#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 0.28 0.00 1.61 -0.02 -1.26 -4.98 135.00 130.63 1n4c n PRO 2 Ca 0.00 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 1n4c n PRO 2 Cb 0.00 -1.46 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 1n4c n PRO 2 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1n4c n LEU 3 N 1.16 0.00 0.00 2.45 4.32 -1.26 -5.01 117.00 118.66 1n4c n LEU 3 Ca 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.08 1n4c n LEU 3 Cb 0.48 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.28 1n4c n LEU 3 CO 0.52 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 177.30 1n4c n GLY 4 N 1.84 0.00 3.69 -0.72 0.00 -1.26 -5.13 105.19 103.61 1n4c n GLY 4 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.28 1.38 0.00 1.61 3.41 -1.26 -5.00 113.62 113.48 1n4c n SER 5 Ca 0.00 0.70 0.00 0.00 -0.26 0.00 0.00 58.87 59.31 1n4c n SER 5 Cb 0.00 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 62.44 1n4c n SER 5 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1n4c n PRO 6 N -2.45 0.00 -1.92 4.33 -0.04 -1.26 -4.61 135.00 129.05 1n4c n PRO 6 Ca 0.14 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.21 1n4c n PRO 6 Cb 0.49 -0.14 -0.03 0.00 -0.04 0.00 0.00 33.50 33.78 1n4c n PRO 6 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1n4c s GLU 7 N 0.00 2.69 -0.06 0.54 0.41 -1.26 -4.91 118.70 116.12 1n4c s GLU 7 Ca 0.00 1.00 -0.29 0.00 -0.41 0.00 0.00 54.97 55.27 1n4c s GLU 7 Cb 0.00 -4.38 -0.07 0.00 -1.78 0.00 0.00 34.13 27.90 1n4c s GLU 7 CO 0.00 -2.63 1.89 -0.06 -0.49 0.00 0.00 175.26 173.97 1n4c s PHE 8 N 9.20 1.52 0.26 1.61 0.08 -1.26 -4.47 117.98 124.92 1n4c s PHE 8 Ca 0.77 -0.02 0.00 0.00 0.12 0.00 0.00 56.93 57.81 1n4c s PHE 8 Cb -0.16 -4.09 0.00 0.00 -0.57 0.00 0.00 43.02 38.20 1n4c s PHE 8 CO 0.25 -4.59 0.00 0.45 -0.10 0.00 0.00 175.22 171.23 1n4c n SER 9 N 8.27 -2.34 -3.56 1.36 2.88 -1.26 -5.16 113.62 113.81 1n4c n SER 9 Ca 0.21 0.69 -0.10 0.00 -1.33 0.00 0.00 58.87 58.34 1n4c n SER 9 Cb 0.43 2.38 -0.04 0.00 -0.75 0.00 0.00 64.21 66.22 1n4c n SER 9 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1n4c s MET 10 N -1.91 0.67 0.39 -1.46 0.23 -1.26 -5.16 119.30 110.81 1n4c s MET 10 Ca 0.00 0.03 -0.25 0.00 -1.03 0.00 0.00 55.69 54.44 1n4c s MET 10 Cb 0.00 0.31 -0.09 0.00 -1.53 0.00 0.00 34.83 33.53 1n4c s MET 10 CO 0.00 -0.23 1.11 -1.25 -2.03 0.00 0.00 175.02 172.62 1n4c s PRO 11 N -1.67 4.13 -0.78 3.16 0.04 -1.26 -4.89 135.00 133.74 1n4c s PRO 11 Ca -0.00 1.70 -0.23 0.00 0.04 0.00 0.00 61.00 62.51 1n4c s PRO 11 Cb -0.01 -2.65 -0.16 0.00 0.04 0.00 0.00 34.50 31.72 1n4c s PRO 11 CO -0.01 -0.21 1.91 0.72 0.04 0.00 0.00 177.00 179.45 1n4c n HIS 12 N 0.09 1.87 -2.82 0.56 8.25 -1.26 -4.50 115.22 117.41 1n4c n HIS 12 Ca 0.04 -1.69 -0.02 0.00 -0.26 0.00 0.00 57.72 55.80 1n4c n HIS 12 Cb 0.48 -1.76 0.01 0.00 1.12 0.00 0.00 29.99 29.83 1n4c n HIS 12 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1n4c s SER 13 N 5.30 -0.87 -0.45 0.41 1.04 -1.26 -5.07 113.70 112.80 1n4c s SER 13 Ca 0.59 -0.81 0.04 0.00 0.48 0.00 0.00 55.95 56.26 1n4c s SER 13 Cb 0.13 1.13 0.25 0.00 0.10 0.00 0.00 66.02 67.63 1n4c s SER 13 CO 0.13 -0.06 0.97 -0.24 0.98 0.00 0.00 173.24 175.03 1n4c n SER 14 N 3.25 -2.54 -0.11 7.02 2.88 -1.26 -5.05 113.62 117.81 1n4c n SER 14 Ca 0.12 -2.97 -0.12 0.00 -1.33 0.00 0.00 58.87 54.57 1n4c n SER 14 Cb 0.60 1.59 -0.08 0.00 -0.75 0.00 0.00 64.21 65.57 1n4c n SER 14 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1n4c h PRO 15 N 3.79 -0.34 -3.70 -1.46 0.11 -1.99 -2.74 132.00 125.68 1n4c h PRO 15 Ca -0.17 0.02 -0.64 0.00 0.11 0.00 0.00 66.00 65.32 1n4c h PRO 15 Cb 1.07 0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1n4c h PRO 15 CO 0.21 -0.23 3.14 1.04 -0.21 0.00 0.00 178.00 181.96 1n4c n GLN 16 N -4.97 2.77 -2.48 1.05 1.13 -1.26 -4.91 117.38 108.71 1n4c n GLN 16 Ca -0.03 -2.19 -0.43 0.00 -1.94 0.00 0.00 57.00 52.41 1n4c n GLN 16 Cb 0.29 -2.96 -0.02 0.00 0.11 0.00 0.00 30.24 27.66 1n4c n GLN 16 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1n4c s ASN 17 N 3.22 6.83 -0.44 1.08 2.47 -1.04 -4.86 114.94 122.21 1n4c s ASN 17 Ca 0.55 1.34 0.06 0.00 0.42 0.00 0.00 52.86 55.22 1n4c s ASN 17 Cb 0.15 -2.54 0.32 0.00 -1.45 0.00 0.00 41.25 37.73 1n4c s ASN 17 CO -0.04 -0.92 1.16 -1.14 -3.72 0.00 0.00 177.10 172.44 1n4c n ARG 18 N 6.95 0.87 0.00 0.43 0.63 -1.26 -5.09 116.66 119.19 1n4c n ARG 18 Ca 0.14 -1.73 0.00 0.00 -0.92 0.00 0.00 57.85 55.34 1n4c n ARG 18 Cb 0.46 -0.90 0.00 0.00 0.45 0.00 0.00 32.46 32.47 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 0.42 0.00 -3.18 -0.14 -0.04 -1.26 -5.00 135.00 125.81 1n4c n PRO 19 Ca 0.04 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.52 1n4c n PRO 19 Cb 0.71 -0.07 -0.01 0.00 -0.04 0.00 0.00 33.50 34.09 1n4c n PRO 19 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1n4c s ASN 20 N -1.22 -1.47 0.04 3.54 2.47 -1.26 -5.12 114.94 111.92 1n4c s ASN 20 Ca 0.00 -0.58 -0.31 0.00 0.42 0.00 0.00 52.86 52.39 1n4c s ASN 20 Cb 0.00 1.89 -0.07 0.00 -1.45 0.00 0.00 41.25 41.62 1n4c s ASN 20 CO 0.00 -0.18 1.45 -0.31 -3.72 0.00 0.00 177.10 174.34 1n4c s TYR 21 N 2.02 2.86 -0.24 0.43 1.51 -1.26 -4.97 117.35 117.69 1n4c s TYR 21 Ca 0.15 0.74 -0.27 0.00 -1.01 0.00 0.00 57.07 56.69 1n4c s TYR 21 Cb -0.05 -3.73 0.13 0.00 -0.11 0.00 0.00 41.96 38.20 1n4c s TYR 21 CO -0.11 -2.74 1.03 1.21 -1.11 0.00 0.00 175.55 173.83 1n4c s ASN 22 N 1.79 -0.42 1.08 2.29 3.04 -1.26 -5.16 114.94 116.30 1n4c s ASN 22 Ca 0.66 0.71 -0.18 0.00 0.04 0.00 0.00 52.86 54.09 1n4c s ASN 22 Cb -0.35 0.69 0.11 0.00 -1.54 0.00 0.00 41.25 40.16 1n4c s ASN 22 CO 0.29 -0.21 -0.01 1.33 -3.04 0.00 0.00 177.10 175.46 1n4c n VAL 23 N 1.75 0.00 -3.64 -5.21 0.24 -1.26 -5.03 118.33 105.18 1n4c n VAL 23 Ca -0.12 -0.17 -0.06 0.00 -2.04 0.00 0.00 64.34 61.96 1n4c n VAL 23 Cb 0.56 -0.51 -0.07 0.00 -1.47 0.00 0.00 33.84 32.35 1n4c n VAL 23 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1n4c s SER 24 N -1.83 -0.82 1.12 -1.34 1.04 -1.26 -5.17 113.70 105.44 1n4c s SER 24 Ca 0.47 1.31 -0.15 0.00 0.48 0.00 0.00 55.95 58.06 1n4c s SER 24 Cb -0.07 1.34 0.22 0.00 0.10 0.00 0.00 66.02 67.60 1n4c s SER 24 CO 0.54 -0.21 0.95 2.22 0.98 0.00 0.00 173.24 177.71 1n4c n PHE 25 N 4.14 -3.83 -1.80 5.02 1.16 -1.26 -5.08 117.46 115.81 1n4c n PHE 25 Ca -0.20 -0.85 0.00 0.00 -1.87 0.00 0.00 57.45 54.54 1n4c n PHE 25 Cb 0.59 -0.87 0.00 0.00 -1.61 0.00 0.00 39.48 37.59 1n4c n PHE 25 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1n4c n SER 26 N -4.17 0.00 -2.81 5.98 2.88 -1.26 -5.13 113.62 109.11 1n4c n SER 26 Ca 0.13 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.65 1n4c n SER 26 Cb 0.46 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.94 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 2.00 -0.77 -0.39 -3.46 0.15 -1.26 -5.07 113.70 104.91 1n4c s SER 27 Ca 0.00 -0.67 0.02 0.00 0.70 0.00 0.00 55.95 56.00 1n4c s SER 27 Cb 0.00 0.99 0.28 0.00 -1.71 0.00 0.00 66.02 65.58 1n4c s SER 27 CO 0.00 -0.05 1.15 1.15 1.20 0.00 0.00 173.24 176.68 1n4c n MET 28 N 3.28 0.43 -0.88 5.44 0.00 -1.26 -5.16 117.12 118.98 1n4c n MET 28 Ca 0.11 -1.16 -0.35 0.00 0.00 0.00 0.00 57.70 56.31 1n4c n MET 28 Cb 0.61 -0.69 0.09 0.00 0.00 0.00 0.00 33.22 33.23 1n4c n MET 28 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 1n4c n PRO 29 N 1.26 -0.33 0.00 3.17 -0.02 -1.26 -4.93 135.00 132.88 1n4c n PRO 29 Ca 0.03 -0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1n4c n PRO 29 Cb 0.69 -1.39 0.00 0.00 -0.02 0.00 0.00 33.50 32.78 1n4c n PRO 29 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1n4c n GLY 30 N 2.60 0.73 3.73 -1.23 0.00 -1.26 -5.11 105.19 104.65 1n4c n GLY 30 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 1n4c n GLY 30 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n4c s GLY 31 N 0.00 2.84 0.62 -0.02 0.00 -1.26 -4.88 107.32 104.63 1n4c s GLY 31 Ca 0.00 0.72 0.27 0.00 0.00 0.00 0.00 44.72 45.70 1n4c s GLY 31 CO 0.00 1.65 1.77 1.46 0.00 0.00 0.00 173.10 177.98 1n4c h GLN 32 N 5.66 0.00 -4.06 2.90 4.20 -2.06 -3.20 115.11 118.56 1n4c h GLN 32 Ca -0.43 0.00 -0.48 0.00 0.06 0.00 0.00 58.65 57.80 1n4c h GLN 32 Cb 1.21 0.00 0.04 0.00 0.30 0.00 0.00 27.48 29.03 1n4c h GLN 32 CO 0.74 0.00 2.25 -1.71 -0.67 0.00 0.00 178.83 179.44 1n4c n ASN 33 N -3.30 3.15 0.08 1.46 5.15 -1.26 -4.47 115.26 116.08 1n4c n ASN 33 Ca 0.06 -2.47 -0.14 0.00 -0.60 0.00 0.00 54.58 51.43 1n4c n ASN 33 Cb 0.69 -1.01 -0.07 0.00 -0.53 0.00 0.00 39.78 38.85 1n4c n ASN 33 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 1n4c h GLU 34 N 7.42 0.35 0.00 1.20 4.81 -1.97 -3.47 114.58 122.91 1n4c h GLU 34 Ca 0.40 -0.44 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1n4c h GLU 34 Cb 0.41 0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1n4c h GLU 34 CO 1.68 1.14 0.00 -2.13 -0.73 0.00 0.00 179.01 178.97 1n4c n ARG 35 N -3.67 0.00 0.00 1.92 0.63 -1.26 -5.15 116.66 109.13 1n4c n ARG 35 Ca -0.07 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.86 1n4c n ARG 35 Cb 0.90 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.81 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 -1.15 -0.14 1.71 5.14 0.00 -1.26 -4.92 105.19 104.57 1n4c n GLY 36 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1n4c n GLY 36 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1n4c n LYS 37 N -0.86 0.00 0.05 1.61 4.81 -1.26 -4.96 118.16 117.54 1n4c n LYS 37 Ca 0.00 0.00 -0.20 0.00 -0.87 0.00 0.00 58.31 57.24 1n4c n LYS 37 Cb 0.00 0.00 -0.13 0.00 0.02 0.00 0.00 35.03 34.92 1n4c n LYS 37 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1n4c h ALA 38 N 0.00 0.00 0.00 3.14 0.00 -2.08 -3.15 119.26 117.17 1n4c h ALA 38 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.23 1n4c h ALA 38 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1n4c h ALA 38 CO 0.00 0.49 0.00 0.00 0.00 0.00 0.00 179.25 179.74 1n4c n ALA 39 N -2.65 2.27 -2.53 0.00 0.00 -1.26 -4.65 120.51 111.69 1n4c n ALA 39 Ca -0.13 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.90 1n4c n ALA 39 Cb 0.83 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.28 1n4c n ALA 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n4c s ALA 40 N -0.23 3.15 -0.80 0.00 0.00 -1.19 -4.91 121.76 117.77 1n4c s ALA 40 Ca 0.00 -2.83 -0.26 0.00 0.00 0.00 0.00 51.96 48.88 1n4c s ALA 40 Cb 0.00 -4.65 0.01 0.00 0.00 0.00 0.00 23.12 18.48 1n4c s ALA 40 CO 0.00 -3.51 1.52 0.54 0.00 0.00 0.00 175.76 174.32 1n4c s ASN 41 N 4.48 5.93 0.41 0.00 4.22 -1.26 -4.80 114.94 123.92 1n4c s ASN 41 Ca 0.55 -0.54 0.21 0.00 -2.14 0.00 0.00 52.86 50.94 1n4c s ASN 41 Cb 0.03 -2.56 0.82 0.00 1.28 0.00 0.00 41.25 40.83 1n4c s ASN 41 CO 0.08 -1.98 1.79 -0.07 -2.04 0.00 0.00 177.10 174.88 1n4c h LEU 42 N 14.27 0.00 0.00 3.54 3.38 -1.98 -3.44 115.31 131.08 1n4c h LEU 42 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1n4c h LEU 42 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1n4c h LEU 42 CO 1.29 0.29 0.00 1.21 0.09 0.00 0.00 178.44 181.33 1n4c n GLU 43 N -3.48 0.00 -2.66 1.13 0.00 -1.26 -5.05 120.64 109.32 1n4c n GLU 43 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 57.16 57.13 1n4c n GLU 43 Cb 0.46 0.00 0.07 0.00 0.00 0.00 0.00 31.44 31.97 1n4c n GLU 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1n4c n GLY 44 N -1.48 -1.26 2.45 8.31 0.00 -1.26 -5.02 105.19 106.93 1n4c n GLY 44 Ca 0.00 0.57 -0.09 0.00 0.00 0.00 0.00 46.02 46.50 1n4c n GLY 44 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1n4c n LYS 45 N 0.15 1.09 -2.56 1.61 3.00 -1.26 -4.75 118.16 115.44 1n4c n LYS 45 Ca -0.13 -0.70 -0.42 0.00 -0.00 0.00 0.00 58.31 57.05 1n4c n LYS 45 Cb 0.72 -1.94 -0.01 0.00 0.00 0.00 0.00 35.03 33.81 1n4c n LYS 45 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 1n4c s GLN 46 N 2.78 3.87 -0.85 1.64 -1.52 -1.26 -4.84 119.66 119.48 1n4c s GLN 46 Ca 0.28 -1.80 -0.05 0.00 -1.95 0.00 0.00 55.36 51.84 1n4c s GLN 46 Cb 0.11 -5.50 -0.05 0.00 -0.22 0.00 0.00 33.01 27.35 1n4c s GLN 46 CO -0.01 -2.30 2.08 1.17 -0.25 0.00 0.00 175.29 175.98 1n4c n LYS 47 N 8.49 1.98 0.00 2.91 0.00 -1.26 -4.33 118.16 125.95 1n4c n LYS 47 Ca 0.46 -1.39 0.13 0.00 0.00 0.00 0.00 58.31 57.51 1n4c n LYS 47 Cb 0.47 -2.41 0.44 0.00 0.00 0.00 0.00 35.03 33.54 1n4c n LYS 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1n4c n ALA 48 N 4.15 2.92 -0.72 3.14 0.00 -1.26 -4.52 120.51 124.21 1n4c n ALA 48 Ca 0.42 -0.22 -0.35 0.00 0.00 0.00 0.00 53.44 53.29 1n4c n ALA 48 Cb 0.14 -1.30 -0.07 0.00 0.00 0.00 0.00 19.45 18.23 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 -1.49 2.37 0.01 0.00 0.00 -1.26 -3.44 120.51 116.69 1n4c n ALA 49 Ca 0.06 -2.49 0.00 0.00 0.00 0.00 0.00 53.44 51.01 1n4c n ALA 49 Cb 0.34 -3.44 0.00 0.00 0.00 0.00 0.00 19.45 16.35 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 7.22 -0.15 -3.60 0.00 5.75 -1.26 -5.00 116.55 119.51 1n4c n ASP 50 Ca 0.42 0.05 -0.43 0.00 -0.01 0.00 0.00 54.79 54.81 1n4c n ASP 50 Cb 0.32 0.39 -0.06 0.00 -1.03 0.00 0.00 41.12 40.74 1n4c n ASP 50 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 1n4c n PHE 51 N -2.08 1.61 -1.98 2.11 -0.00 -1.22 -3.62 117.46 112.28 1n4c n PHE 51 Ca 0.00 -1.64 -0.02 0.00 -0.00 0.00 0.00 57.45 55.79 1n4c n PHE 51 Cb 0.00 -1.58 -0.02 0.00 -0.00 0.00 0.00 39.48 37.88 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 7.07 0.00 -2.69 -4.13 2.13 -1.26 -4.96 120.64 116.80 1n4c n GLU 52 Ca 0.49 -0.27 -0.05 0.00 0.66 0.00 0.00 57.16 58.00 1n4c n GLU 52 Cb 0.40 0.14 0.12 0.00 0.27 0.00 0.00 31.44 32.37 1n4c n GLU 52 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1n4c n ASP 53 N 0.00 -1.61 -4.58 4.31 -0.08 -1.24 -5.13 116.55 108.21 1n4c n ASP 53 Ca -0.07 -2.35 -0.41 0.00 -1.51 0.00 0.00 54.79 50.44 1n4c n ASP 53 Cb 0.54 0.83 0.01 0.00 2.34 0.00 0.00 41.12 44.84 1n4c n ASP 53 CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 1n4c n LEU 54 N -1.02 2.24 -1.96 -2.67 7.94 -1.26 -4.73 117.00 115.53 1n4c n LEU 54 Ca -0.09 1.01 -0.04 0.00 -1.11 0.00 0.00 56.01 55.77 1n4c n LEU 54 Cb 0.86 -1.31 -0.06 0.00 0.53 0.00 0.00 43.42 43.44 1n4c n LEU 54 CO -0.11 -1.73 0.97 0.18 -1.11 0.00 0.00 177.39 175.59 1n4c n LEU 55 N 0.57 3.41 -0.22 -1.96 4.77 -1.26 -4.43 117.00 117.89 1n4c n LEU 55 Ca 0.10 -1.93 0.01 0.00 -0.03 0.00 0.00 56.01 54.16 1n4c n LEU 55 Cb 0.39 -0.83 0.13 0.00 -2.33 0.00 0.00 43.42 40.78 1n4c n LEU 55 CO 0.56 0.80 1.00 0.77 -1.33 0.00 0.00 177.39 179.19 1n4c h SER 56 N 3.18 0.25 0.00 -1.43 4.64 -2.02 -3.16 113.55 115.01 1n4c h SER 56 Ca 0.07 0.08 -0.58 0.00 -0.47 0.00 0.00 61.79 60.90 1n4c h SER 56 Cb 0.83 0.06 0.09 0.00 -0.31 0.00 0.00 62.40 63.07 1n4c h SER 56 CO 0.18 0.14 1.85 0.61 -0.87 0.00 0.00 176.83 178.74 1n4c n GLY 57 N -1.30 1.67 2.61 -0.77 0.00 -1.26 -4.35 105.19 101.79 1n4c n GLY 57 Ca 0.10 -1.04 -0.11 0.00 0.00 0.00 0.00 46.02 44.97 1n4c n GLY 57 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1n4c n GLN 58 N 7.18 0.88 -0.80 1.61 7.27 -1.20 -5.00 117.38 127.33 1n4c n GLN 58 Ca 0.46 -2.17 0.00 0.00 0.07 0.00 0.00 57.00 55.36 1n4c n GLN 58 Cb 0.38 -1.31 0.00 0.00 2.41 0.00 0.00 30.24 31.72 1n4c n GLN 58 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1n4c n GLY 59 N 1.01 0.17 3.64 1.69 0.00 -1.26 -5.12 105.19 105.32 1n4c n GLY 59 Ca 0.11 -0.44 -0.02 0.00 0.00 0.00 0.00 46.02 45.67 1n4c n GLY 59 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1n4c s PHE 60 N -2.13 -0.58 1.04 1.61 5.36 -1.26 -5.16 117.98 116.86 1n4c s PHE 60 Ca 0.00 1.15 -0.14 0.00 -0.96 0.00 0.00 56.93 56.98 1n4c s PHE 60 Cb 0.00 0.35 0.22 0.00 -0.34 0.00 0.00 43.02 43.25 1n4c s PHE 60 CO 0.00 -0.29 0.50 -1.71 -1.46 0.00 0.00 175.22 172.26 1n4c n ASN 61 N 3.72 -3.23 -3.79 6.13 2.85 -1.26 -4.98 115.26 114.69 1n4c n ASN 61 Ca -0.19 -0.50 -0.30 0.00 -0.11 0.00 0.00 54.58 53.48 1n4c n ASN 61 Cb 0.58 -0.77 -0.15 0.00 1.24 0.00 0.00 39.78 40.68 1n4c n ASN 61 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1n4c s ALA 62 N -2.06 1.69 -0.23 5.20 0.00 -1.26 -5.10 121.76 120.00 1n4c s ALA 62 Ca 0.38 -1.66 -0.24 0.00 0.00 0.00 0.00 51.96 50.45 1n4c s ALA 62 Cb -0.07 -1.61 0.06 0.00 0.00 0.00 0.00 23.12 21.51 1n4c s ALA 62 CO 0.32 -1.58 0.66 -1.58 0.00 0.00 0.00 175.76 173.59 1n4c s HIS 63 N 1.53 -0.72 -0.86 0.00 5.04 -1.26 -5.07 115.29 113.96 1n4c s HIS 63 Ca 0.08 1.72 -0.22 0.00 -1.54 0.00 0.00 55.06 55.09 1n4c s HIS 63 Cb -0.18 0.26 -0.22 0.00 0.04 0.00 0.00 32.58 32.49 1n4c s HIS 63 CO -0.20 -0.37 2.41 1.17 -2.34 0.00 0.00 174.74 175.41 1n4c n LYS 64 N 2.57 0.31 -3.01 2.88 4.81 -1.26 -4.70 118.16 119.75 1n4c n LYS 64 Ca -0.14 -0.18 0.03 0.00 -0.87 0.00 0.00 58.31 57.14 1n4c n LYS 64 Cb 0.56 -2.16 -0.00 0.00 0.02 0.00 0.00 35.03 33.45 1n4c n LYS 64 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1n4c s ASP 65 N 7.06 -0.81 0.23 3.14 -1.08 -1.26 -5.16 116.67 118.79 1n4c s ASP 65 Ca 1.19 -0.24 0.00 0.00 -0.52 0.00 0.00 52.55 52.98 1n4c s ASP 65 Cb -0.69 1.18 0.00 0.00 -1.46 0.00 0.00 42.92 41.95 1n4c s ASP 65 CO 0.39 -0.11 0.00 2.29 0.52 0.00 0.00 175.17 178.26 1n4c n LYS 66 N 4.38 0.50 -1.68 4.34 2.85 -1.26 -4.64 118.16 122.65 1n4c n LYS 66 Ca 0.08 0.00 -0.57 0.00 -1.05 0.00 0.00 58.31 56.77 1n4c n LYS 66 Cb 0.59 0.00 -0.07 0.00 -0.65 0.00 0.00 35.03 34.90 1n4c n LYS 66 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1n4c n LYS 67 N -0.46 1.18 -3.93 -1.58 5.02 -1.26 -4.90 118.16 112.23 1n4c n LYS 67 Ca 0.00 0.42 -0.10 0.00 -2.02 0.00 0.00 58.31 56.62 1n4c n LYS 67 Cb 0.00 -2.15 -0.02 0.00 -0.02 0.00 0.00 35.03 32.84 1n4c n LYS 67 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1n4c s GLY 68 N 3.92 0.59 1.20 0.72 0.00 -1.26 -5.17 107.32 107.32 1n4c s GLY 68 Ca 1.00 -0.88 -0.17 0.00 0.00 0.00 0.00 44.72 44.66 1n4c s GLY 68 CO 0.64 -0.51 1.05 2.56 0.00 0.00 0.00 173.10 176.84 1n4c s PRO 69 N -3.23 -1.21 -0.37 2.90 0.04 -1.26 -5.03 135.00 126.84 1n4c s PRO 69 Ca 0.20 0.26 0.12 0.00 0.04 0.00 0.00 61.00 61.61 1n4c s PRO 69 Cb -0.03 -1.57 0.35 0.00 0.04 0.00 0.00 34.50 33.29 1n4c s PRO 69 CO 0.12 -3.77 0.74 0.54 0.04 0.00 0.00 177.00 174.66 1n4c n ARG 70 N -4.86 0.96 -4.30 4.56 5.12 -1.26 -5.07 116.66 111.81 1n4c n ARG 70 Ca 0.09 -3.32 -0.18 0.00 -1.93 0.00 0.00 57.85 52.51 1n4c n ARG 70 Cb 0.58 -1.67 -0.14 0.00 -1.16 0.00 0.00 32.46 30.07 1n4c n ARG 70 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1n4c s THR 71 N -2.29 0.67 -1.42 0.55 -4.23 -1.26 -4.99 115.64 102.68 1n4c s THR 71 Ca 0.39 -0.46 0.00 0.00 -1.18 0.00 0.00 61.69 60.44 1n4c s THR 71 Cb 0.34 -0.58 0.00 0.00 1.34 0.00 0.00 72.50 73.60 1n4c s THR 71 CO -0.08 0.12 0.55 0.00 -0.54 0.00 0.00 174.62 174.67 1n4c n ILE 72 N 2.68 0.45 0.19 2.99 3.06 -1.26 -0.99 119.36 126.49 1n4c n ILE 72 Ca -0.14 0.14 0.08 0.00 -2.50 0.00 0.00 62.75 60.32 1n4c n ILE 72 Cb 0.57 -1.14 0.18 0.00 0.54 0.00 0.00 39.64 39.79 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 1.64 0.87 0.00 1.51 0.00 -2.00 -3.19 119.26 118.09 1n4c h ALA 73 Ca 0.00 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 1n4c h ALA 73 Cb 0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1n4c h ALA 73 CO 0.00 0.29 -0.39 1.49 0.00 0.00 0.00 179.25 180.65 1n4c h GLU 74 N 0.00 0.00 0.17 0.00 4.22 -1.48 -3.11 114.58 114.37 1n4c h GLU 74 Ca -0.00 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.43 1n4c h GLU 74 Cb 1.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1n4c h GLU 74 CO 0.03 0.33 -0.08 1.98 -2.18 0.00 0.00 179.01 179.09 1n4c h MET 75 N 0.00 -0.22 0.00 1.92 4.05 -1.71 -3.12 114.93 115.86 1n4c h MET 75 Ca -0.01 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 1n4c h MET 75 Cb 1.27 0.05 0.00 0.00 -0.80 0.00 0.00 31.60 32.12 1n4c h MET 75 CO 0.04 -0.14 0.00 2.89 0.23 0.00 0.00 176.91 179.93 1n4c n ARG 76 N -3.50 0.05 0.29 0.39 1.85 -1.24 -2.80 116.66 111.70 1n4c n ARG 76 Ca -0.03 0.15 0.10 0.00 -1.00 0.00 0.00 57.85 57.07 1n4c n ARG 76 Cb 0.09 -1.50 0.51 0.00 -1.05 0.00 0.00 32.46 30.51 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 0.45 2.89 3.64 -1.47 -1.45 116.57 120.63 1n4c h LYS 77 Ca 0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1n4c h LYS 77 Cb 0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1n4c h LYS 77 CO 0.00 0.00 -0.21 1.49 -2.27 0.00 0.00 179.45 178.46 1n4c h GLU 78 N 0.00 -0.58 -1.05 1.90 4.81 -1.76 -2.97 114.58 114.93 1n4c h GLU 78 Ca 0.00 0.04 0.30 0.00 -0.13 0.00 0.00 59.36 59.57 1n4c h GLU 78 Cb 0.95 0.13 -0.04 0.00 0.63 0.00 0.00 28.75 30.42 1n4c h GLU 78 CO 0.00 -0.39 0.88 1.49 -0.73 0.00 0.00 179.01 180.27 1n4c h GLU 79 N -1.00 0.00 -0.09 1.92 4.81 -1.56 1.34 114.58 120.00 1n4c h GLU 79 Ca -0.06 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.05 1n4c h GLU 79 Cb 0.46 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 1n4c h GLU 79 CO 0.10 0.00 -0.49 0.52 -0.73 0.00 0.00 179.01 178.41 1n4c h MET 80 N 0.00 0.23 -0.01 1.92 2.86 -1.45 -2.69 114.93 115.79 1n4c h MET 80 Ca 0.50 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 58.01 1n4c h MET 80 Cb 2.26 0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.92 1n4c h MET 80 CO -0.01 0.68 -0.20 0.00 1.06 0.00 0.00 176.91 178.44 1n4c n ALA 81 N -2.47 2.96 0.76 6.32 0.00 0.45 -3.76 120.51 124.77 1n4c n ALA 81 Ca -0.02 -0.42 0.05 0.00 0.00 0.00 0.00 53.44 53.06 1n4c n ALA 81 Cb 0.54 -1.13 0.16 0.00 0.00 0.00 0.00 19.45 19.01 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 -0.43 1.98 -2.70 0.00 4.76 -0.60 -4.06 118.16 117.11 1n4c n LYS 82 Ca 0.14 -1.30 -0.06 0.00 -2.87 0.00 0.00 58.31 54.22 1n4c n LYS 82 Cb 0.35 -1.37 0.08 0.00 -1.84 0.00 0.00 35.03 32.25 1n4c n LYS 82 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1n4c n GLU 83 N 0.49 1.29 -0.45 1.97 2.13 -1.25 -4.99 120.64 119.83 1n4c n GLU 83 Ca 0.12 -2.47 -0.12 0.00 0.66 0.00 0.00 57.16 55.34 1n4c n GLU 83 Cb 0.36 -0.62 -0.02 0.00 0.27 0.00 0.00 31.44 31.44 1n4c n GLU 83 CO 0.00 0.00 0.00 -0.12 -0.41 0.00 0.00 177.13 176.60 1n4c n MET 84 N -0.57 1.22 -1.79 5.31 1.56 -1.26 -4.78 117.12 116.81 1n4c n MET 84 Ca 0.00 -1.00 -0.41 0.00 -0.27 0.00 0.00 57.70 56.03 1n4c n MET 84 Cb 0.84 -2.20 -0.00 0.00 2.15 0.00 0.00 33.22 34.00 1n4c n MET 84 CO 0.00 0.00 0.00 0.34 -0.73 0.00 0.00 175.97 175.58 1n4c s ASP 85 N 3.81 6.34 0.59 6.12 -1.08 -1.26 -4.61 116.67 126.59 1n4c s ASP 85 Ca 0.25 3.03 0.14 0.00 -0.52 0.00 0.00 52.55 55.45 1n4c s ASP 85 Cb 0.07 -2.66 0.48 0.00 -1.46 0.00 0.00 42.92 39.35 1n4c s ASP 85 CO -0.02 -0.89 1.10 -2.65 0.52 0.00 0.00 175.17 173.23 1n4c n PRO 86 N 0.83 0.02 -0.01 4.34 -0.02 -1.26 0.25 135.00 139.15 1n4c n PRO 86 Ca 0.03 0.93 -0.02 0.00 -2.02 0.00 0.00 63.50 62.41 1n4c n PRO 86 Cb 0.39 -2.40 -0.12 0.00 -0.02 0.00 0.00 33.50 31.35 1n4c n PRO 86 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1n4c n GLU 87 N -2.80 0.64 0.11 -0.52 -0.58 -1.26 -4.02 120.64 112.21 1n4c n GLU 87 Ca 0.12 0.12 -0.04 0.00 -0.42 0.00 0.00 57.16 56.95 1n4c n GLU 87 Cb 1.23 -1.70 0.07 0.00 -0.57 0.00 0.00 31.44 30.47 1n4c n GLU 87 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1n4c h LYS 88 N 0.00 0.05 -0.61 3.49 3.64 0.30 -3.01 116.57 120.44 1n4c h LYS 88 Ca -0.26 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.05 1n4c h LYS 88 Cb 1.74 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.54 1n4c h LYS 88 CO 0.04 0.77 0.27 1.25 -2.27 0.00 0.00 179.45 179.51 1n4c h LEU 89 N 0.03 0.79 -1.26 5.20 5.85 -1.48 -2.03 115.31 122.41 1n4c h LEU 89 Ca -0.01 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.67 1n4c h LEU 89 Cb 1.32 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 42.10 1n4c h LEU 89 CO 0.10 0.69 0.53 0.50 -0.34 0.00 0.00 178.44 179.91 1n4c h LYS 90 N 0.86 0.90 -0.07 1.25 3.64 -1.67 -2.41 116.57 119.07 1n4c h LYS 90 Ca 0.21 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1n4c h LYS 90 Cb 0.12 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1n4c h LYS 90 CO -0.02 0.60 0.04 0.82 -2.27 0.00 0.00 179.45 178.61 1n4c h ILE 91 N 0.93 1.10 -1.06 2.00 2.04 -1.45 -2.02 117.51 119.06 1n4c h ILE 91 Ca 0.33 -0.28 0.30 0.00 1.00 0.00 0.00 64.86 66.21 1n4c h ILE 91 Cb 0.14 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 1n4c h ILE 91 CO -0.11 0.08 0.76 -0.07 0.00 0.00 0.00 178.15 178.81 1n4c h LEU 92 N 0.01 0.01 0.00 1.44 3.38 -1.38 0.56 115.31 119.33 1n4c h LEU 92 Ca 0.03 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.77 1n4c h LEU 92 Cb 0.10 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 1n4c h LEU 92 CO -0.00 0.00 -1.12 -0.33 0.09 0.00 0.00 178.44 177.08 1n4c h GLU 93 N 0.01 0.00 -0.24 1.13 4.39 -1.32 -3.04 114.58 115.52 1n4c h GLU 93 Ca 0.50 -0.01 -0.20 0.00 0.34 0.00 0.00 59.36 60.00 1n4c h GLU 93 Cb 2.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.66 1n4c h GLU 93 CO -0.01 0.92 -0.62 2.35 -1.16 0.00 0.00 179.01 180.49 1n4c h TRP 94 N 0.00 1.06 -0.08 4.33 7.01 0.66 -3.05 115.95 125.88 1n4c h TRP 94 Ca -0.06 -0.40 -0.16 0.00 2.11 0.00 0.00 58.89 60.37 1n4c h TRP 94 Cb 1.81 -0.19 0.01 0.00 -2.10 0.00 0.00 29.16 28.69 1n4c h TRP 94 CO 0.00 1.23 -0.59 -0.84 -2.79 0.00 0.00 178.44 175.45 1n4c h ILE 95 N 0.61 1.36 0.00 2.65 3.07 -1.34 -3.06 117.51 120.81 1n4c h ILE 95 Ca -0.01 -1.92 0.00 0.00 1.55 0.00 0.00 64.86 64.48 1n4c h ILE 95 Cb 1.23 2.27 0.00 0.00 -0.27 0.00 0.00 36.82 40.05 1n4c h ILE 95 CO 0.13 0.58 0.00 -1.84 -1.05 0.00 0.00 178.15 175.97 1n4c n GLU 96 N -4.17 0.08 0.05 0.16 0.28 -1.15 -2.08 120.64 113.81 1n4c n GLU 96 Ca -0.09 0.25 -0.20 0.00 -0.16 0.00 0.00 57.16 56.96 1n4c n GLU 96 Cb 0.65 -1.50 -0.11 0.00 1.43 0.00 0.00 31.44 31.91 1n4c n GLU 96 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 1n4c h GLY 97 N 1.77 0.71 -5.00 -1.84 0.00 -1.42 -3.44 103.07 93.86 1n4c h GLY 97 Ca 0.00 -1.31 -0.11 0.00 0.00 0.00 0.00 47.33 45.91 1n4c h GLY 97 CO 0.00 1.15 -0.22 0.58 0.00 0.00 0.00 176.54 178.05 1n4c n LYS 98 N -3.90 0.35 0.00 4.80 2.85 -0.99 -4.98 118.16 116.28 1n4c n LYS 98 Ca -0.12 -1.12 0.00 0.00 -1.05 0.00 0.00 58.31 56.02 1n4c n LYS 98 Cb 0.87 -0.64 0.00 0.00 -0.65 0.00 0.00 35.03 34.61 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 1.83 0.75 -1.45 -1.58 0.00 -0.88 -2.66 120.64 116.65 1n4c n GLU 99 Ca 0.06 0.00 0.04 0.00 0.00 0.00 0.00 57.16 57.26 1n4c n GLU 99 Cb 0.66 -1.25 0.02 0.00 0.00 0.00 0.00 31.44 30.87 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 0.37 0.00 -3.14 3.44 0.63 -1.26 -4.74 116.66 111.96 1n4c n ARG 100 Ca 0.00 -1.95 -0.19 0.00 -0.92 0.00 0.00 57.85 54.78 1n4c n ARG 100 Cb 0.28 -0.03 -0.03 0.00 0.45 0.00 0.00 32.46 33.13 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 0.47 1.46 -0.36 6.15 2.85 -1.09 -4.95 115.26 119.79 1n4c n ASN 101 Ca 0.06 -3.12 0.27 0.00 -0.11 0.00 0.00 54.58 51.68 1n4c n ASN 101 Cb 1.13 -0.61 0.53 0.00 1.24 0.00 0.00 39.78 42.07 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 1.36 0.28 -0.89 -1.44 -0.00 -1.86 0.91 117.51 115.86 1n4c h ILE 102 Ca 0.10 -0.09 0.01 0.00 -0.00 0.00 0.00 64.86 64.88 1n4c h ILE 102 Cb 0.90 -0.01 -0.04 0.00 -0.00 0.00 0.00 36.82 37.66 1n4c h ILE 102 CO 0.55 0.05 0.59 0.08 -0.00 0.00 0.00 178.15 179.42 1n4c h ARG 103 N 0.26 1.18 0.21 2.19 0.11 -1.97 -2.38 114.38 113.98 1n4c h ARG 103 Ca 0.74 -0.07 -0.30 0.00 0.10 0.00 0.00 59.98 60.45 1n4c h ARG 103 Cb 1.91 -0.27 0.03 0.00 1.11 0.00 0.00 29.97 32.75 1n4c h ARG 103 CO -0.52 0.78 -1.33 0.00 0.10 0.00 0.00 179.97 179.00 1n4c h ALA 104 N 1.44 -0.09 -0.66 0.08 0.00 0.32 -3.02 119.26 117.33 1n4c h ALA 104 Ca 0.33 -0.86 0.12 0.00 0.00 0.00 0.00 54.91 54.49 1n4c h ALA 104 Cb -0.14 0.21 -0.08 0.00 0.00 0.00 0.00 17.79 17.77 1n4c h ALA 104 CO -0.07 0.65 0.23 -0.07 0.00 0.00 0.00 179.25 179.99 1n4c h LEU 105 N -0.02 0.19 -0.87 0.00 3.38 -0.66 0.65 115.31 117.98 1n4c h LEU 105 Ca -0.24 0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.80 1n4c h LEU 105 Cb 2.00 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 42.84 1n4c h LEU 105 CO 0.22 0.09 -0.12 0.17 0.09 0.00 0.00 178.44 178.90 1n4c h LEU 106 N 0.39 0.00 -2.08 1.67 8.10 -1.55 -1.04 115.31 120.80 1n4c h LEU 106 Ca 0.35 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.34 1n4c h LEU 106 Cb 0.49 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.71 1n4c h LEU 106 CO -0.36 0.12 0.00 -1.20 -4.11 0.00 0.00 178.44 172.88 1n4c n SER 107 N -3.20 3.09 0.00 0.17 7.64 0.89 -4.11 113.62 118.11 1n4c n SER 107 Ca 0.01 -1.94 0.00 0.00 1.01 0.00 0.00 58.87 57.95 1n4c n SER 107 Cb 0.44 -0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 1n4c n SER 107 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1n4c n THR 108 N 1.23 0.17 0.20 0.44 -2.24 0.19 -4.57 114.28 109.70 1n4c n THR 108 Ca 0.19 -0.17 0.08 0.00 -2.27 0.00 0.00 64.05 61.88 1n4c n THR 108 Cb 0.54 0.99 0.35 0.00 -2.10 0.00 0.00 70.33 70.10 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 -0.06 -0.78 -1.53 -1.35 -3.14 114.93 108.07 1n4c h MET 109 Ca 0.00 0.00 0.02 0.00 -3.44 0.00 0.00 59.70 56.28 1n4c h MET 109 Cb 0.87 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.92 1n4c h MET 109 CO 0.00 0.27 0.06 1.12 0.14 0.00 0.00 176.91 178.50 1n4c h HIS 110 N 0.00 0.00 0.00 1.39 2.07 -1.86 0.24 115.15 116.99 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 0.90 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.88 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 -2.35 6.12 -2.24 -1.19 -3.50 114.28 107.09 1n4c n THR 111 Ca -0.02 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.77 1n4c n THR 111 Cb 0.15 -0.29 -0.01 0.00 -2.10 0.00 0.00 70.33 68.08 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 -0.71 0.00 -2.53 2.28 0.24 0.06 -5.01 118.33 112.66 1n4c n VAL 112 Ca 0.09 -0.70 -0.24 0.00 -2.04 0.00 0.00 64.34 61.45 1n4c n VAL 112 Cb 0.04 0.85 0.10 0.00 -1.47 0.00 0.00 33.84 33.36 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 2.98 0.29 1.34 1.43 -1.17 -4.95 118.68 118.61 1n4c s LEU 113 Ca 0.24 -0.25 -0.18 0.00 -1.03 0.00 0.00 54.13 52.91 1n4c s LEU 113 Cb 0.27 -2.14 -0.09 0.00 0.03 0.00 0.00 46.19 44.27 1n4c s LEU 113 CO -0.12 -1.84 0.76 -1.66 0.23 0.00 0.00 176.35 173.72 1n4c s TRP 114 N -3.16 3.49 -0.22 0.29 -2.14 -1.26 -4.97 118.94 110.97 1n4c s TRP 114 Ca 0.66 1.33 -0.29 0.00 2.66 0.00 0.00 56.10 60.46 1n4c s TRP 114 Cb -0.06 -2.61 -0.04 0.00 -3.10 0.00 0.00 33.47 27.66 1n4c s TRP 114 CO 0.44 0.17 1.95 0.00 -2.66 0.00 0.00 176.95 176.86 1n4c s ALA 115 N -1.81 2.98 0.00 2.67 0.00 -1.26 -3.22 121.76 121.11 1n4c s ALA 115 Ca 0.50 0.63 0.00 0.00 0.00 0.00 0.00 51.96 53.10 1n4c s ALA 115 Cb -0.13 -3.99 0.00 0.00 0.00 0.00 0.00 23.12 19.00 1n4c s ALA 115 CO 0.19 -2.44 0.00 0.41 0.00 0.00 0.00 175.76 173.92 1n4c n GLY 116 N 5.31 2.87 3.61 0.00 0.00 -1.26 -5.09 105.19 110.62 1n4c n GLY 116 Ca 0.24 -0.37 -0.44 0.00 0.00 0.00 0.00 46.02 45.45 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 2.14 -0.05 1.61 4.07 -1.20 -4.78 120.64 122.43 1n4c n GLU 117 Ca 0.00 0.68 0.04 0.00 -0.06 0.00 0.00 57.16 57.82 1n4c n GLU 117 Cb 0.00 -3.03 0.05 0.00 -0.06 0.00 0.00 31.44 28.40 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 6.82 1.25 -0.04 6.31 -2.24 -1.26 -4.64 114.28 120.47 1n4c n THR 118 Ca 0.28 -1.40 0.01 0.00 -2.27 0.00 0.00 64.05 60.67 1n4c n THR 118 Cb 0.40 0.24 -0.14 0.00 -2.10 0.00 0.00 70.33 68.73 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 -0.82 0.86 -1.73 -0.78 5.02 -1.26 -4.95 118.16 114.50 1n4c n LYS 119 Ca 0.06 -0.10 -0.42 0.00 -2.02 0.00 0.00 58.31 55.84 1n4c n LYS 119 Cb 0.44 -1.43 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 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 -2.88 2.52 -0.53 2.13 -0.11 -1.26 -4.95 118.94 113.85 1n4c s TRP 120 Ca -0.07 0.16 -0.08 0.00 1.22 0.00 0.00 56.10 57.33 1n4c s TRP 120 Cb 0.09 -4.16 0.14 0.00 -1.50 0.00 0.00 33.47 28.04 1n4c s TRP 120 CO 0.73 -4.58 0.39 0.21 -4.62 0.00 0.00 176.95 169.08 1n4c s LYS 121 N 1.98 2.55 0.18 5.86 2.20 -1.26 -5.06 119.74 126.19 1n4c s LYS 121 Ca 0.78 -1.99 -0.22 0.00 -0.36 0.00 0.00 55.97 54.18 1n4c s LYS 121 Cb -0.48 -3.90 -0.14 0.00 -1.51 0.00 0.00 37.83 31.81 1n4c s LYS 121 CO 0.34 -1.19 0.39 -2.30 -0.36 0.00 0.00 175.35 172.23 1n4c n PRO 122 N 4.51 0.00 -3.22 4.03 -0.02 -1.26 -4.88 135.00 134.16 1n4c n PRO 122 Ca -0.02 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.06 1n4c n PRO 122 Cb 0.41 -0.81 -0.07 0.00 -0.02 0.00 0.00 33.50 33.00 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 -0.87 5.07 0.01 -1.45 1.01 -1.26 -5.02 120.40 117.89 1n4c s VAL 123 Ca 0.52 0.94 -0.30 0.00 0.00 0.00 0.00 61.98 63.13 1n4c s VAL 123 Cb -0.73 -3.85 -0.07 0.00 0.00 0.00 0.00 36.38 31.73 1n4c s VAL 123 CO 0.46 0.10 1.64 -0.83 0.00 0.00 0.00 175.10 176.47 1n4c s GLY 124 N 1.43 1.58 0.62 4.51 0.00 -1.26 -4.80 107.32 109.40 1n4c s GLY 124 Ca 0.23 1.07 0.22 0.00 0.00 0.00 0.00 44.72 46.23 1n4c s GLY 124 CO 0.09 2.93 1.37 -0.33 0.00 0.00 0.00 173.10 177.16 1n4c h MET 125 N 8.85 0.00 0.00 2.90 2.86 -1.95 2.95 114.93 130.53 1n4c h MET 125 Ca -0.41 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.23 1n4c h MET 125 Cb 1.19 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.85 1n4c h MET 125 CO 0.94 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.91 1n4c n ALA 126 N -2.09 2.25 -0.27 6.32 0.00 -1.26 -3.45 120.51 122.01 1n4c n ALA 126 Ca 0.15 -0.05 -0.13 0.00 0.00 0.00 0.00 53.44 53.40 1n4c n ALA 126 Cb 1.22 -1.46 0.09 0.00 0.00 0.00 0.00 19.45 19.31 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 -1.90 3.78 -2.50 0.00 9.92 0.98 -4.03 116.55 122.81 1n4c n ASP 127 Ca 0.06 -2.89 -0.01 0.00 -0.53 0.00 0.00 54.79 51.42 1n4c n ASP 127 Cb 0.37 -0.72 0.07 0.00 -0.64 0.00 0.00 41.12 40.20 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 -0.30 -0.07 -0.06 0.64 -0.00 -1.22 -4.59 117.00 111.39 1n4c n LEU 128 Ca 0.32 -2.95 0.15 0.00 -0.00 0.00 0.00 56.01 53.53 1n4c n LEU 128 Cb 1.06 0.23 0.72 0.00 -0.00 0.00 0.00 43.42 45.43 1n4c n LEU 128 CO 0.33 1.34 0.97 1.33 -0.00 0.00 0.00 177.39 181.37 1n4c n VAL 129 N -0.90 0.00 -3.88 1.47 0.24 -1.26 -4.81 118.33 109.19 1n4c n VAL 129 Ca -0.07 -0.03 -0.11 0.00 -2.04 0.00 0.00 64.34 62.08 1n4c n VAL 129 Cb 0.85 -0.30 -0.12 0.00 -1.47 0.00 0.00 33.84 32.80 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 -2.42 0.04 0.37 3.34 -4.23 -1.26 -4.94 115.64 106.54 1n4c s THR 130 Ca 0.32 -0.32 0.17 0.00 -1.18 0.00 0.00 61.69 60.68 1n4c s THR 130 Cb 0.20 -0.18 0.36 0.00 1.34 0.00 0.00 72.50 74.23 1n4c s THR 130 CO 0.45 -0.17 1.71 -0.65 -0.54 0.00 0.00 174.62 175.41 1n4c h PRO 131 N 5.46 0.37 -0.38 3.99 0.11 -1.96 0.64 132.00 140.22 1n4c h PRO 131 Ca -0.27 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.86 1n4c h PRO 131 Cb 1.20 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 1n4c h PRO 131 CO 0.45 0.24 0.16 1.49 -0.21 0.00 0.00 178.00 180.13 1n4c h GLU 132 N 0.38 0.32 -0.31 1.05 4.81 -1.97 1.45 114.58 120.30 1n4c h GLU 132 Ca 0.68 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.85 1n4c h GLU 132 Cb 1.64 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.93 1n4c h GLU 132 CO -0.46 0.21 -0.01 1.96 -0.73 0.00 0.00 179.01 179.98 1n4c h GLN 133 N 0.33 0.49 0.02 1.92 4.20 -1.20 -0.92 115.11 119.95 1n4c h GLN 133 Ca 0.17 -0.10 -0.04 0.00 0.06 0.00 0.00 58.65 58.74 1n4c h GLN 133 Cb 0.12 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1n4c h GLN 133 CO -0.15 0.53 -0.18 0.28 -0.67 0.00 0.00 178.83 178.63 1n4c h VAL 134 N 0.47 1.68 -0.42 -0.54 2.07 -0.69 -3.17 116.25 115.65 1n4c h VAL 134 Ca 0.10 -2.22 -0.02 0.00 0.82 0.00 0.00 66.70 65.38 1n4c h VAL 134 Cb 0.33 3.16 -0.02 0.00 -1.52 0.00 0.00 31.29 33.24 1n4c h VAL 134 CO 0.01 0.59 0.19 0.50 0.02 0.00 0.00 177.57 178.89 1n4c h LYS 135 N -0.77 0.59 -0.36 1.57 3.64 0.20 -0.55 116.57 120.89 1n4c h LYS 135 Ca -0.03 -0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 59.18 1n4c h LYS 135 Cb 1.07 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.76 1n4c h LYS 135 CO 0.03 0.47 -0.20 -0.22 -2.27 0.00 0.00 179.45 177.26 1n4c h LYS 136 N 0.59 0.68 0.08 1.90 3.64 -1.26 -3.08 116.57 119.12 1n4c h LYS 136 Ca 0.15 -0.26 -0.26 0.00 -1.27 0.00 0.00 60.65 59.01 1n4c h LYS 136 Cb 0.08 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1n4c h LYS 136 CO -0.02 0.84 -1.22 0.28 -2.27 0.00 0.00 179.45 177.05 1n4c h VAL 137 N 0.61 1.50 -0.62 2.00 2.07 -1.39 -3.20 116.25 117.22 1n4c h VAL 137 Ca 0.09 -3.13 0.18 0.00 0.82 0.00 0.00 66.70 64.66 1n4c h VAL 137 Cb 0.67 2.87 -0.02 0.00 -1.52 0.00 0.00 31.29 33.29 1n4c h VAL 137 CO 0.05 0.89 0.60 0.22 0.02 0.00 0.00 177.57 179.35 1n4c h TYR 138 N 0.05 0.00 -0.02 1.57 3.20 -1.03 0.12 116.97 120.86 1n4c h TYR 138 Ca -0.12 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.74 1n4c h TYR 138 Cb 1.92 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 40.19 1n4c h TYR 138 CO 0.04 0.00 -0.03 -0.09 -1.64 0.00 0.00 178.16 176.44 1n4c h ARG 139 N 0.00 0.05 -0.19 1.82 9.65 -1.59 -2.92 114.38 121.19 1n4c h ARG 139 Ca 0.29 -0.03 -0.05 0.00 -1.10 0.00 0.00 59.98 59.09 1n4c h ARG 139 Cb 1.49 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 30.07 1n4c h ARG 139 CO -0.00 0.58 -0.08 0.87 2.80 0.00 0.00 179.97 184.13 1n4c h LYS 140 N -0.48 0.40 -0.98 0.20 1.57 -0.99 -2.68 116.57 113.60 1n4c h LYS 140 Ca 0.00 -0.17 0.25 0.00 -1.87 0.00 0.00 60.65 58.86 1n4c h LYS 140 Cb 0.57 -0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.80 1n4c h LYS 140 CO 0.01 0.68 0.65 0.00 -0.57 0.00 0.00 179.45 180.22 1n4c h ALA 141 N 0.70 2.37 0.00 3.86 0.00 -1.13 1.13 119.26 126.19 1n4c h ALA 141 Ca 0.04 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1n4c h ALA 141 Cb 0.56 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1n4c h ALA 141 CO 0.03 -0.70 -0.55 0.28 0.00 0.00 0.00 179.25 178.30 1n4c h VAL 142 N 0.32 1.39 0.00 0.00 2.07 -1.28 -2.71 116.25 116.04 1n4c h VAL 142 Ca 0.52 -1.90 -0.09 0.00 0.82 0.00 0.00 66.70 66.05 1n4c h VAL 142 Cb 1.46 2.03 -0.01 0.00 -1.52 0.00 0.00 31.29 33.24 1n4c h VAL 142 CO -0.19 0.54 -0.43 -0.07 0.02 0.00 0.00 177.57 177.44 1n4c h LEU 143 N 0.00 0.00 -1.52 2.57 3.38 0.15 -2.19 115.31 117.70 1n4c h LEU 143 Ca -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1n4c h LEU 143 Cb 0.98 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 1n4c h LEU 143 CO 0.07 0.43 -0.17 0.58 0.09 0.00 0.00 178.44 179.45 1n4c h VAL 144 N 0.00 1.16 -0.15 1.22 2.07 -1.02 -2.94 116.25 116.59 1n4c h VAL 144 Ca -0.00 -0.72 -0.06 0.00 0.82 0.00 0.00 66.70 66.74 1n4c h VAL 144 Cb 0.81 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.84 1n4c h VAL 144 CO 0.06 0.21 -0.17 1.33 0.02 0.00 0.00 177.57 179.02 1n4c n VAL 145 N -4.29 2.26 -1.86 2.57 0.24 -1.04 -4.98 118.33 111.23 1n4c n VAL 145 Ca -0.02 -2.65 -0.42 0.00 -2.04 0.00 0.00 64.34 59.21 1n4c n VAL 145 Cb 0.26 -0.27 -0.03 0.00 -1.47 0.00 0.00 33.84 32.33 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 -3.09 2.37 0.25 6.34 5.04 -0.85 -4.84 115.29 120.51 1n4c s HIS 146 Ca 0.39 0.22 0.02 0.00 -1.54 0.00 0.00 55.06 54.16 1n4c s HIS 146 Cb 0.36 -4.03 0.63 0.00 0.04 0.00 0.00 32.58 29.58 1n4c s HIS 146 CO -0.00 -4.17 1.28 -2.30 -2.34 0.00 0.00 174.74 167.21 1n4c n PRO 147 N 5.53 -0.06 -0.32 2.88 -0.02 -1.26 -0.32 135.00 141.41 1n4c n PRO 147 Ca 0.16 1.22 0.22 0.00 -2.02 0.00 0.00 63.50 63.09 1n4c n PRO 147 Cb 0.40 -1.95 0.44 0.00 -0.02 0.00 0.00 33.50 32.37 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 0.25 -0.05 2.55 1.82 -1.98 1.26 116.42 120.26 1n4c h ASP 148 Ca 0.50 0.22 0.00 0.00 -0.39 0.00 0.00 57.03 57.36 1n4c h ASP 148 Cb 1.04 0.23 0.00 0.00 0.68 0.00 0.00 39.33 41.28 1n4c h ASP 148 CO -0.77 -0.23 0.00 0.29 -1.61 0.00 0.00 179.24 176.92 1n4c n LYS 149 N -5.19 1.67 -1.48 0.28 4.76 0.56 -3.87 118.16 114.89 1n4c n LYS 149 Ca 0.30 -0.98 -0.05 0.00 -2.87 0.00 0.00 58.31 54.71 1n4c n LYS 149 Cb 0.96 -1.46 0.10 0.00 -1.84 0.00 0.00 35.03 32.79 1n4c n LYS 149 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1n4c n ALA 150 N 0.19 3.81 -2.56 7.82 0.00 0.42 -4.86 120.51 125.33 1n4c n ALA 150 Ca 0.18 -3.27 -0.42 0.00 0.00 0.00 0.00 53.44 49.93 1n4c n ALA 150 Cb 0.34 -0.46 -0.06 0.00 0.00 0.00 0.00 19.45 19.27 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 -3.32 4.85 -0.77 0.00 2.01 -0.71 -4.07 115.64 113.64 1n4c s THR 151 Ca 0.41 0.56 0.00 0.00 0.31 0.00 0.00 61.69 62.97 1n4c s THR 151 Cb 0.38 -4.12 0.00 0.00 0.01 0.00 0.00 72.50 68.77 1n4c s THR 151 CO -0.04 -0.38 0.00 0.61 -0.69 0.00 0.00 174.62 174.12 1n4c n GLY 152 N 4.71 0.69 3.77 4.40 0.00 -1.26 -4.91 105.19 112.58 1n4c n GLY 152 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.36 4.60 0.42 1.61 -1.52 -1.26 -4.90 119.66 116.25 1n4c s GLN 153 Ca 0.00 1.19 0.36 0.00 -1.95 0.00 0.00 55.36 54.96 1n4c s GLN 153 Cb 0.00 -3.27 1.35 0.00 -0.22 0.00 0.00 33.01 30.87 1n4c s GLN 153 CO 0.00 0.56 1.28 -2.30 -0.25 0.00 0.00 175.29 174.58 1n4c n PRO 154 N 1.61 -0.01 -1.28 2.91 -0.02 -1.26 0.26 135.00 137.20 1n4c n PRO 154 Ca -0.05 0.94 -0.30 0.00 -2.02 0.00 0.00 63.50 62.07 1n4c n PRO 154 Cb 0.49 -2.04 0.13 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 -3.87 3.16 0.39 6.00 4.11 -1.26 -4.65 117.16 121.05 1n4c n TYR 155 Ca 0.35 -2.48 -0.16 0.00 -0.00 0.00 0.00 57.90 55.61 1n4c n TYR 155 Cb 1.51 -1.22 -0.07 0.00 -0.00 0.00 0.00 39.34 39.56 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 1.53 -0.98 -1.00 -3.48 4.81 0.33 -3.07 114.58 112.72 1n4c h GLU 156 Ca 0.62 0.07 0.14 0.00 -0.13 0.00 0.00 59.36 60.06 1n4c h GLU 156 Cb 1.78 0.22 -0.09 0.00 0.63 0.00 0.00 28.75 31.29 1n4c h GLU 156 CO 1.37 -0.66 0.62 0.37 -0.73 0.00 0.00 179.01 179.99 1n4c h GLN 157 N -1.26 0.88 -0.77 1.92 4.15 -1.82 -1.17 115.11 117.04 1n4c h GLN 157 Ca -0.10 -0.05 0.18 0.00 0.77 0.00 0.00 58.65 59.44 1n4c h GLN 157 Cb 0.78 -0.20 -0.13 0.00 0.21 0.00 0.00 27.48 28.14 1n4c h GLN 157 CO 0.17 0.58 0.02 1.88 -1.93 0.00 0.00 178.83 179.55 1n4c h TYR 158 N 0.90 -0.02 0.00 3.99 -1.99 -1.86 -0.87 116.97 117.12 1n4c h TYR 158 Ca 0.52 0.06 0.03 0.00 2.00 0.00 0.00 58.73 61.33 1n4c h TYR 158 Cb 0.63 0.13 -0.05 0.00 2.00 0.00 0.00 36.73 39.44 1n4c h TYR 158 CO -0.00 -0.24 -0.36 0.00 -0.00 0.00 0.00 178.16 177.56 1n4c h ALA 159 N 1.72 -0.55 -0.53 3.88 0.00 -1.16 -0.90 119.26 121.72 1n4c h ALA 159 Ca 0.42 -0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.43 1n4c h ALA 159 Cb 0.75 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 19.16 1n4c h ALA 159 CO -0.67 -0.89 0.37 -0.22 0.00 0.00 0.00 179.25 177.84 1n4c h LYS 160 N -0.52 0.17 0.15 0.00 3.64 -1.24 1.73 116.57 120.50 1n4c h LYS 160 Ca 0.06 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1n4c h LYS 160 Cb 0.60 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1n4c h LYS 160 CO -0.29 0.11 -0.07 0.52 -2.27 0.00 0.00 179.45 177.45 1n4c h MET 161 N 0.18 -0.19 0.00 1.90 2.86 -0.65 -3.07 114.93 115.96 1n4c h MET 161 Ca 0.25 0.01 -0.14 0.00 -2.06 0.00 0.00 59.70 57.76 1n4c h MET 161 Cb 0.75 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.43 1n4c h MET 161 CO -0.04 0.25 -0.68 -0.84 1.06 0.00 0.00 176.91 176.66 1n4c h ILE 162 N -0.86 1.19 -0.57 -1.22 3.07 -0.92 -2.95 117.51 115.25 1n4c h ILE 162 Ca -0.02 -2.62 -0.07 0.00 1.55 0.00 0.00 64.86 63.71 1n4c h ILE 162 Cb 0.53 2.54 -0.02 0.00 -0.27 0.00 0.00 36.82 39.60 1n4c h ILE 162 CO 0.03 0.66 0.08 0.15 -1.05 0.00 0.00 178.15 178.03 1n4c h PHE 163 N 0.00 0.96 0.11 0.16 3.04 0.25 -2.13 116.94 119.33 1n4c h PHE 163 Ca -0.01 -0.12 -0.16 0.00 3.98 0.00 0.00 57.97 61.67 1n4c h PHE 163 Cb 1.49 -0.27 0.02 0.00 2.56 0.00 0.00 35.95 39.75 1n4c h PHE 163 CO 0.00 0.83 -0.68 0.52 -2.02 0.00 0.00 178.31 176.96 1n4c h MET 164 N 0.86 0.26 -0.77 1.11 2.86 -1.59 -3.13 114.93 114.53 1n4c h MET 164 Ca 0.18 -0.43 0.12 0.00 -2.06 0.00 0.00 59.70 57.50 1n4c h MET 164 Cb 0.39 0.16 -0.05 0.00 0.06 0.00 0.00 31.60 32.16 1n4c h MET 164 CO 0.01 1.20 0.51 0.93 1.06 0.00 0.00 176.91 180.62 1n4c h GLU 165 N -0.46 0.58 -0.12 1.72 3.07 -1.49 1.45 114.58 119.33 1n4c h GLU 165 Ca -0.12 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 58.67 1n4c h GLU 165 Cb 1.53 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 29.31 1n4c h GLU 165 CO 0.13 0.38 -0.06 -0.07 -1.40 0.00 0.00 179.01 178.00 1n4c h LEU 166 N 0.60 0.27 -0.04 1.33 -0.00 -1.45 -3.00 115.31 113.01 1n4c h LEU 166 Ca 0.37 -0.41 0.00 0.00 -0.00 0.00 0.00 57.88 57.84 1n4c h LEU 166 Cb 0.61 -0.07 0.00 0.00 -0.00 0.00 0.00 40.66 41.20 1n4c h LEU 166 CO -0.14 0.62 -0.26 -3.20 -0.00 0.00 0.00 178.44 175.46 1n4c n ASN 167 N -4.69 0.32 -0.03 -0.43 2.85 -0.65 -3.28 115.26 109.34 1n4c n ASN 167 Ca -0.06 -0.01 -0.03 0.00 -0.11 0.00 0.00 54.58 54.37 1n4c n ASN 167 Cb 0.28 -0.08 -0.03 0.00 1.24 0.00 0.00 39.78 41.20 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 0.09 -0.05 0.38 1.20 3.58 0.20 -3.29 116.42 118.54 1n4c h ASP 168 Ca 0.00 -0.16 -0.05 0.00 0.42 0.00 0.00 57.03 57.24 1n4c h ASP 168 Cb 0.48 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.54 1n4c h ASP 168 CO 0.00 0.52 -0.24 0.00 -2.88 0.00 0.00 179.24 176.64 1n4c h ALA 169 N -0.84 1.38 -0.79 -0.78 0.00 -1.69 -2.69 119.26 113.84 1n4c h ALA 169 Ca -0.01 -0.22 0.12 0.00 0.00 0.00 0.00 54.91 54.81 1n4c h ALA 169 Cb 0.20 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.87 1n4c h ALA 169 CO 0.01 0.30 0.40 2.35 0.00 0.00 0.00 179.25 182.31 1n4c h TRP 170 N 0.00 0.71 -0.34 0.00 2.91 -1.65 2.31 115.95 119.89 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 0.50 -0.20 -0.02 0.00 -0.51 0.00 0.00 29.16 28.93 1n4c h TRP 170 CO 0.00 0.21 0.09 0.77 -1.03 0.00 0.00 178.44 178.48 1n4c h SER 171 N 0.63 0.45 0.73 2.65 0.02 -1.54 -1.96 113.55 114.52 1n4c h SER 171 Ca 0.41 -0.06 -0.26 0.00 -0.84 0.00 0.00 61.79 61.05 1n4c h SER 171 Cb 0.51 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.93 1n4c h SER 171 CO -0.32 0.45 -1.23 -0.08 -1.14 0.00 0.00 176.83 174.51 1n4c h GLU 172 N 0.49 0.15 -0.84 3.45 4.81 -0.15 -3.17 114.58 119.33 1n4c h GLU 172 Ca 0.12 -0.26 0.15 0.00 -0.13 0.00 0.00 59.36 59.24 1n4c h GLU 172 Cb 0.18 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 29.59 1n4c h GLU 172 CO -0.01 1.08 0.55 0.35 -0.73 0.00 0.00 179.01 180.25 1n4c h PHE 173 N 0.04 0.67 -0.02 0.92 3.57 0.44 2.37 116.94 124.92 1n4c h PHE 173 Ca -0.12 0.02 -0.24 0.00 3.53 0.00 0.00 57.97 61.16 1n4c h PHE 173 Cb 1.91 -0.21 0.02 0.00 2.79 0.00 0.00 35.95 40.46 1n4c h PHE 173 CO 0.04 0.25 -0.94 0.93 -2.23 0.00 0.00 178.31 176.36 1n4c h GLU 174 N 0.56 0.68 0.15 1.11 5.08 -1.52 -2.25 114.58 118.39 1n4c h GLU 174 Ca 0.42 -0.70 -0.22 0.00 -1.00 0.00 0.00 59.36 57.86 1n4c h GLU 174 Cb 0.80 0.19 0.02 0.00 0.50 0.00 0.00 28.75 30.26 1n4c h GLU 174 CO -0.17 1.29 -1.00 -0.97 -1.00 0.00 0.00 179.01 177.16 1n4c h ASN 175 N 0.34 0.49 0.41 1.42 -0.73 -1.07 -1.51 115.58 114.93 1n4c h ASN 175 Ca -0.11 -0.93 -0.04 0.00 1.87 0.00 0.00 56.30 57.09 1n4c h ASN 175 Cb 1.59 -0.16 -0.01 0.00 0.27 0.00 0.00 38.32 40.02 1n4c h ASN 175 CO 0.19 1.47 -0.20 -0.61 -0.37 0.00 0.00 177.43 177.91 1n4c h GLN 176 N -0.31 0.00 -1.00 6.67 -0.00 0.38 -3.36 115.11 117.50 1n4c h GLN 176 Ca -0.19 0.00 -0.34 0.00 -0.00 0.00 0.00 58.65 58.12 1n4c h GLN 176 Cb 1.72 0.00 -0.24 0.00 0.00 0.00 0.00 27.48 28.96 1n4c h GLN 176 CO 0.15 0.20 -0.71 0.41 0.00 0.00 0.00 178.83 178.87 1n4c n GLY 177 N -0.58 0.91 1.64 2.39 0.00 -0.85 -4.98 105.19 103.72 1n4c n GLY 177 Ca -0.02 -0.42 -0.04 0.00 0.00 0.00 0.00 46.02 45.54 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 1.97 1.27 -3.77 1.61 0.00 -0.57 -4.60 117.38 113.29 1n4c n GLN 178 Ca 0.16 -0.40 -0.00 0.00 -0.00 0.00 0.00 57.00 56.77 1n4c n GLN 178 Cb 0.57 -1.24 0.00 0.00 0.00 0.00 0.00 30.24 29.58 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 -0.18 0.72 0.04 3.69 1.02 -1.26 -5.09 119.74 118.68 1n4c s LYS 179 Ca 0.14 -0.43 -0.30 0.00 0.02 0.00 0.00 55.97 55.40 1n4c s LYS 179 Cb 0.08 0.22 -0.09 0.00 -0.52 0.00 0.00 37.83 37.53 1n4c s LYS 179 CO -0.01 -0.33 1.93 -2.14 -0.92 0.00 0.00 175.35 173.88 1n4c s PRO 180 N -2.45 4.14 -0.88 -1.68 0.02 -1.26 -4.92 135.00 127.96 1n4c s PRO 180 Ca 0.18 2.59 0.00 0.00 0.02 0.00 0.00 61.00 63.80 1n4c s PRO 180 Cb 0.01 -4.07 0.30 0.00 0.02 0.00 0.00 34.50 30.76 1n4c s PRO 180 CO -0.00 -0.93 1.29 -0.11 -0.33 0.00 0.00 177.00 176.92 1n4c n LEU 181 N 7.25 5.67 0.00 -5.54 0.00 -1.26 -5.17 117.00 117.95 1n4c n LEU 181 Ca 0.19 -5.38 0.00 0.00 0.00 0.00 0.00 56.01 50.82 1n4c n LEU 181 Cb 0.41 -0.99 0.00 0.00 0.00 0.00 0.00 43.42 42.83 1n4c n LEU 181 CO 0.67 1.96 0.00 -1.22 0.00 0.00 0.00 177.39 178.80