#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lck s ASN 64 N 0.00 4.31 -0.02 -1.12 4.22 -1.26 -4.99 114.94 116.07 1lck s ASN 64 Ca 0.00 -0.67 0.01 0.00 -2.14 0.00 0.00 52.86 50.06 1lck s ASN 64 Cb 0.00 -1.70 0.01 0.00 1.28 0.00 0.00 41.25 40.84 1lck s ASN 64 CO 0.00 -0.09 -0.04 -0.22 -2.04 0.00 0.00 177.10 174.71 1lck s LEU 65 N 1.40 1.62 0.21 3.54 2.96 -1.26 -2.13 118.68 125.01 1lck s LEU 65 Ca 0.03 -0.10 0.06 0.00 -0.22 0.00 0.00 54.13 53.89 1lck s LEU 65 Cb -0.16 -0.34 -0.05 0.00 0.50 0.00 0.00 46.19 46.14 1lck s LEU 65 CO -0.04 -0.00 -0.08 0.68 -1.32 0.00 0.00 176.35 175.58 1lck s VAL 66 N 0.44 1.39 -0.03 1.68 -7.23 -0.78 0.65 120.40 116.52 1lck s VAL 66 Ca -0.05 -2.11 0.06 0.00 -1.81 0.00 0.00 61.98 58.07 1lck s VAL 66 Cb -0.09 -2.12 -0.01 0.00 0.56 0.00 0.00 36.38 34.71 1lck s VAL 66 CO -0.00 -0.53 -0.22 -0.63 -0.31 0.00 0.00 175.10 173.41 1lck s ILE 67 N -3.19 1.76 -0.10 -0.62 1.01 -0.51 -2.18 121.20 117.36 1lck s ILE 67 Ca 0.23 -0.94 -0.30 0.00 0.00 0.00 0.00 60.65 59.65 1lck s ILE 67 Cb 0.02 -1.48 -0.02 0.00 0.01 0.00 0.00 42.46 41.00 1lck s ILE 67 CO 0.06 0.50 1.17 0.00 0.00 0.00 0.00 174.94 176.67 1lck s ALA 68 N -0.36 3.54 0.01 9.38 0.00 -0.17 -2.07 121.76 132.08 1lck s ALA 68 Ca 0.04 0.51 0.11 0.00 0.00 0.00 0.00 51.96 52.62 1lck s ALA 68 Cb -0.10 -3.53 -0.14 0.00 0.00 0.00 0.00 23.12 19.35 1lck s ALA 68 CO 0.01 -0.86 1.18 -0.07 0.00 0.00 0.00 175.76 176.01 1lck h LEU 69 N 8.63 0.00 -8.50 0.00 3.38 -1.43 0.48 115.31 117.88 1lck h LEU 69 Ca -0.31 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.37 1lck h LEU 69 Cb 1.14 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 41.72 1lck h LEU 69 CO 0.91 0.85 -0.72 -1.00 0.09 0.00 0.00 178.44 178.56 1lck s HIS 70 N -2.77 1.07 0.21 1.13 3.76 -1.25 -4.75 115.29 112.68 1lck s HIS 70 Ca 0.00 -0.74 -0.30 0.00 -0.15 0.00 0.00 55.06 53.87 1lck s HIS 70 Cb 0.09 -0.58 -0.08 0.00 1.11 0.00 0.00 32.58 33.12 1lck s HIS 70 CO 0.80 -0.01 1.05 -1.12 -0.85 0.00 0.00 174.74 174.61 1lck s SER 71 N -2.77 7.37 -0.07 1.40 0.01 -1.26 -3.71 113.70 114.68 1lck s SER 71 Ca 0.10 2.07 0.02 0.00 1.31 0.00 0.00 55.95 59.45 1lck s SER 71 Cb 0.00 -2.61 0.01 0.00 0.21 0.00 0.00 66.02 63.64 1lck s SER 71 CO -0.01 -0.11 -0.12 -0.47 0.41 0.00 0.00 173.24 172.94 1lck s TYR 72 N -0.61 1.49 -0.25 2.43 5.04 -0.43 -4.92 117.35 120.09 1lck s TYR 72 Ca 0.46 -0.57 -0.06 0.00 -2.44 0.00 0.00 57.07 54.46 1lck s TYR 72 Cb -0.29 -1.10 -0.01 0.00 0.35 0.00 0.00 41.96 40.91 1lck s TYR 72 CO 0.35 -0.30 0.04 -2.00 -1.34 0.00 0.00 175.55 172.30 1lck s GLU 73 N 0.74 3.41 0.37 4.97 2.12 -1.26 -1.37 118.70 127.68 1lck s GLU 73 Ca -0.13 -0.63 -0.24 0.00 0.36 0.00 0.00 54.97 54.33 1lck s GLU 73 Cb -0.16 -3.24 -0.14 0.00 0.26 0.00 0.00 34.13 30.86 1lck s GLU 73 CO 0.03 -0.26 0.51 -2.30 -0.54 0.00 0.00 175.26 172.69 1lck n PRO 74 N 4.87 0.46 0.00 4.30 -0.02 -1.26 -4.95 135.00 138.39 1lck n PRO 74 Ca -0.16 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1lck n PRO 74 Cb 0.50 -1.37 0.00 0.00 -0.02 0.00 0.00 33.50 32.61 1lck n PRO 74 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1lck n SER 75 N 1.58 3.60 -4.93 2.55 7.64 -1.26 -5.07 113.62 117.73 1lck n SER 75 Ca 0.12 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.72 1lck n SER 75 Cb 0.36 0.10 -0.03 0.00 -1.01 0.00 0.00 64.21 63.63 1lck n SER 75 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1lck s HIS 76 N -1.85 3.49 -0.04 1.43 3.76 -1.26 -5.06 115.29 115.76 1lck s HIS 76 Ca 0.00 0.21 -0.29 0.00 -0.15 0.00 0.00 55.06 54.83 1lck s HIS 76 Cb 0.00 -1.74 -0.07 0.00 1.11 0.00 0.00 32.58 31.88 1lck s HIS 76 CO 0.00 0.51 1.96 0.34 -0.85 0.00 0.00 174.74 176.70 1lck s ASP 77 N -2.98 6.26 0.00 1.40 -1.08 -1.26 -1.42 116.67 117.59 1lck s ASP 77 Ca 0.36 2.39 0.00 0.00 -0.52 0.00 0.00 52.55 54.77 1lck s ASP 77 Cb -0.12 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.82 1lck s ASP 77 CO 0.28 -1.24 0.00 0.61 0.52 0.00 0.00 175.17 175.34 1lck n GLY 78 N 4.75 1.15 3.77 2.66 0.00 -1.26 -5.08 105.19 111.18 1lck n GLY 78 Ca 0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 1lck n GLY 78 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1lck s ASP 79 N -1.94 5.92 -0.22 1.61 1.01 -0.51 -1.93 116.67 120.63 1lck s ASP 79 Ca 0.00 2.38 -0.08 0.00 0.71 0.00 0.00 52.55 55.56 1lck s ASP 79 Cb 0.00 -2.61 -0.04 0.00 1.01 0.00 0.00 42.92 41.28 1lck s ASP 79 CO 0.00 -1.09 0.10 -0.22 0.21 0.00 0.00 175.17 174.16 1lck s LEU 80 N -3.23 3.82 0.47 1.23 2.96 -0.72 -4.71 118.68 118.50 1lck s LEU 80 Ca 0.66 0.02 -0.11 0.00 -0.22 0.00 0.00 54.13 54.49 1lck s LEU 80 Cb -0.30 -2.00 -0.06 0.00 0.50 0.00 0.00 46.19 44.33 1lck s LEU 80 CO 0.36 0.09 0.86 -0.83 -1.32 0.00 0.00 176.35 175.51 1lck s GLY 81 N 0.88 1.87 0.21 7.98 0.00 -1.26 -4.70 107.32 112.30 1lck s GLY 81 Ca 0.05 -0.14 -0.23 0.00 0.00 0.00 0.00 44.72 44.40 1lck s GLY 81 CO 0.03 0.07 0.83 -0.11 0.00 0.00 0.00 173.10 173.92 1lck s PHE 82 N -2.59 -0.18 0.21 1.90 -0.12 -0.47 -4.99 117.98 111.74 1lck s PHE 82 Ca 0.53 -0.20 0.07 0.00 -0.05 0.00 0.00 56.93 57.28 1lck s PHE 82 Cb -0.10 0.67 -0.04 0.00 -0.63 0.00 0.00 43.02 42.92 1lck s PHE 82 CO 0.36 -1.03 0.07 -2.00 -0.05 0.00 0.00 175.22 172.58 1lck s GLU 83 N -3.61 2.60 -0.07 1.99 2.56 -1.26 -1.31 118.70 119.60 1lck s GLU 83 Ca 0.11 -1.11 -0.32 0.00 0.00 0.00 0.00 54.97 53.66 1lck s GLU 83 Cb -0.04 -2.42 -0.10 0.00 2.00 0.00 0.00 34.13 33.57 1lck s GLU 83 CO 0.04 0.43 1.98 1.17 -0.56 0.00 0.00 175.26 178.32 1lck n LYS 84 N -0.57 2.39 -0.11 4.30 4.81 -1.24 -1.62 118.16 126.12 1lck n LYS 84 Ca -0.08 0.85 0.00 0.00 -0.87 0.00 0.00 58.31 58.20 1lck n LYS 84 Cb 0.56 -2.87 0.00 0.00 0.02 0.00 0.00 35.03 32.75 1lck n LYS 84 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1lck n GLY 85 N 4.75 0.66 3.74 3.14 0.00 0.16 -4.97 105.19 112.67 1lck n GLY 85 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 1lck n GLY 85 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1lck s GLU 86 N -0.89 4.65 -0.25 1.61 2.12 -0.64 -4.74 118.70 120.56 1lck s GLU 86 Ca 0.00 1.66 -0.21 0.00 0.36 0.00 0.00 54.97 56.77 1lck s GLU 86 Cb 0.00 -3.28 -0.02 0.00 0.26 0.00 0.00 34.13 31.09 1lck s GLU 86 CO 0.00 0.17 0.67 -0.65 -0.54 0.00 0.00 175.26 174.92 1lck s GLN 87 N -0.55 4.13 0.16 4.30 -0.21 -1.26 -1.00 119.66 125.22 1lck s GLN 87 Ca 0.47 0.63 0.10 0.00 0.02 0.00 0.00 55.36 56.59 1lck s GLN 87 Cb -0.28 -3.65 -0.04 0.00 1.00 0.00 0.00 33.01 30.04 1lck s GLN 87 CO 0.34 -0.43 -0.21 -0.51 -2.12 0.00 0.00 175.29 172.36 1lck s LEU 88 N 2.56 2.54 -0.07 2.90 1.43 -0.93 -0.64 118.68 126.46 1lck s LEU 88 Ca 0.28 -0.74 0.05 0.00 -1.03 0.00 0.00 54.13 52.69 1lck s LEU 88 Cb -0.15 -1.32 -0.00 0.00 0.03 0.00 0.00 46.19 44.74 1lck s LEU 88 CO 0.08 0.14 -0.23 0.00 0.23 0.00 0.00 176.35 176.57 1lck s ARG 89 N -2.45 2.60 -0.17 1.70 1.70 0.48 -1.86 118.95 120.95 1lck s ARG 89 Ca 0.19 -0.84 -0.25 0.00 -0.47 0.00 0.00 55.73 54.36 1lck s ARG 89 Cb -0.09 -2.10 -0.02 0.00 -0.57 0.00 0.00 34.95 32.17 1lck s ARG 89 CO 0.10 0.28 0.82 0.42 -1.08 0.00 0.00 175.30 175.83 1lck s ILE 90 N 0.08 4.89 -0.20 4.99 -1.09 -0.90 -0.52 121.20 128.45 1lck s ILE 90 Ca -0.10 1.61 0.03 0.00 -2.23 0.00 0.00 60.65 59.96 1lck s ILE 90 Cb -0.15 -4.13 -0.21 0.00 -1.58 0.00 0.00 42.46 36.39 1lck s ILE 90 CO 0.05 0.04 0.04 0.18 -1.23 0.00 0.00 174.94 174.02 1lck n LEU 91 N 5.17 2.29 -3.82 2.97 4.77 0.66 -4.83 117.00 124.21 1lck n LEU 91 Ca 0.04 0.01 -0.12 0.00 -0.03 0.00 0.00 56.01 55.91 1lck n LEU 91 Cb 0.49 -0.67 -0.13 0.00 -2.33 0.00 0.00 43.42 40.78 1lck n LEU 91 CO 0.48 0.81 -0.19 -1.61 -1.33 0.00 0.00 177.39 175.55 1lck s GLU 92 N -2.53 0.18 -0.74 3.23 2.02 -1.01 -4.96 118.70 114.89 1lck s GLU 92 Ca -0.26 0.22 0.03 0.00 0.02 0.00 0.00 54.97 54.98 1lck s GLU 92 Cb 0.08 0.08 0.33 0.00 0.10 0.00 0.00 34.13 34.73 1lck s GLU 92 CO 0.70 -0.02 1.26 1.04 0.02 0.00 0.00 175.26 178.25 1lck n GLN 93 N 3.01 4.03 -2.36 1.61 6.02 -1.26 0.04 117.38 128.48 1lck n GLN 93 Ca -0.13 -4.80 -0.42 0.00 -0.01 0.00 0.00 57.00 51.65 1lck n GLN 93 Cb 0.59 -2.32 -0.03 0.00 1.02 0.00 0.00 30.24 29.50 1lck n GLN 93 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1lck s SER 94 N -2.72 6.13 0.00 1.08 0.15 -1.25 -4.88 113.70 112.21 1lck s SER 94 Ca 0.45 0.43 0.00 0.00 0.70 0.00 0.00 55.95 57.53 1lck s SER 94 Cb 0.25 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 62.01 1lck s SER 94 CO -0.14 -1.68 0.00 0.61 1.20 0.00 0.00 173.24 173.24 1lck n GLY 95 N 5.24 0.40 0.00 9.45 0.00 -1.26 -2.24 105.19 116.78 1lck n GLY 95 Ca 0.14 0.29 0.06 0.00 0.00 0.00 0.00 46.02 46.51 1lck n GLY 95 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1lck n GLU 96 N 0.00 1.41 -3.92 1.61 1.02 -1.26 -4.77 120.64 114.72 1lck n GLU 96 Ca 0.00 -0.07 -0.30 0.00 -0.02 0.00 0.00 57.16 56.77 1lck n GLU 96 Cb 0.00 -1.22 -0.16 0.00 -0.02 0.00 0.00 31.44 30.04 1lck n GLU 96 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 1lck s TRP 97 N -2.61 2.21 0.17 -0.32 0.52 -0.95 -2.26 118.94 115.70 1lck s TRP 97 Ca -0.01 -1.59 -0.07 0.00 0.02 0.00 0.00 56.10 54.45 1lck s TRP 97 Cb 0.09 -1.51 -0.06 0.00 -1.15 0.00 0.00 33.47 30.84 1lck s TRP 97 CO 0.54 -0.74 0.45 -1.58 0.02 0.00 0.00 176.95 175.63 1lck s TRP 98 N 1.46 3.47 -0.17 -1.98 0.51 -0.90 -3.96 118.94 117.37 1lck s TRP 98 Ca -0.04 0.71 -0.24 0.00 -2.12 0.00 0.00 56.10 54.41 1lck s TRP 98 Cb -0.18 -2.12 -0.02 0.00 -0.81 0.00 0.00 33.47 30.34 1lck s TRP 98 CO -0.07 0.38 0.76 0.21 -0.51 0.00 0.00 176.95 177.73 1lck s LYS 99 N -2.63 4.28 0.13 4.98 2.47 0.11 -0.53 119.74 128.56 1lck s LYS 99 Ca 0.43 0.89 0.04 0.00 -1.56 0.00 0.00 55.97 55.77 1lck s LYS 99 Cb -0.12 -3.56 -0.04 0.00 -1.46 0.00 0.00 37.83 32.64 1lck s LYS 99 CO 0.23 -0.27 -0.10 0.00 0.16 0.00 0.00 175.35 175.36 1lck s ALA 100 N 1.97 1.38 -0.18 3.13 0.00 0.70 -0.24 121.76 128.51 1lck s ALA 100 Ca 0.35 -1.42 0.00 0.00 0.00 0.00 0.00 51.96 50.90 1lck s ALA 100 Cb -0.16 0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.01 1lck s ALA 100 CO 0.12 -0.08 -0.17 -1.14 0.00 0.00 0.00 175.76 174.49 1lck s GLN 101 N -3.50 3.06 0.33 0.00 0.74 0.32 -1.43 119.66 119.18 1lck s GLN 101 Ca 0.14 -0.80 -0.29 0.00 0.05 0.00 0.00 55.36 54.47 1lck s GLN 101 Cb 0.01 -2.64 -0.11 0.00 1.10 0.00 0.00 33.01 31.38 1lck s GLN 101 CO 0.00 -0.20 1.44 0.45 -0.55 0.00 0.00 175.29 176.44 1lck s SER 102 N 1.30 6.52 0.05 6.67 0.15 -0.41 -0.39 113.70 127.59 1lck s SER 102 Ca 0.05 2.87 0.26 0.00 0.70 0.00 0.00 55.95 59.83 1lck s SER 102 Cb -0.13 -2.65 0.67 0.00 -1.71 0.00 0.00 66.02 62.20 1lck s SER 102 CO -0.11 -0.75 1.55 0.18 1.20 0.00 0.00 173.24 175.31 1lck n LEU 103 N 1.08 0.45 0.00 3.45 4.77 0.19 -1.05 117.00 125.89 1lck n LEU 103 Ca 0.03 0.23 -0.19 0.00 -0.03 0.00 0.00 56.01 56.04 1lck n LEU 103 Cb 0.40 -0.30 -0.14 0.00 -2.33 0.00 0.00 43.42 41.05 1lck n LEU 103 CO 0.62 0.02 -0.06 0.74 -1.33 0.00 0.00 177.39 177.38 1lck h THR 104 N 0.00 1.39 0.00 -5.08 2.02 -1.92 -3.41 112.91 105.91 1lck h THR 104 Ca 0.00 -2.44 -0.29 0.00 0.77 0.00 0.00 66.41 64.46 1lck h THR 104 Cb 0.58 3.03 -0.05 0.00 -1.74 0.00 0.00 68.15 69.97 1lck h THR 104 CO 0.00 0.66 -2.08 0.35 0.37 0.00 0.00 175.52 174.82 1lck n THR 105 N -4.19 1.08 -0.53 3.16 -2.24 -1.25 -5.01 114.28 105.29 1lck n THR 105 Ca -0.18 -0.63 0.00 0.00 -2.27 0.00 0.00 64.05 60.97 1lck n THR 105 Cb 0.77 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 1lck n THR 105 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lck n GLY 106 N 2.10 0.76 3.77 3.38 0.00 -0.22 -5.06 105.19 109.93 1lck n GLY 106 Ca -0.27 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.36 1lck n GLY 106 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1lck s GLN 107 N -0.47 4.40 0.21 1.61 2.00 -1.26 -4.73 119.66 121.42 1lck s GLN 107 Ca 0.00 1.87 0.06 0.00 -2.00 0.00 0.00 55.36 55.29 1lck s GLN 107 Cb 0.00 -2.98 -0.04 0.00 0.80 0.00 0.00 33.01 30.79 1lck s GLN 107 CO 0.00 -0.03 0.13 -1.21 -0.50 0.00 0.00 175.29 173.69 1lck s GLU 108 N -1.82 2.80 0.00 1.67 2.02 -1.26 -1.28 118.70 120.83 1lck s GLU 108 Ca 0.50 -1.02 0.00 0.00 0.02 0.00 0.00 54.97 54.47 1lck s GLU 108 Cb -0.32 -2.54 0.00 0.00 0.10 0.00 0.00 34.13 31.37 1lck s GLU 108 CO 0.42 0.44 0.00 0.41 0.02 0.00 0.00 175.26 176.54 1lck n GLY 109 N -0.70 -2.67 3.75 -1.39 0.00 -0.51 -4.65 105.19 99.01 1lck n GLY 109 Ca -0.08 -1.30 -0.40 0.00 0.00 0.00 0.00 46.02 44.25 1lck n GLY 109 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1lck s PHE 110 N -2.12 3.74 0.16 1.61 0.08 -0.81 -0.22 117.98 120.42 1lck s PHE 110 Ca 0.00 1.42 0.10 0.00 0.12 0.00 0.00 56.93 58.57 1lck s PHE 110 Cb 0.00 -2.76 -0.04 0.00 -0.57 0.00 0.00 43.02 39.65 1lck s PHE 110 CO 0.00 0.32 -0.20 0.96 -0.10 0.00 0.00 175.22 176.20 1lck s ILE 111 N -0.20 2.65 -0.07 0.64 -4.36 0.31 -1.76 121.20 118.41 1lck s ILE 111 Ca 0.36 -1.77 -0.30 0.00 -0.26 0.00 0.00 60.65 58.68 1lck s ILE 111 Cb -0.20 -2.25 -0.03 0.00 1.25 0.00 0.00 42.46 41.23 1lck s ILE 111 CO 0.22 -0.03 1.20 -2.16 0.24 0.00 0.00 174.94 174.41 1lck s PRO 112 N -2.47 4.34 0.26 0.37 0.04 -1.26 -2.11 135.00 134.17 1lck s PRO 112 Ca 0.20 1.66 -0.02 0.00 0.04 0.00 0.00 61.00 62.88 1lck s PRO 112 Cb -0.09 -3.58 0.44 0.00 0.04 0.00 0.00 34.50 31.31 1lck s PRO 112 CO 0.10 -0.47 1.85 0.27 0.04 0.00 0.00 177.00 178.79 1lck h PHE 113 N 7.53 1.09 -0.09 0.56 -0.00 -1.80 -1.38 116.94 122.84 1lck h PHE 113 Ca -0.33 0.03 0.00 0.00 -0.00 0.00 0.00 57.97 57.67 1lck h PHE 113 Cb 1.15 -0.35 0.00 0.00 -0.00 0.00 0.00 35.95 36.75 1lck h PHE 113 CO 0.74 0.50 0.00 0.27 -0.00 0.00 0.00 178.31 179.82 1lck n ASN 114 N -4.60 0.47 -1.10 -0.68 6.94 -1.26 -2.80 115.26 112.22 1lck n ASN 114 Ca 0.16 -1.97 0.12 0.00 -0.02 0.00 0.00 54.58 52.87 1lck n ASN 114 Cb 0.25 -0.06 0.22 0.00 -2.36 0.00 0.00 39.78 37.83 1lck n ASN 114 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 1lck n PHE 115 N -0.26 0.43 -4.08 -2.53 3.01 -0.52 -4.96 117.46 108.55 1lck n PHE 115 Ca 0.04 -0.21 -0.10 0.00 1.01 0.00 0.00 57.45 58.19 1lck n PHE 115 Cb 0.08 0.00 -0.11 0.00 -0.01 0.00 0.00 39.48 39.44 1lck n PHE 115 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 1lck s VAL 116 N -1.57 0.38 0.09 -4.37 -7.23 -1.12 -1.10 120.40 105.48 1lck s VAL 116 Ca 0.37 -1.47 0.04 0.00 -1.81 0.00 0.00 61.98 59.11 1lck s VAL 116 Cb 0.22 -1.07 -0.03 0.00 0.56 0.00 0.00 36.38 36.06 1lck s VAL 116 CO 0.31 -0.72 -0.11 0.00 -0.31 0.00 0.00 175.10 174.28 1lck s ALA 117 N -2.72 1.13 -0.06 1.32 0.00 -0.88 -4.94 121.76 115.60 1lck s ALA 117 Ca -0.01 -1.16 -0.31 0.00 0.00 0.00 0.00 51.96 50.48 1lck s ALA 117 Cb -0.01 0.01 -0.09 0.00 0.00 0.00 0.00 23.12 23.04 1lck s ALA 117 CO -0.04 -0.01 2.03 1.63 0.00 0.00 0.00 175.76 179.37 1lck n LYS 118 N 0.66 2.47 -2.78 0.00 4.01 -1.26 -1.43 118.16 119.83 1lck n LYS 118 Ca -0.17 0.86 -0.41 0.00 -0.51 0.00 0.00 58.31 58.08 1lck n LYS 118 Cb 0.57 -2.98 0.01 0.00 -0.51 0.00 0.00 35.03 32.13 1lck n LYS 118 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1lck n ALA 119 N 8.46 5.73 -3.44 7.82 0.00 0.21 -4.84 120.51 134.45 1lck n ALA 119 Ca 0.24 -4.68 -0.18 0.00 0.00 0.00 0.00 53.44 48.81 1lck n ALA 119 Cb 0.39 -2.20 -0.16 0.00 0.00 0.00 0.00 19.45 17.48 1lck n ALA 119 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1lck s ASN 120 N -1.56 0.75 0.15 0.00 0.01 -1.25 -4.37 114.94 108.66 1lck s ASN 120 Ca 0.36 -0.10 -0.34 0.00 -0.71 0.00 0.00 52.86 52.08 1lck s ASN 120 Cb 0.14 -0.31 -0.16 0.00 0.41 0.00 0.00 41.25 41.33 1lck s ASN 120 CO -0.05 -0.03 1.13 -1.20 -1.51 0.00 0.00 177.10 175.44 1lck n SER 121 N 3.79 1.04 0.12 -1.22 7.64 -1.26 -4.90 113.62 118.82 1lck n SER 121 Ca -0.23 1.14 -0.02 0.00 1.01 0.00 0.00 58.87 60.77 1lck n SER 121 Cb 0.52 -1.16 0.18 0.00 -1.01 0.00 0.00 64.21 62.75 1lck n SER 121 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1lck h LEU 122 N 3.28 0.14 -1.96 -3.43 3.38 -1.99 -3.30 115.31 111.43 1lck h LEU 122 Ca -0.43 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.46 1lck h LEU 122 Cb 1.36 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.07 1lck h LEU 122 CO 0.69 0.66 -0.02 -0.08 0.09 0.00 0.00 178.44 179.78 1lck h GLU 123 N 0.10 0.00 0.00 1.13 4.81 -1.90 -0.30 114.58 118.41 1lck h GLU 123 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1lck h GLU 123 Cb 1.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.38 1lck h GLU 123 CO 0.08 0.02 0.00 -2.30 -0.73 0.00 0.00 179.01 176.08 1lck n PRO 124 N -4.51 0.08 -3.00 0.92 -0.02 -1.24 -4.85 135.00 122.37 1lck n PRO 124 Ca -0.03 0.37 -0.39 0.00 -2.02 0.00 0.00 63.50 61.42 1lck n PRO 124 Cb 0.11 -1.66 -0.06 0.00 -0.02 0.00 0.00 33.50 31.87 1lck n PRO 124 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1lck s GLU 125 N -3.15 4.53 0.36 -0.52 0.41 -0.13 -4.97 118.70 115.24 1lck s GLU 125 Ca 0.05 1.12 0.06 0.00 -0.41 0.00 0.00 54.97 55.78 1lck s GLU 125 Cb 0.08 -3.27 0.68 0.00 -1.78 0.00 0.00 34.13 29.84 1lck s GLU 125 CO 0.27 0.56 1.91 -1.35 -0.49 0.00 0.00 175.26 176.16 1lck h PRO 126 N 4.44 0.47 0.00 0.39 0.11 -1.88 -2.14 132.00 133.38 1lck h PRO 126 Ca -0.47 -0.09 0.00 0.00 0.11 0.00 0.00 66.00 65.55 1lck h PRO 126 Cb 1.21 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1lck h PRO 126 CO 0.66 0.49 -0.29 -2.67 -0.21 0.00 0.00 178.00 175.98 1lck n TRP 127 N -4.31 0.58 -3.13 0.65 4.27 -1.26 -4.62 117.44 109.62 1lck n TRP 127 Ca 0.01 0.17 -0.43 0.00 -3.89 0.00 0.00 57.50 53.36 1lck n TRP 127 Cb 0.22 -0.71 -0.06 0.00 -1.36 0.00 0.00 31.31 29.40 1lck n TRP 127 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 1lck s PHE 128 N -3.10 3.04 -1.11 -2.67 5.36 -0.81 -0.87 117.98 117.82 1lck s PHE 128 Ca 0.09 -0.42 -0.09 0.00 -0.96 0.00 0.00 56.93 55.55 1lck s PHE 128 Cb 0.14 -3.52 0.28 0.00 -0.34 0.00 0.00 43.02 39.58 1lck s PHE 128 CO 0.65 -1.02 1.10 -0.06 -1.46 0.00 0.00 175.22 174.43 1lck s PHE 129 N 2.74 4.27 0.00 10.12 0.08 0.62 -4.88 117.98 130.93 1lck s PHE 129 Ca 0.17 -2.71 0.00 0.00 0.12 0.00 0.00 56.93 54.52 1lck s PHE 129 Cb -0.18 -3.82 0.00 0.00 -0.57 0.00 0.00 43.02 38.45 1lck s PHE 129 CO 0.14 -0.94 0.13 1.17 -0.10 0.00 0.00 175.22 175.61 1lck n LYS 130 N 2.68 0.00 -1.80 0.44 3.00 -1.26 -2.93 118.16 118.29 1lck n LYS 130 Ca 0.24 0.13 -0.35 0.00 -0.00 0.00 0.00 58.31 58.33 1lck n LYS 130 Cb 0.39 -0.23 0.05 0.00 0.00 0.00 0.00 35.03 35.24 1lck n LYS 130 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 1lck n ASN 131 N -1.16 6.91 -4.85 3.14 0.23 -1.26 -3.45 115.26 114.82 1lck n ASN 131 Ca 0.00 -3.80 -0.22 0.00 -0.53 0.00 0.00 54.58 50.04 1lck n ASN 131 Cb 0.00 -0.87 -0.04 0.00 -2.08 0.00 0.00 39.78 36.79 1lck n ASN 131 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 1lck s LEU 132 N -3.86 3.88 0.06 -4.53 1.02 -1.15 -5.05 118.68 109.04 1lck s LEU 132 Ca 0.56 -0.22 0.09 0.00 0.02 0.00 0.00 54.13 54.58 1lck s LEU 132 Cb 0.46 -2.41 -0.03 0.00 0.02 0.00 0.00 46.19 44.22 1lck s LEU 132 CO -0.19 -0.06 -0.25 -0.94 0.02 0.00 0.00 176.35 174.93 1lck s SER 133 N -3.87 2.98 0.18 2.29 1.04 -1.26 -4.53 113.70 110.52 1lck s SER 133 Ca 0.33 -0.61 -0.18 0.00 0.48 0.00 0.00 55.95 55.98 1lck s SER 133 Cb -0.08 -0.25 0.13 0.00 0.10 0.00 0.00 66.02 65.92 1lck s SER 133 CO 0.26 0.21 1.30 -1.14 0.98 0.00 0.00 173.24 174.84 1lck n ARG 134 N 1.60 -0.25 0.22 4.02 0.63 -1.26 -0.62 116.66 121.01 1lck n ARG 134 Ca -0.17 1.29 0.12 0.00 -0.92 0.00 0.00 57.85 58.16 1lck n ARG 134 Cb 0.53 -1.90 0.26 0.00 0.45 0.00 0.00 32.46 31.79 1lck n ARG 134 CO 0.00 0.00 0.00 1.57 -2.51 0.00 0.00 177.63 176.69 1lck h LYS 135 N 0.00 0.00 0.06 -0.14 2.10 -1.99 -2.93 116.57 113.67 1lck h LYS 135 Ca 0.25 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.74 1lck h LYS 135 Cb 0.46 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.80 1lck h LYS 135 CO -0.82 0.05 -0.66 -0.44 -2.00 0.00 0.00 179.45 175.58 1lck h ASP 136 N 0.00 0.47 -0.98 7.07 5.19 -1.29 -3.10 116.42 123.79 1lck h ASP 136 Ca -0.00 -0.85 0.26 0.00 -0.62 0.00 0.00 57.03 55.81 1lck h ASP 136 Cb 0.94 -0.15 -0.06 0.00 0.18 0.00 0.00 39.33 40.24 1lck h ASP 136 CO 0.01 1.28 0.67 0.00 -3.12 0.00 0.00 179.24 178.07 1lck h ALA 137 N 0.20 2.54 0.00 3.45 0.00 -1.07 0.79 119.26 125.17 1lck h ALA 137 Ca -0.10 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 1lck h ALA 137 Cb 1.44 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.24 1lck h ALA 137 CO 0.13 -0.85 -0.68 0.93 0.00 0.00 0.00 179.25 178.77 1lck h GLU 138 N 0.22 0.00 0.11 0.00 5.08 -1.55 -2.10 114.58 116.34 1lck h GLU 138 Ca 0.50 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.58 1lck h GLU 138 Cb 1.58 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.82 1lck h GLU 138 CO -0.13 0.68 -1.44 0.00 -1.00 0.00 0.00 179.01 177.12 1lck h ARG 139 N 0.00 0.23 -0.98 2.33 -0.00 0.33 -2.58 114.38 113.72 1lck h ARG 139 Ca -0.01 -0.40 0.23 0.00 -0.50 0.00 0.00 59.98 59.31 1lck h ARG 139 Cb 1.22 0.15 -0.18 0.00 0.00 0.00 0.00 29.97 31.15 1lck h ARG 139 CO 0.09 1.19 -0.09 0.37 0.00 0.00 0.00 179.97 181.53 1lck h GLN 140 N -0.31 0.01 0.00 0.04 5.75 0.16 -0.04 115.11 120.71 1lck h GLN 140 Ca -0.31 -0.00 -0.14 0.00 -0.15 0.00 0.00 58.65 58.04 1lck h GLN 140 Cb 1.76 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 30.28 1lck h GLN 140 CO 0.05 0.00 -0.68 -0.07 -2.65 0.00 0.00 178.83 175.48 1lck h LEU 141 N 0.01 0.00 0.00 -2.39 3.38 -1.47 -3.29 115.31 111.54 1lck h LEU 141 Ca 0.54 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.51 1lck h LEU 141 Cb 0.99 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.74 1lck h LEU 141 CO -0.95 0.68 -0.24 0.18 0.09 0.00 0.00 178.44 178.20 1lck n LEU 142 N -3.41 0.51 -4.56 1.67 4.77 -0.14 -4.65 117.00 111.17 1lck n LEU 142 Ca 0.00 0.37 -0.37 0.00 -0.03 0.00 0.00 56.01 55.98 1lck n LEU 142 Cb 0.75 -0.32 0.07 0.00 -2.33 0.00 0.00 43.42 41.59 1lck n LEU 142 CO 0.42 -0.05 0.38 0.00 -1.33 0.00 0.00 177.39 176.82 1lck n ALA 143 N -1.67 -0.49 -1.70 -1.18 0.00 -0.51 -5.00 120.51 109.96 1lck n ALA 143 Ca 0.05 -0.12 -0.44 0.00 0.00 0.00 0.00 53.44 52.94 1lck n ALA 143 Cb 0.39 -2.02 -0.03 0.00 0.00 0.00 0.00 19.45 17.79 1lck n ALA 143 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1lck n PRO 144 N -1.13 2.42 0.00 0.00 -0.04 -1.26 -3.64 135.00 131.34 1lck n PRO 144 Ca 0.13 0.87 0.00 0.00 -0.04 0.00 0.00 63.50 64.45 1lck n PRO 144 Cb 0.49 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.32 1lck n PRO 144 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1lck n GLY 145 N 2.83 1.48 3.59 0.55 0.00 -1.26 -5.08 105.19 107.31 1lck n GLY 145 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 1lck n GLY 145 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1lck n ASN 146 N 0.00 2.93 -3.37 1.61 3.02 -1.24 -4.72 115.26 113.50 1lck n ASN 146 Ca 0.00 -2.93 -0.06 0.00 -0.03 0.00 0.00 54.58 51.56 1lck n ASN 146 Cb 0.00 0.10 0.01 0.00 -0.61 0.00 0.00 39.78 39.28 1lck n ASN 146 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1lck s THR 147 N -2.67 0.00 0.27 3.41 2.01 -1.26 -5.06 115.64 112.33 1lck s THR 147 Ca 0.19 -0.81 -0.31 0.00 0.31 0.00 0.00 61.69 61.07 1lck s THR 147 Cb -0.01 -2.57 -0.12 0.00 0.01 0.00 0.00 72.50 69.81 1lck s THR 147 CO 0.12 0.00 1.60 1.41 -0.69 0.00 0.00 174.62 177.06 1lck n HIS 148 N -0.56 2.75 0.00 4.92 8.25 -1.26 -1.93 115.22 127.39 1lck n HIS 148 Ca -0.06 0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.63 1lck n HIS 148 Cb 0.60 -2.60 0.00 0.00 1.12 0.00 0.00 29.99 29.11 1lck n HIS 148 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lck n GLY 149 N 2.57 1.33 3.73 -1.41 0.00 -0.61 -4.82 105.19 105.99 1lck n GLY 149 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1lck n GLY 149 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1lck s SER 150 N -1.72 6.96 0.19 1.61 0.01 -0.81 -0.13 113.70 119.82 1lck s SER 150 Ca 0.00 2.32 -0.03 0.00 1.31 0.00 0.00 55.95 59.54 1lck s SER 150 Cb 0.00 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.59 1lck s SER 150 CO 0.00 -0.49 0.18 0.72 0.41 0.00 0.00 173.24 174.06 1lck s PHE 151 N 0.24 0.94 0.03 2.43 -0.71 -0.12 -0.58 117.98 120.21 1lck s PHE 151 Ca 0.56 -1.22 -0.28 0.00 -1.04 0.00 0.00 56.93 54.96 1lck s PHE 151 Cb -0.35 -0.40 0.07 0.00 -1.21 0.00 0.00 43.02 41.13 1lck s PHE 151 CO 0.36 -0.68 0.66 -0.48 -1.34 0.00 0.00 175.22 173.74 1lck s LEU 152 N -3.11 -0.61 -0.01 -1.99 0.05 0.82 -1.03 118.68 112.80 1lck s LEU 152 Ca 0.33 0.43 0.05 0.00 0.05 0.00 0.00 54.13 54.98 1lck s LEU 152 Cb 0.06 2.53 -0.03 0.00 -2.05 0.00 0.00 46.19 46.70 1lck s LEU 152 CO 0.09 -0.74 -0.14 -0.63 -0.55 0.00 0.00 176.35 174.38 1lck s ILE 153 N -2.19 3.06 -0.04 1.48 1.01 -0.05 -0.15 121.20 124.32 1lck s ILE 153 Ca -0.06 -0.89 -0.10 0.00 0.00 0.00 0.00 60.65 59.60 1lck s ILE 153 Cb -0.00 -2.25 0.02 0.00 0.01 0.00 0.00 42.46 40.24 1lck s ILE 153 CO 0.01 0.47 0.24 0.00 0.00 0.00 0.00 174.94 175.66 1lck s ARG 154 N -1.08 0.48 0.27 2.79 1.70 -0.71 -0.27 118.95 122.13 1lck s ARG 154 Ca 0.13 -0.06 -0.30 0.00 -0.47 0.00 0.00 55.73 55.04 1lck s ARG 154 Cb -0.11 0.21 -0.11 0.00 -0.57 0.00 0.00 34.95 34.38 1lck s ARG 154 CO 0.03 -0.11 1.49 -1.21 -1.08 0.00 0.00 175.30 174.43 1lck s GLU 155 N -0.83 4.21 -0.04 3.89 2.02 -1.22 -0.61 118.70 126.12 1lck s GLU 155 Ca -0.09 2.41 -0.30 0.00 0.02 0.00 0.00 54.97 57.01 1lck s GLU 155 Cb -0.05 -3.07 -0.05 0.00 0.10 0.00 0.00 34.13 31.06 1lck s GLU 155 CO 0.02 -0.49 1.54 0.45 0.02 0.00 0.00 175.26 176.80 1lck s SER 156 N 0.37 6.74 0.18 -0.19 0.15 -0.63 -4.68 113.70 115.64 1lck s SER 156 Ca 0.60 2.17 0.00 0.00 0.70 0.00 0.00 55.95 59.42 1lck s SER 156 Cb -0.44 -2.54 0.08 0.00 -1.71 0.00 0.00 66.02 61.40 1lck s SER 156 CO 0.46 -0.85 1.44 1.05 1.20 0.00 0.00 173.24 176.54 1lck h GLU 157 N 8.79 0.34 0.00 5.44 4.11 -1.91 -3.38 114.58 127.97 1lck h GLU 157 Ca -0.38 -0.29 0.00 0.00 0.07 0.00 0.00 59.36 58.77 1lck h GLU 157 Cb 1.17 0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1lck h GLU 157 CO 0.94 0.94 0.00 -1.13 0.07 0.00 0.00 179.01 179.83 1lck n SER 158 N -3.81 0.00 -4.57 3.06 3.41 -1.26 -4.49 113.62 105.96 1lck n SER 158 Ca -0.04 0.01 -0.17 0.00 -0.26 0.00 0.00 58.87 58.41 1lck n SER 158 Cb 0.71 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.58 1lck n SER 158 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1lck s THR 159 N -0.02 3.14 0.61 6.66 2.01 -1.26 -4.92 115.64 121.86 1lck s THR 159 Ca 0.00 -0.16 -0.19 0.00 0.31 0.00 0.00 61.69 61.64 1lck s THR 159 Cb 0.00 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.91 1lck s THR 159 CO 0.00 -0.29 1.30 0.00 -0.69 0.00 0.00 174.62 174.94 1lck n ALA 160 N 17.71 1.25 -0.11 7.40 0.00 -1.26 -2.23 120.51 143.26 1lck n ALA 160 Ca 0.44 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.93 1lck n ALA 160 Cb 0.45 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.58 1lck n ALA 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lck n GLY 161 N 0.89 1.44 0.71 0.00 0.00 -1.26 -5.02 105.19 101.95 1lck n GLY 161 Ca 0.14 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.10 1lck n GLY 161 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1lck n SER 162 N 0.00 1.88 -3.94 1.61 2.88 -0.95 -5.01 113.62 110.09 1lck n SER 162 Ca 0.00 -1.40 -0.10 0.00 -1.33 0.00 0.00 58.87 56.04 1lck n SER 162 Cb 0.00 0.04 -0.10 0.00 -0.75 0.00 0.00 64.21 63.39 1lck n SER 162 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 1lck s PHE 163 N -1.00 0.19 0.23 0.66 0.08 -1.26 -1.60 117.98 115.28 1lck s PHE 163 Ca 0.02 -0.43 0.04 0.00 0.12 0.00 0.00 56.93 56.69 1lck s PHE 163 Cb -0.00 -0.15 -0.05 0.00 -0.57 0.00 0.00 43.02 42.25 1lck s PHE 163 CO 0.02 -0.27 -0.03 -1.12 -0.10 0.00 0.00 175.22 173.72 1lck s SER 164 N -1.65 2.02 -0.17 1.36 0.01 0.22 -1.72 113.70 113.76 1lck s SER 164 Ca -0.12 -1.18 0.01 0.00 1.31 0.00 0.00 55.95 55.96 1lck s SER 164 Cb -0.06 -0.03 0.01 0.00 0.21 0.00 0.00 66.02 66.15 1lck s SER 164 CO -0.01 -0.45 -0.19 -0.22 0.41 0.00 0.00 173.24 172.78 1lck s LEU 165 N -3.32 2.23 -0.23 2.44 2.96 -0.49 -1.73 118.68 120.54 1lck s LEU 165 Ca 0.27 -0.60 -0.02 0.00 -0.22 0.00 0.00 54.13 53.56 1lck s LEU 165 Cb 0.05 -1.50 0.01 0.00 0.50 0.00 0.00 46.19 45.25 1lck s LEU 165 CO 0.08 0.03 -0.07 -0.44 -1.32 0.00 0.00 176.35 174.63 1lck s SER 166 N 1.12 4.15 -0.09 3.68 0.01 0.79 -1.23 113.70 122.13 1lck s SER 166 Ca 0.01 -0.66 0.02 0.00 1.31 0.00 0.00 55.95 56.63 1lck s SER 166 Cb -0.14 -1.67 0.01 0.00 0.21 0.00 0.00 66.02 64.43 1lck s SER 166 CO -0.08 -0.07 -0.16 0.54 0.41 0.00 0.00 173.24 173.88 1lck s VAL 167 N 1.38 1.51 0.26 3.43 0.11 -0.81 -0.13 120.40 126.15 1lck s VAL 167 Ca 0.03 -0.68 -0.30 0.00 -2.93 0.00 0.00 61.98 58.11 1lck s VAL 167 Cb -0.15 -1.36 -0.09 0.00 -1.53 0.00 0.00 36.38 33.24 1lck s VAL 167 CO -0.05 0.44 1.18 -0.60 -3.33 0.00 0.00 175.10 172.74 1lck s ARG 168 N 0.75 4.53 0.06 1.54 3.52 0.25 -1.08 118.95 128.52 1lck s ARG 168 Ca -0.12 1.91 0.01 0.00 -0.13 0.00 0.00 55.73 57.41 1lck s ARG 168 Cb -0.16 -3.18 -0.03 0.00 -1.56 0.00 0.00 34.95 30.02 1lck s ARG 168 CO 0.02 0.03 -0.06 0.34 -0.81 0.00 0.00 175.30 174.82 1lck s ASP 169 N -0.44 0.78 0.04 -2.12 2.15 0.66 -1.57 116.67 116.17 1lck s ASP 169 Ca 0.48 -0.74 0.01 0.00 0.43 0.00 0.00 52.55 52.73 1lck s ASP 169 Cb -0.34 0.09 -0.04 0.00 -0.30 0.00 0.00 42.92 42.33 1lck s ASP 169 CO 0.42 -0.36 0.12 0.12 -0.17 0.00 0.00 175.17 175.30 1lck s PHE 170 N -2.44 3.32 -0.20 -5.34 2.19 -1.26 -1.84 117.98 112.40 1lck s PHE 170 Ca -0.02 0.18 -0.18 0.00 0.33 0.00 0.00 56.93 57.23 1lck s PHE 170 Cb -0.03 -1.70 0.05 0.00 -1.31 0.00 0.00 43.02 40.03 1lck s PHE 170 CO -0.03 0.56 0.54 0.34 1.83 0.00 0.00 175.22 178.45 1lck s ASP 171 N -2.19 -0.57 0.17 6.13 2.15 -0.24 -4.95 116.67 117.18 1lck s ASP 171 Ca 0.29 1.08 -0.31 0.00 0.43 0.00 0.00 52.55 54.04 1lck s ASP 171 Cb -0.12 1.09 -0.09 0.00 -0.30 0.00 0.00 42.92 43.50 1lck s ASP 171 CO 0.21 -0.19 1.46 0.00 -0.17 0.00 0.00 175.17 176.48 1lck s GLN 172 N 0.34 4.27 0.00 4.34 0.00 -1.26 -3.62 119.66 123.74 1lck s GLN 172 Ca -0.00 2.23 0.00 0.00 -0.00 0.00 0.00 55.36 57.59 1lck s GLN 172 Cb -0.04 -3.18 0.00 0.00 0.00 0.00 0.00 33.01 29.79 1lck s GLN 172 CO -0.00 -0.48 0.00 -1.71 0.00 0.00 0.00 175.29 173.10 1lck n ASN 173 N 3.48 0.00 -3.92 12.60 2.85 -1.26 -4.92 115.26 124.09 1lck n ASN 173 Ca 0.11 0.00 -0.38 0.00 -0.11 0.00 0.00 54.58 54.20 1lck n ASN 173 Cb 0.40 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 41.35 1lck n ASN 173 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1lck n GLN 174 N 0.00 1.23 0.00 1.20 6.02 -1.26 -4.85 117.38 119.72 1lck n GLN 174 Ca 0.00 -1.88 0.00 0.00 -0.01 0.00 0.00 57.00 55.11 1lck n GLN 174 Cb 0.00 -3.13 0.00 0.00 1.02 0.00 0.00 30.24 28.13 1lck n GLN 174 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1lck n GLY 175 N 5.02 0.00 2.76 1.08 0.00 -1.24 -3.97 105.19 108.85 1lck n GLY 175 Ca 0.47 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.20 1lck n GLY 175 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1lck s GLU 176 N 0.00 1.16 0.60 1.61 2.02 -1.26 -1.08 118.70 121.74 1lck s GLU 176 Ca 0.00 -1.72 -0.16 0.00 0.02 0.00 0.00 54.97 53.11 1lck s GLU 176 Cb 0.00 -2.37 -0.03 0.00 0.10 0.00 0.00 34.13 31.83 1lck s GLU 176 CO 0.00 -1.08 1.07 0.14 0.02 0.00 0.00 175.26 175.41 1lck s VAL 177 N 0.79 3.70 -0.32 2.63 -7.23 -0.77 -4.87 120.40 114.34 1lck s VAL 177 Ca 0.14 0.82 -0.00 0.00 -1.81 0.00 0.00 61.98 61.12 1lck s VAL 177 Cb -0.22 -3.34 0.07 0.00 0.56 0.00 0.00 36.38 33.45 1lck s VAL 177 CO -0.09 -0.46 0.02 -0.69 -0.31 0.00 0.00 175.10 173.57 1lck s VAL 178 N -2.40 2.82 -0.05 1.32 1.01 -1.26 -0.25 120.40 121.59 1lck s VAL 178 Ca 0.64 -1.64 -0.17 0.00 0.00 0.00 0.00 61.98 60.81 1lck s VAL 178 Cb -0.17 -2.73 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 1lck s VAL 178 CO 0.37 -0.24 0.46 -0.54 0.00 0.00 0.00 175.10 175.14 1lck s LYS 179 N 1.17 4.16 -0.08 2.72 1.02 -0.24 -4.88 119.74 123.61 1lck s LYS 179 Ca -0.02 0.46 -0.01 0.00 0.02 0.00 0.00 55.97 56.42 1lck s LYS 179 Cb -0.20 -3.33 -0.03 0.00 -0.52 0.00 0.00 37.83 33.75 1lck s LYS 179 CO -0.03 0.43 -0.01 -1.01 -0.92 0.00 0.00 175.35 173.81 1lck s HIS 180 N -0.27 3.13 0.20 3.18 3.76 -1.26 -1.92 115.29 122.11 1lck s HIS 180 Ca 0.25 0.17 0.07 0.00 -0.15 0.00 0.00 55.06 55.40 1lck s HIS 180 Cb -0.16 -1.77 -0.05 0.00 1.11 0.00 0.00 32.58 31.71 1lck s HIS 180 CO 0.12 0.45 -0.13 0.71 -0.85 0.00 0.00 174.74 175.05 1lck s TYR 181 N -0.89 1.65 -0.24 1.40 1.51 -0.36 -4.97 117.35 115.44 1lck s TYR 181 Ca 0.14 -0.61 -0.07 0.00 -1.01 0.00 0.00 57.07 55.51 1lck s TYR 181 Cb -0.11 -0.79 -0.03 0.00 -0.11 0.00 0.00 41.96 40.92 1lck s TYR 181 CO 0.03 0.31 0.06 0.21 -1.11 0.00 0.00 175.55 175.05 1lck s LYS 182 N -3.67 3.65 -0.49 -0.62 2.36 -1.26 -1.40 119.74 118.31 1lck s LYS 182 Ca 0.22 -0.48 -0.24 0.00 -2.55 0.00 0.00 55.97 52.92 1lck s LYS 182 Cb 0.00 -3.29 0.03 0.00 -1.05 0.00 0.00 37.83 33.52 1lck s LYS 182 CO 0.06 -0.16 0.86 0.42 1.55 0.00 0.00 175.35 178.08 1lck s ILE 183 N 1.53 4.54 0.27 5.43 1.01 -0.70 -4.62 121.20 128.66 1lck s ILE 183 Ca 0.06 0.38 -0.29 0.00 0.00 0.00 0.00 60.65 60.80 1lck s ILE 183 Cb -0.15 -4.42 -0.09 0.00 0.01 0.00 0.00 42.46 37.81 1lck s ILE 183 CO 0.03 -0.88 0.95 -0.13 0.00 0.00 0.00 174.94 174.91 1lck s ARG 184 N 3.57 4.75 0.23 2.79 1.81 0.02 -4.26 118.95 127.86 1lck s ARG 184 Ca 0.30 1.46 -0.24 0.00 -1.72 0.00 0.00 55.73 55.53 1lck s ARG 184 Cb -0.12 -3.11 -0.09 0.00 -0.45 0.00 0.00 34.95 31.18 1lck s ARG 184 CO 0.21 0.42 0.81 -0.80 -0.68 0.00 0.00 175.30 175.26 1lck s ASN 185 N -1.31 7.29 0.57 0.23 -0.87 -1.26 -1.30 114.94 118.29 1lck s ASN 185 Ca 0.44 1.64 0.09 0.00 -1.57 0.00 0.00 52.86 53.46 1lck s ASN 185 Cb -0.24 -2.50 0.10 0.00 -0.02 0.00 0.00 41.25 38.59 1lck s ASN 185 CO 0.30 0.09 0.79 -0.11 -2.57 0.00 0.00 177.10 175.59 1lck n LEU 186 N 1.07 0.00 -4.65 0.60 7.94 -0.94 -4.92 117.00 116.10 1lck n LEU 186 Ca -0.03 -2.45 -0.43 0.00 -1.11 0.00 0.00 56.01 51.99 1lck n LEU 186 Cb 0.50 -0.42 -0.02 0.00 0.53 0.00 0.00 43.42 44.00 1lck n LEU 186 CO 0.45 -0.71 0.93 -1.81 -1.11 0.00 0.00 177.39 175.14 1lck s ASP 187 N -4.53 6.99 1.98 1.96 1.01 -1.26 -4.78 116.67 118.04 1lck s ASP 187 Ca 0.60 1.18 0.00 0.00 0.71 0.00 0.00 52.55 55.03 1lck s ASP 187 Cb -0.05 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.34 1lck s ASP 187 CO 0.38 -0.78 0.00 -3.20 0.21 0.00 0.00 175.17 171.78 1lck n ASN 188 N 6.62 0.00 -4.55 0.27 2.85 -1.26 -4.45 115.26 114.74 1lck n ASN 188 Ca 0.12 0.00 -0.29 0.00 -0.11 0.00 0.00 54.58 54.29 1lck n ASN 188 Cb 0.47 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.44 1lck n ASN 188 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 1lck s GLY 189 N 0.00 -0.30 0.00 8.20 0.00 -1.26 -4.84 107.32 109.12 1lck s GLY 189 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 44.72 44.14 1lck s GLY 189 CO 0.00 3.90 0.00 0.61 0.00 0.00 0.00 173.10 177.61 1lck n GLY 190 N 6.27 2.08 3.17 0.20 0.00 -1.09 -4.65 105.19 111.17 1lck n GLY 190 Ca 0.36 -0.33 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 1lck n GLY 190 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1lck s PHE 191 N -1.84 0.23 0.20 1.61 0.08 0.23 -2.21 117.98 116.27 1lck s PHE 191 Ca 0.00 -0.66 -0.22 0.00 0.12 0.00 0.00 56.93 56.17 1lck s PHE 191 Cb 0.00 -0.14 0.05 0.00 -0.57 0.00 0.00 43.02 42.36 1lck s PHE 191 CO 0.00 -0.48 0.63 1.52 -0.10 0.00 0.00 175.22 176.79 1lck s TYR 192 N -3.68 -0.41 -0.06 0.36 -0.85 -0.42 -0.09 117.35 112.20 1lck s TYR 192 Ca 0.04 0.12 -0.01 0.00 -0.52 0.00 0.00 57.07 56.70 1lck s TYR 192 Cb 0.05 0.59 -0.03 0.00 0.38 0.00 0.00 41.96 42.94 1lck s TYR 192 CO -0.10 -0.97 -0.07 -0.89 -1.52 0.00 0.00 175.55 172.01 1lck n ILE 193 N -0.40 0.35 -4.41 -3.49 5.41 -1.26 -0.80 119.36 114.76 1lck n ILE 193 Ca -0.13 -0.12 -0.34 0.00 1.00 0.00 0.00 62.75 63.17 1lck n ILE 193 Cb 0.63 -1.09 -0.13 0.00 -0.71 0.00 0.00 39.64 38.34 1lck n ILE 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1lck s SER 194 N -5.02 4.67 0.00 4.38 0.15 -1.26 -4.93 113.70 111.69 1lck s SER 194 Ca -0.09 -0.17 0.00 0.00 0.70 0.00 0.00 55.95 56.39 1lck s SER 194 Cb 0.03 -1.76 0.00 0.00 -1.71 0.00 0.00 66.02 62.58 1lck s SER 194 CO 0.13 0.15 0.90 -0.81 1.20 0.00 0.00 173.24 174.81 1lck n PRO 195 N 3.62 0.00 0.15 5.44 -0.04 -1.26 -1.35 135.00 141.56 1lck n PRO 195 Ca -0.17 0.40 -0.00 0.00 -0.04 0.00 0.00 63.50 63.68 1lck n PRO 195 Cb 0.52 -1.52 0.21 0.00 -0.04 0.00 0.00 33.50 32.68 1lck n PRO 195 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1lck h ARG 196 N 0.00 0.01 -4.35 0.54 3.08 -2.03 -3.42 114.38 108.21 1lck h ARG 196 Ca 0.00 -0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.58 1lck h ARG 196 Cb 0.04 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 29.76 1lck h ARG 196 CO 0.00 0.56 -0.79 0.42 -1.07 0.00 0.00 179.97 179.09 1lck s ILE 197 N -3.76 0.86 0.11 2.04 1.01 -0.46 -5.15 121.20 115.86 1lck s ILE 197 Ca -0.02 -0.33 0.10 0.00 0.00 0.00 0.00 60.65 60.40 1lck s ILE 197 Cb 0.13 -0.81 -0.04 0.00 0.01 0.00 0.00 42.46 41.75 1lck s ILE 197 CO 0.75 0.29 -0.22 0.42 0.00 0.00 0.00 174.94 176.19 1lck s THR 198 N 0.69 2.60 0.06 2.92 -4.23 -1.26 -4.49 115.64 111.92 1lck s THR 198 Ca -0.12 -1.56 0.05 0.00 -1.18 0.00 0.00 61.69 58.88 1lck s THR 198 Cb -0.14 -2.16 -0.03 0.00 1.34 0.00 0.00 72.50 71.51 1lck s THR 198 CO 0.02 0.13 -0.15 -0.36 -0.54 0.00 0.00 174.62 173.73 1lck s PHE 199 N -1.08 1.27 0.14 3.99 0.08 0.88 -4.94 117.98 118.32 1lck s PHE 199 Ca 0.16 -0.41 0.10 0.00 0.12 0.00 0.00 56.93 56.91 1lck s PHE 199 Cb -0.10 -0.73 0.10 0.00 -0.57 0.00 0.00 43.02 41.71 1lck s PHE 199 CO 0.08 0.06 1.46 -1.00 -0.10 0.00 0.00 175.22 175.71 1lck h PRO 200 N 4.59 0.00 -3.56 0.24 0.13 -1.85 0.65 132.00 132.20 1lck h PRO 200 Ca -0.40 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.68 1lck h PRO 200 Cb 1.18 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.24 1lck h PRO 200 CO 0.42 0.75 -0.05 0.20 -0.23 0.00 0.00 178.00 179.09 1lck s GLY 201 N -4.56 0.52 0.29 1.56 0.00 -1.26 -2.66 107.32 101.20 1lck s GLY 201 Ca 0.00 -0.84 0.03 0.00 0.00 0.00 0.00 44.72 43.91 1lck s GLY 201 CO 0.78 -0.56 1.74 1.41 0.00 0.00 0.00 173.10 176.47 1lck h LEU 202 N 2.19 0.47 -1.49 0.66 3.38 -1.96 -2.35 115.31 116.22 1lck h LEU 202 Ca -0.26 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 57.61 1lck h LEU 202 Cb 1.25 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.84 1lck h LEU 202 CO 0.34 0.70 0.39 0.45 0.09 0.00 0.00 178.44 180.42 1lck h HIS 203 N 0.43 0.64 0.11 1.13 3.86 -1.97 -1.96 115.15 117.39 1lck h HIS 203 Ca 0.07 0.02 -0.31 0.00 -1.16 0.00 0.00 60.37 58.98 1lck h HIS 203 Cb 0.63 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.87 1lck h HIS 203 CO 0.02 0.36 -1.59 0.93 0.86 0.00 0.00 177.93 178.51 1lck h GLU 204 N 0.65 0.24 -0.08 2.45 3.07 -1.86 -2.03 114.58 117.03 1lck h GLU 204 Ca 0.25 -0.41 0.04 0.00 -0.50 0.00 0.00 59.36 58.74 1lck h GLU 204 Cb 0.16 0.15 -0.06 0.00 -0.84 0.00 0.00 28.75 28.17 1lck h GLU 204 CO -0.07 1.09 -0.29 1.25 -1.40 0.00 0.00 179.01 179.58 1lck h LEU 205 N 0.06 -0.90 -0.73 1.33 6.46 -1.30 -2.10 115.31 118.14 1lck h LEU 205 Ca -0.26 0.13 -0.03 0.00 -0.12 0.00 0.00 57.88 57.60 1lck h LEU 205 Cb 2.02 0.38 -0.03 0.00 -0.73 0.00 0.00 40.66 42.29 1lck h LEU 205 CO 0.15 -0.35 0.34 0.58 -0.62 0.00 0.00 178.44 178.55 1lck h VAL 206 N -0.40 1.24 -0.31 1.05 2.07 -1.37 -2.79 116.25 115.74 1lck h VAL 206 Ca 0.08 -0.68 -0.04 0.00 0.82 0.00 0.00 66.70 66.88 1lck h VAL 206 Cb 0.52 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1lck h VAL 206 CO -0.30 0.28 0.01 -0.09 0.02 0.00 0.00 177.57 177.49 1lck h ARG 207 N 1.02 0.47 -0.27 1.57 2.43 -1.21 -2.40 114.38 116.00 1lck h ARG 207 Ca 0.25 -0.09 -0.16 0.00 -0.81 0.00 0.00 59.98 59.17 1lck h ARG 207 Cb 0.13 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.61 1lck h ARG 207 CO -0.03 0.49 -0.46 1.25 -1.51 0.00 0.00 179.97 179.71 1lck h HIS 208 N 0.46 0.98 0.00 2.20 2.76 -1.17 -3.35 115.15 117.04 1lck h HIS 208 Ca 0.10 -0.34 -0.04 0.00 -2.20 0.00 0.00 60.37 57.89 1lck h HIS 208 Cb 0.28 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 29.05 1lck h HIS 208 CO 0.01 1.14 -0.81 1.88 -1.30 0.00 0.00 177.93 178.85 1lck h TYR 209 N 0.53 0.00 0.00 5.26 0.05 -1.29 -1.29 116.97 120.23 1lck h TYR 209 Ca 0.02 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1lck h TYR 209 Cb 1.06 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.80 1lck h TYR 209 CO 0.08 0.15 0.00 1.79 -1.05 0.00 0.00 178.16 179.12 1lck h THR 210 N 0.00 0.00 0.00 -2.88 1.35 -1.58 -3.10 112.91 106.69 1lck h THR 210 Ca -0.03 -0.37 -0.25 0.00 -0.55 0.00 0.00 66.41 65.21 1lck h THR 210 Cb 1.14 1.27 -0.05 0.00 -1.73 0.00 0.00 68.15 68.78 1lck h THR 210 CO 0.01 0.00 -2.03 0.59 -0.25 0.00 0.00 175.52 173.84 1lck n ASN 211 N -2.79 1.15 -4.02 5.36 4.13 -1.19 -4.66 115.26 113.24 1lck n ASN 211 Ca 0.01 0.00 -0.16 0.00 1.68 0.00 0.00 54.58 56.11 1lck n ASN 211 Cb 0.26 1.01 -0.13 0.00 -1.54 0.00 0.00 39.78 39.37 1lck n ASN 211 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1lck s ALA 212 N -2.49 0.61 -0.88 5.41 0.00 -0.49 -5.04 121.76 118.88 1lck s ALA 212 Ca -0.07 -0.47 0.25 0.00 0.00 0.00 0.00 51.96 51.66 1lck s ALA 212 Cb 0.05 -0.09 0.48 0.00 0.00 0.00 0.00 23.12 23.57 1lck s ALA 212 CO 0.65 0.10 1.40 -1.13 0.00 0.00 0.00 175.76 176.78 1lck n SER 213 N 2.40 0.53 0.00 0.00 3.41 -1.26 -3.98 113.62 114.73 1lck n SER 213 Ca -0.16 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.36 1lck n SER 213 Cb 0.57 0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.71 1lck n SER 213 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1lck n ASP 214 N -1.70 0.00 0.00 4.04 -0.08 -1.26 0.74 116.55 118.29 1lck n ASP 214 Ca 0.05 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.33 1lck n ASP 214 Cb 0.37 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.83 1lck n ASP 214 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1lck n GLY 215 N 0.00 2.73 3.72 0.27 0.00 -1.26 -5.02 105.19 105.63 1lck n GLY 215 Ca 0.00 -0.66 -0.39 0.00 0.00 0.00 0.00 46.02 44.97 1lck n GLY 215 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1lck n LEU 216 N 0.00 4.95 -0.08 0.99 4.77 0.23 -4.90 117.00 122.96 1lck n LEU 216 Ca 0.00 1.00 0.09 0.00 -0.03 0.00 0.00 56.01 57.07 1lck n LEU 216 Cb 0.00 -1.54 0.51 0.00 -2.33 0.00 0.00 43.42 40.06 1lck n LEU 216 CO 0.00 -0.72 0.83 0.00 -1.33 0.00 0.00 177.39 176.17 1lck s THR 218 N -1.97 0.00 -0.10 0.00 2.01 -1.26 -5.01 115.64 109.31 1lck s THR 218 Ca 0.28 -1.49 -0.05 0.00 0.31 0.00 0.00 61.69 60.73 1lck s THR 218 Cb 0.13 -2.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.96 1lck s THR 218 CO 0.21 0.00 0.11 -0.60 -0.69 0.00 0.00 174.62 173.65 1lck s ARG 219 N -3.03 3.32 -1.02 4.92 3.52 -1.26 -4.63 118.95 120.76 1lck s ARG 219 Ca 0.28 -0.22 -0.21 0.00 -0.13 0.00 0.00 55.73 55.44 1lck s ARG 219 Cb -0.01 -3.08 -0.10 0.00 -1.56 0.00 0.00 34.95 30.20 1lck s ARG 219 CO 0.18 0.75 1.93 1.28 -0.81 0.00 0.00 175.30 178.63 1lck n LEU 220 N 1.93 3.98 0.30 -0.88 4.77 -1.17 -4.44 117.00 121.48 1lck n LEU 220 Ca -0.19 -3.18 -0.18 0.00 -0.03 0.00 0.00 56.01 52.43 1lck n LEU 220 Cb 0.54 -1.45 -0.10 0.00 -2.33 0.00 0.00 43.42 40.09 1lck n LEU 220 CO 0.31 -0.77 0.54 0.28 -1.33 0.00 0.00 177.39 176.43 1lck h SER 221 N 8.41 -1.33 -4.36 -1.43 0.02 -0.83 -3.40 113.55 110.63 1lck h SER 221 Ca 0.36 0.11 -0.20 0.00 -0.84 0.00 0.00 61.79 61.21 1lck h SER 221 Cb 0.79 0.44 -0.24 0.00 0.14 0.00 0.00 62.40 63.52 1lck h SER 221 CO 1.63 -0.66 -0.71 -0.13 -1.14 0.00 0.00 176.83 175.83 1lck s ARG 222 N -5.89 0.16 0.63 3.45 0.52 -0.52 -4.95 118.95 112.34 1lck s ARG 222 Ca -0.18 -0.31 -0.14 0.00 -0.52 0.00 0.00 55.73 54.58 1lck s ARG 222 Cb 0.04 0.05 -0.02 0.00 0.52 0.00 0.00 34.95 35.54 1lck s ARG 222 CO 0.61 -0.02 1.05 -1.25 0.02 0.00 0.00 175.30 175.71 1lck s PRO 223 N -0.74 3.22 0.18 3.54 0.04 -1.26 -0.94 135.00 139.05 1lck s PRO 223 Ca -0.08 1.09 -0.32 0.00 0.04 0.00 0.00 61.00 61.73 1lck s PRO 223 Cb -0.05 -2.02 -0.12 0.00 0.04 0.00 0.00 34.50 32.34 1lck s PRO 223 CO -0.00 -0.88 1.71 0.00 0.04 0.00 0.00 177.00 177.87 1lck s GLN 225 N 1.36 3.48 0.00 0.00 0.74 -1.26 -4.89 119.66 119.08 1lck s GLN 225 Ca 0.77 -0.63 0.30 0.00 0.05 0.00 0.00 55.36 55.84 1lck s GLN 225 Cb -0.54 -3.62 1.42 0.00 1.10 0.00 0.00 33.01 31.37 1lck s GLN 225 CO 0.34 -0.38 1.95 0.25 -0.55 0.00 0.00 175.29 176.91