#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 0.76 -1.67 1.61 -0.04 -1.26 -4.87 135.00 129.54 1n4c n PRO 2 Ca 0.00 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.17 1n4c n PRO 2 Cb 0.00 -1.16 0.10 0.00 -0.04 0.00 0.00 33.50 32.39 1n4c n PRO 2 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1n4c s LEU 3 N 0.00 2.47 0.00 1.53 1.02 -1.26 -5.04 118.68 117.40 1n4c s LEU 3 Ca 0.00 1.09 -0.17 0.00 0.02 0.00 0.00 54.13 55.06 1n4c s LEU 3 Cb 0.00 -3.63 0.26 0.00 0.02 0.00 0.00 46.19 42.84 1n4c s LEU 3 CO 0.00 -2.01 0.76 0.61 0.02 0.00 0.00 176.35 175.72 1n4c n GLY 4 N -2.50 -3.29 2.70 -3.19 0.00 -1.26 -5.03 105.19 92.62 1n4c n GLY 4 Ca 0.07 -1.38 -0.06 0.00 0.00 0.00 0.00 46.02 44.65 1n4c n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1n4c n SER 5 N -4.81 -1.81 -4.77 1.61 3.41 -1.26 -5.11 113.62 100.89 1n4c n SER 5 Ca 0.11 -2.80 -0.39 0.00 -0.26 0.00 0.00 58.87 55.54 1n4c n SER 5 Cb 0.46 1.55 -0.04 0.00 -0.26 0.00 0.00 64.21 65.91 1n4c n SER 5 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1n4c s PRO 6 N 0.17 4.48 0.15 4.33 0.04 -1.26 -4.96 135.00 137.94 1n4c s PRO 6 Ca 0.21 1.63 0.01 0.00 0.04 0.00 0.00 61.00 62.90 1n4c s PRO 6 Cb 0.29 -2.93 -0.05 0.00 0.04 0.00 0.00 34.50 31.86 1n4c s PRO 6 CO -0.13 0.11 1.35 0.93 0.04 0.00 0.00 177.00 179.30 1n4c h GLU 7 N 3.31 0.22 0.00 4.56 5.08 -2.04 -3.39 114.58 122.31 1n4c h GLU 7 Ca -0.47 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 57.64 1n4c h GLU 7 Cb 1.21 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1n4c h GLU 7 CO 0.65 0.99 0.00 1.19 -1.00 0.00 0.00 179.01 180.84 1n4c n PHE 8 N -3.65 0.00 -2.34 4.33 3.72 -1.26 -4.71 117.46 113.56 1n4c n PHE 8 Ca -0.04 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 56.98 1n4c n PHE 8 Cb 0.83 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.35 1n4c n PHE 8 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1n4c s SER 9 N -1.94 6.55 -0.45 4.37 0.15 -1.26 -4.99 113.70 116.13 1n4c s SER 9 Ca 0.00 2.28 0.07 0.00 0.70 0.00 0.00 55.95 59.00 1n4c s SER 9 Cb 0.00 -2.61 0.26 0.00 -1.71 0.00 0.00 66.02 61.96 1n4c s SER 9 CO 0.00 -0.65 0.80 0.23 1.20 0.00 0.00 173.24 174.82 1n4c n MET 10 N 0.03 0.80 -0.94 5.44 2.81 -1.26 -4.52 117.12 119.47 1n4c n MET 10 Ca 0.05 -2.27 -0.35 0.00 -1.81 0.00 0.00 57.70 53.32 1n4c n MET 10 Cb 0.47 -1.36 0.08 0.00 -0.71 0.00 0.00 33.22 31.70 1n4c n MET 10 CO 0.00 0.00 0.00 -2.30 1.51 0.00 0.00 175.97 175.18 1n4c n PRO 11 N 1.36 -0.10 -3.61 0.03 -0.02 -1.26 -5.03 135.00 126.37 1n4c n PRO 11 Ca 0.13 -0.01 -0.03 0.00 -2.02 0.00 0.00 63.50 61.57 1n4c n PRO 11 Cb 0.61 -1.43 -0.06 0.00 -0.02 0.00 0.00 33.50 32.61 1n4c n PRO 11 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1n4c s HIS 12 N -2.16 -0.99 0.00 6.00 -3.43 -1.26 -5.04 115.29 108.41 1n4c s HIS 12 Ca 0.50 1.86 0.00 0.00 -0.80 0.00 0.00 55.06 56.61 1n4c s HIS 12 Cb -0.22 0.59 0.00 0.00 -1.43 0.00 0.00 32.58 31.52 1n4c s HIS 12 CO 0.74 -0.49 0.85 -1.13 -2.00 0.00 0.00 174.74 172.71 1n4c n SER 13 N 4.56 -0.84 -2.72 7.38 3.41 -1.26 -5.00 113.62 119.15 1n4c n SER 13 Ca -0.16 -1.71 -0.08 0.00 -0.26 0.00 0.00 58.87 56.66 1n4c n SER 13 Cb 0.55 0.25 0.09 0.00 -0.26 0.00 0.00 64.21 64.85 1n4c n SER 13 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1n4c n SER 14 N 0.00 -2.14 -1.18 4.04 2.88 -1.26 -5.00 113.62 110.97 1n4c n SER 14 Ca -0.24 -3.31 0.00 0.00 -1.33 0.00 0.00 58.87 54.00 1n4c n SER 14 Cb 0.63 1.77 0.00 0.00 -0.75 0.00 0.00 64.21 65.86 1n4c n SER 14 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1n4c n PRO 15 N 0.44 0.79 -3.61 -1.46 -0.04 -1.26 -4.73 135.00 125.14 1n4c n PRO 15 Ca 0.04 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.38 1n4c n PRO 15 Cb 0.71 -1.10 -0.06 0.00 -0.04 0.00 0.00 33.50 33.00 1n4c n PRO 15 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1n4c s GLN 16 N 0.27 0.64 -0.88 0.54 0.74 -1.26 -5.04 119.66 114.67 1n4c s GLN 16 Ca 0.00 0.51 -0.20 0.00 0.05 0.00 0.00 55.36 55.72 1n4c s GLN 16 Cb 0.00 0.31 -0.12 0.00 1.10 0.00 0.00 33.01 34.30 1n4c s GLN 16 CO 0.00 -0.13 1.99 0.27 -0.55 0.00 0.00 175.29 176.87 1n4c n ASN 17 N 1.76 2.94 -2.70 6.67 6.94 -1.26 -4.23 115.26 125.37 1n4c n ASN 17 Ca -0.13 -2.67 -0.06 0.00 -0.02 0.00 0.00 54.58 51.69 1n4c n ASN 17 Cb 0.56 -1.19 0.10 0.00 -2.36 0.00 0.00 39.78 36.89 1n4c n ASN 17 CO 0.00 0.00 0.00 -1.14 -1.03 0.00 0.00 177.26 175.09 1n4c n ARG 18 N 6.63 0.63 0.00 -3.83 0.63 -1.26 -4.99 116.66 114.47 1n4c n ARG 18 Ca 0.50 -1.38 0.00 0.00 -0.92 0.00 0.00 57.85 56.04 1n4c n ARG 18 Cb 0.38 -0.64 0.00 0.00 0.45 0.00 0.00 32.46 32.65 1n4c n ARG 18 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1n4c n PRO 19 N 0.44 0.77 0.00 -0.14 -0.04 -1.26 -4.54 135.00 130.23 1n4c n PRO 19 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1n4c n PRO 19 Cb 0.73 -1.33 0.00 0.00 -0.04 0.00 0.00 33.50 32.86 1n4c n PRO 19 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1n4c n ASN 20 N 0.02 0.00 -3.73 3.54 3.02 -1.26 -5.06 115.26 111.79 1n4c n ASN 20 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.46 1n4c n ASN 20 Cb 0.16 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.30 1n4c n ASN 20 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1n4c s TYR 21 N 0.00 -0.18 -0.50 3.10 2.02 -1.26 -5.11 117.35 115.41 1n4c s TYR 21 Ca 0.00 -0.17 -0.29 0.00 -0.37 0.00 0.00 57.07 56.25 1n4c s TYR 21 Cb 0.00 0.49 0.03 0.00 -0.40 0.00 0.00 41.96 42.08 1n4c s TYR 21 CO 0.00 -0.99 1.21 0.54 -1.57 0.00 0.00 175.55 174.74 1n4c s ASN 22 N -2.87 6.50 -1.12 2.29 4.22 -1.26 -4.91 114.94 117.79 1n4c s ASN 22 Ca 0.09 0.40 -0.25 0.00 -2.14 0.00 0.00 52.86 50.96 1n4c s ASN 22 Cb -0.02 -2.55 -0.18 0.00 1.28 0.00 0.00 41.25 39.78 1n4c s ASN 22 CO -0.01 -1.38 2.05 -0.69 -2.04 0.00 0.00 177.10 175.03 1n4c s VAL 23 N 4.86 3.21 -0.03 3.54 1.01 -1.26 -4.76 120.40 126.97 1n4c s VAL 23 Ca 0.49 -0.36 -0.29 0.00 0.00 0.00 0.00 61.98 61.82 1n4c s VAL 23 Cb -0.08 -4.21 0.10 0.00 0.00 0.00 0.00 36.38 32.18 1n4c s VAL 23 CO 0.30 -0.39 0.86 -0.44 0.00 0.00 0.00 175.10 175.43 1n4c s SER 24 N 7.79 -0.42 1.04 3.32 0.01 -1.26 -5.17 113.70 119.00 1n4c s SER 24 Ca 0.77 0.19 -0.05 0.00 1.31 0.00 0.00 55.95 58.17 1n4c s SER 24 Cb -0.03 0.40 0.07 0.00 0.21 0.00 0.00 66.02 66.67 1n4c s SER 24 CO 0.17 -0.58 0.29 0.49 0.41 0.00 0.00 173.24 174.02 1n4c n PHE 25 N 0.13 -3.53 0.00 2.43 3.01 -1.26 -5.03 117.46 113.21 1n4c n PHE 25 Ca -0.11 -0.26 0.00 0.00 1.01 0.00 0.00 57.45 58.08 1n4c n PHE 25 Cb 0.61 -0.27 0.00 0.00 -0.01 0.00 0.00 39.48 39.80 1n4c n PHE 25 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1n4c n SER 26 N -3.36 0.00 -4.49 4.37 2.88 -1.26 -4.63 113.62 107.13 1n4c n SER 26 Ca 0.04 0.12 -0.49 0.00 -1.33 0.00 0.00 58.87 57.20 1n4c n SER 26 Cb 0.14 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.54 1n4c n SER 26 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1n4c n SER 27 N -0.39 2.39 0.04 -3.46 3.41 -1.26 -4.81 113.62 109.54 1n4c n SER 27 Ca 0.00 0.41 -0.12 0.00 -0.26 0.00 0.00 58.87 58.89 1n4c n SER 27 Cb 0.00 -1.32 -0.01 0.00 -0.26 0.00 0.00 64.21 62.62 1n4c n SER 27 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 1n4c h MET 28 N 12.65 0.49 -4.88 4.33 0.00 -2.00 -3.39 114.93 122.12 1n4c h MET 28 Ca -0.31 -0.43 -0.70 0.00 0.00 0.00 0.00 59.70 58.26 1n4c h MET 28 Cb 1.30 0.10 -0.19 0.00 0.00 0.00 0.00 31.60 32.82 1n4c h MET 28 CO 1.00 1.07 0.64 -1.25 0.00 0.00 0.00 176.91 178.37 1n4c s PRO 29 N -3.54 3.50 0.00 -0.22 0.04 -1.26 -4.99 135.00 128.52 1n4c s PRO 29 Ca -0.07 -1.71 0.00 0.00 0.04 0.00 0.00 61.00 59.26 1n4c s PRO 29 Cb 0.10 -4.72 0.00 0.00 0.04 0.00 0.00 34.50 29.92 1n4c s PRO 29 CO 0.86 -1.69 0.00 0.41 0.04 0.00 0.00 177.00 176.62 1n4c n GLY 30 N 5.26 0.19 2.55 0.56 0.00 -1.26 -4.95 105.19 107.53 1n4c n GLY 30 Ca 0.17 -0.08 -0.06 0.00 0.00 0.00 0.00 46.02 46.05 1n4c n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n4c n GLY 31 N 4.15 -1.26 3.59 -0.02 0.00 -1.26 -4.88 105.19 105.51 1n4c n GLY 31 Ca 0.00 0.95 -0.43 0.00 0.00 0.00 0.00 46.02 46.54 1n4c n GLY 31 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n4c s GLN 32 N -2.23 3.57 0.00 1.61 -0.21 -1.26 -4.95 119.66 116.20 1n4c s GLN 32 Ca 0.19 0.67 0.00 0.00 0.02 0.00 0.00 55.36 56.24 1n4c s GLN 32 Cb -0.05 -4.00 0.00 0.00 1.00 0.00 0.00 33.01 29.96 1n4c s GLN 32 CO 0.60 -1.58 0.06 0.09 -2.12 0.00 0.00 175.29 172.35 1n4c n ASN 33 N 8.59 0.00 -4.57 5.90 3.02 -1.26 -4.28 115.26 122.65 1n4c n ASN 33 Ca 0.14 0.06 -0.41 0.00 -0.03 0.00 0.00 54.58 54.34 1n4c n ASN 33 Cb 0.49 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.63 1n4c n ASN 33 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1n4c s GLU 34 N -0.13 3.24 0.45 3.52 2.12 -1.26 -4.82 118.70 121.83 1n4c s GLU 34 Ca 0.00 0.50 0.26 0.00 0.36 0.00 0.00 54.97 56.09 1n4c s GLU 34 Cb 0.00 -4.15 1.40 0.00 0.26 0.00 0.00 34.13 31.64 1n4c s GLU 34 CO 0.00 -2.00 1.76 -0.09 -0.54 0.00 0.00 175.26 174.39 1n4c h ARG 35 N 11.45 0.00 -3.58 4.30 2.43 -2.02 -3.45 114.38 123.51 1n4c h ARG 35 Ca -0.27 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 58.85 1n4c h ARG 35 Cb 1.10 0.00 0.04 0.00 -0.42 0.00 0.00 29.97 30.69 1n4c h ARG 35 CO 1.18 0.00 -0.16 0.41 -1.51 0.00 0.00 179.97 179.89 1n4c n GLY 36 N -1.23 0.21 1.70 2.80 0.00 -1.26 -4.85 105.19 102.55 1n4c n GLY 36 Ca -0.02 -0.07 -0.00 0.00 0.00 0.00 0.00 46.02 45.94 1n4c n GLY 36 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1n4c n LYS 37 N -1.75 0.63 0.00 1.61 2.85 -1.26 -4.84 118.16 115.41 1n4c n LYS 37 Ca -0.01 -0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.24 1n4c n LYS 37 Cb 0.52 -1.20 0.00 0.00 -0.65 0.00 0.00 35.03 33.70 1n4c n LYS 37 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1n4c n ALA 38 N 1.71 0.00 -3.64 0.58 0.00 -1.26 -5.07 120.51 112.83 1n4c n ALA 38 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.36 1n4c n ALA 38 Cb 0.31 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.70 1n4c n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n4c s ALA 39 N -2.10 -1.93 -0.04 0.00 0.00 -1.26 -5.17 121.76 111.26 1n4c s ALA 39 Ca 0.00 2.17 -0.29 0.00 0.00 0.00 0.00 51.96 53.84 1n4c s ALA 39 Cb 0.00 -1.40 0.09 0.00 0.00 0.00 0.00 23.12 21.81 1n4c s ALA 39 CO 0.00 -0.34 0.76 0.00 0.00 0.00 0.00 175.76 176.19 1n4c s ALA 40 N 0.95 -1.79 0.00 0.00 0.00 -1.26 -5.09 121.76 114.57 1n4c s ALA 40 Ca -0.04 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.14 1n4c s ALA 40 Cb -0.05 0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.08 1n4c s ALA 40 CO -0.10 -0.45 0.00 0.27 0.00 0.00 0.00 175.76 175.48 1n4c n ASN 41 N 0.55 0.00 -3.38 0.00 0.23 -1.26 -4.98 115.26 106.43 1n4c n ASN 41 Ca -0.16 0.00 -0.32 0.00 -0.53 0.00 0.00 54.58 53.58 1n4c n ASN 41 Cb 0.59 0.22 -0.03 0.00 -2.08 0.00 0.00 39.78 38.47 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 -1.76 5.01 -4.56 -4.53 4.32 -1.26 -4.85 117.00 109.38 1n4c n LEU 42 Ca 0.00 -3.07 -0.28 0.00 -0.02 0.00 0.00 56.01 52.64 1n4c n LEU 42 Cb 0.00 -1.17 -0.05 0.00 -1.62 0.00 0.00 43.42 40.58 1n4c n LEU 42 CO 0.00 0.40 1.43 -1.61 -1.22 0.00 0.00 177.39 176.39 1n4c s GLU 43 N 3.87 2.40 0.00 3.23 2.02 -1.26 -4.20 118.70 124.76 1n4c s GLU 43 Ca 0.48 0.15 0.00 0.00 0.02 0.00 0.00 54.97 55.62 1n4c s GLU 43 Cb 0.12 -4.83 0.00 0.00 0.10 0.00 0.00 34.13 29.52 1n4c s GLU 43 CO 0.01 -3.38 0.00 0.41 0.02 0.00 0.00 175.26 172.32 1n4c n GLY 44 N 6.52 -2.06 1.85 -1.39 0.00 -1.26 -4.94 105.19 103.92 1n4c n GLY 44 Ca 0.36 0.67 -0.01 0.00 0.00 0.00 0.00 46.02 47.04 1n4c n GLY 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n4c n LYS 45 N -0.65 0.57 -1.63 1.61 5.02 -1.26 -4.63 118.16 117.18 1n4c n LYS 45 Ca 0.00 -0.09 -0.41 0.00 -2.02 0.00 0.00 58.31 55.79 1n4c n LYS 45 Cb 0.00 -1.35 -0.01 0.00 -0.02 0.00 0.00 35.03 33.65 1n4c n LYS 45 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1n4c n GLN 46 N 1.95 2.94 -3.64 1.97 6.02 -1.26 -4.79 117.38 120.56 1n4c n GLN 46 Ca 0.04 -2.50 -0.06 0.00 -0.01 0.00 0.00 57.00 54.47 1n4c n GLN 46 Cb 0.28 -3.19 -0.06 0.00 1.02 0.00 0.00 30.24 28.28 1n4c n GLN 46 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 1n4c s LYS 47 N 3.09 0.66 0.00 -1.09 -2.85 -1.26 -5.01 119.74 113.28 1n4c s LYS 47 Ca 0.51 1.21 0.00 0.00 -1.00 0.00 0.00 55.97 56.69 1n4c s LYS 47 Cb 0.15 0.24 0.00 0.00 -2.06 0.00 0.00 37.83 36.16 1n4c s LYS 47 CO -0.08 -0.15 0.00 0.00 0.10 0.00 0.00 175.35 175.22 1n4c n ALA 48 N 4.44 0.00 -1.61 0.59 0.00 -1.26 -5.02 120.51 117.64 1n4c n ALA 48 Ca -0.19 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.89 1n4c n ALA 48 Cb 0.57 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.97 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 0.00 2.68 -0.03 0.00 0.00 -1.26 -3.78 120.51 118.12 1n4c n ALA 49 Ca 0.00 -3.21 0.00 0.00 0.00 0.00 0.00 53.44 50.23 1n4c n ALA 49 Cb 0.00 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 15.88 1n4c n ALA 49 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1n4c n ASP 50 N 10.55 0.00 -3.77 0.00 5.68 -1.26 -5.00 116.55 122.75 1n4c n ASP 50 Ca 0.48 0.00 -0.42 0.00 -0.50 0.00 0.00 54.79 54.34 1n4c n ASP 50 Cb 0.43 0.24 0.00 0.00 -1.14 0.00 0.00 41.12 40.66 1n4c n ASP 50 CO 0.00 0.00 0.00 0.33 -1.33 0.00 0.00 177.20 176.20 1n4c n PHE 51 N -1.96 3.33 0.00 2.11 -0.00 -1.25 -3.67 117.46 116.02 1n4c n PHE 51 Ca 0.00 -2.91 0.00 0.00 -0.00 0.00 0.00 57.45 54.54 1n4c n PHE 51 Cb 0.00 -2.35 0.00 0.00 -0.00 0.00 0.00 39.48 37.13 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 5.34 0.00 -3.14 -4.13 2.13 -1.26 -5.08 120.64 114.49 1n4c n GLU 52 Ca 0.48 0.00 0.05 0.00 0.66 0.00 0.00 57.16 58.35 1n4c n GLU 52 Cb 0.38 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.09 1n4c n GLU 52 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1n4c s ASP 53 N -0.68 -0.82 0.00 4.31 2.15 -1.24 -5.03 116.67 115.37 1n4c s ASP 53 Ca 0.00 0.07 0.00 0.00 0.43 0.00 0.00 52.55 53.05 1n4c s ASP 53 Cb 0.00 1.50 0.00 0.00 -0.30 0.00 0.00 42.92 44.12 1n4c s ASP 53 CO 0.00 -0.15 0.00 -0.11 -0.17 0.00 0.00 175.17 174.74 1n4c n LEU 54 N 5.16 0.00 -0.33 -1.34 7.94 -1.26 -4.88 117.00 122.28 1n4c n LEU 54 Ca 0.08 0.00 0.04 0.00 -1.11 0.00 0.00 56.01 55.02 1n4c n LEU 54 Cb 0.57 0.19 0.14 0.00 0.53 0.00 0.00 43.42 44.85 1n4c n LEU 54 CO -0.13 -0.19 0.61 0.18 -1.11 0.00 0.00 177.39 176.75 1n4c n LEU 55 N -1.87 0.95 0.12 -1.96 4.77 -1.26 -4.17 117.00 113.58 1n4c n LEU 55 Ca 0.00 -0.47 -0.13 0.00 -0.03 0.00 0.00 56.01 55.39 1n4c n LEU 55 Cb 0.00 -0.11 -0.06 0.00 -2.33 0.00 0.00 43.42 40.92 1n4c n LEU 55 CO 0.00 0.23 0.70 0.77 -1.33 0.00 0.00 177.39 177.76 1n4c h SER 56 N 1.08 -0.70 0.05 -1.43 4.64 -1.97 -0.97 113.55 114.24 1n4c h SER 56 Ca 0.00 0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1n4c h SER 56 Cb 0.24 0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1n4c h SER 56 CO 0.00 -0.34 -0.02 1.23 -0.87 0.00 0.00 176.83 176.83 1n4c h GLY 57 N -0.46 -0.07 1.18 -0.77 0.00 -1.98 -2.54 103.07 98.44 1n4c h GLY 57 Ca 0.03 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1n4c h GLY 57 CO -0.14 -0.03 0.23 -0.18 0.00 0.00 0.00 176.54 176.43 1n4c n GLN 58 N -4.91 0.03 0.01 4.80 7.27 -1.15 -2.65 117.38 120.78 1n4c n GLN 58 Ca -0.08 0.37 -0.01 0.00 0.07 0.00 0.00 57.00 57.35 1n4c n GLN 58 Cb 0.24 -1.82 -0.01 0.00 2.41 0.00 0.00 30.24 31.07 1n4c n GLN 58 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 1n4c h GLY 59 N 0.00 -1.28 -7.28 1.69 0.00 -0.72 -3.32 103.07 92.16 1n4c h GLY 59 Ca 0.00 0.56 -0.57 0.00 0.00 0.00 0.00 47.33 47.32 1n4c h GLY 59 CO 0.00 -0.47 0.87 -1.36 0.00 0.00 0.00 176.54 175.58 1n4c s PHE 60 N -3.25 2.46 0.00 5.60 0.08 -1.08 -4.71 117.98 117.07 1n4c s PHE 60 Ca -0.01 -0.16 0.00 0.00 0.12 0.00 0.00 56.93 56.88 1n4c s PHE 60 Cb 0.01 -4.48 0.00 0.00 -0.57 0.00 0.00 43.02 37.97 1n4c s PHE 60 CO 0.06 -1.86 0.00 -1.71 -0.10 0.00 0.00 175.22 171.60 1n4c n ASN 61 N 8.68 0.00 -4.49 1.36 5.15 -1.25 -5.07 115.26 119.64 1n4c n ASN 61 Ca 0.01 0.00 -0.45 0.00 -0.60 0.00 0.00 54.58 53.54 1n4c n ASN 61 Cb 0.48 0.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.71 1n4c n ASN 61 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1n4c n ALA 62 N -3.00 -1.42 -1.61 5.20 0.00 -1.26 -4.71 120.51 113.70 1n4c n ALA 62 Ca 0.00 0.34 -0.54 0.00 0.00 0.00 0.00 53.44 53.24 1n4c n ALA 62 Cb 0.00 -1.82 -0.07 0.00 0.00 0.00 0.00 19.45 17.57 1n4c n ALA 62 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1n4c n HIS 63 N -0.15 1.54 -4.88 0.00 1.44 -1.26 -4.95 115.22 106.95 1n4c n HIS 63 Ca 0.13 0.68 -0.26 0.00 -2.01 0.00 0.00 57.72 56.25 1n4c n HIS 63 Cb 0.32 -2.33 -0.15 0.00 0.12 0.00 0.00 29.99 27.95 1n4c n HIS 63 CO 0.00 0.00 0.00 -1.59 -2.81 0.00 0.00 176.34 171.94 1n4c s LYS 64 N 1.11 1.54 1.05 -1.40 -2.85 -1.26 -5.13 119.74 112.81 1n4c s LYS 64 Ca 0.88 -0.76 -0.18 0.00 -1.00 0.00 0.00 55.97 54.91 1n4c s LYS 64 Cb -1.03 -1.53 0.08 0.00 -2.06 0.00 0.00 37.83 33.29 1n4c s LYS 64 CO 0.53 0.41 -0.15 -3.47 0.10 0.00 0.00 175.35 172.77 1n4c n ASP 65 N 2.41 -2.68 -4.57 0.03 2.03 -1.26 -4.72 116.55 107.78 1n4c n ASP 65 Ca -0.16 -0.20 -0.47 0.00 0.52 0.00 0.00 54.79 54.48 1n4c n ASP 65 Cb 0.53 -0.80 -0.03 0.00 -0.72 0.00 0.00 41.12 40.10 1n4c n ASP 65 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1n4c n LYS 66 N -1.13 1.18 -2.85 -0.67 3.00 -1.26 -4.91 118.16 111.52 1n4c n LYS 66 Ca 0.02 0.42 -0.11 0.00 -0.00 0.00 0.00 58.31 58.63 1n4c n LYS 66 Cb 0.54 -1.85 0.04 0.00 0.00 0.00 0.00 35.03 33.76 1n4c n LYS 66 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1n4c n LYS 67 N 1.36 1.07 -0.09 1.64 3.00 -1.26 -5.13 118.16 118.75 1n4c n LYS 67 Ca 0.13 -2.74 -0.05 0.00 -0.00 0.00 0.00 58.31 55.65 1n4c n LYS 67 Cb 0.27 -1.12 0.05 0.00 0.00 0.00 0.00 35.03 34.23 1n4c n LYS 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1n4c n GLY 68 N 0.04 -2.68 2.89 3.14 0.00 -1.26 -4.92 105.19 102.40 1n4c n GLY 68 Ca 0.11 -0.88 -0.10 0.00 0.00 0.00 0.00 46.02 45.15 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 -1.87 -1.39 -2.25 1.61 -0.02 -1.26 -4.81 135.00 125.01 1n4c n PRO 69 Ca 0.02 -0.41 -0.39 0.00 -2.02 0.00 0.00 63.50 60.70 1n4c n PRO 69 Cb 0.10 -1.27 0.01 0.00 -0.02 0.00 0.00 33.50 32.32 1n4c n PRO 69 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1n4c n ARG 70 N -0.22 4.66 -3.18 -0.52 0.63 -1.26 -4.90 116.66 111.87 1n4c n ARG 70 Ca 0.04 -3.95 -0.35 0.00 -0.92 0.00 0.00 57.85 52.67 1n4c n ARG 70 Cb 0.20 -2.48 -0.06 0.00 0.45 0.00 0.00 32.46 30.56 1n4c n ARG 70 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 1n4c s THR 71 N -3.10 4.67 -1.34 5.15 -4.23 -1.26 -4.89 115.64 110.64 1n4c s THR 71 Ca 0.47 1.11 0.00 0.00 -1.18 0.00 0.00 61.69 62.09 1n4c s THR 71 Cb 0.23 -3.80 0.00 0.00 1.34 0.00 0.00 72.50 70.27 1n4c s THR 71 CO -0.15 0.17 0.57 0.00 -0.54 0.00 0.00 174.62 174.67 1n4c n ILE 72 N 0.63 0.53 0.18 2.99 3.06 -1.26 -0.84 119.36 124.65 1n4c n ILE 72 Ca -0.03 0.17 0.07 0.00 -2.50 0.00 0.00 62.75 60.46 1n4c n ILE 72 Cb 0.51 -1.17 0.14 0.00 0.54 0.00 0.00 39.64 39.67 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 1.60 0.83 0.00 1.51 0.00 -1.96 -3.20 119.26 118.04 1n4c h ALA 73 Ca 0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1n4c h ALA 73 Cb 0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1n4c h ALA 73 CO 0.00 0.37 -0.29 1.49 0.00 0.00 0.00 179.25 180.82 1n4c h GLU 74 N 0.00 0.00 0.38 0.00 4.81 -1.33 -3.31 114.58 115.13 1n4c h GLU 74 Ca -0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1n4c h GLU 74 Cb 1.16 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.54 1n4c h GLU 74 CO 0.04 0.16 -0.18 1.98 -0.73 0.00 0.00 179.01 180.28 1n4c h MET 75 N 0.00 -0.49 0.00 1.92 4.05 -1.70 -2.66 114.93 116.05 1n4c h MET 75 Ca -0.01 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.45 1n4c h MET 75 Cb 1.14 0.11 0.00 0.00 -0.80 0.00 0.00 31.60 32.05 1n4c h MET 75 CO 0.02 -0.33 0.02 2.89 0.23 0.00 0.00 176.91 179.75 1n4c n ARG 76 N -4.04 0.00 0.26 0.39 1.85 -1.25 -2.53 116.66 111.34 1n4c n ARG 76 Ca -0.06 0.12 0.15 0.00 -1.00 0.00 0.00 57.85 57.05 1n4c n ARG 76 Cb 0.20 -1.52 0.66 0.00 -1.05 0.00 0.00 32.46 30.74 1n4c n ARG 76 CO 0.00 0.00 0.00 -0.22 -0.01 0.00 0.00 177.63 177.40 1n4c h LYS 77 N 0.00 0.00 0.23 2.89 3.64 -1.56 0.35 116.57 122.13 1n4c h LYS 77 Ca 0.00 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.04 1n4c h LYS 77 Cb 0.05 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 31.90 1n4c h LYS 77 CO 0.00 0.00 -1.56 1.49 -2.27 0.00 0.00 179.45 177.11 1n4c h GLU 78 N 0.00 0.49 0.00 1.90 4.81 -1.73 -3.21 114.58 116.85 1n4c h GLU 78 Ca 0.07 -0.84 0.00 0.00 -0.13 0.00 0.00 59.36 58.46 1n4c h GLU 78 Cb 1.08 0.31 0.00 0.00 0.63 0.00 0.00 28.75 30.77 1n4c h GLU 78 CO -0.00 1.40 0.20 0.93 -0.73 0.00 0.00 179.01 180.81 1n4c h GLU 79 N 0.13 0.00 0.00 1.92 5.08 -0.55 0.34 114.58 121.50 1n4c h GLU 79 Ca -0.28 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.05 1n4c h GLU 79 Cb 2.15 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.39 1n4c h GLU 79 CO 0.25 0.00 -0.14 1.98 -1.00 0.00 0.00 179.01 180.09 1n4c h MET 80 N 0.00 0.00 0.00 2.33 4.05 -1.54 -2.29 114.93 117.48 1n4c h MET 80 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1n4c h MET 80 Cb 0.40 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.20 1n4c h MET 80 CO 0.00 0.14 -0.32 0.00 0.23 0.00 0.00 176.91 176.96 1n4c n ALA 81 N -2.19 2.98 -0.59 0.39 0.00 0.12 -3.40 120.51 117.81 1n4c n ALA 81 Ca 0.00 -0.23 0.09 0.00 0.00 0.00 0.00 53.44 53.30 1n4c n ALA 81 Cb 0.37 -1.27 0.34 0.00 0.00 0.00 0.00 19.45 18.89 1n4c n ALA 81 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1n4c n LYS 82 N -1.63 3.57 -2.71 0.00 5.02 -0.86 -4.39 118.16 117.15 1n4c n LYS 82 Ca 0.06 -2.83 -0.03 0.00 -2.02 0.00 0.00 58.31 53.48 1n4c n LYS 82 Cb 0.36 -1.83 0.10 0.00 -0.02 0.00 0.00 35.03 33.64 1n4c n LYS 82 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1n4c n GLU 83 N 1.10 1.39 -0.02 1.97 4.07 -1.21 -4.94 120.64 123.00 1n4c n GLU 83 Ca 0.25 -2.05 0.00 0.00 -0.06 0.00 0.00 57.16 55.30 1n4c n GLU 83 Cb 0.84 -0.28 0.00 0.00 -0.06 0.00 0.00 31.44 31.94 1n4c n GLU 83 CO 0.00 0.00 0.00 -0.12 -0.06 0.00 0.00 177.13 176.95 1n4c n MET 84 N -1.00 0.74 -1.53 5.31 1.56 -1.24 -4.75 117.12 116.21 1n4c n MET 84 Ca -0.07 0.00 -0.43 0.00 -0.27 0.00 0.00 57.70 56.93 1n4c n MET 84 Cb 0.85 -1.13 -0.00 0.00 2.15 0.00 0.00 33.22 35.08 1n4c n MET 84 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 1n4c n ASP 85 N 0.68 0.33 0.00 6.12 -0.08 -1.26 -4.55 116.55 117.79 1n4c n ASP 85 Ca 0.00 1.06 0.00 0.00 -1.51 0.00 0.00 54.79 54.34 1n4c n ASP 85 Cb 0.37 -1.21 0.00 0.00 2.34 0.00 0.00 41.12 42.62 1n4c n ASP 85 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1n4c n PRO 86 N 0.59 0.00 -0.06 -0.67 -0.04 -1.26 -1.40 135.00 132.16 1n4c n PRO 86 Ca 0.11 0.09 -0.21 0.00 -0.04 0.00 0.00 63.50 63.44 1n4c n PRO 86 Cb 0.35 -1.51 -0.13 0.00 -0.04 0.00 0.00 33.50 32.18 1n4c n PRO 86 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1n4c n GLU 87 N -1.06 0.69 0.09 0.54 0.28 -1.26 -4.11 120.64 115.80 1n4c n GLU 87 Ca 0.00 0.29 -0.04 0.00 -0.16 0.00 0.00 57.16 57.25 1n4c n GLU 87 Cb 0.01 -1.65 -0.03 0.00 1.43 0.00 0.00 31.44 31.20 1n4c n GLU 87 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 177.13 176.75 1n4c h LYS 88 N -0.22 0.00 -0.93 3.44 1.63 -1.60 -3.23 116.57 115.66 1n4c h LYS 88 Ca -0.48 0.00 0.12 0.00 -0.85 0.00 0.00 60.65 59.45 1n4c h LYS 88 Cb 1.84 0.00 -0.09 0.00 -0.60 0.00 0.00 32.23 33.39 1n4c h LYS 88 CO -0.05 0.81 0.56 1.25 -3.45 0.00 0.00 179.45 178.57 1n4c h LEU 89 N 0.00 0.78 -0.83 5.20 7.12 -1.40 -0.18 115.31 126.00 1n4c h LEU 89 Ca -0.01 0.06 0.12 0.00 0.13 0.00 0.00 57.88 58.19 1n4c h LEU 89 Cb 1.56 -0.09 -0.08 0.00 -0.53 0.00 0.00 40.66 41.51 1n4c h LEU 89 CO 0.11 0.40 0.45 0.11 -0.13 0.00 0.00 178.44 179.37 1n4c h LYS 90 N 0.86 0.67 -0.16 1.25 1.57 -1.71 -1.65 116.57 117.40 1n4c h LYS 90 Ca 0.47 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 59.23 1n4c h LYS 90 Cb 0.52 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1n4c h LYS 90 CO -0.29 0.44 0.07 0.82 -0.57 0.00 0.00 179.45 179.92 1n4c h ILE 91 N 0.69 0.98 -1.03 1.86 2.04 -1.20 -2.21 117.51 118.65 1n4c h ILE 91 Ca 0.43 -0.05 0.26 0.00 1.00 0.00 0.00 64.86 66.50 1n4c h ILE 91 Cb 0.53 0.82 -0.10 0.00 -0.74 0.00 0.00 36.82 37.32 1n4c h ILE 91 CO -0.31 0.03 0.65 -0.07 0.00 0.00 0.00 178.15 178.44 1n4c h LEU 92 N 0.15 0.53 -0.32 1.44 3.38 -1.17 0.44 115.31 119.76 1n4c h LEU 92 Ca 0.07 0.10 -0.12 0.00 0.09 0.00 0.00 57.88 58.02 1n4c h LEU 92 Cb 0.03 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1n4c h LEU 92 CO -0.06 0.10 -0.56 -0.33 0.09 0.00 0.00 178.44 177.68 1n4c h GLU 93 N 0.46 0.00 -0.08 1.13 5.08 -1.30 -2.87 114.58 117.00 1n4c h GLU 93 Ca 0.61 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.73 1n4c h GLU 93 Cb 1.40 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.67 1n4c h GLU 93 CO -0.35 0.56 -0.87 2.35 -1.00 0.00 0.00 179.01 179.70 1n4c h TRP 94 N 0.00 1.04 -0.08 4.33 7.01 0.34 -3.10 115.95 125.49 1n4c h TRP 94 Ca -0.01 -0.50 -0.13 0.00 2.11 0.00 0.00 58.89 60.36 1n4c h TRP 94 Cb 1.30 -0.14 0.01 0.00 -2.10 0.00 0.00 29.16 28.22 1n4c h TRP 94 CO 0.00 1.34 -0.47 -0.84 -2.79 0.00 0.00 178.44 175.68 1n4c h ILE 95 N 0.44 1.39 0.00 2.65 3.07 -1.26 -3.03 117.51 120.78 1n4c h ILE 95 Ca -0.08 -1.84 0.00 0.00 1.55 0.00 0.00 64.86 64.49 1n4c h ILE 95 Cb 1.51 2.29 0.00 0.00 -0.27 0.00 0.00 36.82 40.35 1n4c h ILE 95 CO 0.18 0.54 0.00 -1.84 -1.05 0.00 0.00 178.15 175.98 1n4c n GLU 96 N -4.28 0.02 -0.03 0.16 -0.00 -1.08 -1.99 120.64 113.44 1n4c n GLU 96 Ca -0.08 0.35 -0.15 0.00 -0.00 0.00 0.00 57.16 57.27 1n4c n GLU 96 Cb 0.58 -1.50 -0.09 0.00 -0.00 0.00 0.00 31.44 30.43 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 1.17 0.43 -5.00 -1.84 0.00 -1.45 -3.44 103.07 92.95 1n4c h GLY 97 Ca 0.00 -0.60 -0.09 0.00 0.00 0.00 0.00 47.33 46.64 1n4c h GLY 97 CO 0.00 0.53 -0.19 0.58 0.00 0.00 0.00 176.54 177.46 1n4c n LYS 98 N -4.37 0.30 0.00 4.80 2.85 -0.92 -4.99 118.16 115.83 1n4c n LYS 98 Ca -0.08 -1.05 0.00 0.00 -1.05 0.00 0.00 58.31 56.13 1n4c n LYS 98 Cb 0.53 -0.53 0.00 0.00 -0.65 0.00 0.00 35.03 34.37 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 1.88 0.80 -1.18 -1.58 0.00 -0.84 -2.80 120.64 116.92 1n4c n GLU 99 Ca 0.06 0.00 0.02 0.00 0.00 0.00 0.00 57.16 57.25 1n4c n GLU 99 Cb 0.67 -1.13 0.01 0.00 0.00 0.00 0.00 31.44 30.99 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 0.55 0.00 -3.18 3.44 0.00 -1.26 -4.79 116.66 111.42 1n4c n ARG 100 Ca 0.00 -1.64 -0.20 0.00 -0.00 0.00 0.00 57.85 56.01 1n4c n ARG 100 Cb 0.38 -0.12 -0.04 0.00 0.00 0.00 0.00 32.46 32.67 1n4c n ARG 100 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1n4c n ASN 101 N 0.33 0.56 -0.33 6.15 2.85 -1.12 -4.96 115.26 118.74 1n4c n ASN 101 Ca 0.03 -2.92 0.23 0.00 -0.11 0.00 0.00 54.58 51.81 1n4c n ASN 101 Cb 0.99 -0.58 0.46 0.00 1.24 0.00 0.00 39.78 41.90 1n4c n ASN 101 CO 0.00 0.00 0.00 -0.29 -2.11 0.00 0.00 177.26 174.86 1n4c h ILE 102 N 1.35 0.28 -0.89 -1.44 -0.00 -1.86 0.75 117.51 115.70 1n4c h ILE 102 Ca 0.09 -0.10 0.11 0.00 -0.00 0.00 0.00 64.86 64.96 1n4c h ILE 102 Cb 0.94 -0.04 -0.07 0.00 -0.00 0.00 0.00 36.82 37.66 1n4c h ILE 102 CO 0.48 0.05 0.57 0.08 -0.00 0.00 0.00 178.15 179.34 1n4c h ARG 103 N 0.29 0.79 0.19 2.19 0.11 -1.97 -2.22 114.38 113.76 1n4c h ARG 103 Ca 0.73 -0.05 -0.27 0.00 0.10 0.00 0.00 59.98 60.49 1n4c h ARG 103 Cb 1.66 -0.18 0.02 0.00 1.11 0.00 0.00 29.97 32.58 1n4c h ARG 103 CO -0.62 0.52 -1.21 0.00 0.10 0.00 0.00 179.97 178.76 1n4c h ALA 104 N 1.57 -0.07 -0.86 0.08 0.00 0.06 -3.15 119.26 116.89 1n4c h ALA 104 Ca 0.42 -0.84 0.13 0.00 0.00 0.00 0.00 54.91 54.63 1n4c h ALA 104 Cb 0.51 0.20 -0.09 0.00 0.00 0.00 0.00 17.79 18.41 1n4c h ALA 104 CO -0.19 0.60 0.48 -0.07 0.00 0.00 0.00 179.25 180.07 1n4c h LEU 105 N -0.13 0.63 -0.61 0.00 3.38 -0.68 0.39 115.31 118.30 1n4c h LEU 105 Ca -0.22 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 1n4c h LEU 105 Cb 1.90 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.60 1n4c h LEU 105 CO 0.19 0.30 -0.15 0.17 0.09 0.00 0.00 178.44 179.05 1n4c h LEU 106 N 0.72 0.00 -1.72 1.67 8.10 -1.53 -1.74 115.31 120.81 1n4c h LEU 106 Ca 0.45 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.44 1n4c h LEU 106 Cb 0.55 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.77 1n4c h LEU 106 CO -0.32 0.15 0.00 -1.54 -4.11 0.00 0.00 178.44 172.62 1n4c n SER 107 N -3.19 2.67 0.00 0.17 3.41 0.28 -4.12 113.62 112.83 1n4c n SER 107 Ca 0.02 -1.88 0.00 0.00 -0.26 0.00 0.00 58.87 56.75 1n4c n SER 107 Cb 0.49 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 1n4c n SER 107 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1n4c n THR 108 N 1.08 0.02 0.23 6.66 -2.24 0.11 -4.65 114.28 115.49 1n4c n THR 108 Ca 0.15 -0.40 0.09 0.00 -2.27 0.00 0.00 64.05 61.62 1n4c n THR 108 Cb 0.54 1.20 0.58 0.00 -2.10 0.00 0.00 70.33 70.55 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 -0.02 -0.78 -1.53 -1.47 -2.73 114.93 108.40 1n4c h MET 109 Ca 0.00 0.00 0.01 0.00 -3.44 0.00 0.00 59.70 56.27 1n4c h MET 109 Cb 0.12 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.17 1n4c h MET 109 CO 0.00 0.20 0.02 1.12 0.14 0.00 0.00 176.91 178.39 1n4c h HIS 110 N 0.00 0.00 0.00 1.39 2.07 -1.85 0.24 115.15 117.00 1n4c h HIS 110 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1n4c h HIS 110 Cb 0.47 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.45 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 -4.03 0.00 -2.30 6.12 -2.24 -1.03 -3.45 114.28 107.36 1n4c n THR 111 Ca -0.02 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.76 1n4c n THR 111 Cb 0.11 -0.32 -0.01 0.00 -2.10 0.00 0.00 70.33 68.01 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 -0.73 0.00 -2.41 2.28 0.24 0.06 -5.05 118.33 112.73 1n4c n VAL 112 Ca 0.09 -0.60 -0.25 0.00 -2.04 0.00 0.00 64.34 61.54 1n4c n VAL 112 Cb 0.04 0.77 0.12 0.00 -1.47 0.00 0.00 33.84 33.30 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 2.92 0.24 1.34 1.43 -1.16 -4.94 118.68 118.51 1n4c s LEU 113 Ca 0.20 -0.13 -0.16 0.00 -1.03 0.00 0.00 54.13 53.01 1n4c s LEU 113 Cb 0.23 -2.19 -0.08 0.00 0.03 0.00 0.00 46.19 44.18 1n4c s LEU 113 CO -0.10 -2.01 0.67 -1.66 0.23 0.00 0.00 176.35 173.48 1n4c s TRP 114 N -3.31 3.52 -0.17 0.29 -2.14 -1.26 -4.98 118.94 110.90 1n4c s TRP 114 Ca 0.67 1.20 -0.29 0.00 2.66 0.00 0.00 56.10 60.34 1n4c s TRP 114 Cb -0.06 -2.49 -0.05 0.00 -3.10 0.00 0.00 33.47 27.77 1n4c s TRP 114 CO 0.46 0.27 1.98 0.00 -2.66 0.00 0.00 176.95 177.00 1n4c s ALA 115 N -1.70 3.06 0.00 2.67 0.00 -1.26 -3.09 121.76 121.44 1n4c s ALA 115 Ca 0.46 0.79 0.00 0.00 0.00 0.00 0.00 51.96 53.21 1n4c s ALA 115 Cb -0.13 -3.97 0.00 0.00 0.00 0.00 0.00 23.12 19.02 1n4c s ALA 115 CO 0.19 -2.30 0.00 0.41 0.00 0.00 0.00 175.76 174.06 1n4c n GLY 116 N 5.19 3.40 3.59 0.00 0.00 -1.26 -5.09 105.19 111.02 1n4c n GLY 116 Ca 0.24 -0.49 -0.48 0.00 0.00 0.00 0.00 46.02 45.29 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 1.79 -0.03 1.61 4.07 -1.18 -4.78 120.64 122.11 1n4c n GLU 117 Ca 0.00 0.58 0.03 0.00 -0.06 0.00 0.00 57.16 57.72 1n4c n GLU 117 Cb 0.00 -2.73 0.05 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 6.39 1.24 -0.09 6.31 -2.24 -1.26 -4.65 114.28 119.98 1n4c n THR 118 Ca 0.30 -1.37 -0.09 0.00 -2.27 0.00 0.00 64.05 60.61 1n4c n THR 118 Cb 0.31 0.27 -0.16 0.00 -2.10 0.00 0.00 70.33 68.65 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 -0.79 0.69 -1.78 -0.78 5.02 -1.26 -4.93 118.16 114.32 1n4c n LYS 119 Ca 0.05 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.93 1n4c n LYS 119 Cb 0.40 -1.54 -0.03 0.00 -0.02 0.00 0.00 35.03 33.85 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 -2.53 2.77 -0.60 2.13 -0.11 -1.26 -4.95 118.94 114.39 1n4c s TRP 120 Ca -0.10 0.33 -0.05 0.00 1.22 0.00 0.00 56.10 57.51 1n4c s TRP 120 Cb 0.06 -4.09 0.16 0.00 -1.50 0.00 0.00 33.47 28.10 1n4c s TRP 120 CO 0.83 -4.21 0.43 0.15 -4.62 0.00 0.00 176.95 169.54 1n4c s LYS 121 N 1.55 2.59 -0.02 5.86 -0.14 -1.26 -5.06 119.74 123.27 1n4c s LYS 121 Ca 0.75 -2.33 -0.35 0.00 -1.36 0.00 0.00 55.97 52.68 1n4c s LYS 121 Cb -0.47 -3.81 -0.17 0.00 -1.68 0.00 0.00 37.83 31.69 1n4c s LYS 121 CO 0.33 -1.17 0.95 -2.30 -0.76 0.00 0.00 175.35 172.39 1n4c n PRO 122 N 3.87 0.00 -3.12 -1.68 -0.02 -1.26 -4.88 135.00 127.90 1n4c n PRO 122 Ca 0.05 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.13 1n4c n PRO 122 Cb 0.40 -1.31 -0.06 0.00 -0.02 0.00 0.00 33.50 32.51 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 0.11 5.04 0.05 -1.45 1.01 -1.26 -5.01 120.40 118.89 1n4c s VAL 123 Ca 0.80 1.20 -0.30 0.00 0.00 0.00 0.00 61.98 63.68 1n4c s VAL 123 Cb -1.12 -3.95 -0.08 0.00 0.00 0.00 0.00 36.38 31.23 1n4c s VAL 123 CO 0.51 0.15 1.74 -0.83 0.00 0.00 0.00 175.10 176.67 1n4c s GLY 124 N 1.08 1.50 0.65 4.51 0.00 -1.26 -4.78 107.32 109.01 1n4c s GLY 124 Ca 0.30 1.22 0.05 0.00 0.00 0.00 0.00 44.72 46.29 1n4c s GLY 124 CO 0.11 3.07 1.10 -0.33 0.00 0.00 0.00 173.10 177.05 1n4c h MET 125 N 9.03 0.00 0.00 2.90 2.86 -1.95 2.70 114.93 130.47 1n4c h MET 125 Ca -0.44 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.20 1n4c h MET 125 Cb 1.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.87 1n4c h MET 125 CO 0.94 0.00 -0.19 0.00 1.06 0.00 0.00 176.91 178.72 1n4c n ALA 126 N -1.62 2.59 -0.67 6.32 0.00 -1.26 -3.67 120.51 122.20 1n4c n ALA 126 Ca 0.03 -0.13 -0.18 0.00 0.00 0.00 0.00 53.44 53.15 1n4c n ALA 126 Cb 1.03 -1.36 0.13 0.00 0.00 0.00 0.00 19.45 19.24 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 -1.92 3.81 -2.07 0.00 8.00 0.91 -4.11 116.55 121.16 1n4c n ASP 127 Ca 0.05 -3.19 0.02 0.00 0.71 0.00 0.00 54.79 52.38 1n4c n ASP 127 Cb 0.40 -0.77 0.04 0.00 -0.02 0.00 0.00 41.12 40.76 1n4c n ASP 127 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1n4c n LEU 128 N -0.67 1.33 -0.05 0.64 -0.00 -1.24 -4.82 117.00 112.18 1n4c n LEU 128 Ca 0.44 -2.51 0.15 0.00 -0.00 0.00 0.00 56.01 54.09 1n4c n LEU 128 Cb 1.31 0.19 0.83 0.00 -0.00 0.00 0.00 43.42 45.75 1n4c n LEU 128 CO 0.46 0.77 1.04 1.33 -0.00 0.00 0.00 177.39 180.98 1n4c n VAL 129 N -0.02 0.00 -4.00 1.47 0.24 -1.26 -4.82 118.33 109.94 1n4c n VAL 129 Ca 0.07 -0.03 -0.09 0.00 -2.04 0.00 0.00 64.34 62.26 1n4c n VAL 129 Cb 0.99 -0.37 -0.11 0.00 -1.47 0.00 0.00 33.84 32.88 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 -2.20 0.14 0.33 3.34 -4.23 -1.26 -4.88 115.64 106.88 1n4c s THR 130 Ca 0.40 -1.13 0.01 0.00 -1.18 0.00 0.00 61.69 59.79 1n4c s THR 130 Cb 0.21 -0.59 0.24 0.00 1.34 0.00 0.00 72.50 73.70 1n4c s THR 130 CO 0.40 -0.62 1.97 1.55 -0.54 0.00 0.00 174.62 177.38 1n4c h PRO 131 N 4.25 0.86 -0.46 3.99 0.13 -1.97 -1.52 132.00 137.28 1n4c h PRO 131 Ca -0.32 -0.08 0.10 0.00 -0.87 0.00 0.00 66.00 64.83 1n4c h PRO 131 Cb 1.19 -0.18 -0.02 0.00 0.13 0.00 0.00 31.00 32.12 1n4c h PRO 131 CO 0.47 0.61 0.32 1.49 -0.23 0.00 0.00 178.00 180.66 1n4c h GLU 132 N 0.88 0.16 -0.03 0.86 4.81 -1.98 0.49 114.58 119.76 1n4c h GLU 132 Ca 0.23 -0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 59.27 1n4c h GLU 132 Cb -0.02 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1n4c h GLU 132 CO -0.04 0.11 -0.77 1.96 -0.73 0.00 0.00 179.01 179.53 1n4c h GLN 133 N 0.17 0.27 0.12 1.92 1.08 -1.61 -2.03 115.11 115.04 1n4c h GLN 133 Ca 0.22 -0.25 -0.01 0.00 -1.45 0.00 0.00 58.65 57.16 1n4c h GLN 133 Cb 0.63 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.12 1n4c h GLN 133 CO -0.03 0.92 -0.06 0.28 -0.95 0.00 0.00 178.83 178.99 1n4c h VAL 134 N 0.17 0.00 -0.82 -0.54 2.07 -0.22 -2.79 116.25 114.13 1n4c h VAL 134 Ca -0.03 -0.87 0.11 0.00 0.82 0.00 0.00 66.70 66.73 1n4c h VAL 134 Cb 1.36 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 31.07 1n4c h VAL 134 CO 0.12 0.00 0.53 0.50 0.02 0.00 0.00 177.57 178.75 1n4c h LYS 135 N -1.03 0.70 -0.43 1.57 3.64 -0.37 0.87 116.57 121.51 1n4c h LYS 135 Ca -0.02 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.27 1n4c h LYS 135 Cb 0.13 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 1n4c h LYS 135 CO 0.03 0.46 0.07 -0.22 -2.27 0.00 0.00 179.45 177.52 1n4c h LYS 136 N 0.72 0.71 0.09 1.90 3.64 -1.47 -3.13 116.57 119.03 1n4c h LYS 136 Ca 0.39 -0.19 -0.27 0.00 -1.27 0.00 0.00 60.65 59.31 1n4c h LYS 136 Cb 0.52 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1n4c h LYS 136 CO -0.15 0.74 -1.28 0.28 -2.27 0.00 0.00 179.45 176.76 1n4c h VAL 137 N 0.56 1.43 -0.68 2.00 2.07 -0.98 -3.23 116.25 117.43 1n4c h VAL 137 Ca 0.13 -3.07 0.20 0.00 0.82 0.00 0.00 66.70 64.78 1n4c h VAL 137 Cb 0.37 2.85 -0.03 0.00 -1.52 0.00 0.00 31.29 32.96 1n4c h VAL 137 CO 0.01 0.87 0.61 0.22 0.02 0.00 0.00 177.57 179.29 1n4c h TYR 138 N 0.05 0.00 0.55 1.57 3.20 0.76 0.89 116.97 124.00 1n4c h TYR 138 Ca -0.14 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.70 1n4c h TYR 138 Cb 1.94 0.00 0.01 0.00 1.54 0.00 0.00 36.73 40.21 1n4c h TYR 138 CO 0.04 0.00 -0.26 -0.09 -1.64 0.00 0.00 178.16 176.21 1n4c h ARG 139 N 0.00 -0.71 -0.69 1.82 2.43 -1.56 -2.95 114.38 112.72 1n4c h ARG 139 Ca 0.32 0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.52 1n4c h ARG 139 Cb 1.53 0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 31.21 1n4c h ARG 139 CO -0.00 -0.45 0.34 -0.22 -1.51 0.00 0.00 179.97 178.12 1n4c h LYS 140 N -1.17 1.00 -0.95 0.20 3.64 -1.41 -2.09 116.57 115.79 1n4c h LYS 140 Ca -0.08 -0.14 0.22 0.00 -1.27 0.00 0.00 60.65 59.38 1n4c h LYS 140 Cb 0.59 -0.18 -0.08 0.00 -0.41 0.00 0.00 32.23 32.15 1n4c h LYS 140 CO 0.12 0.78 0.62 0.00 -2.27 0.00 0.00 179.45 178.71 1n4c h ALA 141 N 1.16 2.19 0.00 5.00 0.00 -0.94 0.63 119.26 127.30 1n4c h ALA 141 Ca 0.24 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 55.03 1n4c h ALA 141 Cb 0.11 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1n4c h ALA 141 CO -0.03 -0.51 -0.71 0.28 0.00 0.00 0.00 179.25 178.28 1n4c h VAL 142 N 0.43 1.50 0.00 0.00 2.07 -1.20 -2.94 116.25 116.10 1n4c h VAL 142 Ca 0.51 -2.44 -0.09 0.00 0.82 0.00 0.00 66.70 65.50 1n4c h VAL 142 Cb 1.25 2.32 -0.01 0.00 -1.52 0.00 0.00 31.29 33.33 1n4c h VAL 142 CO -0.22 0.69 -0.42 -0.07 0.02 0.00 0.00 177.57 177.58 1n4c h LEU 143 N 0.00 0.00 -1.78 2.57 3.38 0.51 -2.65 115.31 117.34 1n4c h LEU 143 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1n4c h LEU 143 Cb 1.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 1n4c h LEU 143 CO 0.09 0.42 0.03 0.58 0.09 0.00 0.00 178.44 179.65 1n4c h VAL 144 N 0.00 1.07 -0.29 1.22 2.07 -1.06 -2.51 116.25 116.74 1n4c h VAL 144 Ca -0.00 -0.22 -0.10 0.00 0.82 0.00 0.00 66.70 67.19 1n4c h VAL 144 Cb 0.78 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 31.43 1n4c h VAL 144 CO 0.05 0.08 -0.05 1.33 0.02 0.00 0.00 177.57 179.01 1n4c n VAL 145 N -4.46 2.40 -1.89 2.57 0.24 -1.02 -4.94 118.33 111.23 1n4c n VAL 145 Ca -0.01 -2.40 -0.42 0.00 -2.04 0.00 0.00 64.34 59.47 1n4c n VAL 145 Cb 0.12 -0.29 -0.03 0.00 -1.47 0.00 0.00 33.84 32.17 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 -3.07 3.00 0.10 6.34 5.04 -0.95 -4.79 115.29 120.96 1n4c s HIS 146 Ca 0.43 0.62 -0.19 0.00 -1.54 0.00 0.00 55.06 54.38 1n4c s HIS 146 Cb 0.37 -3.97 -0.04 0.00 0.04 0.00 0.00 32.58 28.98 1n4c s HIS 146 CO 0.03 -3.54 1.11 -2.30 -2.34 0.00 0.00 174.74 167.71 1n4c n PRO 147 N 3.67 -0.27 -0.42 2.88 -0.02 -1.26 0.10 135.00 139.68 1n4c n PRO 147 Ca 0.13 1.10 0.35 0.00 -2.02 0.00 0.00 63.50 63.06 1n4c n PRO 147 Cb 0.38 -1.62 0.63 0.00 -0.02 0.00 0.00 33.50 32.87 1n4c n PRO 147 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1n4c h ASP 148 N 0.00 0.27 1.04 2.55 2.03 -1.97 2.32 116.42 122.66 1n4c h ASP 148 Ca 0.10 0.16 0.00 0.00 -0.73 0.00 0.00 57.03 56.55 1n4c h ASP 148 Cb 0.25 0.15 0.00 0.00 -0.83 0.00 0.00 39.33 38.90 1n4c h ASP 148 CO -0.57 -0.22 0.00 0.29 -1.03 0.00 0.00 179.24 177.72 1n4c n LYS 149 N -4.80 0.07 -1.29 4.15 5.02 0.11 -3.26 118.16 118.16 1n4c n LYS 149 Ca 0.37 0.09 -0.03 0.00 -2.02 0.00 0.00 58.31 56.73 1n4c n LYS 149 Cb 1.39 -1.59 0.12 0.00 -0.02 0.00 0.00 35.03 34.93 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 -1.58 3.72 -2.58 7.82 0.00 0.77 -4.87 120.51 123.79 1n4c n ALA 150 Ca 0.06 -3.24 -0.41 0.00 0.00 0.00 0.00 53.44 49.85 1n4c n ALA 150 Cb 0.34 -0.45 -0.07 0.00 0.00 0.00 0.00 19.45 19.28 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 -3.13 4.91 0.00 0.00 2.01 -0.44 -3.90 115.64 115.10 1n4c s THR 151 Ca 0.40 0.71 0.00 0.00 0.31 0.00 0.00 61.69 63.11 1n4c s THR 151 Cb 0.38 -4.04 0.00 0.00 0.01 0.00 0.00 72.50 68.85 1n4c s THR 151 CO -0.06 -0.23 0.00 0.61 -0.69 0.00 0.00 174.62 174.26 1n4c n GLY 152 N 4.55 0.69 3.72 4.40 0.00 -1.26 -4.95 105.19 112.34 1n4c n GLY 152 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.41 4.60 0.46 1.61 -1.52 -1.25 -4.87 119.66 118.29 1n4c s GLN 153 Ca 0.00 1.55 0.24 0.00 -1.95 0.00 0.00 55.36 55.20 1n4c s GLN 153 Cb 0.00 -3.37 0.83 0.00 -0.22 0.00 0.00 33.01 30.25 1n4c s GLN 153 CO 0.00 0.05 1.05 -2.30 -0.25 0.00 0.00 175.29 173.83 1n4c n PRO 154 N 3.16 0.01 -2.27 2.91 -0.02 -1.26 -0.32 135.00 137.21 1n4c n PRO 154 Ca 0.04 0.80 -0.37 0.00 -2.02 0.00 0.00 63.50 61.96 1n4c n PRO 154 Cb 0.49 -1.97 0.02 0.00 -0.02 0.00 0.00 33.50 32.02 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 -2.94 3.08 0.24 6.00 0.18 -1.26 -4.77 117.16 117.69 1n4c n TYR 155 Ca 0.21 -2.64 -0.10 0.00 1.88 0.00 0.00 57.90 57.25 1n4c n TYR 155 Cb 1.27 -0.96 -0.05 0.00 -0.38 0.00 0.00 39.34 39.22 1n4c n TYR 155 CO 0.00 0.00 0.00 0.93 -2.08 0.00 0.00 176.86 175.71 1n4c h GLU 156 N 3.23 -0.64 -0.35 -3.48 5.08 -0.87 -3.22 114.58 114.32 1n4c h GLU 156 Ca 0.48 0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.88 1n4c h GLU 156 Cb 0.28 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 1n4c h GLU 156 CO 1.23 -0.43 0.17 1.96 -1.00 0.00 0.00 179.01 180.94 1n4c h GLN 157 N -1.12 0.49 -1.04 2.33 1.08 -1.87 -1.50 115.11 113.48 1n4c h GLN 157 Ca -0.07 -0.05 0.29 0.00 -1.45 0.00 0.00 58.65 57.37 1n4c h GLN 157 Cb 0.51 -0.10 -0.06 0.00 -0.05 0.00 0.00 27.48 27.79 1n4c h GLN 157 CO 0.11 0.39 0.72 -0.92 -0.95 0.00 0.00 178.83 178.18 1n4c h TYR 158 N 0.49 0.23 0.09 2.96 5.03 -1.90 -1.01 116.97 122.87 1n4c h TYR 158 Ca 0.13 0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.44 1n4c h TYR 158 Cb 0.06 -0.07 0.00 0.00 1.55 0.00 0.00 36.73 38.28 1n4c h TYR 158 CO 0.00 0.03 -0.05 0.00 -1.32 0.00 0.00 178.16 176.83 1n4c h ALA 159 N 1.53 -0.13 -0.48 1.82 0.00 -1.28 -3.17 119.26 117.54 1n4c h ALA 159 Ca 0.52 -0.26 0.11 0.00 0.00 0.00 0.00 54.91 55.28 1n4c h ALA 159 Cb 1.80 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.62 1n4c h ALA 159 CO -0.10 -0.19 0.34 0.87 0.00 0.00 0.00 179.25 180.16 1n4c h LYS 160 N -0.89 0.18 0.44 0.00 6.56 -1.28 0.28 116.57 121.85 1n4c h LYS 160 Ca -0.01 -0.01 -0.02 0.00 -1.06 0.00 0.00 60.65 59.54 1n4c h LYS 160 Cb 0.56 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.19 1n4c h LYS 160 CO 0.02 0.12 -0.21 0.52 -2.06 0.00 0.00 179.45 177.84 1n4c h MET 161 N 0.19 -0.57 0.00 3.15 2.86 -1.30 -3.06 114.93 116.20 1n4c h MET 161 Ca 0.23 0.04 -0.07 0.00 -2.06 0.00 0.00 59.70 57.83 1n4c h MET 161 Cb 0.65 0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.43 1n4c h MET 161 CO -0.04 -0.26 -0.35 -0.84 1.06 0.00 0.00 176.91 176.48 1n4c h ILE 162 N -0.97 0.94 0.12 -1.22 3.07 -1.46 -3.09 117.51 114.90 1n4c h ILE 162 Ca -0.06 -1.36 0.01 0.00 1.55 0.00 0.00 64.86 65.01 1n4c h ILE 162 Cb 0.57 1.80 -0.03 0.00 -0.27 0.00 0.00 36.82 38.89 1n4c h ILE 162 CO 0.10 0.34 -0.21 0.15 -1.05 0.00 0.00 178.15 177.48 1n4c h PHE 163 N 0.00 -0.56 -0.45 0.16 3.04 -0.43 -1.69 116.94 117.01 1n4c h PHE 163 Ca -0.00 0.01 -0.08 0.00 3.98 0.00 0.00 57.97 61.88 1n4c h PHE 163 Cb 0.78 0.23 -0.02 0.00 2.56 0.00 0.00 35.95 39.50 1n4c h PHE 163 CO 0.00 -0.31 -0.02 0.52 -2.02 0.00 0.00 178.31 176.48 1n4c h MET 164 N -0.41 0.81 -0.39 1.11 2.86 -1.53 -2.87 114.93 114.50 1n4c h MET 164 Ca 0.02 -0.27 0.06 0.00 -2.06 0.00 0.00 59.70 57.46 1n4c h MET 164 Cb 0.42 -0.07 -0.06 0.00 0.06 0.00 0.00 31.60 31.96 1n4c h MET 164 CO -0.11 0.88 0.06 0.93 1.06 0.00 0.00 176.91 179.73 1n4c h GLU 165 N 0.65 0.17 -0.22 1.72 4.39 -1.43 1.59 114.58 121.45 1n4c h GLU 165 Ca 0.12 -0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.83 1n4c h GLU 165 Cb 0.53 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.12 1n4c h GLU 165 CO 0.03 0.11 0.09 -0.07 -1.16 0.00 0.00 179.01 178.01 1n4c h LEU 166 N 0.18 0.11 -0.01 1.33 -0.00 -1.24 -2.19 115.31 113.48 1n4c h LEU 166 Ca 0.19 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 58.09 1n4c h LEU 166 Cb 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.90 1n4c h LEU 166 CO -0.27 0.09 -0.16 -3.20 -0.00 0.00 0.00 178.44 174.91 1n4c n ASN 167 N -5.02 0.18 -0.02 -0.43 2.85 -0.84 -3.15 115.26 108.82 1n4c n ASN 167 Ca -0.02 0.20 -0.01 0.00 -0.11 0.00 0.00 54.58 54.63 1n4c n ASN 167 Cb 0.07 -0.24 -0.00 0.00 1.24 0.00 0.00 39.78 40.85 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 0.03 -0.05 0.34 1.20 3.58 0.29 -3.32 116.42 118.51 1n4c h ASP 168 Ca 0.00 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.42 1n4c h ASP 168 Cb 0.49 0.01 -0.00 0.00 1.72 0.00 0.00 39.33 41.54 1n4c h ASP 168 CO 0.00 0.41 -0.15 0.00 -2.88 0.00 0.00 179.24 176.61 1n4c h ALA 169 N -1.10 1.36 -0.78 -0.78 0.00 -1.65 -2.66 119.26 113.66 1n4c h ALA 169 Ca -0.01 -0.14 0.13 0.00 0.00 0.00 0.00 54.91 54.90 1n4c h ALA 169 Cb 0.04 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.72 1n4c h ALA 169 CO 0.01 0.19 0.36 2.35 0.00 0.00 0.00 179.25 182.16 1n4c h TRP 170 N 0.00 0.63 0.00 0.00 2.91 -1.65 1.48 115.95 119.32 1n4c h TRP 170 Ca -0.00 0.03 -0.03 0.00 1.13 0.00 0.00 58.89 60.02 1n4c h TRP 170 Cb 0.36 -0.16 -0.00 0.00 -0.51 0.00 0.00 29.16 28.84 1n4c h TRP 170 CO 0.00 0.14 -0.16 0.77 -1.03 0.00 0.00 178.44 178.17 1n4c h SER 171 N 0.55 0.00 0.36 2.65 0.02 -1.56 -1.89 113.55 113.67 1n4c h SER 171 Ca 0.42 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 61.04 1n4c h SER 171 Cb 0.58 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.14 1n4c h SER 171 CO -0.36 0.16 -1.48 -0.08 -1.14 0.00 0.00 176.83 173.93 1n4c h GLU 172 N 0.00 0.43 -0.75 3.45 4.81 0.43 -2.71 114.58 120.24 1n4c h GLU 172 Ca -0.00 -0.73 0.03 0.00 -0.13 0.00 0.00 59.36 58.52 1n4c h GLU 172 Cb 0.29 0.27 -0.04 0.00 0.63 0.00 0.00 28.75 29.90 1n4c h GLU 172 CO 0.02 1.34 0.49 0.35 -0.73 0.00 0.00 179.01 180.48 1n4c h PHE 173 N 0.12 0.89 -0.01 0.92 3.57 0.23 2.21 116.94 124.86 1n4c h PHE 173 Ca -0.24 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.23 1n4c h PHE 173 Cb 2.10 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 40.55 1n4c h PHE 173 CO 0.10 0.53 -0.19 0.93 -2.23 0.00 0.00 178.31 177.45 1n4c h GLU 174 N 0.94 0.15 -0.01 1.11 4.39 -1.43 -2.68 114.58 117.04 1n4c h GLU 174 Ca 0.29 -0.14 -0.20 0.00 0.34 0.00 0.00 59.36 59.65 1n4c h GLU 174 Cb 0.01 0.04 0.02 0.00 -0.10 0.00 0.00 28.75 28.71 1n4c h GLU 174 CO -0.08 0.87 -0.77 -0.97 -1.16 0.00 0.00 179.01 176.90 1n4c h ASN 175 N -0.52 0.70 0.17 1.42 -0.73 -1.16 -0.61 115.58 114.85 1n4c h ASN 175 Ca -0.02 -0.74 -0.02 0.00 1.87 0.00 0.00 56.30 57.39 1n4c h ASN 175 Cb 0.93 -0.21 -0.00 0.00 0.27 0.00 0.00 38.32 39.30 1n4c h ASN 175 CO 0.04 1.34 -0.10 -0.61 -0.37 0.00 0.00 177.43 177.73 1n4c h GLN 176 N 0.12 0.00 -0.82 6.67 -0.00 0.35 -3.37 115.11 118.06 1n4c h GLN 176 Ca -0.09 0.00 -0.15 0.00 -0.00 0.00 0.00 58.65 58.41 1n4c h GLN 176 Cb 1.45 0.00 -0.16 0.00 0.00 0.00 0.00 27.48 28.78 1n4c h GLN 176 CO 0.15 0.10 -0.47 0.41 0.00 0.00 0.00 178.83 179.02 1n4c n GLY 177 N -1.05 -0.55 1.79 2.39 0.00 -1.01 -4.99 105.19 101.76 1n4c n GLY 177 Ca -0.02 0.46 -0.08 0.00 0.00 0.00 0.00 46.02 46.38 1n4c n GLY 177 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1n4c n GLN 178 N 2.74 1.56 -3.45 1.61 0.00 -0.24 -4.64 117.38 114.96 1n4c n GLN 178 Ca 0.16 -0.65 -0.11 0.00 -0.00 0.00 0.00 57.00 56.41 1n4c n GLN 178 Cb 0.57 -1.54 -0.02 0.00 0.00 0.00 0.00 30.24 29.26 1n4c n GLN 178 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.06 177.21 1n4c s LYS 179 N 0.27 1.18 -0.18 3.69 1.02 -1.26 -5.10 119.74 119.35 1n4c s LYS 179 Ca 0.35 -0.44 -0.29 0.00 0.02 0.00 0.00 55.97 55.61 1n4c s LYS 179 Cb 0.18 0.54 -0.04 0.00 -0.52 0.00 0.00 37.83 37.98 1n4c s LYS 179 CO -0.01 -0.52 1.87 -1.25 -0.92 0.00 0.00 175.35 174.52 1n4c s PRO 180 N -3.60 3.63 -0.87 -1.68 0.04 -1.26 -4.93 135.00 126.34 1n4c s PRO 180 Ca 0.02 1.93 0.01 0.00 0.04 0.00 0.00 61.00 63.00 1n4c s PRO 180 Cb -0.01 -4.17 0.30 0.00 0.04 0.00 0.00 34.50 30.66 1n4c s PRO 180 CO -0.12 -1.51 1.26 -0.11 0.04 0.00 0.00 177.00 176.57 1n4c n LEU 181 N 9.35 5.57 0.00 -3.56 7.94 -1.26 -5.18 117.00 129.85 1n4c n LEU 181 Ca 0.22 -5.40 0.00 0.00 -1.11 0.00 0.00 56.01 49.73 1n4c n LEU 181 Cb 0.44 -0.97 0.00 0.00 0.53 0.00 0.00 43.42 43.43 1n4c n LEU 181 CO 0.66 1.98 0.00 0.00 -1.11 0.00 0.00 177.39 178.92