0.00 175.52 173.69 3n5d n SER 235 N -3.59 3.96 0.02 5.36 3.41 0.25 -4.99 113.62 118.04 3n5d n SER 235 Ca -0.04 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.55 3n5d n SER 235 Cb 0.88 0.05 -0.01 0.00 -0.26 0.00 0.00 64.21 64.87 3n5d n SER 235 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 3n5d h ASN 236 N 0.00 -0.10 -3.22 4.04 -0.73 -1.22 -3.44 115.58 110.92 3n5d h ASN 236 Ca 0.00 0.00 -0.53 0.00 1.87 0.00 0.00 56.30 57.65 3n5d h ASN 236 Cb 0.97 0.02 0.06 0.00 0.27 0.00 0.00 38.32 39.64 3n5d h ASN 236 CO 0.00 0.16 0.81 -0.51 -0.37 0.00 0.00 177.43 177.52 3n5d s ILE 237 N -1.80 2.55 -0.51 2.57 2.07 -0.34 -0.09 121.20 125.64 3n5d s ILE 237 Ca -0.02 0.44 0.07 0.00 -1.41 0.00 0.00 60.65 59.74 3n5d s ILE 237 Cb 0.00 -3.28 -0.04 0.00 0.13 0.00 0.00 42.46 39.27 3n5d s ILE 237 CO 0.05 0.06 0.42 0.00 -1.91 0.00 0.00 174.94 173.56 3n5d n GLN 238 N 2.74 3.44 -3.70 3.50 1.13 0.12 -4.89 117.38 119.73 3n5d n GLN 238 Ca 0.09 -0.26 -0.12 0.00 -1.94 0.00 0.00 57.00 54.76 3n5d n GLN 238 Cb 0.39 -0.92 -0.09 0.00 0.11 0.00 0.00 30.24 29.73 3n5d n GLN 238 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3n5d s LEU 239 N -1.89 -0.02 -0.16 1.08 1.43 -1.25 -4.21 118.68 113.66 3n5d s LEU 239 Ca 0.04 1.02 -0.00 0.00 -1.03 0.00 0.00 54.13 54.16 3n5d s LEU 239 Cb 0.06 1.69 -0.00 0.00 0.03 0.00 0.00 46.19 47.97 3n5d s LEU 239 CO 0.24 -0.18 -0.14 -0.76 0.23 0.00 0.00 176.35 175.74 3n5d s LEU 240 N 0.58 2.53 -0.04 1.79 1.43 -0.88 -4.95 118.68 119.14 3n5d s LEU 240 Ca -0.03 -0.46 -0.30 0.00 -1.03 0.00 0.00 54.13 52.32 3n5d s LEU 240 Cb -0.05 -1.59 -0.06 0.00 0.03 0.00 0.00 46.19 44.53 3n5d s LEU 240 CO -0.03 0.07 1.68 -0.22 0.23 0.00 0.00 176.35 178.08 3n5d s LEU 241 N 0.89 4.33 0.17 1.79 2.96 -1.26 -1.01 118.68 126.55 3n5d s LEU 241 Ca -0.04 2.28 -0.34 0.00 -0.22 0.00 0.00 54.13 55.82 3n5d s LEU 241 Cb -0.15 -3.54 -0.14 0.00 0.50 0.00 0.00 46.19 42.86 3n5d s LEU 241 CO -0.01 -0.93 1.45 -3.20 -1.32 0.00 0.00 176.35 172.34 3n5d n ASN 242 N 7.06 2.57 0.32 3.68 2.85 -1.26 -4.48 115.26 126.01 3n5d n ASN 242 Ca 0.17 1.11 0.20 0.00 -0.11 0.00 0.00 54.58 55.96 3n5d n ASN 242 Cb 0.42 -1.36 1.08 0.00 1.24 0.00 0.00 39.78 41.16 3n5d n ASN 242 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 3n5d h THR 243 N 3.34 0.13 -0.04 -0.44 1.35 -1.93 -0.76 112.91 114.56 3n5d h THR 243 Ca -0.45 -0.10 0.01 0.00 -0.55 0.00 0.00 66.41 65.32 3n5d h THR 243 Cb 1.28 1.09 -0.00 0.00 -1.73 0.00 0.00 68.15 68.79 3n5d h THR 243 CO 0.82 0.01 0.13 0.11 -0.25 0.00 0.00 175.52 176.33 3n5d h LYS 244 N 0.00 0.00 -0.58 4.72 1.57 -1.96 -1.34 116.57 118.99 3n5d h LYS 244 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3n5d h LYS 244 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 3n5d h LYS 244 CO 0.00 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 178.97 3n5d n ASN 245 N -3.25 4.94 0.00 0.86 3.02 -0.29 -5.12 115.26 115.42 3n5d n ASN 245 Ca -0.02 -2.65 0.00 0.00 -0.03 0.00 0.00 54.58 51.89 3n5d n ASN 245 Cb 0.20 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 38.77 3n5d n ASN 245 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26