# 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 M C C 95.98 9.21 18.75 28.19 117.62 -148.33 -100.38 127.68 99.79 0.20 0.01 99.79 0.07 0.02 0.00 0.00 0.00 0.10 0.02 1 L C C 44.69 17.30 14.91 31.78 118.27 -150.16 -93.87 136.37 83.56 16.23 0.21 83.15 0.76 1.13 0.06 0.11 0.00 12.66 2.13 2 L C C 68.33 10.25 22.11 32.55 118.64 -147.73 -99.83 132.47 66.28 33.33 0.40 47.26 16.22 2.36 0.09 0.38 0.00 30.55 3.13 3 F E B 41.65 18.61 17.65 35.63 122.27 -147.55 -101.97 142.36 22.60 77.26 0.14 18.53 2.29 0.08 0.14 0.03 0.00 21.93 57.00 4 C C C 8.50 20.99 14.23 36.17 108.33 -106.84 -69.86 127.09 95.53 4.44 0.02 95.26 1.14 0.06 0.01 0.01 0.00 2.47 1.06 5 P C T 81.76 6.53 19.46 27.33 92.85 -147.96 -66.14 -26.77 99.61 0.13 0.26 0.49 6.00 93.13 0.01 0.25 0.00 0.08 0.04 6 G C T 47.49 4.54 18.45 23.91 98.00 47.61 -79.21 -38.41 99.62 0.09 0.29 0.13 4.09 95.49 0.00 0.22 0.00 0.04 0.03 7 C C T 46.44 10.48 15.47 26.99 102.06 20.81 -106.63 -12.62 99.42 0.29 0.29 0.89 6.06 92.57 0.01 0.26 0.00 0.14 0.08 8 G C C 36.29 8.03 19.22 28.25 95.15 -123.15 75.74 8.52 97.74 1.96 0.30 70.11 22.87 4.60 0.08 0.25 0.00 1.01 1.08 9 N C C 37.98 13.69 18.72 32.98 120.11 138.02 -82.95 152.70 93.58 6.25 0.17 64.74 27.43 1.68 0.03 0.17 0.00 4.49 1.46 10 G E E 13.01 15.30 23.25 38.47 119.77 -123.74 -87.88 147.23 11.53 88.35 0.12 8.54 2.35 0.17 0.06 0.06 0.00 59.89 28.92 11 L E E 4.69 25.61 18.09 44.29 117.23 -125.98 -85.35 138.25 24.02 75.96 0.01 21.89 1.59 0.03 0.00 0.01 0.00 75.85 0.62 12 I E E 47.92 11.32 26.28 38.01 125.01 -161.27 -115.58 139.87 5.09 94.91 0.00 4.97 0.13 0.00 0.00 0.00 0.00 94.71 0.19 13 V E E 30.11 20.41 16.06 35.98 118.19 -141.42 -100.04 129.99 2.45 97.54 0.01 2.38 0.07 0.01 0.00 0.00 0.00 97.43 0.11 14 E E E 77.18 7.52 19.06 27.72 127.61 -174.01 -127.06 144.67 3.09 96.89 0.02 2.66 0.26 0.03 0.00 0.01 0.00 96.81 0.22 15 E E E 122.91 6.23 12.95 21.21 118.10 -137.93 -101.36 132.30 16.97 82.91 0.12 13.45 2.73 0.51 0.02 0.10 0.00 82.75 0.45 16 G C C 32.26 5.25 10.85 18.05 130.87 166.47 -129.19 173.23 80.51 19.25 0.25 69.82 6.90 1.47 0.04 0.22 0.00 21.04 0.51 17 Q C S 160.15 0.59 12.22 11.82 96.29 -72.15 -67.88 -28.85 98.25 1.09 0.65 14.68 58.81 24.85 0.05 0.63 0.00 0.77 0.21 18 R C S 178.57 1.78 12.89 15.03 102.16 6.57 -100.92 -0.11 98.13 1.26 0.61 9.41 63.16 25.69 0.04 0.57 0.00 0.93 0.20 19 C C E 39.48 9.05 13.77 24.55 137.82 27.43 -147.79 162.26 51.88 47.84 0.28 35.91 13.78 1.94 0.03 0.29 0.00 47.08 0.97 20 H E E 41.94 14.36 15.16 30.69 119.98 -115.78 -107.21 133.80 11.76 88.22 0.02 10.60 0.66 0.07 0.00 0.01 0.00 88.45 0.20 21 R E E 53.97 12.82 21.03 34.64 128.21 -172.22 -125.96 144.06 0.81 99.19 0.00 0.72 0.03 0.00 0.00 0.00 0.00 99.23 0.02 22 F E E 15.04 20.76 19.57 40.53 121.18 -151.00 -109.01 135.49 0.14 99.86 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.86 0.00 23 A E E 19.69 12.58 23.88 37.34 130.97 -175.47 -130.25 148.36 0.61 99.38 0.00 0.58 0.01 0.00 0.00 0.00 0.00 99.34 0.06 24 C E E 7.78 20.88 14.19 35.76 115.74 -123.12 -83.33 138.32 43.33 56.66 0.01 42.26 0.69 0.04 0.00 0.01 0.00 56.59 0.41 25 N C S 97.26 5.20 21.21 27.36 93.18 -143.23 -74.59 -17.17 98.25 1.65 0.11 2.41 54.34 41.54 0.00 0.11 0.00 1.50 0.09 26 T C S 71.21 7.08 18.59 26.26 101.08 43.26 -99.37 -17.61 97.66 2.18 0.16 1.36 61.82 35.14 0.00 0.13 0.00 1.22 0.32 27 C C S 27.61 15.34 12.23 27.94 128.37 40.40 -128.35 144.42 96.12 3.72 0.16 17.76 77.77 1.17 0.03 0.11 0.00 2.13 1.03 28 P C S 90.09 4.63 18.99 24.39 95.35 -130.17 -73.71 -9.49 96.67 3.22 0.11 37.61 54.34 4.83 0.01 0.13 0.00 2.76 0.32 29 Y C C 81.32 10.67 16.11 28.04 116.77 107.33 -83.91 138.05 75.10 24.80 0.10 64.04 8.15 0.77 0.02 0.08 0.00 26.22 0.71 30 V E E 61.50 13.99 16.25 30.37 124.84 -168.17 -122.01 135.17 8.34 91.59 0.07 8.23 0.27 0.03 0.04 0.03 0.00 90.32 1.09 31 H E E 54.12 13.24 17.39 31.43 126.54 -171.98 -125.78 140.45 1.45 98.54 0.01 1.40 0.04 0.00 0.00 0.00 0.00 98.39 0.15 32 N E E 95.30 4.51 22.06 26.96 112.73 -115.04 -75.48 131.82 6.24 93.73 0.03 6.00 0.25 0.03 0.01 0.01 0.00 93.39 0.31 33 I C C 22.82 21.61 8.92 29.52 113.91 -140.68 -91.95 126.45 66.94 32.51 0.54 65.13 1.34 0.28 0.18 0.28 0.00 31.92 0.87 34 T C C 100.88 2.04 18.83 20.76 100.19 175.55 -99.66 -17.81 84.96 12.31 2.73 46.95 35.23 2.67 1.39 1.42 0.00 11.61 0.73 35 R C S 127.62 3.61 17.66 22.21 132.36 27.02 -136.57 155.11 79.37 15.56 5.07 27.98 47.83 3.51 3.26 1.77 0.01 14.66 0.99 36 K C C 123.88 7.02 15.79 24.28 114.42 -105.41 -79.90 136.77 76.93 19.34 3.72 71.51 3.60 1.41 2.35 1.41 0.00 17.96 1.76 37 V C C 37.96 16.42 9.93 26.07 114.81 -143.49 -96.95 126.71 63.47 32.33 4.21 58.16 3.28 1.29 2.97 1.23 0.00 22.27 10.79 38 T C C 90.82 3.86 15.11 20.16 109.87 -175.20 -103.46 28.79 79.90 16.29 3.81 60.38 15.02 4.22 2.41 1.56 0.00 14.27 2.13 39 N C C 110.30 3.58 14.48 18.95 106.97 33.92 -98.91 69.87 83.07 13.27 3.66 51.84 23.80 7.55 1.80 2.06 0.00 11.44 1.52 40 R C C 115.70 10.36 10.43 21.43 115.45 132.73 -97.71 128.17 84.39 12.78 2.84 55.72 22.25 6.35 1.36 1.65 0.00 10.86 1.81 41 K C C 132.45 3.90 15.30 20.64 117.52 -156.68 -103.85 129.93 80.27 17.86 1.87 57.00 19.76 3.18 1.04 1.04 0.00 12.76 5.21 42 Y C C 113.74 10.82 12.99 24.51 117.08 -146.27 -105.41 125.38 88.27 11.19 0.55 69.57 18.07 0.75 0.33 0.26 0.00 9.48 1.54 43 P C C 47.78 13.60 11.35 25.36 114.99 -118.00 -70.12 149.05 86.63 10.82 2.55 78.25 5.61 2.66 1.16 1.22 0.00 9.44 1.65 44 K C C 143.55 2.93 16.99 20.88 114.73 -132.29 -95.44 132.25 82.03 13.39 4.57 69.86 8.09 3.60 2.62 2.04 0.00 9.75 4.03 45 L C C 78.95 13.32 10.05 23.20 115.13 -129.09 -87.54 133.18 72.13 14.92 12.95 56.93 10.72 4.28 7.12 5.89 0.01 12.14 2.91 46 K C C 123.69 4.73 14.58 20.81 115.68 -163.57 -98.38 141.99 66.90 17.94 15.16 47.40 14.87 4.96 8.28 6.80 0.02 15.28 2.39 47 E C C 127.18 4.34 15.30 21.20 116.65 -103.98 -91.88 132.53 60.46 24.04 15.50 50.98 5.86 3.56 8.34 6.97 0.02 21.03 3.24 48 V C C 49.77 15.24 10.22 25.21 118.40 -158.56 -107.42 129.23 62.43 20.19 17.38 53.86 4.92 3.33 11.25 6.24 0.01 17.05 3.34 49 D C C 98.76 4.28 16.03 21.55 105.94 -168.34 -97.94 29.09 65.32 14.97 19.71 38.35 17.47 9.99 12.47 7.29 0.10 12.15 2.17 50 D C C 84.05 7.26 15.95 24.02 109.82 35.96 -99.93 95.81 65.21 16.12 18.67 39.37 14.88 11.40 11.30 7.41 0.07 13.15 2.43 51 V C C 56.04 14.23 12.95 26.96 109.58 166.69 -89.90 107.91 61.40 19.41 19.20 34.38 15.88 12.07 12.52 6.80 0.27 14.17 3.90 52 L C C 81.84 9.59 15.12 25.22 105.45 -44.08 -81.44 88.26 67.40 18.19 14.41 27.75 17.56 23.62 8.71 5.37 0.39 12.28 4.32 53 G C C 43.29 6.32 16.22 23.36 104.42 0.53 88.25 0.48 83.91 6.95 9.14 34.17 23.98 27.20 4.05 4.37 0.03 4.42 1.77 54 G C S 26.48 7.84 15.70 24.83 124.80 -107.95 92.49 -174.12 69.66 3.28 27.06 27.28 29.95 13.48 18.21 7.86 0.06 1.46 1.71 55 A H G 66.44 7.81 14.11 22.97 93.71 -55.63 -65.88 -33.72 30.55 1.42 68.03 6.26 5.73 17.08 34.47 34.88 0.22 0.84 0.52 56 A H G 73.79 2.53 17.37 19.96 92.95 57.60 -67.11 -31.08 23.11 1.36 75.54 4.41 3.47 13.49 36.31 40.95 0.12 0.93 0.33 57 A H G 32.13 11.15 13.37 25.86 93.04 58.66 -69.14 -28.14 21.21 1.26 77.53 4.74 3.21 11.57 38.26 40.97 0.07 0.88 0.30 58 W H G 49.17 18.28 11.27 28.65 97.27 49.33 -90.99 1.91 35.92 2.52 61.55 11.61 6.01 17.42 29.65 32.74 0.12 1.49 0.96 59 E C T 130.58 3.47 16.43 21.47 93.56 99.38 -65.88 -26.47 69.83 1.85 28.32 5.02 5.18 58.58 16.77 12.23 0.11 1.07 1.04 60 N C T 124.00 1.77 17.33 18.89 96.94 41.21 -93.20 9.00 78.75 0.93 20.32 5.16 6.54 67.39 8.98 10.86 0.02 0.63 0.41 61 V C C 32.23 19.40 9.03 27.17 117.67 113.44 -85.19 138.98 91.60 5.95 2.46 56.31 32.79 3.06 1.29 1.05 0.00 3.97 1.52 62 D C C 89.72 4.34 20.85 25.46 111.18 -120.79 -78.98 128.91 76.73 22.21 1.06 69.88 3.86 2.06 0.33 0.64 0.00 21.07 2.17 63 S E E 47.86 17.10 12.38 28.29 131.76 -169.26 -131.14 150.71 35.83 63.57 0.61 31.31 3.11 0.68 0.30 0.37 0.00 57.39 6.83 64 T E E 56.22 7.27 18.61 27.04 129.92 -163.37 -130.81 152.87 31.04 68.64 0.32 28.17 2.06 0.40 0.13 0.19 0.00 66.36 2.68 65 A E E 72.00 8.00 16.21 25.50 115.76 -130.15 -97.56 127.88 37.04 62.77 0.18 28.25 8.59 0.72 0.04 0.15 0.00 61.19 1.04 66 E E E 77.43 7.72 17.28 26.35 131.84 157.17 -133.52 150.32 35.20 64.68 0.12 27.20 8.39 0.46 0.03 0.10 0.00 62.03 1.79 67 S E E 70.96 4.69 19.58 25.09 115.77 -104.35 -74.15 142.80 41.74 58.10 0.16 39.75 1.83 0.17 0.09 0.09 0.00 42.35 15.72 68 C C C 7.59 22.39 8.46 30.44 110.23 -112.77 -73.25 127.22 95.07 4.88 0.06 94.51 1.19 0.13 0.01 0.03 0.00 2.81 1.32 69 P C T 93.87 2.82 18.84 22.01 92.92 -141.76 -65.38 -26.14 98.99 0.37 0.64 1.59 16.70 80.53 0.03 0.80 0.00 0.25 0.12 70 K C T 117.19 5.29 16.40 22.79 98.94 43.35 -82.11 -38.22 99.38 0.13 0.48 0.23 9.72 89.43 0.01 0.51 0.00 0.06 0.04 71 C C T 38.02 12.03 12.52 25.37 104.85 20.27 -108.61 -6.07 98.82 0.55 0.63 2.06 15.48 81.11 0.02 0.81 0.00 0.32 0.20 72 E C C 144.16 2.48 18.69 21.57 94.21 -124.20 61.22 24.71 95.98 3.74 0.28 78.66 11.50 5.69 0.07 0.27 0.00 1.91 1.90 73 H C C 42.35 14.14 11.90 26.90 117.55 145.49 -84.47 140.10 89.62 10.23 0.14 76.65 12.41 1.04 0.02 0.17 0.00 6.91 2.80 74 P C S 81.87 5.35 20.79 26.69 93.42 -126.98 -69.33 -20.49 82.79 16.96 0.25 13.01 56.06 13.24 0.01 0.36 0.00 16.70 0.62 75 R E E 87.11 10.47 21.29 31.88 127.96 31.34 -131.99 143.43 30.28 69.54 0.18 14.81 8.81 5.46 0.01 0.28 0.00 70.36 0.28 76 A E E 5.59 22.78 16.80 39.69 134.21 -174.78 -136.60 151.81 3.79 96.21 0.00 3.57 0.15 0.00 0.00 0.00 0.00 96.15 0.12 77 Y E E 41.36 13.17 25.30 39.12 128.59 -153.60 -124.10 146.27 0.28 99.72 0.00 0.29 0.01 0.00 0.00 0.00 0.00 99.69 0.02 78 F E E 19.15 22.22 19.32 40.98 126.88 -163.80 -121.15 140.78 0.20 99.80 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.78 0.01 79 M E E 40.45 13.35 23.16 36.87 126.65 -169.47 -121.33 142.67 0.95 99.04 0.01 0.91 0.04 0.00 0.00 0.00 0.00 99.02 0.02 80 Q E E 50.78 15.72 19.19 34.78 116.39 -140.08 -93.97 132.45 4.58 95.31 0.11 4.32 0.28 0.06 0.04 0.04 0.00 94.97 0.29 81 L E E 45.09 13.47 17.55 31.67 119.53 -168.17 -108.88 138.46 34.64 64.93 0.42 30.12 3.59 0.48 0.16 0.24 0.00 64.47 0.96 82 Q C C 92.19 8.28 17.01 26.25 114.90 -128.73 -93.16 128.73 61.67 37.79 0.54 53.65 6.11 0.97 0.18 0.38 0.00 36.44 2.26 83 T C C 59.60 10.24 13.03 24.18 112.28 -169.07 -103.52 125.77 80.27 18.87 0.86 61.61 15.37 3.08 0.24 0.72 0.00 15.98 3.00 84 R C C 147.19 4.30 12.88 18.54 115.37 -112.48 -101.87 135.63 89.21 9.80 1.00 44.44 39.07 6.31 0.20 0.89 0.00 6.76 2.33 85 S C C 56.18 4.25 12.05 17.79 124.11 -59.55 -106.93 158.56 84.22 14.16 1.62 49.88 27.86 6.63 0.45 1.28 0.00 6.11 7.79 86 A C T 85.13 3.50 9.82 15.13 93.40 -107.37 -64.01 -25.99 97.86 1.08 1.06 4.39 22.31 71.08 0.08 1.08 0.00 0.67 0.39 87 D C T 124.40 0.91 12.02 12.50 96.68 50.11 -88.33 -1.86 98.31 1.04 0.64 6.52 21.94 69.73 0.04 0.76 0.00 0.79 0.22 88 E C S 89.94 6.49 9.88 18.35 120.39 74.29 -108.89 138.82 89.26 10.48 0.26 32.29 57.22 0.93 0.06 0.18 0.00 5.09 4.23 89 P C C 80.84 4.40 14.81 20.41 115.91 -110.28 -68.03 153.18 91.61 8.19 0.20 76.10 13.16 1.99 0.03 0.22 0.00 7.58 0.91 90 M C C 83.73 11.02 13.74 25.46 114.73 -104.86 -73.70 141.09 73.99 25.82 0.19 66.02 5.19 0.97 0.03 0.19 0.00 26.64 0.96 91 T E E 28.11 14.37 16.62 32.00 124.79 -154.04 -114.80 144.90 10.89 89.08 0.03 10.00 0.79 0.06 0.01 0.02 0.00 88.49 0.63 92 T E E 32.36 13.90 20.36 35.10 119.26 -141.58 -106.73 132.50 1.77 98.23 0.01 1.62 0.11 0.01 0.00 0.00 0.00 98.21 0.05 93 F E E 22.65 17.80 21.15 39.19 124.87 -166.85 -115.37 141.12 0.59 99.41 0.00 0.54 0.02 0.00 0.00 0.00 0.00 99.42 0.01 94 Y E E 14.91 21.13 21.83 42.82 123.95 -159.15 -116.45 137.09 0.21 99.79 0.00 0.20 0.00 0.00 0.00 0.00 0.00 99.79 0.00 95 K E E 47.95 13.98 25.83 39.79 126.27 -164.68 -122.71 139.16 0.35 99.65 0.00 0.33 0.01 0.00 0.00 0.00 0.00 99.64 0.03 96 C E E 6.81 21.62 16.15 38.50 116.16 -123.65 -80.07 141.39 12.47 87.51 0.01 12.03 0.31 0.02 0.00 0.01 0.00 87.05 0.57 97 C C S 46.74 10.41 21.07 32.76 95.97 -147.62 -87.53 -9.37 86.13 13.77 0.10 19.16 64.69 1.81 0.01 0.09 0.00 13.83 0.40 98 N C S 50.62 10.31 15.33 27.26 113.91 91.14 -88.53 125.39 87.59 11.94 0.47 20.25 65.60 2.29 0.12 0.32 0.00 9.02 2.40 99 A C T 81.44 3.92 14.78 20.62 92.12 -137.04 -62.58 -30.84 86.78 0.48 12.74 1.96 15.71 68.28 0.64 12.90 0.00 0.24 0.27 100 Q C T 137.04 1.70 17.63 18.92 93.93 56.12 -72.63 -29.27 88.05 0.33 11.62 1.48 9.48 76.45 0.69 11.55 0.00 0.18 0.18 101 C C T 32.36 14.16 12.71 27.34 100.53 34.61 -99.47 -10.14 86.84 3.40 9.77 7.74 13.03 64.60 0.77 10.50 0.00 2.53 0.82 102 G C C 29.71 8.66 18.33 28.01 100.61 -125.56 71.39 17.58 79.49 19.64 0.87 65.61 9.10 3.83 0.14 0.90 0.00 18.74 1.69 103 H C E 53.84 15.05 15.14 30.39 117.52 151.79 -77.28 145.22 51.19 48.69 0.12 46.43 2.67 0.62 0.02 0.10 0.00 49.47 0.69 104 R E E 105.66 9.49 21.12 31.37 129.97 -167.89 -129.42 145.04 5.18 94.79 0.03 4.86 0.34 0.04 0.01 0.02 0.00 93.94 0.80 105 W E E 62.89 17.81 13.86 31.15 123.73 -141.94 -108.71 145.22 4.95 95.01 0.04 4.71 0.22 0.03 0.03 0.02 0.00 93.75 1.24 106 R E E 114.39 7.86 15.65 24.78 122.54 -154.46 -112.62 141.66 42.17 57.73 0.11 41.15 0.56 0.19 0.03 0.05 0.00 56.97 1.03 107 D C C 97.87 5.87 15.00 22.27 110.84 -111.25 -74.55 129.08 99.74 0.25 0.01 99.63 0.13 0.03 0.00 0.00 0.00 0.20 0.01