#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jim s VAL 17 N 0.00 4.89 -0.89 2.52 1.01 0.41 -4.12 120.40 124.21 1jim s VAL 17 Ca 0.00 2.00 -0.01 0.00 0.00 0.00 0.00 61.98 63.97 1jim s VAL 17 Cb 0.00 -4.29 0.00 0.00 0.00 0.00 0.00 36.38 32.09 1jim s VAL 17 CO 0.00 0.16 0.11 0.61 0.00 0.00 0.00 175.10 175.98 1jim n GLY 18 N 2.93 -0.04 3.39 4.51 0.00 -1.24 -1.39 105.19 113.34 1jim n GLY 18 Ca 0.05 -0.39 -0.18 0.00 0.00 0.00 0.00 46.02 45.51 1jim n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jim n GLY 19 N -1.06 2.07 3.31 -0.02 0.00 -1.26 -4.83 105.19 103.39 1jim n GLY 19 Ca -0.11 -2.22 -0.23 0.00 0.00 0.00 0.00 46.02 43.46 1jim n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jim s THR 20 N -2.16 1.79 0.24 2.61 -4.23 -0.21 -4.91 115.64 108.76 1jim s THR 20 Ca 0.50 -1.69 -0.31 0.00 -1.18 0.00 0.00 61.69 59.00 1jim s THR 20 Cb -0.04 -1.69 -0.12 0.00 1.34 0.00 0.00 72.50 71.99 1jim s THR 20 CO 0.31 -0.14 1.65 1.21 -0.54 0.00 0.00 174.62 177.11 1jim n GLU 21 N 0.78 2.68 -2.58 3.99 2.13 -1.26 -0.28 120.64 126.10 1jim n GLU 21 Ca -0.17 0.96 -0.34 0.00 0.66 0.00 0.00 57.16 58.27 1jim n GLU 21 Cb 0.55 -2.77 -0.04 0.00 0.27 0.00 0.00 31.44 29.45 1jim n GLU 21 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1jim s ALA 22 N 0.64 2.91 0.57 4.31 0.00 0.47 -4.79 121.76 125.86 1jim s ALA 22 Ca 0.71 0.59 -0.19 0.00 0.00 0.00 0.00 51.96 53.07 1jim s ALA 22 Cb -0.52 -3.24 -0.05 0.00 0.00 0.00 0.00 23.12 19.31 1jim s ALA 22 CO 0.40 -0.25 1.19 -0.65 0.00 0.00 0.00 175.76 176.45 1jim s GLN 23 N -3.15 3.14 0.35 0.00 -0.21 -1.26 -4.86 119.66 113.66 1jim s GLN 23 Ca 0.66 1.77 0.12 0.00 0.02 0.00 0.00 55.36 57.93 1jim s GLN 23 Cb -0.16 -1.99 0.92 0.00 1.00 0.00 0.00 33.01 32.79 1jim s GLN 23 CO 0.20 -1.06 1.78 0.00 -2.12 0.00 0.00 175.29 174.09 1jim h ARG 24 N 1.06 0.56 -0.50 2.91 3.08 -1.98 -2.66 114.38 116.86 1jim h ARG 24 Ca -0.50 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.51 1jim h ARG 24 Cb 1.28 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.21 1jim h ARG 24 CO 0.56 0.37 0.00 0.27 -1.07 0.00 0.00 179.97 180.10 1jim n ASN 25 N -4.69 3.33 -0.12 7.04 6.94 -1.26 -4.74 115.26 121.75 1jim n ASN 25 Ca 0.24 -1.99 -0.12 0.00 -0.02 0.00 0.00 54.58 52.69 1jim n ASN 25 Cb 0.70 -0.33 -0.02 0.00 -2.36 0.00 0.00 39.78 37.77 1jim n ASN 25 CO 0.00 0.00 0.00 0.28 -1.03 0.00 0.00 177.26 176.51 1jim h SER 26 N 2.97 0.76 -2.23 0.53 0.02 -1.82 -3.40 113.55 110.39 1jim h SER 26 Ca 0.00 -0.39 -0.58 0.00 -0.84 0.00 0.00 61.79 59.98 1jim h SER 26 Cb 0.83 -0.21 -0.42 0.00 0.14 0.00 0.00 62.40 62.75 1jim h SER 26 CO 0.00 0.98 -0.69 0.79 -1.14 0.00 0.00 176.83 176.77 1jim n TRP 27 N -4.33 3.47 1.13 3.45 7.02 -1.26 -4.99 117.44 121.93 1jim n TRP 27 Ca -0.02 -4.02 0.10 0.00 -1.02 0.00 0.00 57.50 52.55 1jim n TRP 27 Cb 0.38 -0.50 0.57 0.00 -2.42 0.00 0.00 31.31 29.34 1jim n TRP 27 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 1jim n PRO 28 N 0.19 0.44 0.00 -0.99 -0.04 -1.26 -2.07 135.00 131.27 1jim n PRO 28 Ca 0.30 0.06 0.13 0.00 -0.04 0.00 0.00 63.50 63.94 1jim n PRO 28 Cb 0.42 -1.50 0.40 0.00 -0.04 0.00 0.00 33.50 32.78 1jim n PRO 28 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1jim n SER 29 N -1.18 0.66 -4.72 3.54 3.41 -1.20 -2.30 113.62 111.83 1jim n SER 29 Ca 0.12 -0.51 -0.42 0.00 -0.26 0.00 0.00 58.87 57.81 1jim n SER 29 Cb 0.13 0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 1jim n SER 29 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1jim s GLN 30 N -2.70 4.31 0.23 4.33 2.00 -0.88 -1.02 119.66 125.93 1jim s GLN 30 Ca 0.20 2.13 0.11 0.00 -2.00 0.00 0.00 55.36 55.80 1jim s GLN 30 Cb 0.19 -3.22 -0.05 0.00 0.80 0.00 0.00 33.01 30.74 1jim s GLN 30 CO 0.57 -0.43 -0.20 0.96 -0.50 0.00 0.00 175.29 175.69 1jim s ILE 31 N 0.88 2.54 -0.25 -2.34 -5.25 -0.74 -4.44 121.20 111.61 1jim s ILE 31 Ca 0.64 -2.15 -0.13 0.00 -0.99 0.00 0.00 60.65 58.02 1jim s ILE 31 Cb -0.38 -2.28 -0.04 0.00 2.95 0.00 0.00 42.46 42.71 1jim s ILE 31 CO 0.32 -0.24 0.29 -0.55 -1.79 0.00 0.00 174.94 172.97 1jim s SER 32 N -3.08 6.21 -0.33 4.36 0.15 -0.03 -2.83 113.70 118.16 1jim s SER 32 Ca 0.25 0.24 -0.19 0.00 0.70 0.00 0.00 55.95 56.95 1jim s SER 32 Cb -0.07 -2.17 -0.01 0.00 -1.71 0.00 0.00 66.02 62.06 1jim s SER 32 CO 0.13 -0.07 0.56 -0.22 1.20 0.00 0.00 173.24 174.84 1jim s LEU 33 N 1.58 4.24 0.04 3.45 2.96 0.52 -1.07 118.68 130.40 1jim s LEU 33 Ca 0.12 0.18 0.09 0.00 -0.22 0.00 0.00 54.13 54.30 1jim s LEU 33 Cb -0.15 -2.68 -0.03 0.00 0.50 0.00 0.00 46.19 43.83 1jim s LEU 33 CO 0.08 -0.47 -0.25 -1.10 -1.32 0.00 0.00 176.35 173.29 1jim s GLN 34 N 2.48 1.73 0.20 1.98 -0.21 -0.11 0.16 119.66 125.89 1jim s GLN 34 Ca 0.21 -1.07 0.10 0.00 0.02 0.00 0.00 55.36 54.62 1jim s GLN 34 Cb -0.15 -1.89 -0.04 0.00 1.00 0.00 0.00 33.01 31.93 1jim s GLN 34 CO 0.13 0.49 -0.11 1.52 -2.12 0.00 0.00 175.29 175.19 1jim s TYR 35 N -0.80 2.57 -0.33 0.91 1.13 -0.61 0.60 117.35 120.82 1jim s TYR 35 Ca 0.11 -0.25 -0.26 0.00 -1.41 0.00 0.00 57.07 55.26 1jim s TYR 35 Cb -0.10 -1.23 0.01 0.00 -1.10 0.00 0.00 41.96 39.54 1jim s TYR 35 CO 0.02 0.54 0.92 0.50 -2.51 0.00 0.00 175.55 175.02 1jim s ARG 36 N -2.94 3.96 -0.70 -3.49 3.52 -0.59 -1.58 118.95 117.13 1jim s ARG 36 Ca 0.25 0.75 0.05 0.00 -0.13 0.00 0.00 55.73 56.65 1jim s ARG 36 Cb -0.08 -3.75 0.18 0.00 -1.56 0.00 0.00 34.95 29.74 1jim s ARG 36 CO 0.15 -0.83 0.53 0.45 -0.81 0.00 0.00 175.30 174.79 1jim n SER 36 N 6.58 3.14 0.00 -2.12 2.88 0.19 -4.74 113.62 119.55 1jim n SER 36 Ca 0.07 -3.25 0.00 0.00 -1.33 0.00 0.00 58.87 54.37 1jim n SER 36 Cb 0.48 -0.75 0.00 0.00 -0.75 0.00 0.00 64.21 63.19 1jim n SER 36 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1jim n GLY 36 N 1.80 1.64 0.60 0.46 0.00 -1.26 -1.79 105.19 106.63 1jim n GLY 36 Ca 0.21 -0.32 0.05 0.00 0.00 0.00 0.00 46.02 45.97 1jim n GLY 36 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1jim n SER 36 N 9.37 2.94 -4.32 1.61 2.88 -1.26 -5.03 113.62 119.81 1jim n SER 36 Ca 0.00 -2.14 -0.29 0.00 -1.33 0.00 0.00 58.87 55.11 1jim n SER 36 Cb 0.00 -0.25 -0.08 0.00 -0.75 0.00 0.00 64.21 63.14 1jim n SER 36 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1jim s SER 37 N -1.14 3.35 -0.09 -3.46 0.15 -0.74 -5.16 113.70 106.62 1jim s SER 37 Ca 0.23 -1.70 0.03 0.00 0.70 0.00 0.00 55.95 55.21 1jim s SER 37 Cb 0.14 0.59 0.00 0.00 -1.71 0.00 0.00 66.02 65.04 1jim s SER 37 CO 0.13 -0.94 -0.20 0.26 1.20 0.00 0.00 173.24 173.69 1jim s TRP 38 N -3.07 2.20 0.06 3.44 0.52 -1.26 0.55 118.94 121.37 1jim s TRP 38 Ca 0.15 -0.88 0.07 0.00 0.02 0.00 0.00 56.10 55.47 1jim s TRP 38 Cb 0.01 -1.50 -0.03 0.00 -1.15 0.00 0.00 33.47 30.80 1jim s TRP 38 CO 0.10 -0.37 -0.17 0.00 0.02 0.00 0.00 176.95 176.53 1jim s ALA 39 N 0.44 2.67 0.21 0.98 0.00 -0.62 -4.93 121.76 120.51 1jim s ALA 39 Ca -0.17 -1.22 -0.30 0.00 0.00 0.00 0.00 51.96 50.27 1jim s ALA 39 Cb -0.17 -0.76 -0.09 0.00 0.00 0.00 0.00 23.12 22.10 1jim s ALA 39 CO 0.07 0.58 1.25 -1.58 0.00 0.00 0.00 175.76 176.08 1jim s HIS 40 N -0.99 3.33 -0.04 0.00 2.46 -1.26 -1.58 115.29 117.21 1jim s HIS 40 Ca 0.16 1.35 0.01 0.00 0.47 0.00 0.00 55.06 57.05 1jim s HIS 40 Cb -0.11 -3.52 -0.03 0.00 -0.13 0.00 0.00 32.58 28.80 1jim s HIS 40 CO 0.07 -1.51 -0.02 -2.37 -2.47 0.00 0.00 174.74 168.44 1jim n THR 41 N 2.32 0.22 -3.94 0.89 5.66 0.12 -4.91 114.28 114.64 1jim n THR 41 Ca 0.04 -0.10 -0.08 0.00 -3.05 0.00 0.00 64.05 60.86 1jim n THR 41 Cb 0.44 -0.70 -0.08 0.00 -1.55 0.00 0.00 70.33 68.43 1jim n THR 41 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1jim n GLY 43 N -0.03 0.72 2.85 0.00 0.00 -0.53 -0.36 105.19 107.84 1jim n GLY 43 Ca -0.14 -1.99 -0.00 0.00 0.00 0.00 0.00 46.02 43.88 1jim n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jim n GLY 44 N 1.42 0.60 2.92 -0.02 0.00 -1.13 -3.63 105.19 105.37 1jim n GLY 44 Ca 0.08 -1.05 -0.22 0.00 0.00 0.00 0.00 46.02 44.83 1jim n GLY 44 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1jim s THR 45 N -2.14 0.72 -0.16 2.61 2.01 -0.25 -1.79 115.64 116.64 1jim s THR 45 Ca 0.19 -0.22 -0.29 0.00 0.31 0.00 0.00 61.69 61.68 1jim s THR 45 Cb -0.01 -0.72 -0.03 0.00 0.01 0.00 0.00 72.50 71.75 1jim s THR 45 CO 0.02 0.27 1.44 -0.22 -0.69 0.00 0.00 174.62 175.45 1jim s LEU 46 N 0.93 4.13 -0.03 4.42 2.96 -0.19 -1.31 118.68 129.60 1jim s LEU 46 Ca -0.11 1.78 0.07 0.00 -0.22 0.00 0.00 54.13 55.65 1jim s LEU 46 Cb -0.15 -3.54 -0.10 0.00 0.50 0.00 0.00 46.19 42.91 1jim s LEU 46 CO 0.00 -0.94 0.11 2.30 -1.32 0.00 0.00 176.35 176.51 1jim n ILE 47 N 5.69 0.13 -4.00 6.68 -5.35 -0.49 -0.42 119.36 121.60 1jim n ILE 47 Ca 0.16 -0.19 -0.08 0.00 -0.27 0.00 0.00 62.75 62.37 1jim n ILE 47 Cb 0.44 -0.00 -0.09 0.00 -1.74 0.00 0.00 39.64 38.25 1jim n ILE 47 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1jim s ARG 48 N -2.38 0.63 0.20 6.28 3.00 -0.71 -4.73 118.95 121.23 1jim s ARG 48 Ca -0.03 -1.02 0.12 0.00 0.00 0.00 0.00 55.73 54.81 1jim s ARG 48 Cb 0.04 0.23 0.66 0.00 0.00 0.00 0.00 34.95 35.88 1jim s ARG 48 CO 0.28 -0.14 1.35 1.04 0.00 0.00 0.00 175.30 177.82 1jim n GLN 49 N 0.34 0.08 -0.10 3.54 6.02 -1.26 -2.21 117.38 123.79 1jim n GLN 49 Ca -0.16 0.56 0.03 0.00 -0.01 0.00 0.00 57.00 57.43 1jim n GLN 49 Cb 0.60 -1.81 0.05 0.00 1.02 0.00 0.00 30.24 30.10 1jim n GLN 49 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 1jim n ASN 50 N -1.92 1.47 -3.85 1.08 2.04 -1.26 -1.76 115.26 111.06 1jim n ASN 50 Ca -0.01 -2.21 -0.13 0.00 -0.44 0.00 0.00 54.58 51.80 1jim n ASN 50 Cb 0.06 -0.18 -0.14 0.00 -2.53 0.00 0.00 39.78 36.99 1jim n ASN 50 CO 0.00 0.00 0.00 0.26 -0.44 0.00 0.00 177.26 177.08 1jim s TRP 51 N -1.31 0.01 0.01 -2.53 0.52 -0.94 -0.94 118.94 113.76 1jim s TRP 51 Ca 0.11 0.03 0.08 0.00 0.02 0.00 0.00 56.10 56.34 1jim s TRP 51 Cb 0.09 -0.06 -0.02 0.00 -1.15 0.00 0.00 33.47 32.33 1jim s TRP 51 CO 0.01 -0.02 -0.25 0.08 0.02 0.00 0.00 176.95 176.79 1jim s VAL 52 N 0.26 1.99 -0.20 4.03 1.01 -0.51 -1.40 120.40 125.58 1jim s VAL 52 Ca -0.02 -1.18 -0.07 0.00 0.00 0.00 0.00 61.98 60.71 1jim s VAL 52 Cb -0.03 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 1jim s VAL 52 CO -0.01 0.46 0.06 -0.32 0.00 0.00 0.00 175.10 175.30 1jim s MET 53 N -0.84 3.90 0.00 2.72 1.75 -0.43 0.07 119.30 126.47 1jim s MET 53 Ca 0.10 -0.38 0.00 0.00 -1.25 0.00 0.00 55.69 54.16 1jim s MET 53 Cb -0.10 -3.23 0.00 0.00 2.84 0.00 0.00 34.83 34.34 1jim s MET 53 CO 0.00 0.18 0.00 -2.37 -0.65 0.00 0.00 175.02 172.18 1jim n THR 54 N 3.83 0.00 -3.60 10.11 5.66 -0.35 -1.09 114.28 128.83 1jim n THR 54 Ca -0.16 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.46 1jim n THR 54 Cb 0.52 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.24 1jim n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1jim s ALA 55 N -1.78 3.75 0.27 1.79 0.00 -1.26 -0.94 121.76 123.59 1jim s ALA 55 Ca 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 51.96 51.62 1jim s ALA 55 Cb 0.00 -2.28 0.60 0.00 0.00 0.00 0.00 23.12 21.44 1jim s ALA 55 CO 0.00 0.52 1.69 0.00 0.00 0.00 0.00 175.76 177.97 1jim h ALA 56 N 4.75 1.19 -0.99 0.00 0.00 -1.72 -1.79 119.26 120.69 1jim h ALA 56 Ca -0.52 0.17 0.28 0.00 0.00 0.00 0.00 54.91 54.84 1jim h ALA 56 Cb 1.22 0.20 -0.04 0.00 0.00 0.00 0.00 17.79 19.17 1jim h ALA 56 CO 0.61 -0.34 0.71 1.25 0.00 0.00 0.00 179.25 181.47 1jim h HIS 57 N 0.33 0.05 0.00 0.00 -0.00 -1.93 -1.24 115.15 112.35 1jim h HIS 57 Ca 0.49 0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.81 1jim h HIS 57 Cb 0.89 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 28.28 1jim h HIS 57 CO -0.21 0.01 -0.26 0.00 -0.00 0.00 0.00 177.93 177.47 1jim n VAL 59 N -3.23 2.30 0.08 0.00 0.24 -0.48 -4.66 118.33 112.59 1jim n VAL 59 Ca 0.02 -2.35 0.01 0.00 -2.04 0.00 0.00 64.34 59.98 1jim n VAL 59 Cb 0.57 -0.28 0.34 0.00 -1.47 0.00 0.00 33.84 33.01 1jim n VAL 59 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1jim h ASP 60 N 1.13 0.30 -3.49 -1.34 3.32 -1.51 -3.43 116.42 111.41 1jim h ASP 60 Ca 0.08 -0.07 -0.53 0.00 0.02 0.00 0.00 57.03 56.53 1jim h ASP 60 Cb 1.41 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 40.85 1jim h ASP 60 CO 0.23 0.47 0.14 -0.13 -1.72 0.00 0.00 179.24 178.22 1jim s ARG 61 N -4.71 4.48 -1.20 3.56 1.81 -1.26 -4.97 118.95 116.66 1jim s ARG 61 Ca -0.06 1.06 -0.13 0.00 -1.72 0.00 0.00 55.73 54.88 1jim s ARG 61 Cb 0.15 -3.21 0.18 0.00 -0.45 0.00 0.00 34.95 31.63 1jim s ARG 61 CO 0.75 0.56 1.40 -1.21 -0.68 0.00 0.00 175.30 176.11 1jim s GLU 62 N -1.25 4.11 0.39 3.54 2.02 -1.26 -4.93 118.70 121.32 1jim s GLU 62 Ca 0.36 -2.67 0.08 0.00 0.02 0.00 0.00 54.97 52.76 1jim s GLU 62 Cb -0.22 -5.00 -0.06 0.00 0.10 0.00 0.00 34.13 28.95 1jim s GLU 62 CO 0.24 -1.70 0.09 -0.51 0.02 0.00 0.00 175.26 173.41 1jim s LEU 63 N 1.23 3.02 -0.20 1.80 1.43 -1.26 -5.12 118.68 119.57 1jim s LEU 63 Ca 0.41 -1.13 -0.14 0.00 -1.03 0.00 0.00 54.13 52.24 1jim s LEU 63 Cb -0.04 -1.27 -0.04 0.00 0.03 0.00 0.00 46.19 44.86 1jim s LEU 63 CO -0.01 -0.44 0.30 -0.89 0.23 0.00 0.00 176.35 175.53 1jim s THR 64 N -2.61 5.28 0.07 5.49 2.01 -1.26 -5.00 115.64 119.61 1jim s THR 64 Ca 0.38 0.50 0.07 0.00 0.31 0.00 0.00 61.69 62.95 1jim s THR 64 Cb 0.05 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.89 1jim s THR 64 CO 0.21 0.31 -0.16 -0.36 -0.69 0.00 0.00 174.62 173.93 1jim s PHE 65 N 1.03 2.60 0.11 4.92 0.08 -1.26 -1.54 117.98 123.92 1jim s PHE 65 Ca 0.15 -0.23 0.03 0.00 0.12 0.00 0.00 56.93 57.00 1jim s PHE 65 Cb -0.14 -1.44 -0.04 0.00 -0.57 0.00 0.00 43.02 40.83 1jim s PHE 65 CO 0.06 0.33 -0.08 -0.98 -0.10 0.00 0.00 175.22 174.44 1jim s ARG 65 N -1.75 0.87 -0.15 0.44 1.70 0.20 -3.14 118.95 117.12 1jim s ARG 65 Ca 0.17 -1.29 -0.05 0.00 -0.47 0.00 0.00 55.73 54.09 1jim s ARG 65 Cb -0.11 -0.39 -0.03 0.00 -0.57 0.00 0.00 34.95 33.85 1jim s ARG 65 CO 0.08 0.03 0.02 0.08 -1.08 0.00 0.00 175.30 174.43 1jim s VAL 66 N -3.14 4.39 -0.32 4.99 1.01 0.16 -0.94 120.40 126.56 1jim s VAL 66 Ca 0.10 -0.19 -0.04 0.00 0.00 0.00 0.00 61.98 61.86 1jim s VAL 66 Cb 0.02 -2.93 0.04 0.00 0.00 0.00 0.00 36.38 33.51 1jim s VAL 66 CO -0.02 0.50 0.05 -0.69 0.00 0.00 0.00 175.10 174.94 1jim s VAL 67 N 0.09 3.36 0.06 2.92 1.01 -0.23 -0.55 120.40 127.05 1jim s VAL 67 Ca 0.03 -1.26 -0.09 0.00 0.00 0.00 0.00 61.98 60.66 1jim s VAL 67 Cb -0.13 -2.91 -0.06 0.00 0.00 0.00 0.00 36.38 33.29 1jim s VAL 67 CO 0.02 -0.13 0.37 0.68 0.00 0.00 0.00 175.10 176.03 1jim s VAL 68 N 1.32 5.14 -0.59 2.92 -7.23 -0.74 -0.85 120.40 120.38 1jim s VAL 68 Ca -0.04 0.38 0.00 0.00 -1.81 0.00 0.00 61.98 60.52 1jim s VAL 68 Cb -0.20 -3.63 0.00 0.00 0.56 0.00 0.00 36.38 33.12 1jim s VAL 68 CO 0.01 0.30 0.00 0.61 -0.31 0.00 0.00 175.10 175.71 1jim n GLY 69 N 0.94 0.21 3.75 2.32 0.00 -1.25 -0.65 105.19 110.52 1jim n GLY 69 Ca -0.09 -0.63 -0.39 0.00 0.00 0.00 0.00 46.02 44.91 1jim n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1jim s GLU 70 N -4.08 4.37 0.07 1.61 2.56 -1.26 -3.93 118.70 118.04 1jim s GLU 70 Ca 0.00 0.80 -0.02 0.00 0.00 0.00 0.00 54.97 55.76 1jim s GLU 70 Cb 0.00 -3.36 -0.01 0.00 2.00 0.00 0.00 34.13 32.76 1jim s GLU 70 CO 0.00 0.30 -0.03 1.58 -0.56 0.00 0.00 175.26 176.55 1jim n HIS 71 N 2.93 0.00 -3.66 5.30 -0.00 -1.26 -4.92 115.22 113.60 1jim n HIS 71 Ca -0.05 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.30 1jim n HIS 71 Cb 0.51 -0.05 -0.11 0.00 -0.00 0.00 0.00 29.99 30.34 1jim n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1jim s ASN 72 N -5.97 5.85 0.46 0.26 3.84 -1.26 -2.15 114.94 115.96 1jim s ASN 72 Ca -0.03 -0.02 0.12 0.00 0.21 0.00 0.00 52.86 53.14 1jim s ASN 72 Cb 0.00 -2.07 1.04 0.00 -0.55 0.00 0.00 41.25 39.68 1jim s ASN 72 CO 0.04 -0.01 2.08 -0.07 -2.79 0.00 0.00 177.10 176.36 1jim h LEU 73 N 8.06 0.21 -2.24 3.21 3.38 -0.02 -3.03 115.31 124.88 1jim h LEU 73 Ca -0.36 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1jim h LEU 73 Cb 1.18 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1jim h LEU 73 CO 0.59 0.19 0.00 0.59 0.09 0.00 0.00 178.44 179.89 1jim n ASN 74 N -4.48 3.13 -3.99 -0.43 4.13 -1.26 -4.98 115.26 107.38 1jim n ASN 74 Ca -0.00 -1.91 -0.09 0.00 1.68 0.00 0.00 54.58 54.26 1jim n ASN 74 Cb 0.10 -0.19 -0.10 0.00 -1.54 0.00 0.00 39.78 38.05 1jim n ASN 74 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1jim s GLN 75 N -1.37 0.43 -0.31 3.52 -0.21 -1.15 -5.11 119.66 115.47 1jim s GLN 75 Ca 0.32 -0.76 -0.27 0.00 0.02 0.00 0.00 55.36 54.67 1jim s GLN 75 Cb 0.19 0.16 0.01 0.00 1.00 0.00 0.00 33.01 34.37 1jim s GLN 75 CO 0.27 -0.08 0.99 1.21 -2.12 0.00 0.00 175.29 175.56 1jim s ASN 76 N -1.88 6.87 0.13 5.90 2.47 -1.26 -4.55 114.94 122.61 1jim s ASN 76 Ca -0.09 0.96 0.25 0.00 0.42 0.00 0.00 52.86 54.40 1jim s ASN 76 Cb -0.04 -2.51 0.56 0.00 -1.45 0.00 0.00 41.25 37.81 1jim s ASN 76 CO -0.03 -0.80 1.50 0.59 -3.72 0.00 0.00 177.10 174.64 1jim n ASN 77 N 6.66 0.67 0.00 -4.21 3.02 -1.26 -4.96 115.26 115.18 1jim n ASN 77 Ca 0.10 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.89 1jim n ASN 77 Cb 0.47 -0.16 0.00 0.00 -0.61 0.00 0.00 39.78 39.49 1jim n ASN 77 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jim n GLY 78 N 1.36 0.76 0.02 7.41 0.00 -1.26 -4.88 105.19 108.61 1jim n GLY 78 Ca 0.04 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.07 1jim n GLY 78 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1jim n THR 79 N -2.22 0.00 -1.95 2.61 -2.24 -1.26 -5.07 114.28 104.15 1jim n THR 79 Ca 0.00 -0.49 -0.41 0.00 -2.27 0.00 0.00 64.05 60.88 1jim n THR 79 Cb 0.02 1.01 -0.01 0.00 -2.10 0.00 0.00 70.33 69.24 1jim n THR 79 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1jim s GLU 80 N -0.65 4.23 -0.07 -0.78 8.01 -1.25 -4.43 118.70 123.76 1jim s GLU 80 Ca 0.01 2.39 0.05 0.00 0.01 0.00 0.00 54.97 57.43 1jim s GLU 80 Cb 0.01 -3.04 -0.00 0.00 -4.31 0.00 0.00 34.13 26.78 1jim s GLU 80 CO 0.03 -0.40 -0.23 -0.65 0.01 0.00 0.00 175.26 174.02 1jim s GLN 81 N -1.42 2.53 -0.28 1.61 -0.21 0.18 -5.02 119.66 117.05 1jim s GLN 81 Ca 0.54 -0.82 -0.06 0.00 0.02 0.00 0.00 55.36 55.04 1jim s GLN 81 Cb -0.43 -2.06 0.00 0.00 1.00 0.00 0.00 33.01 31.52 1jim s GLN 81 CO 0.53 0.27 0.06 0.71 -2.12 0.00 0.00 175.29 174.75 1jim s TYR 82 N 0.08 3.11 -0.03 0.91 2.02 -1.26 -1.79 117.35 120.39 1jim s TYR 82 Ca -0.09 -0.91 0.04 0.00 -0.37 0.00 0.00 57.07 55.74 1jim s TYR 82 Cb -0.15 -2.23 -0.00 0.00 -0.40 0.00 0.00 41.96 39.18 1jim s TYR 82 CO 0.05 -0.54 -0.15 0.08 -1.57 0.00 0.00 175.55 173.42 1jim s VAL 83 N 1.51 1.21 0.58 0.71 1.01 0.28 -4.99 120.40 120.71 1jim s VAL 83 Ca 0.03 -0.61 -0.17 0.00 0.00 0.00 0.00 61.98 61.23 1jim s VAL 83 Cb -0.16 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 1jim s VAL 83 CO 0.02 0.35 1.10 -0.83 0.00 0.00 0.00 175.10 175.74 1jim s GLY 84 N -0.04 2.36 -0.20 4.51 0.00 -1.26 0.38 107.32 113.08 1jim s GLY 84 Ca -0.01 0.62 -0.19 0.00 0.00 0.00 0.00 44.72 45.13 1jim s GLY 84 CO 0.01 0.96 0.56 0.14 0.00 0.00 0.00 173.10 174.77 1jim s VAL 85 N -2.12 5.07 -0.20 1.40 1.01 -1.19 -0.64 120.40 123.73 1jim s VAL 85 Ca 0.68 1.05 0.12 0.00 0.00 0.00 0.00 61.98 63.84 1jim s VAL 85 Cb -0.20 -3.88 -0.23 0.00 0.00 0.00 0.00 36.38 32.07 1jim s VAL 85 CO 0.33 0.15 0.07 1.67 0.00 0.00 0.00 175.10 177.32 1jim n GLN 86 N 4.86 0.68 -3.75 2.72 7.27 0.14 -4.79 117.38 124.50 1jim n GLN 86 Ca -0.03 0.07 -0.12 0.00 0.07 0.00 0.00 57.00 56.98 1jim n GLN 86 Cb 0.50 -1.56 -0.11 0.00 2.41 0.00 0.00 30.24 31.48 1jim n GLN 86 CO 0.00 0.00 0.00 0.21 0.07 0.00 0.00 177.06 177.34 1jim s LYS 87 N -2.51 0.33 -0.11 3.69 2.20 -1.13 -5.00 119.74 117.21 1jim s LYS 87 Ca -0.16 0.48 0.01 0.00 -0.36 0.00 0.00 55.97 55.94 1jim s LYS 87 Cb 0.07 0.10 -0.02 0.00 -1.51 0.00 0.00 37.83 36.47 1jim s LYS 87 CO 0.77 -0.08 -0.15 0.42 -0.36 0.00 0.00 175.35 175.95 1jim s ILE 88 N 0.49 2.91 -0.32 5.43 1.01 -1.26 -1.43 121.20 128.03 1jim s ILE 88 Ca -0.03 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 59.91 1jim s ILE 88 Cb -0.04 -2.19 0.10 0.00 0.01 0.00 0.00 42.46 40.34 1jim s ILE 88 CO -0.03 0.54 0.07 -0.69 0.00 0.00 0.00 174.94 174.84 1jim s VAL 89 N 0.12 1.47 0.32 2.92 1.01 -0.77 -5.03 120.40 120.44 1jim s VAL 89 Ca -0.07 -1.76 -0.09 0.00 0.00 0.00 0.00 61.98 60.06 1jim s VAL 89 Cb -0.15 -2.07 -0.06 0.00 0.00 0.00 0.00 36.38 34.09 1jim s VAL 89 CO 0.05 -0.61 0.64 -0.69 0.00 0.00 0.00 175.10 174.49 1jim s VAL 90 N 1.32 4.89 0.16 2.92 1.01 -1.26 -1.56 120.40 127.89 1jim s VAL 90 Ca 0.09 0.41 -0.31 0.00 0.00 0.00 0.00 61.98 62.17 1jim s VAL 90 Cb -0.18 -3.70 -0.11 0.00 0.00 0.00 0.00 36.38 32.39 1jim s VAL 90 CO -0.17 -0.32 1.77 -2.28 0.00 0.00 0.00 175.10 174.09 1jim s HIS 91 N -2.12 2.51 0.56 5.22 2.46 -0.87 -4.88 115.29 118.18 1jim s HIS 91 Ca 0.48 0.16 0.32 0.00 0.47 0.00 0.00 55.06 56.50 1jim s HIS 91 Cb -0.11 -4.15 1.46 0.00 -0.13 0.00 0.00 32.58 29.65 1jim s HIS 91 CO 0.27 -4.56 1.80 -1.00 -2.47 0.00 0.00 174.74 168.79 1jim h PRO 92 N 7.76 0.00 -0.05 2.88 0.13 -1.93 -2.04 132.00 138.75 1jim h PRO 92 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1jim h PRO 92 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1jim h PRO 92 CO 0.95 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.38 1jim n TYR 93 N -3.94 0.04 -2.10 1.56 4.01 -1.26 -4.95 117.16 110.52 1jim n TYR 93 Ca 0.19 -0.02 -0.41 0.00 -0.16 0.00 0.00 57.90 57.49 1jim n TYR 93 Cb 1.04 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 40.05 1jim n TYR 93 CO 0.00 0.00 0.00 -0.46 -0.46 0.00 0.00 176.86 175.94 1jim s TRP 94 N -1.96 3.14 -0.10 -0.72 -0.00 -0.77 -4.86 118.94 113.67 1jim s TRP 94 Ca 0.34 1.08 -0.01 0.00 -0.00 0.00 0.00 56.10 57.51 1jim s TRP 94 Cb 0.20 -3.73 0.03 0.00 -0.00 0.00 0.00 33.47 29.98 1jim s TRP 94 CO 0.32 -2.37 -0.03 1.21 -0.00 0.00 0.00 176.95 176.08 1jim s ASN 95 N 0.45 1.92 0.48 5.86 2.47 -1.26 -5.01 114.94 119.84 1jim s ASN 95 Ca 0.59 -0.22 0.36 0.00 0.42 0.00 0.00 52.86 54.01 1jim s ASN 95 Cb -0.39 -0.62 1.51 0.00 -1.45 0.00 0.00 41.25 40.31 1jim s ASN 95 CO 0.39 -0.17 1.63 0.74 -3.72 0.00 0.00 177.10 175.97 1jim h THR 96 N 6.28 0.13 -0.01 -5.21 2.02 -1.97 0.14 112.91 114.29 1jim h THR 96 Ca -0.23 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 66.93 1jim h THR 96 Cb 1.13 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1jim h THR 96 CO 0.32 0.01 -0.25 0.47 0.37 0.00 0.00 175.52 176.44 1jim n ASP 97 N -4.44 0.96 -3.20 4.18 8.00 -1.26 -4.51 116.55 116.27 1jim n ASP 97 Ca 0.38 -0.84 -0.24 0.00 0.71 0.00 0.00 54.79 54.80 1jim n ASP 97 Cb 1.56 0.12 -0.07 0.00 -0.02 0.00 0.00 41.12 42.70 1jim n ASP 97 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1jim n ASP 98 N -0.70 0.08 -1.91 -2.24 2.03 0.50 -5.05 116.55 109.26 1jim n ASP 98 Ca 0.12 -2.67 0.00 0.00 0.52 0.00 0.00 54.79 52.76 1jim n ASP 98 Cb 0.34 -0.61 0.00 0.00 -0.72 0.00 0.00 41.12 40.13 1jim n ASP 98 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1jim n VAL 99 N 1.54 0.25 0.00 5.18 0.31 -1.25 -3.98 118.33 120.36 1jim n VAL 99 Ca 0.22 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.49 1jim n VAL 99 Cb 0.53 -1.05 0.00 0.00 -0.91 0.00 0.00 33.84 32.41 1jim n VAL 99 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1jim n ALA 99 N 1.90 0.00 0.00 3.52 0.00 -1.26 -4.76 120.51 119.91 1jim n ALA 99 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1jim n ALA 99 Cb 0.06 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.51 1jim n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jim n GLY 100 N 0.00 -1.10 2.66 0.00 0.00 -1.26 -5.00 105.19 100.49 1jim n GLY 100 Ca 0.00 -1.84 -0.18 0.00 0.00 0.00 0.00 46.02 44.01 1jim n GLY 100 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1jim n TYR 101 N 0.00 -1.41 -2.27 1.61 4.01 -1.26 -4.62 117.16 113.22 1jim n TYR 101 Ca 0.00 0.32 -0.43 0.00 -0.16 0.00 0.00 57.90 57.64 1jim n TYR 101 Cb 0.00 -3.75 0.00 0.00 -0.31 0.00 0.00 39.34 35.28 1jim n TYR 101 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1jim n ASP 102 N -1.59 4.71 -3.73 7.72 -0.08 -1.26 -4.38 116.55 117.94 1jim n ASP 102 Ca -0.12 -2.99 -0.12 0.00 -1.51 0.00 0.00 54.79 50.06 1jim n ASP 102 Cb 0.61 -1.58 -0.11 0.00 2.34 0.00 0.00 41.12 42.38 1jim n ASP 102 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1jim s ILE 103 N 1.88 -0.02 0.02 5.18 2.07 -1.26 -4.16 121.20 124.91 1jim s ILE 103 Ca 0.44 0.08 -0.01 0.00 -1.41 0.00 0.00 60.65 59.75 1jim s ILE 103 Cb 0.08 -0.50 -0.02 0.00 0.13 0.00 0.00 42.46 42.16 1jim s ILE 103 CO -0.02 0.03 -0.02 0.00 -1.91 0.00 0.00 174.94 173.03 1jim s ALA 104 N 0.93 0.15 -0.12 1.50 0.00 -0.11 -2.05 121.76 122.06 1jim s ALA 104 Ca -0.06 -0.66 0.02 0.00 0.00 0.00 0.00 51.96 51.25 1jim s ALA 104 Cb -0.07 0.17 0.02 0.00 0.00 0.00 0.00 23.12 23.24 1jim s ALA 104 CO -0.07 -0.20 -0.16 -0.51 0.00 0.00 0.00 175.76 174.82 1jim s LEU 105 N -1.70 1.80 -0.31 0.00 1.43 -0.60 -1.21 118.68 118.10 1jim s LEU 105 Ca -0.12 -0.48 -0.10 0.00 -1.03 0.00 0.00 54.13 52.40 1jim s LEU 105 Cb -0.07 -1.18 -0.01 0.00 0.03 0.00 0.00 46.19 44.95 1jim s LEU 105 CO -0.02 0.02 0.16 -0.76 0.23 0.00 0.00 176.35 175.97 1jim s LEU 106 N 1.04 4.10 -0.03 1.79 1.43 0.11 -1.84 118.68 125.29 1jim s LEU 106 Ca -0.04 -0.46 -0.29 0.00 -1.03 0.00 0.00 54.13 52.30 1jim s LEU 106 Cb -0.15 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 44.03 1jim s LEU 106 CO -0.03 -0.18 0.96 -0.60 0.23 0.00 0.00 176.35 176.72 1jim s ARG 107 N 1.63 4.52 0.25 1.70 3.52 -0.51 -1.43 118.95 128.63 1jim s ARG 107 Ca 0.05 1.36 -0.17 0.00 -0.13 0.00 0.00 55.73 56.83 1jim s ARG 107 Cb -0.17 -3.48 -0.08 0.00 -1.56 0.00 0.00 34.95 29.66 1jim s ARG 107 CO 0.07 -0.09 0.71 -0.51 -0.81 0.00 0.00 175.30 174.66 1jim s LEU 108 N 1.20 4.25 0.52 -0.88 1.43 -0.12 0.25 118.68 125.32 1jim s LEU 108 Ca 0.50 1.33 0.25 0.00 -1.03 0.00 0.00 54.13 55.17 1jim s LEU 108 Cb -0.20 -3.72 1.41 0.00 0.03 0.00 0.00 46.19 43.71 1jim s LEU 108 CO 0.25 -0.04 2.08 0.00 0.23 0.00 0.00 176.35 178.87 1jim h ALA 109 N 3.03 1.42 -2.61 4.21 0.00 -1.19 -3.43 119.26 120.69 1jim h ALA 109 Ca -0.48 -0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.19 1jim h ALA 109 Cb 1.19 -0.02 -0.18 0.00 0.00 0.00 0.00 17.79 18.78 1jim h ALA 109 CO 0.65 0.14 -0.65 1.14 0.00 0.00 0.00 179.25 180.54 1jim s GLN 110 N -4.37 0.49 0.16 0.00 0.00 -1.26 -5.02 119.66 109.66 1jim s GLN 110 Ca -0.03 -0.88 -0.31 0.00 -0.00 0.00 0.00 55.36 54.13 1jim s GLN 110 Cb 0.14 0.18 -0.10 0.00 0.00 0.00 0.00 33.01 33.23 1jim s GLN 110 CO 0.60 -0.10 1.58 -1.12 0.00 0.00 0.00 175.29 176.26 1jim s SER 111 N -2.17 6.58 0.51 12.60 0.01 -1.26 -4.73 113.70 125.24 1jim s SER 111 Ca -0.05 2.61 -0.17 0.00 1.31 0.00 0.00 55.95 59.65 1jim s SER 111 Cb -0.01 -2.59 -0.08 0.00 0.21 0.00 0.00 66.02 63.55 1jim s SER 111 CO -0.05 -0.83 1.00 0.68 0.41 0.00 0.00 173.24 174.44 1jim s VAL 112 N 1.28 4.32 -0.12 3.43 -7.23 -0.72 -4.99 120.40 116.37 1jim s VAL 112 Ca 0.71 1.19 -0.20 0.00 -1.81 0.00 0.00 61.98 61.87 1jim s VAL 112 Cb -0.44 -3.62 -0.04 0.00 0.56 0.00 0.00 36.38 32.85 1jim s VAL 112 CO 0.31 -0.57 0.54 -0.89 -0.31 0.00 0.00 175.10 174.19 1jim s THR 113 N -2.48 5.13 0.05 5.32 2.01 -1.26 -4.90 115.64 119.52 1jim s THR 113 Ca 0.61 1.08 -0.27 0.00 0.31 0.00 0.00 61.69 63.42 1jim s THR 113 Cb -0.11 -3.88 -0.05 0.00 0.01 0.00 0.00 72.50 68.47 1jim s THR 113 CO 0.29 0.27 0.83 -0.76 -0.69 0.00 0.00 174.62 174.56 1jim s LEU 114 N 0.91 4.45 0.00 4.42 1.43 -1.26 -4.84 118.68 123.79 1jim s LEU 114 Ca 0.28 1.54 0.00 0.00 -1.03 0.00 0.00 54.13 54.92 1jim s LEU 114 Cb -0.16 -3.34 0.00 0.00 0.03 0.00 0.00 46.19 42.72 1jim s LEU 114 CO 0.12 -0.04 0.00 -0.46 0.23 0.00 0.00 176.35 176.20 1jim n ASN 115 N 2.95 0.00 0.03 2.29 0.23 -0.61 -4.98 115.26 115.17 1jim n ASN 115 Ca -0.00 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.16 1jim n ASN 115 Cb 0.50 0.00 0.48 0.00 -2.08 0.00 0.00 39.78 38.68 1jim n ASN 115 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1jim n SER 116 N 0.00 0.17 -0.00 0.53 3.41 -1.26 -2.46 113.62 114.01 1jim n SER 116 Ca 0.00 0.53 0.09 0.00 -0.26 0.00 0.00 58.87 59.22 1jim n SER 116 Cb 0.00 -0.57 -0.11 0.00 -0.26 0.00 0.00 64.21 63.27 1jim n SER 116 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1jim n TYR 117 N -1.67 0.00 -3.55 7.33 4.01 -1.26 -4.81 117.16 117.22 1jim n TYR 117 Ca 0.05 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.50 1jim n TYR 117 Cb 0.29 -0.06 -0.14 0.00 -0.31 0.00 0.00 39.34 39.12 1jim n TYR 117 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1jim s VAL 118 N -2.81 0.08 0.25 -0.72 1.01 -1.03 -3.84 120.40 113.34 1jim s VAL 118 Ca 0.05 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 61.04 1jim s VAL 118 Cb 0.14 -1.08 -0.05 0.00 0.00 0.00 0.00 36.38 35.38 1jim s VAL 118 CO 0.76 -0.78 0.01 -1.10 0.00 0.00 0.00 175.10 174.00 1jim s GLN 119 N 1.84 1.42 0.38 2.72 -1.52 -0.97 -1.57 119.66 121.95 1jim s GLN 119 Ca 0.11 -1.74 -0.19 0.00 -1.95 0.00 0.00 55.36 51.60 1jim s GLN 119 Cb -0.18 -0.67 -0.10 0.00 -0.22 0.00 0.00 33.01 31.85 1jim s GLN 119 CO -0.28 -0.12 0.86 -0.51 -0.25 0.00 0.00 175.29 174.99 1jim s LEU 120 N -3.35 3.99 0.28 2.90 1.43 -1.26 -3.26 118.68 119.42 1jim s LEU 120 Ca 0.31 1.53 -0.29 0.00 -1.03 0.00 0.00 54.13 54.65 1jim s LEU 120 Cb 0.06 -4.35 -0.09 0.00 0.03 0.00 0.00 46.19 41.84 1jim s LEU 120 CO 0.11 -0.29 1.00 -0.83 0.23 0.00 0.00 176.35 176.56 1jim s GLY 121 N -2.21 3.01 -0.13 -3.19 0.00 0.44 -4.82 107.32 100.42 1jim s GLY 121 Ca 0.59 0.70 -0.20 0.00 0.00 0.00 0.00 44.72 45.80 1jim s GLY 121 CO 0.15 1.24 0.57 0.14 0.00 0.00 0.00 173.10 175.20 1jim s VAL 122 N -1.30 5.11 -0.02 1.40 1.01 -1.26 -4.81 120.40 120.53 1jim s VAL 122 Ca 0.45 1.12 -0.09 0.00 0.00 0.00 0.00 61.98 63.47 1jim s VAL 122 Cb -0.26 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.17 1jim s VAL 122 CO 0.33 0.24 0.28 -0.76 0.00 0.00 0.00 175.10 175.19 1jim s LEU 123 N 1.07 4.39 0.86 3.92 1.43 -1.26 -1.02 118.68 128.07 1jim s LEU 123 Ca 0.29 0.64 -0.14 0.00 -1.03 0.00 0.00 54.13 53.89 1jim s LEU 123 Cb -0.16 -2.54 0.03 0.00 0.03 0.00 0.00 46.19 43.54 1jim s LEU 123 CO 0.12 0.30 0.59 -0.81 0.23 0.00 0.00 176.35 176.78 1jim n PRO 124 N 1.44 -0.05 -1.72 1.29 -0.05 -1.26 -4.93 135.00 129.71 1jim n PRO 124 Ca -0.14 0.04 -0.41 0.00 -0.05 0.00 0.00 63.50 62.94 1jim n PRO 124 Cb 0.53 -1.96 0.01 0.00 -0.05 0.00 0.00 33.50 32.03 1jim n PRO 124 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 175.50 173.32 1jim n ARG 125 N -1.76 2.16 -1.67 0.54 0.63 -1.26 -4.81 116.66 110.49 1jim n ARG 125 Ca 0.09 0.76 -0.51 0.00 -0.92 0.00 0.00 57.85 57.27 1jim n ARG 125 Cb 0.52 -2.46 -0.06 0.00 0.45 0.00 0.00 32.46 30.92 1jim n ARG 125 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1jim n ALA 126 N 0.05 0.29 0.00 5.13 0.00 -1.26 -1.70 120.51 123.01 1jim n ALA 126 Ca 0.05 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1jim n ALA 126 Cb 0.39 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.53 1jim n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jim n GLY 127 N 3.75 1.52 3.68 0.00 0.00 -0.54 -5.02 105.19 108.58 1jim n GLY 127 Ca 0.22 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.75 1jim n GLY 127 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1jim n THR 128 N -2.00 0.42 -4.98 2.61 -1.04 -0.69 -5.01 114.28 103.60 1jim n THR 128 Ca 0.00 -0.08 -0.32 0.00 -2.04 0.00 0.00 64.05 61.61 1jim n THR 128 Cb 0.00 -1.70 -0.14 0.00 -1.82 0.00 0.00 70.33 66.66 1jim n THR 128 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1jim s ILE 129 N 3.28 2.79 0.32 12.58 -1.09 -1.26 -4.73 121.20 133.08 1jim s ILE 129 Ca 0.90 -0.81 -0.04 0.00 -2.23 0.00 0.00 60.65 58.47 1jim s ILE 129 Cb -0.74 -2.08 -0.05 0.00 -1.58 0.00 0.00 42.46 38.01 1jim s ILE 129 CO 0.50 0.57 0.58 -0.76 -1.23 0.00 0.00 174.94 174.60 1jim s LEU 130 N -0.43 4.01 0.65 2.97 1.43 -1.26 -5.04 118.68 121.01 1jim s LEU 130 Ca 0.05 0.69 -0.14 0.00 -1.03 0.00 0.00 54.13 53.70 1jim s LEU 130 Cb -0.12 -3.53 -0.01 0.00 0.03 0.00 0.00 46.19 42.57 1jim s LEU 130 CO 0.02 -0.25 1.08 0.00 0.23 0.00 0.00 176.35 177.43 1jim s ALA 131 N -2.19 2.59 0.33 4.21 0.00 -1.26 -4.87 121.76 120.57 1jim s ALA 131 Ca 0.44 0.36 -0.28 0.00 0.00 0.00 0.00 51.96 52.47 1jim s ALA 131 Cb -0.10 -3.25 -0.12 0.00 0.00 0.00 0.00 23.12 19.64 1jim s ALA 131 CO 0.32 -1.14 1.30 -1.71 0.00 0.00 0.00 175.76 174.53 1jim n ASN 132 N -2.55 2.72 -2.53 0.00 5.15 -1.26 -2.76 115.26 114.03 1jim n ASN 132 Ca 0.09 1.20 -0.17 0.00 -0.60 0.00 0.00 54.58 55.10 1jim n ASN 132 Cb 0.53 -1.47 0.05 0.00 -0.53 0.00 0.00 39.78 38.35 1jim n ASN 132 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1jim n ASN 133 N 0.95 -5.05 -4.74 1.20 5.15 0.02 -4.94 115.26 107.85 1jim n ASN 133 Ca 0.06 -0.32 -0.41 0.00 -0.60 0.00 0.00 54.58 53.31 1jim n ASN 133 Cb 0.35 -3.75 -0.04 0.00 -0.53 0.00 0.00 39.78 35.81 1jim n ASN 133 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1jim s SER 134 N -3.05 7.30 -0.46 1.20 0.01 -1.11 -4.58 113.70 112.99 1jim s SER 134 Ca 0.34 2.07 -0.28 0.00 1.31 0.00 0.00 55.95 59.40 1jim s SER 134 Cb -0.15 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.46 1jim s SER 134 CO 0.42 -0.19 1.80 -2.16 0.41 0.00 0.00 173.24 173.53 1jim s PRO 135 N -0.44 3.03 0.08 12.44 0.04 -1.26 -1.77 135.00 147.12 1jim s PRO 135 Ca 0.49 1.04 0.03 0.00 0.04 0.00 0.00 61.00 62.59 1jim s PRO 135 Cb -0.29 -4.27 -0.03 0.00 0.04 0.00 0.00 34.50 29.94 1jim s PRO 135 CO 0.35 -2.24 -0.10 0.00 0.04 0.00 0.00 177.00 175.06 1jim s TYR 137 N -2.29 2.33 -0.18 0.00 1.51 0.11 0.12 117.35 118.96 1jim s TYR 137 Ca 0.03 -0.44 -0.09 0.00 -1.01 0.00 0.00 57.07 55.56 1jim s TYR 137 Cb -0.04 -1.50 -0.05 0.00 -0.11 0.00 0.00 41.96 40.27 1jim s TYR 137 CO -0.00 -0.03 0.13 -1.50 -1.11 0.00 0.00 175.55 173.03 1jim s ILE 138 N -0.62 5.38 0.20 2.71 2.07 -0.33 -1.03 121.20 129.58 1jim s ILE 138 Ca 0.10 0.17 0.08 0.00 -1.41 0.00 0.00 60.65 59.59 1jim s ILE 138 Cb -0.10 -3.42 -0.04 0.00 0.13 0.00 0.00 42.46 39.03 1jim s ILE 138 CO -0.01 0.49 -0.00 0.42 -1.91 0.00 0.00 174.94 173.93 1jim s THR 139 N -0.00 3.64 0.00 4.00 -4.23 -1.19 -1.13 115.64 116.73 1jim s THR 139 Ca 0.09 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 59.04 1jim s THR 139 Cb -0.11 -2.86 0.00 0.00 1.34 0.00 0.00 72.50 70.87 1jim s THR 139 CO -0.00 -0.18 0.00 0.61 -0.54 0.00 0.00 174.62 174.50 1jim n GLY 140 N -0.34 2.35 1.49 3.99 0.00 0.06 -4.62 105.19 108.13 1jim n GLY 140 Ca -0.09 -1.11 0.06 0.00 0.00 0.00 0.00 46.02 44.88 1jim n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1jim n TRP 141 N -1.07 1.47 -0.78 1.61 8.01 -1.26 -2.11 117.44 123.31 1jim n TRP 141 Ca 0.00 -0.53 -0.22 0.00 -1.31 0.00 0.00 57.50 55.45 1jim n TRP 141 Cb 0.00 -0.36 0.19 0.00 -2.01 0.00 0.00 31.31 29.13 1jim n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1jim n GLY 142 N 0.61 -2.88 3.73 6.99 0.00 -1.25 -1.74 105.19 110.66 1jim n GLY 142 Ca 0.21 -1.45 -0.39 0.00 0.00 0.00 0.00 46.02 44.39 1jim n GLY 142 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1jim n LEU 143 N 0.00 5.24 -0.37 0.99 4.77 -0.13 -2.67 117.00 124.83 1jim n LEU 143 Ca 0.11 0.99 0.08 0.00 -0.03 0.00 0.00 56.01 57.15 1jim n LEU 143 Cb 0.42 -1.56 0.00 0.00 -2.33 0.00 0.00 43.42 39.96 1jim n LEU 143 CO 0.29 -0.65 0.27 0.35 -1.33 0.00 0.00 177.39 176.33 1jim n THR 144 N -0.95 0.00 -3.86 -5.08 -2.24 -1.09 -1.02 114.28 100.04 1jim n THR 144 Ca 0.10 -0.35 -0.09 0.00 -2.27 0.00 0.00 64.05 61.44 1jim n THR 144 Cb 0.44 1.19 -0.07 0.00 -2.10 0.00 0.00 70.33 69.80 1jim n THR 144 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1jim s ARG 145 N -1.81 0.97 0.25 -0.78 0.52 -1.26 -4.19 118.95 112.65 1jim s ARG 145 Ca 0.13 -0.99 -0.31 0.00 -0.52 0.00 0.00 55.73 54.04 1jim s ARG 145 Cb 0.13 0.37 -0.12 0.00 0.52 0.00 0.00 34.95 35.85 1jim s ARG 145 CO 0.38 -0.33 1.66 0.99 0.02 0.00 0.00 175.30 178.01 1jim s THR 147 N -3.88 2.04 -1.57 0.02 2.01 -1.26 -1.68 115.64 111.32 1jim s THR 147 Ca 0.08 0.03 -0.02 0.00 0.31 0.00 0.00 61.69 62.09 1jim s THR 147 Cb 0.04 -3.02 0.01 0.00 0.01 0.00 0.00 72.50 69.54 1jim s THR 147 CO -0.08 0.00 0.27 0.59 -0.69 0.00 0.00 174.62 174.71 1jim n ASN 148 N 3.02 -5.58 0.00 3.53 3.02 -1.26 -4.98 115.26 113.01 1jim n ASN 148 Ca 0.12 -0.12 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1jim n ASN 148 Cb 0.36 -4.60 0.00 0.00 -0.61 0.00 0.00 39.78 34.94 1jim n ASN 148 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1jim n GLY 149 N -1.20 2.70 3.34 7.41 0.00 -0.68 -5.13 105.19 111.64 1jim n GLY 149 Ca -0.17 -1.76 -0.18 0.00 0.00 0.00 0.00 46.02 43.92 1jim n GLY 149 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1jim s GLN 150 N 4.61 1.33 0.71 1.61 -2.07 -1.26 -4.89 119.66 119.70 1jim s GLN 150 Ca 0.00 -1.62 -0.16 0.00 -1.82 0.00 0.00 55.36 51.76 1jim s GLN 150 Cb 0.00 -0.94 0.03 0.00 -1.09 0.00 0.00 33.01 31.01 1jim s GLN 150 CO 0.00 0.08 1.23 -0.51 -1.32 0.00 0.00 175.29 174.77 1jim s LEU 151 N -3.31 3.38 0.48 2.60 1.43 -1.26 -2.67 118.68 119.32 1jim s LEU 151 Ca 0.24 2.44 -0.20 0.00 -1.03 0.00 0.00 54.13 55.57 1jim s LEU 151 Cb 0.02 -4.60 -0.09 0.00 0.03 0.00 0.00 46.19 41.55 1jim s LEU 151 CO 0.07 -2.23 1.02 0.00 0.23 0.00 0.00 176.35 175.44 1jim s ALA 152 N -1.82 2.90 -0.02 4.21 0.00 -0.71 -4.85 121.76 121.47 1jim s ALA 152 Ca 0.77 0.56 -0.06 0.00 0.00 0.00 0.00 51.96 53.23 1jim s ALA 152 Cb -0.31 -3.23 -0.29 0.00 0.00 0.00 0.00 23.12 19.28 1jim s ALA 152 CO 0.44 -0.24 0.79 1.96 0.00 0.00 0.00 175.76 178.70 1jim h GLN 153 N 1.59 0.30 -6.12 0.00 4.20 -1.94 -3.45 115.11 109.69 1jim h GLN 153 Ca -0.49 -0.52 -0.64 0.00 0.06 0.00 0.00 58.65 57.07 1jim h GLN 153 Cb 1.21 0.19 -0.08 0.00 0.30 0.00 0.00 27.48 29.11 1jim h GLN 153 CO 0.59 1.18 -0.58 0.95 -0.67 0.00 0.00 178.83 180.31 1jim s THR 154 N -2.60 4.73 0.07 -0.54 -4.23 -1.26 0.72 115.64 112.53 1jim s THR 154 Ca -0.11 -0.67 -0.33 0.00 -1.18 0.00 0.00 61.69 59.40 1jim s THR 154 Cb 0.06 -3.28 -0.12 0.00 1.34 0.00 0.00 72.50 70.50 1jim s THR 154 CO 0.85 0.14 1.78 -0.11 -0.54 0.00 0.00 174.62 176.75 1jim n LEU 155 N 0.45 3.62 -4.72 4.79 7.94 -0.92 -4.84 117.00 123.32 1jim n LEU 155 Ca -0.08 1.01 -0.27 0.00 -1.11 0.00 0.00 56.01 55.56 1jim n LEU 155 Cb 0.51 -1.46 -0.07 0.00 0.53 0.00 0.00 43.42 42.93 1jim n LEU 155 CO 0.46 -0.02 -0.29 -1.10 -1.11 0.00 0.00 177.39 175.33 1jim s GLN 156 N 2.67 2.61 0.04 1.96 -1.52 -0.90 -0.40 119.66 124.12 1jim s GLN 156 Ca 0.84 -0.97 0.04 0.00 -1.95 0.00 0.00 55.36 53.33 1jim s GLN 156 Cb -0.59 -2.50 -0.02 0.00 -0.22 0.00 0.00 33.01 29.68 1jim s GLN 156 CO 0.42 0.48 -0.13 1.14 -0.25 0.00 0.00 175.29 176.95 1jim s GLN 157 N -2.87 0.84 -0.02 2.91 -2.07 0.62 -0.76 119.66 118.30 1jim s GLN 157 Ca 0.28 -0.76 0.02 0.00 -1.82 0.00 0.00 55.36 53.09 1jim s GLN 157 Cb -0.10 -0.82 0.00 0.00 -1.09 0.00 0.00 33.01 31.01 1jim s GLN 157 CO 0.20 0.20 -0.08 0.00 -1.32 0.00 0.00 175.29 174.29 1jim s ALA 158 N -0.94 0.74 -0.11 2.60 0.00 -0.28 -1.05 121.76 122.71 1jim s ALA 158 Ca -0.00 -0.28 -0.29 0.00 0.00 0.00 0.00 51.96 51.39 1jim s ALA 158 Cb -0.08 -0.28 -0.03 0.00 0.00 0.00 0.00 23.12 22.73 1jim s ALA 158 CO 0.01 0.12 1.42 -0.47 0.00 0.00 0.00 175.76 176.84 1jim s TYR 159 N 0.19 2.51 -0.43 0.00 5.04 -1.26 -1.19 117.35 122.20 1jim s TYR 159 Ca -0.03 0.68 0.03 0.00 -2.44 0.00 0.00 57.07 55.31 1jim s TYR 159 Cb -0.08 -3.67 0.16 0.00 0.35 0.00 0.00 41.96 38.72 1jim s TYR 159 CO 0.00 -2.58 0.32 -1.17 -1.34 0.00 0.00 175.55 170.78 1jim s LEU 160 N 3.65 1.74 0.61 6.97 2.96 0.12 -4.96 118.68 129.76 1jim s LEU 160 Ca 0.62 -2.90 -0.19 0.00 -0.22 0.00 0.00 54.13 51.45 1jim s LEU 160 Cb -0.27 -0.59 -0.03 0.00 0.50 0.00 0.00 46.19 45.80 1jim s LEU 160 CO 0.21 -0.20 1.17 -0.81 -1.32 0.00 0.00 176.35 175.40 1jim n PRO 161 N 3.10 1.14 -1.68 0.98 -0.05 -1.26 -4.09 135.00 133.15 1jim n PRO 161 Ca 0.23 0.44 -0.30 0.00 -0.05 0.00 0.00 63.50 63.81 1jim n PRO 161 Cb 0.43 -2.39 0.06 0.00 -0.05 0.00 0.00 33.50 31.55 1jim n PRO 161 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 175.50 176.40 1jim s THR 162 N -1.41 3.69 -0.15 0.52 -4.23 -0.73 -0.90 115.64 112.42 1jim s THR 162 Ca 0.78 0.55 -0.00 0.00 -1.18 0.00 0.00 61.69 61.83 1jim s THR 162 Cb -0.40 -3.38 0.04 0.00 1.34 0.00 0.00 72.50 70.09 1jim s THR 162 CO 0.45 -0.72 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.06 1jim s VAL 163 N -3.17 1.09 0.76 2.29 1.01 -0.42 -0.80 120.40 121.16 1jim s VAL 163 Ca 0.59 -0.54 -0.13 0.00 0.00 0.00 0.00 61.98 61.89 1jim s VAL 163 Cb -0.13 -1.23 0.06 0.00 0.00 0.00 0.00 36.38 35.08 1jim s VAL 163 CO 0.54 0.19 1.15 1.51 0.00 0.00 0.00 175.10 178.49 1jim s ASP 164 N 1.65 4.21 0.29 3.32 1.47 -1.26 -3.96 116.67 122.39 1jim s ASP 164 Ca 0.02 2.13 0.03 0.00 1.18 0.00 0.00 52.55 55.90 1jim s ASP 164 Cb -0.15 -2.56 0.70 0.00 -0.34 0.00 0.00 42.92 40.58 1jim s ASP 164 CO -0.08 -2.24 1.69 0.22 0.68 0.00 0.00 175.17 175.44 1jim h TYR 165 N -0.72 0.59 -0.58 2.11 3.20 -1.94 0.51 116.97 120.14 1jim h TYR 165 Ca -0.46 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.42 1jim h TYR 165 Cb 1.26 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 39.39 1jim h TYR 165 CO 0.52 -0.06 0.22 0.00 -1.64 0.00 0.00 178.16 177.19 1jim h ALA 166 N 1.71 0.76 -0.10 1.82 0.00 -1.97 0.15 119.26 121.62 1jim h ALA 166 Ca 0.55 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 55.16 1jim h ALA 166 Cb 1.03 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1jim h ALA 166 CO -0.54 0.39 -0.40 0.82 0.00 0.00 0.00 179.25 179.53 1jim h ILE 167 N 0.81 1.38 -0.15 0.00 2.04 -1.74 -3.33 117.51 116.53 1jim h ILE 167 Ca 0.19 -1.74 -0.03 0.00 1.00 0.00 0.00 64.86 64.28 1jim h ILE 167 Cb 0.23 2.19 -0.01 0.00 -0.74 0.00 0.00 36.82 38.49 1jim h ILE 167 CO -0.01 0.51 -0.06 0.00 0.00 0.00 0.00 178.15 178.59 1jim n SER 169 N -4.35 6.89 0.00 0.00 3.41 0.44 -0.43 113.62 119.57 1jim n SER 169 Ca -0.01 -3.17 0.00 0.00 -0.26 0.00 0.00 58.87 55.43 1jim n SER 169 Cb 0.21 -1.39 0.00 0.00 -0.26 0.00 0.00 64.21 62.77 1jim n SER 169 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1jim n SER 170 N 2.37 0.00 0.00 4.04 7.64 -1.26 -3.38 113.62 123.03 1jim n SER 170 Ca 0.52 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.40 1jim n SER 170 Cb 0.29 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 1jim n SER 170 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1jim n TYR 171 N 0.00 0.00 0.93 1.43 4.02 -1.26 -4.86 117.16 117.42 1jim n TYR 171 Ca 0.00 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 57.99 1jim n TYR 171 Cb 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.26 1jim n TYR 171 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 1jim n TRP 172 N 0.00 0.01 -4.60 -0.72 7.02 0.43 -4.82 117.44 114.75 1jim n TRP 172 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 1jim n TRP 172 Cb 0.00 -0.08 0.00 0.00 -2.42 0.00 0.00 31.31 28.81 1jim n TRP 172 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1jim n GLY 173 N 1.48 2.30 0.00 6.99 0.00 -1.21 -2.20 105.19 112.55 1jim n GLY 173 Ca 0.04 -0.51 0.14 0.00 0.00 0.00 0.00 46.02 45.69 1jim n GLY 173 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1jim n SER 174 N 1.92 0.00 0.12 1.61 2.88 -1.26 -3.08 113.62 115.82 1jim n SER 174 Ca 0.00 0.11 0.04 0.00 -1.33 0.00 0.00 58.87 57.69 1jim n SER 174 Cb 0.00 -0.37 0.44 0.00 -0.75 0.00 0.00 64.21 63.53 1jim n SER 174 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1jim h THR 175 N 0.00 1.13 -2.98 2.46 2.02 -1.82 -3.43 112.91 110.30 1jim h THR 175 Ca 0.00 -0.54 -0.62 0.00 0.77 0.00 0.00 66.41 66.02 1jim h THR 175 Cb 0.36 1.05 -0.06 0.00 -1.74 0.00 0.00 68.15 67.76 1jim h THR 175 CO 0.00 0.18 -0.28 0.54 0.37 0.00 0.00 175.52 176.33 1jim s VAL 176 N -4.92 5.18 0.30 3.16 0.11 -1.18 -4.77 120.40 118.29 1jim s VAL 176 Ca -0.06 0.66 0.10 0.00 -2.93 0.00 0.00 61.98 59.76 1jim s VAL 176 Cb 0.16 -3.63 -0.05 0.00 -1.53 0.00 0.00 36.38 31.32 1jim s VAL 176 CO 0.72 0.55 -0.09 -0.54 -3.33 0.00 0.00 175.10 172.42 1jim s LYS 177 N -0.78 1.93 0.00 1.54 -0.14 -1.26 -4.89 119.74 116.14 1jim s LYS 177 Ca 0.21 -1.72 0.24 0.00 -1.36 0.00 0.00 55.97 53.33 1jim s LYS 177 Cb -0.15 -1.88 1.19 0.00 -1.68 0.00 0.00 37.83 35.31 1jim s LYS 177 CO 0.10 0.25 1.78 -1.71 -0.76 0.00 0.00 175.35 175.01 1jim n ASN 178 N -0.79 0.00 -0.08 2.83 2.85 -1.26 -1.24 115.26 117.57 1jim n ASN 178 Ca -0.05 -0.05 0.00 0.00 -0.11 0.00 0.00 54.58 54.37 1jim n ASN 178 Cb 0.61 -0.28 0.00 0.00 1.24 0.00 0.00 39.78 41.35 1jim n ASN 178 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1jim n SER 179 N -1.28 0.15 -4.25 1.20 3.41 -1.26 -4.83 113.62 106.76 1jim n SER 179 Ca 0.11 -1.96 -0.18 0.00 -0.26 0.00 0.00 58.87 56.58 1jim n SER 179 Cb 0.19 -0.08 -0.11 0.00 -0.26 0.00 0.00 64.21 63.95 1jim n SER 179 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1jim s MET 180 N -1.85 1.04 -0.10 4.33 -1.94 -0.37 -1.09 119.30 119.33 1jim s MET 180 Ca 0.00 -1.25 -0.03 0.00 -1.71 0.00 0.00 55.69 52.69 1jim s MET 180 Cb 0.00 -0.93 -0.04 0.00 2.01 0.00 0.00 34.83 35.88 1jim s MET 180 CO 0.00 0.18 0.04 0.08 -0.01 0.00 0.00 175.02 175.31 1jim s VAL 181 N -2.15 4.64 0.08 -6.03 1.01 0.35 -4.61 120.40 113.68 1jim s VAL 181 Ca 0.09 -0.12 0.06 0.00 0.00 0.00 0.00 61.98 62.01 1jim s VAL 181 Cb -0.05 -2.98 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 1jim s VAL 181 CO 0.03 0.60 -0.07 0.00 0.00 0.00 0.00 175.10 175.67 1jim s ALA 183 N -1.20 -0.70 0.00 0.00 0.00 -0.45 -1.30 121.76 118.10 1jim s ALA 183 Ca 0.22 0.62 0.00 0.00 0.00 0.00 0.00 51.96 52.79 1jim s ALA 183 Cb -0.11 -0.29 0.00 0.00 0.00 0.00 0.00 23.12 22.71 1jim s ALA 183 CO 0.14 -0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.14 1jim n GLY 184 N 2.40 0.86 1.43 0.00 0.00 -0.08 -1.05 105.19 108.75 1jim n GLY 184 Ca -0.16 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.54 1jim n GLY 184 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jim n GLY 185 N 0.00 0.57 0.00 -0.02 0.00 -1.26 -4.64 105.19 99.83 1jim n GLY 185 Ca 0.00 -0.69 0.12 0.00 0.00 0.00 0.00 46.02 45.46 1jim n GLY 185 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1jim n ASP 186 N 1.25 0.00 0.00 1.61 5.75 -1.26 -0.73 116.55 123.17 1jim n ASP 186 Ca 0.00 0.26 0.00 0.00 -0.01 0.00 0.00 54.79 55.04 1jim n ASP 186 Cb 0.00 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 39.68 1jim n ASP 186 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1jim n GLY 187 N 1.03 3.13 0.10 6.12 0.00 -1.26 -4.78 105.19 109.52 1jim n GLY 187 Ca 0.09 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 1jim n GLY 187 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1jim n VAL 188 N -1.64 1.12 -5.21 1.61 0.31 -1.26 -4.58 118.33 108.67 1jim n VAL 188 Ca 0.00 -0.44 -0.31 0.00 -0.01 0.00 0.00 64.34 63.57 1jim n VAL 188 Cb 0.00 -1.16 -0.15 0.00 -0.91 0.00 0.00 33.84 31.61 1jim n VAL 188 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1jim s ARG 188 N -2.39 2.22 0.25 5.55 3.00 -1.26 -3.68 118.95 122.63 1jim s ARG 188 Ca -0.25 -0.87 -0.22 0.00 0.00 0.00 0.00 55.73 54.38 1jim s ARG 188 Cb 0.07 -2.13 0.04 0.00 0.00 0.00 0.00 34.95 32.93 1jim s ARG 188 CO 0.46 0.57 0.82 -1.54 0.00 0.00 0.00 175.30 175.61 1jim s SER 189 N -0.62 -0.19 0.68 0.23 1.04 -0.49 -4.30 113.70 110.05 1jim s SER 189 Ca 0.10 -0.61 -0.11 0.00 0.48 0.00 0.00 55.95 55.81 1jim s SER 189 Cb -0.10 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1jim s SER 189 CO -0.00 -1.23 1.07 -0.83 0.98 0.00 0.00 173.24 173.22 1jim s GLY 190 N -2.97 1.63 0.29 7.32 0.00 -1.26 -0.45 107.32 111.88 1jim s GLY 190 Ca 0.12 -0.32 -0.14 0.00 0.00 0.00 0.00 44.72 44.38 1jim s GLY 190 CO 0.06 0.02 0.59 0.00 0.00 0.00 0.00 173.10 173.77 1jim s GLN 192 N -3.62 3.95 0.00 0.00 1.11 -1.26 -1.67 119.66 118.17 1jim s GLN 192 Ca 0.20 2.49 0.00 0.00 0.01 0.00 0.00 55.36 58.06 1jim s GLN 192 Cb -0.03 -2.84 0.00 0.00 -1.01 0.00 0.00 33.01 29.13 1jim s GLN 192 CO 0.10 -0.63 0.00 0.41 0.01 0.00 0.00 175.29 175.18 1jim n GLY 193 N 0.52 3.24 0.02 3.09 0.00 -1.26 -0.96 105.19 109.84 1jim n GLY 193 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.16 1jim n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jim n ASP 194 N 0.00 0.66 -4.55 1.61 8.00 -0.67 -3.71 116.55 117.89 1jim n ASP 194 Ca 0.00 -0.40 -0.53 0.00 0.71 0.00 0.00 54.79 54.57 1jim n ASP 194 Cb 0.00 0.73 -0.06 0.00 -0.02 0.00 0.00 41.12 41.77 1jim n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1jim n SER 195 N -1.74 1.01 0.00 -2.24 7.64 -1.26 -2.10 113.62 114.93 1jim n SER 195 Ca 0.03 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.05 1jim n SER 195 Cb 0.39 -1.12 0.00 0.00 -1.01 0.00 0.00 64.21 62.47 1jim n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1jim n GLY 196 N 2.11 2.99 3.48 0.23 0.00 0.10 -1.45 105.19 112.65 1jim n GLY 196 Ca 0.18 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 1jim n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1jim s GLY 197 N -2.75 1.51 0.43 -0.02 0.00 -0.89 -3.61 107.32 101.99 1jim s GLY 197 Ca 0.00 -0.53 -0.20 0.00 0.00 0.00 0.00 44.72 43.99 1jim s GLY 197 CO 0.00 0.29 0.93 2.56 0.00 0.00 0.00 173.10 176.88 1jim s PRO 198 N -4.89 4.19 -0.38 2.90 0.04 -1.26 -0.23 135.00 135.37 1jim s PRO 198 Ca 0.68 1.06 -0.01 0.00 0.04 0.00 0.00 61.00 62.78 1jim s PRO 198 Cb -0.18 -2.20 0.11 0.00 0.04 0.00 0.00 34.50 32.27 1jim s PRO 198 CO 0.60 -0.03 0.15 -1.17 0.04 0.00 0.00 177.00 176.59 1jim s LEU 199 N -3.23 5.07 -0.22 -3.56 2.96 -1.04 -3.15 118.68 115.51 1jim s LEU 199 Ca 0.61 -2.05 -0.22 0.00 -0.22 0.00 0.00 54.13 52.24 1jim s LEU 199 Cb -0.09 -1.76 -0.02 0.00 0.50 0.00 0.00 46.19 44.82 1jim s LEU 199 CO 0.15 -0.49 0.71 -1.00 -1.32 0.00 0.00 176.35 174.41 1jim s HIS 200 N 1.07 3.34 0.01 5.38 3.76 -0.19 -1.42 115.29 127.23 1jim s HIS 200 Ca 0.09 1.00 0.07 0.00 -0.15 0.00 0.00 55.06 56.07 1jim s HIS 200 Cb -0.22 -2.91 -0.02 0.00 1.11 0.00 0.00 32.58 30.54 1jim s HIS 200 CO -0.05 -0.29 -0.22 0.00 -0.85 0.00 0.00 174.74 173.33 1jim s LEU 202 N -0.78 3.94 -0.09 0.00 2.96 -0.82 -1.28 118.68 122.61 1jim s LEU 202 Ca 0.08 -0.10 0.00 0.00 -0.22 0.00 0.00 54.13 53.89 1jim s LEU 202 Cb -0.09 -3.02 0.02 0.00 0.50 0.00 0.00 46.19 43.60 1jim s LEU 202 CO 0.00 -1.22 -0.08 -0.69 -1.32 0.00 0.00 176.35 173.05 1jim s VAL 203 N 4.08 0.95 -1.57 1.68 1.01 -0.34 -4.83 120.40 121.38 1jim s VAL 203 Ca 0.35 -0.28 -0.10 0.00 0.00 0.00 0.00 61.98 61.95 1jim s VAL 203 Cb -0.11 -0.96 0.09 0.00 0.00 0.00 0.00 36.38 35.40 1jim s VAL 203 CO 0.23 0.34 0.61 0.59 0.00 0.00 0.00 175.10 176.87 1jim n ASN 204 N 4.66 -1.98 -0.86 3.32 5.03 -1.26 -1.62 115.26 122.55 1jim n ASN 204 Ca -0.15 -1.01 -0.10 0.00 0.87 0.00 0.00 54.58 54.18 1jim n ASN 204 Cb 0.50 -2.86 -0.04 0.00 -1.02 0.00 0.00 39.78 36.37 1jim n ASN 204 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1jim n GLY 205 N -1.70 0.96 3.04 7.41 0.00 -1.26 -5.02 105.19 108.62 1jim n GLY 205 Ca -0.10 -0.54 -0.22 0.00 0.00 0.00 0.00 46.02 45.16 1jim n GLY 205 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1jim s GLN 206 N -3.16 1.22 -0.03 1.61 0.74 -0.64 -5.12 119.66 114.28 1jim s GLN 206 Ca 0.00 -0.39 -0.30 0.00 0.05 0.00 0.00 55.36 54.72 1jim s GLN 206 Cb 0.00 -1.10 -0.04 0.00 1.10 0.00 0.00 33.01 32.97 1jim s GLN 206 CO 0.00 0.15 1.18 0.71 -0.55 0.00 0.00 175.29 176.78 1jim s TYR 207 N 0.17 3.27 0.03 1.67 2.02 -1.26 -1.20 117.35 122.05 1jim s TYR 207 Ca -0.04 1.26 0.07 0.00 -0.37 0.00 0.00 57.07 57.99 1jim s TYR 207 Cb -0.10 -3.40 -0.02 0.00 -0.40 0.00 0.00 41.96 38.04 1jim s TYR 207 CO 0.01 -1.22 -0.19 0.00 -1.57 0.00 0.00 175.55 172.58 1jim s ALA 208 N 1.94 1.62 -0.69 3.71 0.00 -0.40 -4.52 121.76 123.42 1jim s ALA 208 Ca 0.56 -0.96 -0.25 0.00 0.00 0.00 0.00 51.96 51.30 1jim s ALA 208 Cb -0.25 -0.33 0.05 0.00 0.00 0.00 0.00 23.12 22.58 1jim s ALA 208 CO 0.23 0.37 1.13 0.08 0.00 0.00 0.00 175.76 177.57 1jim s VAL 209 N -0.72 4.01 -0.20 0.00 1.01 -0.19 -0.14 120.40 124.17 1jim s VAL 209 Ca 0.07 0.15 0.22 0.00 0.00 0.00 0.00 61.98 62.41 1jim s VAL 209 Cb -0.08 -4.79 -0.06 0.00 0.00 0.00 0.00 36.38 31.45 1jim s VAL 209 CO 0.01 -1.62 0.95 1.41 0.00 0.00 0.00 175.10 175.85 1jim n HIS 210 N 8.56 0.84 -4.53 5.22 8.25 -0.51 -4.27 115.22 128.78 1jim n HIS 210 Ca 0.01 0.25 -0.22 0.00 -0.26 0.00 0.00 57.72 57.49 1jim n HIS 210 Cb 0.48 -0.91 -0.14 0.00 1.12 0.00 0.00 29.99 30.54 1jim n HIS 210 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1jim s GLY 211 N -4.41 0.81 -0.28 -1.41 0.00 -1.19 -1.84 107.32 99.00 1jim s GLY 211 Ca -0.02 -0.78 -0.06 0.00 0.00 0.00 0.00 44.72 43.87 1jim s GLY 211 CO 0.81 -0.71 0.05 0.14 0.00 0.00 0.00 173.10 173.38 1jim s VAL 212 N -0.63 3.79 0.16 1.40 1.01 -0.65 -2.49 120.40 122.99 1jim s VAL 212 Ca 0.04 -0.66 -0.32 0.00 0.00 0.00 0.00 61.98 61.03 1jim s VAL 212 Cb -0.07 -2.91 -0.12 0.00 0.00 0.00 0.00 36.38 33.28 1jim s VAL 212 CO 0.01 0.16 1.73 0.41 0.00 0.00 0.00 175.10 177.40 1jim n THR 213 N 4.84 0.14 0.03 3.92 -1.04 0.69 -0.31 114.28 122.54 1jim n THR 213 Ca -0.15 -0.02 -0.01 0.00 -2.04 0.00 0.00 64.05 61.82 1jim n THR 213 Cb 0.48 -1.91 -0.00 0.00 -1.82 0.00 0.00 70.33 67.08 1jim n THR 213 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1jim n SER 214 N 4.46 0.96 -3.74 8.00 2.88 -0.54 0.02 113.62 125.66 1jim n SER 214 Ca 0.17 0.13 -0.11 0.00 -1.33 0.00 0.00 58.87 57.73 1jim n SER 214 Cb 0.34 -0.32 -0.07 0.00 -0.75 0.00 0.00 64.21 63.41 1jim n SER 214 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1jim s PHE 215 N -1.87 -0.12 0.22 0.66 -0.71 -0.91 -4.96 117.98 110.29 1jim s PHE 215 Ca -0.02 -0.04 0.00 0.00 -1.04 0.00 0.00 56.93 55.83 1jim s PHE 215 Cb 0.00 0.12 -0.00 0.00 -1.21 0.00 0.00 43.02 41.93 1jim s PHE 215 CO 0.04 -0.53 0.01 1.33 -1.34 0.00 0.00 175.22 174.73 1jim n VAL 216 N 0.46 0.00 -2.69 -2.49 0.24 -1.26 -1.08 118.33 111.51 1jim n VAL 216 Ca -0.18 -1.06 -0.39 0.00 -2.04 0.00 0.00 64.34 60.66 1jim n VAL 216 Cb 0.60 0.24 -0.06 0.00 -1.47 0.00 0.00 33.84 33.16 1jim n VAL 216 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1jim s SER 217 N -2.21 7.47 0.63 -1.34 0.15 -1.23 -4.93 113.70 112.24 1jim s SER 217 Ca 0.02 1.99 0.35 0.00 0.70 0.00 0.00 55.95 59.01 1jim s SER 217 Cb 0.00 -2.61 2.01 0.00 -1.71 0.00 0.00 66.02 63.71 1jim s SER 217 CO 0.01 0.02 2.24 0.03 1.20 0.00 0.00 173.24 176.74 1jim h ARG 217 N 3.80 0.00 0.00 5.44 3.08 -2.01 -2.82 114.38 121.88 1jim h ARG 217 Ca -0.46 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.59 1jim h ARG 217 Cb 1.20 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.25 1jim h ARG 217 CO 0.67 0.00 -0.02 -0.07 -1.07 0.00 0.00 179.97 179.48 1jim h LEU 218 N 0.00 0.00 0.00 3.04 3.38 -2.03 -3.48 115.31 116.22 1jim h LEU 218 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1jim h LEU 218 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1jim h LEU 218 CO -0.00 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.16 1jim n GLY 219 N 0.59 3.47 0.15 0.83 0.00 -1.06 -5.05 105.19 104.13 1jim n GLY 219 Ca 0.02 -1.14 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 1jim n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jim s ASN 221 N -5.27 6.75 -0.14 0.00 4.22 -1.26 -4.65 114.94 114.59 1jim s ASN 221 Ca -0.14 -2.46 0.01 0.00 -2.14 0.00 0.00 52.86 48.13 1jim s ASN 221 Cb 0.02 -2.31 0.02 0.00 1.28 0.00 0.00 41.25 40.26 1jim s ASN 221 CO 0.56 -0.80 -0.17 -0.69 -2.04 0.00 0.00 177.10 173.96 1jim s VAL 221 N 1.35 1.71 0.24 3.54 1.01 -1.26 -4.76 120.40 122.22 1jim s VAL 221 Ca 0.27 -0.74 -0.30 0.00 0.00 0.00 0.00 61.98 61.21 1jim s VAL 221 Cb -0.07 -1.56 -0.15 0.00 0.00 0.00 0.00 36.38 34.60 1jim s VAL 221 CO -0.09 0.48 1.11 0.41 0.00 0.00 0.00 175.10 177.02 1jim n THR 222 N 4.50 1.45 -1.68 3.92 -1.04 -1.26 -1.50 114.28 118.68 1jim n THR 222 Ca -0.19 -0.36 -0.16 0.00 -2.04 0.00 0.00 64.05 61.30 1jim n THR 222 Cb 0.51 -0.99 -0.06 0.00 -1.82 0.00 0.00 70.33 67.96 1jim n THR 222 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1jim n ARG 223 N 1.27 -1.49 -3.64 -2.82 1.74 0.09 -4.91 116.66 106.90 1jim n ARG 223 Ca 0.12 0.93 -0.27 0.00 -0.77 0.00 0.00 57.85 57.86 1jim n ARG 223 Cb 0.29 -5.31 -0.10 0.00 -1.02 0.00 0.00 32.46 26.32 1jim n ARG 223 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1jim n LYS 224 N -2.27 1.94 -1.15 5.56 4.76 -0.56 -4.27 118.16 122.17 1jim n LYS 224 Ca -0.17 -4.41 -0.35 0.00 -2.87 0.00 0.00 58.31 50.51 1jim n LYS 224 Cb 0.56 -2.18 0.09 0.00 -1.84 0.00 0.00 35.03 31.66 1jim n LYS 224 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 1jim n PRO 225 N 1.55 0.18 -2.22 1.97 -0.04 -1.26 -4.55 135.00 130.64 1jim n PRO 225 Ca 0.25 0.11 -0.39 0.00 -0.04 0.00 0.00 63.50 63.42 1jim n PRO 225 Cb 0.39 -1.90 -0.02 0.00 -0.04 0.00 0.00 33.50 31.93 1jim n PRO 225 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1jim s THR 226 N -2.02 2.97 -0.14 0.52 2.01 -0.21 -4.77 115.64 113.99 1jim s THR 226 Ca 0.65 0.87 -0.01 0.00 0.31 0.00 0.00 61.69 63.51 1jim s THR 226 Cb -0.31 -3.52 -0.02 0.00 0.01 0.00 0.00 72.50 68.66 1jim s THR 226 CO 0.59 0.14 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.87 1jim s VAL 227 N -1.29 3.35 0.15 3.82 1.01 -0.24 -1.34 120.40 125.86 1jim s VAL 227 Ca 0.54 -0.55 0.08 0.00 0.00 0.00 0.00 61.98 62.05 1jim s VAL 227 Cb -0.34 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 33.56 1jim s VAL 227 CO 0.44 0.52 -0.09 -0.36 0.00 0.00 0.00 175.10 175.61 1jim s PHE 228 N 0.31 2.69 -0.01 5.22 0.40 0.33 -1.47 117.98 125.44 1jim s PHE 228 Ca -0.08 -0.19 -0.30 0.00 -0.60 0.00 0.00 56.93 55.76 1jim s PHE 228 Cb -0.15 -1.35 -0.05 0.00 0.51 0.00 0.00 43.02 41.98 1jim s PHE 228 CO 0.05 0.48 1.34 0.99 0.70 0.00 0.00 175.22 178.78 1jim s THR 229 N -1.52 3.87 -0.52 0.64 2.01 0.57 -0.50 115.64 120.19 1jim s THR 229 Ca 0.24 1.24 -0.27 0.00 0.31 0.00 0.00 61.69 63.20 1jim s THR 229 Cb -0.10 -3.80 -0.02 0.00 0.01 0.00 0.00 72.50 68.59 1jim s THR 229 CO 0.15 -0.00 1.88 -0.60 -0.69 0.00 0.00 174.62 175.36 1jim s ARG 230 N 2.32 2.81 0.24 4.92 3.52 -0.25 -1.63 118.95 130.87 1jim s ARG 230 Ca 0.61 0.91 -0.05 0.00 -0.13 0.00 0.00 55.73 57.07 1jim s ARG 230 Cb -0.29 -4.34 0.34 0.00 -1.56 0.00 0.00 34.95 29.10 1jim s ARG 230 CO 0.25 -2.50 1.83 0.28 -0.81 0.00 0.00 175.30 174.35 1jim h VAL 231 N 6.92 0.99 0.00 7.11 2.07 -1.67 -1.29 116.25 130.38 1jim h VAL 231 Ca -0.28 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 66.94 1jim h VAL 231 Cb 1.17 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1jim h VAL 231 CO 1.16 0.16 0.17 -1.54 0.02 0.00 0.00 177.57 177.54 1jim n SER 232 N -4.68 0.37 0.03 0.57 3.41 -1.26 0.02 113.62 112.08 1jim n SER 232 Ca 0.12 0.60 0.12 0.00 -0.26 0.00 0.00 58.87 59.46 1jim n SER 232 Cb 0.21 -0.60 0.29 0.00 -0.26 0.00 0.00 64.21 63.84 1jim n SER 232 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jim n ALA 233 N -1.61 3.05 -0.10 7.33 0.00 -0.49 -1.47 120.51 127.22 1jim n ALA 233 Ca -0.01 -0.25 0.04 0.00 0.00 0.00 0.00 53.44 53.22 1jim n ALA 233 Cb 0.19 -1.21 0.10 0.00 0.00 0.00 0.00 19.45 18.53 1jim n ALA 233 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1jim n TYR 234 N -1.78 0.31 -0.18 0.00 4.01 0.10 -4.78 117.16 114.84 1jim n TYR 234 Ca 0.05 -0.48 -0.08 0.00 -0.16 0.00 0.00 57.90 57.23 1jim n TYR 234 Cb 0.38 -0.03 0.06 0.00 -0.31 0.00 0.00 39.34 39.44 1jim n TYR 234 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 1jim h ILE 235 N 1.43 1.26 -0.80 -0.72 1.08 -1.71 0.96 117.51 119.00 1jim h ILE 235 Ca 0.00 -1.13 -0.03 0.00 -0.39 0.00 0.00 64.86 63.31 1jim h ILE 235 Cb 0.65 0.83 -0.04 0.00 -3.07 0.00 0.00 36.82 35.19 1jim h ILE 235 CO 0.00 0.41 0.38 0.28 -0.69 0.00 0.00 178.15 178.53 1jim h SER 236 N 0.92 1.05 -0.31 1.72 0.02 -1.91 -0.56 113.55 114.48 1jim h SER 236 Ca 0.16 -0.14 -0.17 0.00 -0.84 0.00 0.00 61.79 60.81 1jim h SER 236 Cb 0.54 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 62.81 1jim h SER 236 CO 0.03 0.89 -0.45 -0.25 -1.14 0.00 0.00 176.83 175.91 1jim h TRP 237 N 1.13 1.07 -0.45 3.45 7.01 -1.78 -1.03 115.95 125.35 1jim h TRP 237 Ca 0.27 -0.34 -0.12 0.00 2.11 0.00 0.00 58.89 60.81 1jim h TRP 237 Cb 0.12 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 26.96 1jim h TRP 237 CO 0.01 1.16 -0.19 0.82 -2.79 0.00 0.00 178.44 177.45 1jim h ILE 238 N 0.70 1.27 -0.51 2.65 2.04 -0.53 -1.66 117.51 121.48 1jim h ILE 238 Ca 0.04 -1.34 -0.08 0.00 1.00 0.00 0.00 64.86 64.48 1jim h ILE 238 Cb 1.04 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 38.27 1jim h ILE 238 CO 0.10 0.46 -0.00 0.78 0.00 0.00 0.00 178.15 179.49 1jim h ASN 239 N 0.77 0.82 -0.02 1.72 -0.26 -0.98 -1.81 115.58 115.83 1jim h ASN 239 Ca 0.10 -0.21 -0.08 0.00 -0.56 0.00 0.00 56.30 55.55 1jim h ASN 239 Cb 0.76 -0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.79 1jim h ASN 239 CO 0.06 0.89 -0.22 0.78 -1.06 0.00 0.00 177.43 177.89 1jim h ASN 240 N 0.79 0.39 -0.17 5.81 -0.26 -0.94 -1.67 115.58 119.54 1jim h ASN 240 Ca 0.15 -0.12 -0.21 0.00 -0.56 0.00 0.00 56.30 55.56 1jim h ASN 240 Cb 0.48 -0.11 0.01 0.00 -1.06 0.00 0.00 38.32 37.64 1jim h ASN 240 CO 0.02 0.62 -0.71 0.58 -1.06 0.00 0.00 177.43 176.88 1jim h VAL 241 N 0.36 1.28 0.12 2.81 2.07 -1.06 -3.16 116.25 118.66 1jim h VAL 241 Ca 0.06 -1.91 -0.29 0.00 0.82 0.00 0.00 66.70 65.39 1jim h VAL 241 Cb 0.58 1.88 0.02 0.00 -1.52 0.00 0.00 31.29 32.25 1jim h VAL 241 CO 0.04 0.61 -1.22 0.40 0.02 0.00 0.00 177.57 177.42 1jim h ILE 242 N 0.57 1.35 -0.10 4.57 2.04 -0.93 -1.70 117.51 123.31 1jim h ILE 242 Ca -0.03 -2.61 0.03 0.00 1.00 0.00 0.00 64.86 63.25 1jim h ILE 242 Cb 1.33 2.73 -0.00 0.00 -0.74 0.00 0.00 36.82 40.14 1jim h ILE 242 CO 0.15 0.78 0.10 0.00 0.00 0.00 0.00 178.15 179.19 1jim h ALA 243 N 0.42 1.74 -0.01 1.87 0.00 -1.41 -2.37 119.26 119.49 1jim h ALA 243 Ca -0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1jim h ALA 243 Cb 1.90 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.69 1jim h ALA 243 CO 0.22 -0.16 -0.04 -1.13 0.00 0.00 0.00 179.25 178.15 1jim n SER 244 N -3.92 1.56 0.00 0.00 3.41 -1.16 -5.10 113.62 108.41 1jim n SER 244 Ca -0.01 -1.28 0.00 0.00 -0.26 0.00 0.00 58.87 57.32 1jim n SER 244 Cb 0.21 0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.27 1jim n SER 244 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47