# 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 Q C C 106.86 5.98 18.79 25.82 119.19 -161.52 -102.74 132.94 99.35 0.63 0.02 99.42 0.06 0.02 0.01 0.00 0.00 0.47 0.02 1 L C C 48.26 18.72 11.63 29.19 121.34 -157.67 -110.77 134.03 60.03 39.42 0.55 59.36 0.42 0.28 0.30 0.14 0.00 38.41 1.08 2 Q E E 96.48 5.21 20.85 26.87 122.91 -165.32 -117.64 137.44 32.72 66.33 0.96 29.43 2.01 0.67 0.59 0.40 0.00 65.58 1.32 3 L E E 49.10 20.04 12.68 31.57 119.32 -147.91 -101.07 132.55 30.16 68.61 1.23 27.46 1.74 0.63 0.70 0.52 0.00 67.78 1.16 4 V E E 67.39 8.16 20.58 29.44 121.89 -169.41 -115.94 135.82 31.49 67.06 1.45 27.31 2.88 0.88 0.86 0.60 0.00 66.04 1.43 5 E E E 97.42 12.26 16.64 28.87 115.86 -130.64 -91.61 132.44 43.37 54.34 2.28 33.84 6.77 2.56 0.92 1.31 0.00 53.34 1.24 6 S C C 53.81 11.28 17.27 28.56 105.50 -167.90 -97.21 6.53 65.54 32.68 1.78 37.53 17.48 10.83 0.42 1.40 0.00 31.22 1.13 7 G C S 37.19 9.06 18.92 28.15 116.77 -91.96 104.30 7.21 74.57 24.35 1.08 28.68 31.96 13.82 0.13 1.03 0.00 23.39 0.98 8 G C C 30.94 12.63 17.47 29.68 128.47 -43.37 130.72 175.75 67.40 32.11 0.49 44.08 18.74 3.97 0.07 0.52 0.00 31.74 0.88 9 G E E 24.22 12.46 19.35 31.73 135.92 -140.68 155.74 174.50 28.36 71.54 0.10 22.99 4.90 0.44 0.02 0.09 0.00 70.79 0.78 10 L E E 82.64 10.51 22.37 32.83 121.76 -94.47 -108.03 136.19 5.97 94.00 0.04 5.19 0.67 0.06 0.01 0.02 0.00 93.57 0.48 11 V E E 19.80 21.13 14.78 35.46 125.68 -169.50 -120.34 139.10 6.00 93.97 0.03 5.74 0.31 0.02 0.02 0.01 0.00 90.46 3.44 12 Q C C 91.72 5.63 23.08 28.88 120.51 -136.00 -90.08 147.88 86.86 13.10 0.04 86.86 0.50 0.06 0.01 0.02 0.00 11.89 0.66 13 P C T 70.98 11.91 14.65 26.94 109.81 -87.48 -59.35 137.47 99.12 0.64 0.24 0.33 2.30 96.67 0.01 0.19 0.00 0.44 0.05 14 G C T 51.71 3.07 19.22 22.88 96.51 21.93 87.26 -5.31 99.45 0.37 0.19 0.38 2.68 96.49 0.01 0.15 0.00 0.28 0.02 15 G C C 24.55 8.86 16.23 26.45 128.76 114.55 -91.54 173.17 92.02 7.93 0.06 73.69 18.26 0.30 0.01 0.06 0.00 7.05 0.63 16 S E E 55.66 9.16 20.37 30.38 130.85 -119.07 -125.00 152.28 48.53 51.45 0.02 48.93 0.58 0.03 0.00 0.01 0.00 49.37 1.07 17 L E E 16.45 22.90 15.74 38.45 124.87 -157.72 -120.66 139.63 1.97 98.02 0.00 1.89 0.05 0.00 0.00 0.00 0.00 97.95 0.11 18 R E E 113.84 8.04 25.34 34.11 119.86 -153.02 -112.10 129.34 0.65 99.35 0.00 0.61 0.02 0.00 0.00 0.00 0.00 99.34 0.02 19 L E E 6.27 25.73 16.86 43.04 123.97 -170.01 -118.26 136.40 2.78 97.20 0.02 2.59 0.11 0.01 0.01 0.00 0.00 97.18 0.09 20 S E E 37.89 10.23 26.94 37.60 128.49 -170.57 -122.26 146.92 14.31 85.59 0.10 13.13 0.69 0.09 0.03 0.05 0.00 85.80 0.20 21 C E E 6.53 25.11 17.31 42.49 133.72 -171.18 -138.56 147.14 22.44 77.22 0.33 20.33 1.53 0.32 0.12 0.17 0.00 76.88 0.65 22 E E E 78.93 8.73 27.20 36.66 120.32 -153.31 -113.95 134.32 19.82 79.56 0.63 17.42 1.92 0.56 0.29 0.38 0.00 75.87 3.57 23 A E E 9.43 24.23 14.75 38.67 123.42 -167.29 -118.23 136.88 46.50 52.28 1.23 41.47 3.36 1.15 0.36 0.89 0.00 50.08 2.68 24 S C C 58.81 7.14 21.56 29.05 121.54 -159.40 -105.84 140.72 65.02 33.25 1.72 35.31 21.09 10.64 0.28 1.57 0.00 29.34 1.77 25 G C S 40.05 5.62 19.46 25.85 120.61 23.41 108.84 -164.29 78.82 19.20 1.98 17.28 46.37 15.44 0.26 1.64 0.00 17.52 1.49 26 K C C 109.58 8.61 17.13 26.37 115.83 -46.59 -95.40 134.49 77.75 19.86 2.39 53.77 18.58 5.73 0.53 2.07 0.00 16.52 2.80 27 V C C 59.61 13.35 15.54 29.00 115.56 -158.55 -102.33 127.76 76.65 20.39 2.96 55.91 14.35 6.18 0.87 2.26 0.00 16.29 4.14 28 F C C 85.34 12.12 16.12 28.40 114.50 -154.39 -100.26 126.95 77.17 18.76 4.07 48.22 19.88 9.67 1.13 3.06 0.01 14.27 3.76 29 M C C 96.92 8.60 17.98 26.98 110.74 -150.59 -97.12 94.09 81.59 15.04 3.37 43.87 27.24 11.32 0.75 2.64 0.00 11.98 2.18 30 I C S 79.63 10.16 18.81 29.21 112.63 -30.38 -96.65 118.79 80.87 16.35 2.79 33.26 34.41 13.89 0.50 2.17 0.00 14.31 1.46 31 N C C 40.03 16.79 18.13 34.24 114.23 122.93 -101.83 129.59 68.17 30.73 1.09 31.62 28.65 8.06 0.13 0.96 0.00 29.66 0.91 32 A E E 24.55 14.16 24.56 38.85 126.04 -146.51 -117.78 144.92 25.52 74.19 0.29 21.55 3.08 0.60 0.06 0.22 0.00 74.00 0.49 33 M E E 4.81 25.83 20.56 46.53 127.89 -167.00 -124.16 142.04 3.34 96.65 0.01 3.00 0.20 0.02 0.00 0.01 0.00 96.63 0.14 34 G E E 6.09 17.81 27.59 45.30 135.88 -175.95 -136.38 159.17 1.03 98.96 0.00 0.90 0.04 0.00 0.00 0.00 0.00 99.03 0.01 35 W E E 7.11 25.09 22.49 47.58 129.48 -144.51 -126.56 143.76 0.69 99.31 0.00 0.60 0.03 0.00 0.00 0.00 0.00 99.36 0.01 36 Y E E 28.13 17.13 25.46 42.31 132.43 -172.65 -133.48 149.51 0.44 99.56 0.00 0.39 0.01 0.00 0.00 0.00 0.00 99.58 0.01 37 R E E 38.85 18.52 21.52 39.36 125.53 -157.63 -119.14 138.29 0.94 99.06 0.00 0.80 0.06 0.00 0.00 0.00 0.00 99.11 0.02 38 Q E E 49.34 12.88 19.32 32.87 117.68 -149.28 -106.44 130.88 9.37 90.62 0.01 8.60 0.46 0.02 0.00 0.01 0.00 90.40 0.50 39 A C C 25.15 11.70 14.67 27.94 118.29 -129.43 -78.47 151.90 96.65 3.30 0.05 95.17 1.28 0.31 0.01 0.03 0.00 2.84 0.36 40 P C T 85.93 6.95 13.00 21.37 109.63 -79.93 -59.17 135.92 99.28 0.17 0.55 0.50 3.90 94.83 0.01 0.63 0.00 0.10 0.04 41 G C T 67.81 0.40 13.59 11.81 96.39 17.52 83.34 -3.32 99.25 0.11 0.64 0.66 3.85 94.65 0.02 0.73 0.00 0.07 0.02 42 K C S 113.23 4.93 10.05 16.99 126.82 93.53 -112.63 163.64 96.82 2.38 0.79 37.85 56.31 2.85 0.12 0.68 0.00 1.10 1.08 43 Q C C 132.83 1.62 16.83 18.02 116.37 -95.34 -76.56 151.90 94.96 4.94 0.11 82.20 12.32 0.52 0.02 0.10 0.00 4.28 0.56 44 R E E 99.91 14.94 12.00 26.41 115.15 -102.47 -74.30 137.67 48.60 51.35 0.05 46.66 1.19 0.08 0.01 0.04 0.00 51.58 0.45 45 E E E 63.50 11.28 19.51 31.61 126.26 -168.92 -123.40 138.28 4.97 95.01 0.02 4.44 0.34 0.02 0.00 0.01 0.00 95.03 0.15 46 L E E 54.98 15.09 21.05 35.90 110.90 -116.01 -73.72 127.92 1.27 98.73 0.00 1.22 0.03 0.00 0.00 0.00 0.00 98.73 0.02 47 V E E 7.03 22.32 21.45 44.09 102.29 175.47 -100.65 -30.45 6.08 93.92 0.00 3.67 1.75 0.02 0.00 0.00 0.00 94.55 0.01 48 A E E 2.92 22.60 23.20 46.09 142.39 -1.16 -156.80 155.18 0.46 99.54 0.00 0.34 0.04 0.00 0.00 0.00 0.00 99.62 0.00 49 F E E 31.38 17.91 26.06 43.22 132.06 -163.96 -137.21 144.94 0.14 99.86 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.87 0.00 50 I E E 11.58 21.08 20.32 41.60 119.13 -152.13 -113.08 126.59 0.42 99.58 0.00 0.38 0.01 0.00 0.00 0.00 0.00 99.55 0.05 51 S E E 20.89 11.54 19.84 32.49 127.76 -160.18 -96.88 170.35 48.38 51.54 0.08 46.49 1.07 0.15 0.01 0.06 0.00 51.51 0.69 52 R C T 126.92 11.23 15.00 26.65 91.38 -98.71 -64.21 -21.95 96.99 1.64 1.37 1.01 5.86 90.28 0.05 1.34 0.00 1.28 0.18 53 R C T 170.81 1.33 18.02 18.20 93.39 57.40 -86.44 -0.28 98.26 0.26 1.47 0.58 5.04 92.61 0.05 1.51 0.00 0.15 0.06 54 G C S 35.53 10.41 13.82 24.71 98.81 -101.56 88.38 5.96 97.03 1.03 1.94 15.59 73.83 7.70 0.16 1.73 0.00 0.64 0.35 55 N C C 78.03 4.62 19.89 25.41 118.78 137.00 -80.55 146.19 88.48 11.48 0.04 86.39 1.90 0.19 0.01 0.03 0.00 11.03 0.45 56 I E E 53.58 19.92 13.26 32.17 125.44 -154.43 -121.37 136.07 2.85 97.15 0.00 2.79 0.09 0.00 0.00 0.00 0.00 96.81 0.29 57 N E E 63.07 8.67 23.78 33.00 131.35 -173.72 -132.53 147.00 0.72 99.28 0.00 0.65 0.03 0.00 0.00 0.00 0.00 99.29 0.03 58 Y E E 76.71 18.36 16.87 34.18 126.29 -150.39 -116.33 142.03 7.73 92.25 0.02 7.29 0.37 0.03 0.01 0.01 0.00 91.76 0.53 59 A C C 15.70 17.38 13.68 31.54 114.20 -114.78 -72.56 142.98 92.00 7.62 0.39 89.55 2.11 0.36 0.09 0.24 0.00 7.26 0.40 60 D H G 114.06 2.28 18.72 21.54 93.14 -123.06 -62.04 -30.96 36.47 0.64 62.89 2.87 5.22 26.96 2.26 62.10 0.00 0.41 0.18 61 S H G 60.84 7.09 17.75 25.93 91.10 60.89 -70.28 -18.28 36.51 0.30 63.18 1.07 3.26 30.79 1.97 62.64 0.00 0.18 0.10 62 V H G 9.26 22.49 10.92 33.40 97.98 45.21 -101.23 -1.04 37.19 0.98 61.83 2.81 4.94 28.52 2.40 60.39 0.01 0.63 0.30 63 K C T 122.85 7.16 15.10 24.68 110.28 123.46 -60.59 130.49 92.05 3.38 4.57 3.41 5.03 84.03 1.36 2.48 0.01 1.64 2.04 64 G C T 61.76 1.33 18.66 19.00 94.31 12.81 80.56 -3.91 96.36 0.35 3.28 0.79 4.36 91.78 0.37 2.34 0.00 0.21 0.14 65 R C T 90.09 11.88 17.23 29.35 101.34 72.87 -99.87 -23.71 96.34 1.08 2.58 4.53 22.54 69.41 0.27 2.13 0.00 0.90 0.21 66 F E E 9.89 23.76 13.04 37.10 135.34 31.06 -137.67 153.36 16.64 83.29 0.06 11.87 5.09 0.29 0.02 0.05 0.00 80.79 1.88 67 T E E 60.46 6.83 26.40 33.86 125.36 -156.33 -121.71 142.14 2.45 97.55 0.00 2.29 0.08 0.00 0.00 0.00 0.00 97.55 0.07 68 I E E 20.19 24.06 15.14 38.97 122.10 -158.12 -117.71 130.69 1.67 98.33 0.00 1.64 0.03 0.00 0.00 0.00 0.00 98.30 0.02 69 S E E 45.85 7.36 25.35 33.03 131.28 -173.90 -131.75 149.06 2.02 97.98 0.00 1.85 0.06 0.00 0.00 0.00 0.00 98.06 0.02 70 R E E 81.61 18.28 13.97 31.31 124.31 -155.25 -121.21 134.83 2.67 97.32 0.01 2.30 0.22 0.02 0.00 0.01 0.00 97.31 0.16 71 D E E 56.58 7.12 16.94 25.72 108.62 -151.13 -102.78 106.42 16.73 83.23 0.04 16.12 0.61 0.07 0.01 0.03 0.00 82.23 0.92 72 N C T 96.04 7.76 12.96 22.46 93.51 -168.11 -68.13 -26.87 92.32 0.32 7.36 0.81 4.28 85.96 0.13 8.55 0.00 0.20 0.09 73 A C T 90.60 1.03 15.72 15.87 93.04 55.80 -68.91 -35.59 92.13 0.35 7.51 0.45 3.59 87.23 0.12 8.29 0.00 0.19 0.13 74 K C T 111.09 4.35 16.10 21.24 97.84 30.21 -96.69 -5.49 94.52 0.11 5.37 0.74 4.27 88.37 0.10 6.43 0.00 0.06 0.04 75 N C T 53.08 13.33 15.55 29.87 94.95 -128.38 57.54 42.44 99.61 0.16 0.23 6.60 4.58 88.48 0.04 0.15 0.00 0.12 0.02 76 T E E 25.62 12.45 21.70 35.29 132.64 130.56 -131.79 153.56 9.55 90.44 0.01 8.33 0.90 0.05 0.00 0.01 0.00 89.52 1.20 77 V E E 5.15 24.40 18.93 43.94 121.66 -152.22 -116.87 132.95 1.45 98.55 0.00 1.37 0.03 0.00 0.00 0.00 0.00 98.51 0.09 78 Y E E 49.53 12.95 26.93 40.39 120.82 -161.91 -114.71 131.61 2.20 97.80 0.00 2.03 0.04 0.00 0.00 0.00 0.00 97.92 0.01 79 L E E 3.16 26.15 20.02 46.91 119.67 -161.30 -111.70 129.24 0.31 99.69 0.00 0.29 0.00 0.00 0.00 0.00 0.00 99.70 0.00 80 Q E E 52.57 11.61 27.36 39.43 119.90 -162.61 -111.59 128.82 0.12 99.88 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.88 0.00 81 M E E 7.87 24.57 17.39 42.29 120.18 -168.50 -115.51 127.26 11.68 88.31 0.00 11.92 0.08 0.00 0.00 0.00 0.00 87.39 0.60 82 N C C 62.89 8.45 22.94 31.61 120.78 -156.03 -95.83 154.26 96.90 3.06 0.04 50.44 42.78 3.25 0.00 0.07 0.00 3.28 0.17 83 S C S 60.87 5.94 24.20 30.34 97.58 8.67 58.26 55.81 99.33 0.64 0.03 9.60 86.08 3.72 0.00 0.03 0.00 0.48 0.09 84 L C C 15.80 24.28 11.28 35.26 114.70 -155.52 -75.74 135.63 99.03 0.96 0.01 97.69 1.46 0.02 0.00 0.00 0.00 0.27 0.56 85 R C C 105.50 4.81 24.59 29.46 130.64 -171.08 -126.02 156.54 99.86 0.12 0.01 99.41 0.47 0.01 0.00 0.00 0.00 0.03 0.08 86 P H G 67.17 13.26 16.14 29.44 91.10 -103.33 -58.92 -32.36 3.98 0.02 96.00 0.23 0.24 2.47 0.29 96.75 0.00 0.02 0.00 87 E H G 114.11 5.20 21.92 27.96 89.98 62.62 -70.96 -15.50 3.15 0.03 96.82 0.11 0.18 2.11 0.26 97.31 0.00 0.02 0.00 88 D H G 11.90 21.63 17.09 39.10 94.07 64.68 -85.09 -1.17 4.49 0.06 95.45 0.82 0.48 1.61 0.38 96.66 0.00 0.04 0.00 89 T C C 29.77 17.75 21.72 39.21 116.33 106.28 -79.72 136.73 92.37 7.43 0.19 89.38 3.31 0.16 0.03 0.14 0.00 6.55 0.42 90 A E E 11.13 18.81 24.30 42.44 143.55 145.32 -156.74 168.89 5.75 94.23 0.02 5.44 0.32 0.02 0.00 0.01 0.00 93.65 0.55 91 I E E 27.86 18.11 25.99 43.58 119.02 -103.07 -103.90 132.73 0.97 99.03 0.00 0.99 0.03 0.00 0.00 0.00 0.00 98.94 0.04 92 Y E E 6.48 25.24 23.05 48.04 123.46 -162.65 -114.34 137.58 0.59 99.41 0.00 0.56 0.02 0.00 0.00 0.00 0.00 99.39 0.02 93 Y E E 23.70 20.16 28.01 47.02 131.90 -171.80 -129.76 148.98 1.79 98.18 0.02 1.57 0.10 0.01 0.00 0.01 0.00 98.25 0.05 94 C E E 2.81 25.60 23.89 49.25 128.46 -164.24 -126.04 144.25 12.08 87.72 0.20 9.63 1.85 0.32 0.05 0.11 0.00 87.75 0.28 95 S E E 11.07 18.57 26.82 44.89 127.41 -162.45 -118.80 147.41 16.64 82.98 0.38 14.25 2.21 0.43 0.17 0.22 0.00 81.25 1.48 96 A E E 12.99 20.84 20.43 40.68 125.00 -154.24 -115.99 143.19 40.97 58.62 0.42 34.01 6.10 0.67 0.18 0.29 0.00 53.69 5.05 97 D C C 41.33 11.89 19.41 32.22 114.14 -132.14 -95.85 126.35 84.28 14.99 0.73 72.74 9.74 1.29 0.21 0.55 0.00 13.81 1.66 98 P C T 71.24 9.97 15.97 26.78 96.57 -135.00 -66.19 -19.84 80.97 4.09 14.94 25.83 18.93 37.17 2.87 11.43 0.01 2.72 1.05 99 R C T 156.13 3.24 16.56 20.48 97.77 58.50 -83.45 -5.36 78.57 3.50 17.93 21.57 19.37 38.63 4.01 12.95 0.02 1.91 1.53 100 S C C 46.70 10.91 11.93 23.58 109.15 89.51 -88.83 106.51 76.62 4.67 18.71 31.96 24.83 20.86 4.31 13.40 0.02 2.22 2.39 101 N C C 94.75 6.03 15.05 22.20 105.02 -140.19 -88.04 52.33 82.26 4.66 13.09 42.98 19.67 19.98 4.01 8.70 0.01 2.25 2.40 102 L C C 76.30 11.63 11.48 23.32 103.88 150.29 -82.89 3.26 78.63 4.62 16.75 34.81 21.82 22.99 4.92 10.80 0.02 2.11 2.53 103 D C C 99.51 4.28 14.60 20.00 102.26 69.58 -84.01 10.16 78.20 2.94 18.86 29.86 21.03 28.31 4.69 13.07 0.02 1.33 1.70 104 D C T 93.99 5.44 15.09 21.56 100.60 42.09 -82.14 14.48 77.34 1.47 21.20 14.93 19.46 43.48 4.31 16.09 0.02 0.73 0.98 105 G C T 33.34 11.19 15.78 27.06 101.96 -88.62 79.31 4.76 79.00 2.86 18.13 23.26 20.42 36.20 3.23 14.10 0.01 1.55 1.23 106 R C C 99.13 11.22 18.77 30.05 107.58 114.44 -90.55 71.41 72.46 13.30 14.25 42.63 16.81 13.84 3.05 11.28 0.02 9.12 3.25 107 Y C C 56.39 17.77 18.75 35.67 116.93 100.80 -101.49 127.04 56.31 38.73 4.96 39.57 9.93 5.77 1.99 3.44 0.04 28.70 10.57 108 W C C 51.57 19.18 20.30 38.29 108.18 -155.69 -96.58 55.79 50.53 47.84 1.63 39.54 6.08 2.76 0.93 0.99 0.01 34.15 15.53 109 G C C 18.56 16.51 21.23 36.38 122.38 -149.13 -25.60 -161.88 75.54 23.63 0.83 54.87 15.11 5.24 0.23 0.74 0.00 20.19 3.62 110 K C C 109.18 9.69 23.34 32.75 99.10 -60.97 -83.82 -0.48 81.77 17.56 0.67 53.05 24.24 5.11 0.13 0.64 0.00 14.67 2.17 111 G C C 14.85 18.66 18.74 35.83 126.85 -117.18 100.98 -177.84 76.39 23.41 0.20 56.32 17.36 2.26 0.03 0.23 0.00 22.42 1.37 112 T E E 27.10 17.89 20.65 38.10 120.77 -81.30 -106.23 135.46 27.17 72.80 0.03 24.73 2.10 0.08 0.01 0.02 0.00 71.65 1.41 113 P E E 65.19 10.71 24.24 34.76 113.62 -119.73 -74.87 134.42 9.58 90.42 0.01 9.25 0.28 0.01 0.00 0.00 0.00 90.16 0.29 114 V E E 12.78 23.75 15.32 38.92 122.72 -166.57 -117.07 132.26 4.45 95.55 0.00 4.50 0.10 0.01 0.00 0.00 0.00 95.29 0.11 115 T E E 63.16 7.18 24.77 32.29 121.82 -159.20 -111.06 135.04 3.47 96.52 0.01 3.38 0.14 0.01 0.00 0.00 0.00 96.01 0.45 116 V E E 29.06 20.96 12.93 32.95 120.58 -157.31 -109.16 131.45 17.87 82.08 0.05 16.57 0.96 0.11 0.02 0.03 0.00 81.09 1.22 117 S C C 57.61 6.05 17.24 24.27 125.66 -163.79 -110.68 156.93 62.15 37.74 0.11 60.29 0.88 0.25 0.02 0.07 0.00 37.34 1.16 118 S C C 75.39 6.16 15.31 22.71 109.50 -102.03 -76.88 136.59 99.83 0.16 0.01 99.72 0.12 0.03 0.00 0.00 0.00 0.11 0.01