#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 0.29 -2.03 1.61 -0.02 -1.26 -4.82 135.00 128.78 1n4c n PRO 2 Ca 0.00 -0.06 -0.36 0.00 -2.02 0.00 0.00 63.50 61.05 1n4c n PRO 2 Cb 0.00 -2.05 -0.03 0.00 -0.02 0.00 0.00 33.50 31.40 1n4c n PRO 2 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1n4c s LEU 3 N 8.80 3.27 0.56 2.45 0.20 -1.26 -4.72 118.68 127.99 1n4c s LEU 3 Ca 1.23 0.19 0.00 0.00 0.69 0.00 0.00 54.13 56.24 1n4c s LEU 3 Cb -0.86 -2.53 0.00 0.00 -0.43 0.00 0.00 46.19 42.37 1n4c s LEU 3 CO 0.42 -2.46 0.00 0.61 -0.29 0.00 0.00 176.35 174.63 1n4c n GLY 4 N 5.91 -3.33 2.73 7.98 0.00 -1.26 -4.95 105.19 112.27 1n4c n GLY 4 Ca 0.24 -1.09 -0.08 0.00 0.00 0.00 0.00 46.02 45.10 1n4c n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1n4c n SER 5 N -4.10 -2.58 -0.07 1.61 3.41 -1.26 -5.05 113.62 105.58 1n4c n SER 5 Ca -0.09 -3.21 -0.08 0.00 -0.26 0.00 0.00 58.87 55.23 1n4c n SER 5 Cb 0.62 1.73 -0.06 0.00 -0.26 0.00 0.00 64.21 66.24 1n4c n SER 5 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1n4c h PRO 6 N 3.64 -0.23 -1.24 4.33 0.11 -2.01 -3.44 132.00 133.16 1n4c h PRO 6 Ca -0.15 0.02 0.15 0.00 0.11 0.00 0.00 66.00 66.12 1n4c h PRO 6 Cb 1.07 0.05 -0.25 0.00 0.11 0.00 0.00 31.00 31.98 1n4c h PRO 6 CO 0.23 -0.16 0.26 -2.00 -0.21 0.00 0.00 178.00 176.12 1n4c s GLU 7 N -4.55 0.34 0.00 1.05 2.12 -1.26 -5.11 118.70 111.29 1n4c s GLU 7 Ca -0.08 0.74 0.00 0.00 0.36 0.00 0.00 54.97 55.98 1n4c s GLU 7 Cb 0.05 0.33 0.00 0.00 0.26 0.00 0.00 34.13 34.77 1n4c s GLU 7 CO 0.36 -0.10 0.03 1.19 -0.54 0.00 0.00 175.26 176.20 1n4c n PHE 8 N 4.55 0.00 0.00 5.30 3.72 -1.26 -5.03 117.46 124.74 1n4c n PHE 8 Ca -0.13 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.27 1n4c n PHE 8 Cb 0.54 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.08 1n4c n PHE 8 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1n4c n SER 9 N -0.42 -0.05 -2.73 4.37 3.41 -1.26 -5.03 113.62 111.91 1n4c n SER 9 Ca 0.00 0.01 -0.09 0.00 -0.26 0.00 0.00 58.87 58.54 1n4c n SER 9 Cb 0.00 0.51 0.09 0.00 -0.26 0.00 0.00 64.21 64.55 1n4c n SER 9 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 175.04 176.03 1n4c n MET 10 N -2.48 0.94 -1.27 4.33 0.00 -1.26 -5.15 117.12 112.23 1n4c n MET 10 Ca 0.00 -1.83 -0.25 0.00 0.00 0.00 0.00 57.70 55.62 1n4c n MET 10 Cb 0.00 -0.98 0.19 0.00 0.00 0.00 0.00 33.22 32.43 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 0.41 -1.84 -1.07 3.17 -0.04 -1.26 -4.82 135.00 129.56 1n4c n PRO 11 Ca 0.05 -1.60 -0.39 0.00 -0.04 0.00 0.00 63.50 61.52 1n4c n PRO 11 Cb 0.70 -1.24 -0.09 0.00 -0.04 0.00 0.00 33.50 32.84 1n4c n PRO 11 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1n4c n HIS 12 N -3.94 1.18 -1.10 0.54 8.25 -1.26 -4.73 115.22 114.15 1n4c n HIS 12 Ca 0.13 -1.11 -0.28 0.00 -0.26 0.00 0.00 57.72 56.21 1n4c n HIS 12 Cb 0.48 -1.56 -0.06 0.00 1.12 0.00 0.00 29.99 29.97 1n4c n HIS 12 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1n4c n SER 13 N 10.21 6.99 -2.72 0.41 3.41 -1.26 -4.24 113.62 126.41 1n4c n SER 13 Ca 0.47 -2.48 -0.07 0.00 -0.26 0.00 0.00 58.87 56.54 1n4c n SER 13 Cb 0.42 -1.40 0.07 0.00 -0.26 0.00 0.00 64.21 63.04 1n4c n SER 13 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1n4c n SER 14 N 3.37 -2.29 -4.52 4.04 2.88 -1.26 -5.14 113.62 110.70 1n4c n SER 14 Ca 0.62 -2.90 -0.46 0.00 -1.33 0.00 0.00 58.87 54.80 1n4c n SER 14 Cb 0.39 1.53 -0.02 0.00 -0.75 0.00 0.00 64.21 65.36 1n4c n SER 14 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1n4c n PRO 15 N 1.31 0.82 -2.51 -1.46 -0.02 -1.26 -4.86 135.00 127.02 1n4c n PRO 15 Ca 0.05 0.29 -0.42 0.00 -2.02 0.00 0.00 63.50 61.40 1n4c n PRO 15 Cb 0.67 -1.51 -0.02 0.00 -0.02 0.00 0.00 33.50 32.61 1n4c n PRO 15 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1n4c s GLN 16 N -1.34 3.50 0.00 -0.52 -0.21 -1.26 -4.50 119.66 115.33 1n4c s GLN 16 Ca 0.61 0.43 0.00 0.00 0.02 0.00 0.00 55.36 56.42 1n4c s GLN 16 Cb -0.79 -4.02 0.00 0.00 1.00 0.00 0.00 33.01 29.20 1n4c s GLN 16 CO 0.58 -1.68 0.00 0.27 -2.12 0.00 0.00 175.29 172.34 1n4c n ASN 17 N 8.67 0.00 0.03 5.90 2.04 -1.26 -4.95 115.26 125.69 1n4c n ASN 17 Ca 0.11 -0.71 -0.12 0.00 -0.44 0.00 0.00 54.58 53.41 1n4c n ASN 17 Cb 0.49 0.00 -0.00 0.00 -2.53 0.00 0.00 39.78 37.74 1n4c n ASN 17 CO 0.00 0.00 0.00 0.03 -0.44 0.00 0.00 177.26 176.85 1n4c h ARG 18 N 0.00 0.51 0.00 -3.83 3.08 -1.98 -3.14 114.38 109.02 1n4c h ARG 18 Ca 0.00 -0.43 0.00 0.00 0.07 0.00 0.00 59.98 59.62 1n4c h ARG 18 Cb 0.36 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1n4c h ARG 18 CO 0.00 1.06 0.06 -2.30 -1.07 0.00 0.00 179.97 177.71 1n4c n PRO 19 N -3.86 0.00 -3.57 0.04 -0.02 -1.26 -4.31 135.00 122.02 1n4c n PRO 19 Ca -0.05 0.24 -0.00 0.00 -2.02 0.00 0.00 63.50 61.66 1n4c n PRO 19 Cb 0.73 -1.56 -0.04 0.00 -0.02 0.00 0.00 33.50 32.61 1n4c n PRO 19 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 1n4c s ASN 20 N -2.39 -1.08 0.74 2.55 2.47 -1.19 -5.15 114.94 110.90 1n4c s ASN 20 Ca 0.00 1.40 -0.15 0.00 0.42 0.00 0.00 52.86 54.52 1n4c s ASN 20 Cb 0.00 2.20 0.03 0.00 -1.45 0.00 0.00 41.25 42.03 1n4c s ASN 20 CO 0.00 -0.21 1.13 0.00 -3.72 0.00 0.00 177.10 174.30 1n4c n TYR 21 N 5.38 1.18 0.00 0.43 4.19 -1.26 -4.91 117.16 122.17 1n4c n TYR 21 Ca -0.11 0.40 0.00 0.00 3.31 0.00 0.00 57.90 61.51 1n4c n TYR 21 Cb 0.50 -2.13 0.00 0.00 0.49 0.00 0.00 39.34 38.20 1n4c n TYR 21 CO 0.00 0.00 0.00 0.09 0.91 0.00 0.00 176.86 177.86 1n4c n ASN 22 N -2.36 0.00 -3.71 2.98 4.13 -1.26 -5.01 115.26 110.04 1n4c n ASN 22 Ca 0.14 0.00 -0.13 0.00 1.68 0.00 0.00 54.58 56.27 1n4c n ASN 22 Cb 0.49 0.00 -0.09 0.00 -1.54 0.00 0.00 39.78 38.64 1n4c n ASN 22 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1n4c s VAL 23 N 0.00 -0.00 0.59 2.41 -7.23 -1.26 -5.16 120.40 109.75 1n4c s VAL 23 Ca 0.00 0.00 -0.13 0.00 -1.81 0.00 0.00 61.98 60.04 1n4c s VAL 23 Cb 0.00 -0.66 -0.05 0.00 0.56 0.00 0.00 36.38 36.23 1n4c s VAL 23 CO 0.00 0.00 1.02 -0.44 -0.31 0.00 0.00 175.10 175.37 1n4c s SER 24 N 0.32 6.26 1.07 4.85 0.01 -1.26 -5.06 113.70 119.89 1n4c s SER 24 Ca -0.01 1.52 -0.13 0.00 1.31 0.00 0.00 55.95 58.64 1n4c s SER 24 Cb -0.04 -2.49 0.19 0.00 0.21 0.00 0.00 66.02 63.89 1n4c s SER 24 CO -0.00 -0.84 0.93 0.49 0.41 0.00 0.00 173.24 174.22 1n4c n PHE 25 N -2.31 -3.88 -2.40 2.43 3.72 -1.26 -4.93 117.46 108.83 1n4c n PHE 25 Ca 0.07 -0.82 -0.43 0.00 -0.05 0.00 0.00 57.45 56.21 1n4c n PHE 25 Cb 0.54 -0.79 -0.02 0.00 -0.94 0.00 0.00 39.48 38.26 1n4c n PHE 25 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1n4c s SER 26 N -4.29 6.36 0.00 4.37 1.04 -1.26 -4.86 113.70 115.06 1n4c s SER 26 Ca 0.55 0.69 0.00 0.00 0.48 0.00 0.00 55.95 57.67 1n4c s SER 26 Cb -0.03 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.55 1n4c s SER 26 CO 0.40 -1.44 1.41 -1.54 0.98 0.00 0.00 173.24 173.04 1n4c n SER 27 N 8.76 3.93 -2.69 7.02 3.41 -1.26 -3.84 113.62 128.94 1n4c n SER 27 Ca 0.15 -2.12 -0.06 0.00 -0.26 0.00 0.00 58.87 56.59 1n4c n SER 27 Cb 0.48 -0.76 0.10 0.00 -0.26 0.00 0.00 64.21 63.77 1n4c n SER 27 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 1n4c n MET 28 N 0.99 0.51 0.00 4.33 0.00 -1.26 -5.10 117.12 116.60 1n4c n MET 28 Ca 0.00 -1.22 0.00 0.00 -0.00 0.00 0.00 57.70 56.48 1n4c n MET 28 Cb 0.48 -0.53 0.00 0.00 0.00 0.00 0.00 33.22 33.17 1n4c n MET 28 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1n4c n PRO 29 N 0.47 0.00 -0.46 2.12 -0.04 -1.25 -4.81 135.00 131.03 1n4c n PRO 29 Ca -0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1n4c n PRO 29 Cb 0.73 -0.07 0.00 0.00 -0.04 0.00 0.00 33.50 34.12 1n4c n PRO 29 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1n4c n GLY 30 N 2.62 0.28 3.48 0.55 0.00 -1.26 -4.93 105.19 105.92 1n4c n GLY 30 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.00 1.53 0.00 -0.02 0.00 -1.26 -4.79 107.32 100.78 1n4c s GLY 31 Ca 0.00 -0.19 0.10 0.00 0.00 0.00 0.00 44.72 44.64 1n4c s GLY 31 CO 0.00 0.56 1.03 -1.06 0.00 0.00 0.00 173.10 173.63 1n4c n GLN 32 N -4.99 0.40 -0.03 2.90 1.13 -1.26 -3.08 117.38 112.45 1n4c n GLN 32 Ca 0.02 0.00 -0.05 0.00 -1.94 0.00 0.00 57.00 55.04 1n4c n GLN 32 Cb 0.54 -1.39 -0.04 0.00 0.11 0.00 0.00 30.24 29.46 1n4c n GLN 32 CO 0.00 0.00 0.00 -0.97 -1.44 0.00 0.00 177.06 174.65 1n4c h ASN 33 N 0.00 -0.04 -1.36 1.08 -0.00 -1.98 -3.46 115.58 109.82 1n4c h ASN 33 Ca 0.00 -0.28 -0.05 0.00 -0.00 0.00 0.00 56.30 55.97 1n4c h ASN 33 Cb 0.00 0.01 0.03 0.00 -0.00 0.00 0.00 38.32 38.36 1n4c h ASN 33 CO 0.00 0.59 -0.02 -0.62 -0.00 0.00 0.00 177.43 177.38 1n4c n GLU 34 N -4.77 -2.16 -3.27 6.67 -0.58 -1.18 -5.06 120.64 110.29 1n4c n GLU 34 Ca -0.04 -0.20 0.03 0.00 -0.42 0.00 0.00 57.16 56.53 1n4c n GLU 34 Cb 0.15 -0.25 -0.03 0.00 -0.57 0.00 0.00 31.44 30.75 1n4c n GLU 34 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 1n4c s ARG 35 N -3.29 0.30 0.00 3.49 3.52 -1.26 -4.98 118.95 116.74 1n4c s ARG 35 Ca 0.09 0.64 0.00 0.00 -0.13 0.00 0.00 55.73 56.33 1n4c s ARG 35 Cb -0.01 0.37 0.00 0.00 -1.56 0.00 0.00 34.95 33.75 1n4c s ARG 35 CO 0.07 -0.23 0.00 0.41 -0.81 0.00 0.00 175.30 174.75 1n4c n GLY 36 N 5.26 -1.92 2.60 8.12 0.00 -1.26 -5.07 105.19 112.92 1n4c n GLY 36 Ca -0.07 0.76 -0.13 0.00 0.00 0.00 0.00 46.02 46.59 1n4c n GLY 36 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n4c n LYS 37 N 0.00 0.55 -1.70 1.61 5.02 -1.26 -5.14 118.16 117.24 1n4c n LYS 37 Ca 0.00 -2.35 -0.30 0.00 -2.02 0.00 0.00 58.31 53.64 1n4c n LYS 37 Cb 0.00 -1.48 0.19 0.00 -0.02 0.00 0.00 35.03 33.73 1n4c n LYS 37 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n4c s ALA 38 N 0.37 1.82 0.00 7.82 0.00 -1.26 -5.00 121.76 125.52 1n4c s ALA 38 Ca 0.32 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 51.20 1n4c s ALA 38 Cb 0.09 -2.82 0.00 0.00 0.00 0.00 0.00 23.12 20.39 1n4c s ALA 38 CO -0.14 -2.69 0.00 0.00 0.00 0.00 0.00 175.76 172.93 1n4c n ALA 39 N -4.00 0.19 0.71 0.00 0.00 -1.26 -4.90 120.51 111.25 1n4c n ALA 39 Ca 0.14 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.71 1n4c n ALA 39 Cb 0.59 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.52 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 0.00 2.16 -3.15 0.00 0.00 -1.26 -4.67 120.51 113.60 1n4c n ALA 40 Ca 0.00 -0.04 0.05 0.00 0.00 0.00 0.00 53.44 53.45 1n4c n ALA 40 Cb 0.29 -1.44 -0.01 0.00 0.00 0.00 0.00 19.45 18.29 1n4c n ALA 40 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1n4c s ASN 41 N -3.86 -0.86 -0.49 0.00 2.47 -1.26 -5.10 114.94 105.84 1n4c s ASN 41 Ca 0.11 0.45 -0.27 0.00 0.42 0.00 0.00 52.86 53.56 1n4c s ASN 41 Cb 0.14 1.68 -0.02 0.00 -1.45 0.00 0.00 41.25 41.60 1n4c s ASN 41 CO 0.52 -0.16 1.82 -0.22 -3.72 0.00 0.00 177.10 175.34 1n4c s LEU 42 N 2.91 3.39 0.05 3.21 2.96 -1.26 -4.82 118.68 125.12 1n4c s LEU 42 Ca 0.10 0.74 -0.16 0.00 -0.22 0.00 0.00 54.13 54.60 1n4c s LEU 42 Cb -0.11 -2.96 -0.24 0.00 0.50 0.00 0.00 46.19 43.38 1n4c s LEU 42 CO -0.17 -2.08 1.15 1.05 -1.32 0.00 0.00 176.35 174.99 1n4c h GLU 43 N 14.01 0.61 0.00 1.98 4.11 -1.99 -3.49 114.58 129.82 1n4c h GLU 43 Ca -0.29 -0.67 0.26 0.00 0.07 0.00 0.00 59.36 58.73 1n4c h GLU 43 Cb 1.16 0.19 -0.05 0.00 0.50 0.00 0.00 28.75 30.56 1n4c h GLU 43 CO 1.14 1.27 0.75 0.41 0.07 0.00 0.00 179.01 182.65 1n4c n GLY 44 N 1.11 0.39 0.00 1.06 0.00 -1.26 -5.16 105.19 101.33 1n4c n GLY 44 Ca -0.11 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1n4c n GLY 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1n4c n LYS 45 N -0.81 -1.76 -1.87 1.61 5.02 -1.26 -4.99 118.16 114.10 1n4c n LYS 45 Ca 0.02 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.01 1n4c n LYS 45 Cb 0.56 0.00 0.14 0.00 -0.02 0.00 0.00 35.03 35.70 1n4c n LYS 45 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1n4c s GLN 46 N -2.98 1.26 0.05 1.97 -0.21 -1.26 -5.01 119.66 113.49 1n4c s GLN 46 Ca 0.00 -0.11 -0.30 0.00 0.02 0.00 0.00 55.36 54.98 1n4c s GLN 46 Cb 0.00 -1.89 -0.04 0.00 1.00 0.00 0.00 33.01 32.08 1n4c s GLN 46 CO 0.00 -2.04 0.95 0.21 -2.12 0.00 0.00 175.29 172.29 1n4c s LYS 47 N -5.69 4.61 -0.90 2.91 2.20 -1.26 -4.88 119.74 116.74 1n4c s LYS 47 Ca 0.68 1.40 -0.19 0.00 -0.36 0.00 0.00 55.97 57.50 1n4c s LYS 47 Cb -0.08 -3.42 -0.24 0.00 -1.51 0.00 0.00 37.83 32.58 1n4c s LYS 47 CO 0.51 0.09 2.34 0.00 -0.36 0.00 0.00 175.35 177.93 1n4c n ALA 48 N 3.34 0.75 -2.80 3.13 0.00 -1.26 -4.65 120.51 119.03 1n4c n ALA 48 Ca 0.04 -0.90 -0.09 0.00 0.00 0.00 0.00 53.44 52.49 1n4c n ALA 48 Cb 0.50 -2.69 0.03 0.00 0.00 0.00 0.00 19.45 17.30 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 10.83 -1.08 0.03 0.00 0.00 -1.26 -4.93 120.51 124.10 1n4c n ALA 49 Ca 0.59 -1.56 0.00 0.00 0.00 0.00 0.00 53.44 52.47 1n4c n ALA 49 Cb 0.24 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.39 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 1.74 -0.54 -3.20 0.00 5.75 -1.26 -5.02 116.55 114.02 1n4c n ASP 50 Ca 0.11 0.18 -0.24 0.00 -0.01 0.00 0.00 54.79 54.83 1n4c n ASP 50 Cb 0.61 0.74 -0.06 0.00 -1.03 0.00 0.00 41.12 41.39 1n4c n ASP 50 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1n4c n PHE 51 N -2.30 1.40 -1.20 2.11 3.01 -1.26 -4.76 117.46 114.46 1n4c n PHE 51 Ca 0.00 -3.83 0.00 0.00 1.01 0.00 0.00 57.45 54.63 1n4c n PHE 51 Cb 0.00 -0.44 0.00 0.00 -0.01 0.00 0.00 39.48 39.03 1n4c n PHE 51 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1n4c n GLU 52 N 0.72 0.00 0.00 -1.08 2.13 -1.26 -4.88 120.64 116.27 1n4c n GLU 52 Ca 0.26 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.08 1n4c n GLU 52 Cb 0.51 -0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.22 1n4c n GLU 52 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1n4c n ASP 53 N 0.00 0.03 -4.95 4.31 8.00 -1.26 -4.44 116.55 118.23 1n4c n ASP 53 Ca 0.00 -0.94 -0.23 0.00 0.71 0.00 0.00 54.79 54.33 1n4c n ASP 53 Cb 0.05 -0.01 0.05 0.00 -0.02 0.00 0.00 41.12 41.19 1n4c n ASP 53 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1n4c s LEU 54 N -0.94 3.10 -0.34 0.64 1.43 -1.26 -4.90 118.68 116.41 1n4c s LEU 54 Ca 0.00 0.19 -0.04 0.00 -1.03 0.00 0.00 54.13 53.26 1n4c s LEU 54 Cb 0.00 -2.98 -0.10 0.00 0.03 0.00 0.00 46.19 43.14 1n4c s LEU 54 CO 0.00 -1.31 2.01 0.18 0.23 0.00 0.00 176.35 177.46 1n4c n LEU 55 N -2.57 3.31 -2.73 1.79 4.77 -1.26 -3.88 117.00 116.43 1n4c n LEU 55 Ca 0.08 -2.17 -0.09 0.00 -0.03 0.00 0.00 56.01 53.80 1n4c n LEU 55 Cb 0.60 -0.83 0.09 0.00 -2.33 0.00 0.00 43.42 40.95 1n4c n LEU 55 CO 0.48 0.50 0.36 -1.20 -1.33 0.00 0.00 177.39 176.20 1n4c n SER 56 N 3.41 -2.20 -3.78 -1.43 7.64 -1.26 -5.04 113.62 110.96 1n4c n SER 56 Ca 0.29 -3.46 -0.40 0.00 1.01 0.00 0.00 58.87 56.30 1n4c n SER 56 Cb 0.31 1.72 -0.07 0.00 -1.01 0.00 0.00 64.21 65.15 1n4c n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1n4c n GLY 57 N 0.18 1.72 0.57 0.23 0.00 -1.25 -4.63 105.19 102.02 1n4c n GLY 57 Ca 0.05 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 7.48 0.73 0.30 1.61 -0.06 -1.26 -3.84 117.38 122.34 1n4c n GLN 58 Ca 0.48 0.00 0.17 0.00 -2.00 0.00 0.00 57.00 55.64 1n4c n GLN 58 Cb 0.42 -1.33 0.95 0.00 -4.06 0.00 0.00 30.24 26.22 1n4c n GLN 58 CO 0.00 0.00 0.00 0.78 -0.20 0.00 0.00 177.06 177.64 1n4c h GLY 59 N 3.85 0.00 -6.03 1.69 0.00 -1.98 -3.27 103.07 97.33 1n4c h GLY 59 Ca 0.00 0.00 -0.71 0.00 0.00 0.00 0.00 47.33 46.62 1n4c h GLY 59 CO 0.00 0.00 3.07 0.69 0.00 0.00 0.00 176.54 180.30 1n4c n PHE 60 N -3.62 3.50 0.00 5.60 3.72 -1.25 -4.08 117.46 121.33 1n4c n PHE 60 Ca -0.03 -2.97 0.00 0.00 -0.05 0.00 0.00 57.45 54.41 1n4c n PHE 60 Cb 0.11 -2.52 0.00 0.00 -0.94 0.00 0.00 39.48 36.13 1n4c n PHE 60 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1n4c n ASN 61 N 5.94 0.00 0.04 4.37 0.23 -1.23 -4.92 115.26 119.69 1n4c n ASN 61 Ca 0.51 0.00 0.21 0.00 -0.53 0.00 0.00 54.58 54.77 1n4c n ASN 61 Cb 0.39 0.00 0.57 0.00 -2.08 0.00 0.00 39.78 38.66 1n4c n ASN 61 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1n4c h ALA 62 N 1.89 2.31 -2.37 -2.53 0.00 -1.84 -3.38 119.26 113.33 1n4c h ALA 62 Ca 0.00 -0.02 -0.54 0.00 0.00 0.00 0.00 54.91 54.35 1n4c h ALA 62 Cb 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1n4c h ALA 62 CO 0.00 -1.04 0.51 -1.01 0.00 0.00 0.00 179.25 177.71 1n4c s HIS 63 N -4.42 3.50 -0.46 0.00 3.76 -1.26 -4.92 115.29 111.50 1n4c s HIS 63 Ca -0.03 1.51 -0.28 0.00 -0.15 0.00 0.00 55.06 56.11 1n4c s HIS 63 Cb 0.12 -3.25 -0.09 0.00 1.11 0.00 0.00 32.58 30.48 1n4c s HIS 63 CO 0.43 -0.54 2.37 0.36 -0.85 0.00 0.00 174.74 176.51 1n4c n LYS 64 N 4.38 1.16 -2.75 1.40 2.85 -1.26 -4.89 118.16 119.04 1n4c n LYS 64 Ca 0.08 0.16 -0.41 0.00 -1.05 0.00 0.00 58.31 57.09 1n4c n LYS 64 Cb 0.49 -3.09 -0.04 0.00 -0.65 0.00 0.00 35.03 31.73 1n4c n LYS 64 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 1n4c s ASP 65 N 10.43 7.46 -0.35 -5.58 2.15 -1.26 -4.92 116.67 124.59 1n4c s ASP 65 Ca 1.04 1.75 -0.38 0.00 0.43 0.00 0.00 52.55 55.38 1n4c s ASP 65 Cb -0.40 -2.57 -0.14 0.00 -0.30 0.00 0.00 42.92 39.50 1n4c s ASP 65 CO 0.33 -0.08 2.03 0.29 -0.17 0.00 0.00 175.17 177.58 1n4c n LYS 66 N 2.90 0.94 0.00 4.34 5.02 -1.26 -4.73 118.16 125.38 1n4c n LYS 66 Ca 0.02 0.29 0.00 0.00 -2.02 0.00 0.00 58.31 56.61 1n4c n LYS 66 Cb 0.49 -2.19 0.00 0.00 -0.02 0.00 0.00 35.03 33.31 1n4c n LYS 66 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1n4c n LYS 67 N 7.16 0.73 -0.23 1.97 5.02 -1.26 -4.86 118.16 126.69 1n4c n LYS 67 Ca 0.38 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.56 1n4c n LYS 67 Cb 0.15 -1.18 0.11 0.00 -0.02 0.00 0.00 35.03 34.09 1n4c n LYS 67 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n4c n GLY 68 N 0.54 -2.48 0.41 0.72 0.00 -1.26 -4.68 105.19 98.44 1n4c n GLY 68 Ca 0.00 -0.81 -0.09 0.00 0.00 0.00 0.00 46.02 45.12 1n4c n GLY 68 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1n4c h PRO 69 N 0.00 -0.02 -4.35 1.61 0.11 -2.04 -2.97 132.00 124.35 1n4c h PRO 69 Ca -0.14 0.00 -0.38 0.00 0.11 0.00 0.00 66.00 65.59 1n4c h PRO 69 Cb 0.48 0.00 0.06 0.00 0.11 0.00 0.00 31.00 31.66 1n4c h PRO 69 CO 0.08 -0.01 1.60 -2.13 -0.21 0.00 0.00 178.00 177.34 1n4c n ARG 70 N -5.31 0.58 -0.65 1.05 0.63 -1.26 -4.86 116.66 106.83 1n4c n ARG 70 Ca 0.04 -1.06 -0.30 0.00 -0.92 0.00 0.00 57.85 55.61 1n4c n ARG 70 Cb 0.30 -2.41 0.19 0.00 0.45 0.00 0.00 32.46 30.99 1n4c n ARG 70 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 1n4c s THR 71 N 5.46 2.05 -1.11 5.15 2.01 -1.12 -4.72 115.64 123.36 1n4c s THR 71 Ca 0.40 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.42 1n4c s THR 71 Cb 0.09 -2.04 0.00 0.00 0.01 0.00 0.00 72.50 70.56 1n4c s THR 71 CO 0.14 -0.02 0.58 0.00 -0.69 0.00 0.00 174.62 174.63 1n4c n ILE 72 N -4.41 0.65 0.02 1.82 3.06 -1.26 -0.57 119.36 118.67 1n4c n ILE 72 Ca 0.10 0.23 -0.01 0.00 -2.50 0.00 0.00 62.75 60.56 1n4c n ILE 72 Cb 0.53 -1.23 -0.10 0.00 0.54 0.00 0.00 39.64 39.38 1n4c n ILE 72 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1n4c n ALA 73 N -1.08 1.87 0.18 1.51 0.00 -1.26 -3.27 120.51 118.46 1n4c n ALA 73 Ca 0.00 -0.61 0.09 0.00 0.00 0.00 0.00 53.44 52.92 1n4c n ALA 73 Cb 0.06 -0.90 0.10 0.00 0.00 0.00 0.00 19.45 18.71 1n4c n ALA 73 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1n4c h GLU 74 N 0.00 0.00 0.00 0.00 4.57 -1.12 -3.31 114.58 114.72 1n4c h GLU 74 Ca -0.19 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 57.91 1n4c h GLU 74 Cb 1.66 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 30.24 1n4c h GLU 74 CO 0.05 0.15 -0.56 1.98 -1.18 0.00 0.00 179.01 179.45 1n4c h MET 75 N 0.00 0.00 0.00 1.92 4.05 -1.70 -3.29 114.93 115.91 1n4c h MET 75 Ca -0.01 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 1n4c h MET 75 Cb 1.13 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.93 1n4c h MET 75 CO 0.02 0.55 0.54 -0.09 0.23 0.00 0.00 176.91 178.17 1n4c h ARG 76 N -1.00 0.00 0.00 0.39 2.43 -1.69 0.83 114.38 115.34 1n4c h ARG 76 Ca -0.12 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 1n4c h ARG 76 Cb 0.79 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 1n4c h ARG 76 CO -0.07 0.00 0.33 -0.22 -1.51 0.00 0.00 179.97 178.50 1n4c h LYS 77 N 0.00 0.00 0.13 0.20 3.64 -1.64 0.27 116.57 119.17 1n4c h LYS 77 Ca 0.00 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.09 1n4c h LYS 77 Cb 1.09 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 1n4c h LYS 77 CO 0.00 0.00 -1.34 1.49 -2.27 0.00 0.00 179.45 177.33 1n4c h GLU 78 N 0.00 0.28 -0.61 1.90 4.57 -1.10 -3.26 114.58 116.36 1n4c h GLU 78 Ca 0.00 -0.48 0.12 0.00 -1.18 0.00 0.00 59.36 57.82 1n4c h GLU 78 Cb 0.66 0.18 -0.12 0.00 -0.16 0.00 0.00 28.75 29.31 1n4c h GLU 78 CO 0.00 1.20 -0.20 1.49 -1.18 0.00 0.00 179.01 180.32 1n4c h GLU 79 N 0.08 -0.04 -0.38 1.92 4.81 -0.66 2.26 114.58 122.56 1n4c h GLU 79 Ca -0.17 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 58.97 1n4c h GLU 79 Cb 2.00 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 31.37 1n4c h GLU 79 CO 0.20 -0.03 -0.13 0.52 -0.73 0.00 0.00 179.01 178.83 1n4c h MET 80 N -0.05 0.68 -0.09 1.92 2.86 -1.68 -2.02 114.93 116.56 1n4c h MET 80 Ca 0.29 -0.22 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1n4c h MET 80 Cb 0.49 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.09 1n4c h MET 80 CO -0.65 0.79 0.00 0.00 1.06 0.00 0.00 176.91 178.11 1n4c n ALA 81 N -2.49 2.56 0.75 6.32 0.00 0.68 -3.68 120.51 124.65 1n4c n ALA 81 Ca 0.01 -0.43 0.13 0.00 0.00 0.00 0.00 53.44 53.15 1n4c n ALA 81 Cb 0.36 -1.16 0.47 0.00 0.00 0.00 0.00 19.45 19.12 1n4c n ALA 81 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1n4c n LYS 82 N 0.07 0.18 -2.70 0.00 4.81 0.73 -4.55 118.16 116.69 1n4c n LYS 82 Ca 0.17 0.14 -0.04 0.00 -0.87 0.00 0.00 58.31 57.72 1n4c n LYS 82 Cb 0.29 -1.71 0.03 0.00 0.02 0.00 0.00 35.03 33.67 1n4c n LYS 82 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1n4c n GLU 83 N -2.02 0.27 -0.45 1.64 2.13 -1.24 -5.00 120.64 115.97 1n4c n GLU 83 Ca 0.06 -1.23 -0.01 0.00 0.66 0.00 0.00 57.16 56.64 1n4c n GLU 83 Cb 0.40 -0.48 -0.01 0.00 0.27 0.00 0.00 31.44 31.62 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 2.62 0.90 -1.54 5.31 0.00 -1.26 -4.86 117.12 118.29 1n4c n MET 84 Ca 0.13 -0.07 -0.45 0.00 -0.00 0.00 0.00 57.70 57.31 1n4c n MET 84 Cb 0.62 -1.16 -0.02 0.00 0.00 0.00 0.00 33.22 32.67 1n4c n MET 84 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 1n4c n ASP 85 N 1.67 0.61 0.00 6.12 -0.08 -1.26 -4.72 116.55 118.89 1n4c n ASP 85 Ca 0.03 1.14 0.01 0.00 -1.51 0.00 0.00 54.79 54.46 1n4c n ASP 85 Cb 0.44 -1.21 0.06 0.00 2.34 0.00 0.00 41.12 42.75 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 0.74 0.05 -0.05 -0.67 -0.04 -1.26 -1.09 135.00 132.68 1n4c n PRO 86 Ca 0.11 0.09 -0.11 0.00 -0.04 0.00 0.00 63.50 63.56 1n4c n PRO 86 Cb 0.31 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.13 1n4c n PRO 86 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1n4c n GLU 87 N -1.10 0.67 0.11 0.54 -0.58 -1.26 -4.03 120.64 114.99 1n4c n GLU 87 Ca 0.01 0.18 -0.02 0.00 -0.42 0.00 0.00 57.16 56.91 1n4c n GLU 87 Cb 0.01 -1.67 0.05 0.00 -0.57 0.00 0.00 31.44 29.26 1n4c n GLU 87 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1n4c h LYS 88 N 0.01 0.00 -0.78 3.49 1.79 -1.43 -3.10 116.57 116.55 1n4c h LYS 88 Ca -0.42 0.00 0.18 0.00 -2.18 0.00 0.00 60.65 58.23 1n4c h LYS 88 Cb 2.09 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 32.69 1n4c h LYS 88 CO 0.05 0.73 0.53 1.25 -1.08 0.00 0.00 179.45 180.93 1n4c h LEU 89 N 0.00 0.30 -1.50 2.94 5.85 -1.62 0.54 115.31 121.82 1n4c h LEU 89 Ca -0.01 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 1n4c h LEU 89 Cb 1.39 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.38 1n4c h LEU 89 CO 0.09 0.14 -0.15 0.11 -0.34 0.00 0.00 178.44 178.29 1n4c h LYS 90 N 0.31 0.14 0.00 1.25 6.56 -1.72 -2.85 116.57 120.25 1n4c h LYS 90 Ca 0.39 -0.03 -0.09 0.00 -1.06 0.00 0.00 60.65 59.86 1n4c h LYS 90 Cb 1.07 -0.02 0.01 0.00 -0.57 0.00 0.00 32.23 32.71 1n4c h LYS 90 CO -0.11 0.30 -0.33 0.82 -2.06 0.00 0.00 179.45 178.07 1n4c h ILE 91 N 0.13 1.53 -0.73 1.86 2.04 -0.10 -3.00 117.51 119.23 1n4c h ILE 91 Ca 0.03 -2.01 0.21 0.00 1.00 0.00 0.00 64.86 64.09 1n4c h ILE 91 Cb 0.35 2.77 -0.03 0.00 -0.74 0.00 0.00 36.82 39.17 1n4c h ILE 91 CO 0.02 0.56 0.66 -0.07 0.00 0.00 0.00 178.15 179.31 1n4c h LEU 92 N -0.43 0.00 0.00 1.44 3.38 -1.15 0.65 115.31 119.20 1n4c h LEU 92 Ca -0.04 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.70 1n4c h LEU 92 Cb 1.09 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.81 1n4c h LEU 92 CO 0.07 0.00 -1.17 -0.33 0.09 0.00 0.00 178.44 177.10 1n4c h GLU 93 N 0.00 0.00 -0.12 1.13 5.08 -1.47 -3.06 114.58 116.14 1n4c h GLU 93 Ca 0.35 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.56 1n4c h GLU 93 Cb 1.66 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.91 1n4c h GLU 93 CO -0.00 0.86 -0.49 2.35 -1.00 0.00 0.00 179.01 180.72 1n4c h TRP 94 N 0.00 0.73 -0.21 4.33 7.01 0.41 -3.12 115.95 125.10 1n4c h TRP 94 Ca -0.08 -0.31 -0.10 0.00 2.11 0.00 0.00 58.89 60.51 1n4c h TRP 94 Cb 1.82 -0.12 -0.00 0.00 -2.10 0.00 0.00 29.16 28.76 1n4c h TRP 94 CO 0.00 1.08 -0.28 -0.84 -2.79 0.00 0.00 178.44 175.62 1n4c h ILE 95 N 0.16 1.33 0.00 2.65 3.07 -1.39 -2.87 117.51 120.46 1n4c h ILE 95 Ca -0.03 -1.47 0.00 0.00 1.55 0.00 0.00 64.86 64.91 1n4c h ILE 95 Cb 1.13 1.79 0.00 0.00 -0.27 0.00 0.00 36.82 39.47 1n4c h ILE 95 CO 0.10 0.45 0.00 -1.84 -1.05 0.00 0.00 178.15 175.82 1n4c n GLU 96 N -4.35 0.05 0.03 0.16 0.28 -1.16 -1.39 120.64 114.26 1n4c n GLU 96 Ca -0.05 0.29 -0.19 0.00 -0.16 0.00 0.00 57.16 57.04 1n4c n GLU 96 Cb 0.46 -1.50 -0.11 0.00 1.43 0.00 0.00 31.44 31.72 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 1.44 0.64 -5.00 -1.84 0.00 -1.43 -3.43 103.07 93.45 1n4c h GLY 97 Ca 0.00 -1.15 -0.15 0.00 0.00 0.00 0.00 47.33 46.03 1n4c h GLY 97 CO 0.00 1.02 -0.14 0.58 0.00 0.00 0.00 176.54 178.00 1n4c n LYS 98 N -4.00 0.44 0.00 4.80 2.85 -0.96 -4.98 118.16 116.31 1n4c n LYS 98 Ca -0.11 -1.14 0.00 0.00 -1.05 0.00 0.00 58.31 56.01 1n4c n LYS 98 Cb 0.81 -0.54 0.00 0.00 -0.65 0.00 0.00 35.03 34.65 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 0.75 0.56 -1.13 -1.58 0.28 -0.49 -2.53 120.64 116.51 1n4c n GLU 99 Ca 0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 57.03 1n4c n GLU 99 Cb 0.72 -1.24 0.02 0.00 1.43 0.00 0.00 31.44 32.37 1n4c n GLU 99 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 1n4c n ARG 100 N 0.54 0.02 -3.17 3.44 0.63 -1.26 -4.73 116.66 112.14 1n4c n ARG 100 Ca 0.00 -1.66 -0.21 0.00 -0.92 0.00 0.00 57.85 55.06 1n4c n ARG 100 Cb 0.23 -0.20 -0.05 0.00 0.45 0.00 0.00 32.46 32.89 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 0.30 0.32 -0.41 6.15 5.15 -1.05 -4.90 115.26 120.81 1n4c n ASN 101 Ca 0.04 -2.86 0.36 0.00 -0.60 0.00 0.00 54.58 51.52 1n4c n ASN 101 Cb 0.98 -0.51 0.64 0.00 -0.53 0.00 0.00 39.78 40.36 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 1.62 0.03 -0.83 -1.44 -0.00 -1.84 0.57 117.51 115.63 1n4c h ILE 102 Ca 0.07 -0.01 0.08 0.00 -0.00 0.00 0.00 64.86 65.00 1n4c h ILE 102 Cb 0.93 0.00 -0.07 0.00 -0.00 0.00 0.00 36.82 37.68 1n4c h ILE 102 CO 0.47 0.01 0.49 0.08 -0.00 0.00 0.00 178.15 179.19 1n4c h ARG 103 N 0.03 0.83 0.20 2.19 0.11 -1.96 -2.49 114.38 113.29 1n4c h ARG 103 Ca 0.86 -0.05 -0.32 0.00 0.10 0.00 0.00 59.98 60.57 1n4c h ARG 103 Cb 2.56 -0.19 0.02 0.00 1.11 0.00 0.00 29.97 33.47 1n4c h ARG 103 CO -0.57 0.55 -1.44 0.00 0.10 0.00 0.00 179.97 178.62 1n4c h ALA 104 N 1.43 -0.03 -0.52 0.08 0.00 -0.27 -3.04 119.26 116.90 1n4c h ALA 104 Ca 0.38 -0.91 0.08 0.00 0.00 0.00 0.00 54.91 54.47 1n4c h ALA 104 Cb 0.27 0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.15 1n4c h ALA 104 CO -0.21 0.84 0.14 -0.07 0.00 0.00 0.00 179.25 179.95 1n4c h LEU 105 N 0.12 0.08 -0.81 0.00 3.38 -1.01 0.57 115.31 117.64 1n4c h LEU 105 Ca -0.23 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1n4c h LEU 105 Cb 2.10 0.10 -0.00 0.00 0.09 0.00 0.00 40.66 42.94 1n4c h LEU 105 CO 0.24 0.07 -0.08 0.17 0.09 0.00 0.00 178.44 178.93 1n4c h LEU 106 N 0.29 0.00 -1.82 1.67 8.10 -1.57 -1.11 115.31 120.87 1n4c h LEU 106 Ca 0.26 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.25 1n4c h LEU 106 Cb 0.33 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.55 1n4c h LEU 106 CO -0.31 0.08 0.00 -1.20 -4.11 0.00 0.00 178.44 172.90 1n4c n SER 107 N -3.16 2.76 0.00 0.17 7.64 0.13 -4.18 113.62 116.99 1n4c n SER 107 Ca 0.02 -1.89 0.00 0.00 1.01 0.00 0.00 58.87 58.01 1n4c n SER 107 Cb 0.43 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.52 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 1.08 0.04 0.25 0.44 -2.24 0.18 -4.58 114.28 109.45 1n4c n THR 108 Ca 0.17 -0.23 0.13 0.00 -2.27 0.00 0.00 64.05 61.86 1n4c n THR 108 Cb 0.53 1.51 0.64 0.00 -2.10 0.00 0.00 70.33 70.91 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 0.00 -0.78 -1.53 -1.37 -2.84 114.93 108.41 1n4c h MET 109 Ca 0.00 0.00 -0.00 0.00 -3.44 0.00 0.00 59.70 56.26 1n4c h MET 109 Cb 0.34 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.39 1n4c h MET 109 CO 0.00 0.13 -0.02 1.12 0.14 0.00 0.00 176.91 178.28 1n4c h HIS 110 N 0.00 0.00 0.00 1.39 2.07 -1.86 -0.38 115.15 116.37 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 0.52 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.50 1n4c h HIS 110 CO 0.00 0.02 0.00 0.25 -3.07 0.00 0.00 177.93 175.13 1n4c n THR 111 N -3.95 0.00 -2.21 6.12 -2.24 -1.07 -3.41 114.28 107.51 1n4c n THR 111 Ca -0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1n4c n THR 111 Cb 0.11 -0.35 -0.01 0.00 -2.10 0.00 0.00 70.33 67.98 1n4c n THR 111 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1n4c n VAL 112 N -0.74 0.00 -2.14 2.28 0.24 -0.16 -5.07 118.33 112.74 1n4c n VAL 112 Ca 0.09 -0.43 -0.27 0.00 -2.04 0.00 0.00 64.34 61.69 1n4c n VAL 112 Cb 0.04 0.65 0.11 0.00 -1.47 0.00 0.00 33.84 33.18 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 2.77 0.01 1.34 1.43 -1.14 -4.96 118.68 118.12 1n4c s LEU 113 Ca 0.15 0.31 -0.21 0.00 -1.03 0.00 0.00 54.13 53.35 1n4c s LEU 113 Cb 0.17 -2.70 -0.05 0.00 0.03 0.00 0.00 46.19 43.63 1n4c s LEU 113 CO -0.07 -2.03 0.60 -1.66 0.23 0.00 0.00 176.35 173.42 1n4c s TRP 114 N -3.47 3.70 -0.28 0.29 -2.14 -1.26 -4.97 118.94 110.80 1n4c s TRP 114 Ca 0.66 1.22 -0.30 0.00 2.66 0.00 0.00 56.10 60.33 1n4c s TRP 114 Cb -0.08 -2.61 -0.07 0.00 -3.10 0.00 0.00 33.47 27.61 1n4c s TRP 114 CO 0.48 0.37 2.23 0.00 -2.66 0.00 0.00 176.95 177.37 1n4c n ALA 115 N 2.63 1.51 0.00 2.67 0.00 -1.26 -3.12 120.51 122.94 1n4c n ALA 115 Ca -0.07 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1n4c n ALA 115 Cb 0.51 -2.81 0.00 0.00 0.00 0.00 0.00 19.45 17.14 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 6.05 2.23 3.56 0.00 0.00 -1.26 -5.08 105.19 110.68 1n4c n GLY 116 Ca 0.34 -0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1n4c n GLY 116 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1n4c s GLU 117 N 0.00 3.38 0.00 1.61 2.56 -1.18 -4.80 118.70 120.27 1n4c s GLU 117 Ca 0.00 -0.02 0.17 0.00 0.00 0.00 0.00 54.97 55.12 1n4c s GLU 117 Cb 0.00 -4.07 0.10 0.00 2.00 0.00 0.00 34.13 32.16 1n4c s GLU 117 CO 0.00 -1.77 1.00 0.25 -0.56 0.00 0.00 175.26 174.19 1n4c n THR 118 N 6.47 0.00 0.20 -1.70 -2.24 -1.26 -4.38 114.28 111.38 1n4c n THR 118 Ca 0.05 -0.46 0.09 0.00 -2.27 0.00 0.00 64.05 61.46 1n4c n THR 118 Cb 0.49 1.32 0.32 0.00 -2.10 0.00 0.00 70.33 70.35 1n4c n THR 118 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1n4c h LYS 119 N 3.02 0.00 -6.62 -0.78 1.57 -2.03 -3.44 116.57 108.29 1n4c h LYS 119 Ca 0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 1n4c h LYS 119 Cb 0.68 0.00 0.05 0.00 0.08 0.00 0.00 32.23 33.04 1n4c h LYS 119 CO 0.00 0.26 1.00 -0.46 -0.57 0.00 0.00 179.45 179.68 1n4c s TRP 120 N -3.41 2.80 -0.58 -1.35 -0.11 -1.26 -4.95 118.94 110.07 1n4c s TRP 120 Ca 0.02 0.34 -0.06 0.00 1.22 0.00 0.00 56.10 57.62 1n4c s TRP 120 Cb 0.09 -4.10 0.15 0.00 -1.50 0.00 0.00 33.47 28.11 1n4c s TRP 120 CO 0.66 -4.22 0.42 0.15 -4.62 0.00 0.00 176.95 169.35 1n4c s LYS 121 N 1.48 2.58 0.12 5.86 -0.14 -1.26 -5.06 119.74 123.32 1n4c s LYS 121 Ca 0.75 -2.21 -0.28 0.00 -1.36 0.00 0.00 55.97 52.87 1n4c s LYS 121 Cb -0.48 -3.85 -0.16 0.00 -1.68 0.00 0.00 37.83 31.67 1n4c s LYS 121 CO 0.33 -1.18 0.61 -2.30 -0.76 0.00 0.00 175.35 172.05 1n4c n PRO 122 N 4.09 0.00 -3.22 -1.68 -0.02 -1.26 -4.88 135.00 128.03 1n4c n PRO 122 Ca 0.03 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.11 1n4c n PRO 122 Cb 0.40 -1.02 -0.07 0.00 -0.02 0.00 0.00 33.50 32.79 1n4c n PRO 122 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1n4c s VAL 123 N -0.60 5.07 0.07 -1.45 1.01 -1.26 -5.01 120.40 118.22 1n4c s VAL 123 Ca 0.64 0.95 -0.31 0.00 0.00 0.00 0.00 61.98 63.27 1n4c s VAL 123 Cb -0.92 -3.85 -0.09 0.00 0.00 0.00 0.00 36.38 31.52 1n4c s VAL 123 CO 0.50 0.11 1.76 -0.83 0.00 0.00 0.00 175.10 176.63 1n4c s GLY 124 N 1.39 1.47 0.63 4.51 0.00 -1.26 -4.78 107.32 109.28 1n4c s GLY 124 Ca 0.23 1.28 0.17 0.00 0.00 0.00 0.00 44.72 46.41 1n4c s GLY 124 CO 0.09 3.07 1.36 -0.33 0.00 0.00 0.00 173.10 177.29 1n4c h MET 125 N 8.84 0.00 0.00 2.90 2.86 -1.95 2.71 114.93 130.29 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 -0.29 0.00 1.06 0.00 0.00 176.91 178.62 1n4c n ALA 126 N -1.92 2.77 -0.68 6.32 0.00 -1.26 -3.75 120.51 121.99 1n4c n ALA 126 Ca 0.09 -0.18 -0.18 0.00 0.00 0.00 0.00 53.44 53.16 1n4c n ALA 126 Cb 1.04 -1.30 0.13 0.00 0.00 0.00 0.00 19.45 19.32 1n4c n ALA 126 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1n4c n ASP 127 N -1.85 3.77 -1.84 0.00 9.92 0.91 -4.14 116.55 123.32 1n4c n ASP 127 Ca 0.05 -3.21 0.03 0.00 -0.53 0.00 0.00 54.79 51.13 1n4c n ASP 127 Cb 0.39 -0.77 0.03 0.00 -0.64 0.00 0.00 41.12 40.13 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 -0.70 1.16 -0.37 0.64 -0.00 -1.25 -4.77 117.00 111.72 1n4c n LEU 128 Ca 0.45 -2.28 0.10 0.00 -0.00 0.00 0.00 56.01 54.28 1n4c n LEU 128 Cb 1.33 0.12 0.43 0.00 -0.00 0.00 0.00 43.42 45.30 1n4c n LEU 128 CO 0.46 0.64 0.80 1.33 -0.00 0.00 0.00 177.39 180.62 1n4c n VAL 129 N 0.21 0.14 -4.29 1.47 0.24 -1.26 -4.78 118.33 110.06 1n4c n VAL 129 Ca 0.06 -0.23 -0.21 0.00 -2.04 0.00 0.00 64.34 61.93 1n4c n VAL 129 Cb 1.06 0.16 -0.16 0.00 -1.47 0.00 0.00 33.84 33.43 1n4c n VAL 129 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1n4c s THR 130 N -1.86 0.68 0.52 3.34 -4.23 -1.26 -4.86 115.64 107.97 1n4c s THR 130 Ca 0.31 -0.24 0.36 0.00 -1.18 0.00 0.00 61.69 60.95 1n4c s THR 130 Cb 0.16 -0.66 0.56 0.00 1.34 0.00 0.00 72.50 73.91 1n4c s THR 130 CO 0.25 0.24 1.74 -0.65 -0.54 0.00 0.00 174.62 175.66 1n4c h PRO 131 N 6.92 0.06 -0.31 3.99 0.11 -1.90 0.35 132.00 141.21 1n4c h PRO 131 Ca -0.36 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.73 1n4c h PRO 131 Cb 1.16 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1n4c h PRO 131 CO 0.48 0.04 0.12 0.93 -0.21 0.00 0.00 178.00 179.36 1n4c h GLU 132 N 0.06 0.46 -0.69 1.05 3.07 -1.97 1.04 114.58 117.60 1n4c h GLU 132 Ca 0.67 -0.09 0.02 0.00 -0.50 0.00 0.00 59.36 59.47 1n4c h GLU 132 Cb 2.50 -0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 30.29 1n4c h GLU 132 CO -0.09 0.48 0.46 1.96 -1.40 0.00 0.00 179.01 180.41 1n4c h GLN 133 N 0.34 0.85 0.03 2.33 4.20 -0.64 0.41 115.11 122.64 1n4c h GLN 133 Ca 0.10 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.76 1n4c h GLN 133 Cb 0.19 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1n4c h GLN 133 CO -0.01 0.56 -0.01 0.28 -0.67 0.00 0.00 178.83 178.98 1n4c h VAL 134 N 0.87 0.93 -0.55 -0.54 2.07 -1.08 -2.99 116.25 114.97 1n4c h VAL 134 Ca 0.27 -1.61 0.03 0.00 0.82 0.00 0.00 66.70 66.20 1n4c h VAL 134 Cb -0.01 1.73 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 1n4c h VAL 134 CO -0.07 0.30 0.33 0.50 0.02 0.00 0.00 177.57 178.65 1n4c h LYS 135 N -0.98 0.63 -1.00 1.57 3.64 0.12 0.35 116.57 120.91 1n4c h LYS 135 Ca -0.00 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.36 1n4c h LYS 135 Cb 0.53 -0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.15 1n4c h LYS 135 CO 0.01 0.42 0.66 -0.22 -2.27 0.00 0.00 179.45 178.04 1n4c h LYS 136 N 0.65 1.27 0.05 1.90 1.63 -0.30 -2.53 116.57 119.24 1n4c h LYS 136 Ca 0.22 -0.08 -0.24 0.00 -0.85 0.00 0.00 60.65 59.71 1n4c h LYS 136 Cb 0.03 -0.29 -0.02 0.00 -0.60 0.00 0.00 32.23 31.36 1n4c h LYS 136 CO -0.10 0.84 -1.13 0.28 -3.45 0.00 0.00 179.45 175.88 1n4c h VAL 137 N 1.30 1.59 -0.70 2.00 2.07 -1.24 -3.18 116.25 118.08 1n4c h VAL 137 Ca 0.38 -3.25 0.20 0.00 0.82 0.00 0.00 66.70 64.86 1n4c h VAL 137 Cb -0.07 2.87 -0.03 0.00 -1.52 0.00 0.00 31.29 32.54 1n4c h VAL 137 CO -0.11 0.93 0.66 0.22 0.02 0.00 0.00 177.57 179.29 1n4c h TYR 138 N 0.03 0.00 0.44 1.57 3.20 0.13 0.23 116.97 122.57 1n4c h TYR 138 Ca -0.07 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.77 1n4c h TYR 138 Cb 1.86 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.14 1n4c h TYR 138 CO 0.03 0.00 -0.21 -0.09 -1.64 0.00 0.00 178.16 176.24 1n4c h ARG 139 N 0.00 -0.57 -0.55 1.82 2.43 -1.52 -2.79 114.38 113.19 1n4c h ARG 139 Ca 0.33 0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.53 1n4c h ARG 139 Cb 1.64 0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 31.30 1n4c h ARG 139 CO -0.00 -0.33 0.31 -0.22 -1.51 0.00 0.00 179.97 178.22 1n4c h LYS 140 N -1.11 0.77 -0.94 0.20 1.63 -1.26 -1.80 116.57 114.05 1n4c h LYS 140 Ca -0.06 -0.08 0.21 0.00 -0.85 0.00 0.00 60.65 59.86 1n4c h LYS 140 Cb 0.51 -0.15 -0.08 0.00 -0.60 0.00 0.00 32.23 31.91 1n4c h LYS 140 CO 0.10 0.58 0.61 0.00 -3.45 0.00 0.00 179.45 177.29 1n4c h ALA 141 N 1.14 2.12 0.00 5.00 0.00 -0.71 0.68 119.26 127.50 1n4c h ALA 141 Ca 0.20 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 1n4c h ALA 141 Cb 0.03 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1n4c h ALA 141 CO -0.03 -0.43 -0.59 0.28 0.00 0.00 0.00 179.25 178.48 1n4c h VAL 142 N 0.47 1.36 0.00 0.00 2.07 -1.05 -2.84 116.25 116.26 1n4c h VAL 142 Ca 0.50 -2.05 -0.09 0.00 0.82 0.00 0.00 66.70 65.88 1n4c h VAL 142 Cb 1.16 2.12 -0.01 0.00 -1.52 0.00 0.00 31.29 33.04 1n4c h VAL 142 CO -0.22 0.58 -0.44 -0.07 0.02 0.00 0.00 177.57 177.44 1n4c h LEU 143 N 0.00 0.00 -1.99 2.57 3.38 0.73 -2.78 115.31 117.22 1n4c h LEU 143 Ca -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1n4c h LEU 143 Cb 1.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 1n4c h LEU 143 CO 0.08 0.44 -0.08 0.58 0.09 0.00 0.00 178.44 179.55 1n4c h VAL 144 N 0.00 0.86 -0.11 1.22 2.07 -1.07 -2.69 116.25 116.53 1n4c h VAL 144 Ca -0.00 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 1n4c h VAL 144 Cb 0.85 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.76 1n4c h VAL 144 CO 0.06 0.07 -0.12 1.33 0.02 0.00 0.00 177.57 178.93 1n4c n VAL 145 N -4.16 2.16 -1.89 2.57 0.24 -1.07 -5.00 118.33 111.17 1n4c n VAL 145 Ca -0.03 -2.49 -0.42 0.00 -2.04 0.00 0.00 64.34 59.36 1n4c n VAL 145 Cb 0.16 -0.26 -0.03 0.00 -1.47 0.00 0.00 33.84 32.24 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 -3.01 2.36 0.34 6.34 5.04 -1.02 -4.83 115.29 120.51 1n4c s HIS 146 Ca 0.38 0.25 0.20 0.00 -1.54 0.00 0.00 55.06 54.34 1n4c s HIS 146 Cb 0.33 -4.00 1.22 0.00 0.04 0.00 0.00 32.58 30.17 1n4c s HIS 146 CO 0.01 -4.05 1.42 -2.30 -2.34 0.00 0.00 174.74 167.48 1n4c n PRO 147 N 5.66 -0.05 -0.31 2.88 -0.02 -1.26 -0.80 135.00 141.09 1n4c n PRO 147 Ca 0.16 1.23 0.16 0.00 -2.02 0.00 0.00 63.50 63.04 1n4c n PRO 147 Cb 0.40 -2.23 0.34 0.00 -0.02 0.00 0.00 33.50 31.99 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 -0.01 -0.55 2.55 3.58 -1.97 0.70 116.42 120.72 1n4c h ASP 148 Ca 0.77 0.22 0.00 0.00 0.42 0.00 0.00 57.03 58.43 1n4c h ASP 148 Cb 2.06 0.30 0.00 0.00 1.72 0.00 0.00 39.33 43.40 1n4c h ASP 148 CO -0.67 -0.22 0.00 2.29 -2.88 0.00 0.00 179.24 177.76 1n4c n LYS 149 N -5.26 2.50 -1.32 0.28 0.00 0.02 -4.05 118.16 110.33 1n4c n LYS 149 Ca 0.25 -2.07 -0.02 0.00 -0.00 0.00 0.00 58.31 56.47 1n4c n LYS 149 Cb 0.79 -1.51 0.11 0.00 -0.00 0.00 0.00 35.03 34.42 1n4c n LYS 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1n4c n ALA 150 N 1.07 3.62 -2.55 0.58 0.00 0.24 -4.85 120.51 118.63 1n4c n ALA 150 Ca 0.19 -3.18 -0.41 0.00 0.00 0.00 0.00 53.44 50.05 1n4c n ALA 150 Cb 0.53 -0.47 -0.09 0.00 0.00 0.00 0.00 19.45 19.42 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 -2.97 5.18 0.00 0.00 2.01 -1.06 -4.24 115.64 114.55 1n4c s THR 151 Ca 0.39 0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.44 1n4c s THR 151 Cb 0.38 -3.80 0.00 0.00 0.01 0.00 0.00 72.50 69.09 1n4c s THR 151 CO -0.06 -0.07 0.00 0.61 -0.69 0.00 0.00 174.62 174.41 1n4c n GLY 152 N 4.96 0.96 3.70 4.40 0.00 -1.26 -4.93 105.19 113.02 1n4c n GLY 152 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1n4c n GLY 152 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n4c s GLN 153 N -0.11 4.35 0.39 1.61 -1.52 -1.26 -4.84 119.66 118.28 1n4c s GLN 153 Ca 0.00 1.83 0.20 0.00 -1.95 0.00 0.00 55.36 55.44 1n4c s GLN 153 Cb 0.00 -3.47 0.70 0.00 -0.22 0.00 0.00 33.01 30.02 1n4c s GLN 153 CO 0.00 -0.43 0.88 -2.30 -0.25 0.00 0.00 175.29 173.20 1n4c n PRO 154 N 4.75 0.01 -1.62 2.91 -0.02 -1.26 -0.13 135.00 139.63 1n4c n PRO 154 Ca 0.11 0.68 -0.37 0.00 -2.02 0.00 0.00 63.50 61.90 1n4c n PRO 154 Cb 0.45 -1.67 0.06 0.00 -0.02 0.00 0.00 33.50 32.32 1n4c n PRO 154 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 1n4c n TYR 155 N -2.70 3.09 0.19 6.00 4.11 -1.26 -4.71 117.16 121.88 1n4c n TYR 155 Ca 0.18 -2.67 -0.08 0.00 -0.00 0.00 0.00 57.90 55.33 1n4c n TYR 155 Cb 1.07 -1.32 -0.04 0.00 -0.00 0.00 0.00 39.34 39.05 1n4c n TYR 155 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.86 177.79 1n4c h GLU 156 N 2.50 -0.50 -0.90 -3.48 5.08 -0.75 -3.23 114.58 113.31 1n4c h GLU 156 Ca 0.59 0.03 0.17 0.00 -1.00 0.00 0.00 59.36 59.15 1n4c h GLU 156 Cb 0.42 0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.71 1n4c h GLU 156 CO 1.51 -0.33 0.58 0.37 -1.00 0.00 0.00 179.01 180.14 1n4c h GLN 157 N -0.85 0.59 -1.00 2.33 5.75 -1.87 -0.09 115.11 119.97 1n4c h GLN 157 Ca -0.05 -0.04 0.30 0.00 -0.15 0.00 0.00 58.65 58.71 1n4c h GLN 157 Cb 0.40 -0.13 -0.14 0.00 1.07 0.00 0.00 27.48 28.67 1n4c h GLN 157 CO 0.09 0.39 0.58 1.88 -2.65 0.00 0.00 178.83 179.11 1n4c h TYR 158 N 0.60 0.96 0.43 3.99 -1.99 -1.89 -0.35 116.97 118.72 1n4c h TYR 158 Ca 0.47 0.04 -0.02 0.00 2.00 0.00 0.00 58.73 61.21 1n4c h TYR 158 Cb 0.88 -0.26 0.00 0.00 2.00 0.00 0.00 36.73 39.35 1n4c h TYR 158 CO -0.00 -0.10 -0.21 0.00 -0.00 0.00 0.00 178.16 177.85 1n4c h ALA 159 N 1.81 -0.58 -0.57 3.88 0.00 -1.06 -1.46 119.26 121.28 1n4c h ALA 159 Ca 0.71 -0.19 0.12 0.00 0.00 0.00 0.00 54.91 55.55 1n4c h ALA 159 Cb 1.55 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 19.53 1n4c h ALA 159 CO -0.57 -0.67 0.39 -0.22 0.00 0.00 0.00 179.25 178.18 1n4c h LYS 160 N -0.88 0.26 0.02 0.00 3.64 -1.19 1.46 116.57 119.89 1n4c h LYS 160 Ca -0.06 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1n4c h LYS 160 Cb 0.56 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1n4c h LYS 160 CO 0.10 0.17 -0.01 0.52 -2.27 0.00 0.00 179.45 177.96 1n4c h MET 161 N 0.27 -0.03 0.00 1.90 2.86 -1.02 -3.21 114.93 115.70 1n4c h MET 161 Ca 0.27 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.78 1n4c h MET 161 Cb 0.70 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.35 1n4c h MET 161 CO -0.06 0.64 -0.64 0.82 1.06 0.00 0.00 176.91 178.73 1n4c h ILE 162 N -0.74 1.14 0.44 -1.22 2.04 -0.78 -3.22 117.51 115.17 1n4c h ILE 162 Ca -0.00 -2.50 -0.02 0.00 1.00 0.00 0.00 64.86 63.34 1n4c h ILE 162 Cb 0.68 2.49 0.00 0.00 -0.74 0.00 0.00 36.82 39.25 1n4c h ILE 162 CO 0.01 0.63 -0.21 0.15 0.00 0.00 0.00 178.15 178.72 1n4c h PHE 163 N 0.00 -0.55 -0.70 1.37 3.04 0.19 -2.19 116.94 118.10 1n4c h PHE 163 Ca -0.01 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 61.91 1n4c h PHE 163 Cb 1.43 0.18 -0.03 0.00 2.56 0.00 0.00 35.95 40.09 1n4c h PHE 163 CO 0.00 -0.30 0.36 0.52 -2.02 0.00 0.00 178.31 176.87 1n4c h MET 164 N -0.68 0.99 -0.89 1.11 2.86 -1.67 -2.51 114.93 114.14 1n4c h MET 164 Ca -0.06 -0.13 0.10 0.00 -2.06 0.00 0.00 59.70 57.54 1n4c h MET 164 Cb 0.50 -0.19 -0.08 0.00 0.06 0.00 0.00 31.60 31.90 1n4c h MET 164 CO 0.10 0.77 0.53 0.93 1.06 0.00 0.00 176.91 180.30 1n4c h GLU 165 N 0.97 0.86 -0.13 1.72 4.39 -1.54 1.09 114.58 121.94 1n4c h GLU 165 Ca 0.24 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.88 1n4c h GLU 165 Cb 0.08 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 1n4c h GLU 165 CO -0.03 0.57 0.04 -0.07 -1.16 0.00 0.00 179.01 178.35 1n4c h LEU 166 N 0.88 0.20 0.00 1.33 -0.00 -0.96 -2.83 115.31 113.93 1n4c h LEU 166 Ca 0.43 -0.21 0.00 0.00 -0.00 0.00 0.00 57.88 58.10 1n4c h LEU 166 Cb 0.37 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 40.98 1n4c h LEU 166 CO -0.24 0.35 -0.20 -3.20 -0.00 0.00 0.00 178.44 175.15 1n4c n ASN 167 N -4.86 0.25 -0.03 -0.43 2.85 -0.84 -3.23 115.26 108.98 1n4c n ASN 167 Ca -0.05 0.23 -0.00 0.00 -0.11 0.00 0.00 54.58 54.65 1n4c n ASN 167 Cb 0.14 -0.23 -0.00 0.00 1.24 0.00 0.00 39.78 40.93 1n4c n ASN 167 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 1n4c h ASP 168 N 0.00 -0.02 0.03 1.20 5.19 0.14 -3.30 116.42 119.66 1n4c h ASP 168 Ca 0.00 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1n4c h ASP 168 Cb 0.52 0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.04 1n4c h ASP 168 CO 0.00 0.41 -0.02 0.00 -3.12 0.00 0.00 179.24 176.50 1n4c h ALA 169 N -1.14 1.77 -0.90 3.45 0.00 -1.67 -1.81 119.26 118.96 1n4c h ALA 169 Ca -0.00 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.01 1n4c h ALA 169 Cb 0.02 -0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.72 1n4c h ALA 169 CO 0.00 0.03 0.52 2.35 0.00 0.00 0.00 179.25 182.15 1n4c h TRP 170 N 0.00 0.93 -0.12 0.00 2.91 -1.64 1.02 115.95 119.05 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 0.05 -0.28 -0.01 0.00 -0.51 0.00 0.00 29.16 28.41 1n4c h TRP 170 CO 0.00 0.31 -0.05 0.77 -1.03 0.00 0.00 178.44 178.44 1n4c h SER 171 N 0.79 0.15 0.24 2.65 0.02 -1.40 -0.32 113.55 115.68 1n4c h SER 171 Ca 0.46 -0.02 -0.32 0.00 -0.84 0.00 0.00 61.79 61.08 1n4c h SER 171 Cb 0.55 -0.04 0.03 0.00 0.14 0.00 0.00 62.40 63.08 1n4c h SER 171 CO -0.30 0.24 -1.41 -0.08 -1.14 0.00 0.00 176.83 174.14 1n4c h GLU 172 N 0.16 0.50 -0.90 3.45 4.57 -0.03 -1.95 114.58 120.39 1n4c h GLU 172 Ca 0.04 -0.85 -0.00 0.00 -1.18 0.00 0.00 59.36 57.36 1n4c h GLU 172 Cb 0.21 0.32 -0.04 0.00 -0.16 0.00 0.00 28.75 29.07 1n4c h GLU 172 CO 0.01 1.41 0.54 0.35 -1.18 0.00 0.00 179.01 180.14 1n4c h PHE 173 N 0.06 1.17 -0.05 0.92 3.57 0.13 2.04 116.94 124.79 1n4c h PHE 173 Ca -0.25 0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.15 1n4c h PHE 173 Cb 2.09 -0.39 0.01 0.00 2.79 0.00 0.00 35.95 40.45 1n4c h PHE 173 CO 0.14 0.78 -0.39 0.93 -2.23 0.00 0.00 178.31 177.54 1n4c h GLU 174 N 1.23 0.34 -0.01 1.11 5.08 -1.14 -2.59 114.58 118.61 1n4c h GLU 174 Ca 0.32 -0.31 -0.19 0.00 -1.00 0.00 0.00 59.36 58.19 1n4c h GLU 174 Cb -0.06 0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.28 1n4c h GLU 174 CO -0.06 0.97 -0.73 -0.97 -1.00 0.00 0.00 179.01 177.22 1n4c h ASN 175 N -0.18 0.66 0.13 1.42 -0.73 -1.08 -1.21 115.58 114.59 1n4c h ASN 175 Ca -0.04 -0.75 -0.01 0.00 1.87 0.00 0.00 56.30 57.37 1n4c h ASN 175 Cb 1.07 -0.20 -0.00 0.00 0.27 0.00 0.00 38.32 39.45 1n4c h ASN 175 CO 0.08 1.32 -0.07 -0.61 -0.37 0.00 0.00 177.43 177.78 1n4c h GLN 176 N 0.06 0.00 -0.15 6.67 -0.00 0.32 -3.40 115.11 118.61 1n4c h GLN 176 Ca -0.09 0.00 0.17 0.00 -0.00 0.00 0.00 58.65 58.73 1n4c h GLN 176 Cb 1.42 0.00 -0.18 0.00 0.00 0.00 0.00 27.48 28.72 1n4c h GLN 176 CO 0.14 0.07 -0.05 0.20 0.00 0.00 0.00 178.83 179.19 1n4c s GLY 177 N -4.14 -1.37 -0.04 2.39 0.00 -0.98 -5.02 107.32 98.17 1n4c s GLY 177 Ca -0.04 1.63 -0.04 0.00 0.00 0.00 0.00 44.72 46.27 1n4c s GLY 177 CO 0.60 4.30 3.06 -0.18 0.00 0.00 0.00 173.10 180.89 1n4c n GLN 178 N 4.06 1.73 -3.73 2.90 0.00 -0.46 -4.50 117.38 117.37 1n4c n GLN 178 Ca 0.07 -0.81 -0.02 0.00 -0.00 0.00 0.00 57.00 56.23 1n4c n GLN 178 Cb 0.62 -1.71 -0.01 0.00 0.00 0.00 0.00 30.24 29.14 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 0.46 0.99 -0.13 3.69 1.02 -1.26 -5.10 119.74 119.42 1n4c s LYS 179 Ca 0.46 -0.56 -0.37 0.00 0.02 0.00 0.00 55.97 55.53 1n4c s LYS 179 Cb 0.23 0.33 -0.14 0.00 -0.52 0.00 0.00 37.83 37.73 1n4c s LYS 179 CO -0.01 -0.46 1.75 -2.30 -0.92 0.00 0.00 175.35 173.41 1n4c n PRO 180 N -0.50 1.68 -3.06 -1.68 -0.02 -1.26 -4.90 135.00 125.26 1n4c n PRO 180 Ca -0.06 0.61 -0.37 0.00 -2.02 0.00 0.00 63.50 61.66 1n4c n PRO 180 Cb 0.61 -2.37 -0.02 0.00 -0.02 0.00 0.00 33.50 31.70 1n4c n PRO 180 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1n4c n LEU 181 N 5.50 5.64 0.00 2.45 0.00 -1.26 -5.10 117.00 124.23 1n4c n LEU 181 Ca 0.23 -5.35 0.00 0.00 0.00 0.00 0.00 56.01 50.89 1n4c n LEU 181 Cb 0.22 -1.02 0.00 0.00 0.00 0.00 0.00 43.42 42.62 1n4c n LEU 181 CO 0.74 1.92 0.00 0.00 0.00 0.00 0.00 177.39 180.05