#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n4c n PRO 2 N 0.00 2.57 -3.20 1.61 -0.02 -1.26 -5.04 135.00 129.66 1n4c n PRO 2 Ca 0.00 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1n4c n PRO 2 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.46 1n4c n PRO 2 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1n4c s LEU 3 N 0.00 -1.39 0.00 2.45 2.96 -1.26 -4.96 118.68 116.48 1n4c s LEU 3 Ca 0.00 -0.30 0.00 0.00 -0.22 0.00 0.00 54.13 53.61 1n4c s LEU 3 Cb 0.00 1.79 0.00 0.00 0.50 0.00 0.00 46.19 48.48 1n4c s LEU 3 CO 0.00 -0.27 0.00 0.61 -1.32 0.00 0.00 176.35 175.37 1n4c n GLY 4 N 5.03 0.26 3.70 7.98 0.00 -1.26 -5.14 105.19 115.76 1n4c n GLY 4 Ca 0.07 -0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 1n4c n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1n4c s SER 5 N 0.00 3.54 -1.21 1.61 0.15 -1.26 -4.83 113.70 111.70 1n4c s SER 5 Ca 0.00 2.30 -0.22 0.00 0.70 0.00 0.00 55.95 58.73 1n4c s SER 5 Cb 0.00 -2.58 -0.06 0.00 -1.71 0.00 0.00 66.02 61.67 1n4c s SER 5 CO 0.00 -2.70 1.89 -0.81 1.20 0.00 0.00 173.24 172.83 1n4c n PRO 6 N -3.46 1.94 0.00 5.44 -0.04 -1.26 -4.95 135.00 132.67 1n4c n PRO 6 Ca 0.13 -2.64 0.00 0.00 -0.04 0.00 0.00 63.50 60.95 1n4c n PRO 6 Cb 0.51 -3.68 0.00 0.00 -0.04 0.00 0.00 33.50 30.29 1n4c n PRO 6 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1n4c n GLU 7 N 8.28 1.91 -3.64 0.54 0.28 -1.26 -5.06 120.64 121.69 1n4c n GLU 7 Ca 0.46 0.00 -0.01 0.00 -0.16 0.00 0.00 57.16 57.44 1n4c n GLU 7 Cb 0.46 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 33.29 1n4c n GLU 7 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 1n4c s PHE 8 N 0.00 -1.29 0.00 -1.84 2.19 -1.26 -5.01 117.98 110.76 1n4c s PHE 8 Ca 0.00 2.27 0.00 0.00 0.33 0.00 0.00 56.93 59.53 1n4c s PHE 8 Cb 0.00 0.78 0.00 0.00 -1.31 0.00 0.00 43.02 42.49 1n4c s PHE 8 CO 0.00 -0.64 0.06 -1.13 1.83 0.00 0.00 175.22 175.34 1n4c n SER 9 N 5.32 0.00 -4.48 6.13 3.41 -1.26 -5.13 113.62 117.62 1n4c n SER 9 Ca -0.13 -0.96 -0.37 0.00 -0.26 0.00 0.00 58.87 57.15 1n4c n SER 9 Cb 0.50 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.50 1n4c n SER 9 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 1n4c n MET 10 N 0.00 0.44 0.00 4.33 2.81 -1.26 -4.77 117.12 118.67 1n4c n MET 10 Ca 0.00 0.18 0.00 0.00 -1.81 0.00 0.00 57.70 56.07 1n4c n MET 10 Cb 0.48 -1.80 0.00 0.00 -0.71 0.00 0.00 33.22 31.19 1n4c n MET 10 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1n4c n PRO 11 N -0.44 0.64 -1.53 0.03 -0.04 -1.26 -4.55 135.00 127.86 1n4c n PRO 11 Ca 0.11 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.16 1n4c n PRO 11 Cb 0.49 -1.29 -0.01 0.00 -0.04 0.00 0.00 33.50 32.64 1n4c n PRO 11 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1n4c n HIS 12 N 0.11 3.00 0.00 0.54 8.25 -1.26 -4.89 115.22 120.97 1n4c n HIS 12 Ca 0.00 -2.79 0.00 0.00 -0.26 0.00 0.00 57.72 54.67 1n4c n HIS 12 Cb 0.14 -2.39 0.00 0.00 1.12 0.00 0.00 29.99 28.86 1n4c n HIS 12 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1n4c n SER 13 N 5.74 0.00 -4.64 0.41 2.88 -1.26 -4.93 113.62 111.81 1n4c n SER 13 Ca 0.56 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.75 1n4c n SER 13 Cb 0.35 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 63.90 1n4c n SER 13 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1n4c n SER 14 N 0.00 0.83 -4.57 -3.46 7.64 -1.26 -4.82 113.62 107.98 1n4c n SER 14 Ca 0.00 0.69 -0.31 0.00 1.01 0.00 0.00 58.87 60.25 1n4c n SER 14 Cb 0.00 -1.45 -0.04 0.00 -1.01 0.00 0.00 64.21 61.71 1n4c n SER 14 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1n4c s PRO 15 N -3.43 2.89 0.00 1.43 0.04 -1.26 -4.89 135.00 129.77 1n4c s PRO 15 Ca 0.75 -0.84 0.00 0.00 0.04 0.00 0.00 61.00 60.95 1n4c s PRO 15 Cb -0.35 -5.21 0.00 0.00 0.04 0.00 0.00 34.50 28.98 1n4c s PRO 15 CO 0.48 -3.19 0.17 0.94 0.04 0.00 0.00 177.00 175.45 1n4c n GLN 16 N 8.68 0.00 -2.40 4.56 7.27 -1.26 -4.19 117.38 130.04 1n4c n GLN 16 Ca 0.41 0.07 -0.43 0.00 0.07 0.00 0.00 57.00 57.12 1n4c n GLN 16 Cb 0.48 -0.67 -0.02 0.00 2.41 0.00 0.00 30.24 32.43 1n4c n GLN 16 CO 0.00 0.00 0.00 -0.80 0.07 0.00 0.00 177.06 176.33 1n4c s ASN 17 N -2.42 6.37 0.62 1.69 -0.87 -1.26 -4.98 114.94 114.09 1n4c s ASN 17 Ca 0.00 0.71 -0.19 0.00 -1.57 0.00 0.00 52.86 51.81 1n4c s ASN 17 Cb 0.00 -2.54 -0.02 0.00 -0.02 0.00 0.00 41.25 38.66 1n4c s ASN 17 CO 0.00 -1.43 1.22 0.54 -2.57 0.00 0.00 177.10 174.86 1n4c n ARG 18 N 8.09 1.13 -2.40 -0.60 1.74 -1.26 -4.92 116.66 118.44 1n4c n ARG 18 Ca 0.15 0.44 -0.42 0.00 -0.77 0.00 0.00 57.85 57.25 1n4c n ARG 18 Cb 0.48 -2.44 -0.03 0.00 -1.02 0.00 0.00 32.46 29.45 1n4c n ARG 18 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1n4c s PRO 19 N -3.15 4.46 -0.40 5.56 0.04 -1.26 -4.94 135.00 135.30 1n4c s PRO 19 Ca 0.80 1.82 0.06 0.00 0.04 0.00 0.00 61.00 63.71 1n4c s PRO 19 Cb -0.39 -3.30 0.31 0.00 0.04 0.00 0.00 34.50 31.16 1n4c s PRO 19 CO 0.43 -0.18 1.23 -1.71 0.04 0.00 0.00 177.00 176.81 1n4c n ASN 20 N 3.31 -1.89 -4.80 6.66 4.05 -1.26 -5.15 115.26 116.18 1n4c n ASN 20 Ca 0.07 -2.83 -0.31 0.00 0.45 0.00 0.00 54.58 51.96 1n4c n ASN 20 Cb 0.45 1.48 0.07 0.00 1.23 0.00 0.00 39.78 43.01 1n4c n ASN 20 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 177.26 173.49 1n4c s TYR 21 N 0.18 2.88 -0.49 1.20 -0.85 -1.26 -5.03 117.35 113.99 1n4c s TYR 21 Ca 0.20 1.41 0.06 0.00 -0.52 0.00 0.00 57.07 58.22 1n4c s TYR 21 Cb 0.29 -2.97 0.22 0.00 0.38 0.00 0.00 41.96 39.88 1n4c s TYR 21 CO -0.09 -1.53 0.78 0.09 -1.52 0.00 0.00 175.55 173.28 1n4c n ASN 22 N -3.32 -2.68 -3.56 -0.18 4.13 -1.26 -5.13 115.26 103.25 1n4c n ASN 22 Ca 0.08 -3.08 -0.11 0.00 1.68 0.00 0.00 54.58 53.15 1n4c n ASN 22 Cb 0.54 1.46 -0.05 0.00 -1.54 0.00 0.00 39.78 40.19 1n4c n ASN 22 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1n4c s VAL 23 N 0.55 0.00 -0.30 2.41 0.11 -1.26 -5.15 120.40 116.77 1n4c s VAL 23 Ca 0.32 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.35 1n4c s VAL 23 Cb 0.14 -1.00 0.19 0.00 -1.53 0.00 0.00 36.38 34.18 1n4c s VAL 23 CO -0.17 0.00 0.73 -0.55 -3.33 0.00 0.00 175.10 171.78 1n4c s SER 24 N -1.27 -1.21 -0.78 3.54 0.15 -1.26 -5.08 113.70 107.79 1n4c s SER 24 Ca -0.02 0.37 -0.25 0.00 0.70 0.00 0.00 55.95 56.75 1n4c s SER 24 Cb -0.00 1.86 -0.17 0.00 -1.71 0.00 0.00 66.02 66.00 1n4c s SER 24 CO 0.01 -0.22 2.46 0.33 1.20 0.00 0.00 173.24 177.02 1n4c n PHE 25 N 5.38 0.90 -2.64 3.44 7.35 -1.26 -4.48 117.46 126.15 1n4c n PHE 25 Ca 0.03 0.16 -0.03 0.00 -0.76 0.00 0.00 57.45 56.84 1n4c n PHE 25 Cb 0.54 -2.23 0.06 0.00 0.35 0.00 0.00 39.48 38.20 1n4c n PHE 25 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 1n4c n SER 26 N 13.24 -1.19 -4.57 -2.13 2.88 -1.26 -5.09 113.62 115.51 1n4c n SER 26 Ca 0.52 -1.88 -0.40 0.00 -1.33 0.00 0.00 58.87 55.78 1n4c n SER 26 Cb 0.31 0.71 -0.03 0.00 -0.75 0.00 0.00 64.21 64.45 1n4c n SER 26 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1n4c s SER 27 N -0.67 5.77 0.13 -3.46 0.15 -1.26 -4.84 113.70 109.51 1n4c s SER 27 Ca 0.09 0.36 -0.06 0.00 0.70 0.00 0.00 55.95 57.05 1n4c s SER 27 Cb 0.24 -2.54 -0.10 0.00 -1.71 0.00 0.00 66.02 61.92 1n4c s SER 27 CO -0.06 -1.98 1.31 0.24 1.20 0.00 0.00 173.24 173.94 1n4c h MET 28 N 12.71 0.46 -7.02 5.44 0.00 -1.98 -3.46 114.93 121.09 1n4c h MET 28 Ca -0.27 -0.48 -0.53 0.00 0.00 0.00 0.00 59.70 58.42 1n4c h MET 28 Cb 1.12 0.13 0.21 0.00 0.00 0.00 0.00 31.60 33.06 1n4c h MET 28 CO 1.19 1.12 -0.19 -2.30 0.00 0.00 0.00 176.91 176.73 1n4c n PRO 29 N -3.78 -0.39 -3.84 -0.22 -0.02 -1.26 -5.04 135.00 120.45 1n4c n PRO 29 Ca -0.07 -0.06 -0.06 0.00 -2.02 0.00 0.00 63.50 61.29 1n4c n PRO 29 Cb 0.82 -2.11 -0.02 0.00 -0.02 0.00 0.00 33.50 32.17 1n4c n PRO 29 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1n4c s GLY 30 N -2.32 -0.08 0.00 -1.23 0.00 -1.26 -5.18 107.32 97.24 1n4c s GLY 30 Ca 0.62 -0.26 0.00 0.00 0.00 0.00 0.00 44.72 45.08 1n4c s GLY 30 CO 0.63 -0.05 0.00 0.61 0.00 0.00 0.00 173.10 174.28 1n4c n GLY 31 N -0.47 3.13 3.64 0.20 0.00 -1.26 -5.17 105.19 105.26 1n4c n GLY 31 Ca -0.05 -0.73 -0.08 0.00 0.00 0.00 0.00 46.02 45.16 1n4c n GLY 31 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1n4c s GLN 32 N -2.00 0.70 -0.08 1.61 -2.07 -1.26 -5.06 119.66 111.50 1n4c s GLN 32 Ca 0.00 1.09 -0.25 0.00 -1.82 0.00 0.00 55.36 54.37 1n4c s GLN 32 Cb 0.00 0.20 -0.28 0.00 -1.09 0.00 0.00 33.01 31.85 1n4c s GLN 32 CO 0.00 -0.13 0.87 -0.91 -1.32 0.00 0.00 175.29 173.81 1n4c h ASN 33 N 6.30 0.24 -1.21 12.60 2.35 -2.08 -3.46 115.58 130.32 1n4c h ASN 33 Ca -0.29 -0.94 0.10 0.00 -0.55 0.00 0.00 56.30 54.62 1n4c h ASN 33 Cb 1.21 -0.08 -0.21 0.00 0.05 0.00 0.00 38.32 39.29 1n4c h ASN 33 CO 0.14 1.15 -0.21 -0.70 -1.65 0.00 0.00 177.43 176.16 1n4c s GLU 34 N -2.49 0.55 0.00 0.81 2.12 -1.26 -5.09 118.70 113.34 1n4c s GLU 34 Ca -0.16 1.08 0.00 0.00 0.36 0.00 0.00 54.97 56.25 1n4c s GLU 34 Cb -0.01 0.62 0.00 0.00 0.26 0.00 0.00 34.13 35.00 1n4c s GLU 34 CO 0.76 -0.49 0.38 -2.13 -0.54 0.00 0.00 175.26 173.24 1n4c n ARG 35 N 5.43 0.00 -0.81 4.30 0.63 -1.26 -5.04 116.66 119.91 1n4c n ARG 35 Ca -0.04 0.03 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 1n4c n ARG 35 Cb 0.51 -0.89 0.00 0.00 0.45 0.00 0.00 32.46 32.53 1n4c n ARG 35 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1n4c n GLY 36 N 0.32 -4.07 0.13 5.14 0.00 -1.26 -4.66 105.19 100.79 1n4c n GLY 36 Ca 0.00 -0.71 -0.20 0.00 0.00 0.00 0.00 46.02 45.11 1n4c n GLY 36 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1n4c h LYS 37 N 1.27 0.38 0.00 1.61 3.64 -2.06 -3.16 116.57 118.25 1n4c h LYS 37 Ca 0.00 -0.59 0.00 0.00 -1.27 0.00 0.00 60.65 58.79 1n4c h LYS 37 Cb 0.00 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1n4c h LYS 37 CO 0.00 1.26 0.36 0.00 -2.27 0.00 0.00 179.45 178.80 1n4c h ALA 38 N 0.15 1.34 -2.16 5.00 0.00 -2.03 -3.38 119.26 118.18 1n4c h ALA 38 Ca -0.15 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.19 1n4c h ALA 38 Cb 1.69 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.43 1n4c h ALA 38 CO 0.17 -0.34 0.83 0.00 0.00 0.00 0.00 179.25 179.91 1n4c s ALA 39 N -3.93 3.63 0.05 0.00 0.00 -1.20 -4.98 121.76 115.34 1n4c s ALA 39 Ca -0.03 0.39 -0.27 0.00 0.00 0.00 0.00 51.96 52.06 1n4c s ALA 39 Cb 0.07 -3.58 0.09 0.00 0.00 0.00 0.00 23.12 19.71 1n4c s ALA 39 CO 0.23 -1.05 0.82 0.00 0.00 0.00 0.00 175.76 175.75 1n4c s ALA 40 N 3.16 -1.75 -2.00 0.00 0.00 -1.26 -5.00 121.76 114.90 1n4c s ALA 40 Ca 0.51 0.82 0.21 0.00 0.00 0.00 0.00 51.96 53.51 1n4c s ALA 40 Cb -0.20 0.55 1.25 0.00 0.00 0.00 0.00 23.12 24.73 1n4c s ALA 40 CO 0.13 -0.73 1.78 0.27 0.00 0.00 0.00 175.76 177.21 1n4c n ASN 41 N -0.29 0.00 -1.66 0.00 0.23 -1.26 -4.04 115.26 108.24 1n4c n ASN 41 Ca -0.11 -1.25 -0.02 0.00 -0.53 0.00 0.00 54.58 52.67 1n4c n ASN 41 Cb 0.62 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.29 1n4c n ASN 41 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1n4c n LEU 42 N -0.84 4.74 -4.56 -4.53 4.77 -1.26 -4.78 117.00 110.54 1n4c n LEU 42 Ca 0.16 -2.31 -0.39 0.00 -0.03 0.00 0.00 56.01 53.44 1n4c n LEU 42 Cb 0.07 -1.06 -0.03 0.00 -2.33 0.00 0.00 43.42 40.07 1n4c n LEU 42 CO 0.12 1.02 1.47 -1.61 -1.33 0.00 0.00 177.39 177.05 1n4c s GLU 43 N 0.43 3.46 0.00 3.23 0.41 -1.26 -3.80 118.70 121.18 1n4c s GLU 43 Ca 0.13 -1.02 0.00 0.00 -0.41 0.00 0.00 54.97 53.66 1n4c s GLU 43 Cb 0.06 -5.32 0.00 0.00 -1.78 0.00 0.00 34.13 27.09 1n4c s GLU 43 CO 0.00 -2.35 0.00 0.41 -0.49 0.00 0.00 175.26 172.83 1n4c n GLY 44 N 6.88 0.00 3.73 -1.39 0.00 -1.26 -5.14 105.19 108.00 1n4c n GLY 44 Ca 0.34 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.95 1n4c n GLY 44 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1n4c s LYS 45 N 0.00 4.67 -0.86 1.61 2.20 -1.25 -4.96 119.74 121.15 1n4c s LYS 45 Ca 0.00 1.47 -0.25 0.00 -0.36 0.00 0.00 55.97 56.83 1n4c s LYS 45 Cb 0.00 -3.38 0.01 0.00 -1.51 0.00 0.00 37.83 32.95 1n4c s LYS 45 CO 0.00 0.16 1.60 -0.65 -0.36 0.00 0.00 175.35 176.10 1n4c s GLN 46 N 0.15 3.08 -0.13 4.03 -1.52 -1.26 -4.96 119.66 119.06 1n4c s GLN 46 Ca 0.48 -0.42 -0.29 0.00 -1.95 0.00 0.00 55.36 53.17 1n4c s GLN 46 Cb -0.23 -4.85 -0.01 0.00 -0.22 0.00 0.00 33.01 27.69 1n4c s GLN 46 CO 0.30 -2.57 1.08 0.21 -0.25 0.00 0.00 175.29 174.06 1n4c s LYS 47 N 6.00 4.34 0.00 2.91 2.20 -1.26 -4.88 119.74 129.06 1n4c s LYS 47 Ca 0.53 1.47 0.00 0.00 -0.36 0.00 0.00 55.97 57.61 1n4c s LYS 47 Cb -0.06 -3.60 0.00 0.00 -1.51 0.00 0.00 37.83 32.67 1n4c s LYS 47 CO 0.03 -0.47 0.69 0.00 -0.36 0.00 0.00 175.35 175.24 1n4c n ALA 48 N 5.56 2.23 1.17 3.13 0.00 -1.26 -4.05 120.51 127.30 1n4c n ALA 48 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1n4c n ALA 48 Cb 0.47 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.92 1n4c n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n4c n ALA 49 N 0.54 2.13 0.54 0.00 0.00 -1.26 -3.21 120.51 119.25 1n4c n ALA 49 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.48 1n4c n ALA 49 Cb 0.34 -1.00 0.17 0.00 0.00 0.00 0.00 19.45 18.96 1n4c n ALA 49 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1n4c n ASP 50 N -0.32 2.48 -2.70 0.00 9.92 -1.26 -4.40 116.55 120.28 1n4c n ASP 50 Ca 0.00 -2.20 -0.06 0.00 -0.53 0.00 0.00 54.79 52.00 1n4c n ASP 50 Cb 0.05 -0.40 0.07 0.00 -0.64 0.00 0.00 41.12 40.20 1n4c n ASP 50 CO 0.00 0.00 0.00 0.33 0.13 0.00 0.00 177.20 177.66 1n4c n PHE 51 N 0.41 -1.67 -0.95 1.24 -0.00 -1.20 -4.98 117.46 110.32 1n4c n PHE 51 Ca 0.12 -1.14 0.00 0.00 -0.00 0.00 0.00 57.45 56.43 1n4c n PHE 51 Cb 0.48 1.29 0.00 0.00 -0.00 0.00 0.00 39.48 41.25 1n4c n PHE 51 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85 1n4c n GLU 52 N 1.49 0.00 -2.75 -4.13 2.13 -1.26 -5.02 120.64 111.10 1n4c n GLU 52 Ca 0.04 0.00 -0.06 0.00 0.66 0.00 0.00 57.16 57.80 1n4c n GLU 52 Cb 0.68 -0.00 0.03 0.00 0.27 0.00 0.00 31.44 32.42 1n4c n GLU 52 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1n4c n ASP 53 N 0.00 -3.16 -4.76 4.31 8.00 -1.26 -5.13 116.55 114.54 1n4c n ASP 53 Ca 0.00 -3.11 -0.39 0.00 0.71 0.00 0.00 54.79 52.00 1n4c n ASP 53 Cb 0.00 1.79 0.02 0.00 -0.02 0.00 0.00 41.12 42.91 1n4c n ASP 53 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1n4c s LEU 54 N 0.05 4.07 -0.59 0.64 1.43 -1.26 -4.78 118.68 118.24 1n4c s LEU 54 Ca 0.31 2.83 -0.04 0.00 -1.03 0.00 0.00 54.13 56.20 1n4c s LEU 54 Cb 0.12 -4.01 -0.04 0.00 0.03 0.00 0.00 46.19 42.29 1n4c s LEU 54 CO -0.15 -1.20 1.77 -0.11 0.23 0.00 0.00 176.35 176.88 1n4c n LEU 55 N -0.33 3.35 -2.71 1.79 7.94 -1.26 -3.94 117.00 121.84 1n4c n LEU 55 Ca 0.06 -2.26 -0.07 0.00 -1.11 0.00 0.00 56.01 52.62 1n4c n LEU 55 Cb 0.43 -0.89 0.10 0.00 0.53 0.00 0.00 43.42 43.59 1n4c n LEU 55 CO 0.57 0.08 0.46 -1.54 -1.11 0.00 0.00 177.39 175.85 1n4c n SER 56 N 4.31 -2.01 -4.57 1.96 3.41 -1.26 -5.06 113.62 110.41 1n4c n SER 56 Ca 0.30 -3.09 -0.14 0.00 -0.26 0.00 0.00 58.87 55.68 1n4c n SER 56 Cb 0.11 1.67 -0.12 0.00 -0.26 0.00 0.00 64.21 65.62 1n4c n SER 56 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n4c n GLY 57 N 0.47 -0.47 3.51 5.00 0.00 -1.25 -4.82 105.19 107.62 1n4c n GLY 57 Ca 0.02 0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1n4c n GLY 57 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n4c s GLN 58 N 8.50 3.44 0.00 1.61 -0.21 -1.26 -3.96 119.66 127.79 1n4c s GLN 58 Ca 0.80 -1.11 0.00 0.00 0.02 0.00 0.00 55.36 55.07 1n4c s GLN 58 Cb -0.05 -4.84 0.00 0.00 1.00 0.00 0.00 33.01 29.12 1n4c s GLN 58 CO 0.19 -2.01 0.00 0.41 -2.12 0.00 0.00 175.29 171.76 1n4c n GLY 59 N 5.97 1.43 0.15 3.09 0.00 -1.26 -4.63 105.19 109.93 1n4c n GLY 59 Ca 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1n4c n GLY 59 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1n4c n PHE 60 N 0.00 0.00 -0.06 1.61 7.35 -1.26 -4.70 117.46 120.40 1n4c n PHE 60 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1n4c n PHE 60 Cb 0.00 -0.02 0.00 0.00 0.35 0.00 0.00 39.48 39.81 1n4c n PHE 60 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 1n4c n ASN 61 N -0.29 0.00 -3.62 -2.13 6.94 -1.25 -4.98 115.26 109.92 1n4c n ASN 61 Ca 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 54.58 54.48 1n4c n ASN 61 Cb 0.04 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.40 1n4c n ASN 61 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1n4c s ALA 62 N -3.94 -2.00 -0.50 -2.53 0.00 -1.26 -5.09 121.76 106.43 1n4c s ALA 62 Ca 0.00 1.77 -0.27 0.00 0.00 0.00 0.00 51.96 53.46 1n4c s ALA 62 Cb 0.00 -1.29 -0.02 0.00 0.00 0.00 0.00 23.12 21.81 1n4c s ALA 62 CO 0.00 -0.24 1.82 -1.01 0.00 0.00 0.00 175.76 176.33 1n4c s HIS 63 N -0.23 1.75 0.12 0.00 3.76 -1.26 -4.94 115.29 114.49 1n4c s HIS 63 Ca 0.03 0.74 -0.31 0.00 -0.15 0.00 0.00 55.06 55.37 1n4c s HIS 63 Cb -0.04 -4.11 -0.08 0.00 1.11 0.00 0.00 32.58 29.47 1n4c s HIS 63 CO -0.05 -2.51 1.40 -1.59 -0.85 0.00 0.00 174.74 171.14 1n4c s LYS 64 N 6.44 4.31 -0.40 1.40 -2.85 -1.26 -4.94 119.74 122.44 1n4c s LYS 64 Ca 0.72 2.10 -0.29 0.00 -1.00 0.00 0.00 55.97 57.50 1n4c s LYS 64 Cb -0.16 -3.24 0.02 0.00 -2.06 0.00 0.00 37.83 32.39 1n4c s LYS 64 CO 0.26 -0.45 1.27 0.16 0.10 0.00 0.00 175.35 176.70 1n4c s ASP 65 N 1.09 6.55 0.63 0.03 -4.77 -1.26 -5.01 116.67 113.93 1n4c s ASP 65 Ca 0.65 0.81 -0.10 0.00 -3.30 0.00 0.00 52.55 50.61 1n4c s ASP 65 Cb -0.37 -2.54 -0.02 0.00 -1.09 0.00 0.00 42.92 38.90 1n4c s ASP 65 CO 0.30 -1.25 1.01 -0.75 0.70 0.00 0.00 175.17 175.18 1n4c s LYS 66 N 4.51 3.27 0.00 2.11 2.20 -1.26 -4.90 119.74 125.67 1n4c s LYS 66 Ca 0.55 0.51 -0.05 0.00 -0.36 0.00 0.00 55.97 56.61 1n4c s LYS 66 Cb -0.12 -2.12 -0.21 0.00 -1.51 0.00 0.00 37.83 33.87 1n4c s LYS 66 CO 0.29 -0.70 3.04 1.63 -0.36 0.00 0.00 175.35 179.25 1n4c n LYS 67 N -2.76 1.63 0.00 4.03 4.76 -1.26 -4.86 118.16 119.70 1n4c n LYS 67 Ca 0.05 -0.77 0.00 0.00 -2.87 0.00 0.00 58.31 54.72 1n4c n LYS 67 Cb 0.56 -1.85 0.00 0.00 -1.84 0.00 0.00 35.03 31.90 1n4c n LYS 67 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1n4c n GLY 68 N 2.48 -1.03 1.14 0.72 0.00 -1.26 -5.03 105.19 102.20 1n4c n GLY 68 Ca 0.33 -1.64 -0.05 0.00 0.00 0.00 0.00 46.02 44.66 1n4c n GLY 68 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1n4c n PRO 69 N -0.55 -0.14 -2.94 1.61 -0.02 -1.26 -5.01 135.00 126.69 1n4c n PRO 69 Ca 0.00 -0.24 -0.14 0.00 -2.02 0.00 0.00 63.50 61.10 1n4c n PRO 69 Cb 0.00 -0.54 0.01 0.00 -0.02 0.00 0.00 33.50 32.95 1n4c n PRO 69 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1n4c n ARG 70 N -0.78 0.83 -3.63 -0.52 1.74 -1.26 -5.11 116.66 107.93 1n4c n ARG 70 Ca 0.02 -2.45 -0.36 0.00 -0.77 0.00 0.00 57.85 54.29 1n4c n ARG 70 Cb 0.10 -1.35 -0.09 0.00 -1.02 0.00 0.00 32.46 30.10 1n4c n ARG 70 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1n4c s THR 71 N -0.39 5.35 -1.28 0.55 -4.23 -1.26 -4.92 115.64 109.46 1n4c s THR 71 Ca 0.32 0.27 0.00 0.00 -1.18 0.00 0.00 61.69 61.10 1n4c s THR 71 Cb 0.24 -3.53 0.00 0.00 1.34 0.00 0.00 72.50 70.55 1n4c s THR 71 CO -0.15 0.35 0.56 0.00 -0.54 0.00 0.00 174.62 174.85 1n4c n ILE 72 N 4.12 0.54 0.20 2.99 3.06 -1.26 -0.64 119.36 128.37 1n4c n ILE 72 Ca -0.14 0.18 0.12 0.00 -2.50 0.00 0.00 62.75 60.40 1n4c n ILE 72 Cb 0.52 -1.18 0.14 0.00 0.54 0.00 0.00 39.64 39.66 1n4c n ILE 72 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1n4c h ALA 73 N 1.55 0.91 0.06 1.51 0.00 -2.01 -3.29 119.26 117.99 1n4c h ALA 73 Ca 0.00 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 1n4c h ALA 73 Cb 0.08 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.87 1n4c h ALA 73 CO 0.00 0.00 -0.55 1.49 0.00 0.00 0.00 179.25 180.19 1n4c h GLU 74 N 0.00 0.14 -0.99 0.00 4.57 -1.29 -3.31 114.58 113.70 1n4c h GLU 74 Ca -0.00 -0.23 0.17 0.00 -1.18 0.00 0.00 59.36 58.12 1n4c h GLU 74 Cb 1.00 0.09 -0.09 0.00 -0.16 0.00 0.00 28.75 29.58 1n4c h GLU 74 CO 0.00 1.11 0.62 1.98 -1.18 0.00 0.00 179.01 181.54 1n4c h MET 75 N -0.70 0.76 -0.48 1.92 4.05 -1.70 0.42 114.93 119.20 1n4c h MET 75 Ca -0.11 -0.05 0.12 0.00 -0.28 0.00 0.00 59.70 59.38 1n4c h MET 75 Cb 1.34 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 31.95 1n4c h MET 75 CO 0.05 0.50 0.34 0.00 0.23 0.00 0.00 176.91 178.03 1n4c h ARG 76 N 0.79 0.13 0.00 0.39 3.08 -1.65 0.97 114.38 118.10 1n4c h ARG 76 Ca 0.54 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.58 1n4c h ARG 76 Cb 0.81 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.83 1n4c h ARG 76 CO -0.32 0.09 0.36 -0.22 -1.07 0.00 0.00 179.97 178.81 1n4c h LYS 77 N 0.13 0.00 0.14 0.04 3.64 -0.27 0.29 116.57 120.55 1n4c h LYS 77 Ca 0.23 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.32 1n4c h LYS 77 Cb 0.72 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.56 1n4c h LYS 77 CO -0.03 0.00 -1.27 1.49 -2.27 0.00 0.00 179.45 177.38 1n4c h GLU 78 N 0.00 0.45 -0.48 1.90 4.81 -0.93 -2.45 114.58 117.89 1n4c h GLU 78 Ca 0.00 -0.68 0.09 0.00 -0.13 0.00 0.00 59.36 58.64 1n4c h GLU 78 Cb 0.73 0.24 -0.08 0.00 0.63 0.00 0.00 28.75 30.27 1n4c h GLU 78 CO 0.00 1.30 -0.01 1.49 -0.73 0.00 0.00 179.01 181.06 1n4c h GLU 79 N 0.17 0.10 -0.01 1.92 4.81 -0.55 1.39 114.58 122.41 1n4c h GLU 79 Ca -0.17 -0.01 -0.20 0.00 -0.13 0.00 0.00 59.36 58.85 1n4c h GLU 79 Cb 1.96 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 31.31 1n4c h GLU 79 CO 0.23 0.07 -0.88 0.52 -0.73 0.00 0.00 179.01 178.22 1n4c h MET 80 N 0.10 0.28 -0.04 1.92 2.86 -1.64 -2.97 114.93 115.44 1n4c h MET 80 Ca 0.24 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1n4c h MET 80 Cb 0.36 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1n4c h MET 80 CO -0.41 1.00 0.00 0.00 1.06 0.00 0.00 176.91 178.56 1n4c n ALA 81 N -2.49 2.60 0.08 6.32 0.00 -0.53 -3.61 120.51 122.87 1n4c n ALA 81 Ca -0.05 -0.30 -0.10 0.00 0.00 0.00 0.00 53.44 52.99 1n4c n ALA 81 Cb 0.80 -1.27 -0.08 0.00 0.00 0.00 0.00 19.45 18.90 1n4c n ALA 81 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1n4c h LYS 82 N 1.01 0.14 -0.48 0.00 3.64 0.20 -3.43 116.57 117.64 1n4c h LYS 82 Ca 0.00 -0.20 -0.03 0.00 -1.27 0.00 0.00 60.65 59.15 1n4c h LYS 82 Cb 0.22 0.07 -0.16 0.00 -0.41 0.00 0.00 32.23 31.95 1n4c h LYS 82 CO 0.00 1.04 -0.25 -2.00 -2.27 0.00 0.00 179.45 175.96 1n4c s GLU 83 N -2.87 0.50 0.00 1.90 2.12 -1.24 -5.02 118.70 114.09 1n4c s GLU 83 Ca -0.02 -0.46 -0.05 0.00 0.36 0.00 0.00 54.97 54.80 1n4c s GLU 83 Cb 0.09 -0.01 -0.23 0.00 0.26 0.00 0.00 34.13 34.24 1n4c s GLU 83 CO 0.84 -0.62 3.31 -0.12 -0.54 0.00 0.00 175.26 178.12 1n4c n MET 84 N 2.87 1.80 -1.57 4.30 0.00 -1.24 -4.79 117.12 118.49 1n4c n MET 84 Ca 0.13 -0.85 -0.45 0.00 -0.00 0.00 0.00 57.70 56.53 1n4c n MET 84 Cb 0.62 -1.87 -0.02 0.00 0.00 0.00 0.00 33.22 31.94 1n4c n MET 84 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 1n4c n ASP 85 N 2.42 1.12 0.10 6.12 -0.08 -1.26 -4.37 116.55 120.59 1n4c n ASP 85 Ca 0.37 1.17 0.11 0.00 -1.51 0.00 0.00 54.79 54.93 1n4c n ASP 85 Cb 0.83 -1.26 0.18 0.00 2.34 0.00 0.00 41.12 43.21 1n4c n ASP 85 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1n4c n PRO 86 N 0.88 0.02 0.01 -0.67 -0.02 -1.26 0.27 135.00 134.24 1n4c n PRO 86 Ca 0.11 0.95 -0.05 0.00 -2.02 0.00 0.00 63.50 62.48 1n4c n PRO 86 Cb 0.31 -2.47 -0.11 0.00 -0.02 0.00 0.00 33.50 31.20 1n4c n PRO 86 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1n4c h GLU 87 N 0.00 0.00 0.00 -0.52 4.81 -1.96 -3.32 114.58 113.59 1n4c h GLU 87 Ca 0.20 0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 59.25 1n4c h GLU 87 Cb 2.32 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.68 1n4c h GLU 87 CO -0.00 0.50 -0.84 -0.22 -0.73 0.00 0.00 179.01 177.72 1n4c h LYS 88 N 0.00 0.03 -0.79 1.92 1.63 0.36 -3.11 116.57 116.61 1n4c h LYS 88 Ca -0.20 -0.03 0.10 0.00 -0.85 0.00 0.00 60.65 59.67 1n4c h LYS 88 Cb 1.83 0.01 -0.05 0.00 -0.60 0.00 0.00 32.23 33.42 1n4c h LYS 88 CO 0.08 0.85 0.51 1.25 -3.45 0.00 0.00 179.45 178.69 1n4c h LEU 89 N 0.01 0.62 -1.52 5.20 5.85 -1.45 0.29 115.31 124.31 1n4c h LEU 89 Ca -0.01 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.76 1n4c h LEU 89 Cb 1.49 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.38 1n4c h LEU 89 CO 0.11 0.36 0.36 0.50 -0.34 0.00 0.00 178.44 179.44 1n4c h LYS 90 N 0.69 0.60 -0.27 1.25 1.63 -1.68 -2.24 116.57 116.54 1n4c h LYS 90 Ca 0.37 -0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 60.08 1n4c h LYS 90 Cb 0.50 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.99 1n4c h LYS 90 CO -0.14 0.40 -0.03 0.82 -3.45 0.00 0.00 179.45 177.05 1n4c h ILE 91 N 0.62 1.27 -0.86 2.00 2.04 -1.08 -2.68 117.51 118.82 1n4c h ILE 91 Ca 0.22 -0.99 0.21 0.00 1.00 0.00 0.00 64.86 65.30 1n4c h ILE 91 Cb 0.11 1.37 -0.05 0.00 -0.74 0.00 0.00 36.82 37.50 1n4c h ILE 91 CO -0.06 0.31 0.59 -0.07 0.00 0.00 0.00 178.15 178.92 1n4c h LEU 92 N 0.27 0.23 -0.26 1.44 3.38 -1.29 0.31 115.31 119.40 1n4c h LEU 92 Ca 0.07 0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.92 1n4c h LEU 92 Cb 0.47 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1n4c h LEU 92 CO 0.02 0.09 -0.73 -0.33 0.09 0.00 0.00 178.44 177.59 1n4c h GLU 93 N 0.23 0.00 -0.06 1.13 4.39 -1.38 -2.74 114.58 116.15 1n4c h GLU 93 Ca 0.43 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 60.01 1n4c h GLU 93 Cb 1.32 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.97 1n4c h GLU 93 CO -0.10 0.73 -0.44 2.35 -1.16 0.00 0.00 179.01 180.38 1n4c h TRP 94 N 0.00 0.55 -0.19 4.33 7.01 -0.14 -3.08 115.95 124.42 1n4c h TRP 94 Ca -0.01 -0.26 -0.10 0.00 2.11 0.00 0.00 58.89 60.63 1n4c h TRP 94 Cb 1.44 -0.08 -0.00 0.00 -2.10 0.00 0.00 29.16 28.42 1n4c h TRP 94 CO 0.00 1.03 -0.27 -0.84 -2.79 0.00 0.00 178.44 175.57 1n4c h ILE 95 N -0.08 1.34 0.00 2.65 3.07 -1.34 -2.85 117.51 120.28 1n4c h ILE 95 Ca -0.04 -1.48 0.00 0.00 1.55 0.00 0.00 64.86 64.90 1n4c h ILE 95 Cb 1.11 1.83 0.00 0.00 -0.27 0.00 0.00 36.82 39.49 1n4c h ILE 95 CO 0.09 0.45 0.00 -1.84 -1.05 0.00 0.00 178.15 175.80 1n4c n GLU 96 N -4.37 0.05 0.05 0.16 -0.00 -1.04 -1.74 120.64 113.75 1n4c n GLU 96 Ca -0.06 0.30 -0.20 0.00 -0.00 0.00 0.00 57.16 57.20 1n4c n GLU 96 Cb 0.45 -1.50 -0.12 0.00 -0.00 0.00 0.00 31.44 30.27 1n4c n GLU 96 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.13 177.91 1n4c h GLY 97 N 1.32 0.62 -5.00 -1.84 0.00 -1.41 -3.44 103.07 93.33 1n4c h GLY 97 Ca 0.00 -1.22 -0.13 0.00 0.00 0.00 0.00 47.33 45.99 1n4c h GLY 97 CO 0.00 1.07 -0.19 0.58 0.00 0.00 0.00 176.54 178.01 1n4c n LYS 98 N -3.96 0.37 0.00 4.80 2.85 -0.92 -4.99 118.16 116.32 1n4c n LYS 98 Ca -0.12 -1.07 0.00 0.00 -1.05 0.00 0.00 58.31 56.07 1n4c n LYS 98 Cb 0.86 -0.64 0.00 0.00 -0.65 0.00 0.00 35.03 34.60 1n4c n LYS 98 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 1n4c n GLU 99 N 1.42 0.76 -1.12 -1.58 0.00 -0.71 -2.78 120.64 116.63 1n4c n GLU 99 Ca 0.03 0.00 0.03 0.00 0.00 0.00 0.00 57.16 57.22 1n4c n GLU 99 Cb 0.69 -1.20 0.02 0.00 0.00 0.00 0.00 31.44 30.95 1n4c n GLU 99 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1n4c n ARG 100 N 0.47 0.05 -3.19 3.44 0.63 -1.26 -4.68 116.66 112.12 1n4c n ARG 100 Ca 0.00 -1.69 -0.21 0.00 -0.92 0.00 0.00 57.85 55.02 1n4c n ARG 100 Cb 0.32 -0.23 -0.05 0.00 0.45 0.00 0.00 32.46 32.95 1n4c n ARG 100 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1n4c n ASN 101 N 0.27 0.47 -0.39 6.15 5.15 -1.12 -4.97 115.26 120.83 1n4c n ASN 101 Ca 0.04 -2.84 0.33 0.00 -0.60 0.00 0.00 54.58 51.51 1n4c n ASN 101 Cb 0.98 -0.63 0.60 0.00 -0.53 0.00 0.00 39.78 40.20 1n4c n ASN 101 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 1n4c h ILE 102 N 1.54 0.14 -0.76 -1.44 -0.00 -1.84 0.33 117.51 115.47 1n4c h ILE 102 Ca 0.08 -0.04 0.13 0.00 -0.00 0.00 0.00 64.86 65.03 1n4c h ILE 102 Cb 0.92 0.00 -0.09 0.00 -0.00 0.00 0.00 36.82 37.66 1n4c h ILE 102 CO 0.48 0.02 0.33 0.08 -0.00 0.00 0.00 178.15 179.06 1n4c h ARG 103 N 0.12 0.49 0.19 2.19 0.11 -1.97 -2.48 114.38 113.03 1n4c h ARG 103 Ca 0.81 -0.03 -0.32 0.00 0.10 0.00 0.00 59.98 60.53 1n4c h ARG 103 Cb 2.29 -0.11 0.02 0.00 1.11 0.00 0.00 29.97 33.28 1n4c h ARG 103 CO -0.54 0.32 -1.52 0.00 0.10 0.00 0.00 179.97 178.33 1n4c h ALA 104 N 1.52 0.04 -0.48 0.08 0.00 -0.76 -3.10 119.26 116.56 1n4c h ALA 104 Ca 0.41 -0.98 0.09 0.00 0.00 0.00 0.00 54.91 54.43 1n4c h ALA 104 Cb 0.57 0.23 -0.08 0.00 0.00 0.00 0.00 17.79 18.52 1n4c h ALA 104 CO -0.37 0.91 0.02 -0.07 0.00 0.00 0.00 179.25 179.74 1n4c h LEU 105 N 0.11 -0.16 -0.73 0.00 3.38 -0.99 0.82 115.31 117.74 1n4c h LEU 105 Ca -0.25 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1n4c h LEU 105 Cb 2.09 0.19 -0.00 0.00 0.09 0.00 0.00 40.66 43.03 1n4c h LEU 105 CO 0.22 -0.05 -0.08 0.17 0.09 0.00 0.00 178.44 178.79 1n4c h LEU 106 N 0.14 0.00 -2.01 1.67 8.10 -1.61 -1.54 115.31 120.06 1n4c h LEU 106 Ca 0.24 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.23 1n4c h LEU 106 Cb 0.36 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.58 1n4c h LEU 106 CO -0.38 0.08 0.00 -0.24 -4.11 0.00 0.00 178.44 173.79 1n4c n SER 107 N -3.16 3.01 -0.06 0.17 2.88 0.27 -4.08 113.62 112.65 1n4c n SER 107 Ca 0.02 -1.93 0.00 0.00 -1.33 0.00 0.00 58.87 55.63 1n4c n SER 107 Cb 0.45 -0.22 0.00 0.00 -0.75 0.00 0.00 64.21 63.69 1n4c n SER 107 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1n4c n THR 108 N 1.20 0.26 0.16 2.46 -2.24 0.26 -4.51 114.28 111.87 1n4c n THR 108 Ca 0.19 -0.27 0.02 0.00 -2.27 0.00 0.00 64.05 61.71 1n4c n THR 108 Cb 0.53 0.80 0.23 0.00 -2.10 0.00 0.00 70.33 69.79 1n4c n THR 108 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1n4c h MET 109 N 0.00 0.00 -0.17 -0.78 -1.53 -1.43 -3.08 114.93 107.94 1n4c h MET 109 Ca 0.00 0.00 0.05 0.00 -3.44 0.00 0.00 59.70 56.31 1n4c h MET 109 Cb 0.95 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.99 1n4c h MET 109 CO 0.00 0.52 0.20 1.12 0.14 0.00 0.00 176.91 178.89 1n4c h HIS 110 N 0.00 0.00 0.00 1.39 2.07 -1.87 0.22 115.15 116.96 1n4c h HIS 110 Ca -0.01 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.51 1n4c h HIS 110 Cb 1.05 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.03 1n4c h HIS 110 CO 0.00 0.00 0.00 0.25 -3.07 0.00 0.00 177.93 175.11 1n4c n THR 111 N -3.76 0.00 -2.29 6.12 -2.24 -1.16 -3.52 114.28 107.44 1n4c n THR 111 Ca 0.01 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1n4c n THR 111 Cb 0.32 -0.32 -0.01 0.00 -2.10 0.00 0.00 70.33 68.22 1n4c n THR 111 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1n4c n VAL 112 N -0.74 0.00 -2.48 2.28 0.24 0.75 -5.01 118.33 113.38 1n4c n VAL 112 Ca 0.10 -0.57 -0.24 0.00 -2.04 0.00 0.00 64.34 61.58 1n4c n VAL 112 Cb 0.04 0.77 0.11 0.00 -1.47 0.00 0.00 33.84 33.29 1n4c n VAL 112 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 1n4c s LEU 113 N 0.00 2.96 0.25 1.34 1.43 -1.14 -4.95 118.68 118.56 1n4c s LEU 113 Ca 0.19 -0.19 -0.16 0.00 -1.03 0.00 0.00 54.13 52.95 1n4c s LEU 113 Cb 0.22 -2.19 -0.08 0.00 0.03 0.00 0.00 46.19 44.17 1n4c s LEU 113 CO -0.10 -1.89 0.68 -1.66 0.23 0.00 0.00 176.35 173.62 1n4c s TRP 114 N -3.21 3.52 -0.19 0.29 -2.14 -1.26 -4.98 118.94 110.97 1n4c s TRP 114 Ca 0.66 1.22 -0.29 0.00 2.66 0.00 0.00 56.10 60.35 1n4c s TRP 114 Cb -0.06 -2.51 -0.05 0.00 -3.10 0.00 0.00 33.47 27.76 1n4c s TRP 114 CO 0.45 0.26 1.97 0.00 -2.66 0.00 0.00 176.95 176.97 1n4c s ALA 115 N -1.71 3.02 0.00 2.67 0.00 -1.26 -3.20 121.76 121.29 1n4c s ALA 115 Ca 0.47 0.72 0.00 0.00 0.00 0.00 0.00 51.96 53.14 1n4c s ALA 115 Cb -0.13 -3.97 0.00 0.00 0.00 0.00 0.00 23.12 19.01 1n4c s ALA 115 CO 0.19 -2.36 0.00 0.41 0.00 0.00 0.00 175.76 174.00 1n4c n GLY 116 N 5.24 3.09 3.58 0.00 0.00 -1.26 -5.09 105.19 110.75 1n4c n GLY 116 Ca 0.24 -0.42 -0.48 0.00 0.00 0.00 0.00 46.02 45.36 1n4c n GLY 116 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1n4c n GLU 117 N 0.00 1.72 -0.03 1.61 4.07 -1.19 -4.78 120.64 122.04 1n4c n GLU 117 Ca 0.00 0.55 0.02 0.00 -0.06 0.00 0.00 57.16 57.67 1n4c n GLU 117 Cb 0.00 -2.71 0.03 0.00 -0.06 0.00 0.00 31.44 28.70 1n4c n GLU 117 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1n4c n THR 118 N 6.49 1.15 -0.11 6.31 -2.24 -1.26 -4.64 114.28 119.99 1n4c n THR 118 Ca 0.31 -1.20 -0.12 0.00 -2.27 0.00 0.00 64.05 60.77 1n4c n THR 118 Cb 0.31 0.38 -0.15 0.00 -2.10 0.00 0.00 70.33 68.77 1n4c n THR 118 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1n4c n LYS 119 N -0.59 0.73 -1.80 -0.78 5.02 -1.26 -4.94 118.16 114.54 1n4c n LYS 119 Ca 0.03 0.03 -0.42 0.00 -2.02 0.00 0.00 58.31 55.94 1n4c n LYS 119 Cb 0.33 -1.51 -0.03 0.00 -0.02 0.00 0.00 35.03 33.80 1n4c n LYS 119 CO 0.00 0.00 0.00 -0.46 -0.52 0.00 0.00 177.40 176.42 1n4c s TRP 120 N -2.49 2.90 -0.44 2.13 -0.11 -1.26 -4.97 118.94 114.70 1n4c s TRP 120 Ca -0.16 0.57 0.02 0.00 1.22 0.00 0.00 56.10 57.75 1n4c s TRP 120 Cb 0.07 -4.05 0.12 0.00 -1.50 0.00 0.00 33.47 28.10 1n4c s TRP 120 CO 0.75 -3.81 0.19 0.21 -4.62 0.00 0.00 176.95 169.67 1n4c s LYS 121 N 0.58 1.88 0.04 5.86 2.20 -1.26 -5.08 119.74 123.96 1n4c s LYS 121 Ca 0.69 -2.16 -0.28 0.00 -0.36 0.00 0.00 55.97 53.87 1n4c s LYS 121 Cb -0.47 -3.40 -0.14 0.00 -1.51 0.00 0.00 37.83 32.31 1n4c s LYS 121 CO 0.37 -1.05 0.69 -2.30 -0.36 0.00 0.00 175.35 172.71 1n4c n PRO 122 N 3.91 0.00 -3.14 4.03 -0.02 -1.26 -4.87 135.00 133.65 1n4c n PRO 122 Ca 0.03 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.12 1n4c n PRO 122 Cb 0.39 -1.02 -0.05 0.00 -0.02 0.00 0.00 33.50 32.79 1n4c n PRO 122 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1n4c s VAL 123 N -0.20 5.06 0.06 -1.45 1.01 -1.26 -5.00 120.40 118.62 1n4c s VAL 123 Ca 0.63 1.22 -0.30 0.00 0.00 0.00 0.00 61.98 63.52 1n4c s VAL 123 Cb -0.88 -3.95 -0.09 0.00 0.00 0.00 0.00 36.38 31.46 1n4c s VAL 123 CO 0.42 0.20 1.83 -0.83 0.00 0.00 0.00 175.10 176.72 1n4c s GLY 124 N 0.94 1.44 0.61 4.51 0.00 -1.26 -4.79 107.32 108.78 1n4c s GLY 124 Ca 0.31 1.30 0.24 0.00 0.00 0.00 0.00 44.72 46.57 1n4c s GLY 124 CO 0.13 3.20 1.42 -0.33 0.00 0.00 0.00 173.10 177.51 1n4c h MET 125 N 9.35 0.00 0.00 2.90 2.86 -1.95 2.70 114.93 130.79 1n4c h MET 125 Ca -0.46 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.18 1n4c h MET 125 Cb 1.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.88 1n4c h MET 125 CO 0.94 0.00 -0.13 0.00 1.06 0.00 0.00 176.91 178.78 1n4c n ALA 126 N -2.16 2.51 -0.32 6.32 0.00 -1.26 -3.60 120.51 122.01 1n4c n ALA 126 Ca 0.16 -0.12 -0.13 0.00 0.00 0.00 0.00 53.44 53.35 1n4c n ALA 126 Cb 1.24 -1.40 0.11 0.00 0.00 0.00 0.00 19.45 19.41 1n4c n ALA 126 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1n4c n ASP 127 N -1.85 3.47 -2.25 0.00 9.92 0.91 -4.09 116.55 122.66 1n4c n ASP 127 Ca 0.06 -2.94 -0.00 0.00 -0.53 0.00 0.00 54.79 51.38 1n4c n ASP 127 Cb 0.38 -0.70 0.05 0.00 -0.64 0.00 0.00 41.12 40.21 1n4c n ASP 127 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1n4c n LEU 128 N -0.44 0.46 -0.42 0.64 -0.00 -1.24 -4.81 117.00 111.19 1n4c n LEU 128 Ca 0.35 -2.69 0.08 0.00 -0.00 0.00 0.00 56.01 53.75 1n4c n LEU 128 Cb 1.18 0.22 0.33 0.00 -0.00 0.00 0.00 43.42 45.16 1n4c n LEU 128 CO 0.35 1.11 0.74 1.33 -0.00 0.00 0.00 177.39 180.92 1n4c n VAL 129 N -0.47 0.21 -4.20 1.47 0.24 -1.26 -4.76 118.33 109.57 1n4c n VAL 129 Ca -0.03 -0.28 -0.23 0.00 -2.04 0.00 0.00 64.34 61.76 1n4c n VAL 129 Cb 0.89 0.19 -0.17 0.00 -1.47 0.00 0.00 33.84 33.28 1n4c n VAL 129 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1n4c s THR 130 N -1.79 0.77 0.47 3.34 -4.23 -1.26 -5.00 115.64 107.93 1n4c s THR 130 Ca 0.27 -0.22 0.31 0.00 -1.18 0.00 0.00 61.69 60.86 1n4c s THR 130 Cb 0.14 -0.77 0.50 0.00 1.34 0.00 0.00 72.50 73.71 1n4c s THR 130 CO 0.21 0.29 1.72 -0.65 -0.54 0.00 0.00 174.62 175.65 1n4c h PRO 131 N 7.41 0.14 -0.77 3.99 0.11 -1.98 0.72 132.00 141.62 1n4c h PRO 131 Ca -0.32 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.75 1n4c h PRO 131 Cb 1.16 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 1n4c h PRO 131 CO 0.44 0.09 0.38 0.93 -0.21 0.00 0.00 178.00 179.63 1n4c h GLU 132 N 0.15 1.10 -0.24 1.05 4.39 -1.97 0.36 114.58 119.43 1n4c h GLU 132 Ca 0.69 -0.15 -0.07 0.00 0.34 0.00 0.00 59.36 60.16 1n4c h GLU 132 Cb 2.28 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 30.71 1n4c h GLU 132 CO -0.22 0.84 -0.18 1.96 -1.16 0.00 0.00 179.01 180.26 1n4c h GLN 133 N 1.10 0.41 0.09 2.33 1.08 0.11 -1.05 115.11 119.18 1n4c h GLN 133 Ca 0.27 -0.13 -0.00 0.00 -1.45 0.00 0.00 58.65 57.34 1n4c h GLN 133 Cb 0.10 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 1n4c h GLN 133 CO -0.04 0.58 -0.04 0.28 -0.95 0.00 0.00 178.83 178.66 1n4c h VAL 134 N 0.38 0.12 -0.95 -0.54 2.07 -0.96 -3.02 116.25 113.35 1n4c h VAL 134 Ca 0.07 -0.99 0.17 0.00 0.82 0.00 0.00 66.70 66.76 1n4c h VAL 134 Cb 0.53 0.23 -0.08 0.00 -1.52 0.00 0.00 31.29 30.44 1n4c h VAL 134 CO 0.03 0.04 0.60 0.50 0.02 0.00 0.00 177.57 178.77 1n4c h LYS 135 N -1.03 0.67 -0.62 1.57 3.64 -0.37 0.33 116.57 120.76 1n4c h LYS 135 Ca -0.01 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.25 1n4c h LYS 135 Cb 0.16 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1n4c h LYS 135 CO 0.02 0.44 0.09 -0.22 -2.27 0.00 0.00 179.45 177.51 1n4c h LYS 136 N 0.69 1.03 0.14 1.90 3.64 -1.29 -3.12 116.57 119.56 1n4c h LYS 136 Ca 0.51 -0.29 -0.29 0.00 -1.27 0.00 0.00 60.65 59.31 1n4c h LYS 136 Cb 0.87 -0.12 0.01 0.00 -0.41 0.00 0.00 32.23 32.58 1n4c h LYS 136 CO -0.27 0.97 -1.31 0.28 -2.27 0.00 0.00 179.45 176.85 1n4c h VAL 137 N 0.94 1.43 -0.78 2.00 2.07 -0.97 -3.21 116.25 117.73 1n4c h VAL 137 Ca 0.19 -2.98 0.23 0.00 0.82 0.00 0.00 66.70 64.95 1n4c h VAL 137 Cb 0.45 2.94 -0.03 0.00 -1.52 0.00 0.00 31.29 33.12 1n4c h VAL 137 CO 0.01 0.87 0.61 0.22 0.02 0.00 0.00 177.57 179.30 1n4c h TYR 138 N 0.08 0.00 -0.22 1.57 3.20 -0.37 0.39 116.97 121.62 1n4c h TYR 138 Ca -0.16 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.67 1n4c h TYR 138 Cb 2.01 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 40.27 1n4c h TYR 138 CO 0.07 0.00 -0.01 -0.09 -1.64 0.00 0.00 178.16 176.49 1n4c h ARG 139 N 0.00 0.40 0.22 1.82 9.65 -1.54 -2.89 114.38 122.04 1n4c h ARG 139 Ca 0.37 -0.13 -0.30 0.00 -1.10 0.00 0.00 59.98 58.82 1n4c h ARG 139 Cb 1.58 -0.03 0.03 0.00 -1.39 0.00 0.00 29.97 30.16 1n4c h ARG 139 CO -0.00 0.60 -1.31 0.87 2.80 0.00 0.00 179.97 182.93 1n4c h LYS 140 N 0.15 0.49 -1.00 0.20 1.57 -0.87 -3.26 116.57 113.86 1n4c h LYS 140 Ca 0.06 -0.83 0.25 0.00 -1.87 0.00 0.00 60.65 58.26 1n4c h LYS 140 Cb 0.43 0.31 -0.08 0.00 0.08 0.00 0.00 32.23 32.97 1n4c h LYS 140 CO 0.01 1.39 0.66 0.00 -0.57 0.00 0.00 179.45 180.95 1n4c h ALA 141 N 0.14 2.32 0.00 3.86 0.00 -0.42 1.20 119.26 126.36 1n4c h ALA 141 Ca -0.23 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1n4c h ALA 141 Cb 2.03 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.82 1n4c h ALA 141 CO 0.25 -0.67 -0.43 0.28 0.00 0.00 0.00 179.25 178.67 1n4c h VAL 142 N 0.35 1.15 -0.20 0.00 2.07 -1.55 -2.73 116.25 115.34 1n4c h VAL 142 Ca 0.54 -1.55 -0.09 0.00 0.82 0.00 0.00 66.70 66.41 1n4c h VAL 142 Cb 1.46 1.87 -0.01 0.00 -1.52 0.00 0.00 31.29 33.09 1n4c h VAL 142 CO -0.21 0.42 -0.28 0.17 0.02 0.00 0.00 177.57 177.69 1n4c h LEU 143 N 0.00 0.40 -2.23 2.57 8.10 0.14 -2.40 115.31 121.88 1n4c h LEU 143 Ca -0.00 -0.14 0.04 0.00 0.11 0.00 0.00 57.88 57.89 1n4c h LEU 143 Cb 0.84 -0.11 -0.01 0.00 -0.44 0.00 0.00 40.66 40.95 1n4c h LEU 143 CO 0.06 0.67 0.15 0.58 -4.11 0.00 0.00 178.44 175.79 1n4c h VAL 144 N 0.35 0.57 -0.12 0.15 2.07 -1.13 -1.59 116.25 116.55 1n4c h VAL 144 Ca 0.05 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.54 1n4c h VAL 144 Cb 0.68 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 1n4c h VAL 144 CO 0.05 0.00 -0.09 1.33 0.02 0.00 0.00 177.57 178.88 1n4c n VAL 145 N -3.94 2.15 -1.75 2.57 0.24 -0.93 -4.94 118.33 111.72 1n4c n VAL 145 Ca 0.01 -2.39 -0.42 0.00 -2.04 0.00 0.00 64.34 59.50 1n4c n VAL 145 Cb 0.27 -0.26 -0.02 0.00 -1.47 0.00 0.00 33.84 32.36 1n4c n VAL 145 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1n4c s HIS 146 N -2.98 2.84 0.12 6.34 5.04 -0.60 -4.80 115.29 121.24 1n4c s HIS 146 Ca 0.38 0.53 -0.23 0.00 -1.54 0.00 0.00 55.06 54.20 1n4c s HIS 146 Cb 0.33 -4.11 -0.05 0.00 0.04 0.00 0.00 32.58 28.79 1n4c s HIS 146 CO 0.03 -4.01 1.17 -2.30 -2.34 0.00 0.00 174.74 167.29 1n4c n PRO 147 N 3.19 -0.32 -0.37 2.88 -0.02 -1.26 0.12 135.00 139.21 1n4c n PRO 147 Ca 0.12 1.15 0.31 0.00 -2.02 0.00 0.00 63.50 63.07 1n4c n PRO 147 Cb 0.36 -1.69 0.58 0.00 -0.02 0.00 0.00 33.50 32.74 1n4c n PRO 147 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1n4c h ASP 148 N 0.00 0.35 1.23 2.55 1.82 -1.97 2.25 116.42 122.65 1n4c h ASP 148 Ca 0.12 0.19 0.00 0.00 -0.39 0.00 0.00 57.03 56.95 1n4c h ASP 148 Cb 0.30 0.17 0.00 0.00 0.68 0.00 0.00 39.33 40.48 1n4c h ASP 148 CO -0.69 -0.24 0.00 0.29 -1.61 0.00 0.00 179.24 176.99 1n4c n LYS 149 N -4.96 0.21 -1.52 0.28 5.02 0.12 -3.31 118.16 114.00 1n4c n LYS 149 Ca 0.36 0.23 -0.06 0.00 -2.02 0.00 0.00 58.31 56.82 1n4c n LYS 149 Cb 1.25 -1.77 0.10 0.00 -0.02 0.00 0.00 35.03 34.59 1n4c n LYS 149 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n4c n ALA 150 N -1.74 3.86 -2.58 7.82 0.00 0.74 -4.87 120.51 123.74 1n4c n ALA 150 Ca 0.05 -3.29 -0.42 0.00 0.00 0.00 0.00 53.44 49.78 1n4c n ALA 150 Cb 0.37 -0.46 -0.05 0.00 0.00 0.00 0.00 19.45 19.31 1n4c n ALA 150 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1n4c s THR 151 N -3.39 4.75 -0.96 0.00 2.01 0.17 -3.94 115.64 114.29 1n4c s THR 151 Ca 0.41 0.85 0.00 0.00 0.31 0.00 0.00 61.69 63.26 1n4c s THR 151 Cb 0.38 -4.19 0.00 0.00 0.01 0.00 0.00 72.50 68.70 1n4c s THR 151 CO -0.04 -0.41 0.00 0.61 -0.69 0.00 0.00 174.62 174.09 1n4c n GLY 152 N 4.54 0.86 3.77 4.40 0.00 -1.26 -4.92 105.19 112.58 1n4c n GLY 152 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 1n4c n GLY 152 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n4c s GLN 153 N -2.59 4.55 0.42 1.61 -1.52 -1.25 -4.91 119.66 115.96 1n4c s GLN 153 Ca 0.00 1.13 0.35 0.00 -1.95 0.00 0.00 55.36 54.89 1n4c s GLN 153 Cb 0.00 -3.28 1.35 0.00 -0.22 0.00 0.00 33.01 30.86 1n4c s GLN 153 CO 0.00 0.52 1.30 -2.30 -0.25 0.00 0.00 175.29 174.56 1n4c n PRO 154 N 1.80 -0.01 -1.15 2.91 -0.02 -1.26 0.26 135.00 137.53 1n4c n PRO 154 Ca -0.05 0.97 -0.24 0.00 -2.02 0.00 0.00 63.50 62.16 1n4c n PRO 154 Cb 0.49 -2.07 0.15 0.00 -0.02 0.00 0.00 33.50 32.05 1n4c n PRO 154 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 1n4c n TYR 155 N -3.97 2.84 0.14 6.00 4.11 -1.26 -4.52 117.16 120.51 1n4c n TYR 155 Ca 0.35 -1.92 0.03 0.00 -0.00 0.00 0.00 57.90 56.36 1n4c n TYR 155 Cb 1.50 -0.97 0.43 0.00 -0.00 0.00 0.00 39.34 40.30 1n4c n TYR 155 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.86 178.35 1n4c h GLU 156 N 1.08 0.18 -0.02 -3.48 4.81 0.34 -2.34 114.58 115.15 1n4c h GLU 156 Ca 0.58 -0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 59.63 1n4c h GLU 156 Cb 2.39 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 31.73 1n4c h GLU 156 CO 1.09 0.31 -0.66 1.96 -0.73 0.00 0.00 179.01 180.98 1n4c h GLN 157 N 0.18 0.08 -0.11 1.92 1.08 -1.81 -3.22 115.11 113.22 1n4c h GLN 157 Ca 0.04 -0.06 -0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1n4c h GLN 157 Cb 0.32 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.76 1n4c h GLN 157 CO 0.02 0.71 0.07 1.88 -0.95 0.00 0.00 178.83 180.56 1n4c h TYR 158 N 0.05 0.15 -0.17 2.96 -1.99 -1.76 -2.98 116.97 113.23 1n4c h TYR 158 Ca -0.01 -0.00 0.05 0.00 2.00 0.00 0.00 58.73 60.76 1n4c h TYR 158 Cb 1.18 -0.05 -0.07 0.00 2.00 0.00 0.00 36.73 39.79 1n4c h TYR 158 CO 0.01 0.15 -0.43 0.00 -0.00 0.00 0.00 178.16 177.89 1n4c h ALA 159 N 0.99 -0.58 -0.41 3.88 0.00 -1.56 0.36 119.26 121.94 1n4c h ALA 159 Ca 0.04 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.06 1n4c h ALA 159 Cb 0.05 0.81 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1n4c h ALA 159 CO -0.01 -0.92 0.29 0.87 0.00 0.00 0.00 179.25 179.48 1n4c h LYS 160 N -0.47 0.03 0.11 0.00 1.79 -1.65 0.59 116.57 116.98 1n4c h LYS 160 Ca 0.08 -0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.55 1n4c h LYS 160 Cb 0.62 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.26 1n4c h LYS 160 CO -0.43 0.02 -0.05 0.52 -1.08 0.00 0.00 179.45 178.43 1n4c h MET 161 N 0.03 -0.14 0.00 3.15 2.86 -0.84 -3.22 114.93 116.77 1n4c h MET 161 Ca 0.19 0.01 -0.12 0.00 -2.06 0.00 0.00 59.70 57.72 1n4c h MET 161 Cb 0.74 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.41 1n4c h MET 161 CO -0.01 0.34 -0.59 0.82 1.06 0.00 0.00 176.91 178.53 1n4c h ILE 162 N -0.88 1.19 0.44 -1.22 2.04 -0.81 -2.89 117.51 115.38 1n4c h ILE 162 Ca -0.02 -2.20 -0.02 0.00 1.00 0.00 0.00 64.86 63.63 1n4c h ILE 162 Cb 0.55 2.27 0.00 0.00 -0.74 0.00 0.00 36.82 38.90 1n4c h ILE 162 CO 0.02 0.58 -0.21 0.15 0.00 0.00 0.00 178.15 178.69 1n4c h PHE 163 N 0.00 -0.55 -0.23 1.37 3.04 0.08 -0.84 116.94 119.81 1n4c h PHE 163 Ca -0.01 -0.01 -0.04 0.00 3.98 0.00 0.00 57.97 61.89 1n4c h PHE 163 Cb 1.22 0.18 -0.01 0.00 2.56 0.00 0.00 35.95 39.90 1n4c h PHE 163 CO 0.00 -0.29 -0.00 0.52 -2.02 0.00 0.00 178.31 176.51 1n4c h MET 164 N -0.67 0.40 -0.95 1.11 2.86 -1.64 -2.59 114.93 113.44 1n4c h MET 164 Ca -0.06 -0.13 0.11 0.00 -2.06 0.00 0.00 59.70 57.56 1n4c h MET 164 Cb 0.50 -0.04 -0.08 0.00 0.06 0.00 0.00 31.60 32.04 1n4c h MET 164 CO 0.10 0.59 0.59 0.93 1.06 0.00 0.00 176.91 180.17 1n4c h GLU 165 N 0.17 0.92 -0.16 1.72 5.08 -1.49 1.35 114.58 122.18 1n4c h GLU 165 Ca 0.06 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1n4c h GLU 165 Cb 0.41 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1n4c h GLU 165 CO 0.01 0.61 0.06 -0.07 -1.00 0.00 0.00 179.01 178.63 1n4c h LEU 166 N 0.95 0.22 0.00 1.33 -0.00 -0.98 -2.37 115.31 114.45 1n4c h LEU 166 Ca 0.46 -0.16 0.00 0.00 -0.00 0.00 0.00 57.88 58.18 1n4c h LEU 166 Cb 0.42 -0.06 0.00 0.00 -0.00 0.00 0.00 40.66 41.03 1n4c h LEU 166 CO -0.25 0.32 -0.02 -3.20 -0.00 0.00 0.00 178.44 175.28 1n4c n ASN 167 N -4.87 0.16 -0.02 -0.43 2.85 -0.62 -3.01 115.26 109.32 1n4c n ASN 167 Ca -0.05 0.48 -0.05 0.00 -0.11 0.00 0.00 54.58 54.86 1n4c n ASN 167 Cb 0.12 -0.52 -0.04 0.00 1.24 0.00 0.00 39.78 40.58 1n4c n ASN 167 CO 0.00 0.00 0.00 -0.78 -2.11 0.00 0.00 177.26 174.37 1n4c h ASP 168 N 0.00 -0.06 0.12 1.20 1.82 0.22 -3.16 116.42 116.56 1n4c h ASP 168 Ca 0.00 -0.27 -0.02 0.00 -0.39 0.00 0.00 57.03 56.34 1n4c h ASP 168 Cb 0.54 0.02 -0.00 0.00 0.68 0.00 0.00 39.33 40.56 1n4c h ASP 168 CO 0.00 0.56 -0.12 0.00 -1.61 0.00 0.00 179.24 178.07 1n4c h ALA 169 N -0.70 1.79 -0.96 -0.78 0.00 -1.56 -1.58 119.26 115.47 1n4c h ALA 169 Ca -0.01 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.85 1n4c h ALA 169 Cb 0.33 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 1n4c h ALA 169 CO 0.01 0.15 0.62 2.35 0.00 0.00 0.00 179.25 182.38 1n4c h TRP 170 N 0.00 1.14 -0.74 0.00 2.91 -1.61 0.44 115.95 118.08 1n4c h TRP 170 Ca -0.00 0.03 0.05 0.00 1.13 0.00 0.00 58.89 60.09 1n4c h TRP 170 Cb 0.21 -0.37 -0.04 0.00 -0.51 0.00 0.00 29.16 28.44 1n4c h TRP 170 CO 0.00 0.61 0.49 0.66 -1.03 0.00 0.00 178.44 179.16 1n4c h SER 171 N 1.13 0.74 0.93 2.65 4.64 -1.25 -0.61 113.55 121.79 1n4c h SER 171 Ca 0.40 -0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.51 1n4c h SER 171 Cb 0.14 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.04 1n4c h SER 171 CO -0.15 0.50 -0.99 -0.08 -0.87 0.00 0.00 176.83 175.24 1n4c h GLU 172 N 0.85 0.03 -0.61 4.77 4.57 -0.87 -3.20 114.58 120.12 1n4c h GLU 172 Ca 0.30 -0.04 0.15 0.00 -1.18 0.00 0.00 59.36 58.59 1n4c h GLU 172 Cb 0.13 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.70 1n4c h GLU 172 CO -0.09 0.99 0.43 0.35 -1.18 0.00 0.00 179.01 179.50 1n4c h PHE 173 N 0.01 0.18 -0.54 0.92 3.57 0.14 2.23 116.94 123.45 1n4c h PHE 173 Ca -0.02 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.41 1n4c h PHE 173 Cb 1.73 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 40.39 1n4c h PHE 173 CO 0.01 0.07 0.04 0.93 -2.23 0.00 0.00 178.31 177.13 1n4c h GLU 174 N 0.16 0.92 0.14 1.11 5.08 -1.50 2.23 114.58 122.72 1n4c h GLU 174 Ca 0.29 -0.27 -0.35 0.00 -1.00 0.00 0.00 59.36 58.03 1n4c h GLU 174 Cb 0.95 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.09 1n4c h GLU 174 CO -0.04 0.92 -1.84 -0.97 -1.00 0.00 0.00 179.01 176.07 1n4c h ASN 175 N 0.80 0.46 1.00 1.42 -0.73 -1.00 -3.23 115.58 114.30 1n4c h ASN 175 Ca 0.16 -0.93 -0.15 0.00 1.87 0.00 0.00 56.30 57.26 1n4c h ASN 175 Cb 0.47 -0.15 -0.02 0.00 0.27 0.00 0.00 38.32 38.89 1n4c h ASN 175 CO 0.02 1.81 -1.07 -0.61 -0.37 0.00 0.00 177.43 177.21 1n4c h GLN 176 N 0.00 0.00 0.15 6.67 -0.00 0.35 -3.37 115.11 118.92 1n4c h GLN 176 Ca -0.39 0.00 -0.32 0.00 -0.00 0.00 0.00 58.65 57.94 1n4c h GLN 176 Cb 2.00 0.00 0.00 0.00 0.00 0.00 0.00 27.48 29.48 1n4c h GLN 176 CO 0.10 0.39 -1.57 0.78 0.00 0.00 0.00 178.83 178.53 1n4c h GLY 177 N 3.61 0.37 -4.73 2.39 0.00 0.37 -3.36 103.07 101.72 1n4c h GLY 177 Ca -0.10 -0.95 -0.06 0.00 0.00 0.00 0.00 47.33 46.22 1n4c h GLY 177 CO 0.06 0.84 0.29 -1.06 0.00 0.00 0.00 176.54 176.66 1n4c n GLN 178 N -3.53 0.62 -3.72 4.80 1.13 -1.12 -4.66 117.38 110.89 1n4c n GLN 178 Ca -0.18 -0.32 -0.13 0.00 -1.94 0.00 0.00 57.00 54.42 1n4c n GLN 178 Cb 1.06 -1.67 -0.07 0.00 0.11 0.00 0.00 30.24 29.66 1n4c n GLN 178 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 1n4c s LYS 179 N 2.46 0.80 -0.20 -1.09 1.02 -1.26 -5.03 119.74 116.45 1n4c s LYS 179 Ca 0.20 -0.33 -0.42 0.00 0.02 0.00 0.00 55.97 55.44 1n4c s LYS 179 Cb 0.09 0.35 -0.20 0.00 -0.52 0.00 0.00 37.83 37.56 1n4c s LYS 179 CO -0.00 -0.25 1.32 -2.30 -0.92 0.00 0.00 175.35 173.20 1n4c n PRO 180 N 0.81 0.12 -1.99 -1.68 -0.02 -1.26 -4.80 135.00 126.17 1n4c n PRO 180 Ca -0.20 0.04 -0.42 0.00 -2.02 0.00 0.00 63.50 60.91 1n4c n PRO 180 Cb 0.58 -1.56 -0.00 0.00 -0.02 0.00 0.00 33.50 32.50 1n4c n PRO 180 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1n4c n LEU 181 N 2.69 7.04 0.00 2.45 0.00 -1.26 -5.12 117.00 122.80 1n4c n LEU 181 Ca 0.24 -4.46 0.00 0.00 0.00 0.00 0.00 56.01 51.79 1n4c n LEU 181 Cb 0.04 -1.54 0.00 0.00 0.00 0.00 0.00 43.42 41.92 1n4c n LEU 181 CO 0.73 1.40 0.00 -1.22 0.00 0.00 0.00 177.39 178.30