# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 V C C 67.99 10.35 12.63 23.87 122.61 -168.67 -110.48 135.86 99.69 0.31 0.01 99.67 0.10 0.02 0.00 0.00 0.00 0.18 0.02 1 N C C 120.16 2.16 15.30 18.30 109.41 -135.54 -91.85 113.63 89.99 9.92 0.09 89.33 1.13 0.40 0.03 0.04 0.00 6.14 2.93 2 V C C 60.66 12.80 9.04 22.10 117.43 -167.51 -100.03 131.15 89.56 10.39 0.05 77.95 11.74 0.22 0.01 0.03 0.00 8.27 1.77 3 P C C 55.78 7.97 12.68 22.56 115.26 -108.39 -65.76 149.81 91.82 7.69 0.48 89.97 1.58 0.72 0.08 0.34 0.00 6.24 1.07 4 K C S 149.02 3.13 14.53 19.16 96.44 -132.75 -73.67 -26.03 87.90 11.24 0.86 16.57 64.93 6.13 0.06 0.86 0.00 10.62 0.83 5 T E E 71.58 5.84 15.52 22.75 130.22 25.89 -134.31 146.81 43.37 55.24 1.39 23.89 15.44 5.68 0.11 1.39 0.00 52.74 0.76 6 R E E 94.24 12.08 13.51 26.24 126.93 -172.09 -129.54 142.20 21.91 77.66 0.42 18.95 2.65 0.46 0.07 0.31 0.00 76.95 0.60 7 K E E 101.44 8.67 17.18 26.84 121.15 -146.14 -110.44 136.30 8.42 91.52 0.07 7.72 0.48 0.06 0.02 0.03 0.00 91.41 0.28 8 T E E 42.02 12.55 15.81 29.35 126.73 -163.96 -121.58 144.63 5.27 94.70 0.03 4.71 0.37 0.05 0.01 0.02 0.00 94.62 0.22 9 Y E E 93.75 9.35 17.47 27.81 119.20 -139.91 -104.80 137.28 12.60 87.23 0.17 10.74 1.65 0.31 0.05 0.11 0.00 86.45 0.70 10 C C E 27.39 13.80 11.86 26.81 120.07 -154.22 -113.10 135.37 51.34 48.36 0.31 44.59 4.78 0.77 0.07 0.25 0.00 48.46 1.08 11 K C C 131.24 3.70 16.18 20.78 113.08 -144.83 -92.88 130.76 72.92 24.83 2.25 38.17 26.57 9.89 0.42 1.88 0.01 20.72 2.33 12 G C T 39.51 5.00 12.93 19.09 121.04 10.16 83.94 -164.61 87.22 3.36 9.42 7.30 39.12 41.87 1.03 7.42 0.01 2.00 1.25 13 K C T 161.24 1.85 13.05 15.54 95.59 -39.47 -71.60 -24.89 85.94 0.92 13.14 4.47 25.28 56.62 1.54 11.01 0.01 0.50 0.57 14 T C T 96.35 2.53 13.39 16.49 99.27 49.30 -87.58 -13.79 83.85 3.71 12.43 7.11 22.20 54.66 1.80 10.39 0.04 2.44 1.37 15 C C C 46.13 11.83 8.72 20.76 103.08 61.04 -85.15 12.13 68.05 23.27 8.68 35.05 15.82 19.29 2.08 6.64 0.06 16.41 4.63 16 R C C 152.67 3.74 14.59 19.49 100.02 86.75 -79.08 -8.95 68.58 28.05 3.37 41.13 18.24 10.06 0.75 2.59 0.01 25.50 1.72 17 K C E 126.16 3.33 17.61 21.73 116.58 76.37 -101.17 138.31 57.44 39.93 2.62 35.55 15.72 6.93 0.44 2.18 0.00 37.63 1.55 18 H E E 69.01 16.90 10.59 26.46 124.03 -149.24 -104.13 142.91 35.78 63.71 0.51 31.49 3.51 0.70 0.15 0.32 0.00 62.90 0.92 19 T E E 62.93 6.32 19.60 26.92 124.84 -161.91 -122.80 140.83 9.77 90.09 0.14 9.08 0.57 0.10 0.06 0.06 0.00 89.56 0.58 20 Q E E 97.99 9.27 16.90 26.99 115.33 -112.74 -74.47 140.64 8.91 90.97 0.12 8.12 0.60 0.09 0.05 0.05 0.00 90.39 0.70 21 H E E 42.04 16.43 13.28 29.93 125.31 -155.95 -112.17 147.02 33.30 66.31 0.39 28.92 3.13 0.40 0.15 0.19 0.00 66.61 0.58 22 K E E 128.18 3.92 21.43 26.00 118.08 -132.03 -99.73 135.24 36.20 63.26 0.55 31.69 3.18 0.47 0.25 0.28 0.00 62.61 1.52 23 V E E 34.73 19.35 11.08 29.66 115.91 -134.06 -89.43 131.66 33.82 64.64 1.54 31.46 1.73 0.43 1.02 0.63 0.00 61.97 2.77 24 T E E 71.83 5.22 19.12 24.95 111.56 -165.88 -104.20 -10.41 38.59 59.73 1.69 27.55 9.91 1.23 0.87 0.82 0.00 58.62 0.99 25 Q E E 105.06 6.13 17.04 24.32 118.79 -24.49 -112.25 131.91 26.43 71.51 2.06 20.41 5.11 1.24 1.07 1.01 0.01 69.35 1.81 26 Y E E 80.76 14.59 10.57 24.97 122.73 -163.32 -111.53 138.42 29.57 68.85 1.58 25.97 2.31 0.68 1.15 0.68 0.00 65.10 4.12 27 K C C 115.63 4.23 14.78 20.14 115.71 -125.37 -80.25 145.05 64.67 32.30 3.03 46.31 12.91 5.65 1.18 1.98 0.01 29.32 2.64 28 A C T 79.53 4.51 11.65 17.94 110.27 -100.38 -66.74 138.09 83.03 9.11 7.87 16.47 22.92 44.08 2.36 5.17 0.04 7.25 1.70 29 G C T 57.12 2.19 13.83 16.57 105.39 25.20 85.57 -13.21 86.65 3.80 9.56 18.99 25.60 42.90 2.46 6.40 0.01 2.48 1.16 30 K C C 122.02 5.21 12.41 18.99 113.52 72.45 -93.00 130.21 75.09 9.98 14.93 44.25 20.64 10.66 7.52 7.28 0.06 5.84 3.76 31 A C C 60.69 8.37 12.68 21.97 110.34 -114.28 -83.25 112.89 71.96 9.95 18.10 50.13 13.12 8.12 11.84 6.92 0.02 6.72 3.13 32 S C C 43.19 9.14 13.93 24.37 123.23 32.86 -110.73 151.62 62.61 12.23 25.16 46.85 9.08 6.31 16.67 8.94 0.04 8.60 3.51 33 L H H 92.58 8.50 15.63 24.94 95.07 -116.49 -65.70 -26.90 43.16 12.36 44.47 15.43 10.69 18.33 25.08 18.28 0.62 9.07 2.49 34 F H H 102.33 9.02 15.73 25.45 96.57 58.90 -86.34 -6.24 41.56 16.66 41.78 14.25 9.55 18.92 24.07 16.94 0.79 12.55 2.91 35 A C C 41.68 11.70 13.83 26.19 102.99 73.04 -83.40 14.77 46.79 16.66 36.55 25.27 9.73 12.86 21.69 14.66 0.28 12.34 3.16 36 Q C C 102.97 7.13 15.31 23.46 112.70 104.04 -94.87 111.31 62.92 16.78 20.31 31.15 13.70 18.25 15.00 5.67 0.19 12.48 3.55 37 G C C 34.16 8.32 13.42 22.87 126.42 -129.06 104.29 175.01 72.93 16.79 10.28 35.86 20.07 17.83 5.91 4.25 0.10 13.40 2.57 38 K C C 139.59 3.87 14.77 20.13 116.34 -84.24 -96.39 135.87 63.99 24.18 11.83 43.29 13.98 6.51 8.04 4.20 0.06 20.73 3.19 39 R C C 123.47 8.59 11.77 21.58 119.23 -151.89 -100.70 134.85 52.92 32.24 14.84 37.43 9.71 5.30 10.71 4.73 0.06 28.02 4.05 40 R C C 134.65 5.85 13.81 21.25 116.38 -155.80 -102.63 134.27 47.37 36.18 16.46 34.12 7.68 5.14 11.97 5.00 0.06 31.77 4.26 41 Y C C 100.02 9.88 10.70 21.73 119.69 -152.69 -105.49 136.50 51.23 30.26 18.51 35.07 10.30 5.54 13.92 5.28 0.08 26.04 3.77 42 D C C 79.44 5.07 12.92 19.58 112.82 -149.32 -97.45 123.63 62.50 19.27 18.23 48.09 7.86 5.59 13.13 5.74 0.02 17.33 2.25 43 R C C 148.42 5.62 11.06 18.26 97.55 -153.59 -74.27 -14.04 52.64 15.01 32.35 28.55 11.45 13.35 19.19 13.01 0.15 12.10 2.21 44 K C C 148.57 1.94 12.37 15.07 99.94 72.32 -81.62 -4.22 50.38 18.09 31.53 27.32 11.01 13.17 18.10 13.09 0.25 13.87 3.19 45 Q C C 103.75 5.64 9.29 16.51 107.02 84.27 -87.33 87.68 56.24 17.73 26.03 34.45 11.95 10.10 15.55 10.60 0.24 11.61 5.50 46 S C C 75.74 4.20 10.70 16.32 109.55 132.79 -91.54 108.71 72.84 10.42 16.74 38.02 15.53 20.06 9.36 6.94 0.06 6.36 3.66 47 G C T 50.72 3.05 11.24 15.68 113.86 23.64 85.10 -171.75 81.90 4.35 13.75 22.13 25.37 35.44 4.47 8.31 0.04 2.45 1.80 48 F C T 145.71 3.56 9.88 14.85 107.48 -27.92 -91.01 104.67 79.16 5.75 15.09 17.31 22.56 40.01 3.89 10.16 0.09 3.16 2.82 49 G C T 57.18 2.10 11.66 14.73 104.96 -21.80 73.20 4.06 84.47 4.96 10.56 19.43 23.96 41.47 2.21 8.00 0.03 3.06 1.85 50 G C C 49.65 4.16 10.81 16.57 109.28 -51.18 79.97 11.58 85.36 8.31 6.33 38.49 25.72 21.70 1.07 5.40 0.00 5.31 2.31 51 Q C C 111.04 4.52 11.26 17.41 116.11 116.51 -90.84 136.88 80.09 17.11 2.80 57.16 17.84 4.70 0.93 2.11 0.01 10.91 6.36 52 T C C 89.08 5.68 11.23 18.50 113.36 -155.76 -93.92 120.50 77.34 21.56 1.10 58.60 16.02 2.26 0.42 0.82 0.00 16.23 5.64 53 K C C 121.11 5.01 12.54 19.11 118.64 -151.15 -102.38 136.28 76.90 22.78 0.32 61.04 15.19 0.63 0.14 0.21 0.00 20.80 1.99 54 P C C 80.78 6.57 12.41 20.61 113.97 -108.68 -67.98 144.99 67.01 31.94 1.05 62.58 3.10 0.82 0.66 0.48 0.00 26.97 5.38 55 V C C 78.82 8.37 11.33 21.07 115.74 -140.64 -97.44 133.17 64.37 32.42 3.20 49.45 12.16 2.21 2.31 1.15 0.01 27.84 4.86 56 F C C 117.16 6.56 11.84 19.97 119.24 -148.72 -105.57 135.91 55.69 40.26 4.05 42.90 10.43 1.99 2.86 1.45 0.02 33.72 6.60 57 H C C 116.24 6.34 11.52 19.52 118.18 -157.31 -102.49 133.16 66.25 29.00 4.75 55.76 7.51 2.41 3.01 1.90 0.00 25.91 3.50 58 K C C 128.46 5.16 11.67 18.46 116.43 -142.79 -94.28 137.67 73.41 15.44 11.15 49.59 15.96 8.12 6.00 5.03 0.02 12.52 2.77 59 K C C 137.17 4.21 12.49 18.46 113.54 -125.72 -88.45 132.48 74.11 11.29 14.60 46.91 17.52 10.22 7.04 7.37 0.03 7.95 2.96 60 A C C 58.30 8.60 10.35 20.12 115.09 -124.17 -81.52 142.32 74.78 8.67 16.55 52.47 13.86 8.85 7.17 9.22 0.01 5.86 2.57 61 K C C 132.34 4.57 13.54 19.55 110.34 -132.19 -88.23 120.62 76.22 9.74 14.03 53.58 13.58 9.12 6.11 7.89 0.01 6.47 3.23 62 T C C 77.59 7.77 12.39 21.29 112.63 -155.20 -96.90 121.75 77.58 11.10 11.31 48.24 17.64 12.02 4.88 6.35 0.03 7.14 3.70 63 T C C 75.98 7.32 13.84 22.24 109.94 -164.56 -99.24 69.47 80.35 12.97 6.68 48.75 21.09 10.92 2.76 3.90 0.02 9.16 3.39 64 K C C 104.46 8.16 15.77 24.85 117.08 83.88 -94.93 133.19 81.56 16.87 1.57 47.81 30.18 4.22 0.43 1.13 0.00 14.61 1.62 65 K C C 89.51 10.56 17.60 28.58 121.26 -132.53 -100.29 138.87 58.46 41.16 0.38 48.25 8.00 1.02 0.08 0.29 0.00 41.37 0.98 66 V E E 21.72 17.48 16.47 34.58 121.13 -151.17 -110.52 134.40 12.75 87.22 0.02 12.27 0.50 0.03 0.00 0.01 0.00 86.73 0.45 67 V E E 32.88 11.83 21.78 34.90 119.23 -155.87 -110.51 129.67 3.28 96.71 0.00 3.07 0.12 0.00 0.00 0.00 0.00 96.75 0.05 68 L E E 14.42 20.42 18.06 38.87 120.40 -161.81 -109.63 131.89 0.92 99.08 0.00 0.80 0.03 0.00 0.00 0.00 0.00 99.15 0.01 69 R E E 73.47 10.86 23.56 34.89 118.60 -158.56 -108.92 127.55 0.60 99.39 0.00 0.50 0.02 0.00 0.00 0.00 0.00 99.46 0.00 70 L E E 12.63 21.36 17.06 38.53 124.14 -166.93 -115.01 137.02 0.88 99.11 0.00 0.73 0.04 0.00 0.00 0.00 0.00 99.22 0.01 71 E E E 67.88 7.87 22.34 31.15 118.08 -151.29 -108.32 128.90 3.28 96.71 0.01 2.99 0.16 0.01 0.00 0.00 0.00 96.70 0.13 72 C E E 12.16 17.70 11.45 30.38 110.13 -131.50 -82.14 124.15 31.48 68.44 0.09 29.05 1.73 0.19 0.01 0.07 0.00 68.25 0.70 73 V C T 87.40 4.62 16.96 22.85 94.53 -157.86 -72.57 -28.30 95.11 3.73 1.16 6.21 38.36 50.64 0.09 1.06 0.00 3.18 0.46 74 K C T 133.24 2.86 15.31 18.78 98.91 45.03 -82.48 -37.92 96.84 1.70 1.46 3.91 33.74 59.36 0.14 1.28 0.00 1.16 0.41 75 C C T 60.13 6.24 11.79 19.61 107.78 22.25 -110.12 -4.01 94.92 3.73 1.36 20.10 33.38 41.65 0.14 1.40 0.00 2.65 0.67 76 K C C 155.93 2.48 13.63 17.45 95.73 -130.42 60.82 15.00 90.07 9.22 0.71 46.67 25.66 18.12 0.09 0.69 0.00 7.85 0.93 77 T C C 67.07 5.04 13.89 20.66 120.88 128.32 -92.93 147.25 69.20 30.54 0.26 59.23 6.75 1.61 0.04 0.22 0.00 31.62 0.53 78 R E E 126.90 9.68 13.42 24.44 122.32 -147.29 -110.96 138.62 23.71 76.10 0.19 21.92 0.99 0.17 0.07 0.09 0.00 76.14 0.62 79 A E E 38.11 10.25 15.94 27.71 131.28 -175.73 -134.52 150.83 3.27 96.63 0.10 3.04 0.19 0.05 0.04 0.03 0.00 96.34 0.30 80 Q E E 98.21 9.66 16.27 26.94 121.19 -134.46 -107.84 134.88 7.12 92.76 0.11 6.30 0.66 0.11 0.03 0.05 0.00 92.44 0.40 81 L E E 40.45 14.50 14.46 29.72 123.63 -168.27 -116.78 138.95 39.81 60.04 0.15 37.06 1.38 0.13 0.04 0.07 0.00 60.98 0.33 82 T E E 81.64 5.01 20.72 26.29 114.13 -118.48 -79.25 136.18 48.13 51.56 0.31 44.13 2.51 0.36 0.09 0.17 0.00 51.95 0.79 83 L C C 31.02 20.62 11.55 31.34 122.46 -160.37 -109.58 141.39 59.45 39.83 0.72 53.94 4.20 0.66 0.27 0.39 0.00 39.29 1.25 84 K E E 110.95 5.43 21.14 27.11 119.38 -138.46 -99.81 139.96 47.26 51.60 1.15 38.64 7.59 1.08 0.54 0.62 0.00 49.72 1.79 85 R E E 111.08 11.27 16.89 28.42 116.30 -116.07 -83.75 138.21 33.99 63.72 2.28 27.76 4.88 1.20 1.26 1.17 0.01 54.51 9.21 86 C C C 30.18 16.13 11.81 28.11 122.38 -152.44 -107.40 146.06 49.81 47.51 2.68 46.22 2.63 0.90 1.11 1.53 0.00 43.45 4.15 87 K C S 136.55 3.46 17.77 22.09 98.81 -157.57 -86.96 -28.05 70.60 26.70 2.70 21.18 41.81 7.92 0.55 1.79 0.02 25.71 1.01 88 H C E 103.93 5.03 18.96 24.93 132.25 9.72 -142.07 144.46 58.02 39.54 2.44 30.27 23.09 6.14 0.46 1.76 0.01 37.26 1.01 89 F E E 61.20 17.65 11.96 28.98 126.27 -167.80 -127.98 136.34 47.92 49.45 2.62 43.33 3.37 1.07 1.17 1.47 0.00 45.60 3.97 90 E C C 98.08 5.73 18.32 25.08 118.49 -159.59 -111.26 126.75 52.39 45.93 1.68 47.95 2.74 1.20 0.80 0.92 0.00 42.35 4.02 91 L C C 79.32 11.51 12.45 24.42 113.77 -151.84 -90.77 132.58 65.39 31.22 3.39 33.82 13.93 19.73 1.00 2.32 0.01 26.94 2.24 92 G C T 46.47 4.57 14.63 20.27 107.02 17.64 88.45 -5.97 81.49 13.95 4.56 27.25 26.93 28.39 1.24 2.93 0.02 11.52 1.72 93 G C S 42.50 5.31 12.52 19.13 117.49 42.72 94.54 -169.50 77.01 7.86 15.12 30.48 32.67 15.00 8.21 6.11 0.05 5.55 1.92 94 E C C 128.62 3.58 12.26 17.23 111.14 -50.43 -86.34 124.89 66.42 8.60 24.98 41.14 14.86 10.67 15.34 9.60 0.04 6.11 2.23 95 K C C 129.03 4.95 10.58 17.29 110.62 -144.20 -88.61 122.45 56.32 9.27 34.41 36.88 10.79 8.99 21.56 12.82 0.06 6.72 2.18 96 K C C 135.60 3.97 10.87 16.49 110.39 -146.14 -88.97 123.79 56.98 8.47 34.55 38.12 9.83 9.13 22.09 12.59 0.05 6.15 2.04 97 Q C C 118.04 4.17 10.03 15.92 113.10 -136.32 -94.62 121.59 60.51 6.65 32.84 39.71 10.55 10.31 21.08 11.88 0.04 4.38 2.06 98 K C T 144.73 3.07 9.78 14.62 110.93 -136.12 -87.00 125.91 67.28 4.76 27.96 26.33 12.84 28.99 17.53 9.58 0.10 2.86 1.77 99 G C T 53.71 3.12 9.91 14.69 109.57 8.75 71.95 83.78 75.29 2.78 21.93 24.07 15.88 36.14 11.32 9.84 0.03 1.66 1.07 100 Q C C 127.22 2.92 8.76 13.47 112.24 -98.56 -88.13 132.35 74.86 7.50 17.63 45.20 14.88 15.28 7.77 9.56 0.02 4.88 2.42 101 A C C 85.82 2.42 8.55 12.72 110.60 -119.80 -83.39 129.81 79.68 10.61 9.71 66.18 4.07 9.10 5.25 4.00 0.00 6.72 4.67 102 L C C 113.43 4.79 10.21 16.55 107.59 -133.89 -85.73 80.04 99.62 0.34 0.04 99.49 0.16 0.09 0.02 0.00 0.00 0.20 0.04