#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jtc s PRO 2 N 0.00 4.19 0.12 3.69 0.04 -1.26 -4.14 135.00 137.64 2jtc s PRO 2 Ca 0.00 1.22 -0.16 0.00 0.04 0.00 0.00 61.00 62.11 2jtc s PRO 2 Cb 0.00 -2.27 -0.07 0.00 0.04 0.00 0.00 34.50 32.20 2jtc s PRO 2 CO 0.00 -0.08 0.55 0.08 0.04 0.00 0.00 177.00 177.59 2jtc s VAL 3 N -2.03 4.83 -0.02 -0.36 1.01 -1.26 -3.42 120.40 119.15 2jtc s VAL 3 Ca 0.61 0.94 0.01 0.00 0.00 0.00 0.00 61.98 63.53 2jtc s VAL 3 Cb -0.13 -3.78 0.02 0.00 0.00 0.00 0.00 36.38 32.50 2jtc s VAL 3 CO 0.17 0.34 -0.01 -0.69 0.00 0.00 0.00 175.10 174.91 2jtc s VAL 4 N -1.36 0.19 0.79 2.92 1.01 0.53 -4.80 120.40 119.70 2jtc s VAL 4 Ca 0.35 0.03 -0.13 0.00 0.00 0.00 0.00 61.98 62.23 2jtc s VAL 4 Cb -0.16 -0.26 0.19 0.00 0.00 0.00 0.00 36.38 36.15 2jtc s VAL 4 CO 0.19 0.13 0.89 0.29 0.00 0.00 0.00 175.10 176.60 2jtc n LYS 5 N 3.85 -1.66 -2.45 2.72 4.76 -1.26 0.73 118.16 124.85 2jtc n LYS 5 Ca -0.24 -1.40 -0.41 0.00 -2.87 0.00 0.00 58.31 53.39 2jtc n LYS 5 Cb 0.52 -1.08 -0.03 0.00 -1.84 0.00 0.00 35.03 32.60 2jtc n LYS 5 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2jtc s SER 6 N -4.16 6.17 0.13 4.39 0.15 -1.21 -3.45 113.70 115.73 2jtc s SER 6 Ca 0.54 0.12 -0.20 0.00 0.70 0.00 0.00 55.95 57.11 2jtc s SER 6 Cb -0.03 -2.55 -0.03 0.00 -1.71 0.00 0.00 66.02 61.70 2jtc s SER 6 CO 0.39 -1.71 1.72 -0.07 1.20 0.00 0.00 173.24 174.78 2jtc h LEU 7 N 12.95 -0.07 -0.73 3.45 3.38 0.28 0.61 115.31 135.18 2jtc h LEU 7 Ca -0.27 0.04 0.10 0.00 0.09 0.00 0.00 57.88 57.85 2jtc h LEU 7 Cb 1.08 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.83 2jtc h LEU 7 CO 1.20 -0.01 0.37 -0.07 0.09 0.00 0.00 178.44 180.02 2jtc h LEU 8 N 0.07 0.48 -0.74 1.67 3.38 -1.89 0.79 115.31 119.06 2jtc h LEU 8 Ca 0.09 0.06 -0.11 0.00 0.09 0.00 0.00 57.88 58.02 2jtc h LEU 8 Cb 0.12 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2jtc h LEU 8 CO -0.16 0.27 -0.21 0.44 0.09 0.00 0.00 178.44 178.87 2jtc h ASP 9 N 0.62 0.74 0.00 -0.43 5.19 -1.50 0.52 116.42 121.55 2jtc h ASP 9 Ca 0.36 -0.26 0.00 0.00 -0.62 0.00 0.00 57.03 56.51 2jtc h ASP 9 Cb 0.39 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.70 2jtc h ASP 9 CO -0.28 0.94 0.07 -1.28 -3.12 0.00 0.00 179.24 175.57 2jtc h SER 10 N 0.64 0.00 0.00 6.45 0.87 0.26 0.40 113.55 122.18 2jtc h SER 10 Ca 0.09 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.65 2jtc h SER 10 Cb 0.71 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.66 2jtc h SER 10 CO 0.05 0.00 -0.14 0.29 -0.53 0.00 0.00 176.83 176.51 2jtc n LYS 11 N -2.35 1.27 -4.04 2.24 5.02 -0.60 -4.95 118.16 114.75 2jtc n LYS 11 Ca -0.02 -2.65 -0.33 0.00 -2.02 0.00 0.00 58.31 53.29 2jtc n LYS 11 Cb 0.11 -1.46 -0.03 0.00 -0.02 0.00 0.00 35.03 33.62 2jtc n LYS 11 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jtc n GLY 12 N -1.29 -0.45 3.52 0.72 0.00 0.14 -4.73 105.19 103.10 2jtc n GLY 12 Ca 0.16 0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.85 2jtc n GLY 12 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jtc s ILE 13 N -3.13 4.76 -0.44 -0.61 1.01 0.17 -2.91 121.20 120.05 2jtc s ILE 13 Ca 0.67 0.14 0.02 0.00 0.00 0.00 0.00 60.65 61.48 2jtc s ILE 13 Cb -0.37 -4.27 0.15 0.00 0.01 0.00 0.00 42.46 37.98 2jtc s ILE 13 CO 0.82 -0.69 0.29 -1.00 0.00 0.00 0.00 174.94 174.36 2jtc s HIS 14 N 3.00 1.60 0.62 3.97 3.76 0.73 -4.51 115.29 124.46 2jtc s HIS 14 Ca 0.24 -2.31 0.01 0.00 -0.15 0.00 0.00 55.06 52.86 2jtc s HIS 14 Cb -0.14 -1.46 0.08 0.00 1.11 0.00 0.00 32.58 32.17 2jtc s HIS 14 CO 0.19 -0.78 0.86 0.71 -0.85 0.00 0.00 174.74 174.88 2jtc s TYR 15 N 0.23 2.16 0.09 1.40 2.02 -1.25 -3.50 117.35 118.49 2jtc s TYR 15 Ca 0.23 -0.21 -0.00 0.00 -0.37 0.00 0.00 57.07 56.71 2jtc s TYR 15 Cb -0.13 -2.79 0.00 0.00 -0.40 0.00 0.00 41.96 38.64 2jtc s TYR 15 CO -0.08 -1.25 0.12 -1.71 -1.57 0.00 0.00 175.55 171.07 2jtc n ASN 16 N -2.53 -0.34 0.00 2.29 5.15 -1.26 -4.91 115.26 113.66 2jtc n ASN 16 Ca 0.12 -1.48 0.00 0.00 -0.60 0.00 0.00 54.58 52.62 2jtc n ASN 16 Cb 0.60 0.63 0.00 0.00 -0.53 0.00 0.00 39.78 40.49 2jtc n ASN 16 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jtc n GLN 17 N -0.15 -0.16 0.00 1.20 6.02 -1.26 -4.72 117.38 118.31 2jtc n GLN 17 Ca 0.00 -0.33 -0.04 0.00 -0.01 0.00 0.00 57.00 56.63 2jtc n GLN 17 Cb 0.15 -0.82 -0.01 0.00 1.02 0.00 0.00 30.24 30.58 2jtc n GLN 17 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2jtc n GLY 18 N 0.07 -0.13 0.00 1.08 0.00 -1.26 -2.15 105.19 102.80 2jtc n GLY 18 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2jtc n GLY 18 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2jtc n ASN 19 N -3.56 0.00 0.00 1.61 4.05 -1.26 -3.34 115.26 112.76 2jtc n ASN 19 Ca -0.07 0.00 0.05 0.00 0.45 0.00 0.00 54.58 55.02 2jtc n ASN 19 Cb 0.29 0.00 0.30 0.00 1.23 0.00 0.00 39.78 41.60 2jtc n ASN 19 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 2jtc n PRO 20 N 0.00 0.96 0.09 1.20 -0.04 -1.26 -3.27 135.00 132.67 2jtc n PRO 20 Ca 0.00 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.31 2jtc n PRO 20 Cb 0.00 -1.17 -0.10 0.00 -0.04 0.00 0.00 33.50 32.20 2jtc n PRO 20 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2jtc h TYR 21 N 0.00 0.54 -0.50 0.54 0.05 -1.85 -3.15 116.97 112.61 2jtc h TYR 21 Ca 0.00 -0.35 -0.01 0.00 0.05 0.00 0.00 58.73 58.42 2jtc h TYR 21 Cb 0.00 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 37.69 2jtc h TYR 21 CO 0.00 1.22 0.02 0.27 -1.05 0.00 0.00 178.16 178.62 2jtc n ASN 22 N -3.63 4.98 0.00 3.88 0.23 -1.20 -4.30 115.26 115.21 2jtc n ASN 22 Ca -0.08 -2.81 0.10 0.00 -0.53 0.00 0.00 54.58 51.26 2jtc n ASN 22 Cb 0.94 -0.66 0.56 0.00 -2.08 0.00 0.00 39.78 38.54 2jtc n ASN 22 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 2jtc n LEU 23 N 0.49 0.00 0.00 -4.53 4.77 -1.19 -3.02 117.00 113.51 2jtc n LEU 23 Ca 0.24 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 2jtc n LEU 23 Cb 1.07 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.16 2jtc n LEU 23 CO 0.28 0.00 0.09 0.18 -1.33 0.00 0.00 177.39 176.61 2jtc n LEU 24 N -0.91 0.29 -4.68 2.23 4.77 -1.26 -5.00 117.00 112.44 2jtc n LEU 24 Ca 0.14 -0.29 -0.30 0.00 -0.03 0.00 0.00 56.01 55.53 2jtc n LEU 24 Cb 0.07 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.31 2jtc n LEU 24 CO 0.11 0.07 0.65 0.42 -1.33 0.00 0.00 177.39 177.31 2jtc s THR 25 N -0.02 2.51 0.11 -5.08 -4.23 -1.17 -4.89 115.64 102.87 2jtc s THR 25 Ca 0.00 0.17 -0.31 0.00 -1.18 0.00 0.00 61.69 60.37 2jtc s THR 25 Cb 0.00 -2.50 -0.07 0.00 1.34 0.00 0.00 72.50 71.27 2jtc s THR 25 CO 0.00 -0.22 1.27 -2.16 -0.54 0.00 0.00 174.62 172.98 2jtc s PRO 26 N -4.80 4.40 0.46 3.99 0.04 -1.26 -4.61 135.00 133.22 2jtc s PRO 26 Ca 0.65 1.92 -0.23 0.00 0.04 0.00 0.00 61.00 63.37 2jtc s PRO 26 Cb -0.20 -3.28 -0.07 0.00 0.04 0.00 0.00 34.50 30.99 2jtc s PRO 26 CO 0.58 -0.30 1.22 0.08 0.04 0.00 0.00 177.00 178.63 2jtc s VAL 27 N 0.84 2.84 0.43 -0.36 1.01 -1.26 -3.07 120.40 120.83 2jtc s VAL 27 Ca 0.60 0.65 -0.22 0.00 0.00 0.00 0.00 61.98 63.01 2jtc s VAL 27 Cb -0.33 -3.34 -0.10 0.00 0.00 0.00 0.00 36.38 32.61 2jtc s VAL 27 CO 0.31 0.01 0.99 -0.63 0.00 0.00 0.00 175.10 175.79 2jtc s ILE 28 N -1.44 4.08 0.00 2.22 1.01 -0.92 -4.89 121.20 121.26 2jtc s ILE 28 Ca 0.64 1.37 0.00 0.00 0.00 0.00 0.00 60.65 62.66 2jtc s ILE 28 Cb -0.32 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 38.55 2jtc s ILE 28 CO 0.40 -0.20 0.00 -0.62 0.00 0.00 0.00 174.94 174.51 2jtc n GLU 29 N -0.56 1.89 -4.62 2.79 1.02 -0.98 -1.66 120.64 118.53 2jtc n GLU 29 Ca 0.07 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.92 2jtc n GLU 29 Cb 0.53 -0.87 -0.09 0.00 -0.02 0.00 0.00 31.44 30.98 2jtc n GLU 29 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2jtc s LYS 30 N -1.54 2.06 0.09 3.49 1.02 0.51 -4.77 119.74 120.60 2jtc s LYS 30 Ca 0.00 -2.18 0.07 0.00 0.02 0.00 0.00 55.97 53.88 2jtc s LYS 30 Cb 0.00 -1.64 -0.04 0.00 -0.52 0.00 0.00 37.83 35.63 2jtc s LYS 30 CO 0.00 -0.16 -0.13 0.08 -0.92 0.00 0.00 175.35 174.21 2jtc s VAL 31 N -2.76 3.16 -0.08 3.17 1.01 -1.24 -4.22 120.40 119.44 2jtc s VAL 31 Ca 0.26 -1.29 -0.21 0.00 0.00 0.00 0.00 61.98 60.74 2jtc s VAL 31 Cb 0.07 -2.44 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 2jtc s VAL 31 CO 0.14 0.16 0.58 -0.75 0.00 0.00 0.00 175.10 175.23 2jtc s LYS 32 N -2.03 4.37 0.08 2.72 2.20 -1.18 -4.71 119.74 121.19 2jtc s LYS 32 Ca 0.19 0.66 -0.31 0.00 -0.36 0.00 0.00 55.97 56.16 2jtc s LYS 32 Cb -0.11 -3.43 -0.07 0.00 -1.51 0.00 0.00 37.83 32.72 2jtc s LYS 32 CO 0.11 0.16 1.38 -1.25 -0.36 0.00 0.00 175.35 175.38 2jtc s PRO 33 N 0.56 4.32 0.00 4.03 0.04 -1.26 -2.58 135.00 140.11 2jtc s PRO 33 Ca 0.31 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.38 2jtc s PRO 33 Cb -0.17 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 31.03 2jtc s PRO 33 CO 0.14 -0.46 0.00 0.41 0.04 0.00 0.00 177.00 177.14 2jtc n GLY 34 N 3.51 0.93 3.48 0.56 0.00 -1.26 -5.08 105.19 107.33 2jtc n GLY 34 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 2jtc n GLY 34 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jtc s GLU 35 N -0.72 1.54 0.42 1.61 2.12 -1.07 -5.16 118.70 117.44 2jtc s GLU 35 Ca 0.00 -1.45 -0.07 0.00 0.36 0.00 0.00 54.97 53.81 2jtc s GLU 35 Cb 0.00 0.42 0.11 0.00 0.26 0.00 0.00 34.13 34.91 2jtc s GLU 35 CO 0.00 -0.62 0.35 1.04 -0.54 0.00 0.00 175.26 175.49 2jtc n GLN 36 N -0.39 -1.93 -3.17 4.30 6.02 -1.26 -4.77 117.38 116.18 2jtc n GLN 36 Ca -0.00 -0.56 -0.39 0.00 -0.01 0.00 0.00 57.00 56.04 2jtc n GLN 36 Cb 0.63 -0.56 -0.06 0.00 1.02 0.00 0.00 30.24 31.27 2jtc n GLN 36 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2jtc s SER 37 N -2.46 7.18 0.00 1.08 0.15 -1.26 -4.45 113.70 113.93 2jtc s SER 37 Ca 0.23 1.39 0.04 0.00 0.70 0.00 0.00 55.95 58.32 2jtc s SER 37 Cb -0.03 -2.41 0.12 0.00 -1.71 0.00 0.00 66.02 62.00 2jtc s SER 37 CO 0.18 0.25 1.09 0.49 1.20 0.00 0.00 173.24 176.45 2jtc n PHE 38 N 1.70 0.18 -1.68 3.44 3.72 -1.26 -4.95 117.46 118.61 2jtc n PHE 38 Ca -0.09 -0.49 -0.42 0.00 -0.05 0.00 0.00 57.45 56.40 2jtc n PHE 38 Cb 0.50 -0.04 -0.03 0.00 -0.94 0.00 0.00 39.48 38.97 2jtc n PHE 38 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2jtc s VAL 39 N -0.99 3.06 0.00 -4.37 1.01 -1.26 0.96 120.40 118.81 2jtc s VAL 39 Ca 0.09 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.14 2jtc s VAL 39 Cb 0.05 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.38 2jtc s VAL 39 CO 0.06 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.76 2jtc n GLY 40 N 4.83 0.69 3.73 4.51 0.00 -0.66 -4.97 105.19 113.32 2jtc n GLY 40 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 2jtc n GLY 40 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jtc s GLN 41 N -0.78 4.55 -0.27 1.61 -0.21 0.27 -4.77 119.66 120.06 2jtc s GLN 41 Ca 0.00 1.67 -0.29 0.00 0.02 0.00 0.00 55.36 56.76 2jtc s GLN 41 Cb 0.00 -3.33 -0.01 0.00 1.00 0.00 0.00 33.01 30.67 2jtc s GLN 41 CO 0.00 -0.02 1.46 -1.01 -2.12 0.00 0.00 175.29 173.60 2jtc s HIS 42 N 0.32 2.39 0.48 0.91 3.76 -1.26 -2.16 115.29 119.74 2jtc s HIS 42 Ca 0.52 0.71 -0.22 0.00 -0.15 0.00 0.00 55.06 55.92 2jtc s HIS 42 Cb -0.28 -3.96 -0.09 0.00 1.11 0.00 0.00 32.58 29.36 2jtc s HIS 42 CO 0.32 -2.31 0.97 0.00 -0.85 0.00 0.00 174.74 172.87 2jtc n ALA 43 N 8.09 0.12 -1.20 -1.40 0.00 -1.17 -4.68 120.51 120.27 2jtc n ALA 43 Ca 0.17 0.15 -0.29 0.00 0.00 0.00 0.00 53.44 53.46 2jtc n ALA 43 Cb 0.46 -2.08 0.16 0.00 0.00 0.00 0.00 19.45 17.99 2jtc n ALA 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jtc s ALA 44 N -1.38 1.26 0.06 0.00 0.00 0.32 -4.54 121.76 117.48 2jtc s ALA 44 Ca 0.67 -0.22 0.01 0.00 0.00 0.00 0.00 51.96 52.42 2jtc s ALA 44 Cb -0.51 -3.15 -0.25 0.00 0.00 0.00 0.00 23.12 19.21 2jtc s ALA 44 CO 0.54 -2.59 1.07 1.79 0.00 0.00 0.00 175.76 176.57 2jtc h THR 45 N -1.72 1.42 0.00 0.00 1.35 -1.72 -3.43 112.91 108.81 2jtc h THR 45 Ca -0.52 -3.08 0.00 0.00 -0.55 0.00 0.00 66.41 62.26 2jtc h THR 45 Cb 1.31 2.81 0.00 0.00 -1.73 0.00 0.00 68.15 70.54 2jtc h THR 45 CO 0.56 0.86 0.00 0.61 -0.25 0.00 0.00 175.52 177.30 2jtc n GLY 46 N 1.51 2.35 0.17 5.82 0.00 -1.26 -4.32 105.19 109.47 2jtc n GLY 46 Ca -0.09 -1.54 -0.09 0.00 0.00 0.00 0.00 46.02 44.31 2jtc n GLY 46 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jtc h SER 47 N 0.00 -0.40 -0.64 1.61 4.64 -1.87 0.11 113.55 117.01 2jtc h SER 47 Ca 0.00 0.08 0.11 0.00 -0.47 0.00 0.00 61.79 61.51 2jtc h SER 47 Cb 0.00 0.19 -0.12 0.00 -0.31 0.00 0.00 62.40 62.16 2jtc h SER 47 CO 0.00 -0.17 -0.34 0.58 -0.87 0.00 0.00 176.83 176.04 2jtc h VAL 48 N -0.15 0.15 0.52 0.95 2.07 -1.80 2.36 116.25 120.36 2jtc h VAL 48 Ca 0.09 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.59 2jtc h VAL 48 Cb 0.28 0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.20 2jtc h VAL 48 CO -0.22 0.00 -0.29 0.00 0.02 0.00 0.00 177.57 177.08 2jtc h ALA 49 N 1.06 -0.76 0.00 1.67 0.00 -1.42 -0.06 119.26 119.75 2jtc h ALA 49 Ca 0.25 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2jtc h ALA 49 Cb 0.56 0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 2jtc h ALA 49 CO -0.72 -0.93 -0.15 1.15 0.00 0.00 0.00 179.25 178.60 2jtc h THR 50 N -0.75 0.95 -0.12 0.00 2.02 0.58 1.29 112.91 116.87 2jtc h THR 50 Ca -0.06 -0.53 -0.02 0.00 0.77 0.00 0.00 66.41 66.57 2jtc h THR 50 Cb 0.60 1.30 -0.00 0.00 -1.74 0.00 0.00 68.15 68.31 2jtc h THR 50 CO 0.08 0.14 -0.01 0.00 0.37 0.00 0.00 175.52 176.11 2jtc h ALA 51 N 1.85 0.16 -0.00 6.16 0.00 0.46 -1.88 119.26 126.01 2jtc h ALA 51 Ca -0.00 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 2jtc h ALA 51 Cb 0.29 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2jtc h ALA 51 CO 0.02 -0.13 -0.10 1.15 0.00 0.00 0.00 179.25 180.18 2jtc h THR 52 N -0.06 1.58 -0.89 0.00 2.02 -0.35 -3.04 112.91 112.18 2jtc h THR 52 Ca 0.03 -1.85 0.21 0.00 0.77 0.00 0.00 66.41 65.58 2jtc h THR 52 Cb 0.38 2.79 -0.06 0.00 -1.74 0.00 0.00 68.15 69.52 2jtc h THR 52 CO 0.01 0.49 0.60 0.00 0.37 0.00 0.00 175.52 176.99 2jtc h ALA 53 N 0.25 2.35 0.01 6.16 0.00 0.16 1.40 119.26 129.59 2jtc h ALA 53 Ca -0.01 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jtc h ALA 53 Cb 0.86 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2jtc h ALA 53 CO 0.02 -0.63 -0.00 1.96 0.00 0.00 0.00 179.25 180.60 2jtc h GLN 54 N 0.30 -0.01 0.00 0.00 4.20 -1.35 0.32 115.11 118.58 2jtc h GLN 54 Ca 0.45 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.15 2jtc h GLN 54 Cb 1.28 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.06 2jtc h GLN 54 CO -0.14 0.41 -0.05 0.82 -0.67 0.00 0.00 178.83 179.20 2jtc h ILE 55 N -0.43 0.37 -0.14 2.54 2.04 -0.60 0.38 117.51 121.68 2jtc h ILE 55 Ca -0.00 -0.27 -0.21 0.00 1.00 0.00 0.00 64.86 65.38 2jtc h ILE 55 Cb 0.42 1.19 0.01 0.00 -0.74 0.00 0.00 36.82 37.70 2jtc h ILE 55 CO 0.00 0.05 -0.72 0.24 0.00 0.00 0.00 178.15 177.72 2jtc h MET 56 N 0.00 0.73 -0.35 2.37 2.86 0.25 -2.79 114.93 118.00 2jtc h MET 56 Ca -0.00 -0.60 -0.05 0.00 -2.06 0.00 0.00 59.70 56.98 2jtc h MET 56 Cb 0.19 0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 2jtc h MET 56 CO 0.01 1.21 0.02 -0.22 1.06 0.00 0.00 176.91 178.99 2jtc h LYS 57 N 0.43 0.61 -0.56 1.72 1.63 0.18 0.99 116.57 121.58 2jtc h LYS 57 Ca -0.05 -0.18 0.16 0.00 -0.85 0.00 0.00 60.65 59.72 2jtc h LYS 57 Cb 1.36 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 32.91 2jtc h LYS 57 CO 0.15 0.71 0.45 -0.92 -3.45 0.00 0.00 179.45 176.39 2jtc h TYR 58 N 0.42 0.00 0.00 1.91 5.03 -0.29 -2.19 116.97 121.86 2jtc h TYR 58 Ca 0.10 0.00 -0.12 0.00 2.58 0.00 0.00 58.73 61.29 2jtc h TYR 58 Cb 0.43 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.68 2jtc h TYR 58 CO 0.03 0.00 -1.74 0.72 -1.32 0.00 0.00 178.16 175.85 2jtc n HIS 59 N -4.11 0.00 -3.95 -3.82 8.25 -0.88 -5.00 115.22 105.71 2jtc n HIS 59 Ca 0.10 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.15 2jtc n HIS 59 Cb 0.68 -0.47 0.03 0.00 1.12 0.00 0.00 29.99 31.34 2jtc n HIS 59 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2jtc n ASN 60 N -2.23 -4.42 0.00 0.41 3.02 0.34 -4.91 115.26 107.47 2jtc n ASN 60 Ca -0.12 -1.20 0.00 0.00 -0.03 0.00 0.00 54.58 53.23 2jtc n ASN 60 Cb 0.64 -2.26 0.00 0.00 -0.61 0.00 0.00 39.78 37.55 2jtc n ASN 60 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jtc n TYR 61 N -4.76 0.00 -2.16 3.10 9.36 -1.26 -4.78 117.16 116.66 2jtc n TYR 61 Ca -0.11 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 60.69 2jtc n TYR 61 Cb 0.58 -0.05 -0.03 0.00 -0.63 0.00 0.00 39.34 39.21 2jtc n TYR 61 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2jtc s PRO 62 N -0.12 3.36 0.46 2.98 0.04 -1.26 -4.78 135.00 135.67 2jtc s PRO 62 Ca 0.00 1.10 0.22 0.00 0.04 0.00 0.00 61.00 62.36 2jtc s PRO 62 Cb 0.00 -4.15 1.12 0.00 0.04 0.00 0.00 34.50 31.52 2jtc s PRO 62 CO 0.00 -1.83 1.95 -0.91 0.04 0.00 0.00 177.00 176.25 2jtc h ASN 63 N 12.12 0.00 -3.49 6.66 4.21 -1.86 -3.38 115.58 129.83 2jtc h ASN 63 Ca -0.30 0.00 -0.48 0.00 1.21 0.00 0.00 56.30 56.73 2jtc h ASN 63 Cb 1.14 0.00 -0.33 0.00 -1.12 0.00 0.00 38.32 38.01 2jtc h ASN 63 CO 1.08 0.21 -0.80 -0.75 -1.29 0.00 0.00 177.43 175.88 2jtc s LYS 64 N -4.09 1.39 1.05 0.81 2.20 -1.26 -0.44 119.74 119.40 2jtc s LYS 64 Ca -0.02 -0.33 -0.13 0.00 -0.36 0.00 0.00 55.97 55.13 2jtc s LYS 64 Cb 0.13 -1.20 0.17 0.00 -1.51 0.00 0.00 37.83 35.41 2jtc s LYS 64 CO 0.64 0.02 0.74 0.41 -0.36 0.00 0.00 175.35 176.79 2jtc n GLY 65 N 3.79 -1.67 0.12 5.54 0.00 -0.68 -4.83 105.19 107.46 2jtc n GLY 65 Ca -0.23 -0.90 -0.15 0.00 0.00 0.00 0.00 46.02 44.74 2jtc n GLY 65 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2jtc n LEU 66 N -3.44 1.80 -3.69 0.99 0.00 0.16 -4.06 117.00 108.76 2jtc n LEU 66 Ca 0.06 0.07 -0.11 0.00 0.00 0.00 0.00 56.01 56.03 2jtc n LEU 66 Cb 0.55 -0.43 -0.10 0.00 0.00 0.00 0.00 43.42 43.44 2jtc n LEU 66 CO 0.53 0.72 0.09 -0.75 0.00 0.00 0.00 177.39 177.98 2jtc s LYS 67 N -2.53 0.44 1.23 1.96 2.20 0.41 -4.43 119.74 119.01 2jtc s LYS 67 Ca -0.21 0.80 -0.14 0.00 -0.36 0.00 0.00 55.97 56.06 2jtc s LYS 67 Cb 0.08 0.04 0.31 0.00 -1.51 0.00 0.00 37.83 36.75 2jtc s LYS 67 CO 0.73 -0.14 1.00 -0.51 -0.36 0.00 0.00 175.35 176.08 2jtc s ASP 68 N 1.22 0.45 -0.06 1.43 1.01 -1.26 -3.15 116.67 116.31 2jtc s ASP 68 Ca -0.08 1.45 -0.08 0.00 0.71 0.00 0.00 52.55 54.56 2jtc s ASP 68 Cb -0.07 -2.25 0.02 0.00 1.01 0.00 0.00 42.92 41.63 2jtc s ASP 68 CO -0.11 -4.52 0.20 -0.47 0.21 0.00 0.00 175.17 170.48 2jtc s TYR 69 N -2.38 -0.18 0.02 4.23 6.14 -0.37 -4.78 117.35 120.03 2jtc s TYR 69 Ca 0.69 0.43 -0.04 0.00 0.64 0.00 0.00 57.07 58.79 2jtc s TYR 69 Cb -0.25 0.06 -0.01 0.00 0.42 0.00 0.00 41.96 42.18 2jtc s TYR 69 CO 0.65 -0.15 0.07 -0.08 0.64 0.00 0.00 175.55 176.68 2jtc s THR 70 N -0.20 0.12 0.12 4.34 -1.32 -1.26 0.00 115.64 117.43 2jtc s THR 70 Ca -0.03 -0.96 -0.25 0.00 -1.21 0.00 0.00 61.69 59.25 2jtc s THR 70 Cb -0.03 -0.62 0.07 0.00 -1.51 0.00 0.00 72.50 70.41 2jtc s THR 70 CO 0.01 -0.53 0.62 -0.72 -2.21 0.00 0.00 174.62 171.79 2jtc s TYR 71 N -2.00 -0.56 -0.18 9.09 1.13 -0.81 -4.99 117.35 119.03 2jtc s TYR 71 Ca -0.10 0.48 -0.17 0.00 -1.41 0.00 0.00 57.07 55.86 2jtc s TYR 71 Cb -0.05 0.53 -0.04 0.00 -1.10 0.00 0.00 41.96 41.30 2jtc s TYR 71 CO -0.02 -0.80 0.47 0.99 -2.51 0.00 0.00 175.55 173.67 2jtc s THR 72 N -3.26 5.16 0.46 -3.49 2.01 -1.26 -1.66 115.64 113.60 2jtc s THR 72 Ca -0.01 0.87 -0.20 0.00 0.31 0.00 0.00 61.69 62.66 2jtc s THR 72 Cb -0.01 -3.80 -0.13 0.00 0.01 0.00 0.00 72.50 68.57 2jtc s THR 72 CO -0.09 0.25 0.30 -0.11 -0.69 0.00 0.00 174.62 174.28 2jtc n LEU 73 N 4.35 -1.29 -4.77 4.42 7.94 0.39 -4.82 117.00 123.22 2jtc n LEU 73 Ca -0.07 0.81 -0.40 0.00 -1.11 0.00 0.00 56.01 55.24 2jtc n LEU 73 Cb 0.51 -1.01 0.02 0.00 0.53 0.00 0.00 43.42 43.46 2jtc n LEU 73 CO 0.42 -3.61 1.07 -0.94 -1.11 0.00 0.00 177.39 173.22 2jtc s SER 74 N -1.01 5.87 0.00 1.96 1.04 -1.26 -4.83 113.70 115.46 2jtc s SER 74 Ca 0.62 2.93 0.15 0.00 0.48 0.00 0.00 55.95 60.13 2jtc s SER 74 Cb -0.57 -2.65 0.81 0.00 0.10 0.00 0.00 66.02 63.71 2jtc s SER 74 CO 0.60 -1.18 1.36 -0.24 0.98 0.00 0.00 173.24 174.76 2jtc n SER 75 N -0.20 0.00 -0.66 7.02 2.88 -1.26 -1.55 113.62 119.85 2jtc n SER 75 Ca 0.05 -0.19 0.12 0.00 -1.33 0.00 0.00 58.87 57.53 2jtc n SER 75 Cb 0.42 -0.15 0.15 0.00 -0.75 0.00 0.00 64.21 63.88 2jtc n SER 75 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2jtc n ASN 76 N -1.15 2.25 -4.60 -3.46 3.02 -1.26 -4.88 115.26 105.19 2jtc n ASN 76 Ca 0.09 -1.65 -0.43 0.00 -0.03 0.00 0.00 54.58 52.56 2jtc n ASN 76 Cb 0.08 0.18 -0.03 0.00 -0.61 0.00 0.00 39.78 39.41 2jtc n ASN 76 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2jtc s ASN 77 N -2.22 6.00 -0.12 6.41 3.84 -0.60 -4.82 114.94 123.43 2jtc s ASN 77 Ca 0.26 1.14 0.08 0.00 0.21 0.00 0.00 52.86 54.54 2jtc s ASN 77 Cb 0.19 -2.53 0.44 0.00 -0.55 0.00 0.00 41.25 38.80 2jtc s ASN 77 CO 0.42 -1.65 1.17 -0.81 -2.79 0.00 0.00 177.10 173.44 2jtc n PRO 78 N 8.35 3.04 -0.01 0.43 -0.04 -1.26 -4.02 135.00 141.50 2jtc n PRO 78 Ca 0.21 -1.67 -0.00 0.00 -0.04 0.00 0.00 63.50 62.00 2jtc n PRO 78 Cb 0.47 -1.89 -0.02 0.00 -0.04 0.00 0.00 33.50 32.02 2jtc n PRO 78 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2jtc n TYR 79 N 0.34 0.00 -4.42 0.54 4.01 -1.26 -3.12 117.16 113.25 2jtc n TYR 79 Ca 0.15 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.62 2jtc n TYR 79 Cb 0.74 -0.09 -0.09 0.00 -0.31 0.00 0.00 39.34 39.59 2jtc n TYR 79 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2jtc s PHE 80 N -2.11 2.49 0.00 -0.72 0.40 -1.26 0.19 117.98 116.98 2jtc s PHE 80 Ca -0.01 -0.66 0.00 0.00 -0.60 0.00 0.00 56.93 55.66 2jtc s PHE 80 Cb 0.01 -1.84 0.00 0.00 0.51 0.00 0.00 43.02 41.70 2jtc s PHE 80 CO 0.10 0.31 0.26 0.09 0.70 0.00 0.00 175.22 176.68 2jtc n ASN 81 N -1.11 0.00 0.00 1.36 5.03 -1.26 -4.89 115.26 114.38 2jtc n ASN 81 Ca -0.04 0.26 0.00 0.00 0.87 0.00 0.00 54.58 55.66 2jtc n ASN 81 Cb 0.66 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.42 2jtc n ASN 81 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 2jtc n HIS 82 N -0.34 0.00 -1.01 3.10 8.25 -1.26 -4.97 115.22 119.00 2jtc n HIS 82 Ca 0.00 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.18 2jtc n HIS 82 Cb 0.00 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.07 2jtc n HIS 82 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2jtc n PRO 83 N 0.00 2.75 -3.81 -0.41 -0.04 -1.26 -4.26 135.00 127.97 2jtc n PRO 83 Ca 0.00 -1.70 -0.36 0.00 -0.04 0.00 0.00 63.50 61.40 2jtc n PRO 83 Cb 0.00 -2.53 -0.12 0.00 -0.04 0.00 0.00 33.50 30.81 2jtc n PRO 83 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2jtc s LYS 84 N 2.55 3.72 -0.31 0.54 2.47 -1.26 -5.00 119.74 122.45 2jtc s LYS 84 Ca 0.55 -0.45 -0.11 0.00 -1.56 0.00 0.00 55.97 54.41 2jtc s LYS 84 Cb 0.16 -3.31 -0.02 0.00 -1.46 0.00 0.00 37.83 33.20 2jtc s LYS 84 CO -0.04 -0.10 0.18 -0.80 0.16 0.00 0.00 175.35 174.75 2jtc s ASN 85 N 1.39 5.75 -0.12 1.43 0.01 -1.26 -0.47 114.94 121.67 2jtc s ASN 85 Ca 0.05 -0.38 -0.13 0.00 -0.71 0.00 0.00 52.86 51.69 2jtc s ASN 85 Cb -0.15 -2.06 -0.05 0.00 0.41 0.00 0.00 41.25 39.41 2jtc s ASN 85 CO 0.04 -0.17 0.29 -0.76 -1.51 0.00 0.00 177.10 174.99 2jtc s LEU 86 N 1.67 4.32 -0.04 0.60 1.02 -0.67 -4.93 118.68 120.65 2jtc s LEU 86 Ca 0.06 0.60 0.02 0.00 0.02 0.00 0.00 54.13 54.83 2jtc s LEU 86 Cb -0.17 -2.37 0.01 0.00 0.02 0.00 0.00 46.19 43.69 2jtc s LEU 86 CO 0.08 0.20 -0.08 0.12 0.02 0.00 0.00 176.35 176.70 2jtc s PHE 87 N -0.13 0.98 -0.24 0.29 5.36 -1.26 -1.92 117.98 121.05 2jtc s PHE 87 Ca 0.18 -0.30 -0.04 0.00 -0.96 0.00 0.00 56.93 55.81 2jtc s PHE 87 Cb -0.14 -0.77 0.00 0.00 -0.34 0.00 0.00 43.02 41.77 2jtc s PHE 87 CO 0.06 -0.19 -0.02 0.00 -1.46 0.00 0.00 175.22 173.61 2jtc s ALA 88 N 0.66 2.85 -0.34 11.12 0.00 0.10 -4.96 121.76 131.19 2jtc s ALA 88 Ca -0.11 -1.27 -0.05 0.00 0.00 0.00 0.00 51.96 50.53 2jtc s ALA 88 Cb -0.13 -1.79 -0.15 0.00 0.00 0.00 0.00 23.12 21.05 2jtc s ALA 88 CO 0.01 -0.59 2.56 0.00 0.00 0.00 0.00 175.76 177.74 2jtc n ALA 89 N 4.79 4.93 0.14 0.00 0.00 -1.26 -1.24 120.51 127.87 2jtc n ALA 89 Ca -0.17 -1.60 -0.15 0.00 0.00 0.00 0.00 53.44 51.51 2jtc n ALA 89 Cb 0.50 -2.54 -0.08 0.00 0.00 0.00 0.00 19.45 17.33 2jtc n ALA 89 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2jtc h ILE 90 N 2.62 0.12 -1.17 0.00 2.04 -1.87 0.20 117.51 119.44 2jtc h ILE 90 Ca 0.27 0.00 0.34 0.00 1.00 0.00 0.00 64.86 66.47 2jtc h ILE 90 Cb 0.79 0.12 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 2jtc h ILE 90 CO 0.68 0.00 1.03 0.77 0.00 0.00 0.00 178.15 180.64 2jtc h SER 91 N -0.71 0.00 -0.39 1.72 4.64 -1.69 2.10 113.55 119.21 2jtc h SER 91 Ca 0.01 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.11 2jtc h SER 91 Cb 0.72 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.68 2jtc h SER 91 CO -0.22 0.00 -0.07 0.35 -0.87 0.00 0.00 176.83 176.02 2jtc n THR 92 N -3.72 2.60 -2.23 2.95 -2.24 0.53 -3.82 114.28 108.35 2jtc n THR 92 Ca 0.26 -2.80 -0.31 0.00 -2.27 0.00 0.00 64.05 58.92 2jtc n THR 92 Cb 1.40 -0.37 -0.01 0.00 -2.10 0.00 0.00 70.33 69.26 2jtc n THR 92 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2jtc s ARG 93 N -3.28 3.75 -0.75 -0.78 1.81 0.70 -4.81 118.95 115.58 2jtc s ARG 93 Ca 0.46 0.76 0.02 0.00 -1.72 0.00 0.00 55.73 55.25 2jtc s ARG 93 Cb 0.41 -2.15 0.18 0.00 -0.45 0.00 0.00 34.95 32.94 2jtc s ARG 93 CO -0.00 -0.37 0.58 -0.65 -0.68 0.00 0.00 175.30 174.17 2jtc s GLN 94 N -4.59 2.72 -1.06 3.54 -1.52 -1.26 -2.89 119.66 114.61 2jtc s GLN 94 Ca 0.56 -3.24 -0.22 0.00 -1.95 0.00 0.00 55.36 50.51 2jtc s GLN 94 Cb -0.10 -3.62 0.06 0.00 -0.22 0.00 0.00 33.01 29.13 2jtc s GLN 94 CO 0.42 -1.26 1.47 0.71 -0.25 0.00 0.00 175.29 176.38 2jtc s TYR 95 N -1.27 2.63 -0.96 0.91 2.02 0.41 -4.91 117.35 116.18 2jtc s TYR 95 Ca 0.25 -1.03 -0.24 0.00 -0.37 0.00 0.00 57.07 55.68 2jtc s TYR 95 Cb -0.08 -4.67 0.04 0.00 -0.40 0.00 0.00 41.96 36.85 2jtc s TYR 95 CO -0.13 -1.87 1.46 1.21 -1.57 0.00 0.00 175.55 174.64 2jtc s ASN 96 N 4.72 6.33 0.00 2.29 3.84 -1.26 -4.56 114.94 126.30 2jtc s ASN 96 Ca 0.46 -1.20 0.01 0.00 0.21 0.00 0.00 52.86 52.34 2jtc s ASN 96 Cb 0.00 -2.57 0.04 0.00 -0.55 0.00 0.00 41.25 38.18 2jtc s ASN 96 CO -0.07 -1.66 0.92 0.79 -2.79 0.00 0.00 177.10 174.29 2jtc n TRP 97 N 9.37 0.00 0.22 0.43 5.03 -1.26 0.38 117.44 131.60 2jtc n TRP 97 Ca 0.28 0.00 0.12 0.00 3.03 0.00 0.00 57.50 60.93 2jtc n TRP 97 Cb 0.50 -0.39 0.04 0.00 -1.03 0.00 0.00 31.31 30.44 2jtc n TRP 97 CO 0.00 0.00 0.00 -0.91 -0.03 0.00 0.00 177.69 176.75 2jtc h ASN 98 N 0.00 0.00 0.00 -0.99 2.35 -2.01 -3.33 115.58 111.59 2jtc h ASN 98 Ca 0.00 -0.05 -0.37 0.00 -0.55 0.00 0.00 56.30 55.33 2jtc h ASN 98 Cb 0.01 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.31 2jtc h ASN 98 CO 0.00 0.03 -2.38 0.59 -1.65 0.00 0.00 177.43 174.02 2jtc n ASN 99 N -2.57 0.32 -3.47 5.81 3.02 0.16 -4.55 115.26 113.98 2jtc n ASN 99 Ca 0.01 -0.02 -0.36 0.00 -0.03 0.00 0.00 54.58 54.18 2jtc n ASN 99 Cb 0.52 0.82 -0.03 0.00 -0.61 0.00 0.00 39.78 40.49 2jtc n ASN 99 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2jtc n ILE 100 N -2.80 2.68 -1.40 2.41 5.41 0.46 -4.39 119.36 121.74 2jtc n ILE 100 Ca -0.34 -1.98 -0.39 0.00 1.00 0.00 0.00 62.75 61.04 2jtc n ILE 100 Cb 1.13 -2.37 0.02 0.00 -0.71 0.00 0.00 39.64 37.71 2jtc n ILE 100 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2jtc n LEU 101 N 5.69 -0.78 0.23 1.39 4.77 -1.26 -4.84 117.00 122.20 2jtc n LEU 101 Ca 0.53 0.75 0.13 0.00 -0.03 0.00 0.00 56.01 57.38 2jtc n LEU 101 Cb 0.30 -1.06 0.31 0.00 -2.33 0.00 0.00 43.42 40.64 2jtc n LEU 101 CO 0.89 -3.57 0.85 1.55 -1.33 0.00 0.00 177.39 175.77 2jtc h PRO 102 N 0.27 0.00 -3.05 3.23 0.13 -1.85 -3.43 132.00 127.29 2jtc h PRO 102 Ca -0.43 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.42 2jtc h PRO 102 Cb 1.42 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 32.20 2jtc h PRO 102 CO 0.46 0.02 -0.62 -0.08 -0.23 0.00 0.00 178.00 177.56 2jtc s THR 103 N -3.33 -0.28 -0.01 1.56 -1.32 -1.15 0.26 115.64 111.38 2jtc s THR 103 Ca 0.05 0.34 0.02 0.00 -1.21 0.00 0.00 61.69 60.89 2jtc s THR 103 Cb 0.06 -0.32 -0.03 0.00 -1.51 0.00 0.00 72.50 70.70 2jtc s THR 103 CO 0.64 0.14 -0.03 -0.31 -2.21 0.00 0.00 174.62 172.85 2jtc s TYR 104 N 2.28 2.99 -2.29 9.09 2.02 -1.23 -4.92 117.35 125.29 2jtc s TYR 104 Ca 0.02 0.03 0.23 0.00 -0.37 0.00 0.00 57.07 56.99 2jtc s TYR 104 Cb -0.12 -1.65 0.12 0.00 -0.40 0.00 0.00 41.96 39.90 2jtc s TYR 104 CO -0.06 0.42 1.18 -1.13 -1.57 0.00 0.00 175.55 174.38 2jtc n SER 105 N 1.55 2.22 0.00 2.29 3.41 -1.26 -4.92 113.62 116.91 2jtc n SER 105 Ca -0.15 -1.61 0.00 0.00 -0.26 0.00 0.00 58.87 56.85 2jtc n SER 105 Cb 0.53 0.32 0.00 0.00 -0.26 0.00 0.00 64.21 64.79 2jtc n SER 105 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jtc n GLY 106 N 1.39 0.80 0.05 5.00 0.00 -1.26 -4.82 105.19 106.36 2jtc n GLY 106 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2jtc n GLY 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jtc n ARG 107 N -2.33 1.71 -0.57 1.61 1.74 -1.26 -4.84 116.66 112.72 2jtc n ARG 107 Ca 0.00 -1.22 -0.15 0.00 -0.77 0.00 0.00 57.85 55.71 2jtc n ARG 107 Cb 0.00 -1.02 0.12 0.00 -1.02 0.00 0.00 32.46 30.54 2jtc n ARG 107 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2jtc n GLU 108 N -0.26 -1.89 -1.32 5.56 4.71 -1.26 -5.02 120.64 121.17 2jtc n GLU 108 Ca 0.01 -0.89 -0.29 0.00 -0.01 0.00 0.00 57.16 55.98 2jtc n GLU 108 Cb 0.18 -0.79 0.19 0.00 -1.01 0.00 0.00 31.44 30.01 2jtc n GLU 108 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 2jtc s SER 109 N -3.02 2.28 0.10 1.62 1.04 -1.26 -4.92 113.70 109.54 2jtc s SER 109 Ca 0.35 0.83 -0.03 0.00 0.48 0.00 0.00 55.95 57.58 2jtc s SER 109 Cb -0.03 -1.25 -0.21 0.00 0.10 0.00 0.00 66.02 64.63 2jtc s SER 109 CO 0.27 -3.30 1.21 0.78 0.98 0.00 0.00 173.24 173.18 2jtc h ASN 110 N -2.02 0.40 0.21 7.02 4.21 -1.97 -2.93 115.58 120.50 2jtc h ASN 110 Ca -0.49 -0.39 0.00 0.00 1.21 0.00 0.00 56.30 56.63 2jtc h ASN 110 Cb 1.31 -0.13 -0.04 0.00 -1.12 0.00 0.00 38.32 38.35 2jtc h ASN 110 CO 0.49 1.27 -0.46 0.58 -1.29 0.00 0.00 177.43 178.01 2jtc h VAL 111 N 0.10 0.00 -0.37 2.81 2.07 -1.98 1.89 116.25 120.77 2jtc h VAL 111 Ca -0.11 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.39 2jtc h VAL 111 Cb 1.83 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 2jtc h VAL 111 CO 0.18 0.00 0.12 1.56 0.02 0.00 0.00 177.57 179.45 2jtc h GLN 112 N -0.73 0.52 -0.36 1.57 7.50 -1.77 -1.12 115.11 120.72 2jtc h GLN 112 Ca -0.02 -0.07 -0.06 0.00 0.50 0.00 0.00 58.65 59.00 2jtc h GLN 112 Cb 0.70 -0.10 -0.01 0.00 0.05 0.00 0.00 27.48 28.12 2jtc h GLN 112 CO -0.20 0.46 0.01 0.87 -1.50 0.00 0.00 178.83 178.47 2jtc h LYS 113 N 0.52 0.63 -0.52 1.46 1.57 -1.03 -2.12 116.57 117.07 2jtc h LYS 113 Ca 0.13 -0.20 0.02 0.00 -1.87 0.00 0.00 60.65 58.73 2jtc h LYS 113 Cb 0.15 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.38 2jtc h LYS 113 CO -0.01 0.73 0.35 1.98 -0.57 0.00 0.00 179.45 181.93 2jtc h MET 114 N 0.44 0.64 0.17 3.15 4.05 0.37 -1.00 114.93 122.75 2jtc h MET 114 Ca 0.10 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.48 2jtc h MET 114 Cb 0.45 -0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 31.10 2jtc h MET 114 CO 0.02 0.42 -0.11 0.00 0.23 0.00 0.00 176.91 177.47 2jtc h ALA 115 N 1.68 -0.97 -0.78 0.39 0.00 -0.56 -1.57 119.26 117.46 2jtc h ALA 115 Ca 0.20 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.07 2jtc h ALA 115 Cb -0.00 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 2jtc h ALA 115 CO -0.05 -0.96 0.51 0.97 0.00 0.00 0.00 179.25 179.72 2jtc h ILE 116 N -0.26 1.16 -0.89 0.00 6.09 -1.40 -1.84 117.51 120.38 2jtc h ILE 116 Ca -0.02 -0.35 0.13 0.00 -1.37 0.00 0.00 64.86 63.25 2jtc h ILE 116 Cb 0.21 0.06 -0.09 0.00 0.47 0.00 0.00 36.82 37.47 2jtc h ILE 116 CO 0.02 0.19 0.51 0.77 -3.07 0.00 0.00 178.15 176.56 2jtc h SER 117 N 1.02 0.68 -0.19 2.19 4.64 -1.14 0.80 113.55 121.54 2jtc h SER 117 Ca 0.30 0.07 -0.07 0.00 -0.47 0.00 0.00 61.79 61.62 2jtc h SER 117 Cb -0.07 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 61.97 2jtc h SER 117 CO -0.08 0.33 -0.16 -0.08 -0.87 0.00 0.00 176.83 175.97 2jtc h GLU 118 N 0.77 0.45 -0.23 4.77 4.81 -0.71 0.43 114.58 124.87 2jtc h GLU 118 Ca 0.46 -0.22 0.05 0.00 -0.13 0.00 0.00 59.36 59.52 2jtc h GLU 118 Cb 0.56 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.90 2jtc h GLU 118 CO -0.31 0.78 -0.06 1.25 -0.73 0.00 0.00 179.01 179.94 2jtc h LEU 119 N 0.12 -0.22 -0.44 1.64 5.85 -0.32 1.76 115.31 123.70 2jtc h LEU 119 Ca 0.04 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.85 2jtc h LEU 119 Cb 0.68 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.82 2jtc h LEU 119 CO 0.04 -0.08 0.24 0.24 -0.34 0.00 0.00 178.44 178.55 2jtc h MET 120 N -0.00 0.47 -0.56 1.25 2.86 0.73 0.60 114.93 120.28 2jtc h MET 120 Ca 0.11 -0.03 -0.08 0.00 -2.06 0.00 0.00 59.70 57.64 2jtc h MET 120 Cb 0.17 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 2jtc h MET 120 CO -0.24 0.31 0.03 0.00 1.06 0.00 0.00 176.91 178.08 2jtc h ALA 121 N 1.22 0.99 0.44 6.32 0.00 0.12 1.31 119.26 129.66 2jtc h ALA 121 Ca 0.19 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2jtc h ALA 121 Cb 0.06 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2jtc h ALA 121 CO -0.11 0.62 -0.21 -0.44 0.00 0.00 0.00 179.25 179.11 2jtc h ASP 122 N 0.88 -0.50 0.13 0.00 3.32 0.35 0.42 116.42 121.01 2jtc h ASP 122 Ca 0.17 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 2jtc h ASP 122 Cb 0.48 0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.16 2jtc h ASP 122 CO 0.02 -0.19 -0.06 0.58 -1.72 0.00 0.00 179.24 177.87 2jtc h VAL 123 N -0.83 0.93 -0.50 -1.35 2.07 0.30 1.21 116.25 118.08 2jtc h VAL 123 Ca -0.06 -0.20 0.10 0.00 0.82 0.00 0.00 66.70 67.36 2jtc h VAL 123 Cb 0.56 1.05 -0.09 0.00 -1.52 0.00 0.00 31.29 31.29 2jtc h VAL 123 CO 0.10 0.05 -0.05 1.23 0.02 0.00 0.00 177.57 178.91 2jtc h GLY 124 N -0.26 0.45 0.74 2.17 0.00 0.17 0.43 103.07 106.77 2jtc h GLY 124 Ca -0.02 0.11 -0.04 0.00 0.00 0.00 0.00 47.33 47.38 2jtc h GLY 124 CO 0.03 -0.17 -0.35 -2.22 0.00 0.00 0.00 176.54 173.83 2jtc h ILE 125 N 0.06 0.00 -1.38 2.60 2.04 0.22 0.72 117.51 121.76 2jtc h ILE 125 Ca 0.25 -0.24 0.40 0.00 1.00 0.00 0.00 64.86 66.27 2jtc h ILE 125 Cb 0.38 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.40 2jtc h ILE 125 CO -0.46 0.00 0.99 0.77 0.00 0.00 0.00 178.15 179.44 2jtc h SER 126 N -1.22 0.03 -0.98 1.72 4.64 0.21 1.39 113.55 119.34 2jtc h SER 126 Ca -0.10 0.01 -0.64 0.00 -0.47 0.00 0.00 61.79 60.59 2jtc h SER 126 Cb 0.76 0.01 -0.30 0.00 -0.31 0.00 0.00 62.40 62.55 2jtc h SER 126 CO 0.17 -0.00 0.74 1.33 -0.87 0.00 0.00 176.83 178.19 2jtc n VAL 127 N -4.16 3.49 -3.97 0.95 0.24 0.14 -4.77 118.33 110.26 2jtc n VAL 127 Ca 0.31 -2.83 -0.30 0.00 -2.04 0.00 0.00 64.34 59.47 2jtc n VAL 127 Cb 1.43 -1.03 -0.04 0.00 -1.47 0.00 0.00 33.84 32.73 2jtc n VAL 127 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2jtc n ASP 128 N -0.95 -0.86 -4.72 -1.34 8.00 0.48 -4.28 116.55 112.88 2jtc n ASP 128 Ca 0.61 -1.03 -0.42 0.00 0.71 0.00 0.00 54.79 54.67 2jtc n ASP 128 Cb 0.85 -1.25 -0.03 0.00 -0.02 0.00 0.00 41.12 40.66 2jtc n ASP 128 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 2jtc s MET 129 N -6.69 4.26 -0.18 -1.24 -2.45 0.25 -4.53 119.30 108.72 2jtc s MET 129 Ca 0.16 2.24 -0.29 0.00 -1.25 0.00 0.00 55.69 56.55 2jtc s MET 129 Cb -0.09 -3.19 -0.01 0.00 1.25 0.00 0.00 34.83 32.79 2jtc s MET 129 CO 0.78 -0.52 1.24 0.34 1.05 0.00 0.00 175.02 177.91 2jtc s ASP 130 N 1.04 6.95 -0.41 1.11 -1.08 0.18 -4.88 116.67 119.59 2jtc s ASP 130 Ca 0.67 1.63 -0.13 0.00 -0.52 0.00 0.00 52.55 54.20 2jtc s ASP 130 Cb -0.41 -2.54 0.04 0.00 -1.46 0.00 0.00 42.92 38.55 2jtc s ASP 130 CO 0.32 -0.76 0.28 -0.31 0.52 0.00 0.00 175.17 175.21 2jtc s TYR 131 N 3.50 3.25 0.00 -5.34 2.02 -1.26 -2.49 117.35 117.03 2jtc s TYR 131 Ca 0.53 -0.88 0.00 0.00 -0.37 0.00 0.00 57.07 56.36 2jtc s TYR 131 Cb -0.21 -2.65 0.00 0.00 -0.40 0.00 0.00 41.96 38.70 2jtc s TYR 131 CO 0.14 -0.67 0.00 0.41 -1.57 0.00 0.00 175.55 173.86 2jtc n GLY 132 N 5.08 3.10 0.31 0.71 0.00 -1.26 -4.84 105.19 108.30 2jtc n GLY 132 Ca -0.11 -1.33 0.20 0.00 0.00 0.00 0.00 46.02 44.78 2jtc n GLY 132 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jtc h PRO 133 N 0.00 0.00 -5.39 1.61 0.13 -1.90 0.91 132.00 127.35 2jtc h PRO 133 Ca 0.00 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.48 2jtc h PRO 133 Cb 0.00 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 30.90 2jtc h PRO 133 CO 0.00 0.02 -0.69 -1.54 -0.23 0.00 0.00 178.00 175.55 2jtc s SER 134 N -5.51 4.59 -0.32 1.44 1.04 -1.26 -4.21 113.70 109.47 2jtc s SER 134 Ca -0.04 -0.16 0.01 0.00 0.48 0.00 0.00 55.95 56.24 2jtc s SER 134 Cb 0.13 -1.68 0.08 0.00 0.10 0.00 0.00 66.02 64.65 2jtc s SER 134 CO 0.47 0.19 0.02 -0.44 0.98 0.00 0.00 173.24 174.46 2jtc s SER 135 N 0.23 4.80 -0.12 7.02 0.01 -1.26 -4.62 113.70 119.77 2jtc s SER 135 Ca -0.04 -1.68 -0.02 0.00 1.31 0.00 0.00 55.95 55.51 2jtc s SER 135 Cb -0.14 -1.67 -0.03 0.00 0.21 0.00 0.00 66.02 64.39 2jtc s SER 135 CO 0.03 -0.32 -0.04 -0.83 0.41 0.00 0.00 173.24 172.49 2jtc s GLY 136 N 1.22 1.74 0.00 3.44 0.00 -1.04 -3.68 107.32 108.99 2jtc s GLY 136 Ca 0.01 -0.83 0.00 0.00 0.00 0.00 0.00 44.72 43.89 2jtc s GLY 136 CO -0.05 -0.32 0.00 -1.26 0.00 0.00 0.00 173.10 171.48 2jtc n SER 137 N 2.93 1.74 -0.11 1.64 2.88 -1.26 0.49 113.62 121.94 2jtc n SER 137 Ca -0.18 -0.09 -0.23 0.00 -1.33 0.00 0.00 58.87 57.05 2jtc n SER 137 Cb 0.53 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.87 2jtc n SER 137 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jtc n ALA 138 N -3.00 0.82 0.00 -1.46 0.00 -1.26 -2.95 120.51 112.66 2jtc n ALA 138 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.90 2jtc n ALA 138 Cb 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 18.94 2jtc n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jtc n GLY 139 N 1.43 1.10 0.25 0.00 0.00 -1.26 -2.45 105.19 104.26 2jtc n GLY 139 Ca -0.34 -1.00 -0.15 0.00 0.00 0.00 0.00 46.02 44.53 2jtc n GLY 139 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2jtc h SER 140 N 0.00 -0.52 -1.22 1.61 0.02 -1.94 -2.91 113.55 108.58 2jtc h SER 140 Ca 0.00 0.03 0.35 0.00 -0.84 0.00 0.00 61.79 61.33 2jtc h SER 140 Cb 0.00 0.15 -0.07 0.00 0.14 0.00 0.00 62.40 62.62 2jtc h SER 140 CO 0.00 -0.34 0.85 0.77 -1.14 0.00 0.00 176.83 176.97 2jtc h SER 141 N -0.54 0.14 0.19 3.07 4.64 -1.96 -1.48 113.55 117.60 2jtc h SER 141 Ca -0.04 0.04 -0.35 0.00 -0.47 0.00 0.00 61.79 60.96 2jtc h SER 141 Cb 0.44 0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.51 2jtc h SER 141 CO 0.05 0.00 -2.04 0.54 -0.87 0.00 0.00 176.83 174.51 2jtc n ARG 142 N -4.33 0.70 -0.17 4.77 1.74 -1.20 -3.00 116.66 115.17 2jtc n ARG 142 Ca 0.28 0.22 -0.09 0.00 -0.77 0.00 0.00 57.85 57.49 2jtc n ARG 142 Cb 1.23 -1.68 0.00 0.00 -1.02 0.00 0.00 32.46 31.00 2jtc n ARG 142 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2jtc h VAL 143 N 0.03 1.25 -0.30 1.55 2.07 -1.16 2.50 116.25 122.20 2jtc h VAL 143 Ca -0.43 -0.95 -0.14 0.00 0.82 0.00 0.00 66.70 66.01 2jtc h VAL 143 Cb 2.03 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 32.70 2jtc h VAL 143 CO 0.05 0.34 -0.37 0.06 0.02 0.00 0.00 177.57 177.67 2jtc h GLN 144 N 0.69 0.69 0.04 1.57 -0.00 -1.48 0.27 115.11 116.89 2jtc h GLN 144 Ca 0.15 -0.34 -0.00 0.00 -0.00 0.00 0.00 58.65 58.45 2jtc h GLN 144 Cb 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.89 2jtc h GLN 144 CO 0.01 0.95 -0.02 -0.09 -0.00 0.00 0.00 178.83 179.69 2jtc h ARG 145 N 0.58 -0.05 -0.73 0.06 2.43 -1.35 -3.14 114.38 112.18 2jtc h ARG 145 Ca 0.05 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.19 2jtc h ARG 145 Cb 0.90 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.42 2jtc h ARG 145 CO 0.08 0.61 0.31 0.00 -1.51 0.00 0.00 179.97 179.46 2jtc h ALA 146 N 0.02 1.18 -0.58 2.80 0.00 0.43 1.16 119.26 124.26 2jtc h ALA 146 Ca -0.01 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.79 2jtc h ALA 146 Cb 0.68 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 2jtc h ALA 146 CO 0.01 0.61 0.30 -0.07 0.00 0.00 0.00 179.25 180.10 2jtc h LEU 147 N 1.05 0.43 0.14 0.00 3.38 -0.55 -0.09 115.31 119.67 2jtc h LEU 147 Ca 0.25 0.03 -0.35 0.00 0.09 0.00 0.00 57.88 57.90 2jtc h LEU 147 Cb 0.17 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2jtc h LEU 147 CO -0.03 0.28 -1.85 0.11 0.09 0.00 0.00 178.44 177.05 2jtc h LYS 148 N 0.57 0.30 0.40 1.13 1.57 -1.42 0.85 116.57 119.96 2jtc h LYS 148 Ca 0.26 -0.51 -0.02 0.00 -1.87 0.00 0.00 60.65 58.51 2jtc h LYS 148 Cb 0.18 0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.68 2jtc h LYS 148 CO -0.18 1.20 -0.19 0.93 -0.57 0.00 0.00 179.45 180.64 2jtc h GLU 149 N 0.08 -0.52 0.12 3.15 5.08 0.15 -2.05 114.58 120.59 2jtc h GLU 149 Ca -0.37 0.04 -0.20 0.00 -1.00 0.00 0.00 59.36 57.82 2jtc h GLU 149 Cb 2.06 0.12 0.01 0.00 0.50 0.00 0.00 28.75 31.43 2jtc h GLU 149 CO 0.13 -0.34 -0.96 -0.91 -1.00 0.00 0.00 179.01 175.93 2jtc h ASN 150 N -1.08 0.39 0.65 1.42 -0.26 -1.21 -3.33 115.58 112.15 2jtc h ASN 150 Ca -0.05 -0.91 0.00 0.00 -0.56 0.00 0.00 56.30 54.78 2jtc h ASN 150 Cb 0.41 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 37.54 2jtc h ASN 150 CO 0.09 1.44 -0.77 0.49 -1.06 0.00 0.00 177.43 177.62 2jtc n PHE 151 N -4.11 0.37 -2.58 1.19 3.72 -0.55 0.36 117.46 115.85 2jtc n PHE 151 Ca -0.18 0.11 -0.15 0.00 -0.05 0.00 0.00 57.45 57.18 2jtc n PHE 151 Cb 0.82 -0.52 0.01 0.00 -0.94 0.00 0.00 39.48 38.85 2jtc n PHE 151 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2jtc n GLY 152 N 1.37 -0.16 3.72 1.37 0.00 -0.11 -4.45 105.19 106.93 2jtc n GLY 152 Ca 0.03 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 2jtc n GLY 152 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2jtc s TYR 153 N -2.87 2.05 0.69 1.61 1.51 0.28 -4.88 117.35 115.75 2jtc s TYR 153 Ca 0.13 1.65 -0.17 0.00 -1.01 0.00 0.00 57.07 57.67 2jtc s TYR 153 Cb -0.06 -3.35 -0.08 0.00 -0.11 0.00 0.00 41.96 38.37 2jtc s TYR 153 CO 0.16 -2.46 0.23 -1.71 -1.11 0.00 0.00 175.55 170.65 2jtc n ASN 154 N -3.24 -2.29 0.23 2.29 2.85 0.14 -4.51 115.26 110.72 2jtc n ASN 154 Ca 0.12 0.57 0.12 0.00 -0.11 0.00 0.00 54.58 55.28 2jtc n ASN 154 Cb 0.51 -1.08 0.64 0.00 1.24 0.00 0.00 39.78 41.10 2jtc n ASN 154 CO 0.00 0.00 0.00 -0.61 -2.11 0.00 0.00 177.26 174.54 2jtc h GLN 155 N -0.31 0.00 0.00 1.20 5.75 -1.90 -1.08 115.11 118.77 2jtc h GLN 155 Ca -0.44 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.06 2jtc h GLN 155 Cb 1.37 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.92 2jtc h GLN 155 CO 0.41 0.00 0.31 0.66 -2.65 0.00 0.00 178.83 177.55 2jtc h SER 156 N 0.00 0.00 -2.79 -0.69 4.64 -1.84 -3.39 113.55 109.48 2jtc h SER 156 Ca 0.00 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.77 2jtc h SER 156 Cb 0.39 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.46 2jtc h SER 156 CO 0.00 0.00 0.96 -0.69 -0.87 0.00 0.00 176.83 176.23 2jtc s VAL 157 N -3.74 3.84 0.24 0.95 1.01 0.10 -3.90 120.40 118.91 2jtc s VAL 157 Ca -0.02 1.08 -0.09 0.00 0.00 0.00 0.00 61.98 62.95 2jtc s VAL 157 Cb 0.06 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.73 2jtc s VAL 157 CO 0.20 -0.07 0.37 -1.38 0.00 0.00 0.00 175.10 174.23 2jtc s HIS 158 N 3.41 0.63 0.06 5.22 -3.43 -0.74 -4.94 115.29 115.50 2jtc s HIS 158 Ca 0.65 -0.95 0.05 0.00 -0.80 0.00 0.00 55.06 54.01 2jtc s HIS 158 Cb -0.29 -0.05 -0.04 0.00 -1.43 0.00 0.00 32.58 30.78 2jtc s HIS 158 CO 0.24 -0.90 -0.07 -1.14 -2.00 0.00 0.00 174.74 170.88 2jtc s GLN 159 N -4.01 2.40 -0.02 -0.38 0.74 -1.26 -1.71 119.66 115.42 2jtc s GLN 159 Ca 0.28 -0.85 -0.02 0.00 0.05 0.00 0.00 55.36 54.82 2jtc s GLN 159 Cb 0.02 -2.44 0.00 0.00 1.10 0.00 0.00 33.01 31.69 2jtc s GLN 159 CO 0.10 0.56 0.05 0.96 -0.55 0.00 0.00 175.29 176.41 2jtc s ILE 160 N -1.13 0.01 -0.40 -2.34 -4.36 0.12 -4.95 121.20 108.16 2jtc s ILE 160 Ca 0.20 -0.11 -0.11 0.00 -0.26 0.00 0.00 60.65 60.37 2jtc s ILE 160 Cb -0.11 -0.12 0.05 0.00 1.25 0.00 0.00 42.46 43.53 2jtc s ILE 160 CO 0.12 -0.06 0.24 0.20 0.24 0.00 0.00 174.94 175.68 2jtc s ASN 161 N -0.17 5.74 0.56 4.36 0.01 -1.26 0.14 114.94 124.31 2jtc s ASN 161 Ca -0.02 -1.20 0.34 0.00 -0.71 0.00 0.00 52.86 51.27 2jtc s ASN 161 Cb -0.02 -2.03 1.49 0.00 0.41 0.00 0.00 41.25 41.11 2jtc s ASN 161 CO 0.00 -0.46 1.79 -0.09 -1.51 0.00 0.00 177.10 176.83 2jtc h ARG 162 N 8.46 0.00 0.00 -0.60 9.65 -1.55 2.14 114.38 132.47 2jtc h ARG 162 Ca -0.25 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.63 2jtc h ARG 162 Cb 1.10 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.68 2jtc h ARG 162 CO 0.72 0.00 0.00 0.41 2.80 0.00 0.00 179.97 183.90 2jtc n GLY 163 N -1.72 -1.35 0.42 2.80 0.00 -1.22 -2.47 105.19 101.65 2jtc n GLY 163 Ca 0.22 0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.35 2jtc n GLY 163 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2jtc n ASP 164 N -2.06 1.79 -4.80 1.61 9.92 0.72 -4.99 116.55 118.74 2jtc n ASP 164 Ca 0.04 -1.40 -0.33 0.00 -0.53 0.00 0.00 54.79 52.57 2jtc n ASP 164 Cb 0.27 0.46 -0.06 0.00 -0.64 0.00 0.00 41.12 41.16 2jtc n ASP 164 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 2jtc s PHE 165 N -2.10 1.72 -0.05 1.24 0.40 -1.01 -5.00 117.98 113.18 2jtc s PHE 165 Ca 0.15 -0.99 -0.01 0.00 -0.60 0.00 0.00 56.93 55.49 2jtc s PHE 165 Cb 0.15 -1.63 -0.03 0.00 0.51 0.00 0.00 43.02 42.02 2jtc s PHE 165 CO 0.46 0.10 0.00 -1.54 0.70 0.00 0.00 175.22 174.94 2jtc s SER 166 N -3.96 5.21 0.22 1.36 1.04 -1.26 -4.89 113.70 111.42 2jtc s SER 166 Ca 0.05 0.09 -0.05 0.00 0.48 0.00 0.00 55.95 56.52 2jtc s SER 166 Cb -0.00 -1.43 0.40 0.00 0.10 0.00 0.00 66.02 65.09 2jtc s SER 166 CO 0.03 0.34 1.20 1.17 0.98 0.00 0.00 173.24 176.96 2jtc n LYS 167 N 1.84 -0.07 0.33 4.02 4.81 -1.26 0.17 118.16 128.00 2jtc n LYS 167 Ca -0.17 1.19 -0.16 0.00 -0.87 0.00 0.00 58.31 58.31 2jtc n LYS 167 Cb 0.53 -1.80 -0.08 0.00 0.02 0.00 0.00 35.03 33.70 2jtc n LYS 167 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 2jtc h GLN 168 N 0.00 -0.81 0.00 1.64 1.08 -2.00 -1.68 115.11 113.34 2jtc h GLN 168 Ca 0.39 0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.64 2jtc h GLN 168 Cb 0.64 0.18 0.00 0.00 -0.05 0.00 0.00 27.48 28.26 2jtc h GLN 168 CO -0.78 -0.49 0.00 -0.44 -0.95 0.00 0.00 178.83 176.17 2jtc h ASP 169 N -1.05 0.00 -0.12 1.46 3.32 -1.14 -2.28 116.42 116.61 2jtc h ASP 169 Ca -0.09 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.81 2jtc h ASP 169 Cb 0.69 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.25 2jtc h ASP 169 CO 0.14 0.00 -0.52 -0.25 -1.72 0.00 0.00 179.24 176.89 2jtc h TRP 170 N 0.00 0.75 -0.27 4.55 2.91 0.22 -3.06 115.95 121.05 2jtc h TRP 170 Ca 0.00 -0.32 -0.05 0.00 1.13 0.00 0.00 58.89 59.64 2jtc h TRP 170 Cb 0.20 -0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 28.71 2jtc h TRP 170 CO 0.00 1.11 -0.06 0.93 -1.03 0.00 0.00 178.44 179.38 2jtc h GLU 171 N 0.19 0.43 -0.69 2.65 5.08 -0.74 -2.45 114.58 119.05 2jtc h GLU 171 Ca -0.03 -0.10 0.06 0.00 -1.00 0.00 0.00 59.36 58.29 2jtc h GLU 171 Cb 1.16 -0.06 -0.06 0.00 0.50 0.00 0.00 28.75 30.29 2jtc h GLU 171 CO 0.11 0.51 0.39 0.00 -1.00 0.00 0.00 179.01 179.02 2jtc h ALA 172 N 1.53 0.93 -0.27 3.43 0.00 -1.40 1.95 119.26 125.43 2jtc h ALA 172 Ca 0.08 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2jtc h ALA 172 Cb 0.37 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2jtc h ALA 172 CO 0.02 0.08 0.16 1.96 0.00 0.00 0.00 179.25 181.46 2jtc h GLN 173 N 0.72 0.37 0.01 0.00 1.08 -1.37 0.42 115.11 116.34 2jtc h GLN 173 Ca 0.31 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.47 2jtc h GLN 173 Cb 0.18 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.54 2jtc h GLN 173 CO -0.18 0.30 -0.01 0.82 -0.95 0.00 0.00 178.83 178.81 2jtc h ILE 174 N 0.34 1.53 0.03 2.54 2.04 -1.24 -2.76 117.51 119.99 2jtc h ILE 174 Ca 0.10 -1.81 0.03 0.00 1.00 0.00 0.00 64.86 64.17 2jtc h ILE 174 Cb 0.03 2.73 -0.04 0.00 -0.74 0.00 0.00 36.82 38.80 2jtc h ILE 174 CO -0.02 0.46 -0.21 0.44 0.00 0.00 0.00 178.15 178.82 2jtc h ASP 175 N -0.82 -0.62 -0.99 1.72 3.32 0.31 0.56 116.42 119.90 2jtc h ASP 175 Ca -0.00 0.08 0.18 0.00 0.02 0.00 0.00 57.03 57.31 2jtc h ASP 175 Cb 0.76 0.25 -0.10 0.00 0.22 0.00 0.00 39.33 40.46 2jtc h ASP 175 CO 0.00 -0.28 0.59 0.50 -1.72 0.00 0.00 179.24 178.33 2jtc h LYS 176 N -0.35 0.74 0.26 3.56 3.64 -1.03 2.22 116.57 125.61 2jtc h LYS 176 Ca 0.05 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2jtc h LYS 176 Cb 0.42 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 2jtc h LYS 176 CO -0.18 0.49 -0.12 0.93 -2.27 0.00 0.00 179.45 178.30 2jtc h GLU 177 N 0.76 -0.34 0.00 1.90 4.39 -0.48 -2.15 114.58 118.67 2jtc h GLU 177 Ca 0.56 0.02 -0.04 0.00 0.34 0.00 0.00 59.36 60.25 2jtc h GLU 177 Cb 0.85 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.57 2jtc h GLU 177 CO -0.38 -0.18 -0.19 -0.07 -1.16 0.00 0.00 179.01 177.03 2jtc h LEU 178 N -0.41 0.00 -1.12 1.33 3.38 0.29 0.22 115.31 119.00 2jtc h LEU 178 Ca -0.04 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.10 2jtc h LEU 178 Cb 0.31 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.97 2jtc h LEU 178 CO 0.06 0.19 0.61 0.77 0.09 0.00 0.00 178.44 180.16 2jtc h SER 179 N 0.00 0.75 -0.97 -0.43 4.64 0.42 0.69 113.55 118.65 2jtc h SER 179 Ca -0.00 0.07 -0.64 0.00 -0.47 0.00 0.00 61.79 60.75 2jtc h SER 179 Cb 0.58 -0.08 -0.30 0.00 -0.31 0.00 0.00 62.40 62.30 2jtc h SER 179 CO 0.02 0.33 0.73 0.00 -0.87 0.00 0.00 176.83 177.05 2jtc n GLN 180 N -4.65 2.65 -4.19 4.77 6.02 -1.00 -4.87 117.38 116.11 2jtc n GLN 180 Ca 0.21 -3.29 -0.30 0.00 -0.01 0.00 0.00 57.00 53.61 2jtc n GLN 180 Cb 0.51 -2.26 -0.07 0.00 1.02 0.00 0.00 30.24 29.44 2jtc n GLN 180 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2jtc n ASN 181 N -0.95 0.21 -3.97 1.08 4.13 0.24 -4.90 115.26 111.10 2jtc n ASN 181 Ca 0.61 -1.20 -0.31 0.00 1.68 0.00 0.00 54.58 55.36 2jtc n ASN 181 Cb 0.86 -2.05 -0.15 0.00 -1.54 0.00 0.00 39.78 36.89 2jtc n ASN 181 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2jtc s GLN 182 N -7.12 1.64 1.13 3.52 -0.21 0.75 -4.94 119.66 114.42 2jtc s GLN 182 Ca 0.04 -1.31 -0.13 0.00 0.02 0.00 0.00 55.36 53.98 2jtc s GLN 182 Cb -0.02 -2.76 0.26 0.00 1.00 0.00 0.00 33.01 31.50 2jtc s GLN 182 CO 0.96 -0.72 1.04 -1.25 -2.12 0.00 0.00 175.29 173.21 2jtc s PRO 183 N 1.22 -0.63 -0.05 2.91 0.04 -1.26 -2.28 135.00 134.95 2jtc s PRO 183 Ca -0.01 0.76 0.05 0.00 0.04 0.00 0.00 61.00 61.84 2jtc s PRO 183 Cb -0.19 -1.59 -0.01 0.00 0.04 0.00 0.00 34.50 32.75 2jtc s PRO 183 CO -0.08 -3.51 -0.21 0.08 0.04 0.00 0.00 177.00 173.31 2jtc s VAL 184 N -2.58 1.76 -0.37 -0.36 1.01 0.32 -4.52 120.40 115.67 2jtc s VAL 184 Ca 0.68 -0.90 -0.24 0.00 0.00 0.00 0.00 61.98 61.52 2jtc s VAL 184 Cb -0.23 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.66 2jtc s VAL 184 CO 0.63 0.50 0.81 -0.47 0.00 0.00 0.00 175.10 176.57 2jtc s TYR 185 N -0.06 3.10 0.30 5.22 6.14 0.25 -0.66 117.35 131.65 2jtc s TYR 185 Ca -0.04 0.60 0.10 0.00 0.64 0.00 0.00 57.07 58.36 2jtc s TYR 185 Cb -0.13 -3.45 -0.06 0.00 0.42 0.00 0.00 41.96 38.74 2jtc s TYR 185 CO 0.03 -0.75 -0.14 -0.47 0.64 0.00 0.00 175.55 174.86 2jtc s TYR 186 N 3.18 2.23 -0.29 4.97 6.14 -1.01 0.18 117.35 132.76 2jtc s TYR 186 Ca 0.33 -0.47 -0.19 0.00 0.64 0.00 0.00 57.07 57.38 2jtc s TYR 186 Cb -0.13 -1.14 0.13 0.00 0.42 0.00 0.00 41.96 41.24 2jtc s TYR 186 CO 0.17 0.58 0.94 1.14 0.64 0.00 0.00 175.55 179.02 2jtc s GLN 187 N -3.59 0.47 -0.42 4.97 -2.07 -1.03 -0.21 119.66 117.78 2jtc s GLN 187 Ca 0.30 0.73 -0.19 0.00 -1.82 0.00 0.00 55.36 54.38 2jtc s GLN 187 Cb -0.01 0.14 0.02 0.00 -1.09 0.00 0.00 33.01 32.07 2jtc s GLN 187 CO 0.14 -0.09 0.57 0.20 -1.32 0.00 0.00 175.29 174.80 2jtc s GLY 188 N 1.06 1.78 0.70 2.60 0.00 0.23 -3.19 107.32 110.50 2jtc s GLY 188 Ca -0.06 -1.26 -0.11 0.00 0.00 0.00 0.00 44.72 43.29 2jtc s GLY 188 CO -0.13 1.39 1.07 0.14 0.00 0.00 0.00 173.10 175.58 2jtc s VAL 189 N 2.57 3.83 0.00 1.40 1.01 -1.11 -1.57 120.40 126.52 2jtc s VAL 189 Ca 0.19 0.59 0.00 0.00 0.00 0.00 0.00 61.98 62.77 2jtc s VAL 189 Cb -0.15 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 32.73 2jtc s VAL 189 CO 0.17 -0.78 0.00 0.61 0.00 0.00 0.00 175.10 175.10 2jtc n GLY 190 N -2.59 3.05 0.13 4.51 0.00 -0.98 -2.46 105.19 106.85 2jtc n GLY 190 Ca 0.07 -0.09 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 2jtc n GLY 190 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2jtc h LYS 191 N 0.00 0.28 0.00 1.61 1.57 -1.95 -3.35 116.57 114.74 2jtc h LYS 191 Ca 0.00 -0.48 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 2jtc h LYS 191 Cb 0.00 0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.49 2jtc h LYS 191 CO 0.00 1.17 0.00 1.33 -0.57 0.00 0.00 179.45 181.38 2jtc n VAL 192 N -3.47 0.49 0.00 0.50 0.24 -1.26 -5.01 118.33 109.82 2jtc n VAL 192 Ca -0.26 -0.01 0.00 0.00 -2.04 0.00 0.00 64.34 62.03 2jtc n VAL 192 Cb 1.06 -0.72 0.00 0.00 -1.47 0.00 0.00 33.84 32.71 2jtc n VAL 192 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2jtc n GLY 193 N 0.94 0.78 3.54 7.63 0.00 -1.26 -4.72 105.19 112.10 2jtc n GLY 193 Ca 0.05 -2.07 -0.43 0.00 0.00 0.00 0.00 46.02 43.58 2jtc n GLY 193 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jtc s GLY 194 N 0.00 1.46 -0.03 -0.02 0.00 -1.03 -2.31 107.32 105.40 2jtc s GLY 194 Ca 0.00 -1.04 -0.30 0.00 0.00 0.00 0.00 44.72 43.38 2jtc s GLY 194 CO 0.00 2.01 1.31 -1.58 0.00 0.00 0.00 173.10 174.84 2jtc s HIS 195 N 3.79 2.99 0.34 1.90 5.04 -0.61 -4.54 115.29 124.20 2jtc s HIS 195 Ca 0.33 0.99 0.10 0.00 -1.54 0.00 0.00 55.06 54.93 2jtc s HIS 195 Cb -0.12 -3.56 -0.06 0.00 0.04 0.00 0.00 32.58 28.88 2jtc s HIS 195 CO 0.22 -1.96 -0.10 0.00 -2.34 0.00 0.00 174.74 170.57 2jtc s ALA 196 N 2.34 2.96 0.00 1.58 0.00 -1.26 0.78 121.76 128.15 2jtc s ALA 196 Ca 0.60 -2.05 0.00 0.00 0.00 0.00 0.00 51.96 50.51 2jtc s ALA 196 Cb -0.28 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 22.73 2jtc s ALA 196 CO 0.24 0.10 0.00 1.97 0.00 0.00 0.00 175.76 178.08 2jtc n PHE 197 N -0.79 0.00 -3.88 0.00 1.16 0.70 -3.95 117.46 110.70 2jtc n PHE 197 Ca -0.05 0.00 -0.14 0.00 -1.87 0.00 0.00 57.45 55.39 2jtc n PHE 197 Cb 0.63 0.00 -0.15 0.00 -1.61 0.00 0.00 39.48 38.35 2jtc n PHE 197 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 2jtc s VAL 198 N -2.33 0.04 -0.36 1.97 1.01 -1.10 -2.41 120.40 117.22 2jtc s VAL 198 Ca 0.00 0.04 -0.12 0.00 0.00 0.00 0.00 61.98 61.91 2jtc s VAL 198 Cb 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 36.38 36.30 2jtc s VAL 198 CO 0.00 0.05 0.21 -0.63 0.00 0.00 0.00 175.10 174.73 2jtc s ILE 199 N 0.35 4.81 -0.22 2.22 1.01 0.16 0.68 121.20 130.21 2jtc s ILE 199 Ca -0.03 -0.60 0.12 0.00 0.00 0.00 0.00 60.65 60.14 2jtc s ILE 199 Cb -0.05 -3.59 0.45 0.00 0.01 0.00 0.00 42.46 39.28 2jtc s ILE 199 CO -0.01 -0.13 1.19 -0.90 0.00 0.00 0.00 174.94 175.09 2jtc n ASP 200 N 5.04 2.88 -3.62 3.58 5.75 0.86 -0.52 116.55 130.50 2jtc n ASP 200 Ca -0.12 -3.42 -0.01 0.00 -0.01 0.00 0.00 54.79 51.23 2jtc n ASP 200 Cb 0.48 -0.42 -0.01 0.00 -1.03 0.00 0.00 41.12 40.13 2jtc n ASP 200 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2jtc s GLY 201 N -3.31 -0.37 -0.03 6.12 0.00 -1.22 0.24 107.32 108.76 2jtc s GLY 201 Ca 0.41 0.87 -0.13 0.00 0.00 0.00 0.00 44.72 45.88 2jtc s GLY 201 CO -0.03 0.22 0.28 0.00 0.00 0.00 0.00 173.10 173.56 2jtc s ALA 202 N -2.55 -0.69 -0.17 3.20 0.00 0.22 -1.55 121.76 120.23 2jtc s ALA 202 Ca 0.12 0.33 0.16 0.00 0.00 0.00 0.00 51.96 52.57 2jtc s ALA 202 Cb 0.02 -0.02 0.38 0.00 0.00 0.00 0.00 23.12 23.51 2jtc s ALA 202 CO -0.04 -0.23 1.25 -3.47 0.00 0.00 0.00 175.76 173.28 2jtc n ASP 203 N 1.59 2.59 -1.51 0.00 2.03 0.21 0.20 116.55 121.66 2jtc n ASP 203 Ca -0.20 -3.27 -0.10 0.00 0.52 0.00 0.00 54.79 51.73 2jtc n ASP 203 Cb 0.56 -0.49 -0.04 0.00 -0.72 0.00 0.00 41.12 40.44 2jtc n ASP 203 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2jtc n GLY 204 N -1.16 0.69 1.41 0.27 0.00 -1.22 -4.68 105.19 100.51 2jtc n GLY 204 Ca 0.19 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.25 2jtc n GLY 204 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jtc n ARG 205 N -1.87 0.11 -1.03 1.61 1.74 -1.26 -4.56 116.66 111.39 2jtc n ARG 205 Ca -0.10 -2.06 -0.01 0.00 -0.77 0.00 0.00 57.85 54.90 2jtc n ARG 205 Cb 0.38 -0.12 -0.00 0.00 -1.02 0.00 0.00 32.46 31.70 2jtc n ARG 205 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2jtc n ASN 206 N 0.38 -3.82 -4.41 0.55 4.13 -1.26 -5.00 115.26 105.82 2jtc n ASN 206 Ca 0.07 0.02 -0.32 0.00 1.68 0.00 0.00 54.58 56.03 2jtc n ASN 206 Cb 1.11 -1.41 -0.14 0.00 -1.54 0.00 0.00 39.78 37.80 2jtc n ASN 206 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 2jtc s PHE 207 N -1.80 2.63 0.35 3.10 0.08 -1.26 -4.07 117.98 117.01 2jtc s PHE 207 Ca 0.00 -0.33 0.07 0.00 0.12 0.00 0.00 56.93 56.78 2jtc s PHE 207 Cb 0.00 -1.64 -0.07 0.00 -0.57 0.00 0.00 43.02 40.75 2jtc s PHE 207 CO 0.00 0.05 -0.01 0.71 -0.10 0.00 0.00 175.22 175.87 2jtc s TYR 208 N -0.50 2.26 -0.34 0.36 1.51 -1.01 0.64 117.35 120.28 2jtc s TYR 208 Ca 0.06 -0.72 -0.18 0.00 -1.01 0.00 0.00 57.07 55.23 2jtc s TYR 208 Cb -0.12 -1.46 -0.01 0.00 -0.11 0.00 0.00 41.96 40.26 2jtc s TYR 208 CO 0.01 0.33 0.52 -1.58 -1.11 0.00 0.00 175.55 173.73 2jtc s HIS 209 N -2.89 3.19 -0.07 2.71 2.46 -0.59 -0.86 115.29 119.24 2jtc s HIS 209 Ca 0.34 0.26 0.03 0.00 0.47 0.00 0.00 55.06 56.16 2jtc s HIS 209 Cb 0.07 -2.90 -0.02 0.00 -0.13 0.00 0.00 32.58 29.59 2jtc s HIS 209 CO 0.16 -0.50 -0.13 0.08 -2.47 0.00 0.00 174.74 171.88 2jtc s VAL 210 N 2.40 3.14 -1.09 0.89 1.01 0.17 -0.10 120.40 126.82 2jtc s VAL 210 Ca 0.19 -0.68 -0.09 0.00 0.00 0.00 0.00 61.98 61.40 2jtc s VAL 210 Cb -0.15 -2.25 0.27 0.00 0.00 0.00 0.00 36.38 34.25 2jtc s VAL 210 CO 0.13 0.58 1.08 0.21 0.00 0.00 0.00 175.10 177.10 2jtc s ASN 211 N -0.54 7.25 1.04 3.32 3.84 0.21 -0.88 114.94 129.19 2jtc s ASN 211 Ca 0.07 -3.54 -0.21 0.00 0.21 0.00 0.00 52.86 49.40 2jtc s ASN 211 Cb -0.12 -2.20 -0.04 0.00 -0.55 0.00 0.00 41.25 38.35 2jtc s ASN 211 CO 0.01 -0.30 -0.55 0.79 -2.79 0.00 0.00 177.10 174.26 2jtc n TRP 212 N 2.78 -1.89 0.11 0.43 5.03 -1.26 -2.73 117.44 119.91 2jtc n TRP 212 Ca 0.23 0.30 -0.09 0.00 3.03 0.00 0.00 57.50 60.97 2jtc n TRP 212 Cb 0.40 -1.52 0.06 0.00 -1.03 0.00 0.00 31.31 29.22 2jtc n TRP 212 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 2jtc n GLY 213 N 2.62 2.98 0.30 6.99 0.00 -1.25 -4.82 105.19 112.00 2jtc n GLY 213 Ca 0.00 -0.43 -0.03 0.00 0.00 0.00 0.00 46.02 45.56 2jtc n GLY 213 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2jtc n TRP 214 N -0.03 0.01 0.00 1.61 7.02 -1.26 -4.86 117.44 119.93 2jtc n TRP 214 Ca 0.22 -0.21 0.00 0.00 -1.02 0.00 0.00 57.50 56.49 2jtc n TRP 214 Cb 0.89 -0.03 0.00 0.00 -2.42 0.00 0.00 31.31 29.75 2jtc n TRP 214 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2jtc n GLY 215 N 4.49 1.66 2.58 6.99 0.00 -1.26 -4.84 105.19 114.81 2jtc n GLY 215 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 2jtc n GLY 215 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jtc n GLY 216 N 3.63 4.64 0.00 -0.02 0.00 -1.26 -4.88 105.19 107.30 2jtc n GLY 216 Ca 0.00 -2.32 0.00 0.00 0.00 0.00 0.00 46.02 43.70 2jtc n GLY 216 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2jtc n VAL 217 N -0.27 0.00 1.55 1.61 3.14 -1.26 -4.77 118.33 118.32 2jtc n VAL 217 Ca 0.29 0.00 0.10 0.00 -2.96 0.00 0.00 64.34 61.77 2jtc n VAL 217 Cb 0.65 0.00 0.58 0.00 -1.06 0.00 0.00 33.84 34.02 2jtc n VAL 217 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2jtc n SER 218 N 0.00 0.00 -4.59 6.55 7.64 -1.26 -4.86 113.62 117.11 2jtc n SER 218 Ca 0.00 -0.93 -0.37 0.00 1.01 0.00 0.00 58.87 58.57 2jtc n SER 218 Cb 0.00 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.26 2jtc n SER 218 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2jtc n ASP 219 N -0.90 0.39 0.00 6.43 5.75 -1.26 -4.73 116.55 122.23 2jtc n ASP 219 Ca 0.15 0.77 0.00 0.00 -0.01 0.00 0.00 54.79 55.70 2jtc n ASP 219 Cb 0.07 -1.35 0.00 0.00 -1.03 0.00 0.00 41.12 38.80 2jtc n ASP 219 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2jtc n GLY 220 N 1.37 0.36 3.68 6.12 0.00 -0.06 -4.96 105.19 111.70 2jtc n GLY 220 Ca 0.14 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.08 2jtc n GLY 220 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2jtc s PHE 221 N -2.16 2.62 0.00 1.61 -0.12 -1.26 0.46 117.98 119.12 2jtc s PHE 221 Ca 0.00 0.61 0.00 0.00 -0.05 0.00 0.00 56.93 57.49 2jtc s PHE 221 Cb 0.00 -3.77 0.00 0.00 -0.63 0.00 0.00 43.02 38.62 2jtc s PHE 221 CO 0.00 -2.98 0.00 1.19 -0.05 0.00 0.00 175.22 173.38 2jtc n PHE 222 N 5.74 0.00 -3.95 3.49 3.01 -0.04 -4.87 117.46 120.84 2jtc n PHE 222 Ca 0.14 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.34 2jtc n PHE 222 Cb 0.43 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.88 2jtc n PHE 222 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2jtc s ARG 223 N -0.23 2.27 -0.10 -1.08 3.00 -1.26 -2.41 118.95 119.14 2jtc s ARG 223 Ca 0.00 -1.99 0.15 0.00 0.00 0.00 0.00 55.73 53.89 2jtc s ARG 223 Cb 0.00 -2.07 0.22 0.00 0.00 0.00 0.00 34.95 33.11 2jtc s ARG 223 CO 0.00 -0.51 1.11 1.28 0.00 0.00 0.00 175.30 177.18 2jtc n LEU 224 N -1.66 2.15 -0.08 2.53 7.99 -1.26 -4.71 117.00 121.96 2jtc n LEU 224 Ca -0.02 -2.77 -0.14 0.00 -0.01 0.00 0.00 56.01 53.07 2jtc n LEU 224 Cb 0.64 -0.33 -0.07 0.00 -0.11 0.00 0.00 43.42 43.55 2jtc n LEU 224 CO 0.40 0.65 -1.05 0.47 -1.51 0.00 0.00 177.39 176.35 2jtc n ASP 225 N -1.20 2.21 -3.89 -1.43 9.92 -1.26 -4.86 116.55 116.05 2jtc n ASP 225 Ca 0.12 0.02 -0.30 0.00 -0.53 0.00 0.00 54.79 54.10 2jtc n ASP 225 Cb 0.58 -0.34 -0.14 0.00 -0.64 0.00 0.00 41.12 40.57 2jtc n ASP 225 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2jtc s ALA 226 N -2.32 2.77 -1.04 2.24 0.00 -1.26 -5.03 121.76 117.12 2jtc s ALA 226 Ca -0.22 -2.79 -0.16 0.00 0.00 0.00 0.00 51.96 48.79 2jtc s ALA 226 Cb 0.07 -2.00 0.16 0.00 0.00 0.00 0.00 23.12 21.35 2jtc s ALA 226 CO 0.34 -1.92 1.22 -0.51 0.00 0.00 0.00 175.76 174.90 2jtc s LEU 227 N 0.33 5.26 0.19 0.00 2.01 -1.26 -4.84 118.68 120.37 2jtc s LEU 227 Ca 0.15 -2.56 0.10 0.00 0.01 0.00 0.00 54.13 51.82 2jtc s LEU 227 Cb -0.23 -2.37 -0.04 0.00 0.01 0.00 0.00 46.19 43.55 2jtc s LEU 227 CO -0.04 -0.85 -0.14 0.20 1.01 0.00 0.00 176.35 176.53 2jtc s ASN 228 N 3.06 3.99 0.50 2.29 0.01 -1.26 -4.67 114.94 118.87 2jtc s ASN 228 Ca 0.35 -0.69 -0.18 0.00 -0.71 0.00 0.00 52.86 51.63 2jtc s ASN 228 Cb -0.05 -0.57 -0.08 0.00 0.41 0.00 0.00 41.25 40.96 2jtc s ASN 228 CO -0.06 0.10 1.00 -2.16 -1.51 0.00 0.00 177.10 174.47 2jtc s PRO 229 N -2.86 3.89 -0.06 -0.60 0.04 -1.26 -5.01 135.00 129.14 2jtc s PRO 229 Ca 0.24 1.11 -0.02 0.00 0.04 0.00 0.00 61.00 62.37 2jtc s PRO 229 Cb -0.08 -2.12 -0.03 0.00 0.04 0.00 0.00 34.50 32.30 2jtc s PRO 229 CO 0.14 -0.32 -0.07 -1.13 0.04 0.00 0.00 177.00 175.65 2jtc n SER 230 N -1.31 1.82 -4.55 6.66 3.41 -1.26 -4.91 113.62 113.48 2jtc n SER 230 Ca 0.07 0.03 -0.42 0.00 -0.26 0.00 0.00 58.87 58.29 2jtc n SER 230 Cb 0.54 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 2jtc n SER 230 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jtc s ALA 231 N -2.12 2.99 -0.22 7.33 0.00 -1.26 -4.85 121.76 123.63 2jtc s ALA 231 Ca -0.09 -1.08 -0.17 0.00 0.00 0.00 0.00 51.96 50.63 2jtc s ALA 231 Cb 0.03 -4.00 -0.12 0.00 0.00 0.00 0.00 23.12 19.02 2jtc s ALA 231 CO 0.13 -2.73 -0.13 1.28 0.00 0.00 0.00 175.76 174.31 2jtc n LEU 232 N 8.36 1.90 0.00 0.00 4.77 -1.26 -4.93 117.00 125.84 2jtc n LEU 232 Ca 0.05 0.41 0.00 0.00 -0.03 0.00 0.00 56.01 56.44 2jtc n LEU 232 Cb 0.48 -0.87 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 2jtc n LEU 232 CO 0.69 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.56 2jtc n GLY 233 N 1.40 0.83 3.77 -0.72 0.00 -1.26 -4.46 105.19 104.75 2jtc n GLY 233 Ca -0.34 0.71 -0.29 0.00 0.00 0.00 0.00 46.02 46.10 2jtc n GLY 233 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2jtc s THR 234 N 0.00 2.27 -1.22 2.61 -4.23 -1.26 -4.93 115.64 108.88 2jtc s THR 234 Ca 0.00 0.09 -0.04 0.00 -1.18 0.00 0.00 61.69 60.56 2jtc s THR 234 Cb 0.00 -2.79 0.18 0.00 1.34 0.00 0.00 72.50 71.23 2jtc s THR 234 CO 0.00 -0.11 2.23 0.61 -0.54 0.00 0.00 174.62 176.80 2jtc n GLY 235 N -1.99 5.48 0.11 3.99 0.00 -1.26 -4.63 105.19 106.89 2jtc n GLY 235 Ca 0.06 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.88 2jtc n GLY 235 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jtc n GLY 236 N 1.16 -0.26 2.38 -0.02 0.00 -1.26 -4.71 105.19 102.47 2jtc n GLY 236 Ca 0.58 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.23 2jtc n GLY 236 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jtc n GLY 237 N 2.59 4.61 1.01 -0.02 0.00 -1.26 -4.93 105.19 107.18 2jtc n GLY 237 Ca 0.00 -1.76 -0.07 0.00 0.00 0.00 0.00 46.02 44.20 2jtc n GLY 237 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jtc n ALA 238 N 2.47 -0.13 -0.39 4.61 0.00 -1.26 -4.93 120.51 120.88 2jtc n ALA 238 Ca 0.67 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2jtc n ALA 238 Cb 0.31 0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.80 2jtc n ALA 238 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jtc n GLY 239 N 2.90 -0.56 2.41 0.00 0.00 -1.26 -4.78 105.19 103.90 2jtc n GLY 239 Ca 0.04 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 44.94 2jtc n GLY 239 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jtc n GLY 240 N 1.36 5.90 2.89 -0.02 0.00 -1.26 -4.78 105.19 109.28 2jtc n GLY 240 Ca 0.00 -2.44 -0.25 0.00 0.00 0.00 0.00 46.02 43.33 2jtc n GLY 240 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2jtc n PHE 241 N -0.77 0.72 -3.51 1.61 1.16 -1.26 -5.03 117.46 110.38 2jtc n PHE 241 Ca 0.56 -2.06 -0.27 0.00 -1.87 0.00 0.00 57.45 53.81 2jtc n PHE 241 Cb 0.62 -0.20 -0.11 0.00 -1.61 0.00 0.00 39.48 38.19 2jtc n PHE 241 CO 0.00 0.00 0.00 1.21 -1.87 0.00 0.00 176.76 176.10 2jtc s ASN 242 N -3.20 2.23 -0.04 5.98 3.04 -1.26 -4.71 114.94 116.97 2jtc s ASN 242 Ca 0.05 -3.17 -0.16 0.00 0.04 0.00 0.00 52.86 49.62 2jtc s ASN 242 Cb 0.00 -0.69 -0.10 0.00 -1.54 0.00 0.00 41.25 38.92 2jtc s ASN 242 CO 0.03 -0.16 0.66 1.23 -3.04 0.00 0.00 177.10 175.82 2jtc h GLY 243 N 5.68 -0.45 -7.16 1.21 0.00 -1.82 -3.42 103.07 97.11 2jtc h GLY 243 Ca 0.23 0.17 -0.60 0.00 0.00 0.00 0.00 47.33 47.12 2jtc h GLY 243 CO 0.44 -0.16 -0.74 -0.19 0.00 0.00 0.00 176.54 175.88 2jtc s TYR 244 N -3.25 2.07 0.00 5.60 1.51 -1.26 -5.00 117.35 117.03 2jtc s TYR 244 Ca -0.09 -2.16 -0.17 0.00 -1.01 0.00 0.00 57.07 53.65 2jtc s TYR 244 Cb 0.01 -1.94 -0.06 0.00 -0.11 0.00 0.00 41.96 39.86 2jtc s TYR 244 CO 0.29 -0.85 0.47 1.14 -1.11 0.00 0.00 175.55 175.49 2jtc s GLN 245 N 1.05 4.08 0.02 -0.62 -2.07 -1.26 -2.75 119.66 118.11 2jtc s GLN 245 Ca 0.13 0.52 -0.28 0.00 -1.82 0.00 0.00 55.36 53.91 2jtc s GLN 245 Cb -0.20 -3.26 0.10 0.00 -1.09 0.00 0.00 33.01 28.55 2jtc s GLN 245 CO -0.13 0.59 0.92 -1.54 -1.32 0.00 0.00 175.29 173.80 2jtc s SER 246 N -0.81 -0.32 0.20 12.60 1.04 -1.19 -1.38 113.70 123.84 2jtc s SER 246 Ca 0.26 -0.07 -0.01 0.00 0.48 0.00 0.00 55.95 56.61 2jtc s SER 246 Cb -0.17 0.39 -0.04 0.00 0.10 0.00 0.00 66.02 66.30 2jtc s SER 246 CO 0.15 -0.65 0.11 0.00 0.98 0.00 0.00 173.24 173.82 2jtc s ALA 247 N -3.12 1.22 -0.20 5.32 0.00 0.36 -2.45 121.76 122.89 2jtc s ALA 247 Ca 0.07 -1.69 -0.01 0.00 0.00 0.00 0.00 51.96 50.33 2jtc s ALA 247 Cb -0.01 1.22 0.01 0.00 0.00 0.00 0.00 23.12 24.35 2jtc s ALA 247 CO -0.07 -0.54 -0.14 0.08 0.00 0.00 0.00 175.76 175.09 2jtc s VAL 248 N -4.06 2.53 0.05 0.00 1.01 0.49 0.15 120.40 120.57 2jtc s VAL 248 Ca 0.36 -0.84 0.07 0.00 0.00 0.00 0.00 61.98 61.57 2jtc s VAL 248 Cb 0.07 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 2jtc s VAL 248 CO 0.10 0.45 -0.20 0.68 0.00 0.00 0.00 175.10 176.14 2jtc s VAL 249 N 1.34 1.61 0.00 2.92 -7.23 -0.70 -0.58 120.40 117.77 2jtc s VAL 249 Ca 0.04 -1.19 0.00 0.00 -1.81 0.00 0.00 61.98 59.02 2jtc s VAL 249 Cb -0.14 -1.40 0.00 0.00 0.56 0.00 0.00 36.38 35.40 2jtc s VAL 249 CO -0.09 0.17 0.00 0.61 -0.31 0.00 0.00 175.10 175.48 2jtc n GLY 250 N 1.83 0.61 3.25 2.32 0.00 -1.25 -1.79 105.19 110.16 2jtc n GLY 250 Ca -0.17 -0.20 -0.43 0.00 0.00 0.00 0.00 46.02 45.21 2jtc n GLY 250 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jtc s ILE 251 N -1.17 4.88 -0.24 -0.61 1.01 -1.26 0.02 121.20 123.83 2jtc s ILE 251 Ca 0.00 -2.29 -0.26 0.00 0.00 0.00 0.00 60.65 58.10 2jtc s ILE 251 Cb 0.00 -4.09 0.09 0.00 0.01 0.00 0.00 42.46 38.46 2jtc s ILE 251 CO 0.00 -0.92 0.80 -1.59 0.00 0.00 0.00 174.94 173.23 2jtc s LYS 252 N 0.57 0.78 0.00 2.79 -2.85 -1.26 -4.94 119.74 114.83 2jtc s LYS 252 Ca 0.13 0.75 0.31 0.00 -1.00 0.00 0.00 55.97 56.16 2jtc s LYS 252 Cb -0.18 0.38 1.82 0.00 -2.06 0.00 0.00 37.83 37.78 2jtc s LYS 252 CO -0.04 -0.13 2.15 -0.35 0.10 0.00 0.00 175.35 177.08