#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vll s SER 2 N 0.00 5.16 0.10 1.61 0.01 -1.26 -4.25 113.70 115.06 2vll s SER 2 Ca 0.00 2.71 -0.04 0.00 1.31 0.00 0.00 55.95 59.93 2vll s SER 2 Cb 0.00 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.57 2vll s SER 2 CO 0.00 -1.64 0.09 -1.00 0.41 0.00 0.00 173.24 171.10 2vll s HIS 3 N -1.34 0.51 0.03 2.43 0.09 -0.69 -4.95 115.29 111.37 2vll s HIS 3 Ca 0.74 -0.96 0.01 0.00 -0.00 0.00 0.00 55.06 54.85 2vll s HIS 3 Cb -0.39 -0.29 -0.02 0.00 -0.00 0.00 0.00 32.58 31.88 2vll s HIS 3 CO 0.45 -0.50 -0.05 -1.54 -0.00 0.00 0.00 174.74 173.10 2vll s SER 4 N -2.95 0.54 -0.07 1.40 1.04 -1.26 -0.87 113.70 111.53 2vll s SER 4 Ca 0.12 -0.56 0.05 0.00 0.48 0.00 0.00 55.95 56.04 2vll s SER 4 Cb 0.06 0.08 -0.00 0.00 0.10 0.00 0.00 66.02 66.26 2vll s SER 4 CO -0.06 -0.28 -0.23 -0.32 0.98 0.00 0.00 173.24 173.34 2vll s MET 5 N -1.69 2.58 -0.00 4.02 1.75 -0.34 -0.54 119.30 125.09 2vll s MET 5 Ca -0.12 -0.82 0.00 0.00 -1.25 0.00 0.00 55.69 53.51 2vll s MET 5 Cb -0.09 -2.08 0.00 0.00 2.84 0.00 0.00 34.83 35.51 2vll s MET 5 CO -0.01 0.26 -0.00 1.03 -0.65 0.00 0.00 175.02 175.65 2vll s ARG 6 N 0.12 0.02 -0.01 4.11 1.81 -0.22 -1.41 118.95 123.37 2vll s ARG 6 Ca -0.10 -0.00 0.06 0.00 -1.72 0.00 0.00 55.73 53.97 2vll s ARG 6 Cb -0.15 -0.03 -0.03 0.00 -0.45 0.00 0.00 34.95 34.29 2vll s ARG 6 CO 0.06 -0.00 -0.20 0.71 -0.68 0.00 0.00 175.30 175.18 2vll s TYR 7 N 0.04 2.51 -0.09 -0.53 2.02 0.30 -0.42 117.35 121.17 2vll s TYR 7 Ca -0.00 -0.29 0.02 0.00 -0.37 0.00 0.00 57.07 56.42 2vll s TYR 7 Cb -0.01 -1.53 0.02 0.00 -0.40 0.00 0.00 41.96 40.04 2vll s TYR 7 CO -0.00 0.12 -0.13 -0.06 -1.57 0.00 0.00 175.55 173.91 2vll s PHE 8 N -0.74 1.73 -0.06 2.71 0.08 -0.13 -1.62 117.98 119.94 2vll s PHE 8 Ca 0.12 -0.76 0.04 0.00 0.12 0.00 0.00 56.93 56.45 2vll s PHE 8 Cb -0.10 -1.27 -0.00 0.00 -0.57 0.00 0.00 43.02 41.07 2vll s PHE 8 CO 0.01 -0.41 -0.20 -0.06 -0.10 0.00 0.00 175.22 174.46 2vll s PHE 9 N 0.97 2.01 -0.09 0.36 0.08 0.10 -0.93 117.98 120.48 2vll s PHE 9 Ca -0.08 -0.65 0.02 0.00 0.12 0.00 0.00 56.93 56.34 2vll s PHE 9 Cb -0.15 -1.35 0.01 0.00 -0.57 0.00 0.00 43.02 40.96 2vll s PHE 9 CO -0.00 -0.24 -0.14 0.99 -0.10 0.00 0.00 175.22 175.73 2vll s THR 10 N 0.12 1.33 -0.11 0.64 2.01 0.00 -0.94 115.64 118.69 2vll s THR 10 Ca -0.08 -0.56 0.02 0.00 0.31 0.00 0.00 61.69 61.38 2vll s THR 10 Cb -0.14 -1.23 0.01 0.00 0.01 0.00 0.00 72.50 71.16 2vll s THR 10 CO 0.04 0.41 -0.19 -0.55 -0.69 0.00 0.00 174.62 173.64 2vll s SER 11 N 0.89 2.73 -0.14 3.53 0.15 0.33 -0.96 113.70 120.22 2vll s SER 11 Ca -0.09 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.06 2vll s SER 11 Cb -0.15 -1.25 0.02 0.00 -1.71 0.00 0.00 66.02 62.94 2vll s SER 11 CO 0.01 0.06 -0.13 -0.69 1.20 0.00 0.00 173.24 173.69 2vll s VAL 12 N 0.80 1.45 0.44 4.45 1.01 -0.00 -0.44 120.40 128.11 2vll s VAL 12 Ca -0.09 -0.56 -0.23 0.00 0.00 0.00 0.00 61.98 61.10 2vll s VAL 12 Cb -0.16 -1.38 -0.08 0.00 0.00 0.00 0.00 36.38 34.76 2vll s VAL 12 CO 0.00 0.44 1.13 -0.94 0.00 0.00 0.00 175.10 175.73 2vll s SER 13 N 1.54 6.36 -0.44 3.32 1.04 -0.20 -0.54 113.70 124.77 2vll s SER 13 Ca 0.05 2.22 0.06 0.00 0.48 0.00 0.00 55.95 58.76 2vll s SER 13 Cb -0.13 -2.60 0.22 0.00 0.10 0.00 0.00 66.02 63.62 2vll s SER 13 CO -0.10 -0.78 0.49 0.54 0.98 0.00 0.00 173.24 174.37 2vll n ARG 14 N -0.36 0.84 -1.60 4.02 1.74 -1.26 -4.05 116.66 115.99 2vll n ARG 14 Ca 0.07 -3.45 -0.50 0.00 -0.77 0.00 0.00 57.85 53.19 2vll n ARG 14 Cb 0.49 -1.53 -0.05 0.00 -1.02 0.00 0.00 32.46 30.34 2vll n ARG 14 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2vll n PRO 15 N 1.79 1.34 -0.57 5.56 -0.02 -1.26 -0.55 135.00 141.29 2vll n PRO 15 Ca 0.25 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 2vll n PRO 15 Cb 0.49 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 2vll n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vll n GLY 16 N 2.56 0.39 0.93 -1.23 0.00 -1.26 -4.75 105.19 101.83 2vll n GLY 16 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2vll n GLY 16 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2vll n ARG 17 N -2.00 1.80 0.00 1.61 3.00 0.29 -5.09 116.66 116.27 2vll n ARG 17 Ca 0.00 -3.17 0.00 0.00 -0.00 0.00 0.00 57.85 54.68 2vll n ARG 17 Cb 0.00 -1.75 0.00 0.00 0.00 0.00 0.00 32.46 30.71 2vll n ARG 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2vll n GLY 18 N -1.10 -1.65 3.74 5.14 0.00 -1.21 -4.91 105.19 105.19 2vll n GLY 18 Ca 0.27 -1.53 -0.34 0.00 0.00 0.00 0.00 46.02 44.42 2vll n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vll s GLU 19 N 0.00 2.41 0.68 1.61 0.41 -1.26 -4.48 118.70 118.08 2vll s GLU 19 Ca 0.00 1.64 -0.17 0.00 -0.41 0.00 0.00 54.97 56.03 2vll s GLU 19 Cb 0.00 -1.88 0.01 0.00 -1.78 0.00 0.00 34.13 30.48 2vll s GLU 19 CO 0.00 -1.60 1.28 -1.25 -0.49 0.00 0.00 175.26 173.20 2vll s PRO 20 N -3.92 2.35 0.29 0.39 0.04 -1.26 -4.64 135.00 128.25 2vll s PRO 20 Ca 0.72 2.01 -0.28 0.00 0.04 0.00 0.00 61.00 63.49 2vll s PRO 20 Cb -0.26 -1.83 -0.09 0.00 0.04 0.00 0.00 34.50 32.36 2vll s PRO 20 CO 0.43 -1.74 1.02 0.50 0.04 0.00 0.00 177.00 177.26 2vll s ARG 21 N -3.53 4.62 -0.04 4.56 6.06 0.30 -4.86 118.95 126.05 2vll s ARG 21 Ca 0.81 1.60 -0.01 0.00 -2.50 0.00 0.00 55.73 55.63 2vll s ARG 21 Cb -0.36 -3.06 0.03 0.00 0.06 0.00 0.00 34.95 31.62 2vll s ARG 21 CO 0.42 0.25 0.02 0.12 -2.50 0.00 0.00 175.30 173.61 2vll s PHE 22 N -1.31 0.32 -0.08 5.12 5.36 -1.26 -0.82 117.98 125.31 2vll s PHE 22 Ca 0.46 0.04 0.03 0.00 -0.96 0.00 0.00 56.93 56.50 2vll s PHE 22 Cb -0.27 -0.53 0.01 0.00 -0.34 0.00 0.00 43.02 41.89 2vll s PHE 22 CO 0.34 -0.20 -0.16 0.42 -1.46 0.00 0.00 175.22 174.16 2vll s ILE 23 N 1.63 1.43 -0.04 3.12 -1.09 -0.13 -0.42 121.20 125.70 2vll s ILE 23 Ca -0.01 -0.65 0.07 0.00 -2.23 0.00 0.00 60.65 57.83 2vll s ILE 23 Cb -0.13 -1.28 -0.01 0.00 -1.58 0.00 0.00 42.46 39.46 2vll s ILE 23 CO -0.03 0.42 -0.25 0.00 -1.23 0.00 0.00 174.94 173.85 2vll s ALA 24 N 0.62 2.15 0.03 9.38 0.00 0.07 -0.82 121.76 133.20 2vll s ALA 24 Ca -0.15 -1.08 0.02 0.00 0.00 0.00 0.00 51.96 50.75 2vll s ALA 24 Cb -0.16 -0.62 -0.02 0.00 0.00 0.00 0.00 23.12 22.32 2vll s ALA 24 CO 0.05 0.47 -0.07 0.14 0.00 0.00 0.00 175.76 176.34 2vll s VAL 25 N -0.36 0.48 0.01 0.00 -7.23 -0.11 -0.68 120.40 112.52 2vll s VAL 25 Ca 0.02 -0.93 0.07 0.00 -1.81 0.00 0.00 61.98 59.33 2vll s VAL 25 Cb -0.12 -0.54 -0.02 0.00 0.56 0.00 0.00 36.38 36.26 2vll s VAL 25 CO 0.02 -0.32 -0.21 -0.83 -0.31 0.00 0.00 175.10 173.45 2vll s GLY 26 N -1.34 1.07 0.05 2.32 0.00 -0.79 -0.96 107.32 107.67 2vll s GLY 26 Ca -0.09 -0.98 0.06 0.00 0.00 0.00 0.00 44.72 43.71 2vll s GLY 26 CO 0.00 -0.87 -0.17 -0.19 0.00 0.00 0.00 173.10 171.87 2vll s TYR 27 N -0.64 1.51 -0.16 1.90 1.51 0.44 -0.41 117.35 121.50 2vll s TYR 27 Ca 0.08 -0.38 -0.02 0.00 -1.01 0.00 0.00 57.07 55.74 2vll s TYR 27 Cb -0.08 -0.88 -0.01 0.00 -0.11 0.00 0.00 41.96 40.87 2vll s TYR 27 CO 0.01 0.08 -0.09 0.08 -1.11 0.00 0.00 175.55 174.51 2vll s VAL 28 N -0.91 3.23 0.00 0.71 1.01 0.04 -1.06 120.40 123.41 2vll s VAL 28 Ca 0.04 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.44 2vll s VAL 28 Cb -0.09 -2.40 0.00 0.00 0.00 0.00 0.00 36.38 33.89 2vll s VAL 28 CO 0.02 0.49 0.00 0.47 0.00 0.00 0.00 175.10 176.08 2vll n ASP 29 N 3.90 0.00 -1.94 3.32 8.00 0.30 -0.53 116.55 129.60 2vll n ASP 29 Ca -0.18 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.33 2vll n ASP 29 Cb 0.52 0.00 0.36 0.00 -0.02 0.00 0.00 41.12 41.98 2vll n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2vll n ASP 30 N 2.94 5.36 -4.25 -2.24 8.00 -1.26 -4.86 116.55 120.24 2vll n ASP 30 Ca 0.00 -3.07 -0.35 0.00 0.71 0.00 0.00 54.79 52.08 2vll n ASP 30 Cb 0.00 -0.71 -0.14 0.00 -0.02 0.00 0.00 41.12 40.25 2vll n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2vll s THR 31 N -2.88 3.27 0.35 -3.53 2.01 0.31 -5.00 115.64 110.17 2vll s THR 31 Ca 0.55 -0.93 -0.27 0.00 0.31 0.00 0.00 61.69 61.35 2vll s THR 31 Cb 0.43 -2.68 -0.09 0.00 0.01 0.00 0.00 72.50 70.16 2vll s THR 31 CO 0.15 0.14 1.23 -1.58 -0.69 0.00 0.00 174.62 173.86 2vll s GLN 32 N 1.38 4.26 0.00 4.92 0.74 -1.26 -0.78 119.66 128.91 2vll s GLN 32 Ca 0.01 2.02 0.00 0.00 0.05 0.00 0.00 55.36 57.44 2vll s GLN 32 Cb -0.17 -2.93 0.00 0.00 1.10 0.00 0.00 33.01 31.01 2vll s GLN 32 CO -0.02 -0.20 0.00 1.97 -0.55 0.00 0.00 175.29 176.49 2vll n PHE 33 N 0.55 0.00 -4.05 1.67 -1.74 0.45 -4.06 117.46 110.28 2vll n PHE 33 Ca 0.02 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 56.83 2vll n PHE 33 Cb 0.44 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.34 2vll n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 2vll s VAL 34 N -0.85 0.20 0.05 1.97 -7.23 -1.21 -0.01 120.40 113.32 2vll s VAL 34 Ca 0.00 -1.67 -0.08 0.00 -1.81 0.00 0.00 61.98 58.43 2vll s VAL 34 Cb 0.00 -1.41 -0.00 0.00 0.56 0.00 0.00 36.38 35.53 2vll s VAL 34 CO 0.00 -0.92 0.15 0.00 -0.31 0.00 0.00 175.10 174.02 2vll s ARG 35 N -3.73 0.69 -0.01 4.82 1.70 -0.31 -1.89 118.95 120.22 2vll s ARG 35 Ca 0.05 -0.77 0.00 0.00 -0.47 0.00 0.00 55.73 54.55 2vll s ARG 35 Cb 0.06 0.28 0.01 0.00 -0.57 0.00 0.00 34.95 34.73 2vll s ARG 35 CO -0.09 -0.19 -0.01 0.12 -1.08 0.00 0.00 175.30 174.04 2vll s PHE 36 N -2.92 0.21 -0.12 5.89 5.36 0.15 -0.60 117.98 125.94 2vll s PHE 36 Ca -0.02 -0.00 -0.01 0.00 -0.96 0.00 0.00 56.93 55.93 2vll s PHE 36 Cb 0.01 -0.24 0.03 0.00 -0.34 0.00 0.00 43.02 42.48 2vll s PHE 36 CO -0.06 -0.06 -0.03 0.34 -1.46 0.00 0.00 175.22 173.95 2vll s ASP 37 N 0.47 2.25 0.57 6.13 2.15 -1.26 -0.75 116.67 126.23 2vll s ASP 37 Ca -0.04 -0.39 0.28 0.00 0.43 0.00 0.00 52.55 52.83 2vll s ASP 37 Cb -0.07 -0.70 1.50 0.00 -0.30 0.00 0.00 42.92 43.35 2vll s ASP 37 CO -0.01 -0.18 1.96 0.77 -0.17 0.00 0.00 175.17 177.54 2vll h SER 38 N 8.22 0.00 0.18 -0.34 4.64 -1.12 -1.07 113.55 124.06 2vll h SER 38 Ca -0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 2vll h SER 38 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2vll h SER 38 CO 0.35 0.00 -0.33 0.47 -0.87 0.00 0.00 176.83 176.45 2vll n ASP 39 N -3.93 1.25 -4.88 4.97 9.92 -1.26 -4.92 116.55 117.70 2vll n ASP 39 Ca 0.08 -1.02 -0.30 0.00 -0.53 0.00 0.00 54.79 53.01 2vll n ASP 39 Cb 0.60 0.23 0.01 0.00 -0.64 0.00 0.00 41.12 41.33 2vll n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2vll s ALA 40 N -2.51 3.16 0.13 2.24 0.00 -0.41 -4.99 121.76 119.37 2vll s ALA 40 Ca 0.22 -0.20 -0.04 0.00 0.00 0.00 0.00 51.96 51.94 2vll s ALA 40 Cb 0.19 -2.97 -0.09 0.00 0.00 0.00 0.00 23.12 20.25 2vll s ALA 40 CO 0.54 -0.65 1.31 0.00 0.00 0.00 0.00 175.76 176.96 2vll h ALA 41 N -0.22 0.37 -0.65 0.00 0.00 -1.91 -3.32 119.26 113.53 2vll h ALA 41 Ca -0.45 -0.70 -0.04 0.00 0.00 0.00 0.00 54.91 53.72 2vll h ALA 41 Cb 1.20 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 2vll h ALA 41 CO 0.62 0.81 0.25 0.66 0.00 0.00 0.00 179.25 181.59 2vll h SER 42 N 0.24 0.87 -4.98 0.00 4.64 -1.94 -3.46 113.55 108.92 2vll h SER 42 Ca -0.08 -0.12 -0.41 0.00 -0.47 0.00 0.00 61.79 60.71 2vll h SER 42 Cb 1.57 -0.23 0.07 0.00 -0.31 0.00 0.00 62.40 63.50 2vll h SER 42 CO 0.16 0.79 -0.63 0.00 -0.87 0.00 0.00 176.83 176.28 2vll n GLN 43 N -4.30 -5.71 -4.18 4.77 1.13 -1.25 -5.00 117.38 102.85 2vll n GLN 43 Ca 0.06 0.86 -0.15 0.00 -1.94 0.00 0.00 57.00 55.82 2vll n GLN 43 Cb 0.18 -5.77 -0.11 0.00 0.11 0.00 0.00 30.24 24.65 2vll n GLN 43 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2vll s ARG 44 N -5.93 0.85 0.23 -1.09 0.52 -1.26 -5.03 118.95 107.24 2vll s ARG 44 Ca 0.40 -1.12 -0.31 0.00 -0.52 0.00 0.00 55.73 54.18 2vll s ARG 44 Cb -0.18 -0.61 -0.11 0.00 0.52 0.00 0.00 34.95 34.57 2vll s ARG 44 CO 0.50 0.11 1.60 1.41 0.02 0.00 0.00 175.30 178.94 2vll s MET 45 N -2.56 4.16 0.06 3.54 -2.45 -1.26 -4.68 119.30 116.12 2vll s MET 45 Ca 0.04 2.50 0.08 0.00 -1.25 0.00 0.00 55.69 57.06 2vll s MET 45 Cb -0.05 -3.08 -0.03 0.00 1.25 0.00 0.00 34.83 32.93 2vll s MET 45 CO 0.01 -0.63 -0.22 -1.21 1.05 0.00 0.00 175.02 174.02 2vll s GLU 46 N 0.37 1.38 0.29 4.11 2.02 0.23 -4.88 118.70 122.22 2vll s GLU 46 Ca 0.68 -1.03 -0.29 0.00 0.02 0.00 0.00 54.97 54.34 2vll s GLU 46 Cb -0.47 -1.56 -0.10 0.00 0.10 0.00 0.00 34.13 32.11 2vll s GLU 46 CO 0.39 0.39 1.15 -1.25 0.02 0.00 0.00 175.26 175.96 2vll s PRO 47 N -1.40 4.56 -0.01 0.39 0.04 -1.26 -1.16 135.00 136.16 2vll s PRO 47 Ca 0.08 1.90 0.01 0.00 0.04 0.00 0.00 61.00 63.04 2vll s PRO 47 Cb -0.09 -3.15 0.02 0.00 0.04 0.00 0.00 34.50 31.32 2vll s PRO 47 CO 0.03 0.11 0.84 0.54 0.04 0.00 0.00 177.00 178.56 2vll n ARG 48 N 1.07 1.71 -3.97 4.56 5.12 0.98 -4.84 116.66 121.30 2vll n ARG 48 Ca -0.01 -1.22 -0.10 0.00 -1.93 0.00 0.00 57.85 54.59 2vll n ARG 48 Cb 0.44 -0.85 -0.12 0.00 -1.16 0.00 0.00 32.46 30.78 2vll n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2vll s ALA 49 N -0.76 0.14 0.24 7.54 0.00 -1.23 -4.64 121.76 123.06 2vll s ALA 49 Ca 0.02 -0.44 -0.05 0.00 0.00 0.00 0.00 51.96 51.49 2vll s ALA 49 Cb 0.02 0.09 0.26 0.00 0.00 0.00 0.00 23.12 23.50 2vll s ALA 49 CO 0.00 -0.10 1.80 -1.00 0.00 0.00 0.00 175.76 176.47 2vll h PRO 50 N 5.07 1.06 0.00 0.00 0.13 -1.94 -3.10 132.00 133.21 2vll h PRO 50 Ca -0.30 -0.20 -0.05 0.00 -0.87 0.00 0.00 66.00 64.59 2vll h PRO 50 Cb 1.21 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 2vll h PRO 50 CO 0.44 0.88 -0.22 0.11 -0.23 0.00 0.00 178.00 178.97 2vll h TRP 51 N 1.03 0.00 0.00 1.56 5.08 -1.96 -1.84 115.95 119.82 2vll h TRP 51 Ca 0.23 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.20 2vll h TRP 51 Cb 0.24 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.40 2vll h TRP 51 CO 0.02 0.22 0.00 0.97 -1.28 0.00 0.00 178.44 178.37 2vll h ILE 52 N 0.00 0.00 0.00 0.12 6.09 -1.89 -3.19 117.51 118.64 2vll h ILE 52 Ca -0.00 -0.62 0.00 0.00 -1.37 0.00 0.00 64.86 62.87 2vll h ILE 52 Cb 0.44 1.60 0.00 0.00 0.47 0.00 0.00 36.82 39.33 2vll h ILE 52 CO 0.03 0.00 0.00 -0.33 -3.07 0.00 0.00 178.15 174.78 2vll h GLU 53 N 0.00 0.00 0.00 2.19 5.08 -1.40 -1.58 114.58 118.87 2vll h GLU 53 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2vll h GLU 53 Cb 0.78 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.03 2vll h GLU 53 CO 0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 179.01 177.95 2vll n GLN 54 N -2.76 0.03 -2.19 2.33 10.64 -1.21 -4.79 117.38 119.44 2vll n GLN 54 Ca -0.01 0.02 -0.37 0.00 -1.83 0.00 0.00 57.00 54.81 2vll n GLN 54 Cb 0.16 -1.53 -0.00 0.00 -0.86 0.00 0.00 30.24 28.01 2vll n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 2vll s GLU 55 N -3.01 3.66 0.85 2.61 0.41 -0.60 -5.02 118.70 117.61 2vll s GLU 55 Ca 0.13 1.84 -0.09 0.00 -0.41 0.00 0.00 54.97 56.44 2vll s GLU 55 Cb 0.18 -2.38 0.19 0.00 -1.78 0.00 0.00 34.13 30.34 2vll s GLU 55 CO 0.55 -0.65 1.16 0.41 -0.49 0.00 0.00 175.26 176.25 2vll n GLY 56 N 0.48 -0.55 0.30 -1.39 0.00 -1.26 -4.85 105.19 97.93 2vll n GLY 56 Ca 0.08 -1.85 0.11 0.00 0.00 0.00 0.00 46.02 44.35 2vll n GLY 56 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2vll h PRO 57 N 0.00 0.09 -0.64 1.61 0.13 -1.97 -0.56 132.00 130.66 2vll h PRO 57 Ca -0.38 -0.01 -0.04 0.00 -0.87 0.00 0.00 66.00 64.70 2vll h PRO 57 Cb 1.18 -0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.26 2vll h PRO 57 CO 0.32 0.06 0.23 1.49 -0.23 0.00 0.00 178.00 179.88 2vll h GLU 58 N 0.10 0.95 0.11 0.86 4.57 -1.99 0.16 114.58 119.34 2vll h GLU 58 Ca 0.10 -0.17 -0.01 0.00 -1.18 0.00 0.00 59.36 58.10 2vll h GLU 58 Cb 0.26 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 2vll h GLU 58 CO -0.01 0.79 -0.05 -0.92 -1.18 0.00 0.00 179.01 177.64 2vll h TYR 59 N 0.93 -0.14 -0.70 0.92 5.03 -1.46 -1.12 116.97 120.43 2vll h TYR 59 Ca 0.21 -0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.47 2vll h TYR 59 Cb 0.21 0.05 -0.03 0.00 1.55 0.00 0.00 36.73 38.51 2vll h TYR 59 CO 0.02 0.12 0.23 -1.49 -1.32 0.00 0.00 178.16 175.71 2vll h TRP 60 N -0.39 1.09 -0.35 -3.82 4.06 -1.21 0.19 115.95 115.53 2vll h TRP 60 Ca -0.02 -0.10 -0.14 0.00 2.06 0.00 0.00 58.89 60.70 2vll h TRP 60 Cb 0.32 -0.32 -0.01 0.00 -1.00 0.00 0.00 29.16 28.15 2vll h TRP 60 CO 0.01 0.86 -0.33 -0.44 -3.56 0.00 0.00 178.44 174.98 2vll h ASP 61 N 1.03 0.80 -0.18 -3.49 5.19 -0.68 -0.53 116.42 118.56 2vll h ASP 61 Ca 0.23 -0.34 -0.05 0.00 -0.62 0.00 0.00 57.03 56.25 2vll h ASP 61 Cb 0.28 -0.22 -0.00 0.00 0.18 0.00 0.00 39.33 39.56 2vll h ASP 61 CO -0.01 1.06 -0.10 1.23 -3.12 0.00 0.00 179.24 178.30 2vll h GLY 62 N 0.94 0.42 1.61 2.75 0.00 -0.63 -0.21 103.07 107.95 2vll h GLY 62 Ca 0.07 -0.39 -0.05 0.00 0.00 0.00 0.00 47.33 46.96 2vll h GLY 62 CO 0.08 0.35 -0.03 0.83 0.00 0.00 0.00 176.54 177.77 2vll h GLU 63 N 0.06 0.48 -0.31 4.80 4.39 -0.59 -1.01 114.58 122.41 2vll h GLU 63 Ca 0.04 -0.11 -0.04 0.00 0.34 0.00 0.00 59.36 59.59 2vll h GLU 63 Cb 0.60 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 2vll h GLU 63 CO 0.03 0.54 0.03 1.15 -1.16 0.00 0.00 179.01 179.60 2vll h THR 64 N 0.46 1.24 -0.49 1.13 2.02 -0.91 -0.41 112.91 115.97 2vll h THR 64 Ca 0.10 -0.86 -0.03 0.00 0.77 0.00 0.00 66.41 66.38 2vll h THR 64 Cb 0.35 1.21 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 2vll h THR 64 CO 0.01 0.28 0.17 -0.09 0.37 0.00 0.00 175.52 176.27 2vll h ARG 65 N 0.33 0.74 -0.40 6.66 2.43 -0.71 -1.72 114.38 121.72 2vll h ARG 65 Ca 0.09 -0.15 -0.15 0.00 -0.81 0.00 0.00 59.98 58.96 2vll h ARG 65 Cb 0.38 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 2vll h ARG 65 CO 0.01 0.68 -0.35 0.87 -1.51 0.00 0.00 179.97 179.67 2vll h LYS 66 N 0.65 0.92 -0.04 0.20 1.57 -1.15 -2.71 116.57 116.01 2vll h LYS 66 Ca 0.16 -0.46 -0.13 0.00 -1.87 0.00 0.00 60.65 58.34 2vll h LYS 66 Cb 0.24 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 2vll h LYS 66 CO -0.01 1.12 -0.58 -0.24 -0.57 0.00 0.00 179.45 179.17 2vll h VAL 67 N 0.76 1.39 -0.75 0.50 3.04 -0.95 -1.35 116.25 118.89 2vll h VAL 67 Ca 0.07 -1.96 -0.05 0.00 -1.01 0.00 0.00 66.70 63.76 2vll h VAL 67 Cb 0.93 2.01 -0.03 0.00 -2.01 0.00 0.00 31.29 32.19 2vll h VAL 67 CO 0.09 0.57 0.29 0.11 -1.01 0.00 0.00 177.57 177.62 2vll h LYS 68 N 0.11 1.12 -0.74 4.17 1.57 -1.25 -0.30 116.57 121.25 2vll h LYS 68 Ca -0.00 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.54 2vll h LYS 68 Cb 1.06 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 33.15 2vll h LYS 68 CO 0.08 0.92 0.32 0.00 -0.57 0.00 0.00 179.45 180.21 2vll h ALA 69 N 1.22 0.96 -0.16 3.86 0.00 -1.12 -0.69 119.26 123.32 2vll h ALA 69 Ca 0.25 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.01 2vll h ALA 69 Cb 0.22 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2vll h ALA 69 CO -0.02 0.55 0.02 0.45 0.00 0.00 0.00 179.25 180.25 2vll h HIS 70 N 1.05 0.02 -0.31 0.00 3.86 -1.01 -1.50 115.15 117.27 2vll h HIS 70 Ca 0.25 0.01 0.06 0.00 -1.16 0.00 0.00 60.37 59.53 2vll h HIS 70 Cb 0.17 0.01 -0.06 0.00 1.06 0.00 0.00 27.41 28.60 2vll h HIS 70 CO 0.01 -0.00 -0.06 1.03 0.86 0.00 0.00 177.93 179.77 2vll h SER 71 N 0.08 -0.24 -0.71 2.45 0.87 -0.67 -0.94 113.55 114.38 2vll h SER 71 Ca 0.07 0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 60.70 2vll h SER 71 Cb 0.08 0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.18 2vll h SER 71 CO -0.11 -0.08 0.36 1.56 -0.53 0.00 0.00 176.83 178.02 2vll h GLN 72 N 0.02 1.01 -0.49 2.24 1.08 -1.02 -0.71 115.11 117.26 2vll h GLN 72 Ca 0.15 -0.14 0.01 0.00 -1.45 0.00 0.00 58.65 57.22 2vll h GLN 72 Cb 0.22 -0.19 -0.03 0.00 -0.05 0.00 0.00 27.48 27.43 2vll h GLN 72 CO -0.30 0.78 0.31 1.15 -0.95 0.00 0.00 178.83 179.82 2vll h THR 73 N 0.99 1.09 -0.05 -0.54 2.02 -0.82 -1.70 112.91 113.90 2vll h THR 73 Ca 0.25 -0.21 -0.11 0.00 0.77 0.00 0.00 66.41 67.10 2vll h THR 73 Cb 0.09 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 2vll h THR 73 CO -0.03 0.11 -0.48 0.45 0.37 0.00 0.00 175.52 175.94 2vll h HIS 74 N 0.62 0.15 -0.44 3.16 3.86 -0.89 -0.23 115.15 121.38 2vll h HIS 74 Ca 0.19 -0.04 0.01 0.00 -1.16 0.00 0.00 60.37 59.36 2vll h HIS 74 Cb -0.04 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 2vll h HIS 74 CO -0.05 0.58 0.28 -0.09 0.86 0.00 0.00 177.93 179.51 2vll h ARG 75 N 0.10 0.55 -0.21 2.45 2.43 -0.67 -1.80 114.38 117.23 2vll h ARG 75 Ca 0.00 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 2vll h ARG 75 Cb 0.89 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.31 2vll h ARG 75 CO 0.07 0.37 0.11 0.28 -1.51 0.00 0.00 179.97 179.29 2vll h VAL 76 N 0.57 1.12 -0.97 0.20 2.07 -1.01 -3.06 116.25 115.18 2vll h VAL 76 Ca 0.17 -0.34 0.15 0.00 0.82 0.00 0.00 66.70 67.50 2vll h VAL 76 Cb -0.04 0.96 -0.10 0.00 -1.52 0.00 0.00 31.29 30.59 2vll h VAL 76 CO -0.05 0.12 0.58 0.44 0.02 0.00 0.00 177.57 178.68 2vll h ASP 77 N 0.23 0.79 -0.84 0.57 3.32 -0.69 -1.51 116.42 118.29 2vll h ASP 77 Ca 0.07 0.08 0.02 0.00 0.02 0.00 0.00 57.03 57.23 2vll h ASP 77 Cb 0.09 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.52 2vll h ASP 77 CO -0.01 0.35 0.55 -0.07 -1.72 0.00 0.00 179.24 178.33 2vll h LEU 78 N 0.83 0.92 -0.51 1.55 3.38 -1.23 0.01 115.31 120.26 2vll h LEU 78 Ca 0.52 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.41 2vll h LEU 78 Cb 0.69 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 2vll h LEU 78 CO -0.33 0.65 0.05 1.23 0.09 0.00 0.00 178.44 180.13 2vll h GLY 79 N 1.08 0.93 0.96 0.83 0.00 -1.34 -2.37 103.07 103.16 2vll h GLY 79 Ca 0.32 -0.64 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 2vll h GLY 79 CO -0.10 0.59 0.17 -0.84 0.00 0.00 0.00 176.54 176.36 2vll h THR 80 N 0.73 1.13 -0.38 4.70 2.02 -0.76 -2.57 112.91 117.78 2vll h THR 80 Ca 0.15 -0.33 -0.07 0.00 0.77 0.00 0.00 66.41 66.93 2vll h THR 80 Cb 0.44 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 2vll h THR 80 CO 0.02 0.13 -0.03 -0.07 0.37 0.00 0.00 175.52 175.93 2vll h LEU 81 N 0.37 0.69 -0.68 2.58 3.38 -1.02 -0.02 115.31 120.61 2vll h LEU 81 Ca 0.11 -0.33 0.15 0.00 0.09 0.00 0.00 57.88 57.90 2vll h LEU 81 Cb 0.06 -0.19 -0.11 0.00 0.09 0.00 0.00 40.66 40.51 2vll h LEU 81 CO -0.02 0.85 0.04 -0.09 0.09 0.00 0.00 178.44 179.31 2vll h ARG 82 N 0.51 0.14 0.17 1.13 2.43 -1.39 0.00 114.38 117.38 2vll h ARG 82 Ca 0.10 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 2vll h ARG 82 Cb 0.52 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 2vll h ARG 82 CO 0.03 0.09 -0.09 0.78 -1.51 0.00 0.00 179.97 179.27 2vll h GLY 83 N 0.14 -0.25 0.85 2.80 0.00 -1.01 -0.03 103.07 105.57 2vll h GLY 83 Ca 0.36 0.10 0.09 0.00 0.00 0.00 0.00 47.33 47.88 2vll h GLY 83 CO -0.56 -0.09 0.52 -0.97 0.00 0.00 0.00 176.54 175.44 2vll h TYR 84 N -0.24 0.80 -0.39 5.60 0.05 -0.03 -2.39 116.97 120.37 2vll h TYR 84 Ca -0.02 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2vll h TYR 84 Cb 0.19 -0.26 0.00 0.00 1.01 0.00 0.00 36.73 37.67 2vll h TYR 84 CO -0.07 0.38 0.00 0.66 -1.05 0.00 0.00 178.16 178.08 2vll n TYR 85 N -4.50 0.50 -3.66 4.88 4.01 -0.11 -4.89 117.16 113.39 2vll n TYR 85 Ca 0.13 -0.25 -0.23 0.00 -0.16 0.00 0.00 57.90 57.39 2vll n TYR 85 Cb 0.31 -0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.37 2vll n TYR 85 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2vll n ASN 86 N 1.48 -2.48 -4.86 7.72 5.15 -0.62 -4.98 115.26 116.67 2vll n ASN 86 Ca 0.19 -0.85 -0.29 0.00 -0.60 0.00 0.00 54.58 53.03 2vll n ASN 86 Cb 0.60 -4.02 -0.05 0.00 -0.53 0.00 0.00 39.78 35.78 2vll n ASN 86 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2vll s GLN 87 N -5.82 3.19 0.60 1.20 -0.21 -0.12 -5.04 119.66 113.45 2vll s GLN 87 Ca 0.14 -0.63 -0.19 0.00 0.02 0.00 0.00 55.36 54.70 2vll s GLN 87 Cb -0.04 -2.86 -0.03 0.00 1.00 0.00 0.00 33.01 31.08 2vll s GLN 87 CO 0.82 0.55 1.24 0.45 -2.12 0.00 0.00 175.29 176.23 2vll s SER 88 N -2.77 5.05 0.15 5.90 0.15 -1.26 -4.78 113.70 116.15 2vll s SER 88 Ca 0.33 2.47 0.18 0.00 0.70 0.00 0.00 55.95 59.63 2vll s SER 88 Cb -0.12 -2.61 0.78 0.00 -1.71 0.00 0.00 66.02 62.37 2vll s SER 88 CO 0.26 -1.69 1.55 -0.62 1.20 0.00 0.00 173.24 173.94 2vll n GLU 89 N -1.62 0.10 0.07 5.44 -0.58 -1.26 -3.65 120.64 119.14 2vll n GLU 89 Ca 0.14 0.38 -0.01 0.00 -0.42 0.00 0.00 57.16 57.26 2vll n GLU 89 Cb 0.49 -1.71 -0.06 0.00 -0.57 0.00 0.00 31.44 29.59 2vll n GLU 89 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2vll h ALA 90 N 2.31 0.63 -2.33 0.62 0.00 -1.98 -3.43 119.26 115.08 2vll h ALA 90 Ca 0.00 -0.78 -0.50 0.00 0.00 0.00 0.00 54.91 53.64 2vll h ALA 90 Cb 0.26 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2vll h ALA 90 CO 0.00 0.92 0.08 0.20 0.00 0.00 0.00 179.25 180.46 2vll s GLY 91 N -4.70 2.20 0.07 0.00 0.00 -1.24 -4.64 107.32 99.01 2vll s GLY 91 Ca -0.00 -0.07 -0.24 0.00 0.00 0.00 0.00 44.72 44.41 2vll s GLY 91 CO 0.79 0.13 0.72 -0.45 0.00 0.00 0.00 173.10 174.29 2vll s SER 92 N -2.57 7.20 0.18 1.64 0.15 -1.26 -4.65 113.70 114.39 2vll s SER 92 Ca 0.53 1.43 0.03 0.00 0.70 0.00 0.00 55.95 58.64 2vll s SER 92 Cb -0.10 -2.45 -0.05 0.00 -1.71 0.00 0.00 66.02 61.71 2vll s SER 92 CO 0.22 0.10 -0.02 -1.00 1.20 0.00 0.00 173.24 173.74 2vll s HIS 93 N -0.44 1.28 -0.08 3.44 3.76 -1.26 -4.95 115.29 117.05 2vll s HIS 93 Ca 0.36 -0.94 0.02 0.00 -0.15 0.00 0.00 55.06 54.35 2vll s HIS 93 Cb -0.21 -0.72 0.01 0.00 1.11 0.00 0.00 32.58 32.78 2vll s HIS 93 CO 0.22 -0.11 -0.13 0.99 -0.85 0.00 0.00 174.74 174.87 2vll s THR 94 N -3.54 1.21 -0.14 1.30 2.01 -1.26 -1.03 115.64 114.19 2vll s THR 94 Ca 0.23 -0.50 -0.04 0.00 0.31 0.00 0.00 61.69 61.68 2vll s THR 94 Cb 0.05 -1.11 -0.03 0.00 0.01 0.00 0.00 72.50 71.42 2vll s THR 94 CO 0.04 0.38 0.00 -0.69 -0.69 0.00 0.00 174.62 173.66 2vll s VAL 95 N 0.79 4.27 0.07 3.82 1.01 0.41 -0.34 120.40 130.43 2vll s VAL 95 Ca -0.12 -0.23 0.09 0.00 0.00 0.00 0.00 61.98 61.71 2vll s VAL 95 Cb -0.15 -2.87 -0.03 0.00 0.00 0.00 0.00 36.38 33.33 2vll s VAL 95 CO 0.02 0.52 -0.23 -1.10 0.00 0.00 0.00 175.10 174.31 2vll s GLN 96 N 0.02 1.41 0.00 2.72 -0.21 -0.44 -0.52 119.66 122.65 2vll s GLN 96 Ca 0.03 -1.10 -0.01 0.00 0.02 0.00 0.00 55.36 54.30 2vll s GLN 96 Cb -0.13 -1.65 -0.00 0.00 1.00 0.00 0.00 33.01 32.23 2vll s GLN 96 CO 0.02 0.41 0.01 0.50 -2.12 0.00 0.00 175.29 174.11 2vll s ARG 97 N -1.51 0.13 -0.01 2.91 3.52 -0.12 -0.84 118.95 123.02 2vll s ARG 97 Ca 0.09 -0.18 0.01 0.00 -0.13 0.00 0.00 55.73 55.52 2vll s ARG 97 Cb -0.10 0.05 0.01 0.00 -1.56 0.00 0.00 34.95 33.35 2vll s ARG 97 CO 0.03 -0.02 -0.02 1.41 -0.81 0.00 0.00 175.30 175.89 2vll s MET 98 N -0.49 0.29 0.16 5.12 -2.45 -0.18 0.02 119.30 121.77 2vll s MET 98 Ca -0.05 -0.06 -0.12 0.00 -1.25 0.00 0.00 55.69 54.21 2vll s MET 98 Cb -0.03 -0.33 0.01 0.00 1.25 0.00 0.00 34.83 35.72 2vll s MET 98 CO -0.00 0.01 0.35 1.52 1.05 0.00 0.00 175.02 177.95 2vll s TYR 99 N 0.25 0.19 -5.00 4.11 -0.85 -0.64 -0.89 117.35 114.52 2vll s TYR 99 Ca -0.02 -0.55 0.00 0.00 -0.52 0.00 0.00 57.07 55.98 2vll s TYR 99 Cb -0.05 0.09 0.00 0.00 0.38 0.00 0.00 41.96 42.38 2vll s TYR 99 CO -0.01 -0.76 0.00 0.41 -1.52 0.00 0.00 175.55 173.67 2vll n GLY 100 N -0.24 -1.25 3.03 5.49 0.00 -0.72 -0.54 105.19 110.96 2vll n GLY 100 Ca -0.09 -1.25 -0.09 0.00 0.00 0.00 0.00 46.02 44.58 2vll n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vll s ASP 102 N -1.70 4.41 0.14 0.00 1.01 0.16 -1.19 116.67 119.49 2vll s ASP 102 Ca -0.12 -0.18 0.08 0.00 0.71 0.00 0.00 52.55 53.05 2vll s ASP 102 Cb -0.07 -0.98 -0.04 0.00 1.01 0.00 0.00 42.92 42.84 2vll s ASP 102 CO -0.02 0.30 -0.11 0.68 0.21 0.00 0.00 175.17 176.23 2vll s VAL 103 N -0.91 3.24 0.16 -1.27 -7.23 -0.05 -0.48 120.40 113.85 2vll s VAL 103 Ca 0.15 -1.45 -0.03 0.00 -1.81 0.00 0.00 61.98 58.84 2vll s VAL 103 Cb -0.11 -2.55 0.04 0.00 0.56 0.00 0.00 36.38 34.32 2vll s VAL 103 CO 0.05 0.02 0.22 0.61 -0.31 0.00 0.00 175.10 175.69 2vll n GLY 104 N 0.44 -1.14 0.18 2.32 0.00 -0.65 -1.70 105.19 104.64 2vll n GLY 104 Ca -0.13 -1.68 0.13 0.00 0.00 0.00 0.00 46.02 44.34 2vll n GLY 104 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2vll h SER 105 N -0.29 0.00 -0.00 1.61 4.64 -1.91 0.14 113.55 117.75 2vll h SER 105 Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2vll h SER 105 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2vll h SER 105 CO 0.05 0.00 -0.00 -0.90 -0.87 0.00 0.00 176.83 175.11 2vll n ASP 106 N -2.41 0.96 -0.57 4.97 5.75 -1.26 -4.68 116.55 119.31 2vll n ASP 106 Ca 0.00 -1.30 -0.07 0.00 -0.01 0.00 0.00 54.79 53.40 2vll n ASP 106 Cb 0.15 -0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.21 2vll n ASP 106 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2vll n TRP 107 N -0.26 0.00 -3.53 2.11 7.02 0.50 -5.01 117.44 118.28 2vll n TRP 107 Ca 0.21 0.00 -0.31 0.00 -1.02 0.00 0.00 57.50 56.38 2vll n TRP 107 Cb 0.27 -2.19 -0.04 0.00 -2.42 0.00 0.00 31.31 26.93 2vll n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 2vll s ARG 108 N -2.41 3.67 0.13 -0.99 0.52 -1.26 -4.80 118.95 113.81 2vll s ARG 108 Ca 0.00 0.03 -0.35 0.00 -0.52 0.00 0.00 55.73 54.89 2vll s ARG 108 Cb 0.00 -2.74 -0.16 0.00 0.52 0.00 0.00 34.95 32.56 2vll s ARG 108 CO 0.00 0.36 1.20 0.34 0.02 0.00 0.00 175.30 177.22 2vll n PHE 109 N -0.25 1.26 -0.01 -0.53 7.35 -1.26 -1.63 117.46 122.39 2vll n PHE 109 Ca -0.01 0.71 -0.02 0.00 -0.76 0.00 0.00 57.45 57.36 2vll n PHE 109 Cb 0.52 -2.27 -0.01 0.00 0.35 0.00 0.00 39.48 38.08 2vll n PHE 109 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89 2vll n LEU 110 N 2.15 1.08 -3.65 -2.13 7.94 0.36 -4.75 117.00 118.01 2vll n LEU 110 Ca 0.17 0.01 -0.15 0.00 -1.11 0.00 0.00 56.01 54.93 2vll n LEU 110 Cb 0.21 -0.06 -0.08 0.00 0.53 0.00 0.00 43.42 44.02 2vll n LEU 110 CO 0.61 0.20 0.27 -0.13 -1.11 0.00 0.00 177.39 177.24 2vll s ARG 111 N -2.04 0.77 0.18 1.96 0.52 -1.09 -4.98 118.95 114.27 2vll s ARG 111 Ca -0.03 0.54 0.10 0.00 -0.52 0.00 0.00 55.73 55.82 2vll s ARG 111 Cb 0.01 0.37 -0.04 0.00 0.52 0.00 0.00 34.95 35.80 2vll s ARG 111 CO 0.04 -0.15 -0.20 0.20 0.02 0.00 0.00 175.30 175.20 2vll s GLY 112 N -0.28 1.54 -0.00 -3.53 0.00 -1.26 0.40 107.32 104.19 2vll s GLY 112 Ca -0.04 -1.57 -0.03 0.00 0.00 0.00 0.00 44.72 43.07 2vll s GLY 112 CO 0.03 -1.62 0.06 -0.19 0.00 0.00 0.00 173.10 171.38 2vll s TYR 113 N -1.98 0.08 -0.30 1.90 1.51 -0.10 -4.82 117.35 113.64 2vll s TYR 113 Ca 0.19 -0.16 -0.03 0.00 -1.01 0.00 0.00 57.07 56.05 2vll s TYR 113 Cb -0.06 -0.07 0.19 0.00 -0.11 0.00 0.00 41.96 41.90 2vll s TYR 113 CO 0.08 -0.17 0.75 -1.58 -1.11 0.00 0.00 175.55 173.52 2vll s HIS 114 N -0.95 -1.29 0.06 2.71 2.46 -1.25 -1.76 115.29 115.26 2vll s HIS 114 Ca -0.10 1.13 -0.11 0.00 0.47 0.00 0.00 55.06 56.44 2vll s HIS 114 Cb -0.06 0.36 0.01 0.00 -0.13 0.00 0.00 32.58 32.76 2vll s HIS 114 CO 0.00 -0.73 0.24 1.14 -2.47 0.00 0.00 174.74 172.93 2vll s GLN 115 N 2.89 0.79 0.11 2.88 -2.07 -0.07 -0.46 119.66 123.72 2vll s GLN 115 Ca 0.14 -0.66 0.06 0.00 -1.82 0.00 0.00 55.36 53.08 2vll s GLN 115 Cb -0.11 0.33 -0.04 0.00 -1.09 0.00 0.00 33.01 32.11 2vll s GLN 115 CO -0.20 -0.25 -0.15 0.71 -1.32 0.00 0.00 175.29 174.08 2vll s TYR 116 N -2.91 1.42 0.03 9.60 1.51 0.59 -1.01 117.35 126.58 2vll s TYR 116 Ca -0.02 -0.51 0.03 0.00 -1.01 0.00 0.00 57.07 55.56 2vll s TYR 116 Cb 0.00 -0.76 -0.02 0.00 -0.11 0.00 0.00 41.96 41.08 2vll s TYR 116 CO -0.06 0.14 -0.09 0.00 -1.11 0.00 0.00 175.55 174.42 2vll s ALA 117 N -1.78 0.76 -0.11 3.71 0.00 -0.02 -0.88 121.76 123.43 2vll s ALA 117 Ca 0.06 -0.68 0.02 0.00 0.00 0.00 0.00 51.96 51.36 2vll s ALA 117 Cb -0.07 -0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.00 2vll s ALA 117 CO 0.03 0.09 -0.18 -0.47 0.00 0.00 0.00 175.76 175.23 2vll s TYR 118 N -0.94 2.17 -1.67 0.00 5.04 -0.11 -1.33 117.35 120.51 2vll s TYR 118 Ca -0.03 -1.00 -0.16 0.00 -2.44 0.00 0.00 57.07 53.44 2vll s TYR 118 Cb -0.08 -1.52 0.14 0.00 0.35 0.00 0.00 41.96 40.85 2vll s TYR 118 CO 0.01 -0.47 0.71 -0.25 -1.34 0.00 0.00 175.55 174.20 2vll n ASP 119 N 4.01 -2.72 0.00 4.32 8.00 0.54 -2.13 116.55 128.57 2vll n ASP 119 Ca -0.20 -1.03 0.00 0.00 0.71 0.00 0.00 54.79 54.28 2vll n ASP 119 Cb 0.52 -2.72 0.00 0.00 -0.02 0.00 0.00 41.12 38.90 2vll n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2vll n GLY 120 N -1.51 0.78 3.44 0.44 0.00 -1.26 -5.02 105.19 102.05 2vll n GLY 120 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2vll n GLY 120 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2vll s LYS 121 N -0.36 2.21 0.19 1.61 2.20 -0.91 -5.08 119.74 119.60 2vll s LYS 121 Ca 0.00 -0.89 -0.32 0.00 -0.36 0.00 0.00 55.97 54.41 2vll s LYS 121 Cb 0.00 -2.22 -0.16 0.00 -1.51 0.00 0.00 37.83 33.94 2vll s LYS 121 CO 0.00 0.57 1.05 -0.25 -0.36 0.00 0.00 175.35 176.36 2vll n ASP 122 N 1.93 0.95 0.00 1.43 8.00 -1.26 -0.93 116.55 126.67 2vll n ASP 122 Ca -0.16 1.15 -0.01 0.00 0.71 0.00 0.00 54.79 56.47 2vll n ASP 122 Cb 0.52 -1.18 -0.00 0.00 -0.02 0.00 0.00 41.12 40.43 2vll n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vll n TYR 123 N 1.05 0.00 -3.85 1.24 9.36 -0.06 -4.67 117.16 120.23 2vll n TYR 123 Ca 0.14 0.00 -0.12 0.00 3.32 0.00 0.00 57.90 61.25 2vll n TYR 123 Cb 0.25 -0.08 -0.11 0.00 -0.63 0.00 0.00 39.34 38.77 2vll n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 2vll s ILE 124 N -1.65 0.05 -0.00 2.97 2.07 -1.14 -1.11 121.20 122.38 2vll s ILE 124 Ca -0.05 -0.39 0.00 0.00 -1.41 0.00 0.00 60.65 58.81 2vll s ILE 124 Cb 0.01 -0.34 -0.00 0.00 0.13 0.00 0.00 42.46 42.25 2vll s ILE 124 CO 0.07 -0.21 -0.01 0.00 -1.91 0.00 0.00 174.94 172.87 2vll s ALA 125 N -0.74 0.09 0.01 1.50 0.00 -0.28 -0.30 121.76 122.05 2vll s ALA 125 Ca -0.08 -0.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.52 2vll s ALA 125 Cb -0.05 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.01 2vll s ALA 125 CO 0.01 0.02 1.17 -1.17 0.00 0.00 0.00 175.76 175.78 2vll s LEU 126 N -0.06 4.34 0.86 0.00 2.96 0.39 -0.26 118.68 126.91 2vll s LEU 126 Ca 0.00 1.90 -0.11 0.00 -0.22 0.00 0.00 54.13 55.69 2vll s LEU 126 Cb -0.01 -3.57 0.11 0.00 0.50 0.00 0.00 46.19 43.22 2vll s LEU 126 CO -0.00 -0.47 1.09 -0.54 -1.32 0.00 0.00 176.35 175.11 2vll s LYS 127 N 1.43 1.58 0.54 1.98 1.02 0.16 -4.55 119.74 121.90 2vll s LYS 127 Ca 0.57 0.88 0.25 0.00 0.02 0.00 0.00 55.97 57.69 2vll s LYS 127 Cb -0.27 -1.84 1.44 0.00 -0.52 0.00 0.00 37.83 36.64 2vll s LYS 127 CO 0.27 -2.03 2.02 1.49 -0.92 0.00 0.00 175.35 176.18 2vll h GLU 128 N -1.40 0.00 0.00 1.68 4.81 -1.89 0.10 114.58 117.89 2vll h GLU 128 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 2vll h GLU 128 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 2vll h GLU 128 CO 0.54 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.42 2vll n ASP 129 N -4.24 0.00 -2.23 1.04 5.68 -1.26 -4.78 116.55 110.76 2vll n ASP 129 Ca 0.07 0.48 -0.20 0.00 -0.50 0.00 0.00 54.79 54.64 2vll n ASP 129 Cb 0.51 -0.49 -0.02 0.00 -1.14 0.00 0.00 41.12 39.98 2vll n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 2vll n LEU 130 N -1.49 -1.88 0.00 -2.12 4.77 0.36 -4.78 117.00 111.85 2vll n LEU 130 Ca 0.05 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 2vll n LEU 130 Cb 0.21 -2.86 0.00 0.00 -2.33 0.00 0.00 43.42 38.44 2vll n LEU 130 CO 0.17 -0.30 -0.15 0.54 -1.33 0.00 0.00 177.39 176.33 2vll n ARG 131 N -2.89 4.17 -4.29 3.23 1.74 -1.26 -4.53 116.66 112.83 2vll n ARG 131 Ca -0.24 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.69 2vll n ARG 131 Cb 0.68 -0.65 -0.10 0.00 -1.02 0.00 0.00 32.46 31.37 2vll n ARG 131 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2vll s SER 132 N -0.61 1.79 0.08 0.55 1.04 -1.26 -4.92 113.70 110.37 2vll s SER 132 Ca 0.00 -1.12 0.09 0.00 0.48 0.00 0.00 55.95 55.40 2vll s SER 132 Cb 0.00 0.00 -0.03 0.00 0.10 0.00 0.00 66.02 66.09 2vll s SER 132 CO 0.00 -0.42 -0.23 0.26 0.98 0.00 0.00 173.24 173.83 2vll s TRP 133 N -3.38 2.43 -0.28 5.02 0.52 -1.26 -0.67 118.94 121.32 2vll s TRP 133 Ca 0.23 -0.33 -0.07 0.00 0.02 0.00 0.00 56.10 55.95 2vll s TRP 133 Cb 0.04 -1.37 -0.00 0.00 -1.15 0.00 0.00 33.47 30.99 2vll s TRP 133 CO 0.05 0.27 0.08 0.99 0.02 0.00 0.00 176.95 178.35 2vll s THR 134 N -0.97 4.06 -0.21 2.01 2.01 0.64 -4.90 115.64 118.28 2vll s THR 134 Ca 0.14 -0.53 -0.08 0.00 0.31 0.00 0.00 61.69 61.54 2vll s THR 134 Cb -0.10 -3.03 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 2vll s THR 134 CO 0.06 0.16 0.07 0.00 -0.69 0.00 0.00 174.62 174.22 2vll s ALA 135 N 1.54 3.31 0.06 7.40 0.00 -1.26 -1.12 121.76 131.68 2vll s ALA 135 Ca 0.04 -0.92 0.11 0.00 0.00 0.00 0.00 51.96 51.20 2vll s ALA 135 Cb -0.16 -2.01 0.04 0.00 0.00 0.00 0.00 23.12 20.99 2vll s ALA 135 CO 0.03 -0.12 1.42 0.00 0.00 0.00 0.00 175.76 177.09 2vll h ALA 136 N 7.39 0.60 -3.28 0.00 0.00 -1.39 -3.46 119.26 119.11 2vll h ALA 136 Ca -0.37 -0.66 -0.14 0.00 0.00 0.00 0.00 54.91 53.74 2vll h ALA 136 Cb 1.17 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 2vll h ALA 136 CO 0.64 0.91 -0.02 -0.40 0.00 0.00 0.00 179.25 180.38 2vll n ASP 137 N -3.39 -1.07 -0.13 0.00 5.68 -1.26 -5.04 116.55 111.35 2vll n ASP 137 Ca 0.00 -2.19 -0.04 0.00 -0.50 0.00 0.00 54.79 52.06 2vll n ASP 137 Cb 0.79 1.91 0.04 0.00 -1.14 0.00 0.00 41.12 42.72 2vll n ASP 137 CO 0.00 0.00 0.00 0.24 -1.33 0.00 0.00 177.20 176.11 2vll h MET 138 N 0.00 0.26 -0.33 0.11 2.86 -1.99 -1.81 114.93 114.03 2vll h MET 138 Ca -0.19 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.47 2vll h MET 138 Cb 0.79 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.35 2vll h MET 138 CO 0.25 0.17 0.10 0.00 1.06 0.00 0.00 176.91 178.50 2vll h ALA 139 N 1.30 0.38 -0.17 6.32 0.00 -1.97 -2.60 119.26 122.51 2vll h ALA 139 Ca 0.20 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 2vll h ALA 139 Cb 0.22 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2vll h ALA 139 CO -0.23 -0.30 -0.03 0.00 0.00 0.00 0.00 179.25 178.70 2vll h ALA 140 N 1.22 1.65 0.00 0.00 0.00 -1.77 -1.33 119.26 119.03 2vll h ALA 140 Ca 0.15 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2vll h ALA 140 Cb 0.14 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2vll h ALA 140 CO -0.17 0.27 -0.13 1.96 0.00 0.00 0.00 179.25 181.18 2vll h GLN 141 N 0.24 0.00 -0.21 0.00 4.20 -0.94 0.67 115.11 119.07 2vll h GLN 141 Ca 0.06 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 2vll h GLN 141 Cb 0.21 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 2vll h GLN 141 CO 0.01 0.13 0.06 1.15 -0.67 0.00 0.00 178.83 179.51 2vll h THR 142 N 0.00 1.19 -0.58 -0.54 2.02 -1.18 -1.08 112.91 112.74 2vll h THR 142 Ca -0.00 -0.60 -0.00 0.00 0.77 0.00 0.00 66.41 66.57 2vll h THR 142 Cb 0.24 1.19 -0.03 0.00 -1.74 0.00 0.00 68.15 67.82 2vll h THR 142 CO 0.02 0.19 0.35 0.74 0.37 0.00 0.00 175.52 177.19 2vll h THR 143 N 0.17 1.17 0.01 3.16 2.02 -1.37 -2.01 112.91 116.06 2vll h THR 143 Ca 0.07 -0.37 0.02 0.00 0.77 0.00 0.00 66.41 66.90 2vll h THR 143 Cb 0.23 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 2vll h THR 143 CO -0.00 0.17 -0.16 0.50 0.37 0.00 0.00 175.52 176.41 2vll h LYS 144 N 0.78 -0.25 -0.78 6.66 3.64 -0.73 0.24 116.57 126.12 2vll h LYS 144 Ca 0.21 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.64 2vll h LYS 144 Cb -0.02 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.81 2vll h LYS 144 CO -0.04 -0.17 0.49 0.45 -2.27 0.00 0.00 179.45 177.91 2vll h HIS 145 N -0.26 0.92 -0.39 1.91 3.86 -1.08 0.16 115.15 120.26 2vll h HIS 145 Ca 0.05 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.26 2vll h HIS 145 Cb 0.32 -0.30 -0.02 0.00 1.06 0.00 0.00 27.41 28.47 2vll h HIS 145 CO -0.20 0.52 0.16 -0.22 0.86 0.00 0.00 177.93 179.04 2vll h LYS 146 N 0.95 0.59 -0.02 2.45 3.64 -0.73 -0.97 116.57 122.47 2vll h LYS 146 Ca 0.32 -0.10 -0.12 0.00 -1.27 0.00 0.00 60.65 59.47 2vll h LYS 146 Cb 0.04 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 2vll h LYS 146 CO -0.12 0.55 -0.54 -1.49 -2.27 0.00 0.00 179.45 175.58 2vll h TRP 147 N 0.49 0.06 -0.31 1.91 6.55 -0.03 -1.43 115.95 123.19 2vll h TRP 147 Ca 0.13 -0.02 -0.03 0.00 0.95 0.00 0.00 58.89 59.92 2vll h TRP 147 Cb 0.18 -0.01 -0.01 0.00 -0.86 0.00 0.00 29.16 28.46 2vll h TRP 147 CO -0.00 0.58 0.06 0.93 -1.05 0.00 0.00 178.44 178.96 2vll h GLU 148 N 0.04 0.50 -0.07 0.49 5.08 -0.43 -1.22 114.58 118.96 2vll h GLU 148 Ca -0.00 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.17 2vll h GLU 148 Cb 0.97 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.15 2vll h GLU 148 CO 0.07 0.59 -0.25 0.00 -1.00 0.00 0.00 179.01 178.42 2vll h ALA 149 N 0.89 1.46 -0.09 3.43 0.00 -1.03 -2.56 119.26 121.36 2vll h ALA 149 Ca 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2vll h ALA 149 Cb 0.32 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2vll h ALA 149 CO 0.00 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.64 2vll n ALA 150 N -2.49 2.52 -3.72 0.00 0.00 -0.55 -4.97 120.51 111.30 2vll n ALA 150 Ca -0.02 -0.58 -0.24 0.00 0.00 0.00 0.00 53.44 52.61 2vll n ALA 150 Cb 0.33 -1.04 0.04 0.00 0.00 0.00 0.00 19.45 18.78 2vll n ALA 150 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2vll n HIS 151 N 0.61 -2.16 -0.16 0.00 -0.00 -0.56 -4.91 115.22 108.04 2vll n HIS 151 Ca 0.17 0.89 -0.10 0.00 -0.00 0.00 0.00 57.72 58.68 2vll n HIS 151 Cb 0.43 -4.42 -0.00 0.00 -0.00 0.00 0.00 29.99 26.00 2vll n HIS 151 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 2vll h VAL 152 N -2.03 1.27 -0.70 1.59 2.07 -1.58 -3.21 116.25 113.67 2vll h VAL 152 Ca -0.60 -1.16 0.06 0.00 0.82 0.00 0.00 66.70 65.82 2vll h VAL 152 Cb 1.36 1.05 -0.06 0.00 -1.52 0.00 0.00 31.29 32.13 2vll h VAL 152 CO 0.59 0.40 0.39 0.00 0.02 0.00 0.00 177.57 178.97 2vll h ALA 153 N 0.90 0.94 -0.76 1.67 0.00 -1.90 -0.29 119.26 119.82 2vll h ALA 153 Ca 0.13 0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.12 2vll h ALA 153 Cb 0.59 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.19 2vll h ALA 153 CO 0.04 0.07 0.45 0.93 0.00 0.00 0.00 179.25 180.74 2vll h GLU 154 N 0.72 0.79 -0.34 0.00 3.07 -1.79 0.47 114.58 117.50 2vll h GLU 154 Ca 0.31 -0.05 -0.12 0.00 -0.50 0.00 0.00 59.36 59.01 2vll h GLU 154 Cb 0.20 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 27.92 2vll h GLU 154 CO -0.19 0.52 -0.25 1.96 -1.40 0.00 0.00 179.01 179.66 2vll h GLN 155 N 0.82 0.77 -0.31 2.33 4.20 -1.36 -2.48 115.11 119.08 2vll h GLN 155 Ca 0.34 -0.37 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 2vll h GLN 155 Cb 0.19 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2vll h GLN 155 CO -0.18 0.99 0.15 -0.07 -0.67 0.00 0.00 178.83 179.05 2vll h LEU 156 N 0.55 0.40 -0.69 1.46 3.38 -0.77 -2.92 115.31 116.72 2vll h LEU 156 Ca 0.07 -0.12 0.13 0.00 0.09 0.00 0.00 57.88 58.05 2vll h LEU 156 Cb 0.81 -0.10 -0.09 0.00 0.09 0.00 0.00 40.66 41.36 2vll h LEU 156 CO 0.07 0.41 0.21 -0.09 0.09 0.00 0.00 178.44 179.12 2vll h ARG 157 N 0.36 0.33 -0.63 1.13 2.43 0.04 0.24 114.38 118.29 2vll h ARG 157 Ca 0.11 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 2vll h ARG 157 Cb 0.11 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 2vll h ARG 157 CO -0.01 0.22 0.28 0.00 -1.51 0.00 0.00 179.97 178.94 2vll h ALA 158 N 1.53 1.31 -0.01 2.80 0.00 -1.31 -0.29 119.26 123.30 2vll h ALA 158 Ca 0.37 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 2vll h ALA 158 Cb 0.58 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2vll h ALA 158 CO -0.42 0.52 -0.01 -0.92 0.00 0.00 0.00 179.25 178.42 2vll h TYR 159 N 0.89 0.03 -0.43 0.00 3.20 -1.15 -2.46 116.97 117.04 2vll h TYR 159 Ca 0.22 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.00 2vll h TYR 159 Cb 0.13 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 2vll h TYR 159 CO 0.01 0.54 -0.03 -0.07 -1.64 0.00 0.00 178.16 176.97 2vll h LEU 160 N -0.50 0.69 0.00 2.82 3.38 -0.09 0.27 115.31 121.87 2vll h LEU 160 Ca 0.00 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2vll h LEU 160 Cb 0.54 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2vll h LEU 160 CO 0.00 0.78 -0.51 -0.62 0.09 0.00 0.00 178.44 178.18 2vll n GLU 161 N -4.21 0.24 0.00 1.13 1.02 -0.16 -4.15 120.64 114.51 2vll n GLU 161 Ca 0.02 0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 2vll n GLU 161 Cb 0.30 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 2vll n GLU 161 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2vll n GLY 162 N 1.36 0.60 0.34 0.62 0.00 -0.93 -4.76 105.19 102.43 2vll n GLY 162 Ca 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2vll n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vll h THR 163 N 0.00 1.20 -0.10 2.61 1.03 -1.40 -1.59 112.91 114.65 2vll h THR 163 Ca 0.00 -0.42 0.04 0.00 -0.01 0.00 0.00 66.41 66.02 2vll h THR 163 Cb 0.00 0.18 -0.04 0.00 -1.07 0.00 0.00 68.15 67.21 2vll h THR 163 CO 0.00 0.20 -0.16 0.00 -0.01 0.00 0.00 175.52 175.55 2vll h VAL 165 N -0.21 1.32 -0.62 0.00 -1.51 -1.57 -1.58 116.25 112.08 2vll h VAL 165 Ca 0.09 -1.61 -0.01 0.00 -1.23 0.00 0.00 66.70 63.94 2vll h VAL 165 Cb 0.33 1.71 -0.03 0.00 -2.13 0.00 0.00 31.29 31.18 2vll h VAL 165 CO -0.23 0.49 0.36 -0.33 -1.23 0.00 0.00 177.57 176.63 2vll h GLU 166 N 0.25 0.84 -0.52 5.19 5.08 -0.73 -0.61 114.58 124.08 2vll h GLU 166 Ca 0.02 -0.08 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2vll h GLU 166 Cb 0.89 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.94 2vll h GLU 166 CO 0.07 0.61 0.32 -1.49 -1.00 0.00 0.00 179.01 177.53 2vll h TRP 167 N 0.83 0.68 -0.36 4.33 -0.00 -0.76 -1.47 115.95 119.21 2vll h TRP 167 Ca 0.22 0.00 -0.00 0.00 -0.00 0.00 0.00 58.89 59.11 2vll h TRP 167 Cb -0.00 -0.23 -0.02 0.00 -0.00 0.00 0.00 29.16 28.91 2vll h TRP 167 CO -0.02 0.46 0.22 1.25 -0.00 0.00 0.00 178.44 180.36 2vll h LEU 168 N 0.70 0.42 -0.80 -4.49 5.85 -0.98 0.66 115.31 116.67 2vll h LEU 168 Ca 0.19 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.79 2vll h LEU 168 Cb -0.03 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 2vll h LEU 168 CO -0.04 0.34 0.01 0.03 -0.34 0.00 0.00 178.44 178.44 2vll h ARG 169 N 0.47 0.92 -0.04 1.25 3.08 -0.94 -0.02 114.38 119.09 2vll h ARG 169 Ca 0.13 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.92 2vll h ARG 169 Cb -0.01 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 29.94 2vll h ARG 169 CO -0.03 0.90 0.02 -0.09 -1.07 0.00 0.00 179.97 179.71 2vll h ARG 170 N 0.85 0.05 -0.80 0.04 2.43 -0.65 -2.00 114.38 114.29 2vll h ARG 170 Ca 0.16 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.29 2vll h ARG 170 Cb 0.49 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.99 2vll h ARG 170 CO 0.02 0.03 0.34 1.88 -1.51 0.00 0.00 179.97 180.74 2vll h TYR 171 N 0.05 1.19 -0.99 2.20 0.05 -0.57 0.14 116.97 119.04 2vll h TYR 171 Ca 0.02 -0.08 0.01 0.00 0.05 0.00 0.00 58.73 58.73 2vll h TYR 171 Cb 0.00 -0.36 -0.05 0.00 1.01 0.00 0.00 36.73 37.33 2vll h TYR 171 CO -0.08 0.89 0.66 -0.07 -1.05 0.00 0.00 178.16 178.50 2vll h LEU 172 N 1.15 1.13 -0.03 3.88 3.38 -0.84 0.28 115.31 124.26 2vll h LEU 172 Ca 0.27 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 58.06 2vll h LEU 172 Cb 0.18 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 40.66 2vll h LEU 172 CO -0.03 0.82 -0.57 1.05 0.09 0.00 0.00 178.44 179.80 2vll h GLU 173 N 1.34 0.43 -0.54 1.13 4.11 -0.87 -2.08 114.58 118.10 2vll h GLU 173 Ca 0.37 -0.43 -0.12 0.00 0.07 0.00 0.00 59.36 59.25 2vll h GLU 173 Cb -0.14 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2vll h GLU 173 CO -0.08 1.09 -0.12 -0.91 0.07 0.00 0.00 179.01 179.06 2vll h ASN 174 N -0.05 1.02 -0.88 3.06 -0.26 -0.75 -2.89 115.58 114.83 2vll h ASN 174 Ca -0.06 -0.34 -0.41 0.00 -0.56 0.00 0.00 56.30 54.92 2vll h ASN 174 Cb 1.27 -0.28 -0.25 0.00 -1.06 0.00 0.00 38.32 38.00 2vll h ASN 174 CO 0.11 1.14 0.50 0.61 -1.06 0.00 0.00 177.43 178.73 2vll n GLY 175 N -0.26 4.31 0.31 2.83 0.00 0.96 -4.71 105.19 108.62 2vll n GLY 175 Ca 0.01 -1.08 0.13 0.00 0.00 0.00 0.00 46.02 45.08 2vll n GLY 175 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2vll h LYS 176 N 1.44 0.30 -1.01 1.61 3.64 -1.15 0.39 116.57 121.79 2vll h LYS 176 Ca 0.51 -0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.95 2vll h LYS 176 Cb 2.64 -0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 34.32 2vll h LYS 176 CO 0.96 0.20 0.65 1.49 -2.27 0.00 0.00 179.45 180.48 2vll h GLU 177 N 0.31 1.10 0.08 1.90 4.81 -1.87 -1.69 114.58 119.23 2vll h GLU 177 Ca 0.55 -0.07 -0.33 0.00 -0.13 0.00 0.00 59.36 59.38 2vll h GLU 177 Cb 1.06 -0.25 -0.03 0.00 0.63 0.00 0.00 28.75 30.16 2vll h GLU 177 CO -0.57 0.73 -1.82 1.15 -0.73 0.00 0.00 179.01 177.77 2vll h THR 178 N 1.14 0.79 0.00 0.32 2.02 -1.05 -3.41 112.91 112.71 2vll h THR 178 Ca 0.45 -2.54 -0.37 0.00 0.77 0.00 0.00 66.41 64.72 2vll h THR 178 Cb 0.25 2.52 -0.07 0.00 -1.74 0.00 0.00 68.15 69.11 2vll h THR 178 CO -0.20 0.75 -2.38 0.18 0.37 0.00 0.00 175.52 174.24 2vll n LEU 179 N -3.33 0.61 -1.31 2.58 4.77 0.11 -4.31 117.00 116.12 2vll n LEU 179 Ca -0.24 -0.03 0.07 0.00 -0.03 0.00 0.00 56.01 55.78 2vll n LEU 179 Cb 1.05 0.21 0.28 0.00 -2.33 0.00 0.00 43.42 42.62 2vll n LEU 179 CO 0.45 0.58 0.72 0.00 -1.33 0.00 0.00 177.39 177.81 2vll n GLN 180 N -2.84 3.16 -3.74 3.23 6.02 -0.64 -4.92 117.38 117.65 2vll n GLN 180 Ca -0.35 -2.21 -0.24 0.00 -0.01 0.00 0.00 57.00 54.19 2vll n GLN 180 Cb 1.11 -1.77 -0.02 0.00 1.02 0.00 0.00 30.24 30.58 2vll n GLN 180 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 2vll s ARG 181 N -1.81 3.47 0.05 -1.09 1.70 -1.26 -5.04 118.95 114.97 2vll s ARG 181 Ca 0.39 -0.52 0.09 0.00 -0.47 0.00 0.00 55.73 55.22 2vll s ARG 181 Cb 0.26 -2.83 -0.03 0.00 -0.57 0.00 0.00 34.95 31.78 2vll s ARG 181 CO 0.18 0.36 -0.25 0.95 -1.08 0.00 0.00 175.30 175.47 2vll s THR 182 N -2.01 2.03 -0.27 4.99 -4.23 -1.26 -4.66 115.64 110.24 2vll s THR 182 Ca 0.37 -1.39 -0.04 0.00 -1.18 0.00 0.00 61.69 59.45 2vll s THR 182 Cb -0.10 -1.75 0.02 0.00 1.34 0.00 0.00 72.50 72.01 2vll s THR 182 CO 0.31 0.29 -0.01 -1.81 -0.54 0.00 0.00 174.62 172.86 2vll s ASP 183 N -1.32 4.63 0.35 3.99 1.01 0.44 -4.92 116.67 120.85 2vll s ASP 183 Ca 0.11 -0.79 -0.28 0.00 0.71 0.00 0.00 52.55 52.29 2vll s ASP 183 Cb -0.10 -1.75 -0.10 0.00 1.01 0.00 0.00 42.92 41.99 2vll s ASP 183 CO 0.02 -0.15 1.27 0.00 0.21 0.00 0.00 175.17 176.53 2vll s ALA 184 N 1.40 3.41 0.29 5.23 0.00 -1.26 -0.89 121.76 129.93 2vll s ALA 184 Ca 0.01 1.19 -0.30 0.00 0.00 0.00 0.00 51.96 52.87 2vll s ALA 184 Cb -0.17 -3.46 -0.11 0.00 0.00 0.00 0.00 23.12 19.39 2vll s ALA 184 CO -0.02 -0.62 1.56 -1.25 0.00 0.00 0.00 175.76 175.44 2vll s PRO 185 N -1.89 4.15 -0.13 0.00 0.04 -1.26 -4.53 135.00 131.38 2vll s PRO 185 Ca 0.51 2.53 -0.26 0.00 0.04 0.00 0.00 61.00 63.81 2vll s PRO 185 Cb -0.38 -3.04 -0.02 0.00 0.04 0.00 0.00 34.50 31.10 2vll s PRO 185 CO 0.50 -0.59 0.84 0.15 0.04 0.00 0.00 177.00 177.93 2vll s LYS 186 N -0.51 4.36 0.11 4.56 1.02 0.48 -4.82 119.74 124.94 2vll s LYS 186 Ca 0.62 1.06 0.09 0.00 0.02 0.00 0.00 55.97 57.77 2vll s LYS 186 Cb -0.47 -3.54 -0.04 0.00 -0.52 0.00 0.00 37.83 33.26 2vll s LYS 186 CO 0.47 -0.24 -0.20 0.95 -0.92 0.00 0.00 175.35 175.42 2vll s THR 187 N 1.81 2.73 0.13 2.17 -4.23 -1.26 -0.41 115.64 116.58 2vll s THR 187 Ca 0.40 -1.52 -0.25 0.00 -1.18 0.00 0.00 61.69 59.15 2vll s THR 187 Cb -0.17 -2.24 0.07 0.00 1.34 0.00 0.00 72.50 71.50 2vll s THR 187 CO 0.15 0.12 0.77 -1.38 -0.54 0.00 0.00 174.62 173.74 2vll s HIS 188 N -1.11 -0.35 0.07 3.99 -3.43 -0.98 -4.99 115.29 108.49 2vll s HIS 188 Ca 0.17 0.10 0.08 0.00 -0.80 0.00 0.00 55.06 54.61 2vll s HIS 188 Cb -0.10 0.59 -0.04 0.00 -1.43 0.00 0.00 32.58 31.60 2vll s HIS 188 CO 0.09 -0.83 -0.18 1.41 -2.00 0.00 0.00 174.74 173.24 2vll s MET 189 N -3.52 1.97 0.20 -0.38 1.75 -1.26 -0.55 119.30 117.52 2vll s MET 189 Ca 0.06 -1.05 0.11 0.00 -1.25 0.00 0.00 55.69 53.55 2vll s MET 189 Cb -0.02 -2.17 -0.04 0.00 2.84 0.00 0.00 34.83 35.44 2vll s MET 189 CO -0.06 0.52 -0.22 0.95 -0.65 0.00 0.00 175.02 175.57 2vll s THR 190 N -1.01 2.22 -0.04 10.11 -4.23 -0.16 -4.96 115.64 117.57 2vll s THR 190 Ca 0.16 -2.08 0.01 0.00 -1.18 0.00 0.00 61.69 58.60 2vll s THR 190 Cb -0.11 -2.08 0.02 0.00 1.34 0.00 0.00 72.50 71.67 2vll s THR 190 CO 0.07 -0.23 -0.05 -2.28 -0.54 0.00 0.00 174.62 171.59 2vll s HIS 191 N -1.96 0.75 -0.13 3.99 2.46 -1.26 -1.31 115.29 117.84 2vll s HIS 191 Ca 0.21 -0.20 -0.04 0.00 0.47 0.00 0.00 55.06 55.49 2vll s HIS 191 Cb -0.07 -0.65 0.06 0.00 -0.13 0.00 0.00 32.58 31.80 2vll s HIS 191 CO 0.10 -0.18 0.24 -1.01 -2.47 0.00 0.00 174.74 171.42 2vll s HIS 192 N 0.83 -0.36 0.17 3.88 4.02 -0.80 -4.98 115.29 118.04 2vll s HIS 192 Ca -0.11 0.82 -0.32 0.00 1.02 0.00 0.00 55.06 56.47 2vll s HIS 192 Cb -0.14 -0.12 -0.10 0.00 -1.02 0.00 0.00 32.58 31.20 2vll s HIS 192 CO 0.00 -0.37 1.62 0.00 1.02 0.00 0.00 174.74 177.02 2vll s ALA 193 N 2.39 3.81 -0.07 -1.40 0.00 -1.26 -0.19 121.76 125.04 2vll s ALA 193 Ca 0.02 1.42 0.21 0.00 0.00 0.00 0.00 51.96 53.62 2vll s ALA 193 Cb -0.12 -3.65 -0.31 0.00 0.00 0.00 0.00 23.12 19.03 2vll s ALA 193 CO -0.08 -0.85 0.41 0.28 0.00 0.00 0.00 175.76 175.51 2vll n VAL 194 N 4.05 0.31 -2.72 0.00 0.31 -0.15 -4.89 118.33 115.24 2vll n VAL 194 Ca 0.15 -0.58 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 2vll n VAL 194 Cb 0.38 -0.11 0.00 0.00 -0.91 0.00 0.00 33.84 33.20 2vll n VAL 194 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2vll n SER 195 N -2.38 0.00 0.20 4.52 3.41 -1.12 -4.97 113.62 113.28 2vll n SER 195 Ca -0.10 -0.59 0.13 0.00 -0.26 0.00 0.00 58.87 58.06 2vll n SER 195 Cb 0.70 0.00 0.33 0.00 -0.26 0.00 0.00 64.21 64.98 2vll n SER 195 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2vll h ASP 196 N 0.00 0.00 0.00 4.04 3.04 -2.03 -3.31 116.42 118.15 2vll h ASP 196 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 2vll h ASP 196 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 2vll h ASP 196 CO 0.00 0.00 -0.04 0.00 -2.04 0.00 0.00 179.24 177.16 2vll n HIS 197 N -2.87 0.00 -3.88 4.15 1.44 -1.26 -4.87 115.22 107.92 2vll n HIS 197 Ca 0.04 -0.67 -0.11 0.00 -2.01 0.00 0.00 57.72 54.97 2vll n HIS 197 Cb 0.45 -0.09 -0.10 0.00 0.12 0.00 0.00 29.99 30.37 2vll n HIS 197 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 2vll s GLU 198 N -1.75 0.46 -0.01 -1.40 2.02 -1.25 -1.81 118.70 114.97 2vll s GLU 198 Ca 0.15 -0.41 -0.05 0.00 0.02 0.00 0.00 54.97 54.68 2vll s GLU 198 Cb 0.13 0.19 0.00 0.00 0.10 0.00 0.00 34.13 34.55 2vll s GLU 198 CO 0.01 -0.11 0.10 0.00 0.02 0.00 0.00 175.26 175.29 2vll s ALA 199 N -1.37 -0.23 -0.18 5.21 0.00 0.50 -0.98 121.76 124.70 2vll s ALA 199 Ca -0.15 -0.02 -0.17 0.00 0.00 0.00 0.00 51.96 51.62 2vll s ALA 199 Cb -0.08 -0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 2vll s ALA 199 CO 0.01 -0.13 0.45 0.99 0.00 0.00 0.00 175.76 177.08 2vll s THR 200 N -0.79 5.17 -0.23 0.00 2.01 0.74 0.12 115.64 122.66 2vll s THR 200 Ca -0.09 0.83 -0.11 0.00 0.31 0.00 0.00 61.69 62.63 2vll s THR 200 Cb -0.05 -3.78 -0.05 0.00 0.01 0.00 0.00 72.50 68.63 2vll s THR 200 CO 0.01 0.25 0.17 -0.76 -0.69 0.00 0.00 174.62 173.59 2vll s LEU 201 N 1.26 4.14 -0.15 4.42 1.43 -0.00 -1.91 118.68 127.87 2vll s LEU 201 Ca 0.22 0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.50 2vll s LEU 201 Cb -0.15 -2.13 0.01 0.00 0.03 0.00 0.00 46.19 43.95 2vll s LEU 201 CO 0.09 0.09 -0.20 -0.60 0.23 0.00 0.00 176.35 175.96 2vll s ARG 202 N 0.89 3.07 -0.25 1.70 3.52 -0.42 -1.35 118.95 126.10 2vll s ARG 202 Ca 0.08 -0.82 -0.13 0.00 -0.13 0.00 0.00 55.73 54.74 2vll s ARG 202 Cb -0.13 -2.51 -0.05 0.00 -1.56 0.00 0.00 34.95 30.70 2vll s ARG 202 CO 0.03 -0.05 0.26 0.00 -0.81 0.00 0.00 175.30 174.73 2vll s TRP 204 N 1.47 2.91 -0.17 0.00 0.52 0.28 -1.25 118.94 122.70 2vll s TRP 204 Ca 0.11 -0.20 0.01 0.00 0.02 0.00 0.00 56.10 56.05 2vll s TRP 204 Cb -0.15 -1.79 0.02 0.00 -1.15 0.00 0.00 33.47 30.40 2vll s TRP 204 CO 0.08 0.12 -0.20 0.00 0.02 0.00 0.00 176.95 176.97 2vll s ALA 205 N -0.30 2.29 0.12 0.98 0.00 -0.14 -2.32 121.76 122.40 2vll s ALA 205 Ca 0.04 -1.17 0.06 0.00 0.00 0.00 0.00 51.96 50.89 2vll s ALA 205 Cb -0.13 -1.12 -0.04 0.00 0.00 0.00 0.00 23.12 21.83 2vll s ALA 205 CO 0.02 -0.27 -0.15 -0.51 0.00 0.00 0.00 175.76 174.86 2vll s LEU 206 N 1.17 2.39 -1.45 0.00 1.43 0.46 -1.40 118.68 121.27 2vll s LEU 206 Ca 0.02 -0.79 -0.11 0.00 -1.03 0.00 0.00 54.13 52.22 2vll s LEU 206 Cb -0.14 -0.61 0.05 0.00 0.03 0.00 0.00 46.19 45.53 2vll s LEU 206 CO -0.10 -0.11 1.06 -0.24 0.23 0.00 0.00 176.35 177.20 2vll n SER 207 N 0.62 -5.35 -4.84 2.29 2.88 -0.82 -0.39 113.62 108.01 2vll n SER 207 Ca -0.16 -0.68 -0.25 0.00 -1.33 0.00 0.00 58.87 56.45 2vll n SER 207 Cb 0.56 -4.38 -0.04 0.00 -0.75 0.00 0.00 64.21 59.59 2vll n SER 207 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 2vll s PHE 208 N -3.32 3.22 -0.22 0.66 -0.71 -0.95 -4.54 117.98 112.13 2vll s PHE 208 Ca 0.61 -0.02 -0.16 0.00 -1.04 0.00 0.00 56.93 56.32 2vll s PHE 208 Cb -0.29 -1.52 0.06 0.00 -1.21 0.00 0.00 43.02 40.06 2vll s PHE 208 CO 0.79 0.51 0.56 -0.47 -1.34 0.00 0.00 175.22 175.27 2vll s TYR 209 N -1.86 -0.73 1.14 3.49 5.04 -0.07 -0.48 117.35 123.89 2vll s TYR 209 Ca 0.32 1.62 -0.19 0.00 -2.44 0.00 0.00 57.07 56.38 2vll s TYR 209 Cb -0.10 0.33 0.28 0.00 0.35 0.00 0.00 41.96 42.83 2vll s TYR 209 CO 0.25 -0.37 1.08 -0.35 -1.34 0.00 0.00 175.55 174.82 2vll n PRO 210 N 3.50 -2.82 0.19 4.97 -0.04 -1.26 -0.42 135.00 139.13 2vll n PRO 210 Ca -0.17 -1.71 0.03 0.00 -0.04 0.00 0.00 63.50 61.60 2vll n PRO 210 Cb 0.57 -1.53 0.37 0.00 -0.04 0.00 0.00 33.50 32.86 2vll n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2vll h ALA 211 N -2.59 1.35 -2.36 0.55 0.00 -1.95 -3.45 119.26 110.82 2vll h ALA 211 Ca -0.40 -0.33 -0.54 0.00 0.00 0.00 0.00 54.91 53.64 2vll h ALA 211 Cb 1.19 -0.06 0.03 0.00 0.00 0.00 0.00 17.79 18.95 2vll h ALA 211 CO 0.26 0.46 1.19 -1.91 0.00 0.00 0.00 179.25 179.25 2vll n GLU 212 N -4.04 2.78 -3.65 0.00 4.07 -1.26 -4.97 120.64 113.58 2vll n GLU 212 Ca -0.02 1.02 -0.13 0.00 -0.06 0.00 0.00 57.16 57.97 2vll n GLU 212 Cb 0.41 -2.95 -0.06 0.00 -0.06 0.00 0.00 31.44 28.78 2vll n GLU 212 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 2vll s ILE 213 N 3.94 0.05 -0.14 6.31 2.07 -1.26 -4.61 121.20 127.55 2vll s ILE 213 Ca 0.87 -0.40 0.00 0.00 -1.41 0.00 0.00 60.65 59.72 2vll s ILE 213 Cb -0.47 -0.93 0.03 0.00 0.13 0.00 0.00 42.46 41.21 2vll s ILE 213 CO 0.42 -0.22 -0.11 -0.89 -1.91 0.00 0.00 174.94 172.23 2vll s THR 214 N -2.33 1.34 -0.19 4.00 2.01 -0.57 -5.00 115.64 114.90 2vll s THR 214 Ca -0.06 -0.55 -0.03 0.00 0.31 0.00 0.00 61.69 61.36 2vll s THR 214 Cb -0.01 -1.33 -0.02 0.00 0.01 0.00 0.00 72.50 71.15 2vll s THR 214 CO -0.01 0.36 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.48 2vll s LEU 215 N 1.57 3.02 0.03 4.42 1.02 -1.26 -1.02 118.68 126.46 2vll s LEU 215 Ca 0.04 -0.28 0.02 0.00 0.02 0.00 0.00 54.13 53.93 2vll s LEU 215 Cb -0.13 -1.75 -0.02 0.00 0.02 0.00 0.00 46.19 44.31 2vll s LEU 215 CO -0.09 0.07 -0.07 0.42 0.02 0.00 0.00 176.35 176.70 2vll s THR 216 N 0.95 0.47 -0.02 5.49 -4.23 -0.44 -4.98 115.64 112.88 2vll s THR 216 Ca -0.00 -0.77 0.00 0.00 -1.18 0.00 0.00 61.69 59.74 2vll s THR 216 Cb -0.15 -0.50 -0.04 0.00 1.34 0.00 0.00 72.50 73.16 2vll s THR 216 CO 0.01 -0.22 0.01 0.26 -0.54 0.00 0.00 174.62 174.14 2vll s TRP 217 N -0.95 3.13 0.05 3.99 0.52 -1.26 -0.22 118.94 124.20 2vll s TRP 217 Ca -0.06 0.13 0.08 0.00 0.02 0.00 0.00 56.10 56.27 2vll s TRP 217 Cb -0.07 -1.71 -0.03 0.00 -1.15 0.00 0.00 33.47 30.51 2vll s TRP 217 CO 0.00 0.48 -0.21 -0.65 0.02 0.00 0.00 176.95 176.59 2vll s GLN 218 N -1.43 1.39 -0.20 4.98 -0.21 0.59 -0.79 119.66 123.99 2vll s GLN 218 Ca 0.19 -1.00 -0.02 0.00 0.02 0.00 0.00 55.36 54.54 2vll s GLN 218 Cb -0.12 -1.54 0.00 0.00 1.00 0.00 0.00 33.01 32.35 2vll s GLN 218 CO 0.09 0.39 -0.10 0.50 -2.12 0.00 0.00 175.29 174.05 2vll s ARG 219 N -1.31 3.25 -1.46 2.91 3.52 0.15 -0.88 118.95 125.12 2vll s ARG 219 Ca 0.08 -0.70 -0.05 0.00 -0.13 0.00 0.00 55.73 54.93 2vll s ARG 219 Cb -0.09 -2.84 0.04 0.00 -1.56 0.00 0.00 34.95 30.50 2vll s ARG 219 CO 0.02 -0.18 0.60 -0.25 -0.81 0.00 0.00 175.30 174.68 2vll n ASP 220 N 4.67 -1.53 0.00 -2.12 8.00 -0.56 -1.03 116.55 123.97 2vll n ASP 220 Ca -0.19 -0.95 0.00 0.00 0.71 0.00 0.00 54.79 54.36 2vll n ASP 220 Cb 0.51 -3.25 0.00 0.00 -0.02 0.00 0.00 41.12 38.36 2vll n ASP 220 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2vll n GLY 221 N -1.78 0.41 3.56 0.44 0.00 -1.26 -4.99 105.19 101.57 2vll n GLY 221 Ca -0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 2vll n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vll s GLU 222 N -0.68 3.89 0.17 1.61 2.02 -0.20 -4.99 118.70 120.52 2vll s GLU 222 Ca 0.00 -0.36 -0.33 0.00 0.02 0.00 0.00 54.97 54.30 2vll s GLU 222 Cb 0.00 -3.55 -0.14 0.00 0.10 0.00 0.00 34.13 30.53 2vll s GLU 222 CO 0.00 -0.15 1.49 -0.25 0.02 0.00 0.00 175.26 176.37 2vll n ASP 223 N 4.92 2.75 -2.71 -0.19 9.92 -1.26 -0.67 116.55 129.31 2vll n ASP 223 Ca -0.15 1.11 -0.37 0.00 -0.53 0.00 0.00 54.79 54.85 2vll n ASP 223 Cb 0.52 -1.39 0.04 0.00 -0.64 0.00 0.00 41.12 39.65 2vll n ASP 223 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2vll n GLN 224 N 2.86 2.85 -0.10 -1.24 1.13 0.03 -4.83 117.38 118.07 2vll n GLN 224 Ca 0.16 -3.61 -0.11 0.00 -1.94 0.00 0.00 57.00 51.50 2vll n GLN 224 Cb 0.28 -2.27 -0.06 0.00 0.11 0.00 0.00 30.24 28.30 2vll n GLN 224 CO 0.00 0.00 0.00 1.15 -1.44 0.00 0.00 177.06 176.77 2vll h THR 225 N 1.86 0.09 0.00 5.09 2.02 -1.91 -1.41 112.91 118.66 2vll h THR 225 Ca 0.54 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.72 2vll h THR 225 Cb 0.36 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 2vll h THR 225 CO 1.38 0.00 0.00 0.00 0.37 0.00 0.00 175.52 177.27 2vll n GLN 226 N -5.41 0.03 -0.04 6.66 6.02 -1.26 -2.80 117.38 120.58 2vll n GLN 226 Ca -0.02 0.32 0.02 0.00 -0.01 0.00 0.00 57.00 57.32 2vll n GLN 226 Cb 0.35 -1.57 0.04 0.00 1.02 0.00 0.00 30.24 30.09 2vll n GLN 226 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2vll n ASP 227 N -1.62 1.91 -4.72 1.08 9.92 -0.58 -4.99 116.55 117.55 2vll n ASP 227 Ca 0.03 -1.65 -0.36 0.00 -0.53 0.00 0.00 54.79 52.27 2vll n ASP 227 Cb 0.15 -0.05 -0.08 0.00 -0.64 0.00 0.00 41.12 40.50 2vll n ASP 227 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2vll s THR 228 N -0.72 5.37 -0.22 -3.53 2.01 -0.88 -4.53 115.64 113.13 2vll s THR 228 Ca 0.07 0.32 -0.23 0.00 0.31 0.00 0.00 61.69 62.15 2vll s THR 228 Cb 0.04 -3.53 -0.01 0.00 0.01 0.00 0.00 72.50 69.00 2vll s THR 228 CO 0.05 0.41 0.76 -0.70 -0.69 0.00 0.00 174.62 174.45 2vll s GLU 229 N 0.49 4.20 -0.12 4.92 2.12 -0.12 -4.93 118.70 125.26 2vll s GLU 229 Ca 0.11 0.83 0.03 0.00 0.36 0.00 0.00 54.97 56.30 2vll s GLU 229 Cb -0.12 -3.62 0.01 0.00 0.26 0.00 0.00 34.13 30.66 2vll s GLU 229 CO 0.01 -0.41 -0.21 -1.17 -0.54 0.00 0.00 175.26 172.94 2vll s LEU 230 N 2.47 2.01 0.32 2.70 2.96 -1.26 -0.45 118.68 127.43 2vll s LEU 230 Ca 0.33 -0.55 -0.04 0.00 -0.22 0.00 0.00 54.13 53.65 2vll s LEU 230 Cb -0.16 -1.35 -0.05 0.00 0.50 0.00 0.00 46.19 45.14 2vll s LEU 230 CO 0.09 0.08 0.57 0.68 -1.32 0.00 0.00 176.35 176.45 2vll s VAL 231 N 0.77 5.03 0.33 1.68 -7.23 -1.05 -5.04 120.40 114.89 2vll s VAL 231 Ca -0.09 -0.06 -0.29 0.00 -1.81 0.00 0.00 61.98 59.73 2vll s VAL 231 Cb -0.16 -3.78 -0.11 0.00 0.56 0.00 0.00 36.38 32.89 2vll s VAL 231 CO 0.00 -0.43 1.55 -0.70 -0.31 0.00 0.00 175.10 175.21 2vll s GLU 232 N -3.85 4.11 0.23 4.82 2.12 -1.26 -4.63 118.70 120.23 2vll s GLU 232 Ca 0.43 2.58 -0.32 0.00 0.36 0.00 0.00 54.97 58.03 2vll s GLU 232 Cb -0.10 -3.00 -0.13 0.00 0.26 0.00 0.00 34.13 31.16 2vll s GLU 232 CO 0.33 -0.60 1.56 2.41 -0.54 0.00 0.00 175.26 178.42 2vll n THR 233 N 1.44 0.53 -4.26 -1.70 -1.04 -1.26 -4.86 114.28 103.13 2vll n THR 233 Ca 0.05 -0.13 -0.18 0.00 -2.04 0.00 0.00 64.05 61.75 2vll n THR 233 Cb 0.38 -1.70 -0.13 0.00 -1.82 0.00 0.00 70.33 67.05 2vll n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2vll s ARG 234 N 0.22 0.75 0.27 -2.82 1.70 -0.35 -4.95 118.95 113.78 2vll s ARG 234 Ca 0.71 -0.64 -0.29 0.00 -0.47 0.00 0.00 55.73 55.04 2vll s ARG 234 Cb -0.59 -0.70 -0.09 0.00 -0.57 0.00 0.00 34.95 32.99 2vll s ARG 234 CO 0.43 0.17 1.07 -1.25 -1.08 0.00 0.00 175.30 174.64 2vll s PRO 235 N -1.01 4.67 0.34 3.89 0.04 -1.26 -0.71 135.00 140.96 2vll s PRO 235 Ca -0.01 1.76 0.18 0.00 0.04 0.00 0.00 61.00 62.97 2vll s PRO 235 Cb -0.07 -3.20 0.35 0.00 0.04 0.00 0.00 34.50 31.62 2vll s PRO 235 CO 0.01 0.26 1.58 0.00 0.04 0.00 0.00 177.00 178.88 2vll h ALA 236 N 3.85 0.82 0.00 8.56 0.00 -1.15 -3.47 119.26 127.87 2vll h ALA 236 Ca -0.46 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.11 2vll h ALA 236 Cb 1.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2vll h ALA 236 CO 0.67 0.47 0.00 0.41 0.00 0.00 0.00 179.25 180.80 2vll n GLY 237 N 0.87 0.35 0.66 0.00 0.00 -1.26 -4.92 105.19 100.89 2vll n GLY 237 Ca 0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.10 2vll n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2vll n ASP 238 N 0.00 3.21 0.00 1.61 5.75 -1.26 -4.96 116.55 120.90 2vll n ASP 238 Ca 0.00 -2.47 0.00 0.00 -0.01 0.00 0.00 54.79 52.31 2vll n ASP 238 Cb 0.00 -0.35 0.00 0.00 -1.03 0.00 0.00 41.12 39.74 2vll n ASP 238 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2vll n GLY 239 N -0.08 0.70 3.80 6.12 0.00 -1.26 -5.06 105.19 109.40 2vll n GLY 239 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 2vll n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2vll s THR 240 N -2.55 1.94 0.27 2.61 -4.23 -1.26 -4.85 115.64 107.57 2vll s THR 240 Ca 0.00 -1.67 0.06 0.00 -1.18 0.00 0.00 61.69 58.90 2vll s THR 240 Cb 0.00 -2.61 -0.06 0.00 1.34 0.00 0.00 72.50 71.17 2vll s THR 240 CO 0.00 0.00 -0.06 -0.36 -0.54 0.00 0.00 174.62 173.66 2vll s PHE 241 N -2.69 1.90 0.04 3.99 0.40 0.36 -0.57 117.98 121.41 2vll s PHE 241 Ca 0.33 -0.70 0.01 0.00 -0.60 0.00 0.00 56.93 55.97 2vll s PHE 241 Cb 0.01 -1.06 -0.03 0.00 0.51 0.00 0.00 43.02 42.45 2vll s PHE 241 CO 0.19 0.26 -0.05 -0.65 0.70 0.00 0.00 175.22 175.67 2vll s GLN 242 N -3.73 0.51 0.05 0.44 -0.21 0.11 -1.95 119.66 114.88 2vll s GLN 242 Ca 0.29 -0.86 -0.25 0.00 0.02 0.00 0.00 55.36 54.56 2vll s GLN 242 Cb 0.03 -0.09 0.06 0.00 1.00 0.00 0.00 33.01 34.02 2vll s GLN 242 CO 0.11 -0.01 0.60 0.21 -2.12 0.00 0.00 175.29 174.08 2vll s LYS 243 N -2.17 1.12 0.05 2.91 2.20 -0.49 -1.21 119.74 122.15 2vll s LYS 243 Ca -0.07 -0.14 -0.01 0.00 -0.36 0.00 0.00 55.97 55.40 2vll s LYS 243 Cb -0.05 0.52 -0.04 0.00 -1.51 0.00 0.00 37.83 36.74 2vll s LYS 243 CO -0.02 -0.41 -0.03 1.67 -0.36 0.00 0.00 175.35 176.19 2vll s TRP 244 N -2.41 0.56 -0.02 4.03 1.48 -1.26 -0.96 118.94 120.35 2vll s TRP 244 Ca -0.05 -1.05 0.00 0.00 -1.06 0.00 0.00 56.10 53.93 2vll s TRP 244 Cb -0.01 -0.40 0.02 0.00 -1.16 0.00 0.00 33.47 31.92 2vll s TRP 244 CO -0.01 -0.36 0.01 0.00 -4.06 0.00 0.00 176.95 172.53 2vll s ALA 245 N -3.89 0.17 0.11 2.67 0.00 -0.38 -2.52 121.76 117.92 2vll s ALA 245 Ca 0.07 0.17 0.08 0.00 0.00 0.00 0.00 51.96 52.28 2vll s ALA 245 Cb 0.08 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.94 2vll s ALA 245 CO -0.09 -0.06 -0.19 0.00 0.00 0.00 0.00 175.76 175.41 2vll s ALA 246 N 0.79 1.72 0.02 0.00 0.00 0.41 -0.13 121.76 124.56 2vll s ALA 246 Ca -0.07 -1.25 0.04 0.00 0.00 0.00 0.00 51.96 50.67 2vll s ALA 246 Cb -0.10 -0.20 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 2vll s ALA 246 CO -0.02 0.29 -0.11 0.14 0.00 0.00 0.00 175.76 176.06 2vll s VAL 247 N -1.39 0.90 -0.20 0.00 -7.23 -0.46 -0.95 120.40 111.07 2vll s VAL 247 Ca 0.07 -0.72 -0.18 0.00 -1.81 0.00 0.00 61.98 59.34 2vll s VAL 247 Cb -0.09 -0.80 -0.03 0.00 0.56 0.00 0.00 36.38 36.02 2vll s VAL 247 CO 0.04 0.08 0.51 -0.69 -0.31 0.00 0.00 175.10 174.73 2vll s VAL 248 N -0.59 5.12 0.04 1.32 1.01 -1.26 -0.82 120.40 125.21 2vll s VAL 248 Ca 0.02 0.94 0.09 0.00 0.00 0.00 0.00 61.98 63.02 2vll s VAL 248 Cb -0.06 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 2vll s VAL 248 CO 0.00 0.19 -0.25 0.68 0.00 0.00 0.00 175.10 175.72 2vll s VAL 249 N 1.57 2.04 0.11 2.92 -7.23 0.32 -4.94 120.40 115.19 2vll s VAL 249 Ca 0.24 -1.32 -0.31 0.00 -1.81 0.00 0.00 61.98 58.78 2vll s VAL 249 Cb -0.15 -1.74 -0.09 0.00 0.56 0.00 0.00 36.38 34.95 2vll s VAL 249 CO 0.10 0.37 1.72 -2.84 -0.31 0.00 0.00 175.10 174.13 2vll s PRO 250 N -1.14 4.17 0.19 4.82 0.02 -1.26 -0.37 135.00 141.43 2vll s PRO 250 Ca 0.11 2.45 -0.33 0.00 0.02 0.00 0.00 61.00 63.25 2vll s PRO 250 Cb -0.10 -3.52 -0.14 0.00 0.02 0.00 0.00 34.50 30.76 2vll s PRO 250 CO 0.02 -0.76 1.44 0.43 -0.33 0.00 0.00 177.00 177.79 2vll n SER 251 N 5.36 2.65 0.00 2.53 7.64 -0.75 -0.89 113.62 130.16 2vll n SER 251 Ca 0.16 1.12 0.00 0.00 1.01 0.00 0.00 58.87 61.16 2vll n SER 251 Cb 0.39 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.20 2vll n SER 251 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vll n GLY 252 N 2.63 2.09 0.84 0.23 0.00 -1.26 -4.91 105.19 104.81 2vll n GLY 252 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.25 2vll n GLY 252 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2vll n GLN 253 N -2.00 2.27 -0.33 1.61 6.02 -0.07 -4.63 117.38 120.25 2vll n GLN 253 Ca 0.00 -2.02 0.21 0.00 -0.01 0.00 0.00 57.00 55.19 2vll n GLN 253 Cb 0.00 -1.37 0.44 0.00 1.02 0.00 0.00 30.24 30.33 2vll n GLN 253 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2vll h GLU 254 N 3.08 0.36 0.00 -1.09 3.07 -1.92 -0.09 114.58 117.98 2vll h GLU 254 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 2vll h GLU 254 Cb 0.79 -0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.62 2vll h GLU 254 CO 0.00 0.24 0.00 -0.56 -1.40 0.00 0.00 179.01 177.29 2vll h GLN 255 N 0.37 0.00 0.00 2.33 3.07 -1.83 -1.80 115.11 117.25 2vll h GLN 255 Ca 0.70 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.44 2vll h GLN 255 Cb 1.52 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.08 2vll h GLN 255 CO -0.58 0.00 -0.03 0.00 0.09 0.00 0.00 178.83 178.31 2vll h ARG 256 N 0.00 0.00 -5.63 0.06 3.08 -1.37 -3.46 114.38 107.06 2vll h ARG 256 Ca 0.00 0.00 -0.65 0.00 0.07 0.00 0.00 59.98 59.40 2vll h ARG 256 Cb 0.20 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.17 2vll h ARG 256 CO 0.00 0.00 -0.44 0.71 -1.07 0.00 0.00 179.97 179.17 2vll s TYR 257 N -3.20 3.58 -0.01 3.04 1.51 -0.68 -1.50 117.35 120.09 2vll s TYR 257 Ca 0.07 0.57 0.03 0.00 -1.01 0.00 0.00 57.07 56.73 2vll s TYR 257 Cb 0.06 -2.04 -0.01 0.00 -0.11 0.00 0.00 41.96 39.86 2vll s TYR 257 CO 0.67 0.64 -0.10 0.95 -1.11 0.00 0.00 175.55 176.59 2vll s THR 258 N -0.76 0.82 -0.10 -0.71 -4.23 -0.06 -4.39 115.64 106.22 2vll s THR 258 Ca 0.15 -0.46 -0.04 0.00 -1.18 0.00 0.00 61.69 60.16 2vll s THR 258 Cb -0.13 -0.69 -0.04 0.00 1.34 0.00 0.00 72.50 72.99 2vll s THR 258 CO 0.04 0.22 0.07 0.00 -0.54 0.00 0.00 174.62 174.41 2vll s HIS 260 N -0.96 2.06 -0.15 0.00 3.76 0.69 -0.38 115.29 120.31 2vll s HIS 260 Ca 0.14 -0.80 0.01 0.00 -0.15 0.00 0.00 55.06 54.26 2vll s HIS 260 Cb -0.12 -1.41 0.02 0.00 1.11 0.00 0.00 32.58 32.18 2vll s HIS 260 CO 0.03 -0.34 -0.16 0.08 -0.85 0.00 0.00 174.74 173.50 2vll s VAL 261 N 0.44 1.69 -0.14 -0.90 1.01 -0.12 -1.33 120.40 121.05 2vll s VAL 261 Ca -0.16 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.11 2vll s VAL 261 Cb -0.17 -1.55 -0.00 0.00 0.00 0.00 0.00 36.38 34.66 2vll s VAL 261 CO 0.06 0.48 -0.17 -1.10 0.00 0.00 0.00 175.10 174.37 2vll s GLN 262 N 1.30 3.20 -0.13 2.72 -0.21 -0.19 -1.17 119.66 125.17 2vll s GLN 262 Ca 0.02 -0.77 -0.20 0.00 0.02 0.00 0.00 55.36 54.43 2vll s GLN 262 Cb -0.13 -2.56 0.05 0.00 1.00 0.00 0.00 33.01 31.36 2vll s GLN 262 CO -0.09 0.06 0.52 -1.58 -2.12 0.00 0.00 175.29 172.09 2vll s HIS 263 N 0.68 -0.52 0.54 0.91 2.46 -1.26 -1.51 115.29 116.59 2vll s HIS 263 Ca -0.08 1.15 0.26 0.00 0.47 0.00 0.00 55.06 56.85 2vll s HIS 263 Cb -0.16 0.22 1.43 0.00 -0.13 0.00 0.00 32.58 33.94 2vll s HIS 263 CO 0.02 -0.37 2.00 1.49 -2.47 0.00 0.00 174.74 175.41 2vll h GLU 264 N 4.58 0.00 -0.00 2.88 4.81 -1.93 -1.39 114.58 123.53 2vll h GLU 264 Ca -0.28 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 2vll h GLU 264 Cb 1.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.55 2vll h GLU 264 CO 0.26 0.00 -0.02 0.41 -0.73 0.00 0.00 179.01 178.93 2vll n GLY 265 N -1.61 -1.09 3.78 1.92 0.00 -1.26 -4.83 105.19 102.11 2vll n GLY 265 Ca 0.09 -0.19 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 2vll n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vll s LEU 266 N -2.35 4.40 0.42 0.99 1.43 -0.52 -4.40 118.68 118.64 2vll s LEU 266 Ca 0.35 0.96 0.10 0.00 -1.03 0.00 0.00 54.13 54.51 2vll s LEU 266 Cb 0.21 -2.69 0.89 0.00 0.03 0.00 0.00 46.19 44.62 2vll s LEU 266 CO 0.43 0.18 2.00 1.55 0.23 0.00 0.00 176.35 180.74 2vll h PRO 267 N 5.50 0.30 -2.72 1.29 0.13 -1.88 -3.44 132.00 131.19 2vll h PRO 267 Ca -0.47 -0.04 -0.10 0.00 -0.87 0.00 0.00 66.00 64.52 2vll h PRO 267 Cb 1.20 -0.06 -0.20 0.00 0.13 0.00 0.00 31.00 32.08 2vll h PRO 267 CO 0.68 0.31 -0.14 0.15 -0.23 0.00 0.00 178.00 178.77 2vll s LYS 268 N -5.04 0.77 0.54 0.86 1.02 -1.26 -5.14 119.74 111.49 2vll s LYS 268 Ca -0.06 -0.01 -0.22 0.00 0.02 0.00 0.00 55.97 55.70 2vll s LYS 268 Cb 0.16 0.35 -0.06 0.00 -0.52 0.00 0.00 37.83 37.77 2vll s LYS 268 CO 0.72 -0.22 1.23 -2.30 -0.92 0.00 0.00 175.35 173.87 2vll n PRO 269 N 1.29 1.49 -3.81 -1.68 -0.02 -1.26 -4.97 135.00 126.05 2vll n PRO 269 Ca -0.20 0.55 -0.34 0.00 -2.02 0.00 0.00 63.50 61.48 2vll n PRO 269 Cb 0.56 -2.42 -0.05 0.00 -0.02 0.00 0.00 33.50 31.57 2vll n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2vll s LEU 270 N -2.72 4.37 -0.13 2.45 1.43 -0.32 -4.93 118.68 118.83 2vll s LEU 270 Ca 0.71 0.50 0.03 0.00 -1.03 0.00 0.00 54.13 54.33 2vll s LEU 270 Cb -0.44 -2.62 0.00 0.00 0.03 0.00 0.00 46.19 43.17 2vll s LEU 270 CO 0.50 0.27 -0.21 -0.89 0.23 0.00 0.00 176.35 176.24 2vll s THR 271 N -1.29 2.17 0.01 5.49 2.01 -1.26 -0.94 115.64 121.83 2vll s THR 271 Ca 0.27 -0.96 0.06 0.00 0.31 0.00 0.00 61.69 61.37 2vll s THR 271 Cb -0.13 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.49 2vll s THR 271 CO 0.16 0.55 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.71 2vll s LEU 272 N 0.64 2.66 0.03 4.42 1.02 0.48 -4.95 118.68 122.98 2vll s LEU 272 Ca -0.11 -0.34 0.03 0.00 0.02 0.00 0.00 54.13 53.72 2vll s LEU 272 Cb -0.16 -1.55 -0.02 0.00 0.02 0.00 0.00 46.19 44.48 2vll s LEU 272 CO 0.02 0.28 -0.09 -0.60 0.02 0.00 0.00 176.35 175.99 2vll s ARG 273 N -1.21 0.59 0.31 1.70 3.52 -1.26 -0.57 118.95 122.03 2vll s ARG 273 Ca 0.14 -0.62 -0.27 0.00 -0.13 0.00 0.00 55.73 54.85 2vll s ARG 273 Cb -0.11 -0.48 -0.09 0.00 -1.56 0.00 0.00 34.95 32.72 2vll s ARG 273 CO 0.04 0.11 1.02 -0.46 -0.81 0.00 0.00 175.30 175.20 2vll s TRP 274 N -0.94 3.60 0.00 5.12 -0.11 -1.26 -4.76 118.94 120.59 2vll s TRP 274 Ca -0.04 1.74 0.00 0.00 1.22 0.00 0.00 56.10 59.02 2vll s TRP 274 Cb -0.07 -3.11 0.00 0.00 -1.50 0.00 0.00 33.47 28.78 2vll s TRP 274 CO 0.00 -0.22 0.00 -0.85 -4.62 0.00 0.00 176.95 171.26 2vll n GLU 275 N 0.78 0.00 0.00 5.86 0.28 -1.26 -4.68 120.64 121.63 2vll n GLU 275 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.01 2vll n GLU 275 Cb 0.48 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.35 2vll n GLU 275 CO 0.00 0.00 0.00 -2.30 -0.16 0.00 0.00 177.13 174.67