#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q4n s PRO 15 N 0.00 4.22 0.03 0.52 0.04 -1.26 -4.79 135.00 133.76 2q4n s PRO 15 Ca 0.00 1.62 -0.33 0.00 0.04 0.00 0.00 61.00 62.33 2q4n s PRO 15 Cb 0.00 -2.68 -0.12 0.00 0.04 0.00 0.00 34.50 31.74 2q4n s PRO 15 CO 0.00 -0.11 1.79 0.28 0.04 0.00 0.00 177.00 178.99 2q4n n VAL 16 N 0.17 0.38 -2.15 -0.36 0.31 -1.26 -4.53 118.33 110.89 2q4n n VAL 16 Ca 0.04 -0.07 -0.41 0.00 -0.01 0.00 0.00 64.34 63.89 2q4n n VAL 16 Cb 0.48 -1.84 -0.02 0.00 -0.91 0.00 0.00 33.84 31.55 2q4n n VAL 16 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 2q4n s HIS 17 N 2.88 3.10 0.44 3.52 2.46 -1.26 -4.88 115.29 121.55 2q4n s HIS 17 Ca 0.86 1.43 0.30 0.00 0.47 0.00 0.00 55.06 58.12 2q4n s HIS 17 Cb -0.64 -3.65 1.65 0.00 -0.13 0.00 0.00 32.58 29.82 2q4n s HIS 17 CO 0.44 -1.76 1.92 -1.35 -2.47 0.00 0.00 174.74 171.52 2q4n h PRO 18 N 3.51 0.00 -0.00 2.88 0.11 -1.94 -1.07 132.00 135.48 2q4n h PRO 18 Ca -0.49 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.46 2q4n h PRO 18 Cb 1.22 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 2q4n h PRO 18 CO 0.66 0.00 -0.79 0.74 -0.21 0.00 0.00 178.00 178.40 2q4n h PHE 19 N 0.00 0.05 0.00 0.65 -1.00 -1.90 -3.31 116.94 111.43 2q4n h PHE 19 Ca 0.00 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.75 2q4n h PHE 19 Cb 0.37 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 39.92 2q4n h PHE 19 CO 0.00 0.81 -0.82 0.28 -1.61 0.00 0.00 178.31 176.98 2q4n h VAL 20 N 0.02 0.00 -0.98 -0.55 2.07 -1.47 -3.41 116.25 111.94 2q4n h VAL 20 Ca -0.01 -0.82 0.25 0.00 0.82 0.00 0.00 66.70 66.93 2q4n h VAL 20 Cb 1.40 1.37 -0.13 0.00 -1.52 0.00 0.00 31.29 32.42 2q4n h VAL 20 CO 0.11 0.00 0.54 0.00 0.02 0.00 0.00 177.57 178.23 2q4n h ALA 21 N 2.18 1.72 0.00 1.67 0.00 -1.52 -1.67 119.26 121.64 2q4n h ALA 21 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2q4n h ALA 21 Cb 0.91 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2q4n h ALA 21 CO 0.00 -0.33 0.00 -0.35 0.00 0.00 0.00 179.25 178.57 2q4n n PRO 22 N -4.95 0.17 -0.18 0.00 -0.04 -1.26 -1.44 135.00 127.29 2q4n n PRO 22 Ca 0.26 0.17 0.07 0.00 -0.04 0.00 0.00 63.50 63.96 2q4n n PRO 22 Cb 0.76 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.87 2q4n n PRO 22 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2q4n n LEU 23 N -1.31 2.82 0.20 1.53 4.77 -0.63 -4.63 117.00 119.74 2q4n n LEU 23 Ca 0.06 -2.65 0.16 0.00 -0.03 0.00 0.00 56.01 53.55 2q4n n LEU 23 Cb 0.11 -0.34 0.79 0.00 -2.33 0.00 0.00 43.42 41.66 2q4n n LEU 23 CO 0.11 0.66 1.14 0.77 -1.33 0.00 0.00 177.39 178.74 2q4n h SER 24 N 0.87 0.00 0.12 -1.43 4.64 -1.19 0.02 113.55 116.58 2q4n h SER 24 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2q4n h SER 24 Cb 0.98 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.07 2q4n h SER 24 CO 0.06 0.00 -0.01 0.10 -0.87 0.00 0.00 176.83 176.12 2q4n h TYR 25 N 0.00 0.00 0.00 4.77 -0.00 -1.82 -2.04 116.97 117.87 2q4n h TYR 25 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 58.73 58.70 2q4n h TYR 25 Cb 0.43 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.14 2q4n h TYR 25 CO 0.00 0.01 -0.57 -0.07 -0.00 0.00 0.00 178.16 177.53 2q4n h LEU 26 N 0.00 0.00 -9.26 0.10 3.38 -1.36 -3.45 115.31 104.72 2q4n h LEU 26 Ca -0.00 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.42 2q4n h LEU 26 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2q4n h LEU 26 CO 0.00 0.57 1.19 -0.76 0.09 0.00 0.00 178.44 179.54 2q4n s LEU 27 N -6.72 4.25 0.00 1.67 1.43 -0.77 -4.35 118.68 114.19 2q4n s LEU 27 Ca 0.02 2.34 0.00 0.00 -1.03 0.00 0.00 54.13 55.46 2q4n s LEU 27 Cb 0.09 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.78 2q4n s LEU 27 CO 0.74 -1.11 0.00 0.61 0.23 0.00 0.00 176.35 176.82 2q4n n GLY 28 N 4.52 -1.56 3.76 -3.19 0.00 -0.90 -4.99 105.19 102.83 2q4n n GLY 28 Ca 0.20 -1.46 -0.23 0.00 0.00 0.00 0.00 46.02 44.53 2q4n n GLY 28 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q4n s THR 29 N -2.09 4.09 -0.11 2.61 2.01 -1.26 -2.67 115.64 118.22 2q4n s THR 29 Ca 0.00 -1.55 -0.14 0.00 0.31 0.00 0.00 61.69 60.31 2q4n s THR 29 Cb 0.00 -3.19 0.03 0.00 0.01 0.00 0.00 72.50 69.35 2q4n s THR 29 CO 0.00 -0.33 0.37 0.26 -0.69 0.00 0.00 174.62 174.23 2q4n s TRP 30 N -2.15 -0.37 -0.08 4.92 0.52 -0.45 -1.31 118.94 120.02 2q4n s TRP 30 Ca 0.32 0.84 -0.05 0.00 0.02 0.00 0.00 56.10 57.23 2q4n s TRP 30 Cb -0.08 0.14 0.04 0.00 -1.15 0.00 0.00 33.47 32.42 2q4n s TRP 30 CO 0.23 -0.26 0.20 0.50 0.02 0.00 0.00 176.95 177.64 2q4n s ARG 31 N -0.23 0.17 0.00 4.98 3.52 -0.80 -1.93 118.95 124.66 2q4n s ARG 31 Ca -0.04 0.41 0.00 0.00 -0.13 0.00 0.00 55.73 55.97 2q4n s ARG 31 Cb -0.03 -0.08 0.00 0.00 -1.56 0.00 0.00 34.95 33.27 2q4n s ARG 31 CO 0.02 -0.13 0.00 0.41 -0.81 0.00 0.00 175.30 174.79 2q4n n GLY 32 N 3.91 3.40 3.26 8.12 0.00 -0.92 -2.57 105.19 120.38 2q4n n GLY 32 Ca -0.22 -1.10 -0.21 0.00 0.00 0.00 0.00 46.02 44.48 2q4n n GLY 32 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2q4n s GLN 33 N -0.16 1.06 0.26 1.61 -2.07 -1.15 -2.49 119.66 116.73 2q4n s GLN 33 Ca 0.00 -1.17 0.02 0.00 -1.82 0.00 0.00 55.36 52.39 2q4n s GLN 33 Cb 0.00 -1.18 -0.04 0.00 -1.09 0.00 0.00 33.01 30.70 2q4n s GLN 33 CO 0.00 0.26 0.13 0.20 -1.32 0.00 0.00 175.29 174.56 2q4n s GLY 34 N -2.07 1.79 -0.01 2.60 0.00 0.54 -2.59 107.32 107.58 2q4n s GLY 34 Ca 0.06 -1.79 -0.00 0.00 0.00 0.00 0.00 44.72 42.99 2q4n s GLY 34 CO 0.04 -1.54 0.02 -0.54 0.00 0.00 0.00 173.10 171.08 2q4n s GLU 35 N -3.97 0.00 0.11 2.90 2.02 0.23 -0.25 118.70 119.75 2q4n s GLU 35 Ca 0.37 0.08 0.09 0.00 0.02 0.00 0.00 54.97 55.53 2q4n s GLU 35 Cb 0.06 -0.07 -0.04 0.00 0.10 0.00 0.00 34.13 34.18 2q4n s GLU 35 CO 0.15 -0.06 -0.18 0.20 0.02 0.00 0.00 175.26 175.40 2q4n s GLY 36 N 0.35 1.69 -0.20 -1.39 0.00 0.29 -1.04 107.32 107.03 2q4n s GLY 36 Ca -0.03 -1.33 -0.28 0.00 0.00 0.00 0.00 44.72 43.08 2q4n s GLY 36 CO -0.01 -1.31 0.97 -1.83 0.00 0.00 0.00 173.10 170.92 2q4n s GLU 37 N -2.10 0.61 -0.09 2.90 -1.05 0.41 -0.48 118.70 118.91 2q4n s GLU 37 Ca 0.18 0.36 -0.30 0.00 -0.15 0.00 0.00 54.97 55.05 2q4n s GLU 37 Cb -0.11 0.29 0.12 0.00 -0.44 0.00 0.00 34.13 33.99 2q4n s GLU 37 CO 0.10 -0.15 0.98 -0.47 0.95 0.00 0.00 175.26 176.67 2q4n s TYR 38 N -0.57 -0.32 0.27 4.83 5.04 -1.03 -4.16 117.35 121.41 2q4n s TYR 38 Ca -0.01 0.33 0.00 0.00 -2.44 0.00 0.00 57.07 54.96 2q4n s TYR 38 Cb -0.02 0.50 0.58 0.00 0.35 0.00 0.00 41.96 43.37 2q4n s TYR 38 CO -0.00 -0.42 1.76 -1.35 -1.34 0.00 0.00 175.55 174.19 2q4n h PRO 39 N 2.19 0.60 0.00 4.97 0.11 -1.99 -1.38 132.00 136.50 2q4n h PRO 39 Ca -0.19 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2q4n h PRO 39 Cb 1.20 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2q4n h PRO 39 CO 0.30 0.40 0.00 0.25 -0.21 0.00 0.00 178.00 178.74 2q4n n THR 40 N -4.87 0.68 -3.72 -1.15 -2.24 -1.26 -4.82 114.28 96.90 2q4n n THR 40 Ca 0.18 0.04 -0.15 0.00 -2.27 0.00 0.00 64.05 61.85 2q4n n THR 40 Cb 0.47 -0.88 -0.15 0.00 -2.10 0.00 0.00 70.33 67.67 2q4n n THR 40 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 2q4n s ILE 41 N -3.17 -0.12 0.45 2.28 -4.36 -0.52 -5.16 121.20 110.59 2q4n s ILE 41 Ca 0.08 0.26 -0.21 0.00 -0.26 0.00 0.00 60.65 60.51 2q4n s ILE 41 Cb 0.11 -0.23 -0.12 0.00 1.25 0.00 0.00 42.46 43.47 2q4n s ILE 41 CO 0.46 0.11 0.48 -0.81 0.24 0.00 0.00 174.94 175.41 2q4n n PRO 42 N 4.65 0.49 -1.96 0.37 -0.04 -1.26 -2.47 135.00 134.79 2q4n n PRO 42 Ca -0.18 0.18 -0.41 0.00 -0.04 0.00 0.00 63.50 63.05 2q4n n PRO 42 Cb 0.51 -1.47 -0.01 0.00 -0.04 0.00 0.00 33.50 32.48 2q4n n PRO 42 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2q4n s SER 43 N -0.99 6.57 0.19 3.54 1.04 -1.26 -4.70 113.70 118.10 2q4n s SER 43 Ca 0.63 2.83 -0.00 0.00 0.48 0.00 0.00 55.95 59.89 2q4n s SER 43 Cb -0.58 -2.65 -0.04 0.00 0.10 0.00 0.00 66.02 62.85 2q4n s SER 43 CO 0.58 -0.71 0.08 0.72 0.98 0.00 0.00 173.24 174.89 2q4n s PHE 44 N -0.83 1.15 0.13 5.02 -0.71 0.37 -4.96 117.98 118.15 2q4n s PHE 44 Ca 0.53 -1.24 0.10 0.00 -1.04 0.00 0.00 56.93 55.29 2q4n s PHE 44 Cb -0.43 -0.62 -0.04 0.00 -1.21 0.00 0.00 43.02 40.72 2q4n s PHE 44 CO 0.54 -0.47 -0.25 1.03 -1.34 0.00 0.00 175.22 174.73 2q4n s ARG 45 N -4.06 1.35 0.05 1.99 0.52 -1.26 -0.54 118.95 116.99 2q4n s ARG 45 Ca 0.32 -1.33 -0.05 0.00 -0.52 0.00 0.00 55.73 54.14 2q4n s ARG 45 Cb 0.07 -1.77 -0.01 0.00 0.52 0.00 0.00 34.95 33.75 2q4n s ARG 45 CO 0.08 0.41 0.10 1.52 0.02 0.00 0.00 175.30 177.43 2q4n s TYR 46 N -1.18 0.22 0.15 -0.53 1.13 0.66 -4.73 117.35 113.08 2q4n s TYR 46 Ca 0.13 -0.57 -0.05 0.00 -1.41 0.00 0.00 57.07 55.17 2q4n s TYR 46 Cb -0.10 -0.16 -0.06 0.00 -1.10 0.00 0.00 41.96 40.55 2q4n s TYR 46 CO 0.06 -0.39 0.40 0.20 -2.51 0.00 0.00 175.55 173.31 2q4n s GLY 47 N -2.29 2.24 -0.06 5.49 0.00 -0.02 -0.34 107.32 112.34 2q4n s GLY 47 Ca -0.03 -0.53 -0.08 0.00 0.00 0.00 0.00 44.72 44.08 2q4n s GLY 47 CO -0.06 -0.44 0.22 1.85 0.00 0.00 0.00 173.10 174.67 2q4n s GLU 48 N -2.67 0.34 -0.01 2.90 2.12 -1.04 -0.66 118.70 119.68 2q4n s GLU 48 Ca 0.42 0.16 0.04 0.00 0.36 0.00 0.00 54.97 55.95 2q4n s GLU 48 Cb -0.12 0.16 -0.01 0.00 0.26 0.00 0.00 34.13 34.41 2q4n s GLU 48 CO 0.24 -0.06 -0.14 -2.00 -0.54 0.00 0.00 175.26 172.76 2q4n s GLU 49 N -0.25 1.12 0.02 4.30 2.12 -0.04 -2.17 118.70 123.79 2q4n s GLU 49 Ca -0.04 -0.52 0.03 0.00 0.36 0.00 0.00 54.97 54.81 2q4n s GLU 49 Cb -0.03 -1.08 -0.01 0.00 0.26 0.00 0.00 34.13 33.26 2q4n s GLU 49 CO 0.01 0.30 -0.10 0.42 -0.54 0.00 0.00 175.26 175.35 2q4n s ILE 50 N -0.36 0.75 -0.09 -3.70 1.01 -0.82 -1.66 121.20 116.34 2q4n s ILE 50 Ca 0.05 -0.67 -0.01 0.00 0.00 0.00 0.00 60.65 60.03 2q4n s ILE 50 Cb -0.06 -0.68 0.03 0.00 0.01 0.00 0.00 42.46 41.76 2q4n s ILE 50 CO -0.00 0.03 -0.04 -0.60 0.00 0.00 0.00 174.94 174.32 2q4n s ARG 51 N -0.72 1.09 -0.20 2.79 3.52 0.21 -1.34 118.95 124.31 2q4n s ARG 51 Ca 0.00 -0.09 -0.06 0.00 -0.13 0.00 0.00 55.73 55.45 2q4n s ARG 51 Cb -0.06 -1.27 -0.03 0.00 -1.56 0.00 0.00 34.95 32.03 2q4n s ARG 51 CO 0.00 -0.26 0.04 -0.06 -0.81 0.00 0.00 175.30 174.21 2q4n s PHE 52 N 1.75 3.14 0.28 5.12 0.08 -1.09 -0.95 117.98 126.32 2q4n s PHE 52 Ca 0.03 -0.16 -0.01 0.00 0.12 0.00 0.00 56.93 56.91 2q4n s PHE 52 Cb -0.13 -2.10 -0.02 0.00 -0.57 0.00 0.00 43.02 40.21 2q4n s PHE 52 CO -0.06 -0.04 0.32 -1.54 -0.10 0.00 0.00 175.22 173.80 2q4n s SER 53 N 0.73 0.70 0.12 1.36 1.04 -0.66 -2.11 113.70 114.88 2q4n s SER 53 Ca 0.02 -1.43 -0.10 0.00 0.48 0.00 0.00 55.95 54.92 2q4n s SER 53 Cb -0.14 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.53 2q4n s SER 53 CO 0.02 -1.08 0.26 -1.38 0.98 0.00 0.00 173.24 172.04 2q4n s HIS 54 N -3.64 0.16 -0.03 5.02 -3.43 -1.26 -0.22 115.29 111.88 2q4n s HIS 54 Ca 0.34 -0.55 0.05 0.00 -0.80 0.00 0.00 55.06 54.10 2q4n s HIS 54 Cb 0.02 0.01 0.07 0.00 -1.43 0.00 0.00 32.58 31.26 2q4n s HIS 54 CO 0.18 -0.63 0.93 -1.13 -2.00 0.00 0.00 174.74 172.09 2q4n n SER 55 N -0.14 1.41 0.00 7.38 3.41 -1.26 -4.87 113.62 119.55 2q4n n SER 55 Ca -0.13 -2.07 0.00 0.00 -0.26 0.00 0.00 58.87 56.41 2q4n n SER 55 Cb 0.63 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.44 2q4n n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2q4n n GLY 56 N -0.57 1.50 2.50 5.00 0.00 -1.26 -4.76 105.19 107.60 2q4n n GLY 56 Ca 0.04 -0.16 -0.22 0.00 0.00 0.00 0.00 46.02 45.68 2q4n n GLY 56 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2q4n n LYS 57 N -1.31 1.03 -1.24 1.61 4.76 -1.26 -4.79 118.16 116.96 2q4n n LYS 57 Ca 0.00 -2.55 -0.31 0.00 -2.87 0.00 0.00 58.31 52.58 2q4n n LYS 57 Cb 0.06 0.84 0.07 0.00 -1.84 0.00 0.00 35.03 34.17 2q4n n LYS 57 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2q4n n PRO 58 N -0.83 2.48 -3.95 1.97 -0.04 -1.26 -4.61 135.00 128.76 2q4n n PRO 58 Ca -0.12 -2.88 -0.10 0.00 -0.04 0.00 0.00 63.50 60.36 2q4n n PRO 58 Cb 0.44 -2.13 -0.11 0.00 -0.04 0.00 0.00 33.50 31.67 2q4n n PRO 58 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2q4n s VAL 59 N -4.21 0.10 -0.07 0.52 1.01 -1.26 -4.40 120.40 112.09 2q4n s VAL 59 Ca 0.57 -0.85 0.05 0.00 0.00 0.00 0.00 61.98 61.75 2q4n s VAL 59 Cb 0.44 -0.31 -0.01 0.00 0.00 0.00 0.00 36.38 36.50 2q4n s VAL 59 CO -0.02 -0.47 -0.22 -0.63 0.00 0.00 0.00 175.10 173.76 2q4n s ILE 60 N -1.45 2.31 0.19 2.22 1.01 -0.27 -4.74 121.20 120.47 2q4n s ILE 60 Ca -0.16 -0.97 -0.21 0.00 0.00 0.00 0.00 60.65 59.31 2q4n s ILE 60 Cb -0.09 -1.86 -0.08 0.00 0.01 0.00 0.00 42.46 40.43 2q4n s ILE 60 CO -0.00 0.57 0.72 0.00 0.00 0.00 0.00 174.94 176.23 2q4n s ALA 61 N -0.18 3.44 -0.07 9.38 0.00 0.69 -1.99 121.76 133.04 2q4n s ALA 61 Ca -0.03 0.21 0.04 0.00 0.00 0.00 0.00 51.96 52.19 2q4n s ALA 61 Cb -0.14 -2.84 -0.01 0.00 0.00 0.00 0.00 23.12 20.13 2q4n s ALA 61 CO 0.04 0.33 -0.21 -0.47 0.00 0.00 0.00 175.76 175.44 2q4n s TYR 62 N -1.37 2.55 0.01 0.00 5.04 -0.32 -1.65 117.35 121.61 2q4n s TYR 62 Ca 0.39 -0.67 -0.02 0.00 -2.44 0.00 0.00 57.07 54.33 2q4n s TYR 62 Cb -0.19 -1.66 -0.01 0.00 0.35 0.00 0.00 41.96 40.46 2q4n s TYR 62 CO 0.22 -0.18 0.03 0.95 -1.34 0.00 0.00 175.55 175.23 2q4n s THR 63 N -0.10 0.08 -0.10 4.34 -4.23 -0.12 -1.89 115.64 113.62 2q4n s THR 63 Ca -0.05 -0.69 -0.30 0.00 -1.18 0.00 0.00 61.69 59.47 2q4n s THR 63 Cb -0.14 -0.28 0.10 0.00 1.34 0.00 0.00 72.50 73.52 2q4n s THR 63 CO 0.04 -0.38 0.86 -1.58 -0.54 0.00 0.00 174.62 173.02 2q4n s GLN 64 N -1.18 0.80 0.12 3.99 -0.44 -0.41 -0.62 119.66 121.92 2q4n s GLN 64 Ca -0.13 0.17 -0.14 0.00 -2.50 0.00 0.00 55.36 52.76 2q4n s GLN 64 Cb -0.08 0.38 0.02 0.00 -1.64 0.00 0.00 33.01 31.69 2q4n s GLN 64 CO -0.00 -0.26 0.34 -1.59 0.50 0.00 0.00 175.29 174.28 2q4n s LYS 65 N -1.26 1.03 0.23 1.67 -2.85 -0.66 -0.52 119.74 117.37 2q4n s LYS 65 Ca -0.05 -0.82 0.05 0.00 -1.00 0.00 0.00 55.97 54.15 2q4n s LYS 65 Cb -0.00 0.43 -0.05 0.00 -2.06 0.00 0.00 37.83 36.15 2q4n s LYS 65 CO 0.04 -0.38 -0.06 0.95 0.10 0.00 0.00 175.35 176.00 2q4n s THR 66 N -3.83 1.39 0.09 3.79 -4.23 -0.89 -0.86 115.64 111.09 2q4n s THR 66 Ca 0.05 -2.10 -0.26 0.00 -1.18 0.00 0.00 61.69 58.20 2q4n s THR 66 Cb 0.03 -2.25 0.07 0.00 1.34 0.00 0.00 72.50 71.69 2q4n s THR 66 CO -0.10 -0.43 0.63 -1.66 -0.54 0.00 0.00 174.62 172.51 2q4n s TRP 67 N -3.19 -0.57 0.10 3.99 -2.14 0.17 -3.67 118.94 113.63 2q4n s TRP 67 Ca 0.26 0.58 -0.31 0.00 2.66 0.00 0.00 56.10 59.29 2q4n s TRP 67 Cb 0.03 0.51 -0.09 0.00 -3.10 0.00 0.00 33.47 30.82 2q4n s TRP 67 CO 0.08 -0.77 1.68 0.15 -2.66 0.00 0.00 176.95 175.44 2q4n s LYS 68 N -2.92 4.18 0.14 3.25 1.02 -0.10 -0.84 119.74 124.47 2q4n s LYS 68 Ca -0.03 2.41 -0.24 0.00 0.02 0.00 0.00 55.97 58.13 2q4n s LYS 68 Cb -0.01 -3.50 -0.02 0.00 -0.52 0.00 0.00 37.83 33.78 2q4n s LYS 68 CO -0.06 -0.74 1.63 -0.07 -0.92 0.00 0.00 175.35 175.20 2q4n h LEU 69 N 8.21 -0.78 -0.20 3.17 3.38 -1.91 0.64 115.31 127.82 2q4n h LEU 69 Ca -0.43 0.12 -0.20 0.00 0.09 0.00 0.00 57.88 57.46 2q4n h LEU 69 Cb 1.21 0.34 -0.02 0.00 0.09 0.00 0.00 40.66 42.28 2q4n h LEU 69 CO 0.93 -0.30 -0.92 1.05 0.09 0.00 0.00 178.44 179.28 2q4n h GLU 70 N -0.33 0.10 0.00 1.13 9.09 -1.99 -3.27 114.58 119.31 2q4n h GLU 70 Ca 0.10 -0.13 0.00 0.00 0.05 0.00 0.00 59.36 59.38 2q4n h GLU 70 Cb 0.47 0.04 0.00 0.00 -1.65 0.00 0.00 28.75 27.61 2q4n h GLU 70 CO -0.30 0.95 -1.59 -1.13 0.05 0.00 0.00 179.01 176.99 2q4n n SER 71 N -3.55 0.36 0.00 3.06 3.41 -1.18 -4.99 113.62 110.73 2q4n n SER 71 Ca -0.02 -0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.34 2q4n n SER 71 Cb 0.85 1.53 0.00 0.00 -0.26 0.00 0.00 64.21 66.33 2q4n n SER 71 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2q4n n GLY 72 N 1.33 0.63 3.69 5.00 0.00 0.22 -4.96 105.19 111.09 2q4n n GLY 72 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 2q4n n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q4n n ALA 73 N 1.00 2.07 -0.58 4.61 0.00 -1.23 -4.60 120.51 121.77 2q4n n ALA 73 Ca 0.00 0.31 -0.30 0.00 0.00 0.00 0.00 53.44 53.45 2q4n n ALA 73 Cb 0.00 -2.59 0.21 0.00 0.00 0.00 0.00 19.45 17.07 2q4n n ALA 73 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2q4n n PRO 74 N 5.73 -1.67 -0.62 0.00 -0.02 -1.26 -0.92 135.00 136.24 2q4n n PRO 74 Ca 0.18 -0.45 -0.10 0.00 -2.02 0.00 0.00 63.50 61.12 2q4n n PRO 74 Cb 0.37 -2.10 0.07 0.00 -0.02 0.00 0.00 33.50 31.82 2q4n n PRO 74 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2q4n n HIS 76 N -4.60 -3.97 -3.53 6.00 8.25 -1.24 -4.82 115.22 111.32 2q4n n HIS 76 Ca 0.05 -0.39 -0.10 0.00 -0.26 0.00 0.00 57.72 57.02 2q4n n HIS 76 Cb 0.55 -0.34 -0.03 0.00 1.12 0.00 0.00 29.99 31.28 2q4n n HIS 76 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2q4n s ALA 77 N -3.95 -1.85 0.14 -1.41 0.00 -1.26 -2.10 121.76 111.33 2q4n s ALA 77 Ca 0.25 1.24 -0.17 0.00 0.00 0.00 0.00 51.96 53.28 2q4n s ALA 77 Cb -0.01 -0.01 0.04 0.00 0.00 0.00 0.00 23.12 23.14 2q4n s ALA 77 CO 0.18 -0.53 0.44 -1.83 0.00 0.00 0.00 175.76 174.02 2q4n s GLU 78 N -2.25 1.16 -0.00 0.00 -1.05 0.32 -0.64 118.70 116.23 2q4n s GLU 78 Ca 0.01 -0.73 -0.22 0.00 -0.15 0.00 0.00 54.97 53.88 2q4n s GLU 78 Cb -0.01 0.49 0.05 0.00 -0.44 0.00 0.00 34.13 34.22 2q4n s GLU 78 CO -0.04 -0.47 0.49 -1.54 0.95 0.00 0.00 175.26 174.65 2q4n s SER 79 N -2.82 -0.41 0.00 0.83 1.04 -1.17 -1.29 113.70 109.88 2q4n s SER 79 Ca 0.04 0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.77 2q4n s SER 79 Cb 0.01 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.57 2q4n s SER 79 CO -0.10 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.14 2q4n n GLY 80 N 0.85 1.66 2.98 7.32 0.00 -0.79 -2.64 105.19 114.58 2q4n n GLY 80 Ca -0.20 -0.54 -0.13 0.00 0.00 0.00 0.00 46.02 45.16 2q4n n GLY 80 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2q4n s TYR 81 N -1.88 -0.16 -0.13 1.61 2.02 0.11 -1.17 117.35 117.75 2q4n s TYR 81 Ca 0.00 0.41 -0.03 0.00 -0.37 0.00 0.00 57.07 57.08 2q4n s TYR 81 Cb 0.00 0.00 -0.03 0.00 -0.40 0.00 0.00 41.96 41.53 2q4n s TYR 81 CO 0.00 -0.11 -0.02 -0.06 -1.57 0.00 0.00 175.55 173.79 2q4n s PHE 82 N 0.49 3.08 -0.53 2.71 0.40 -0.84 -0.28 117.98 123.00 2q4n s PHE 82 Ca -0.03 -0.09 0.07 0.00 -0.60 0.00 0.00 56.93 56.28 2q4n s PHE 82 Cb -0.05 -1.90 0.28 0.00 0.51 0.00 0.00 43.02 41.86 2q4n s PHE 82 CO -0.02 0.16 0.71 0.54 0.70 0.00 0.00 175.22 177.32 2q4n n ARG 83 N 3.01 1.95 -2.92 0.44 1.74 0.15 -1.11 116.66 119.92 2q4n n ARG 83 Ca -0.18 -4.14 -0.36 0.00 -0.77 0.00 0.00 57.85 52.40 2q4n n ARG 83 Cb 0.53 -1.89 -0.06 0.00 -1.02 0.00 0.00 32.46 30.01 2q4n n ARG 83 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2q4n s PRO 84 N -2.27 4.38 0.28 5.56 0.04 -1.26 -2.57 135.00 139.16 2q4n s PRO 84 Ca 0.40 1.10 0.09 0.00 0.04 0.00 0.00 61.00 62.63 2q4n s PRO 84 Cb 0.20 -2.70 -0.06 0.00 0.04 0.00 0.00 34.50 31.99 2q4n s PRO 84 CO -0.07 0.26 -0.12 1.03 0.04 0.00 0.00 177.00 178.14 2q4n s ARG 85 N -2.29 1.61 0.00 4.56 0.52 -0.26 -4.60 118.95 118.49 2q4n s ARG 85 Ca 0.50 -1.79 0.11 0.00 -0.52 0.00 0.00 55.73 54.03 2q4n s ARG 85 Cb -0.16 -1.45 0.58 0.00 0.52 0.00 0.00 34.95 34.45 2q4n s ARG 85 CO 0.21 0.16 1.20 -0.35 0.02 0.00 0.00 175.30 176.54 2q4n n PRO 86 N -0.61 0.21 0.00 3.54 -0.04 -1.26 -2.38 135.00 134.46 2q4n n PRO 86 Ca -0.06 0.13 0.14 0.00 -0.04 0.00 0.00 63.50 63.67 2q4n n PRO 86 Cb 0.62 -1.50 0.57 0.00 -0.04 0.00 0.00 33.50 33.15 2q4n n PRO 86 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2q4n n ASP 87 N -1.20 0.70 0.00 3.54 5.75 -1.26 -4.93 116.55 119.15 2q4n n ASP 87 Ca 0.06 -0.79 0.00 0.00 -0.01 0.00 0.00 54.79 54.05 2q4n n ASP 87 Cb 0.07 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.15 2q4n n ASP 87 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2q4n n GLY 88 N 1.26 2.32 3.89 6.12 0.00 -1.00 -5.10 105.19 112.69 2q4n n GLY 88 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 2q4n n GLY 88 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2q4n s SER 89 N -1.22 5.44 -0.14 1.61 1.04 -1.26 -2.53 113.70 116.64 2q4n s SER 89 Ca 0.00 0.98 -0.29 0.00 0.48 0.00 0.00 55.95 57.13 2q4n s SER 89 Cb 0.00 -1.82 0.08 0.00 0.10 0.00 0.00 66.02 64.38 2q4n s SER 89 CO 0.00 -1.28 0.75 -0.51 0.98 0.00 0.00 173.24 173.18 2q4n s ILE 90 N -3.26 0.00 0.02 -1.02 2.07 -0.47 -1.11 121.20 117.43 2q4n s ILE 90 Ca 0.57 0.00 0.06 0.00 -1.41 0.00 0.00 60.65 59.87 2q4n s ILE 90 Cb -0.11 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.46 2q4n s ILE 90 CO 0.50 0.00 -0.18 -1.83 -1.91 0.00 0.00 174.94 171.52 2q4n s GLU 91 N -0.62 1.28 -0.13 3.50 -1.05 -1.06 -0.62 118.70 119.98 2q4n s GLU 91 Ca -0.06 -0.76 -0.00 0.00 -0.15 0.00 0.00 54.97 54.00 2q4n s GLU 91 Cb -0.02 -1.30 0.02 0.00 -0.44 0.00 0.00 34.13 32.39 2q4n s GLU 91 CO 0.05 0.34 -0.10 0.08 0.95 0.00 0.00 175.26 176.58 2q4n s VAL 92 N -0.65 1.29 -0.08 1.83 1.01 0.47 0.30 120.40 124.57 2q4n s VAL 92 Ca 0.06 -0.47 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 2q4n s VAL 92 Cb -0.08 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 35.01 2q4n s VAL 92 CO 0.01 0.39 -0.02 0.68 0.00 0.00 0.00 175.10 176.16 2q4n s VAL 93 N 1.60 4.14 -0.10 2.92 -7.23 0.61 -0.82 120.40 121.52 2q4n s VAL 93 Ca 0.05 -0.31 -0.09 0.00 -1.81 0.00 0.00 61.98 59.82 2q4n s VAL 93 Cb -0.13 -2.73 0.03 0.00 0.56 0.00 0.00 36.38 34.11 2q4n s VAL 93 CO -0.09 0.60 0.27 -0.63 -0.31 0.00 0.00 175.10 174.93 2q4n s ILE 94 N -0.82 -0.00 0.01 -0.62 1.01 -0.96 0.07 121.20 119.89 2q4n s ILE 94 Ca 0.12 0.02 0.03 0.00 0.00 0.00 0.00 60.65 60.82 2q4n s ILE 94 Cb -0.11 -0.38 -0.03 0.00 0.01 0.00 0.00 42.46 41.94 2q4n s ILE 94 CO 0.02 0.01 -0.06 0.00 0.00 0.00 0.00 174.94 174.91 2q4n s ALA 95 N 0.27 3.06 0.20 9.38 0.00 -1.08 -0.80 121.76 132.79 2q4n s ALA 95 Ca -0.01 -1.02 0.07 0.00 0.00 0.00 0.00 51.96 51.00 2q4n s ALA 95 Cb -0.03 -1.15 -0.04 0.00 0.00 0.00 0.00 23.12 21.90 2q4n s ALA 95 CO -0.01 0.62 0.07 -0.65 0.00 0.00 0.00 175.76 175.79 2q4n s GLN 96 N -1.48 2.61 0.34 0.00 -0.21 0.19 -3.06 119.66 118.05 2q4n s GLN 96 Ca 0.18 -1.08 0.03 0.00 0.02 0.00 0.00 55.36 54.51 2q4n s GLN 96 Cb -0.11 -2.44 0.62 0.00 1.00 0.00 0.00 33.01 32.07 2q4n s GLN 96 CO 0.08 0.44 1.96 0.66 -2.12 0.00 0.00 175.29 176.31 2q4n h SER 97 N 2.30 0.66 0.13 5.90 4.64 -1.22 -1.46 113.55 124.50 2q4n h SER 97 Ca -0.47 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 2q4n h SER 97 Cb 1.21 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 2q4n h SER 97 CO 0.60 0.55 0.00 0.35 -0.87 0.00 0.00 176.83 177.46 2q4n n THR 98 N -4.39 0.85 -0.28 2.95 -2.24 -1.26 -4.89 114.28 105.03 2q4n n THR 98 Ca 0.05 0.21 0.00 0.00 -2.27 0.00 0.00 64.05 62.04 2q4n n THR 98 Cb 0.11 -1.09 0.00 0.00 -2.10 0.00 0.00 70.33 67.25 2q4n n THR 98 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2q4n n GLY 99 N -0.67 1.50 3.65 3.38 0.00 -0.55 -5.11 105.19 107.39 2q4n n GLY 99 Ca 0.03 -0.15 -0.25 0.00 0.00 0.00 0.00 46.02 45.65 2q4n n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2q4n s LEU 100 N 0.00 2.98 -0.00 0.99 1.02 -1.25 -4.71 118.68 117.71 2q4n s LEU 100 Ca 0.00 -1.07 -0.02 0.00 0.02 0.00 0.00 54.13 53.06 2q4n s LEU 100 Cb 0.00 -1.29 -0.00 0.00 0.02 0.00 0.00 46.19 44.92 2q4n s LEU 100 CO 0.00 -0.33 0.03 0.68 0.02 0.00 0.00 176.35 176.76 2q4n s VAL 101 N -2.56 0.05 -0.00 -1.59 -7.23 -0.92 0.55 120.40 108.69 2q4n s VAL 101 Ca 0.36 -0.39 0.01 0.00 -1.81 0.00 0.00 61.98 60.15 2q4n s VAL 101 Cb 0.02 -0.18 -0.00 0.00 0.56 0.00 0.00 36.38 36.78 2q4n s VAL 101 CO 0.20 -0.21 -0.03 -1.83 -0.31 0.00 0.00 175.10 172.92 2q4n s GLU 102 N -0.64 0.24 -0.24 4.82 -1.05 0.02 -0.70 118.70 121.16 2q4n s GLU 102 Ca -0.07 -0.11 -0.08 0.00 -0.15 0.00 0.00 54.97 54.56 2q4n s GLU 102 Cb -0.04 -0.23 -0.04 0.00 -0.44 0.00 0.00 34.13 33.38 2q4n s GLU 102 CO -0.00 0.06 0.10 0.08 0.95 0.00 0.00 175.26 176.45 2q4n s VAL 103 N -0.07 4.66 -0.12 1.83 1.01 -0.48 -2.25 120.40 124.98 2q4n s VAL 103 Ca 0.01 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 61.94 2q4n s VAL 103 Cb -0.01 -3.17 -0.02 0.00 0.00 0.00 0.00 36.38 33.18 2q4n s VAL 103 CO -0.00 0.35 -0.14 -1.10 0.00 0.00 0.00 175.10 174.21 2q4n s GLN 104 N 1.34 3.26 0.04 2.72 -1.52 0.00 -1.29 119.66 124.22 2q4n s GLN 104 Ca 0.06 -0.70 0.05 0.00 -1.95 0.00 0.00 55.36 52.82 2q4n s GLN 104 Cb -0.15 -2.58 -0.02 0.00 -0.22 0.00 0.00 33.01 30.04 2q4n s GLN 104 CO 0.05 0.26 -0.15 0.15 -0.25 0.00 0.00 175.29 175.34 2q4n s LYS 105 N 0.22 1.02 0.00 2.91 1.02 -0.02 -0.39 119.74 124.50 2q4n s LYS 105 Ca -0.09 -0.79 0.00 0.00 0.02 0.00 0.00 55.97 55.11 2q4n s LYS 105 Cb -0.15 -1.05 0.00 0.00 -0.52 0.00 0.00 37.83 36.11 2q4n s LYS 105 CO 0.05 0.26 0.00 0.41 -0.92 0.00 0.00 175.35 175.15 2q4n n GLY 106 N 1.90 -0.93 3.29 -3.33 0.00 0.20 -0.78 105.19 105.54 2q4n n GLY 106 Ca -0.18 -0.03 -0.17 0.00 0.00 0.00 0.00 46.02 45.64 2q4n n GLY 106 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2q4n s THR 107 N -3.88 1.49 -0.00 2.61 -4.23 0.00 -1.37 115.64 110.26 2q4n s THR 107 Ca 0.00 -2.02 0.05 0.00 -1.18 0.00 0.00 61.69 58.54 2q4n s THR 107 Cb 0.00 -1.84 -0.01 0.00 1.34 0.00 0.00 72.50 71.99 2q4n s THR 107 CO 0.00 -0.57 -0.15 -0.72 -0.54 0.00 0.00 174.62 172.64 2q4n s TYR 108 N -2.77 1.35 -0.16 3.99 -0.85 -1.05 -0.77 117.35 117.10 2q4n s TYR 108 Ca 0.17 -0.27 0.00 0.00 -0.52 0.00 0.00 57.07 56.45 2q4n s TYR 108 Cb -0.01 -0.85 0.03 0.00 0.38 0.00 0.00 41.96 41.50 2q4n s TYR 108 CO 0.04 -0.01 -0.11 1.21 -1.52 0.00 0.00 175.55 175.16 2q4n s ASN 109 N -0.52 2.78 0.18 -0.18 3.84 -0.66 -4.85 114.94 115.53 2q4n s ASN 109 Ca 0.05 -0.57 -0.06 0.00 0.21 0.00 0.00 52.86 52.49 2q4n s ASN 109 Cb -0.06 -1.11 0.07 0.00 -0.55 0.00 0.00 41.25 39.59 2q4n s ASN 109 CO -0.00 -0.10 1.51 0.58 -2.79 0.00 0.00 177.10 176.30 2q4n h VAL 110 N 6.18 1.29 0.00 -5.21 2.07 -1.89 -1.10 116.25 117.59 2q4n h VAL 110 Ca -0.33 -1.63 -0.11 0.00 0.82 0.00 0.00 66.70 65.45 2q4n h VAL 110 Cb 1.12 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 32.42 2q4n h VAL 110 CO 0.49 0.53 -0.50 0.44 0.02 0.00 0.00 177.57 178.54 2q4n h ASP 111 N 0.59 0.00 0.27 0.57 3.32 -1.97 -2.28 116.42 116.92 2q4n h ASP 111 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2q4n h ASP 111 Cb 1.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.55 2q4n h ASP 111 CO 0.09 0.50 -0.54 -0.62 -1.72 0.00 0.00 179.24 176.96 2q4n n GLU 112 N -3.88 0.35 -3.79 3.56 1.02 -1.21 -4.97 120.64 111.72 2q4n n GLU 112 Ca -0.01 -0.24 -0.23 0.00 -0.02 0.00 0.00 57.16 56.66 2q4n n GLU 112 Cb 0.53 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.46 2q4n n GLU 112 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2q4n n GLN 113 N -1.12 -4.31 -4.34 3.49 6.02 -0.43 -4.42 117.38 112.28 2q4n n GLN 113 Ca 0.07 0.54 -0.18 0.00 -0.01 0.00 0.00 57.00 57.43 2q4n n GLN 113 Cb 0.35 -4.94 -0.10 0.00 1.02 0.00 0.00 30.24 26.57 2q4n n GLN 113 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2q4n s SER 114 N -4.37 2.08 -0.07 1.08 1.04 -1.15 0.10 113.70 112.41 2q4n s SER 114 Ca 0.00 -1.16 -0.05 0.00 0.48 0.00 0.00 55.95 55.22 2q4n s SER 114 Cb -0.00 -0.04 0.03 0.00 0.10 0.00 0.00 66.02 66.10 2q4n s SER 114 CO 0.84 -0.42 0.17 -0.63 0.98 0.00 0.00 173.24 174.18 2q4n s ILE 115 N -3.28 -0.02 -0.10 -1.02 1.01 0.42 -1.65 121.20 116.56 2q4n s ILE 115 Ca 0.26 0.07 -0.00 0.00 0.00 0.00 0.00 60.65 60.98 2q4n s ILE 115 Cb 0.04 -0.25 0.02 0.00 0.01 0.00 0.00 42.46 42.28 2q4n s ILE 115 CO 0.08 0.03 -0.07 -0.54 0.00 0.00 0.00 174.94 174.44 2q4n s LYS 116 N 0.56 1.41 0.01 2.79 1.02 0.05 -0.87 119.74 124.71 2q4n s LYS 116 Ca -0.04 -0.23 0.07 0.00 0.02 0.00 0.00 55.97 55.79 2q4n s LYS 116 Cb -0.05 -1.45 -0.02 0.00 -0.52 0.00 0.00 37.83 35.79 2q4n s LYS 116 CO -0.03 -0.21 -0.21 -0.51 -0.92 0.00 0.00 175.35 173.47 2q4n s LEU 117 N 1.53 2.08 0.05 3.17 1.43 -0.02 -0.82 118.68 126.11 2q4n s LEU 117 Ca 0.01 -0.42 0.05 0.00 -1.03 0.00 0.00 54.13 52.74 2q4n s LEU 117 Cb -0.13 -1.03 -0.02 0.00 0.03 0.00 0.00 46.19 45.04 2q4n s LEU 117 CO -0.06 0.22 -0.14 -0.75 0.23 0.00 0.00 176.35 175.85 2q4n s LYS 118 N -0.72 0.91 0.37 1.70 2.20 0.04 -1.64 119.74 122.59 2q4n s LYS 118 Ca 0.08 -0.85 -0.24 0.00 -0.36 0.00 0.00 55.97 54.60 2q4n s LYS 118 Cb -0.08 -0.93 -0.10 0.00 -1.51 0.00 0.00 37.83 35.21 2q4n s LYS 118 CO 0.00 0.22 0.96 -1.54 -0.36 0.00 0.00 175.35 174.63 2q4n s SER 119 N -1.39 7.12 -0.15 1.43 1.04 -0.82 -0.84 113.70 120.08 2q4n s SER 119 Ca 0.01 1.81 0.04 0.00 0.48 0.00 0.00 55.95 58.29 2q4n s SER 119 Cb -0.09 -2.57 -0.23 0.00 0.10 0.00 0.00 66.02 63.24 2q4n s SER 119 CO 0.02 -0.23 0.23 0.47 0.98 0.00 0.00 173.24 174.71 2q4n n ASP 120 N 0.06 1.42 -3.77 7.02 9.92 -0.41 -4.87 116.55 125.92 2q4n n ASP 120 Ca 0.04 0.13 -0.13 0.00 -0.53 0.00 0.00 54.79 54.30 2q4n n ASP 120 Cb 0.51 -0.23 -0.12 0.00 -0.64 0.00 0.00 41.12 40.65 2q4n n ASP 120 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 2q4n s LEU 121 N -6.41 0.84 -0.38 0.64 0.20 -1.19 -5.02 118.68 107.36 2q4n s LEU 121 Ca -0.19 0.50 0.01 0.00 0.69 0.00 0.00 54.13 55.14 2q4n s LEU 121 Cb 0.07 0.80 0.12 0.00 -0.43 0.00 0.00 46.19 46.75 2q4n s LEU 121 CO 0.75 -0.11 0.18 -0.69 -0.29 0.00 0.00 176.35 176.19 2q4n s VAL 122 N 0.53 1.15 0.22 1.68 1.01 -1.26 -1.38 120.40 122.36 2q4n s VAL 122 Ca -0.03 -2.08 -0.05 0.00 0.00 0.00 0.00 61.98 59.82 2q4n s VAL 122 Cb -0.05 -1.83 -0.06 0.00 0.00 0.00 0.00 36.38 34.45 2q4n s VAL 122 CO -0.03 -0.82 0.48 -0.83 0.00 0.00 0.00 175.10 173.90 2q4n s GLY 123 N 0.87 2.04 -1.26 4.51 0.00 0.12 -4.22 107.32 109.39 2q4n s GLY 123 Ca 0.15 -0.54 -0.08 0.00 0.00 0.00 0.00 44.72 44.25 2q4n s GLY 123 CO -0.09 -0.44 1.08 -2.01 0.00 0.00 0.00 173.10 171.64 2q4n n ASN 124 N -0.44 -6.05 -4.60 1.64 5.15 -1.26 -2.18 115.26 107.52 2q4n n ASN 124 Ca -0.02 -0.49 -0.34 0.00 -0.60 0.00 0.00 54.58 53.13 2q4n n ASN 124 Cb 0.53 -4.67 -0.11 0.00 -0.53 0.00 0.00 39.78 35.00 2q4n n ASN 124 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2q4n s ALA 125 N -3.29 3.04 0.12 5.20 0.00 -1.26 -4.52 121.76 121.06 2q4n s ALA 125 Ca 0.53 -0.88 -0.26 0.00 0.00 0.00 0.00 51.96 51.35 2q4n s ALA 125 Cb -0.24 -1.27 -0.05 0.00 0.00 0.00 0.00 23.12 21.56 2q4n s ALA 125 CO 0.66 0.58 1.63 0.66 0.00 0.00 0.00 175.76 179.29 2q4n h SER 126 N 5.18 -0.81 0.00 0.00 4.64 -1.96 -3.39 113.55 117.21 2q4n h SER 126 Ca -0.49 0.11 -0.09 0.00 -0.47 0.00 0.00 61.79 60.85 2q4n h SER 126 Cb 1.18 0.33 -0.17 0.00 -0.31 0.00 0.00 62.40 63.43 2q4n h SER 126 CO 0.53 -0.34 -0.58 0.29 -0.87 0.00 0.00 176.83 175.86 2q4n n LYS 127 N -5.39 0.00 -3.34 4.77 5.02 -1.26 -5.04 118.16 112.92 2q4n n LYS 127 Ca -0.05 -1.21 -0.38 0.00 -2.02 0.00 0.00 58.31 54.65 2q4n n LYS 127 Cb 0.30 -0.06 -0.06 0.00 -0.02 0.00 0.00 35.03 35.19 2q4n n LYS 127 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2q4n s VAL 128 N 0.00 5.03 0.00 -0.18 1.01 -1.26 -1.42 120.40 123.58 2q4n s VAL 128 Ca 0.12 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.11 2q4n s VAL 128 Cb 0.14 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.70 2q4n s VAL 128 CO -0.06 0.44 0.00 0.29 0.00 0.00 0.00 175.10 175.77 2q4n n LYS 129 N 2.72 0.00 -4.36 2.72 4.76 0.03 -4.86 118.16 119.18 2q4n n LYS 129 Ca -0.09 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.10 2q4n n LYS 129 Cb 0.52 -0.38 -0.09 0.00 -1.84 0.00 0.00 35.03 33.24 2q4n n LYS 129 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2q4n s GLU 130 N -0.98 2.04 -0.01 1.97 8.01 -1.25 -4.35 118.70 124.13 2q4n s GLU 130 Ca 0.00 -1.70 0.01 0.00 0.01 0.00 0.00 54.97 53.30 2q4n s GLU 130 Cb 0.00 -1.94 0.00 0.00 -4.31 0.00 0.00 34.13 27.89 2q4n s GLU 130 CO 0.00 0.21 -0.04 0.42 0.01 0.00 0.00 175.26 175.87 2q4n s ILE 131 N -2.48 0.32 -0.17 -1.63 1.01 -1.26 -1.62 121.20 115.37 2q4n s ILE 131 Ca 0.33 -0.14 -0.04 0.00 0.00 0.00 0.00 60.65 60.81 2q4n s ILE 131 Cb -0.02 -0.30 -0.02 0.00 0.01 0.00 0.00 42.46 42.13 2q4n s ILE 131 CO 0.19 0.11 -0.03 -0.44 0.00 0.00 0.00 174.94 174.76 2q4n s SER 132 N 0.13 4.72 -0.20 3.58 0.01 0.90 -1.95 113.70 120.88 2q4n s SER 132 Ca -0.01 -0.18 -0.01 0.00 1.31 0.00 0.00 55.95 57.06 2q4n s SER 132 Cb -0.04 -1.78 0.06 0.00 0.21 0.00 0.00 66.02 64.46 2q4n s SER 132 CO -0.00 0.13 -0.01 -0.13 0.41 0.00 0.00 173.24 173.63 2q4n s ARG 133 N 0.62 1.12 -0.06 12.44 0.52 -0.65 -1.61 118.95 131.33 2q4n s ARG 133 Ca -0.02 -0.62 0.06 0.00 -0.52 0.00 0.00 55.73 54.62 2q4n s ARG 133 Cb -0.14 -2.23 -0.01 0.00 0.52 0.00 0.00 34.95 33.09 2q4n s ARG 133 CO 0.02 -0.58 -0.23 -1.21 0.02 0.00 0.00 175.30 173.32 2q4n s GLU 134 N 1.66 2.44 0.13 3.54 2.02 -0.92 -0.84 118.70 126.73 2q4n s GLU 134 Ca -0.02 -0.84 0.07 0.00 0.02 0.00 0.00 54.97 54.19 2q4n s GLU 134 Cb -0.17 -2.05 -0.04 0.00 0.10 0.00 0.00 34.13 31.97 2q4n s GLU 134 CO -0.07 0.34 -0.17 -0.06 0.02 0.00 0.00 175.26 175.32 2q4n s PHE 135 N -0.08 1.58 -0.16 1.61 0.40 -0.05 -1.47 117.98 119.81 2q4n s PHE 135 Ca -0.05 -0.50 -0.27 0.00 -0.60 0.00 0.00 56.93 55.51 2q4n s PHE 135 Cb -0.14 -0.83 0.07 0.00 0.51 0.00 0.00 43.02 42.64 2q4n s PHE 135 CO 0.04 0.21 0.69 -2.00 0.70 0.00 0.00 175.22 174.85 2q4n s GLU 136 N -2.50 0.93 -0.06 0.44 2.12 -0.40 -0.44 118.70 118.79 2q4n s GLU 136 Ca 0.10 0.64 -0.27 0.00 0.36 0.00 0.00 54.97 55.80 2q4n s GLU 136 Cb -0.06 0.45 -0.03 0.00 0.26 0.00 0.00 34.13 34.74 2q4n s GLU 136 CO 0.04 -0.20 0.85 -1.17 -0.54 0.00 0.00 175.26 174.24 2q4n s LEU 137 N -0.36 4.31 -0.21 2.70 2.96 0.11 -1.89 118.68 126.30 2q4n s LEU 137 Ca -0.05 1.39 -0.03 0.00 -0.22 0.00 0.00 54.13 55.21 2q4n s LEU 137 Cb -0.03 -3.33 0.07 0.00 0.50 0.00 0.00 46.19 43.40 2q4n s LEU 137 CO 0.05 -0.24 0.06 0.68 -1.32 0.00 0.00 176.35 175.58 2q4n s VAL 138 N 1.21 0.41 -1.43 1.68 -7.23 0.23 -4.83 120.40 110.43 2q4n s VAL 138 Ca 0.44 -0.60 -0.03 0.00 -1.81 0.00 0.00 61.98 59.98 2q4n s VAL 138 Cb -0.19 -1.02 0.02 0.00 0.56 0.00 0.00 36.38 35.76 2q4n s VAL 138 CO 0.21 -0.31 0.54 -0.67 -0.31 0.00 0.00 175.10 174.55 2q4n n ASP 139 N 5.08 -1.07 0.00 4.85 2.03 -1.26 -1.53 116.55 124.66 2q4n n ASP 139 Ca -0.08 -0.96 0.00 0.00 0.52 0.00 0.00 54.79 54.27 2q4n n ASP 139 Cb 0.46 -3.22 0.00 0.00 -0.72 0.00 0.00 41.12 37.64 2q4n n ASP 139 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2q4n n GLY 140 N -1.84 1.25 3.78 0.27 0.00 -1.26 -5.01 105.19 102.38 2q4n n GLY 140 Ca -0.24 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 2q4n n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2q4n s LYS 141 N -0.15 3.00 -0.31 1.61 1.02 -0.58 -4.13 119.74 120.20 2q4n s LYS 141 Ca 0.00 -0.57 -0.08 0.00 0.02 0.00 0.00 55.97 55.35 2q4n s LYS 141 Cb 0.00 -2.81 0.01 0.00 -0.52 0.00 0.00 37.83 34.51 2q4n s LYS 141 CO 0.00 0.61 0.11 -1.17 -0.92 0.00 0.00 175.35 173.99 2q4n s LEU 142 N -2.00 4.06 0.12 3.17 2.96 0.31 0.76 118.68 128.07 2q4n s LEU 142 Ca 0.26 -0.76 0.04 0.00 -0.22 0.00 0.00 54.13 53.45 2q4n s LEU 142 Cb -0.12 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.61 2q4n s LEU 142 CO 0.17 -0.23 0.08 -0.55 -1.32 0.00 0.00 176.35 174.50 2q4n s SER 143 N 1.52 5.38 0.17 3.68 0.15 -0.79 0.34 113.70 124.15 2q4n s SER 143 Ca 0.02 -0.11 -0.14 0.00 0.70 0.00 0.00 55.95 56.43 2q4n s SER 143 Cb -0.18 -1.38 0.01 0.00 -1.71 0.00 0.00 66.02 62.76 2q4n s SER 143 CO 0.04 0.13 0.40 -0.72 1.20 0.00 0.00 173.24 174.29 2q4n s TYR 144 N -1.54 0.08 0.07 3.44 -0.85 -0.08 -1.27 117.35 117.20 2q4n s TYR 144 Ca 0.29 -0.44 0.06 0.00 -0.52 0.00 0.00 57.07 56.46 2q4n s TYR 144 Cb -0.11 0.18 -0.03 0.00 0.38 0.00 0.00 41.96 42.38 2q4n s TYR 144 CO 0.22 -0.80 -0.15 0.08 -1.52 0.00 0.00 175.55 173.37 2q4n s VAL 145 N -3.90 1.22 -0.23 -3.49 1.01 -0.54 -1.94 120.40 112.53 2q4n s VAL 145 Ca 0.11 -1.26 0.00 0.00 0.00 0.00 0.00 61.98 60.84 2q4n s VAL 145 Cb 0.01 -1.14 0.06 0.00 0.00 0.00 0.00 36.38 35.31 2q4n s VAL 145 CO -0.03 -0.13 -0.05 -0.69 0.00 0.00 0.00 175.10 174.20 2q4n s VAL 146 N -1.13 1.43 0.47 2.92 1.01 -0.72 -2.16 120.40 122.22 2q4n s VAL 146 Ca 0.00 -1.15 0.08 0.00 0.00 0.00 0.00 61.98 60.91 2q4n s VAL 146 Cb -0.09 -1.72 0.02 0.00 0.00 0.00 0.00 36.38 34.58 2q4n s VAL 146 CO 0.02 -0.11 0.50 -0.13 0.00 0.00 0.00 175.10 175.39 2q4n s ARG 147 N 1.44 2.51 0.01 2.72 0.52 -0.64 -0.11 118.95 125.41 2q4n s ARG 147 Ca -0.05 -1.57 -0.05 0.00 -0.52 0.00 0.00 55.73 53.55 2q4n s ARG 147 Cb -0.19 -2.47 -0.01 0.00 0.52 0.00 0.00 34.95 32.81 2q4n s ARG 147 CO -0.06 -0.40 0.08 -1.54 0.02 0.00 0.00 175.30 173.39 2q4n s SER 149 N -4.30 0.10 0.38 0.23 1.04 -0.64 -0.07 113.70 110.45 2q4n s SER 149 Ca 0.50 -0.32 0.04 0.00 0.48 0.00 0.00 55.95 56.65 2q4n s SER 149 Cb -0.05 0.17 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 2q4n s SER 149 CO 0.30 -0.35 0.09 0.42 0.98 0.00 0.00 173.24 174.68 2q4n s THR 150 N -1.42 0.91 0.45 2.02 -4.23 0.50 -0.79 115.64 113.09 2q4n s THR 150 Ca -0.15 -2.00 0.29 0.00 -1.18 0.00 0.00 61.69 58.65 2q4n s THR 150 Cb -0.08 -2.52 0.49 0.00 1.34 0.00 0.00 72.50 71.72 2q4n s THR 150 CO 0.01 0.00 1.70 0.74 -0.54 0.00 0.00 174.62 176.52 2q4n h THR 151 N 1.88 0.29 0.00 3.99 2.02 -1.61 -3.07 112.91 116.41 2q4n h THR 151 Ca -0.39 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 66.74 2q4n h THR 151 Cb 1.27 0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 2q4n h THR 151 CO 0.64 0.03 -0.02 0.35 0.37 0.00 0.00 175.52 176.89 2q4n n THR 152 N -4.53 0.00 -3.75 3.16 -2.24 -1.26 -5.00 114.28 100.65 2q4n n THR 152 Ca 0.32 -0.32 -0.37 0.00 -2.27 0.00 0.00 64.05 61.41 2q4n n THR 152 Cb 1.27 0.98 -0.06 0.00 -2.10 0.00 0.00 70.33 70.42 2q4n n THR 152 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2q4n s ASN 153 N -0.68 6.53 0.55 3.42 -0.87 -1.16 -5.08 114.94 117.64 2q4n s ASN 153 Ca 0.00 0.63 -0.09 0.00 -1.57 0.00 0.00 52.86 51.83 2q4n s ASN 153 Cb 0.00 -2.13 -0.04 0.00 -0.02 0.00 0.00 41.25 39.06 2q4n s ASN 153 CO 0.00 0.37 0.92 -2.16 -2.57 0.00 0.00 177.10 173.66 2q4n s PRO 154 N -1.13 3.62 0.11 -0.60 0.04 -1.26 -0.37 135.00 135.41 2q4n s PRO 154 Ca 0.19 0.55 -0.35 0.00 0.04 0.00 0.00 61.00 61.43 2q4n s PRO 154 Cb -0.14 -2.21 -0.14 0.00 0.04 0.00 0.00 34.50 32.05 2q4n s PRO 154 CO 0.08 -0.38 1.56 -0.11 0.04 0.00 0.00 177.00 178.19 2q4n n LEU 155 N -2.39 2.81 -3.54 -3.56 7.94 -1.26 -4.56 117.00 112.44 2q4n n LEU 155 Ca 0.04 1.08 -0.09 0.00 -1.11 0.00 0.00 56.01 55.93 2q4n n LEU 155 Cb 0.54 -1.37 -0.02 0.00 0.53 0.00 0.00 43.42 43.11 2q4n n LEU 155 CO 0.55 -0.43 0.55 0.00 -1.11 0.00 0.00 177.39 176.95 2q4n s GLN 156 N 1.15 1.16 0.16 1.96 -2.07 -1.26 -4.90 119.66 115.85 2q4n s GLN 156 Ca 0.82 -0.49 -0.32 0.00 -1.82 0.00 0.00 55.36 53.54 2q4n s GLN 156 Cb -0.75 0.49 -0.12 0.00 -1.09 0.00 0.00 33.01 31.55 2q4n s GLN 156 CO 0.41 -0.51 1.76 -2.30 -1.32 0.00 0.00 175.29 173.33 2q4n n PRO 157 N -0.35 2.68 -0.08 9.60 -0.02 -1.26 -4.38 135.00 141.19 2q4n n PRO 157 Ca -0.11 0.97 -0.14 0.00 -2.02 0.00 0.00 63.50 62.20 2q4n n PRO 157 Cb 0.63 -2.83 -0.07 0.00 -0.02 0.00 0.00 33.50 31.21 2q4n n PRO 157 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 2q4n n HIS 158 N 4.69 0.00 -4.79 6.00 -0.00 0.85 -4.65 115.22 117.33 2q4n n HIS 158 Ca 0.17 0.00 -0.26 0.00 0.46 0.00 0.00 57.72 58.09 2q4n n HIS 158 Cb 0.35 -0.59 -0.15 0.00 -0.12 0.00 0.00 29.99 29.48 2q4n n HIS 158 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 2q4n s LEU 159 N -6.32 2.13 -0.05 0.27 1.43 -0.86 -0.44 118.68 114.84 2q4n s LEU 159 Ca -0.22 -0.48 -0.02 0.00 -1.03 0.00 0.00 54.13 52.38 2q4n s LEU 159 Cb 0.07 -1.04 0.04 0.00 0.03 0.00 0.00 46.19 45.29 2q4n s LEU 159 CO 0.33 0.20 0.10 -1.59 0.23 0.00 0.00 176.35 175.62 2q4n s LYS 160 N -0.97 0.04 -0.01 1.70 -2.85 -0.21 -1.75 119.74 115.69 2q4n s LYS 160 Ca 0.08 0.30 -0.11 0.00 -1.00 0.00 0.00 55.97 55.25 2q4n s LYS 160 Cb -0.09 -0.21 0.01 0.00 -2.06 0.00 0.00 37.83 35.48 2q4n s LYS 160 CO 0.01 -0.17 0.23 0.00 0.10 0.00 0.00 175.35 175.51 2q4n s ALA 161 N 1.17 -0.56 -0.11 0.59 0.00 -0.82 -0.60 121.76 121.43 2q4n s ALA 161 Ca -0.09 0.16 0.02 0.00 0.00 0.00 0.00 51.96 52.05 2q4n s ALA 161 Cb -0.12 0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.06 2q4n s ALA 161 CO -0.05 -0.22 -0.15 0.42 0.00 0.00 0.00 175.76 175.76 2q4n s ILE 162 N -1.21 1.48 0.19 0.00 1.01 -1.07 -0.90 121.20 120.70 2q4n s ILE 162 Ca -0.13 -0.63 0.09 0.00 0.00 0.00 0.00 60.65 59.98 2q4n s ILE 162 Cb -0.06 -1.35 -0.04 0.00 0.01 0.00 0.00 42.46 41.02 2q4n s ILE 162 CO 0.03 0.44 -0.07 -0.76 0.00 0.00 0.00 174.94 174.57 2q4n s LEU 163 N 0.97 3.05 0.01 2.97 1.02 1.03 -2.96 118.68 124.77 2q4n s LEU 163 Ca -0.07 -0.56 0.05 0.00 0.02 0.00 0.00 54.13 53.57 2q4n s LEU 163 Cb -0.15 -1.71 -0.03 0.00 0.02 0.00 0.00 46.19 44.32 2q4n s LEU 163 CO -0.01 0.09 -0.15 -1.81 0.02 0.00 0.00 176.35 174.49 2q4n s ASP 164 N -2.96 4.00 0.15 2.29 1.01 -1.06 0.11 116.67 120.21 2q4n s ASP 164 Ca 0.26 -0.31 -0.30 0.00 0.71 0.00 0.00 52.55 52.91 2q4n s ASP 164 Cb -0.08 -0.76 -0.08 0.00 1.01 0.00 0.00 42.92 43.01 2q4n s ASP 164 CO 0.16 0.28 1.22 -0.75 0.21 0.00 0.00 175.17 176.30 2q4n s LYS 165 N -1.24 4.45 0.00 8.23 2.20 -1.26 -1.90 119.74 130.23 2q4n s LYS 165 Ca 0.14 1.88 0.30 0.00 -0.36 0.00 0.00 55.97 57.93 2q4n s LYS 165 Cb -0.11 -3.26 1.47 0.00 -1.51 0.00 0.00 37.83 34.42 2q4n s LYS 165 CO 0.04 -0.17 1.98 1.28 -0.36 0.00 0.00 175.35 178.12