#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n4c h PRO 2 N 0.00 0.00 0.00 1.61 0.13 -2.07 -3.12 132.00 128.55 1n4c h PRO 2 Ca 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 1n4c h PRO 2 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 1n4c h PRO 2 CO 0.00 0.72 -0.14 -0.07 -0.23 0.00 0.00 178.00 178.28 1n4c h LEU 3 N 0.00 0.00 0.00 1.56 3.38 -2.09 -3.49 115.31 114.67 1n4c h LEU 3 Ca -0.01 0.00 0.32 0.00 0.09 0.00 0.00 57.88 58.28 1n4c h LEU 3 Cb 1.33 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 42.00 1n4c h LEU 3 CO 0.09 0.14 -0.42 0.61 0.09 0.00 0.00 178.44 178.95 1n4c n GLY 4 N -0.02 -1.75 0.17 0.83 0.00 -1.18 -4.26 105.19 98.98 1n4c n GLY 4 Ca -0.00 -1.13 -0.16 0.00 0.00 0.00 0.00 46.02 44.73 1n4c n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1n4c h SER 5 N -1.09 0.66 -2.81 1.61 0.02 -1.94 -3.46 113.55 106.55 1n4c h SER 5 Ca 0.02 -0.53 -0.45 0.00 -0.84 0.00 0.00 61.79 60.00 1n4c h SER 5 Cb 1.07 -0.20 0.23 0.00 0.14 0.00 0.00 62.40 63.64 1n4c h SER 5 CO 0.01 1.32 -0.52 -2.65 -1.14 0.00 0.00 176.83 173.85 1n4c n PRO 6 N -3.79 -2.05 -3.64 3.45 -0.02 -1.26 -5.06 135.00 122.64 1n4c n PRO 6 Ca -0.08 -0.57 -0.10 0.00 -2.02 0.00 0.00 63.50 60.73 1n4c n PRO 6 Cb 0.85 -1.95 -0.07 0.00 -0.02 0.00 0.00 33.50 32.31 1n4c n PRO 6 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1n4c s GLU 7 N -3.94 0.64 0.00 -0.52 -1.05 -1.26 -5.01 118.70 107.56 1n4c s GLU 7 Ca 0.63 0.86 0.00 0.00 -0.15 0.00 0.00 54.97 56.30 1n4c s GLU 7 Cb -0.19 0.26 0.00 0.00 -0.44 0.00 0.00 34.13 33.76 1n4c s GLU 7 CO 0.66 -0.09 0.90 1.19 0.95 0.00 0.00 175.26 178.87 1n4c n PHE 8 N 2.96 0.00 0.00 4.83 3.01 -1.26 -4.46 117.46 122.54 1n4c n PHE 8 Ca -0.15 -0.45 0.00 0.00 1.01 0.00 0.00 57.45 57.86 1n4c n PHE 8 Cb 0.56 -0.25 0.00 0.00 -0.01 0.00 0.00 39.48 39.79 1n4c n PHE 8 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1n4c n SER 9 N 0.69 0.00 -4.50 4.37 2.88 -1.26 -4.74 113.62 111.07 1n4c n SER 9 Ca 0.00 0.13 -0.36 0.00 -1.33 0.00 0.00 58.87 57.31 1n4c n SER 9 Cb 0.41 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 63.94 1n4c n SER 9 CO 0.00 0.00 0.00 1.15 -1.23 0.00 0.00 175.04 174.96 1n4c n MET 10 N -0.16 0.40 0.00 -1.46 -0.00 -1.26 -4.81 117.12 109.82 1n4c n MET 10 Ca 0.00 0.18 0.10 0.00 -0.00 0.00 0.00 57.70 57.98 1n4c n MET 10 Cb 0.00 -1.90 0.59 0.00 -0.00 0.00 0.00 33.22 31.92 1n4c n MET 10 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1n4c n PRO 11 N -0.85 0.60 -2.36 3.17 -0.04 -1.26 -4.68 135.00 129.59 1n4c n PRO 11 Ca 0.11 0.01 -0.41 0.00 -0.04 0.00 0.00 63.50 63.17 1n4c n PRO 11 Cb 0.49 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.43 1n4c n PRO 11 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1n4c s HIS 12 N -2.06 2.17 0.20 0.54 2.46 -1.26 -4.95 115.29 112.39 1n4c s HIS 12 Ca 0.29 0.41 -0.32 0.00 0.47 0.00 0.00 55.06 55.91 1n4c s HIS 12 Cb 0.14 -4.39 -0.14 0.00 -0.13 0.00 0.00 32.58 28.05 1n4c s HIS 12 CO 0.24 -2.07 1.32 -1.13 -2.47 0.00 0.00 174.74 170.62 1n4c n SER 13 N 10.09 2.16 -4.75 9.88 3.41 -1.26 -4.91 113.62 128.24 1n4c n SER 13 Ca 0.12 1.14 -0.33 0.00 -0.26 0.00 0.00 58.87 59.54 1n4c n SER 13 Cb 0.50 -1.33 0.08 0.00 -0.26 0.00 0.00 64.21 63.19 1n4c n SER 13 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1n4c s SER 14 N 0.21 4.58 1.15 4.04 0.15 -1.26 -5.02 113.70 117.55 1n4c s SER 14 Ca 0.71 2.05 -0.16 0.00 0.70 0.00 0.00 55.95 59.26 1n4c s SER 14 Cb -0.74 -2.55 0.23 0.00 -1.71 0.00 0.00 66.02 61.24 1n4c s SER 14 CO 0.50 -1.99 0.91 -0.81 1.20 0.00 0.00 173.24 173.05 1n4c n PRO 15 N -2.91 -2.33 -0.66 5.44 -0.04 -1.26 -4.99 135.00 128.26 1n4c n PRO 15 Ca 0.11 -1.44 -0.32 0.00 -0.04 0.00 0.00 63.50 61.81 1n4c n PRO 15 Cb 0.52 -1.25 0.18 0.00 -0.04 0.00 0.00 33.50 32.91 1n4c n PRO 15 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1n4c n GLN 16 N -3.94 -1.62 -3.82 0.54 10.64 -1.26 -5.02 117.38 112.90 1n4c n GLN 16 Ca 0.12 -0.45 -0.02 0.00 -1.83 0.00 0.00 57.00 54.82 1n4c n GLN 16 Cb 0.46 -1.78 0.02 0.00 -0.86 0.00 0.00 30.24 28.09 1n4c n GLN 16 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.06 175.50 1n4c n ASN 17 N -2.09 -1.60 -4.74 2.61 0.23 -1.26 -5.09 115.26 103.32 1n4c n ASN 17 Ca 0.01 -1.77 -0.35 0.00 -0.53 0.00 0.00 54.58 51.94 1n4c n ASN 17 Cb 0.61 2.58 0.06 0.00 -2.08 0.00 0.00 39.78 40.95 1n4c n ASN 17 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1n4c s ARG 18 N -2.04 2.60 -0.99 -3.83 0.52 -1.26 -4.74 118.95 109.22 1n4c s ARG 18 Ca 0.23 1.81 -0.20 0.00 -0.52 0.00 0.00 55.73 57.05 1n4c s ARG 18 Cb -0.02 -1.88 -0.10 0.00 0.52 0.00 0.00 34.95 33.46 1n4c s ARG 18 CO 0.04 -1.49 1.98 -0.35 0.02 0.00 0.00 175.30 175.50 1n4c n PRO 19 N -2.09 1.87 -0.01 3.54 -0.04 -1.26 -4.69 135.00 132.32 1n4c n PRO 19 Ca 0.14 -2.15 -0.00 0.00 -0.04 0.00 0.00 63.50 61.44 1n4c n PRO 19 Cb 0.50 -3.13 -0.00 0.00 -0.04 0.00 0.00 33.50 30.83 1n4c n PRO 19 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 1n4c h ASN 20 N 7.75 -0.02 0.00 3.54 -0.00 -1.98 -3.47 115.58 121.40 1n4c h ASN 20 Ca 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.73 1n4c h ASN 20 Cb 0.71 0.01 0.00 0.00 -0.00 0.00 0.00 38.32 39.04 1n4c h ASN 20 CO 1.82 0.20 0.00 -1.22 -0.00 0.00 0.00 177.43 178.23 1n4c n TYR 21 N -3.25 -0.04 0.00 0.67 4.01 -1.26 -5.03 117.16 112.26 1n4c n TYR 21 Ca -0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1n4c n TYR 21 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 1n4c n TYR 21 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1n4c n ASN 22 N 0.00 0.00 -4.29 7.72 6.94 -1.26 -4.95 115.26 119.42 1n4c n ASN 22 Ca 0.00 0.00 -0.34 0.00 -0.02 0.00 0.00 54.58 54.22 1n4c n ASN 22 Cb 0.00 0.00 0.12 0.00 -2.36 0.00 0.00 39.78 37.54 1n4c n ASN 22 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 1n4c n VAL 23 N -0.30 0.00 -3.67 3.53 0.24 -1.26 -4.98 118.33 111.88 1n4c n VAL 23 Ca 0.00 -0.25 -0.03 0.00 -2.04 0.00 0.00 64.34 62.02 1n4c n VAL 23 Cb 0.00 -0.50 0.02 0.00 -1.47 0.00 0.00 33.84 31.89 1n4c n VAL 23 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1n4c n SER 24 N -0.53 -1.21 -0.85 -1.34 7.64 -1.26 -4.99 113.62 111.09 1n4c n SER 24 Ca 0.03 -1.70 0.00 0.00 1.01 0.00 0.00 58.87 58.21 1n4c n SER 24 Cb 0.58 1.98 0.00 0.00 -1.01 0.00 0.00 64.21 65.77 1n4c n SER 24 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1n4c n PHE 25 N -0.43 0.00 -1.68 1.43 3.01 -1.26 -4.88 117.46 113.65 1n4c n PHE 25 Ca -0.03 -0.29 -0.38 0.00 1.01 0.00 0.00 57.45 57.76 1n4c n PHE 25 Cb 0.38 -0.18 0.05 0.00 -0.01 0.00 0.00 39.48 39.72 1n4c n PHE 25 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1n4c n SER 26 N 0.42 1.64 -0.85 4.37 3.41 -1.26 -4.81 113.62 116.54 1n4c n SER 26 Ca 0.00 0.86 0.00 0.00 -0.26 0.00 0.00 58.87 59.47 1n4c n SER 26 Cb 0.36 -1.48 0.00 0.00 -0.26 0.00 0.00 64.21 62.82 1n4c n SER 26 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1n4c n SER 27 N -1.10 2.23 -2.71 4.04 2.88 -1.26 -3.97 113.62 113.73 1n4c n SER 27 Ca 0.13 -1.86 -0.06 0.00 -1.33 0.00 0.00 58.87 55.76 1n4c n SER 27 Cb 0.46 -0.46 0.07 0.00 -0.75 0.00 0.00 64.21 63.53 1n4c n SER 27 CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 175.04 174.61 1n4c n MET 28 N 0.39 0.47 -1.27 -1.46 0.00 -1.26 -5.15 117.12 108.83 1n4c n MET 28 Ca 0.00 -1.22 -0.37 0.00 -0.00 0.00 0.00 57.70 56.10 1n4c n MET 28 Cb 0.40 -0.81 0.04 0.00 0.00 0.00 0.00 33.22 32.84 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 1.43 0.22 0.00 2.12 -0.02 -1.25 -4.90 135.00 132.60 1n4c n PRO 29 Ca 0.05 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1n4c n PRO 29 Cb 0.68 -1.45 0.00 0.00 -0.02 0.00 0.00 33.50 32.70 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 2.15 -0.40 1.45 -1.23 0.00 -1.26 -5.16 105.19 100.75 1n4c n GLY 30 Ca 0.08 0.38 0.18 0.00 0.00 0.00 0.00 46.02 46.66 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 0.00 -3.10 1.11 -0.02 0.00 -1.26 -4.93 105.19 96.99 1n4c n GLY 31 Ca 0.00 -1.01 -0.05 0.00 0.00 0.00 0.00 46.02 44.96 1n4c n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n4c n GLN 32 N -4.34 0.16 -1.51 1.61 10.64 -1.26 -5.10 117.38 117.58 1n4c n GLN 32 Ca -0.08 -0.76 -0.00 0.00 -1.83 0.00 0.00 57.00 54.33 1n4c n GLN 32 Cb 0.69 0.47 0.00 0.00 -0.86 0.00 0.00 30.24 30.54 1n4c n GLN 32 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 1n4c n ASN 33 N -0.19 -0.18 -3.53 2.61 4.05 -1.26 -5.18 115.26 111.58 1n4c n ASN 33 Ca -0.19 -1.11 -0.17 0.00 0.45 0.00 0.00 54.58 53.56 1n4c n ASN 33 Cb 0.61 0.29 -0.06 0.00 1.23 0.00 0.00 39.78 41.86 1n4c n ASN 33 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 177.26 172.38 1n4c s GLU 34 N -2.01 1.01 0.31 1.20 -1.05 -1.26 -4.96 118.70 111.95 1n4c s GLU 34 Ca 0.02 0.25 -0.27 0.00 -0.15 0.00 0.00 54.97 54.81 1n4c s GLU 34 Cb -0.00 0.48 -0.14 0.00 -0.44 0.00 0.00 34.13 34.03 1n4c s GLU 34 CO 0.01 -0.32 1.00 -2.13 0.95 0.00 0.00 175.26 174.77 1n4c n ARG 35 N 0.89 1.34 -2.71 -4.83 0.63 -1.26 -4.92 116.66 105.79 1n4c n ARG 35 Ca -0.18 0.47 -0.06 0.00 -0.92 0.00 0.00 57.85 57.15 1n4c n ARG 35 Cb 0.57 -1.86 0.07 0.00 0.45 0.00 0.00 32.46 31.70 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 1.23 -0.67 0.46 5.14 0.00 -1.26 -4.98 105.19 105.10 1n4c n GLY 36 Ca 0.09 0.50 0.27 0.00 0.00 0.00 0.00 46.02 46.88 1n4c n GLY 36 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1n4c h LYS 37 N 3.34 0.00 -5.07 1.61 3.64 -2.09 -3.21 116.57 114.78 1n4c h LYS 37 Ca -0.19 0.00 -0.59 0.00 -1.27 0.00 0.00 60.65 58.60 1n4c h LYS 37 Cb 1.12 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.91 1n4c h LYS 37 CO 0.09 0.00 2.13 0.00 -2.27 0.00 0.00 179.45 179.40 1n4c n ALA 38 N -2.57 3.48 -2.71 5.00 0.00 -1.26 -4.51 120.51 117.94 1n4c n ALA 38 Ca 0.16 -3.53 -0.06 0.00 0.00 0.00 0.00 53.44 50.01 1n4c n ALA 38 Cb 0.94 -3.57 0.05 0.00 0.00 0.00 0.00 19.45 16.87 1n4c n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n4c n ALA 39 N 9.29 -2.53 -0.86 0.00 0.00 -1.22 -4.97 120.51 120.23 1n4c n ALA 39 Ca 0.49 -0.80 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1n4c n ALA 39 Cb 0.43 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.61 1n4c n ALA 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n4c n ALA 40 N 1.83 0.00 -2.65 0.00 0.00 -1.26 -5.11 120.51 113.33 1n4c n ALA 40 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.09 1n4c n ALA 40 Cb 0.65 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.08 1n4c n ALA 40 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1n4c s ASN 41 N 0.00 7.23 1.18 0.00 0.02 -1.26 -5.03 114.94 117.08 1n4c s ASN 41 Ca 0.00 1.61 -0.18 0.00 -1.02 0.00 0.00 52.86 53.27 1n4c s ASN 41 Cb 0.00 -2.56 0.28 0.00 0.02 0.00 0.00 41.25 38.99 1n4c s ASN 41 CO 0.00 -0.44 1.11 -0.76 0.02 0.00 0.00 177.10 177.03 1n4c s LEU 42 N 1.85 0.79 0.00 0.60 1.43 -1.26 -5.01 118.68 117.07 1n4c s LEU 42 Ca 0.50 0.69 0.00 0.00 -1.03 0.00 0.00 54.13 54.30 1n4c s LEU 42 Cb -0.20 -2.48 0.00 0.00 0.03 0.00 0.00 46.19 43.54 1n4c s LEU 42 CO 0.21 -4.02 0.00 -0.62 0.23 0.00 0.00 176.35 172.14 1n4c n GLU 43 N -4.70 0.00 0.00 1.70 -0.58 -1.26 -4.45 120.64 111.34 1n4c n GLU 43 Ca 0.12 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.86 1n4c n GLU 43 Cb 0.59 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.46 1n4c n GLU 43 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1n4c n GLY 44 N 0.00 0.24 3.56 0.62 0.00 -1.26 -4.46 105.19 103.89 1n4c n GLY 44 Ca 0.00 0.56 -0.15 0.00 0.00 0.00 0.00 46.02 46.43 1n4c n GLY 44 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n4c s LYS 45 N 0.00 0.90 0.00 1.61 -2.85 -1.26 -5.04 119.74 113.10 1n4c s LYS 45 Ca 0.00 0.39 0.00 0.00 -1.00 0.00 0.00 55.97 55.36 1n4c s LYS 45 Cb 0.00 0.43 0.00 0.00 -2.06 0.00 0.00 37.83 36.20 1n4c s LYS 45 CO 0.00 -0.24 0.00 0.00 0.10 0.00 0.00 175.35 175.21 1n4c n GLN 46 N 1.28 0.00 -2.10 1.78 10.64 -1.26 -4.99 117.38 122.73 1n4c n GLN 46 Ca -0.16 0.00 -0.40 0.00 -1.83 0.00 0.00 57.00 54.61 1n4c n GLN 46 Cb 0.57 0.00 -0.03 0.00 -0.86 0.00 0.00 30.24 29.92 1n4c n GLN 46 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 1n4c s LYS 47 N -0.26 2.86 0.00 2.61 1.02 -1.26 -4.11 119.74 120.60 1n4c s LYS 47 Ca 0.00 0.70 0.00 0.00 0.02 0.00 0.00 55.97 56.69 1n4c s LYS 47 Cb 0.00 -4.31 0.00 0.00 -0.52 0.00 0.00 37.83 33.00 1n4c s LYS 47 CO 0.00 -2.45 0.00 0.00 -0.92 0.00 0.00 175.35 171.98 1n4c n ALA 48 N 11.79 0.00 0.08 5.17 0.00 -1.26 -4.91 120.51 131.38 1n4c n ALA 48 Ca 0.19 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.66 1n4c n ALA 48 Cb 0.51 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.10 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 -0.08 0.51 -0.29 0.00 0.00 -1.26 -0.93 120.51 118.47 1n4c n ALA 49 Ca 0.00 0.05 -0.11 0.00 0.00 0.00 0.00 53.44 53.38 1n4c n ALA 49 Cb 0.00 -0.58 0.05 0.00 0.00 0.00 0.00 19.45 18.92 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 -1.62 4.69 -2.69 0.00 5.75 -1.26 -4.27 116.55 117.15 1n4c n ASP 50 Ca -0.00 -2.74 -0.06 0.00 -0.01 0.00 0.00 54.79 51.98 1n4c n ASP 50 Cb 0.32 -0.84 0.07 0.00 -1.03 0.00 0.00 41.12 39.64 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 0.25 -1.44 -0.47 2.11 -0.00 -0.10 -4.98 117.46 112.83 1n4c n PHE 51 Ca 0.22 -1.07 0.00 0.00 -0.00 0.00 0.00 57.45 56.61 1n4c n PHE 51 Cb 0.75 1.26 0.00 0.00 -0.00 0.00 0.00 39.48 41.49 1n4c n PHE 51 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85 1n4c n GLU 52 N 1.44 0.00 -2.72 -4.13 2.13 -1.26 -5.02 120.64 111.08 1n4c n GLU 52 Ca 0.03 0.00 -0.08 0.00 0.66 0.00 0.00 57.16 57.78 1n4c n GLU 52 Cb 0.69 0.00 0.09 0.00 0.27 0.00 0.00 31.44 32.49 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 -2.11 -4.22 4.31 2.03 -1.26 -5.15 116.55 110.15 1n4c n ASP 53 Ca 0.00 -3.23 -0.34 0.00 0.52 0.00 0.00 54.79 51.73 1n4c n ASP 53 Cb 0.00 1.73 0.12 0.00 -0.72 0.00 0.00 41.12 42.26 1n4c n ASP 53 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1n4c n LEU 54 N 0.49 -2.39 -4.50 -2.67 7.94 -1.26 -4.32 117.00 110.29 1n4c n LEU 54 Ca 0.03 0.02 -0.23 0.00 -1.11 0.00 0.00 56.01 54.72 1n4c n LEU 54 Cb 0.71 -0.90 -0.22 0.00 0.53 0.00 0.00 43.42 43.55 1n4c n LEU 54 CO 0.00 -3.35 2.08 -0.11 -1.11 0.00 0.00 177.39 174.90 1n4c n LEU 55 N -0.08 -1.23 -4.12 -1.96 7.94 -1.26 -4.60 117.00 111.69 1n4c n LEU 55 Ca 0.01 -0.52 -0.32 0.00 -1.11 0.00 0.00 56.01 54.07 1n4c n LEU 55 Cb 0.63 -0.60 -0.16 0.00 0.53 0.00 0.00 43.42 43.82 1n4c n LEU 55 CO 0.50 -1.41 2.00 -0.24 -1.11 0.00 0.00 177.39 177.13 1n4c n SER 56 N 6.32 -0.25 -0.65 1.96 2.88 -1.26 -2.51 113.62 120.11 1n4c n SER 56 Ca 0.67 -0.05 0.00 0.00 -1.33 0.00 0.00 58.87 58.16 1n4c n SER 56 Cb 0.14 -0.73 0.00 0.00 -0.75 0.00 0.00 64.21 62.87 1n4c n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1n4c n GLY 57 N 5.66 0.17 0.11 0.46 0.00 -1.26 -4.85 105.19 105.48 1n4c n GLY 57 Ca 0.61 -0.44 0.04 0.00 0.00 0.00 0.00 46.02 46.23 1n4c n GLY 57 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1n4c n GLN 58 N -0.28 0.05 -3.64 1.61 3.00 -1.04 -4.23 117.38 112.85 1n4c n GLN 58 Ca 0.00 0.45 -0.05 0.00 -0.01 0.00 0.00 57.00 57.39 1n4c n GLN 58 Cb 0.06 -2.02 -0.06 0.00 0.00 0.00 0.00 30.24 28.22 1n4c n GLN 58 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1n4c s GLY 59 N -2.83 -0.62 0.00 1.08 0.00 -1.26 -5.00 107.32 98.69 1n4c s GLY 59 Ca -0.01 2.45 0.00 0.00 0.00 0.00 0.00 44.72 47.17 1n4c s GLY 59 CO 0.07 2.61 0.46 0.33 0.00 0.00 0.00 173.10 176.57 1n4c n PHE 60 N 4.60 0.00 -0.11 1.90 7.35 -1.26 -4.78 117.46 125.17 1n4c n PHE 60 Ca -0.18 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.51 1n4c n PHE 60 Cb 0.56 -0.03 0.00 0.00 0.35 0.00 0.00 39.48 40.36 1n4c n PHE 60 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1n4c n ASN 61 N -0.14 2.34 -3.04 -2.13 5.15 -1.26 -5.14 115.26 111.03 1n4c n ASN 61 Ca 0.00 0.00 0.05 0.00 -0.60 0.00 0.00 54.58 54.03 1n4c n ASN 61 Cb 0.08 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.33 1n4c n ASN 61 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1n4c s ALA 62 N -1.00 -4.23 -0.53 5.20 0.00 -1.26 -5.00 121.76 114.94 1n4c s ALA 62 Ca 0.00 1.35 0.00 0.00 0.00 0.00 0.00 51.96 53.31 1n4c s ALA 62 Cb 0.00 -2.90 0.00 0.00 0.00 0.00 0.00 23.12 20.22 1n4c s ALA 62 CO 0.00 -2.22 0.54 -2.39 0.00 0.00 0.00 175.76 171.69 1n4c n HIS 63 N 4.70 0.00 -2.76 0.00 1.44 -1.26 -4.69 115.22 112.65 1n4c n HIS 63 Ca 0.09 -0.17 -0.42 0.00 -2.01 0.00 0.00 57.72 55.20 1n4c n HIS 63 Cb 0.59 -0.14 -0.03 0.00 0.12 0.00 0.00 29.99 30.53 1n4c n HIS 63 CO 0.00 0.00 0.00 0.21 -2.81 0.00 0.00 176.34 173.74 1n4c s LYS 64 N -0.41 3.24 -0.14 -1.40 2.20 -1.26 -4.97 119.74 117.00 1n4c s LYS 64 Ca 0.00 -0.83 -0.38 0.00 -0.36 0.00 0.00 55.97 54.40 1n4c s LYS 64 Cb 0.00 -4.41 -0.15 0.00 -1.51 0.00 0.00 37.83 31.75 1n4c s LYS 64 CO 0.00 -1.94 1.65 -0.40 -0.36 0.00 0.00 175.35 174.31 1n4c n ASP 65 N 8.10 2.38 -4.81 1.43 5.75 -1.26 -4.91 116.55 123.22 1n4c n ASP 65 Ca 0.05 1.07 -0.38 0.00 -0.01 0.00 0.00 54.79 55.53 1n4c n ASP 65 Cb 0.47 -1.20 -0.06 0.00 -1.03 0.00 0.00 41.12 39.31 1n4c n ASP 65 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1n4c s LYS 66 N 2.70 4.21 0.27 0.11 2.20 -1.26 -5.01 119.74 122.96 1n4c s LYS 66 Ca 0.93 0.77 -0.31 0.00 -0.36 0.00 0.00 55.97 57.00 1n4c s LYS 66 Cb -0.97 -3.13 -0.12 0.00 -1.51 0.00 0.00 37.83 32.09 1n4c s LYS 66 CO 0.58 0.57 1.54 0.36 -0.36 0.00 0.00 175.35 178.03 1n4c n LYS 67 N 1.38 2.46 0.00 4.03 2.85 -1.26 -4.66 118.16 122.97 1n4c n LYS 67 Ca -0.08 0.88 0.00 0.00 -1.05 0.00 0.00 58.31 58.06 1n4c n LYS 67 Cb 0.51 -2.62 0.00 0.00 -0.65 0.00 0.00 35.03 32.26 1n4c n LYS 67 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1n4c n GLY 68 N 2.32 -1.10 3.79 2.58 0.00 -1.26 -4.95 105.19 106.58 1n4c n GLY 68 Ca 0.10 -1.62 -0.29 0.00 0.00 0.00 0.00 46.02 44.21 1n4c n GLY 68 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1n4c s PRO 69 N -1.20 1.58 -1.00 1.61 0.04 -1.26 -4.95 135.00 129.81 1n4c s PRO 69 Ca 0.00 0.47 -0.04 0.00 0.04 0.00 0.00 61.00 61.47 1n4c s PRO 69 Cb 0.00 -1.87 0.18 0.00 0.04 0.00 0.00 34.50 32.85 1n4c s PRO 69 CO 0.00 -1.93 2.29 -2.13 0.04 0.00 0.00 177.00 175.27 1n4c n ARG 70 N -3.61 4.10 -3.51 4.56 0.63 -1.26 -4.83 116.66 112.74 1n4c n ARG 70 Ca 0.07 -3.52 -0.32 0.00 -0.92 0.00 0.00 57.85 53.15 1n4c n ARG 70 Cb 0.58 -2.44 -0.05 0.00 0.45 0.00 0.00 32.46 31.00 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 -2.66 5.02 -1.17 5.15 -4.23 -1.26 -4.93 115.64 111.56 1n4c s THR 71 Ca 0.51 0.36 0.02 0.00 -1.18 0.00 0.00 61.69 61.40 1n4c s THR 71 Cb 0.26 -3.63 0.03 0.00 1.34 0.00 0.00 72.50 70.50 1n4c s THR 71 CO -0.17 0.03 0.99 -0.38 -0.54 0.00 0.00 174.62 174.54 1n4c n ILE 72 N 0.11 1.54 0.13 2.99 2.08 -1.26 -1.40 119.36 123.55 1n4c n ILE 72 Ca -0.02 0.38 0.08 0.00 0.56 0.00 0.00 62.75 63.75 1n4c n ILE 72 Cb 0.52 -1.35 0.03 0.00 -0.75 0.00 0.00 39.64 38.09 1n4c n ILE 72 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1n4c h ALA 73 N 2.08 0.69 0.00 -1.39 0.00 -1.96 -3.21 119.26 115.47 1n4c h ALA 73 Ca 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 1n4c h ALA 73 Cb 0.03 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1n4c h ALA 73 CO 0.00 0.31 -0.15 1.49 0.00 0.00 0.00 179.25 180.89 1n4c h GLU 74 N 0.00 0.00 0.00 0.00 4.57 -1.55 -3.30 114.58 114.30 1n4c h GLU 74 Ca -0.03 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.05 1n4c h GLU 74 Cb 1.19 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.77 1n4c h GLU 74 CO 0.02 0.15 -0.59 1.98 -1.18 0.00 0.00 179.01 179.39 1n4c h MET 75 N 0.00 0.00 0.00 1.92 4.05 -1.68 -3.29 114.93 115.94 1n4c h MET 75 Ca -0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1n4c h MET 75 Cb 1.06 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.86 1n4c h MET 75 CO 0.02 0.69 0.47 -2.13 0.23 0.00 0.00 176.91 176.19 1n4c n ARG 76 N -4.56 0.06 0.29 0.39 0.63 -1.21 -0.97 116.66 111.28 1n4c n ARG 76 Ca -0.17 0.51 0.11 0.00 -0.92 0.00 0.00 57.85 57.38 1n4c n ARG 76 Cb 0.46 -2.15 0.59 0.00 0.45 0.00 0.00 32.46 31.80 1n4c n ARG 76 CO 0.00 0.00 0.00 -0.22 -2.51 0.00 0.00 177.63 174.90 1n4c h LYS 77 N 0.00 0.00 -0.04 -0.14 3.64 -1.63 0.32 116.57 118.71 1n4c h LYS 77 Ca 0.00 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 59.13 1n4c h LYS 77 Cb 0.94 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.77 1n4c h LYS 77 CO 0.00 0.00 -0.95 1.49 -2.27 0.00 0.00 179.45 177.72 1n4c h GLU 78 N 0.00 0.68 -0.54 1.90 4.81 -1.34 -3.10 114.58 116.99 1n4c h GLU 78 Ca 0.00 -0.67 0.16 0.00 -0.13 0.00 0.00 59.36 58.71 1n4c h GLU 78 Cb 0.82 0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.36 1n4c h GLU 78 CO 0.00 1.27 0.79 1.49 -0.73 0.00 0.00 179.01 181.83 1n4c h GLU 79 N 0.41 0.00 -0.19 1.92 4.81 -0.60 1.09 114.58 122.02 1n4c h GLU 79 Ca -0.10 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.00 1n4c h GLU 79 Cb 1.60 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.97 1n4c h GLU 79 CO 0.19 0.00 -0.44 0.52 -0.73 0.00 0.00 179.01 178.55 1n4c h MET 80 N 0.00 0.46 -0.04 1.92 2.86 -1.66 -2.36 114.93 116.12 1n4c h MET 80 Ca 0.26 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1n4c h MET 80 Cb 1.83 0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.50 1n4c h MET 80 CO -0.00 0.81 0.00 0.00 1.06 0.00 0.00 176.91 178.78 1n4c n ALA 81 N -2.49 2.61 0.26 6.32 0.00 0.37 -3.50 120.51 124.08 1n4c n ALA 81 Ca -0.02 -0.31 0.12 0.00 0.00 0.00 0.00 53.44 53.24 1n4c n ALA 81 Cb 0.52 -1.29 0.22 0.00 0.00 0.00 0.00 19.45 18.90 1n4c n ALA 81 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1n4c h LYS 82 N 1.04 0.00 -0.17 0.00 1.63 -1.19 -3.42 116.57 114.46 1n4c h LYS 82 Ca 0.00 0.00 0.04 0.00 -0.85 0.00 0.00 60.65 59.84 1n4c h LYS 82 Cb 0.22 0.00 -0.16 0.00 -0.60 0.00 0.00 32.23 31.70 1n4c h LYS 82 CO 0.00 0.00 -0.11 -1.83 -3.45 0.00 0.00 179.45 174.06 1n4c s GLU 83 N -3.22 0.18 -1.07 1.90 -1.05 -1.23 -5.04 118.70 109.17 1n4c s GLU 83 Ca 0.07 -0.16 -0.07 0.00 -0.15 0.00 0.00 54.97 54.66 1n4c s GLU 83 Cb 0.06 -0.00 -0.04 0.00 -0.44 0.00 0.00 34.13 33.71 1n4c s GLU 83 CO 0.66 -0.22 2.88 -0.12 0.95 0.00 0.00 175.26 179.40 1n4c n MET 84 N 2.75 3.49 -1.53 -4.83 1.56 -1.24 -4.91 117.12 112.40 1n4c n MET 84 Ca 0.10 -2.40 -0.43 0.00 -0.27 0.00 0.00 57.70 54.71 1n4c n MET 84 Cb 0.65 -2.51 0.00 0.00 2.15 0.00 0.00 33.22 33.51 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 2.42 0.30 0.00 6.12 -0.08 -1.26 -4.59 116.55 119.46 1n4c n ASP 85 Ca 0.63 1.02 0.00 0.00 -1.51 0.00 0.00 54.79 54.94 1n4c n ASP 85 Cb 0.41 -1.22 0.00 0.00 2.34 0.00 0.00 41.12 42.64 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 0.49 0.00 -0.05 -0.67 -0.04 -1.26 0.13 135.00 133.60 1n4c n PRO 86 Ca 0.11 0.38 -0.06 0.00 -0.04 0.00 0.00 63.50 63.89 1n4c n PRO 86 Cb 0.37 -1.60 -0.14 0.00 -0.04 0.00 0.00 33.50 32.09 1n4c n PRO 86 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1n4c n GLU 87 N -1.38 0.66 0.12 0.54 2.13 -1.26 -4.02 120.64 117.42 1n4c n GLU 87 Ca 0.00 0.12 -0.01 0.00 0.66 0.00 0.00 57.16 57.93 1n4c n GLU 87 Cb 0.10 -1.66 0.06 0.00 0.27 0.00 0.00 31.44 30.21 1n4c n GLU 87 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1n4c h LYS 88 N 0.00 0.00 -0.68 5.31 1.63 -0.61 -3.20 116.57 119.02 1n4c h LYS 88 Ca -0.36 0.00 0.11 0.00 -0.85 0.00 0.00 60.65 59.55 1n4c h LYS 88 Cb 1.98 0.00 -0.08 0.00 -0.60 0.00 0.00 32.23 33.53 1n4c h LYS 88 CO 0.05 0.69 0.27 1.25 -3.45 0.00 0.00 179.45 178.26 1n4c h LEU 89 N 0.00 0.28 -1.23 5.20 6.46 -1.49 0.19 115.31 124.71 1n4c h LEU 89 Ca -0.01 0.09 0.26 0.00 -0.12 0.00 0.00 57.88 58.10 1n4c h LEU 89 Cb 1.37 0.06 -0.11 0.00 -0.73 0.00 0.00 40.66 41.25 1n4c h LEU 89 CO 0.09 0.14 0.65 0.50 -0.62 0.00 0.00 178.44 179.20 1n4c h LYS 90 N 0.45 0.44 0.01 1.25 1.63 -1.74 0.07 116.57 118.69 1n4c h LYS 90 Ca 0.36 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 60.13 1n4c h LYS 90 Cb 0.47 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.00 1n4c h LYS 90 CO -0.34 0.29 -0.01 0.82 -3.45 0.00 0.00 179.45 176.77 1n4c h ILE 91 N 0.45 1.17 -1.00 2.00 2.04 -0.80 -2.29 117.51 119.08 1n4c h ILE 91 Ca 0.62 -0.54 0.25 0.00 1.00 0.00 0.00 64.86 66.19 1n4c h ILE 91 Cb 1.43 1.54 -0.08 0.00 -0.74 0.00 0.00 36.82 38.97 1n4c h ILE 91 CO -0.37 0.14 0.66 -0.07 0.00 0.00 0.00 178.15 178.51 1n4c h LEU 92 N -0.25 0.39 -0.30 1.44 3.38 -0.83 0.46 115.31 119.60 1n4c h LEU 92 Ca -0.00 0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.89 1n4c h LEU 92 Cb 0.24 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1n4c h LEU 92 CO 0.00 0.10 -0.65 -0.33 0.09 0.00 0.00 178.44 177.66 1n4c h GLU 93 N 0.36 0.00 -0.06 1.13 4.39 -1.20 -2.88 114.58 116.32 1n4c h GLU 93 Ca 0.55 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 60.09 1n4c h GLU 93 Cb 1.46 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.12 1n4c h GLU 93 CO -0.23 0.65 -0.56 2.35 -1.16 0.00 0.00 179.01 180.07 1n4c h TRP 94 N 0.00 0.68 -0.22 4.33 7.01 0.43 -3.15 115.95 125.02 1n4c h TRP 94 Ca -0.01 -0.33 -0.11 0.00 2.11 0.00 0.00 58.89 60.55 1n4c h TRP 94 Cb 1.37 -0.09 -0.00 0.00 -2.10 0.00 0.00 29.16 28.33 1n4c h TRP 94 CO 0.00 1.12 -0.31 -0.84 -2.79 0.00 0.00 178.44 175.62 1n4c h ILE 95 N 0.05 1.32 0.00 2.65 3.07 -1.27 -2.88 117.51 120.46 1n4c h ILE 95 Ca -0.05 -1.51 0.00 0.00 1.55 0.00 0.00 64.86 64.85 1n4c h ILE 95 Cb 1.22 1.78 0.00 0.00 -0.27 0.00 0.00 36.82 39.56 1n4c h ILE 95 CO 0.11 0.47 0.00 -1.84 -1.05 0.00 0.00 178.15 175.84 1n4c n GLU 96 N -4.31 0.05 -0.03 0.16 -0.00 -1.09 -2.25 120.64 113.17 1n4c n GLU 96 Ca -0.05 0.30 -0.15 0.00 -0.00 0.00 0.00 57.16 57.25 1n4c n GLU 96 Cb 0.48 -1.50 -0.09 0.00 -0.00 0.00 0.00 31.44 30.33 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 1.34 0.45 -5.00 -1.84 0.00 -1.46 -3.44 103.07 93.12 1n4c h GLY 97 Ca 0.00 -0.62 -0.08 0.00 0.00 0.00 0.00 47.33 46.63 1n4c h GLY 97 CO 0.00 0.55 -0.22 0.58 0.00 0.00 0.00 176.54 177.45 1n4c n LYS 98 N -4.36 0.29 0.00 4.80 2.85 -0.97 -4.99 118.16 115.78 1n4c n LYS 98 Ca -0.08 -1.12 0.00 0.00 -1.05 0.00 0.00 58.31 56.06 1n4c n LYS 98 Cb 0.53 -0.50 0.00 0.00 -0.65 0.00 0.00 35.03 34.41 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 2.16 0.82 -1.28 -1.58 0.00 -0.96 -2.94 120.64 116.86 1n4c n GLU 99 Ca 0.09 0.00 0.03 0.00 0.00 0.00 0.00 57.16 57.28 1n4c n GLU 99 Cb 0.65 -1.13 0.01 0.00 0.00 0.00 0.00 31.44 30.97 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 0.53 0.00 -3.16 3.44 0.00 -1.26 -4.72 116.66 111.48 1n4c n ARG 100 Ca 0.00 -1.75 -0.19 0.00 -0.00 0.00 0.00 57.85 55.90 1n4c n ARG 100 Cb 0.38 -0.08 -0.04 0.00 0.00 0.00 0.00 32.46 32.73 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 0.38 0.45 -0.48 6.15 5.15 -1.15 -4.91 115.26 120.85 1n4c n ASN 101 Ca 0.04 -2.95 0.40 0.00 -0.60 0.00 0.00 54.58 51.46 1n4c n ASN 101 Cb 1.04 -0.49 0.69 0.00 -0.53 0.00 0.00 39.78 40.49 1n4c n ASN 101 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 1n4c h ILE 102 N 1.40 0.12 -0.90 -1.44 -0.00 -1.85 0.62 117.51 115.46 1n4c h ILE 102 Ca 0.08 -0.02 0.06 0.00 -0.00 0.00 0.00 64.86 64.97 1n4c h ILE 102 Cb 0.95 0.05 -0.06 0.00 -0.00 0.00 0.00 36.82 37.76 1n4c h ILE 102 CO 0.47 0.01 0.57 0.08 -0.00 0.00 0.00 178.15 179.28 1n4c h ARG 103 N 0.07 1.03 0.18 2.19 0.11 -1.97 -2.29 114.38 113.70 1n4c h ARG 103 Ca 0.83 -0.06 -0.26 0.00 0.10 0.00 0.00 59.98 60.59 1n4c h ARG 103 Cb 2.77 -0.23 0.03 0.00 1.11 0.00 0.00 29.97 33.64 1n4c h ARG 103 CO -0.32 0.68 -1.15 0.00 0.10 0.00 0.00 179.97 179.28 1n4c h ALA 104 N 1.41 -0.09 -0.70 0.08 0.00 -0.17 -3.00 119.26 116.79 1n4c h ALA 104 Ca 0.38 -0.81 0.12 0.00 0.00 0.00 0.00 54.91 54.61 1n4c h ALA 104 Cb 0.13 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 18.01 1n4c h ALA 104 CO -0.16 0.55 0.27 -0.07 0.00 0.00 0.00 179.25 179.84 1n4c h LEU 105 N -0.16 0.25 -0.47 0.00 3.38 -1.13 0.72 115.31 117.90 1n4c h LEU 105 Ca -0.21 0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1n4c h LEU 105 Cb 1.86 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 42.69 1n4c h LEU 105 CO 0.19 0.12 -0.17 0.17 0.09 0.00 0.00 178.44 178.84 1n4c h LEU 106 N 0.43 0.00 -2.22 1.67 8.10 -1.54 -1.67 115.31 120.08 1n4c h LEU 106 Ca 0.37 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.36 1n4c h LEU 106 Cb 0.52 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.74 1n4c h LEU 106 CO -0.37 0.17 0.00 -1.20 -4.11 0.00 0.00 178.44 172.93 1n4c n SER 107 N -3.19 3.30 0.00 0.17 7.64 0.22 -4.10 113.62 117.67 1n4c n SER 107 Ca 0.02 -1.97 0.00 0.00 1.01 0.00 0.00 58.87 57.93 1n4c n SER 107 Cb 0.52 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 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 1.37 0.28 0.21 0.44 -2.24 0.23 -4.62 114.28 109.95 1n4c n THR 108 Ca 0.20 -0.30 0.08 0.00 -2.27 0.00 0.00 64.05 61.76 1n4c n THR 108 Cb 0.57 0.95 0.39 0.00 -2.10 0.00 0.00 70.33 70.15 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 -0.07 -0.78 -1.53 -1.46 -3.03 114.93 108.07 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 0.77 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.82 1n4c h MET 109 CO 0.00 0.29 0.07 1.12 0.14 0.00 0.00 176.91 178.53 1n4c h HIS 110 N 0.00 0.00 0.00 1.39 2.07 -1.86 0.58 115.15 117.33 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 0.83 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.81 1n4c h HIS 110 CO 0.00 0.00 0.00 0.25 -3.07 0.00 0.00 177.93 175.11 1n4c n THR 111 N -3.89 0.00 -2.23 6.12 -2.24 -1.14 -3.50 114.28 107.39 1n4c n THR 111 Ca -0.01 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.77 1n4c n THR 111 Cb 0.17 -0.29 -0.00 0.00 -2.10 0.00 0.00 70.33 68.11 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 -0.72 0.00 -2.32 2.28 0.24 0.18 -4.99 118.33 113.00 1n4c n VAL 112 Ca 0.09 -0.46 -0.26 0.00 -2.04 0.00 0.00 64.34 61.67 1n4c n VAL 112 Cb 0.04 0.68 0.12 0.00 -1.47 0.00 0.00 33.84 33.22 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 2.88 0.04 1.34 1.43 -1.15 -4.94 118.68 118.28 1n4c s LEU 113 Ca 0.16 -0.02 -0.21 0.00 -1.03 0.00 0.00 54.13 53.02 1n4c s LEU 113 Cb 0.18 -2.29 -0.06 0.00 0.03 0.00 0.00 46.19 44.05 1n4c s LEU 113 CO -0.08 -2.07 0.63 -1.66 0.23 0.00 0.00 176.35 173.40 1n4c s TRP 114 N -3.38 3.74 -0.18 0.29 -2.14 -1.26 -4.97 118.94 111.03 1n4c s TRP 114 Ca 0.67 1.30 -0.34 0.00 2.66 0.00 0.00 56.10 60.40 1n4c s TRP 114 Cb -0.06 -2.63 -0.11 0.00 -3.10 0.00 0.00 33.47 27.58 1n4c s TRP 114 CO 0.47 0.41 2.02 0.00 -2.66 0.00 0.00 176.95 177.19 1n4c n ALA 115 N 2.38 1.05 0.00 2.67 0.00 -1.26 -2.92 120.51 122.42 1n4c n ALA 115 Ca -0.07 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1n4c n ALA 115 Cb 0.51 -2.58 0.00 0.00 0.00 0.00 0.00 19.45 17.38 1n4c n ALA 115 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1n4c n GLY 116 N 5.18 3.36 3.59 0.00 0.00 -1.26 -5.09 105.19 110.97 1n4c n GLY 116 Ca 0.29 -0.49 -0.47 0.00 0.00 0.00 0.00 46.02 45.35 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 1.84 -0.02 1.61 4.07 -1.15 -4.78 120.64 122.21 1n4c n GLU 117 Ca 0.00 0.59 0.03 0.00 -0.06 0.00 0.00 57.16 57.72 1n4c n GLU 117 Cb 0.00 -2.80 0.04 0.00 -0.06 0.00 0.00 31.44 28.62 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 6.55 1.25 -0.08 6.31 -2.24 -1.26 -4.63 114.28 120.18 1n4c n THR 118 Ca 0.30 -1.35 -0.07 0.00 -2.27 0.00 0.00 64.05 60.66 1n4c n THR 118 Cb 0.33 0.30 -0.16 0.00 -2.10 0.00 0.00 70.33 68.70 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 -0.75 0.68 -1.77 -0.78 5.02 -1.26 -4.93 118.16 114.37 1n4c n LYS 119 Ca 0.04 -0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.91 1n4c n LYS 119 Cb 0.36 -1.55 -0.03 0.00 -0.02 0.00 0.00 35.03 33.79 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 -2.65 2.66 -0.58 2.13 -0.11 -1.26 -4.95 118.94 114.19 1n4c s TRP 120 Ca -0.09 0.27 -0.05 0.00 1.22 0.00 0.00 56.10 57.45 1n4c s TRP 120 Cb 0.07 -4.11 0.15 0.00 -1.50 0.00 0.00 33.47 28.08 1n4c s TRP 120 CO 0.84 -4.33 0.42 0.21 -4.62 0.00 0.00 176.95 169.47 1n4c s LYS 121 N 1.75 2.56 0.03 5.86 2.47 -1.26 -5.06 119.74 126.09 1n4c s LYS 121 Ca 0.76 -2.24 -0.33 0.00 -1.56 0.00 0.00 55.97 52.60 1n4c s LYS 121 Cb -0.47 -3.82 -0.17 0.00 -1.46 0.00 0.00 37.83 31.91 1n4c s LYS 121 CO 0.33 -1.17 0.85 -2.30 0.16 0.00 0.00 175.35 173.22 1n4c n PRO 122 N 4.03 0.00 -3.29 4.03 -0.02 -1.26 -4.89 135.00 133.60 1n4c n PRO 122 Ca 0.04 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.13 1n4c n PRO 122 Cb 0.40 -1.23 -0.07 0.00 -0.02 0.00 0.00 33.50 32.58 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 -0.17 5.14 0.05 -1.45 1.01 -1.26 -5.02 120.40 118.70 1n4c s VAL 123 Ca 0.75 0.90 -0.30 0.00 0.00 0.00 0.00 61.98 63.33 1n4c s VAL 123 Cb -1.06 -3.81 -0.08 0.00 0.00 0.00 0.00 36.38 31.43 1n4c s VAL 123 CO 0.50 0.22 1.75 -0.83 0.00 0.00 0.00 175.10 176.74 1n4c s GLY 124 N 1.03 1.49 0.66 4.51 0.00 -1.26 -4.78 107.32 108.96 1n4c s GLY 124 Ca 0.23 1.22 0.06 0.00 0.00 0.00 0.00 44.72 46.24 1n4c s GLY 124 CO 0.09 3.09 1.15 -0.33 0.00 0.00 0.00 173.10 177.11 1n4c h MET 125 N 9.12 0.00 0.00 2.90 2.86 -1.95 2.63 114.93 130.49 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 -0.18 0.00 1.06 0.00 0.00 176.91 178.73 1n4c n ALA 126 N -1.61 2.59 -0.59 6.32 0.00 -1.26 -3.67 120.51 122.28 1n4c n ALA 126 Ca 0.02 -0.14 -0.17 0.00 0.00 0.00 0.00 53.44 53.15 1n4c n ALA 126 Cb 0.95 -1.37 0.12 0.00 0.00 0.00 0.00 19.45 19.16 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 -1.87 3.74 -1.88 0.00 8.00 0.88 -4.11 116.55 121.31 1n4c n ASP 127 Ca 0.06 -3.14 0.02 0.00 0.71 0.00 0.00 54.79 52.44 1n4c n ASP 127 Cb 0.39 -0.76 0.03 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 -0.63 1.05 -0.13 0.64 -0.00 -1.24 -4.75 117.00 111.94 1n4c n LEU 128 Ca 0.42 -2.31 0.15 0.00 -0.00 0.00 0.00 56.01 54.27 1n4c n LEU 128 Cb 1.28 0.14 0.83 0.00 -0.00 0.00 0.00 43.42 45.67 1n4c n LEU 128 CO 0.44 0.71 1.04 1.33 -0.00 0.00 0.00 177.39 180.90 1n4c n VAL 129 N 0.14 0.00 -4.25 1.47 0.24 -1.26 -4.78 118.33 109.89 1n4c n VAL 129 Ca 0.05 -0.07 -0.18 0.00 -2.04 0.00 0.00 64.34 62.10 1n4c n VAL 129 Cb 1.03 -0.22 -0.11 0.00 -1.47 0.00 0.00 33.84 33.07 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 -2.00 1.34 0.24 3.34 -4.23 -1.26 -4.90 115.64 108.17 1n4c s THR 130 Ca 0.45 -1.77 -0.03 0.00 -1.18 0.00 0.00 61.69 59.16 1n4c s THR 130 Cb 0.22 -1.59 0.09 0.00 1.34 0.00 0.00 72.50 72.56 1n4c s THR 130 CO 0.36 -0.45 1.71 1.55 -0.54 0.00 0.00 174.62 177.25 1n4c h PRO 131 N 3.40 0.78 -0.94 3.99 0.13 -1.96 -2.51 132.00 134.89 1n4c h PRO 131 Ca -0.39 -0.24 -0.00 0.00 -0.87 0.00 0.00 66.00 64.49 1n4c h PRO 131 Cb 1.20 -0.07 -0.05 0.00 0.13 0.00 0.00 31.00 32.21 1n4c h PRO 131 CO 0.52 0.84 0.58 1.49 -0.23 0.00 0.00 178.00 181.20 1n4c h GLU 132 N 0.71 1.26 -0.51 0.86 4.81 -1.96 1.25 114.58 121.00 1n4c h GLU 132 Ca 0.13 -0.11 -0.07 0.00 -0.13 0.00 0.00 59.36 59.18 1n4c h GLU 132 Cb 0.55 -0.27 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 1n4c h GLU 132 CO 0.03 0.87 0.03 1.96 -0.73 0.00 0.00 179.01 181.17 1n4c h GLN 133 N 1.29 0.83 0.07 1.92 4.20 -1.81 0.60 115.11 122.22 1n4c h GLN 133 Ca 0.34 -0.22 -0.13 0.00 0.06 0.00 0.00 58.65 58.70 1n4c h GLN 133 Cb -0.08 -0.10 0.01 0.00 0.30 0.00 0.00 27.48 27.62 1n4c h GLN 133 CO -0.07 0.82 -0.54 0.28 -0.67 0.00 0.00 178.83 178.65 1n4c h VAL 134 N 0.78 1.56 -0.03 -0.54 2.07 -0.84 -2.97 116.25 116.29 1n4c h VAL 134 Ca 0.15 -2.34 -0.13 0.00 0.82 0.00 0.00 66.70 65.20 1n4c h VAL 134 Cb 0.43 3.08 -0.02 0.00 -1.52 0.00 0.00 31.29 33.27 1n4c h VAL 134 CO 0.02 0.65 -0.58 0.50 0.02 0.00 0.00 177.57 178.18 1n4c h LYS 135 N -0.47 0.10 -0.29 1.57 3.11 0.16 -1.35 116.57 119.39 1n4c h LYS 135 Ca -0.09 -0.06 -0.14 0.00 -2.81 0.00 0.00 60.65 57.55 1n4c h LYS 135 Cb 1.38 0.01 -0.01 0.00 -1.00 0.00 0.00 32.23 32.61 1n4c h LYS 135 CO 0.10 0.65 -0.40 -0.22 -2.81 0.00 0.00 179.45 176.77 1n4c h LYS 136 N 0.07 0.70 0.07 1.90 3.64 0.12 -3.15 116.57 119.93 1n4c h LYS 136 Ca -0.00 -0.36 -0.25 0.00 -1.27 0.00 0.00 60.65 58.76 1n4c h LYS 136 Cb 1.04 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 1n4c h LYS 136 CO 0.08 0.97 -1.19 0.28 -2.27 0.00 0.00 179.45 177.33 1n4c h VAL 137 N 0.57 1.54 -0.91 2.00 2.07 -1.43 -3.21 116.25 116.89 1n4c h VAL 137 Ca 0.05 -3.18 0.26 0.00 0.82 0.00 0.00 66.70 64.65 1n4c h VAL 137 Cb 0.93 2.87 -0.04 0.00 -1.52 0.00 0.00 31.29 33.54 1n4c h VAL 137 CO 0.08 0.91 0.69 0.22 0.02 0.00 0.00 177.57 179.49 1n4c h TYR 138 N 0.04 0.00 0.54 1.57 3.20 -1.20 0.13 116.97 121.25 1n4c h TYR 138 Ca -0.10 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.75 1n4c h TYR 138 Cb 1.89 0.00 0.01 0.00 1.54 0.00 0.00 36.73 40.17 1n4c h TYR 138 CO 0.03 0.00 -0.26 -0.09 -1.64 0.00 0.00 178.16 176.21 1n4c h ARG 139 N 0.00 -0.70 -0.60 1.82 2.43 -1.61 -2.67 114.38 113.06 1n4c h ARG 139 Ca 0.43 0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.65 1n4c h ARG 139 Cb 1.80 0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 31.48 1n4c h ARG 139 CO -0.00 -0.42 0.38 0.87 -1.51 0.00 0.00 179.97 179.29 1n4c h LYS 140 N -1.12 0.80 -0.94 0.20 1.57 -1.32 -1.42 116.57 114.33 1n4c h LYS 140 Ca -0.07 -0.06 0.21 0.00 -1.87 0.00 0.00 60.65 58.86 1n4c h LYS 140 Cb 0.60 -0.17 -0.08 0.00 0.08 0.00 0.00 32.23 32.66 1n4c h LYS 140 CO 0.12 0.55 0.62 0.00 -0.57 0.00 0.00 179.45 180.17 1n4c h ALA 141 N 1.20 2.14 0.00 3.86 0.00 -0.85 0.69 119.26 126.31 1n4c h ALA 141 Ca 0.22 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.02 1n4c h ALA 141 Cb -0.06 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1n4c h ALA 141 CO -0.04 -0.46 -0.64 0.28 0.00 0.00 0.00 179.25 178.39 1n4c h VAL 142 N 0.46 1.45 0.00 0.00 2.07 -0.90 -2.84 116.25 116.48 1n4c h VAL 142 Ca 0.51 -2.20 -0.09 0.00 0.82 0.00 0.00 66.70 65.74 1n4c h VAL 142 Cb 1.19 2.19 -0.01 0.00 -1.52 0.00 0.00 31.29 33.14 1n4c h VAL 142 CO -0.22 0.63 -0.41 -0.07 0.02 0.00 0.00 177.57 177.51 1n4c h LEU 143 N 0.00 0.00 -1.60 2.57 3.38 0.83 -2.14 115.31 118.35 1n4c h LEU 143 Ca -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1n4c h LEU 143 Cb 1.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1n4c h LEU 143 CO 0.08 0.41 -0.14 0.58 0.09 0.00 0.00 178.44 179.47 1n4c h VAL 144 N 0.00 1.13 -0.15 1.22 2.07 -1.03 -2.87 116.25 116.62 1n4c h VAL 144 Ca -0.00 -0.61 -0.04 0.00 0.82 0.00 0.00 66.70 66.87 1n4c h VAL 144 Cb 0.77 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1n4c h VAL 144 CO 0.05 0.18 -0.09 1.33 0.02 0.00 0.00 177.57 179.06 1n4c n VAL 145 N -4.33 2.19 -1.70 2.57 0.24 -1.02 -4.97 118.33 111.32 1n4c n VAL 145 Ca -0.02 -2.41 -0.42 0.00 -2.04 0.00 0.00 64.34 59.45 1n4c n VAL 145 Cb 0.23 -0.26 -0.03 0.00 -1.47 0.00 0.00 33.84 32.31 1n4c n VAL 145 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 1n4c n HIS 146 N -1.06 2.66 -0.29 6.34 -0.00 -0.84 -4.81 115.22 117.23 1n4c n HIS 146 Ca 0.22 -0.09 0.11 0.00 -0.00 0.00 0.00 57.72 57.96 1n4c n HIS 146 Cb 0.80 -2.71 0.22 0.00 -0.00 0.00 0.00 29.99 28.30 1n4c n HIS 146 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 1n4c n PRO 147 N 5.11 -0.07 -0.32 1.57 -0.02 -1.26 -0.36 135.00 139.65 1n4c n PRO 147 Ca 0.17 1.23 0.19 0.00 -2.02 0.00 0.00 63.50 63.08 1n4c n PRO 147 Cb 0.36 -1.94 0.39 0.00 -0.02 0.00 0.00 33.50 32.29 1n4c n PRO 147 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1n4c h ASP 148 N 0.00 0.09 0.24 2.55 5.19 -1.98 1.32 116.42 123.82 1n4c h ASP 148 Ca 0.48 0.22 0.00 0.00 -0.62 0.00 0.00 57.03 57.11 1n4c h ASP 148 Cb 0.96 0.28 0.00 0.00 0.18 0.00 0.00 39.33 40.75 1n4c h ASP 148 CO -0.78 -0.24 -0.12 0.29 -3.12 0.00 0.00 179.24 175.26 1n4c n LYS 149 N -5.24 0.92 -1.42 3.56 5.02 0.51 -3.74 118.16 117.77 1n4c n LYS 149 Ca 0.27 -0.42 -0.04 0.00 -2.02 0.00 0.00 58.31 56.11 1n4c n LYS 149 Cb 0.88 -1.49 0.11 0.00 -0.02 0.00 0.00 35.03 34.50 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 -0.68 3.75 -2.56 7.82 0.00 0.43 -4.85 120.51 124.43 1n4c n ALA 150 Ca 0.15 -3.24 -0.42 0.00 0.00 0.00 0.00 53.44 49.93 1n4c n ALA 150 Cb 0.30 -0.46 -0.07 0.00 0.00 0.00 0.00 19.45 19.22 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 -3.21 4.89 -0.54 0.00 2.01 -0.00 -4.09 115.64 114.70 1n4c s THR 151 Ca 0.40 0.48 0.00 0.00 0.31 0.00 0.00 61.69 62.89 1n4c s THR 151 Cb 0.38 -4.08 0.00 0.00 0.01 0.00 0.00 72.50 68.81 1n4c s THR 151 CO -0.05 -0.35 0.00 0.61 -0.69 0.00 0.00 174.62 174.14 1n4c n GLY 152 N 4.74 0.49 3.77 4.40 0.00 -1.26 -4.91 105.19 112.42 1n4c n GLY 152 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.11 4.66 0.39 1.61 -1.52 -1.26 -4.89 119.66 116.55 1n4c s GLN 153 Ca 0.00 1.30 0.31 0.00 -1.95 0.00 0.00 55.36 55.02 1n4c s GLN 153 Cb 0.00 -3.14 1.28 0.00 -0.22 0.00 0.00 33.01 30.93 1n4c s GLN 153 CO 0.00 0.48 1.27 -2.30 -0.25 0.00 0.00 175.29 174.49 1n4c n PRO 154 N 1.27 -0.02 -1.10 2.91 -0.02 -1.26 0.28 135.00 137.05 1n4c n PRO 154 Ca -0.02 0.98 -0.12 0.00 -2.02 0.00 0.00 63.50 62.32 1n4c n PRO 154 Cb 0.48 -2.02 0.27 0.00 -0.02 0.00 0.00 33.50 32.21 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 -4.09 2.69 -0.27 6.00 0.18 -1.26 -4.57 117.16 115.84 1n4c n TYR 155 Ca 0.34 -1.40 -0.00 0.00 1.88 0.00 0.00 57.90 58.72 1n4c n TYR 155 Cb 1.40 -0.78 0.12 0.00 -0.38 0.00 0.00 39.34 39.70 1n4c n TYR 155 CO 0.00 0.00 0.00 1.49 -2.08 0.00 0.00 176.86 176.27 1n4c h GLU 156 N 2.21 0.81 -0.61 -3.48 4.81 0.38 -2.20 114.58 116.50 1n4c h GLU 156 Ca 0.38 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.54 1n4c h GLU 156 Cb 2.53 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 31.70 1n4c h GLU 156 CO 0.87 0.54 0.27 1.96 -0.73 0.00 0.00 179.01 181.91 1n4c h GLN 157 N 0.84 0.89 -0.59 1.92 1.08 -1.80 -2.86 115.11 114.57 1n4c h GLN 157 Ca 0.34 -0.14 0.12 0.00 -1.45 0.00 0.00 58.65 57.52 1n4c h GLN 157 Cb 0.19 -0.15 -0.11 0.00 -0.05 0.00 0.00 27.48 27.36 1n4c h GLN 157 CO -0.18 0.73 -0.12 1.88 -0.95 0.00 0.00 178.83 180.19 1n4c h TYR 158 N 0.84 -0.26 -0.13 2.96 -1.99 -1.74 -1.72 116.97 114.92 1n4c h TYR 158 Ca 0.21 0.05 0.05 0.00 2.00 0.00 0.00 58.73 61.03 1n4c h TYR 158 Cb 0.15 0.21 -0.07 0.00 2.00 0.00 0.00 36.73 39.03 1n4c h TYR 158 CO 0.00 -0.24 -0.37 0.00 -0.00 0.00 0.00 178.16 177.56 1n4c h ALA 159 N 1.58 -0.47 -0.50 3.88 0.00 -1.43 -0.75 119.26 121.57 1n4c h ALA 159 Ca 0.29 0.01 0.10 0.00 0.00 0.00 0.00 54.91 55.31 1n4c h ALA 159 Cb 0.45 0.69 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1n4c h ALA 159 CO -0.59 -0.85 0.34 0.87 0.00 0.00 0.00 179.25 179.02 1n4c h LYS 160 N -0.44 0.22 0.10 0.00 1.57 -1.36 0.98 116.57 117.64 1n4c h LYS 160 Ca 0.09 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1n4c h LYS 160 Cb 0.59 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1n4c h LYS 160 CO -0.38 0.15 -0.05 0.52 -0.57 0.00 0.00 179.45 179.12 1n4c h MET 161 N 0.23 -0.13 0.00 3.15 2.86 -0.69 -3.23 114.93 117.12 1n4c h MET 161 Ca 0.23 0.01 -0.11 0.00 -2.06 0.00 0.00 59.70 57.77 1n4c h MET 161 Cb 0.62 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.29 1n4c h MET 161 CO -0.04 0.38 -0.52 -0.84 1.06 0.00 0.00 176.91 176.94 1n4c h ILE 162 N -0.86 0.97 -0.71 -1.22 3.07 -0.99 -2.94 117.51 114.83 1n4c h ILE 162 Ca -0.01 -2.16 -0.02 0.00 1.55 0.00 0.00 64.86 64.22 1n4c h ILE 162 Cb 0.57 2.33 -0.03 0.00 -0.27 0.00 0.00 36.82 39.41 1n4c h ILE 162 CO 0.02 0.51 0.38 0.15 -1.05 0.00 0.00 178.15 178.17 1n4c h PHE 163 N 0.00 0.99 0.11 0.16 3.04 0.89 -1.84 116.94 120.29 1n4c h PHE 163 Ca -0.01 -0.03 -0.15 0.00 3.98 0.00 0.00 57.97 61.76 1n4c h PHE 163 Cb 1.28 -0.31 0.02 0.00 2.56 0.00 0.00 35.95 39.50 1n4c h PHE 163 CO 0.00 0.71 -0.67 0.52 -2.02 0.00 0.00 178.31 176.85 1n4c h MET 164 N 0.99 0.26 -0.76 1.11 2.86 -1.61 -3.08 114.93 114.69 1n4c h MET 164 Ca 0.25 -0.43 0.13 0.00 -2.06 0.00 0.00 59.70 57.60 1n4c h MET 164 Cb 0.05 0.16 -0.05 0.00 0.06 0.00 0.00 31.60 31.82 1n4c h MET 164 CO -0.04 1.20 0.50 0.93 1.06 0.00 0.00 176.91 180.56 1n4c h GLU 165 N -0.46 0.50 -0.26 1.72 3.07 -1.49 1.66 114.58 119.32 1n4c h GLU 165 Ca -0.12 -0.03 -0.09 0.00 -0.50 0.00 0.00 59.36 58.63 1n4c h GLU 165 Cb 1.52 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 29.31 1n4c h GLU 165 CO 0.13 0.33 -0.18 -0.07 -1.40 0.00 0.00 179.01 177.82 1n4c h LEU 166 N 0.51 0.61 -0.01 1.33 -0.00 -1.39 -2.94 115.31 113.41 1n4c h LEU 166 Ca 0.37 -0.44 0.00 0.00 -0.00 0.00 0.00 57.88 57.81 1n4c h LEU 166 Cb 0.72 -0.17 0.00 0.00 -0.00 0.00 0.00 40.66 41.21 1n4c h LEU 166 CO -0.13 0.92 -0.29 -3.20 -0.00 0.00 0.00 178.44 175.74 1n4c n ASN 167 N -4.40 0.31 -0.05 -0.43 2.85 -0.22 -3.28 115.26 110.03 1n4c n ASN 167 Ca -0.04 0.03 -0.04 0.00 -0.11 0.00 0.00 54.58 54.42 1n4c n ASN 167 Cb 0.39 -0.06 -0.03 0.00 1.24 0.00 0.00 39.78 41.32 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 -0.01 0.27 1.20 3.58 0.25 -3.28 116.42 118.46 1n4c h ASP 168 Ca 0.00 -0.25 -0.04 0.00 0.42 0.00 0.00 57.03 57.16 1n4c h ASP 168 Cb 0.50 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.54 1n4c h ASP 168 CO 0.00 0.61 -0.19 0.00 -2.88 0.00 0.00 179.24 176.77 1n4c h ALA 169 N -0.75 1.51 -0.87 -0.78 0.00 -1.68 -2.42 119.26 114.26 1n4c h ALA 169 Ca -0.00 -0.18 0.12 0.00 0.00 0.00 0.00 54.91 54.85 1n4c h ALA 169 Cb 0.26 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 17.94 1n4c h ALA 169 CO 0.00 0.24 0.50 2.35 0.00 0.00 0.00 179.25 182.34 1n4c h TRP 170 N 0.00 0.90 -0.06 0.00 2.91 -1.65 1.13 115.95 119.18 1n4c h TRP 170 Ca -0.00 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.03 1n4c h TRP 170 Cb 0.38 -0.27 -0.01 0.00 -0.51 0.00 0.00 29.16 28.75 1n4c h TRP 170 CO 0.00 0.32 -0.07 1.03 -1.03 0.00 0.00 178.44 178.69 1n4c h SER 171 N 0.79 0.08 0.13 2.65 0.87 -1.49 -0.32 113.55 116.26 1n4c h SER 171 Ca 0.44 -0.01 -0.18 0.00 -1.23 0.00 0.00 61.79 60.81 1n4c h SER 171 Cb 0.48 -0.02 0.02 0.00 -0.44 0.00 0.00 62.40 62.44 1n4c h SER 171 CO -0.28 0.17 -0.79 -0.08 -0.53 0.00 0.00 176.83 175.32 1n4c h GLU 172 N 0.09 0.28 -0.90 2.24 4.57 -0.03 -1.20 114.58 119.63 1n4c h GLU 172 Ca 0.02 -0.48 0.09 0.00 -1.18 0.00 0.00 59.36 57.80 1n4c h GLU 172 Cb 0.19 0.18 -0.07 0.00 -0.16 0.00 0.00 28.75 28.89 1n4c h GLU 172 CO 0.01 1.23 0.55 0.35 -1.18 0.00 0.00 179.01 179.97 1n4c h PHE 173 N -0.40 1.01 -0.01 0.92 3.57 0.15 2.53 116.94 124.70 1n4c h PHE 173 Ca -0.14 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.29 1n4c h PHE 173 Cb 1.61 -0.32 0.01 0.00 2.79 0.00 0.00 35.95 40.04 1n4c h PHE 173 CO 0.20 0.45 -0.41 0.93 -2.23 0.00 0.00 178.31 177.25 1n4c h GLU 174 N 0.94 0.30 -0.07 1.11 5.08 -1.14 -2.97 114.58 117.83 1n4c h GLU 174 Ca 0.42 -0.30 -0.23 0.00 -1.00 0.00 0.00 59.36 58.25 1n4c h GLU 174 Cb 0.32 0.08 0.02 0.00 0.50 0.00 0.00 28.75 29.67 1n4c h GLU 174 CO -0.22 1.00 -0.86 -0.97 -1.00 0.00 0.00 179.01 176.95 1n4c h ASN 175 N -0.28 0.88 0.09 1.42 -0.73 -0.74 -1.87 115.58 114.35 1n4c h ASN 175 Ca -0.05 -0.69 -0.01 0.00 1.87 0.00 0.00 56.30 57.43 1n4c h ASN 175 Cb 1.13 -0.26 -0.00 0.00 0.27 0.00 0.00 38.32 39.46 1n4c h ASN 175 CO 0.08 1.44 -0.04 -0.61 -0.37 0.00 0.00 177.43 177.94 1n4c h GLN 176 N 0.40 0.00 0.00 6.67 -0.00 0.42 -3.42 115.11 119.18 1n4c h GLN 176 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.56 1n4c h GLN 176 Cb 1.51 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.99 1n4c h GLN 176 CO 0.17 0.04 0.00 0.41 0.00 0.00 0.00 178.83 179.45 1n4c n GLY 177 N -1.18 -0.54 2.19 2.39 0.00 -1.12 -5.02 105.19 101.90 1n4c n GLY 177 Ca -0.03 0.74 -0.18 0.00 0.00 0.00 0.00 46.02 46.56 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 0.00 2.14 -3.62 1.61 0.00 -0.71 -4.63 117.38 112.17 1n4c n GLN 178 Ca 0.00 -1.56 -0.15 0.00 -0.00 0.00 0.00 57.00 55.29 1n4c n GLN 178 Cb 0.00 -2.02 -0.06 0.00 0.00 0.00 0.00 30.24 28.15 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 0.94 -0.62 3.69 1.02 -1.26 -5.08 119.74 118.16 1n4c s LYS 179 Ca 0.61 -0.13 -0.22 0.00 0.02 0.00 0.00 55.97 56.25 1n4c s LYS 179 Cb 0.34 0.43 -0.14 0.00 -0.52 0.00 0.00 37.83 37.93 1n4c s LYS 179 CO -0.10 -0.31 1.73 -2.30 -0.92 0.00 0.00 175.35 173.46 1n4c n PRO 180 N 0.74 0.00 -3.44 -1.68 -0.02 -1.26 -4.84 135.00 124.49 1n4c n PRO 180 Ca -0.19 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 60.93 1n4c n PRO 180 Cb 0.58 -0.99 -0.05 0.00 -0.02 0.00 0.00 33.50 33.03 1n4c n PRO 180 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1n4c n LEU 181 N 6.68 4.67 0.00 2.45 4.77 -1.26 -5.15 117.00 129.16 1n4c n LEU 181 Ca 0.43 -5.21 0.00 0.00 -0.03 0.00 0.00 56.01 51.19 1n4c n LEU 181 Cb 0.01 -1.07 0.00 0.00 -2.33 0.00 0.00 43.42 40.03 1n4c n LEU 181 CO 0.61 1.68 0.00 0.00 -1.33 0.00 0.00 177.39 178.36