# 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 E C C 109.78 6.11 19.86 26.70 117.20 -145.78 -99.19 130.93 99.31 0.68 0.01 99.39 0.06 0.01 0.00 0.00 0.00 0.52 0.01 1 V C C 37.80 19.69 11.61 30.27 121.54 -160.79 -110.86 132.90 50.57 49.05 0.38 49.91 0.49 0.21 0.18 0.11 0.00 48.11 0.99 2 Q E E 93.52 5.35 21.66 27.75 122.53 -165.00 -116.38 135.32 24.47 74.80 0.73 22.30 1.50 0.45 0.43 0.31 0.00 73.86 1.16 3 L E E 51.18 19.30 13.56 32.01 118.39 -146.57 -100.61 130.35 25.33 73.63 1.04 23.20 1.44 0.50 0.55 0.44 0.00 72.91 0.98 4 V E E 60.54 9.60 19.61 30.03 121.43 -167.30 -111.63 135.21 32.40 66.11 1.50 27.49 3.56 1.11 0.72 0.72 0.00 65.26 1.14 5 E E E 97.91 11.63 17.36 29.09 117.38 -136.43 -96.18 134.40 46.08 51.58 2.34 34.72 8.36 3.25 0.74 1.53 0.01 50.19 1.21 6 S C C 52.94 12.15 16.48 28.51 109.34 -163.63 -95.88 58.00 68.91 29.04 2.05 43.05 16.34 9.47 0.39 1.76 0.00 27.75 1.24 7 G C S 40.38 8.32 18.88 27.45 110.20 -108.02 90.91 5.38 77.38 21.39 1.23 30.85 32.08 14.68 0.13 1.21 0.00 19.93 1.10 8 G C C 32.22 11.99 17.60 29.26 125.72 -37.13 130.27 171.56 71.97 27.39 0.64 39.45 25.19 7.28 0.07 0.70 0.00 26.33 0.98 9 G E E 25.82 11.78 19.45 31.22 133.75 121.19 140.52 174.81 38.90 60.97 0.13 29.87 8.56 0.78 0.02 0.13 0.00 59.79 0.84 10 L E E 79.52 11.38 21.79 32.95 120.99 -84.43 -105.65 134.92 9.00 90.95 0.05 7.66 1.29 0.10 0.02 0.03 0.00 90.11 0.78 11 V E E 20.03 20.70 15.27 35.63 124.17 -167.92 -117.49 135.85 7.10 92.87 0.03 6.52 0.46 0.02 0.03 0.01 0.00 87.84 5.12 12 Q C C 90.59 5.98 23.16 29.33 120.64 -132.30 -86.86 149.13 89.92 10.06 0.03 89.90 0.49 0.05 0.01 0.01 0.00 8.98 0.55 13 P C T 69.75 12.22 14.77 27.27 109.59 -86.34 -59.24 137.62 99.19 0.61 0.21 0.33 2.39 96.64 0.01 0.16 0.00 0.42 0.05 14 G C T 52.29 2.89 19.30 22.67 96.52 21.92 87.31 -5.18 99.41 0.41 0.17 0.41 2.82 96.29 0.01 0.14 0.00 0.31 0.02 15 G C C 23.07 9.48 15.88 26.72 128.23 114.76 -91.53 173.11 89.45 10.49 0.06 72.52 16.86 0.27 0.01 0.07 0.00 9.57 0.71 16 S E E 54.24 9.35 20.65 30.80 131.90 -119.56 -130.07 153.15 42.64 57.34 0.02 42.76 0.57 0.03 0.00 0.01 0.00 55.64 0.98 17 L E E 14.98 23.06 15.96 38.88 126.64 -156.44 -124.79 139.60 2.18 97.81 0.00 2.08 0.06 0.00 0.00 0.00 0.00 97.74 0.11 18 R E E 112.61 8.28 25.38 34.30 118.91 -154.73 -112.15 128.51 0.89 99.11 0.00 0.84 0.03 0.00 0.00 0.00 0.00 99.10 0.03 19 L E E 6.36 25.60 17.03 43.05 123.69 -169.53 -117.15 135.02 4.51 95.47 0.02 4.24 0.17 0.02 0.01 0.00 0.00 95.43 0.13 20 S E E 38.67 10.18 27.11 37.72 126.77 -164.92 -117.30 144.89 20.17 79.75 0.09 18.20 1.18 0.13 0.02 0.05 0.00 80.19 0.23 21 C E E 5.61 25.29 17.57 43.00 132.19 -173.61 -136.37 145.15 25.14 74.60 0.26 22.75 1.71 0.28 0.08 0.14 0.00 74.25 0.79 22 A E E 36.52 10.54 27.21 38.33 122.83 -159.38 -115.76 139.60 18.40 81.10 0.51 16.49 1.55 0.38 0.25 0.28 0.00 76.37 4.68 23 A E E 8.40 24.03 15.93 39.74 123.99 -168.24 -122.17 136.46 45.45 52.63 1.91 41.14 2.98 0.96 0.57 1.34 0.00 49.88 3.14 24 S C C 50.27 8.28 21.65 30.25 126.67 -158.47 -117.53 149.55 71.20 25.71 3.10 35.60 24.89 12.25 0.40 2.76 0.00 22.64 1.46 25 D C S 96.84 4.72 21.26 26.46 97.08 9.03 63.14 29.17 82.06 14.45 3.49 25.83 38.72 18.46 0.44 3.02 0.00 12.02 1.52 26 F C C 51.93 18.32 13.14 30.64 117.39 134.24 -93.33 135.71 81.88 14.51 3.61 56.10 17.18 8.51 0.71 3.33 0.00 11.14 3.03 27 Y C C 113.96 7.57 20.07 28.25 114.23 -161.12 -111.45 118.02 84.73 12.74 2.53 60.43 15.52 8.43 0.56 2.25 0.00 9.12 3.70 28 F C C 60.81 16.33 14.05 29.91 114.84 -143.02 -100.30 133.87 84.93 11.45 3.61 47.49 24.22 13.79 0.70 3.14 0.00 7.46 3.19 29 D C S 91.45 5.27 19.38 25.24 101.76 -145.72 -87.97 -17.41 90.26 7.18 2.56 22.52 45.58 22.46 0.29 2.37 0.00 5.65 1.12 30 Y C S 112.74 8.04 19.25 27.70 109.54 23.51 -109.37 41.62 77.86 19.90 2.24 27.55 32.45 18.22 0.23 2.16 0.00 18.11 1.28 31 Y E E 31.00 20.19 15.47 35.17 128.35 109.58 -122.43 149.05 46.01 53.69 0.30 34.55 10.41 1.13 0.05 0.28 0.00 52.58 1.00 32 E E E 51.19 11.73 25.65 37.90 125.29 -154.66 -118.91 142.40 10.89 89.08 0.02 10.08 0.59 0.05 0.00 0.01 0.00 88.97 0.29 33 M E E 4.66 25.91 19.46 45.79 126.44 -161.47 -121.41 138.46 1.67 98.33 0.00 1.56 0.06 0.00 0.00 0.00 0.00 98.33 0.04 34 S E E 16.84 15.19 27.64 43.06 131.57 -174.20 -130.27 149.65 0.68 99.31 0.00 0.62 0.02 0.00 0.00 0.00 0.00 99.35 0.01 35 W E E 8.45 24.49 21.77 46.21 126.46 -159.08 -121.13 139.55 0.65 99.35 0.00 0.56 0.02 0.00 0.00 0.00 0.00 99.41 0.00 36 V E E 17.19 16.74 24.63 41.48 128.22 -168.89 -125.46 141.75 0.47 99.53 0.00 0.41 0.01 0.00 0.00 0.00 0.00 99.57 0.01 37 R E E 44.33 17.46 21.21 38.13 124.67 -161.23 -117.38 137.61 0.71 99.29 0.00 0.62 0.03 0.00 0.00 0.00 0.00 99.33 0.02 38 Q E E 60.76 11.97 19.07 31.67 117.46 -147.59 -103.19 127.80 4.57 95.43 0.01 4.10 0.24 0.02 0.00 0.00 0.00 95.42 0.22 39 A C C 26.41 11.57 13.58 26.76 117.53 -132.73 -77.69 149.80 76.54 23.32 0.14 73.50 1.70 0.32 0.02 0.10 0.00 23.81 0.56 40 P C T 95.33 4.90 12.87 19.63 109.29 -84.96 -59.04 135.30 95.47 0.28 4.24 0.49 3.61 90.86 0.06 4.76 0.00 0.16 0.06 41 G C T 69.76 0.27 13.12 10.63 95.99 15.34 81.70 -3.84 95.65 0.11 4.24 0.49 3.16 91.42 0.07 4.78 0.00 0.06 0.03 42 Q C T 112.25 3.93 11.55 17.07 106.97 75.02 -105.81 -4.36 89.17 3.91 6.92 11.53 35.14 41.33 0.26 8.30 0.00 2.63 0.81 43 G C C 33.26 3.93 16.70 21.72 127.44 -120.19 91.75 -167.08 70.10 29.73 0.17 52.22 16.00 1.77 0.02 0.19 0.00 28.70 1.11 44 L E E 60.70 15.56 13.06 28.43 115.83 -27.09 -77.54 137.85 26.67 73.30 0.02 24.26 1.00 0.07 0.00 0.02 0.00 74.51 0.16 45 E E E 76.65 9.40 20.90 31.02 127.25 -170.92 -126.86 140.69 1.70 98.29 0.00 1.46 0.09 0.01 0.00 0.00 0.00 98.41 0.03 46 W E E 94.90 15.31 19.08 34.02 110.88 -113.63 -73.19 128.31 0.37 99.63 0.00 0.34 0.01 0.00 0.00 0.00 0.00 99.64 0.01 47 V E E 15.28 19.61 20.77 40.48 101.67 175.77 -99.20 -30.77 4.05 95.95 0.01 2.45 1.25 0.06 0.00 0.00 0.00 96.23 0.01 48 S E E 6.59 20.01 22.29 42.44 143.22 -6.23 -158.22 155.65 1.17 98.82 0.00 0.84 0.14 0.02 0.00 0.00 0.00 98.99 0.01 49 T E E 34.60 17.08 23.66 40.00 132.74 -161.78 -139.04 144.38 1.26 98.74 0.01 1.09 0.06 0.01 0.00 0.00 0.00 98.82 0.02 50 I E E 18.56 19.63 19.92 39.45 120.54 -158.15 -116.49 130.32 3.51 96.47 0.02 2.99 0.32 0.03 0.01 0.01 0.00 96.30 0.34 51 S E E 37.94 11.26 20.87 32.53 117.59 -165.94 -108.35 140.07 35.19 64.44 0.37 28.82 4.91 1.09 0.08 0.32 0.00 63.95 0.84 52 G C T 28.25 12.53 16.58 29.01 116.27 -135.71 -79.65 -20.54 85.53 10.13 4.34 18.93 31.52 35.27 0.33 4.27 0.00 8.60 1.07 53 L C T 109.34 5.58 15.84 22.52 107.56 -13.42 -81.13 110.17 88.43 4.17 7.40 7.17 25.53 55.59 0.49 7.17 0.01 2.80 1.23 54 G C T 56.44 2.79 15.40 18.98 100.33 3.61 81.90 0.00 91.59 1.18 7.24 6.70 23.02 60.78 0.40 7.89 0.00 0.73 0.48 55 G C S 46.12 6.26 14.51 21.78 105.17 -70.32 85.66 6.73 91.85 4.26 3.88 26.29 34.48 31.05 0.31 4.11 0.00 2.83 0.94 56 A C C 55.86 7.63 16.49 25.10 118.38 145.35 -88.69 142.48 74.96 24.46 0.59 62.07 10.08 1.79 0.10 0.58 0.00 23.86 1.52 57 T E E 57.44 15.31 15.09 30.03 126.56 -162.67 -119.60 140.79 31.79 68.04 0.16 27.84 3.02 0.41 0.04 0.13 0.00 66.81 1.76 58 Y E E 85.84 11.50 20.93 32.75 126.70 -171.51 -127.60 139.17 9.86 90.07 0.07 8.25 1.50 0.13 0.03 0.04 0.00 88.24 1.80 59 Y E E 88.37 15.56 18.04 32.90 127.26 -153.06 -116.14 143.30 19.52 80.34 0.14 17.63 1.46 0.17 0.07 0.09 0.00 76.64 3.95 60 A C C 14.79 18.04 13.23 31.68 113.29 -111.35 -71.38 140.19 89.75 9.87 0.37 86.80 2.49 0.44 0.11 0.22 0.00 9.10 0.84 61 D C G 114.81 2.12 18.16 20.88 92.39 -128.18 -62.46 -30.82 51.26 0.70 48.05 2.82 6.65 40.55 2.71 46.56 0.00 0.44 0.27 62 S C G 63.47 6.65 17.60 25.34 90.80 62.18 -70.31 -18.33 51.95 0.30 47.74 1.08 4.17 45.51 2.12 46.81 0.00 0.17 0.14 63 V C G 10.50 22.05 10.90 32.94 98.34 42.81 -103.02 -0.84 52.41 1.40 46.19 3.25 6.49 41.24 2.84 44.74 0.01 0.90 0.52 64 K C T 123.44 7.07 14.85 24.39 110.41 122.98 -60.84 130.85 92.45 2.82 4.74 3.32 4.68 84.99 1.37 2.62 0.01 1.43 1.57 65 G C T 61.76 1.31 18.65 19.07 94.14 14.21 80.86 -3.13 95.37 0.52 4.11 1.10 4.62 90.24 0.50 3.03 0.00 0.36 0.16 66 R C T 83.43 12.67 17.14 30.00 100.27 79.39 -98.26 -20.80 94.35 1.98 3.67 6.42 22.86 65.14 0.46 2.97 0.00 1.88 0.25 67 F E E 9.00 24.25 12.68 37.25 135.07 35.61 -137.10 151.35 15.38 84.48 0.14 11.76 3.58 0.33 0.05 0.10 0.00 82.27 1.91 68 T E E 62.00 6.52 26.50 33.61 127.36 -163.26 -126.13 143.13 2.64 97.35 0.01 2.46 0.11 0.00 0.00 0.00 0.00 97.28 0.14 69 I E E 23.52 23.89 14.73 38.21 123.18 -160.01 -119.34 131.43 1.73 98.26 0.00 1.67 0.04 0.00 0.00 0.00 0.00 98.25 0.03 70 S E E 47.15 6.64 25.21 32.22 133.66 175.01 -135.24 153.48 2.39 97.61 0.00 2.13 0.09 0.00 0.00 0.00 0.00 97.74 0.03 71 R E E 88.06 17.57 13.75 30.49 122.93 -148.97 -115.32 134.83 3.77 96.21 0.02 3.29 0.33 0.03 0.00 0.01 0.00 96.04 0.29 72 D E E 54.70 7.63 15.79 25.24 109.58 -148.87 -102.63 108.19 25.16 74.77 0.07 24.24 0.82 0.11 0.02 0.05 0.00 73.60 1.15 73 N C T 102.77 6.38 12.79 21.21 93.64 -163.73 -68.92 -24.24 89.68 0.43 9.89 1.38 6.43 79.74 0.17 11.87 0.00 0.29 0.12 74 S C T 93.60 0.79 15.26 14.67 93.35 56.54 -73.92 -32.00 88.85 0.55 10.60 0.79 5.92 80.22 0.17 12.39 0.00 0.33 0.18 75 K C T 107.27 5.31 15.30 21.47 98.54 31.73 -98.57 -3.56 90.41 0.18 9.41 1.59 10.54 75.82 0.16 11.72 0.00 0.10 0.07 76 N C T 60.78 12.60 15.81 29.27 96.08 -130.59 54.75 40.68 99.51 0.22 0.26 7.91 9.11 82.52 0.03 0.22 0.00 0.18 0.03 77 T E E 27.15 12.11 21.29 34.65 133.32 120.95 -131.01 152.67 13.61 86.38 0.01 11.71 1.62 0.07 0.00 0.01 0.00 85.38 1.21 78 L E E 5.88 24.26 18.75 43.53 121.37 -148.74 -113.17 133.04 1.39 98.61 0.00 1.33 0.03 0.00 0.00 0.00 0.00 98.58 0.06 79 Y E E 46.81 13.17 26.54 40.20 121.74 -162.85 -115.52 133.37 1.28 98.72 0.00 1.13 0.04 0.00 0.00 0.00 0.00 98.83 0.00 80 L E E 3.56 25.80 20.01 46.45 120.53 -162.52 -112.06 130.02 0.15 99.85 0.00 0.14 0.00 0.00 0.00 0.00 0.00 99.86 0.00 81 Q E E 53.43 11.50 27.08 39.00 119.32 -162.45 -112.60 128.05 0.11 99.89 0.00 0.11 0.00 0.00 0.00 0.00 0.00 99.88 0.01 82 M E E 8.47 24.37 17.11 41.79 119.59 -168.95 -115.67 128.60 13.34 86.66 0.00 13.54 0.09 0.00 0.00 0.00 0.00 85.77 0.59 83 N C S 67.57 7.89 22.99 31.09 121.45 -155.67 -100.00 154.03 95.50 4.46 0.04 42.85 47.90 3.86 0.00 0.07 0.00 5.14 0.17 84 S C S 60.27 5.58 24.29 30.16 97.67 9.62 58.93 52.97 98.92 1.05 0.03 10.53 84.66 3.79 0.00 0.03 0.00 0.88 0.12 85 L C C 13.39 24.67 11.70 36.37 115.23 -155.33 -73.43 136.59 98.36 1.63 0.01 98.08 0.68 0.01 0.00 0.00 0.00 0.59 0.62 86 R C C 97.96 5.56 25.23 30.97 133.56 -174.70 -127.64 161.58 98.30 1.66 0.04 98.27 0.36 0.01 0.01 0.01 0.00 0.38 0.96 87 A H G 44.66 15.82 16.06 31.45 91.23 -102.19 -59.52 -32.94 3.81 0.03 96.16 0.25 0.27 2.26 0.27 96.93 0.00 0.02 0.00 88 E H G 117.82 4.66 22.47 27.92 90.31 62.95 -71.12 -16.51 3.16 0.04 96.80 0.15 0.21 2.01 0.25 97.35 0.00 0.03 0.00 89 D H G 12.97 21.44 17.39 39.04 94.35 66.97 -83.52 0.35 4.64 0.05 95.30 0.93 0.52 1.58 0.38 96.54 0.00 0.04 0.00 90 T C C 32.83 17.30 22.04 38.96 114.27 108.34 -78.88 134.93 95.30 4.48 0.21 91.85 3.65 0.20 0.03 0.18 0.00 3.79 0.30 91 A E E 10.41 19.16 23.71 42.15 143.41 146.48 -154.26 171.28 6.25 93.72 0.03 6.00 0.35 0.03 0.01 0.01 0.00 92.73 0.87 92 L E E 29.67 17.17 25.98 42.76 117.87 -102.26 -99.27 133.34 1.34 98.66 0.00 1.39 0.05 0.00 0.00 0.00 0.00 98.50 0.06 93 Y E E 6.46 25.17 22.20 47.31 123.16 -161.36 -113.54 138.19 0.69 99.31 0.00 0.67 0.04 0.00 0.00 0.00 0.00 99.26 0.03 94 Y E E 22.22 19.82 27.50 46.35 130.78 -171.60 -127.09 148.47 1.56 98.41 0.02 1.34 0.11 0.02 0.00 0.01 0.00 98.46 0.05 95 C E E 3.74 24.35 24.06 48.12 126.28 -160.33 -123.63 142.22 9.83 90.04 0.12 8.34 0.98 0.13 0.03 0.05 0.00 90.04 0.42 96 A E E 7.93 19.66 24.05 43.47 129.39 -161.60 -123.41 146.77 18.28 81.41 0.31 16.38 1.64 0.31 0.11 0.15 0.00 80.60 0.81 97 T E E 25.40 16.54 21.59 37.97 125.10 -158.34 -116.09 142.90 28.43 71.15 0.41 22.12 6.27 1.01 0.12 0.28 0.00 68.48 1.72 98 R E E 105.81 10.34 19.00 29.68 115.97 -127.51 -93.17 131.05 44.74 54.78 0.47 34.46 10.11 1.27 0.17 0.38 0.00 49.63 3.98 99 S C C 30.90 11.53 11.94 24.74 121.40 -148.83 -97.08 152.05 86.01 13.46 0.53 77.51 6.26 1.59 0.12 0.48 0.00 12.51 1.52 100 P C T 105.64 3.01 13.09 17.47 94.62 -113.69 -67.15 -21.09 95.26 1.53 3.21 9.71 23.52 61.69 0.27 3.28 0.00 1.15 0.38 101 F C T 154.85 2.02 11.56 14.42 102.78 49.74 -95.74 11.01 94.96 1.43 3.60 7.18 24.23 63.38 0.34 3.45 0.00 0.94 0.48 102 G C S 41.64 4.28 12.10 17.81 126.11 -22.37 127.41 -173.69 89.54 6.46 4.00 24.97 47.63 17.08 0.51 3.66 0.00 4.15 2.00 103 D C C 110.88 3.01 13.55 17.79 106.96 -68.91 -86.67 73.39 87.43 8.61 3.97 43.29 25.46 19.06 0.61 3.67 0.00 6.04 1.87 104 Y C C 117.93 9.33 12.60 22.69 112.40 78.17 -97.87 106.13 73.85 20.91 5.24 42.12 18.82 13.94 1.04 4.56 0.02 15.11 4.39 105 A C C 50.53 9.49 16.56 26.79 112.78 -147.95 -90.55 132.93 68.67 27.50 3.83 39.11 21.15 9.95 0.82 3.24 0.02 22.10 3.61 106 F C C 59.27 16.83 15.39 31.63 119.66 -133.65 -100.40 138.82 62.53 35.01 2.45 41.31 15.37 7.03 0.56 2.07 0.01 30.28 3.38 107 S C C 39.21 12.71 20.35 33.12 112.82 -148.39 -92.91 129.64 56.93 41.56 1.51 40.22 13.38 4.63 0.30 1.26 0.00 38.46 1.74 108 Y E E 83.44 15.42 19.73 34.37 121.20 -142.80 -108.40 132.00 35.63 62.97 1.41 27.42 6.17 2.55 0.56 1.05 0.01 55.85 6.38 109 W E E 59.52 18.19 18.54 35.78 114.37 -163.21 -102.32 120.40 41.04 57.62 1.34 31.25 6.41 3.91 0.55 1.03 0.01 47.52 9.30 110 G C C 22.03 14.27 19.89 33.38 122.31 -137.84 70.02 -160.63 73.66 25.13 1.21 38.32 25.11 11.44 0.19 1.15 0.00 21.79 1.99 111 Q C S 103.78 8.29 22.42 30.68 99.26 -34.92 -81.37 2.14 80.26 18.27 1.47 29.35 37.42 14.00 0.17 1.37 0.00 16.15 1.54 112 G C C 15.48 17.42 18.97 35.11 124.18 -119.83 87.97 173.81 73.14 26.31 0.55 47.00 19.60 5.90 0.07 0.59 0.00 25.86 0.98 113 T E E 21.66 19.69 19.85 38.88 121.09 -96.11 -104.61 136.66 20.63 79.30 0.07 18.28 1.91 0.17 0.01 0.05 0.00 78.75 0.83 114 L E E 72.39 10.87 24.85 35.67 115.52 -137.47 -93.90 128.74 3.28 96.72 0.00 3.09 0.14 0.01 0.00 0.00 0.00 96.60 0.16 115 V E E 9.71 24.15 16.10 40.39 121.41 -166.23 -113.16 130.80 1.73 98.27 0.00 1.73 0.04 0.00 0.00 0.00 0.00 98.19 0.03 116 T E E 59.68 7.47 25.27 33.05 120.48 -157.47 -108.65 135.22 2.09 97.91 0.00 2.04 0.06 0.01 0.00 0.00 0.00 97.74 0.14 117 V E E 24.61 21.44 12.67 33.29 119.69 -157.26 -106.16 132.32 15.83 84.12 0.05 14.60 0.89 0.09 0.02 0.03 0.00 83.39 0.98 118 S C C 56.41 6.00 17.44 24.31 125.18 -166.07 -111.72 158.47 62.12 37.77 0.11 59.63 1.24 0.29 0.02 0.08 0.00 37.63 1.11 119 S C C 79.02 4.97 15.56 21.88 109.00 -95.67 -75.99 132.46 99.77 0.22 0.01 99.67 0.14 0.03 0.00 0.00 0.00 0.14 0.01