A0A096NEH2_PAPAN Loading...

Ataxin 1 like

AlphaFold DB , UniProt , Accession A0A096NEH2, Species PAPAN (Papio anubis, Olive baboon), Gene ATXN1L, Length 689 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.4	Very low	42.2	Very low	246 Å²	246	139.8 Å²	139.8	100%	1.212	71%	0.708	S	S	*	*				0	158.9	0	-69.4	145.7	72.9	0	0	108.7
2	K	49.6	Very low	42.3	Very low	194 Å²	194	141.8 Å²	141.8	84%	0.843	72%	0.72	S	S	*	*			trans	-99.4	174.8	171.3	-74.7	-173.7	176.8	-175.8	0	109.1
3	P	53.6	Low	42.3	Very low	120 Å²	120	139.8 Å²	139.8	78%	0.779	72%	0.723	S	S	*	*			cis	-115.8	-174.2	5.3	22.4	3	0	0	0	112.5
4	V	41.9	Very low	42.3	Very low	130 Å²	130	139.2 Å²	139.2	79%	0.788	73%	0.732	S	S	*	*			cis	84.2	100.6	21.2	-173.5	0	0	0	0	117.3
5	H	39	Very low	41.9	Very low	177 Å²	177	143.2 Å²	143.2	82%	0.819	74%	0.741	S	S	*	*			trans	-167	169.8	144.8	-153.9	45.8	0	0	0	114.4
6	E	42.9	Very low	42.1	Very low	148 Å²	148	146 Å²	146	69%	0.692	75%	0.746	S	S	*	*			trans	-102.6	172.8	-177	-58	157.2	54.5	0	0	111.8
7	R	45	Very low	42.5	Very low	130 Å²	130	151.8 Å²	151.8	49%	0.491	76%	0.756	S	S	.	*			cis	77.5	141.3	16.9	-158.8	-179.8	167.5	72	32.8	115.4	T205	R7-T205 WeakPolarHBondContact O-CG2 3.35Å
8	S	43.3	Very low	42	Very low	44 Å²	44	150.4 Å²	150.4	31%	0.308	75%	0.752	S	S	.	*			cis	-159.4	164.5	-25.5	54.6	0	0	0	0	108.7	T205 P207	S8-T205 VanDerWaalsContact N-CG2 3.27Å; S8-T205 WeakPolarHBondContact O-CB 3Å; S8-T205 WeakPolarHBondContact O-CG2 3.5Å; S8-P207 VanDerWaalsContact CB-O 3.28Å; S8-P207 WeakPolarHBondContact CB-O 3.43Å
9	Q	35.4	Very low	41.7	Very low	89 Å²	89	150.4 Å²	150.4	42%	0.416	75%	0.754	S	S	.	*			cis	-160.9	147.8	-0.6	-127.4	167.8	-76	0	0	113.7	T205 S206 P207	Q9-T205 CarbonylContact C-O 3.59Å; Q9-S206 VanDerWaalsContact CA-O 3.32Å; Q9-S206 WeakPolarHBondContact CA-O 3.32Å; Q9-P207 WeakPolarHBondContact CG-O 3.39Å; Q9-P207 PolarHBondContact OE1-O 3.23Å
10	E	39.9	Very low	41.5	Very low	152 Å²	152	149.5 Å²	149.5	71%	0.71	76%	0.759	S	S	*	*			trans	72	-173.8	135	-136.1	163.7	103.4	0	0	123.5	S206	E10-S206 PolarHBondContact N-O 2.86Å
11	C	38.5	Very low	41.2	Very low	108 Å²	108	148.3 Å²	148.3	73%	0.73	76%	0.759	S	S	*	*			trans	-117.6	-179.3	-161.1	-65.2	0	0	0	0	113.8
12	L	42.4	Very low	40.8	Very low	163 Å²	163	143.1 Å²	143.1	85%	0.853	74%	0.741	S	S	*	*			trans	86	142	162	-54.4	179.1	0	0	0	118.7
13	P	42.3	Very low	39.8	Very low	117 Å²	117	138 Å²	138	76%	0.76	73%	0.73	S	S	*	*			trans	-94.3	145.6	-179.3	36.5	-34.5	0	0	0	113.8
14	P	43.1	Very low	38.8	Very low	131 Å²	131	140.6 Å²	140.6	85%	0.851	73%	0.732	S	S	*	*			trans	-83.6	153.8	177.1	33.5	-35.1	0	0	0	113.6
15	K	35.3	Very low	38.2	Very low	199 Å²	199	140.8 Å²	140.8	87%	0.865	73%	0.728	S	S	*	*			trans	-116.4	122.8	-177.8	-179.7	179	-179.8	178.2	0	111.2
16	K	45.8	Very low	38	Very low	188 Å²	188	138.6 Å²	138.6	82%	0.817	72%	0.72	S	S	*	*			trans	42.1	138.1	166.6	-74.1	-157.6	171.7	-162.3	0	120.4
17	R	48.7	Very low	37.5	Very low	244 Å²	244	134.6 Å²	134.6	92%	0.921	72%	0.719	S	S	*	*			trans	-152.2	152.7	153.5	-150.7	178.8	-64.5	161.2	0.3	109.2
18	D	33.1	Very low	37.1	Very low	127 Å²	127	138.7 Å²	138.7	68%	0.679	73%	0.734	S	S	*	*			trans	-104.4	154.4	-164.9	-62.7	-92.2	0	0	0	114.8
19	L	36.9	Very low	36.7	Very low	150 Å²	150	141.6 Å²	141.6	79%	0.785	75%	0.75	S	S	*	*			trans	32.5	139.6	146	-58.3	179.8	0	0	0	121.2
20	P	38.3	Very low	36.6	Very low	133 Å²	133	143.2 Å²	143.2	86%	0.864	77%	0.766	S	S	*	*				-139.6	-171.5	84.3	39.8	-25.3	0	0	0	115.7
21	V	33.6	Very low	36	Very low	125 Å²	125	140.1 Å²	140.1	76%	0.758	76%	0.761	S	S	*	*			trans	-119	136.5	-166.8	169.9	0	0	0	0	113.3
22	T	29	Very low	35.3	Very low	136 Å²	136	140.6 Å²	140.6	83%	0.834	76%	0.764	S	S	*	*			trans	-156.6	118	152.3	46.5	0	0	0	0	106.4
23	S	27.4	Very low	34.6	Very low	87 Å²	87	138.1 Å²	138.1	61%	0.608	76%	0.761	S	S	*	*			cis	84.8	115.6	49.7	-143	0	0	0	0	114.1
24	E	32.7	Very low	34	Very low	175 Å²	175	136.7 Å²	136.7	82%	0.818	76%	0.759	S	S	*	*			trans	62.4	160.2	163.7	-64.7	135	143.6	0	0	117.8
25	D	30.5	Very low	33.3	Very low	134 Å²	134	136.8 Å²	136.8	72%	0.717	75%	0.752	S	S	*	*			cis	-145.2	-177.6	8.5	-166.3	19.6	0	0	0	112.7
26	M	32.8	Very low	33	Very low	131 Å²	131	135.5 Å²	135.5	65%	0.645	75%	0.749	S	S	*	*			trans	-4.8	137.1	154.7	-139.5	70.1	51.3	0	0	117.4	R28	M26-R28 HydrophobicContact CG-CG 4.28Å; M26-R28 HydrophobicContact SD-CG 4.37Å
27	G	33.4	Very low	32.7	Very low	64 Å²	64	132.7 Å²	132.7	66%	0.66	75%	0.748	S	S	*	*			cis	110.1	171	13.9	0	0	0	0	0	112.1
28	R	37.1	Very low	32.4	Very low	216 Å²	216	126.5 Å²	126.5	82%	0.815	74%	0.739	S	S	*	*			trans	68.5	153.5	174.3	-62	-166.4	174.6	-159	-0.6	115.7	M26	M26-R28 HydrophobicContact CG-CG 4.28Å; M26-R28 HydrophobicContact SD-CG 4.37Å
29	T	34.9	Very low	32.3	Very low	105 Å²	105	126.1 Å²	126.1	64%	0.644	75%	0.746	S	S	*	*			cis	-161.5	164.4	-9.1	16.9	0	0	0	0	110.9
30	T	32.2	Very low	32	Very low	122 Å²	122	123.7 Å²	123.7	75%	0.748	74%	0.742	S	S	*	*			trans	63.4	149.2	143.4	50.4	0	0	0	0	121
31	S	28.1	Very low	31.7	Very low	87 Å²	87	124.1 Å²	124.1	61%	0.608	74%	0.737	S	S	*	*			cis	-179.4	144.6	-24.7	49.9	0	0	0	0	110.2
32	C	24.6	Very low	31.6	Very low	118 Å²	118	122 Å²	122	80%	0.797	73%	0.733	S	S	*	*			trans	54.3	175	150.5	76	0	0	0	0	117.1
33	S	26.1	Very low	31.8	Very low	111 Å²	111	120.3 Å²	120.3	78%	0.776	73%	0.726	S	S	*	*			cis	-150.5	-170.7	-0.9	-154.4	0	0	0	0	110.6
34	A	31.3	Very low	32.3	Very low	88 Å²	88	123.4 Å²	123.4	73%	0.727	73%	0.731	S	S	*	*			trans	69.1	83.7	160	0	0	0	0	0	117.4
35	N	26.9	Very low	32.1	Very low	132 Å²	132	123.5 Å²	123.5	71%	0.706	72%	0.724	S	S	*	*			trans	-43.4	150	146.4	-39.3	-34.8	0	0	0	111.6
36	H	29.9	Very low	32.3	Very low	172 Å²	172	121 Å²	121	80%	0.796	72%	0.717	S	S	*	*				171.4	134.5	102.8	-92.7	-68.4	0	0	0	112.9
37	T	39	Very low	32.3	Very low	129 Å²	129	124.6 Å²	124.6	79%	0.791	72%	0.724	S	S	*	*			trans	-99.8	135.9	170	-27.6	0	0	0	0	110.2
38	P	41.8	Very low	32	Very low	114 Å²	114	124.8 Å²	124.8	74%	0.74	73%	0.726	S	S	*	*			trans	-86.9	129.5	152.2	32.6	-27.5	0	0	0	109
39	S	31.8	Very low	31.5	Very low	119 Å²	119	121.3 Å²	121.3	83%	0.832	73%	0.728	S	S	*	*			cis	85.7	146.9	31.4	-161.4	0	0	0	0	114.4
40	S	31.2	Very low	31.4	Very low	99 Å²	99	122.5 Å²	122.5	69%	0.692	74%	0.735	S	S	*	*			trans	93.7	123.9	-172.8	-155.6	0	0	0	0	114.5
41	D	30.7	Very low	31.2	Very low	142 Å²	142	123.2 Å²	123.2	76%	0.759	74%	0.739	S	S	*	*			cis	-153	147.9	2.8	-126.9	39.7	0	0	0	115.3
42	A	32.9	Very low	31.3	Very low	82 Å²	82	123.2 Å²	123.2	68%	0.678	74%	0.744	S	S	*	*			trans	49.5	158.7	134.4	0	0	0	0	0	123.1
43	S	33.2	Very low	31.4	Very low	99 Å²	99	121.1 Å²	121.1	69%	0.692	74%	0.743	S	S	*	*			cis	174.6	154.1	-29.6	-99.1	0	0	0	0	107.6
44	E	36.3	Very low	31.5	Very low	152 Å²	152	125.7 Å²	125.7	71%	0.71	75%	0.752	S	S	*	*			cis	-149.8	-122	-10	-133.5	163	104.3	0	0	109.8
45	W	29.9	Very low	31.2	Very low	177 Å²	177	126.6 Å²	126.6	67%	0.67	75%	0.753	S	S	*	*			cis	-159.2	101.2	-1.9	175.9	-112.5	0	0	0	113
46	S	35.1	Very low	31.4	Very low	82 Å²	82	129.8 Å²	129.8	57%	0.573	76%	0.764	S	S	*	*			trans	62	174.8	143.7	-57.2	0	0	0	0	120.3
47	R	32	Very low	31.2	Very low	207 Å²	207	126.7 Å²	126.7	78%	0.781	77%	0.767	S	S	*	*			cis	-152.9	139.3	3.4	-155.3	-164.2	-67.5	-102.5	11.5	114
48	G	27.3	Very low	30.5	Very low	68 Å²	68	123.8 Å²	123.8	70%	0.701	76%	0.763	S	S	*	*			trans	82.5	157.5	151.4	0	0	0	0	0	117.5
49	V	26.7	Very low	29.9	Very low	142 Å²	142	124.5 Å²	124.5	86%	0.861	77%	0.765	S	S	*	*			cis	-142.9	155.3	-1.4	170.8	0	0	0	0	109.1
50	V	32.7	Very low	29.7	Very low	130 Å²	130	130.3 Å²	130.3	79%	0.788	77%	0.769	S	S	*	*			trans	-124.7	137.9	-175.4	176.5	0	0	0	0	112.5
51	V	26.9	Very low	29.7	Very low	137 Å²	137	132.3 Å²	132.3	83%	0.83	78%	0.777	S	S	*	*			trans	-143.8	101.4	157.5	-177.9	0	0	0	0	105.5
52	A	30.3	Very low	29.8	Very low	87 Å²	87	130.6 Å²	130.6	72%	0.719	78%	0.776	S	S	*	*				62.9	116.2	82.8	0	0	0	0	0	113.5
53	G	26.4	Very low	29.9	Very low	75 Å²	75	134.9 Å²	134.9	77%	0.773	79%	0.786	S	S	*	*			trans	-109.2	-175.5	-176.1	0	0	0	0	0	114.4
54	Q	28.6	Very low	29.7	Very low	206 Å²	206	133.7 Å²	133.7	96%	0.963	79%	0.79	S	S	*	*			trans	-159.4	171.4	171.2	-124.4	163.1	88.7	0	0	112
55	S	26.4	Very low	29.4	Very low	107 Å²	107	130.3 Å²	130.3	75%	0.748	80%	0.796	S	S	*	*			trans	-124.7	136.1	-176.4	171.3	0	0	0	0	110.8
56	Q	29.6	Very low	29.8	Very low	200 Å²	200	130.2 Å²	130.2	94%	0.935	81%	0.808	S	S	*	*			trans	-170.7	172.1	135.4	-107.6	-179.2	21.5	0	0	113.9
57	A	25.8	Very low	29.7	Very low	106 Å²	106	129.5 Å²	129.5	88%	0.876	81%	0.814	S	S	*	*			trans	-75.6	163.2	-164.3	0	0	0	0	0	116.5
58	G	25.9	Very low	29.8	Very low	68 Å²	68	124.6 Å²	124.6	70%	0.701	82%	0.818	S	S	*	*			trans	-167.3	26.1	-176.4	0	0	0	0	0	120.9
59	T	28.6	Very low	30.2	Very low	129 Å²	129	130.8 Å²	130.8	79%	0.791	83%	0.829	S	S	*	*			trans	52.6	116.2	161.7	45.4	0	0	0	0	122.9
60	R	28.3	Very low	30.8	Very low	242 Å²	242	128.4 Å²	128.4	91%	0.913	82%	0.824	S	S	*	*			trans	67.4	154.5	149.9	-55.6	-179.6	179.2	-112.1	0.4	116.7
61	V	30.6	Very low	31.3	Very low	141 Å²	141	128.1 Å²	128.1	86%	0.855	82%	0.817	S	S	*	*			cis	-129.6	161.4	9.9	179.7	0	0	0	0	110
62	S	33	Very low	32.1	Very low	105 Å²	105	127.7 Å²	127.7	73%	0.734	81%	0.814	S	S	*	*			trans	-106.7	138.7	179.1	-53.4	0	0	0	0	114.4
63	L	33.4	Very low	33	Very low	172 Å²	172	125.2 Å²	125.2	90%	0.901	80%	0.798	S	S	*	*			trans	176.8	129.8	140.7	-114.3	62.8	0	0	0	105.9
64	G	29.5	Very low	34	Very low	74 Å²	74	125 Å²	125	76%	0.763	78%	0.778	S	S	*	*				67.9	106	77	0	0	0	0	0	110.5
65	G	31.3	Very low	35.4	Very low	81 Å²	81	117.9 Å²	117.9	84%	0.835	75%	0.749	S	S	*	*			cis	92.4	125.6	20.8	0	0	0	0	0	110.2
66	D	36.8	Very low	37	Very low	175 Å²	175	117 Å²	117	94%	0.936	74%	0.739	S	S	*	*			cis	-156.5	166.1	3	-177.5	23.3	0	0	0	109.9
67	G	32.7	Very low	38.8	Very low	68 Å²	68	110.5 Å²	110.5	70%	0.701	71%	0.71	S	S	*	*			trans	121.4	94.6	159.8	0	0	0	0	0	117.9
68	A	34.9	Very low	40	Very low	103 Å²	103	113.7 Å²	113.7	85%	0.851	71%	0.707	S	S	*	*			trans	-174	96.2	145.9	0	0	0	0	0	112
69	E	36	Very low	41.4	Very low	199 Å²	199	119.7 Å²	119.7	93%	0.93	71%	0.71	S	S	*	*			trans	-105.4	133.7	161.2	-73.3	-146.5	110.1	0	0	110.7
70	A	39.1	Very low	43	Very low	91 Å²	91	115.9 Å²	115.9	75%	0.752	70%	0.696	S	S	*	*			trans	-87.3	135.6	-167	0	0	0	0	0	113.3	T72	A70-T72 VanDerWaalsContact C-N 3.35Å; A70-T72 PolarHBondContact O-N 2.7Å
71	I	42.9	Very low	44.3	Very low	125 Å²	125	110.4 Å²	110.4	64%	0.641	68%	0.683	S	S	*	*			trans	-82.3	76.7	-178	-44.8	177.8	0	0	0	111	L74	I71-L74 HydrophobicContact CB-CD1 4.43Å; I71-L74 HydrophobicContact CG2-CD1 3.87Å; I71-L74 HydrophobicContact CG2-CG 3.9Å
72	T	43.7	Very low	46	Very low	127 Å²	127	109 Å²	109	78%	0.779	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	129.7	170.1	-57.3	0	0	0	0	110.5	A70	A70-T72 VanDerWaalsContact C-N 3.35Å; A70-T72 PolarHBondContact O-N 2.7Å
73	G	49.1	Very low	47.1	Very low	36 Å²	36	109.6 Å²	109.6	37%	0.371	66%	0.657	S	S	.	*	T	Hydrogen-bonded Turn	trans	108.3	16.9	171.1	0	0	0	0	0	117.1	K84 V85	G73-K84 WeakPolarHBondContact O-CA 3.37Å; G73-V85 PolarHBondContact O-N 3.29Å; G73-V85 VanDerWaalsContact O-N 3.09Å
74	L	48.1	Very low	48	Very low	69 Å²	69	109 Å²	109	36%	0.361	65%	0.647	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.4	132.1	166.5	-63.9	177.9	0	0	0	111.2	I71 L82 Y83 K84	I71-L74 HydrophobicContact CB-CD1 4.43Å; I71-L74 HydrophobicContact CG2-CD1 3.87Å; I71-L74 HydrophobicContact CG2-CG 3.9Å; L74-L82 HydrophobicContact CB-CD2 3.9Å; L74-L82 HydrophobicContact CD1-CB 4.48Å; L74-L82 HydrophobicContact CD1-CD2 4.19Å; L74-Y83 WeakPolarHBondContact CA-O 3.37Å; L74-K84 HydrophobicContact CD2-CB 3.86Å; L74-K84 HydrophobicContact CD2-CG 4.42Å
75	T	57	Low	49	Very low	58 Å²	58	109.1 Å²	109.1	36%	0.356	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117	155	168.3	44.9	0	0	0	0	110.4	L82 Y83 V85	T75-L82 WeakPolarHBondContact O-CA 3.44Å; T75-Y83 PolarHBondContact N-O 3.19Å; T75-Y83 VanDerWaalsContact O-CD1 3.26Å; T75-Y83 WeakPolarHBondContact O-CD1 3.23Å; T75-Y83 PolarHBondContact O-N 3.06Å; T75-Y83 WeakPolarHBondContact OG1-CE2 3.35Å; T75-Y83 PolarHBondContact OG1-OH 2.74Å; T75-V85 HydrophobicContact CG2-CG2 4.4Å; T75-V85 WeakPolarHBondContact OG1-CG2 3.31Å
76	V	59.8	Low	49.6	Very low	89 Å²	89	109.9 Å²	109.9	54%	0.539	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.9	130.9	-177.3	173.2	0	0	0	0	109.8	M81 L82	V76-M81 WeakPolarHBondContact CA-O 3.32Å; V76-L82 HydrophobicContact CG2-CD2 3.36Å; V76-L82 HydrophobicContact CG2-CG 3.97Å
77	D	67.6	Low	50.2	Low	62 Å²	62	107.6 Å²	107.6	33%	0.332	62%	0.623	S	S	.	*			trans	-87.6	176	170.4	75.5	56.4	0	0	0	113.1	Y79 G80 M81 Y83	D77-Y79 PolarHBondContact O-N 3.14Å; D77-Y79 WeakPolarHBondContact OD1-CA 3.33Å; D77-Y79 WeakPolarHBondContact OD1-CB 3.28Å; D77-Y79 PolarHBondContact OD1-N 2.72Å; D77-G80 PolarHBondContact O-N 3.44Å; D77-M81 PolarHBondContact N-O 3.34Å; D77-Y83 HydrophobicContact CB-CE1 4.07Å
78	Q	52	Low	50.6	Low	174 Å²	174	109.4 Å²	109.4	81%	0.813	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	-21.1	-176	-174.3	171.4	95	0	0	114.6
79	Y	55.4	Low	50.6	Low	193 Å²	193	110.7 Å²	110.7	76%	0.757	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	8	178.5	-54.8	-80.2	0	0	0	113.1	D77	D77-Y79 PolarHBondContact O-N 3.14Å; D77-Y79 WeakPolarHBondContact OD1-CA 3.33Å; D77-Y79 WeakPolarHBondContact OD1-CB 3.28Å; D77-Y79 PolarHBondContact OD1-N 2.72Å
80	G	61.5	Low	50.7	Low	49 Å²	49	105.9 Å²	105.9	51%	0.505	62%	0.617	S	S	.	*			trans	86.4	5.5	173.2	0	0	0	0	0	115.3	D77	D77-G80 PolarHBondContact O-N 3.44Å
81	M	55.3	Low	50.6	Low	127 Å²	127	107 Å²	107	63%	0.626	61%	0.614	S	S	*	*			trans	-79.7	129.1	-177.8	-62.9	-62.1	-64.2	0	0	111.7	V76 D77	V76-M81 WeakPolarHBondContact CA-O 3.32Å; D77-M81 PolarHBondContact N-O 3.34Å
82	L	66.9	Low	50.2	Low	113 Å²	113	110.2 Å²	110.2	59%	0.592	62%	0.624	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.3	120.4	175.5	-74.6	158.5	0	0	0	110.5	L74 T75 V76	L74-L82 HydrophobicContact CB-CD2 3.9Å; L74-L82 HydrophobicContact CD1-CB 4.48Å; L74-L82 HydrophobicContact CD1-CD2 4.19Å; T75-L82 WeakPolarHBondContact O-CA 3.44Å; V76-L82 HydrophobicContact CG2-CD2 3.36Å; V76-L82 HydrophobicContact CG2-CG 3.97Å
83	Y	56.9	Low	49.8	Very low	116 Å²	116	109 Å²	109	46%	0.455	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.6	143.1	175.1	63	-83.2	0	0	0	111.9	L74 T75 D77 V85	L74-Y83 WeakPolarHBondContact CA-O 3.37Å; T75-Y83 PolarHBondContact N-O 3.19Å; T75-Y83 VanDerWaalsContact O-CD1 3.26Å; T75-Y83 WeakPolarHBondContact O-CD1 3.23Å; T75-Y83 PolarHBondContact O-N 3.06Å; T75-Y83 WeakPolarHBondContact OG1-CE2 3.35Å; T75-Y83 PolarHBondContact OG1-OH 2.74Å; D77-Y83 HydrophobicContact CB-CE1 4.07Å; Y83-V85 HydrophobicContact CD2-CG2 3.98Å; Y83-V85 HydrophobicContact CE2-CG2 3.73Å
84	K	51.4	Low	49.4	Very low	160 Å²	160	112.8 Å²	112.8	70%	0.696	64%	0.639	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.2	112.5	-177.1	-168.9	177	-177.8	178.7	0	110.4	G73 L74 A86	G73-K84 WeakPolarHBondContact O-CA 3.37Å; L74-K84 HydrophobicContact CD2-CB 3.86Å; L74-K84 HydrophobicContact CD2-CG 4.42Å; K84-A86 PolarHBondContact O-N 2.87Å
85	V	51.7	Low	48.8	Very low	77 Å²	77	116 Å²	116	47%	0.467	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-79.9	120.4	-180	178	0	0	0	0	109.9	G73 T75 Y83	G73-V85 PolarHBondContact O-N 3.29Å; G73-V85 VanDerWaalsContact O-N 3.09Å; T75-V85 HydrophobicContact CG2-CG2 4.4Å; T75-V85 WeakPolarHBondContact OG1-CG2 3.31Å; Y83-V85 HydrophobicContact CD2-CG2 3.98Å; Y83-V85 HydrophobicContact CE2-CG2 3.73Å
86	A	42.3	Very low	48	Very low	96 Å²	96	116.3 Å²	116.3	79%	0.793	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-85.5	116.5	173.3	0	0	0	0	0	110.4	K84	K84-A86 PolarHBondContact O-N 2.87Å
87	V	49.4	Very low	46.9	Very low	128 Å²	128	120.4 Å²	120.4	78%	0.776	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-81.2	130.9	169.5	-179.6	0	0	0	0	108.6
88	P	41.1	Very low	45.6	Very low	106 Å²	106	123.7 Å²	123.7	69%	0.688	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-68.4	140.4	178.7	27.9	-34.6	0	0	0	111.4	A90	P88-A90 PolarHBondContact O-N 2.75Å
89	P	36.5	Very low	44.6	Very low	130 Å²	130	120.5 Å²	120.5	84%	0.844	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-72.3	126.9	178.8	29.2	-33.8	0	0	0	111.1
90	A	37.8	Very low	43.8	Very low	98 Å²	98	117.8 Å²	117.8	81%	0.81	72%	0.719	S	S	*	*			trans	-118.9	119.6	175.4	0	0	0	0	0	110.7	P88	P88-A90 PolarHBondContact O-N 2.75Å
91	T	36.3	Very low	42.6	Very low	114 Å²	114	120.8 Å²	120.8	70%	0.699	73%	0.727	S	S	*	*			trans	-149.3	138.2	172.8	23.1	0	0	0	0	107
92	F	33.6	Very low	41.4	Very low	193 Å²	193	121.1 Å²	121.1	85%	0.846	73%	0.732	S	S	*	*			cis	-124.9	161.4	20.9	-94.5	-97.7	0	0	0	115.8
93	S	35.4	Very low	39.8	Very low	102 Å²	102	123.4 Å²	123.4	71%	0.713	74%	0.741	S	S	*	*			trans	-53.8	169	168.2	-51.6	0	0	0	0	114.1
94	P	41.6	Very low	38.6	Very low	114 Å²	114	122.2 Å²	122.2	74%	0.74	75%	0.75	S	S	*	*			cis	-152.2	172.9	45	43.1	-21.1	0	0	0	121.7
95	T	35.8	Very low	37.9	Very low	136 Å²	136	120.6 Å²	120.6	83%	0.834	76%	0.756	S	S	*	*			trans	94.3	103.3	154	-34.7	0	0	0	0	118.9
96	G	39.5	Very low	37.2	Very low	66 Å²	66	124.8 Å²	124.8	68%	0.68	78%	0.775	S	S	*	*			trans	85.4	125	131.5	0	0	0	0	0	119.7
97	L	38	Very low	36.8	Very low	174 Å²	174	125.1 Å²	125.1	91%	0.911	77%	0.769	S	S	*	*			trans	75.4	145.4	166.8	-53.2	178	0	0	0	117.1
98	P	38.4	Very low	36.2	Very low	131 Å²	131	125.2 Å²	125.2	85%	0.851	77%	0.772	S	S	*	*			trans	-83	139.1	-177.2	33.3	-34.4	0	0	0	112.1
99	S	32.2	Very low	36	Very low	107 Å²	107	125.9 Å²	125.9	75%	0.748	77%	0.774	S	S	*	*			trans	-120.1	132.7	174	-169.9	0	0	0	0	111.3
100	V	38.5	Very low	36	Very low	137 Å²	137	128.9 Å²	128.9	83%	0.83	77%	0.774	S	S	*	*			trans	-83.8	113.3	177.9	176.4	0	0	0	0	108.9	N102	V100-N102 PolarHBondContact O-N 3.49Å
101	V	35.4	Very low	35.8	Very low	111 Å²	111	131.7 Å²	131.7	67%	0.673	78%	0.776	S	S	*	*			trans	-80	92.2	-179.6	-174.9	0	0	0	0	110.4	M103	V101-M103 HydrophobicContact CG1-CE 3.71Å; V101-M103 HydrophobicContact CG1-CG 4.42Å; V101-M103 HydrophobicContact CG1-SD 3.95Å
102	N	30.6	Very low	35.7	Very low	134 Å²	134	131.5 Å²	131.5	72%	0.717	77%	0.774	S	S	*	*			trans	-77	116.6	167.4	-175.9	17.7	0	0	0	110	V100 S104	V100-N102 PolarHBondContact O-N 3.49Å; N102-S104 PolarHBondContact O-N 2.89Å; N102-S104 VanDerWaalsContact O-N 3.17Å
103	M	33.4	Very low	35.7	Very low	161 Å²	161	126.1 Å²	126.1	79%	0.793	77%	0.766	S	S	*	*			trans	-86.5	81.6	-175.4	-71	-67.3	-169.8	0	0	112.2	V101	V101-M103 HydrophobicContact CG1-CE 3.71Å; V101-M103 HydrophobicContact CG1-CG 4.42Å; V101-M103 HydrophobicContact CG1-SD 3.95Å
104	S	32.3	Very low	35.5	Very low	92 Å²	92	126.5 Å²	126.5	64%	0.643	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-84.7	132.4	168.3	-68.9	0	0	0	0	111.5	N102	N102-S104 PolarHBondContact O-N 2.89Å; N102-S104 VanDerWaalsContact O-N 3.17Å
105	P	36.9	Very low	35.5	Very low	125 Å²	125	126.5 Å²	126.5	81%	0.812	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-73.6	145.4	176.5	30.4	-34.6	0	0	0	112.4
106	L	35.5	Very low	35.9	Very low	165 Å²	165	127.3 Å²	127.3	86%	0.864	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-82.5	149.4	177.1	-68.5	171.3	0	0	0	112.1
107	P	34.1	Very low	36.2	Very low	103 Å²	103	130.6 Å²	130.6	67%	0.669	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-80.7	149.1	-175.1	32.2	-36	0	0	0	113.8	T109	P107-T109 PolarHBondContact O-N 3.08Å
108	P	38	Very low	36.4	Very low	131 Å²	131	131.5 Å²	131.5	85%	0.851	77%	0.769	S	S	*	*			trans	-91.4	88.1	-176.2	35.3	-34.5	0	0	0	113
109	T	35.8	Very low	36.5	Very low	119 Å²	119	132.2 Å²	132.2	73%	0.73	76%	0.761	S	S	*	*			trans	-139.4	77.6	175	56.7	0	0	0	0	114.4	P107	P107-T109 PolarHBondContact O-N 3.08Å
110	F	35.9	Very low	36.9	Very low	193 Å²	193	133.5 Å²	133.5	85%	0.846	77%	0.767	S	S	*	*			trans	-155.6	117.4	140.5	-138.8	-95.8	0	0	0	110.9	V112	F110-V112 HydrophobicContact CD1-CG2 3.72Å; F110-V112 HydrophobicContact CE1-CG2 4.09Å
111	N	34.3	Very low	37.6	Very low	158 Å²	158	130.6 Å²	130.6	85%	0.845	77%	0.765	S	S	*	*			trans	-111.4	100	179.1	-172.4	6.2	0	0	0	108.8	A113	N111-A113 PolarHBondContact O-N 3Å
112	V	34.9	Very low	38.3	Very low	110 Å²	110	130.6 Å²	130.6	67%	0.667	76%	0.76	S	S	*	*			trans	-84.3	102.7	178.8	-175.2	0	0	0	0	109.1	F110 S114	F110-V112 HydrophobicContact CD1-CG2 3.72Å; F110-V112 HydrophobicContact CE1-CG2 4.09Å; V112-S114 PolarHBondContact O-N 3.14Å
113	A	34.1	Very low	38.7	Very low	80 Å²	80	133.3 Å²	133.3	66%	0.661	77%	0.768	S	S	*	*			trans	-65.1	115.3	174.1	0	0	0	0	0	110.6	N111 S115	N111-A113 PolarHBondContact O-N 3Å; A113-S115 PolarHBondContact O-N 3.23Å
114	S	30	Very low	39.2	Very low	109 Å²	109	134.9 Å²	134.9	76%	0.762	77%	0.766	S	S	*	*			trans	-75.9	101.1	168.6	-71.2	0	0	0	0	109.6	V112 L116	V112-S114 PolarHBondContact O-N 3.14Å; S114-L116 VanDerWaalsContact C-N 3.29Å; S114-L116 PolarHBondContact O-N 2.96Å
115	S	41.3	Very low	40.3	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	77%	0.768	S	S	*	*			trans	-74.6	74.1	-179	-61.1	0	0	0	0	112.6	A113	A113-S115 PolarHBondContact O-N 3.23Å
116	L	43.8	Very low	40.8	Very low	153 Å²	153	134.5 Å²	134.5	80%	0.801	76%	0.761	S	S	*	*			trans	-126.2	133.6	169.5	-81.6	168	0	0	0	110.4	S114	S114-L116 VanDerWaalsContact C-N 3.29Å; S114-L116 PolarHBondContact O-N 2.96Å
117	I	46.6	Very low	41.4	Very low	136 Å²	136	133 Å²	133	70%	0.697	75%	0.753	S	S	*	*			trans	66.2	75	179.6	-43.9	177.5	0	0	0	113.8	H119	I117-H119 VanDerWaalsContact CG2-CD2 3.44Å; I117-H119 WeakPolarHBondContact CG2-CD2 3.36Å; I117-H119 VanDerWaalsContact CG2-NE2 3.32Å; I117-H119 WeakPolarHBondContact CG2-NE2 3.13Å
118	Q	42	Very low	41.6	Very low	192 Å²	192	136 Å²	136	90%	0.897	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-86.8	116.8	152.6	-74.7	-177.3	-19.3	0	0	109.1
119	H	39.9	Very low	41.8	Very low	147 Å²	147	139.6 Å²	139.6	68%	0.681	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-100.5	131.2	164.7	-73.5	-59.4	0	0	0	109.7	I117 G121	I117-H119 VanDerWaalsContact CG2-CD2 3.44Å; I117-H119 WeakPolarHBondContact CG2-CD2 3.36Å; I117-H119 VanDerWaalsContact CG2-NE2 3.32Å; I117-H119 WeakPolarHBondContact CG2-NE2 3.13Å; H119-G121 PolarHBondContact O-N 2.76Å
120	P	42.5	Very low	42	Very low	134 Å²	134	138.3 Å²	138.3	87%	0.87	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	126.5	172.9	-19.3	32	0	0	0	111
121	G	53.3	Low	42	Very low	76 Å²	76	138.2 Å²	138.2	78%	0.784	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	110.3	2	163	0	0	0	0	0	118.5	H119	H119-G121 PolarHBondContact O-N 2.76Å
122	I	49.5	Very low	42.3	Very low	111 Å²	111	137.9 Å²	137.9	57%	0.569	76%	0.757	S	S	*	*			trans	-119.1	112	174.2	-54.5	-178.7	0	0	0	110.9	Y124	I122-Y124 HydrophobicContact CB-CE2 4.16Å; I122-Y124 HydrophobicContact CG2-CD2 3.96Å; I122-Y124 HydrophobicContact CG2-CE1 4.4Å; I122-Y124 HydrophobicContact CG2-CE2 3.5Å
123	H	39.2	Very low	42.5	Very low	191 Å²	191	138 Å²	138	88%	0.884	76%	0.759	S	S	*	*			trans	-85.1	115.1	168.8	-76.3	-98.1	0	0	0	110
124	Y	43.6	Very low	42.8	Very low	193 Å²	193	139.8 Å²	139.8	76%	0.757	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-91.6	129.4	166.6	-69.3	-86.4	0	0	0	109.9	I122	I122-Y124 HydrophobicContact CB-CE2 4.16Å; I122-Y124 HydrophobicContact CG2-CD2 3.96Å; I122-Y124 HydrophobicContact CG2-CE1 4.4Å; I122-Y124 HydrophobicContact CG2-CE2 3.5Å
125	P	54.9	Low	43	Very low	106 Å²	106	140.4 Å²	140.4	69%	0.688	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-70.1	146.7	171	30	-33.8	0	0	0	110.4	I127	P125-I127 PolarHBondContact O-N 3.42Å
126	P	47.8	Very low	42.9	Very low	103 Å²	103	139.7 Å²	139.7	67%	0.669	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-61.7	124.7	174	-21.1	32.9	0	0	0	111.1	H128	P126-H128 PolarHBondContact O-CD2 3.14Å; P126-H128 PolarHBondContact O-N 3.21Å
127	I	47.7	Very low	42.8	Very low	133 Å²	133	140.1 Å²	140.1	68%	0.682	76%	0.764	S	S	*	*			trans	-76.6	93.2	173.5	-59.5	-178.3	0	0	0	108.5	P125 Y129	P125-I127 PolarHBondContact O-N 3.42Å; I127-Y129 HydrophobicContact CB-CE2 4.43Å; I127-Y129 HydrophobicContact CG2-CD2 4.01Å; I127-Y129 HydrophobicContact CG2-CE2 3.66Å; I127-Y129 PolarHBondContact O-N 3.38Å; I127-Y129 VanDerWaalsContact O-N 3.16Å
128	H	38.3	Very low	42.5	Very low	168 Å²	168	141.4 Å²	141.4	78%	0.778	77%	0.767	S	S	*	*			trans	-71.9	99.9	169.5	-71.4	-91.6	0	0	0	109.7	P126 A130	P126-H128 PolarHBondContact O-CD2 3.14Å; P126-H128 PolarHBondContact O-N 3.21Å; H128-A130 PolarHBondContact O-N 2.86Å
129	Y	42	Very low	42.2	Very low	206 Å²	206	141.9 Å²	141.9	81%	0.808	77%	0.767	S	S	*	*			trans	-67.7	122.9	166.5	-75.6	-87.3	0	0	0	109.8	I127 Q131	I127-Y129 HydrophobicContact CB-CE2 4.43Å; I127-Y129 HydrophobicContact CG2-CD2 4.01Å; I127-Y129 HydrophobicContact CG2-CE2 3.66Å; I127-Y129 PolarHBondContact O-N 3.38Å; I127-Y129 VanDerWaalsContact O-N 3.16Å; Y129-Q131 PolarHBondContact O-N 3.17Å; Y129-Q131 VanDerWaalsContact O-N 3.16Å
130	A	39.5	Very low	42.1	Very low	91 Å²	91	142.5 Å²	142.5	75%	0.752	77%	0.773	S	S	*	*			trans	-68.2	111.5	175.3	0	0	0	0	0	109.8	H128 L132	H128-A130 PolarHBondContact O-N 2.86Å; A130-L132 PolarHBondContact O-N 2.76Å
131	Q	36.3	Very low	41.8	Very low	191 Å²	191	139.1 Å²	139.1	89%	0.893	76%	0.763	S	S	*	*			trans	-70.7	100.3	178.4	-176.5	173.1	-25.1	0	0	109.9	Y129	Y129-Q131 PolarHBondContact O-N 3.17Å; Y129-Q131 VanDerWaalsContact O-N 3.16Å
132	L	40.2	Very low	40.8	Very low	151 Å²	151	140.5 Å²	140.5	79%	0.791	76%	0.76	S	S	*	*			trans	-60.2	136	174.7	-67.7	171.7	0	0	0	110.2	A130 S134	A130-L132 PolarHBondContact O-N 2.76Å; L132-S134 PolarHBondContact O-N 2.66Å
133	P	40	Very low	40.2	Very low	112 Å²	112	140.6 Å²	140.6	73%	0.727	77%	0.768	S	S	*	*			trans	-66.8	133.2	177.6	27.8	-33.9	0	0	0	110.2	T135	P133-T135 PolarHBondContact O-N 2.86Å
134	S	39.8	Very low	40	Very low	118 Å²	118	142.6 Å²	142.6	83%	0.825	77%	0.77	S	S	*	*			trans	-65.7	102.7	178.6	53.6	0	0	0	0	110.9	L132 S136	L132-S134 PolarHBondContact O-N 2.66Å; S134-S136 PolarHBondContact O-N 2.89Å
135	T	35.4	Very low	39.7	Very low	122 Å²	122	138.7 Å²	138.7	75%	0.748	77%	0.77	S	S	*	*			trans	-67.5	111.3	178	51.1	0	0	0	0	110.7	P133 L137	P133-T135 PolarHBondContact O-N 2.86Å; T135-L137 PolarHBondContact O-N 3.3Å
136	S	39	Very low	38.7	Very low	100 Å²	100	141.8 Å²	141.8	70%	0.699	78%	0.78	S	S	*	*			trans	-71.1	96.6	174	39.6	0	0	0	0	110.7	S134 Q138	S134-S136 PolarHBondContact O-N 2.89Å; S136-Q138 PolarHBondContact O-N 2.85Å
137	L	41.4	Very low	38.4	Very low	161 Å²	161	142 Å²	142	84%	0.843	78%	0.782	S	S	*	*			trans	-67	92.4	171.2	-78	172.5	0	0	0	110.3	T135 F139	T135-L137 PolarHBondContact O-N 3.3Å; L137-F139 PolarHBondContact O-N 3Å
138	Q	39.7	Very low	37.7	Very low	163 Å²	163	146.5 Å²	146.5	76%	0.762	79%	0.792	S	S	*	*			trans	-71.7	113.8	168.9	-64.3	-178.2	0.6	0	0	108.9	S136 I140	S136-Q138 PolarHBondContact O-N 2.85Å; Q138-I140 PolarHBondContact O-N 3.31Å
139	F	36.3	Very low	37.6	Very low	203 Å²	203	142.8 Å²	142.8	89%	0.89	79%	0.79	S	S	*	*			trans	-78	104.3	179.2	-135.7	-87.3	0	0	0	110	L137 G141	L137-F139 PolarHBondContact O-N 3Å; F139-G141 PolarHBondContact O-N 3.28Å; F139-G141 VanDerWaalsContact O-N 3.13Å
140	I	37.4	Very low	37.2	Very low	160 Å²	160	139.3 Å²	139.3	82%	0.821	79%	0.79	S	S	*	*			trans	-78.9	96.2	176.8	-64.4	174.4	0	0	0	108.6	Q138	Q138-I140 PolarHBondContact O-N 3.31Å
141	G	36.3	Very low	37.4	Very low	63 Å²	63	140.4 Å²	140.4	65%	0.649	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-77.8	127.4	168.7	0	0	0	0	0	111.3	F139	F139-G141 PolarHBondContact O-N 3.28Å; F139-G141 VanDerWaalsContact O-N 3.13Å
142	S	31.4	Very low	38.1	Very low	104 Å²	104	135.9 Å²	135.9	73%	0.727	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-71	132.5	173.2	53.9	0	0	0	0	111.2
143	P	38.8	Very low	37.7	Very low	114 Å²	114	135.1 Å²	135.1	74%	0.74	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-80	135.7	-176.8	31.7	-34.5	0	0	0	112.5
144	Y	34.1	Very low	37.4	Very low	233 Å²	233	139 Å²	139	91%	0.914	78%	0.779	S	S	*	*			trans	-132.8	139.3	155.9	-97.9	-83.5	0	0	0	109.7
145	S	37.6	Very low	37.2	Very low	110 Å²	110	140.9 Å²	140.9	77%	0.769	78%	0.779	S	S	*	*			trans	-105.4	135.4	-155.6	-48.2	0	0	0	0	113.6
146	L	33.5	Very low	37.6	Very low	172 Å²	172	140.4 Å²	140.4	90%	0.901	78%	0.778	S	S	*	*			trans	-132.5	151	149.3	-77.9	179.3	0	0	0	109.7
147	P	41.7	Very low	37.1	Very low	108 Å²	108	141 Å²	141	70%	0.701	78%	0.782	S	S	*	*			trans	-102.2	140.7	-155.3	36.2	-32.9	0	0	0	114.7
148	Y	33.2	Very low	37.8	Very low	227 Å²	227	138.8 Å²	138.8	89%	0.89	78%	0.778	S	S	*	*				-162.1	172.6	124.1	-128.2	-102.5	0	0	0	112.4
149	A	36.2	Very low	37.5	Very low	90 Å²	90	138.4 Å²	138.4	74%	0.744	78%	0.78	S	S	*	*			trans	-37.2	157.7	-166.5	0	0	0	0	0	122
150	V	32.9	Very low	37.2	Very low	132 Å²	132	136.3 Å²	136.3	80%	0.8	78%	0.777	S	S	*	*			trans	-150.2	157.5	-174.2	154.8	0	0	0	0	105.5
151	P	45	Very low	37	Very low	115 Å²	115	134 Å²	134	75%	0.747	78%	0.775	S	S	*	*			cis	-133.2	-131.4	19.8	27.8	1	0	0	0	114.1
152	P	51	Low	37.3	Very low	96 Å²	96	136.8 Å²	136.8	62%	0.623	78%	0.782	S	S	*	*				-127.3	175.9	-87.5	36.8	-19.9	0	0	0	115.9
153	N	30.1	Very low	37.3	Very low	134 Å²	134	137.3 Å²	137.3	72%	0.717	79%	0.785	S	S	*	*				174.7	132.9	115.9	-90.8	-25.8	0	0	0	117.5
154	F	34.5	Very low	37	Very low	193 Å²	193	136 Å²	136	85%	0.846	78%	0.784	S	S	*	*			trans	49.1	115.7	148.3	-72.1	-91.6	0	0	0	124.4
155	L	35.1	Very low	36.9	Very low	159 Å²	159	131.9 Å²	131.9	83%	0.832	78%	0.778	S	S	*	*			trans	-84.6	-174	141.7	-60	172.4	0	0	0	108.9
156	P	44.9	Very low	36.6	Very low	111 Å²	111	134.8 Å²	134.8	72%	0.721	78%	0.784	S	S	*	*			cis	-144.3	-173.1	6.8	42.2	-21.1	0	0	0	118
157	S	28.4	Very low	36.3	Very low	112 Å²	112	130 Å²	130	78%	0.783	77%	0.769	S	S	*	*			trans	98.4	145.1	148	-60.9	0	0	0	0	120.9
158	P	56.8	Low	35.9	Very low	116 Å²	116	131.3 Å²	131.3	75%	0.753	78%	0.776	S	S	*	*			trans	-116.5	179.7	-172.9	44.2	-34.8	0	0	0	114.8
159	L	31.6	Very low	35.7	Very low	154 Å²	154	125.5 Å²	125.5	81%	0.806	77%	0.768	S	S	*	*				174.8	152.9	129.6	-97	171.1	0	0	0	115.3
160	L	31.7	Very low	35.5	Very low	160 Å²	160	129.7 Å²	129.7	84%	0.838	77%	0.772	S	S	*	*			trans	75.3	153.8	154.7	-67.6	159.8	0	0	0	122.3
161	S	31.3	Very low	35.6	Very low	111 Å²	111	130.2 Å²	130.2	78%	0.776	77%	0.769	S	S	*	*			trans	-125.1	168.8	179.9	-41.3	0	0	0	0	110.2
162	P	43.9	Very low	35.9	Very low	121 Å²	121	130.2 Å²	130.2	79%	0.786	77%	0.769	S	S	*	*				-163.3	168.6	89	42.6	-21.3	0	0	0	120.3
163	S	30.3	Very low	35.1	Very low	115 Å²	115	133.4 Å²	133.4	80%	0.804	78%	0.776	S	S	*	*			trans	45.7	115.5	139	-58.3	0	0	0	0	127.5
164	A	34.3	Very low	35.1	Very low	86 Å²	86	136.6 Å²	136.6	71%	0.711	78%	0.784	S	S	*	*				85.4	146.7	112.1	0	0	0	0	0	126.3
165	N	30.4	Very low	35	Very low	148 Å²	148	133.5 Å²	133.5	79%	0.791	78%	0.78	S	S	*	*			trans	101.7	131.6	141.7	-75.6	-26.1	0	0	0	124.9
166	L	31.7	Very low	35.6	Very low	170 Å²	170	131.1 Å²	131.1	89%	0.89	77%	0.774	S	S	*	*			trans	68.4	157.2	153.7	-59.7	163.6	0	0	0	120
167	A	28.5	Very low	35	Very low	72 Å²	72	136.3 Å²	136.3	60%	0.595	78%	0.781	S	S	*	*			cis	-171.1	157.8	-29.1	0	0	0	0	0	114.2
168	T	31.9	Very low	35.1	Very low	136 Å²	136	135 Å²	135	83%	0.834	78%	0.776	S	S	*	*			trans	61.8	115.4	145.7	45.4	0	0	0	0	126.2
169	S	30	Very low	33.8	Very low	104 Å²	104	134.4 Å²	134.4	73%	0.727	78%	0.775	S	S	*	*				97.3	155.3	115	-148.6	0	0	0	0	125.4
170	H	32.3	Very low	34	Very low	179 Å²	179	134 Å²	134	83%	0.829	77%	0.773	S	S	*	*			trans	87.3	148.2	160.3	-88.9	-74.6	0	0	0	125
171	L	34.7	Very low	34.4	Very low	143 Å²	143	134.1 Å²	134.1	75%	0.749	77%	0.774	S	S	*	*			trans	-156.9	143.3	-173.6	-153.5	177	0	0	0	107.7
172	P	49.7	Very low	34.5	Very low	115 Å²	115	132.7 Å²	132.7	75%	0.747	77%	0.769	S	S	*	*			trans	-152.7	157	132.8	35.9	-16.9	0	0	0	119
173	H	34.8	Very low	34	Very low	163 Å²	163	136.3 Å²	136.3	76%	0.755	78%	0.775	S	S	*	*			trans	-20.4	159.2	163.8	-49.2	-85.1	0	0	0	124
174	F	30.5	Very low	33.9	Very low	201 Å²	201	134.3 Å²	134.3	88%	0.882	77%	0.773	S	S	*	*				-171	153.8	108.6	-110.3	-78.9	0	0	0	114.5
175	V	32.5	Very low	33.9	Very low	128 Å²	128	134.5 Å²	134.5	78%	0.776	77%	0.774	S	S	*	*			trans	-158	139.4	-172.7	175.9	0	0	0	0	108
176	P	47.9	Very low	34	Very low	108 Å²	108	133.9 Å²	133.9	70%	0.701	78%	0.776	S	S	*	*				-148.2	-147.2	67.4	35.7	-8.2	0	0	0	113.7
177	Y	31.6	Very low	34.8	Very low	221 Å²	221	131.5 Å²	131.5	87%	0.867	77%	0.771	S	S	*	*			cis	-168.8	164.9	7.6	-139.6	-9	0	0	0	113.4
178	A	31.2	Very low	35.9	Very low	83 Å²	83	133.6 Å²	133.6	69%	0.686	78%	0.778	S	S	*	*			trans	61.5	157	155.5	0	0	0	0	0	120.1
179	S	29.5	Very low	36.5	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	78%	0.776	S	S	*	*			cis	177.5	165.8	-15.8	-88.2	0	0	0	0	108.2
180	L	36	Very low	36.6	Very low	146 Å²	146	137 Å²	137	76%	0.764	78%	0.784	S	S	*	*			cis	-172.8	163.4	-15.2	-106.7	171.9	0	0	0	110.1
181	L	40.6	Very low	36.8	Very low	161 Å²	161	133.1 Å²	133.1	84%	0.843	78%	0.783	S	S	*	*			trans	66.5	164.1	163	-64.5	171.5	0	0	0	118
182	A	32.6	Very low	37.2	Very low	82 Å²	82	132.5 Å²	132.5	68%	0.678	79%	0.787	S	S	*	*			cis	-178.2	175.6	-20.2	0	0	0	0	0	108.8
183	E	32.3	Very low	36.3	Very low	196 Å²	196	132.1 Å²	132.1	92%	0.916	79%	0.788	S	S	*	*			cis	-174.5	155.2	-37.2	-173.6	168.6	110.6	0	0	109.5
184	G	29.4	Very low	37.1	Very low	74 Å²	74	129.9 Å²	129.9	76%	0.763	79%	0.787	S	S	*	*			trans	158.2	155.5	172.9	0	0	0	0	0	116.9
185	A	33.3	Very low	37.2	Very low	89 Å²	89	124.1 Å²	124.1	74%	0.736	78%	0.777	S	S	*	*			trans	-159.4	167.3	-169.1	0	0	0	0	0	118.4
186	T	32.8	Very low	37.3	Very low	135 Å²	135	126.9 Å²	126.9	83%	0.828	78%	0.781	S	S	*	*			trans	80.1	169.6	161.1	71.7	0	0	0	0	119.2
187	P	48.3	Very low	36.5	Very low	121 Å²	121	126 Å²	126	79%	0.786	78%	0.777	S	S	*	*				-129.8	-132.9	-77.6	44.2	-24.4	0	0	0	116.3
188	P	51.4	Low	36.6	Very low	115 Å²	115	124.6 Å²	124.6	75%	0.747	78%	0.776	S	S	*	*			trans	-115.7	177.5	-138.3	44.1	-27.4	0	0	0	118
189	P	44.7	Very low	36.7	Very low	122 Å²	122	126.7 Å²	126.7	79%	0.792	78%	0.776	S	S	*	*				-155.2	150.8	124.8	37.8	-19.1	0	0	0	120.4
190	Q	32.6	Very low	36.8	Very low	190 Å²	190	131.2 Å²	131.2	89%	0.888	78%	0.782	S	S	*	*			trans	33.7	129.4	143.2	-62.6	-174	-26.6	0	0	126.9
191	A	35.8	Very low	36.8	Very low	97 Å²	97	128.3 Å²	128.3	80%	0.802	78%	0.779	S	S	*	*				37	155.5	123.8	0	0	0	0	0	123.1
192	P	43.4	Very low	37	Very low	130 Å²	130	126.5 Å²	126.5	84%	0.844	78%	0.777	S	S	*	*			cis	-143.8	-165	28.8	43.8	-22.5	0	0	0	117.9
193	S	30.6	Very low	37.1	Very low	108 Å²	108	128.5 Å²	128.5	76%	0.755	79%	0.786	S	S	*	*			trans	-115.4	178.2	175.3	63.5	0	0	0	0	112.3
194	P	52.8	Low	37.2	Very low	115 Å²	115	123.3 Å²	123.3	75%	0.747	78%	0.777	S	S	*	*				-162.4	163.2	86.6	42.2	-21.3	0	0	0	120.7
195	A	31.2	Very low	37.3	Very low	81 Å²	81	123.6 Å²	123.6	67%	0.669	76%	0.764	S	S	*	*			trans	57.8	168.3	147.1	0	0	0	0	0	120.8
196	H	36.5	Very low	37.2	Very low	185 Å²	185	122.9 Å²	122.9	86%	0.856	75%	0.753	S	S	*	*			cis	-148.3	-175.4	11.5	-77.7	-87.1	0	0	0	110.6
197	S	30.3	Very low	38.4	Very low	89 Å²	89	119.2 Å²	119.2	62%	0.622	73%	0.732	S	S	*	*				179.7	115.7	-51.6	178.3	0	0	0	0	113.9
198	F	34.4	Very low	38.4	Very low	192 Å²	192	117.1 Å²	117.1	84%	0.842	72%	0.719	S	S	*	*			trans	65.9	172.9	156.4	-81.9	-121.3	0	0	0	119.8
199	N	31.7	Very low	37.2	Very low	127 Å²	127	119.9 Å²	119.9	68%	0.679	72%	0.721	S	S	*	*			cis	-174.9	149.4	-45.3	-157.5	-26.7	0	0	0	112.4
200	K	32.1	Very low	36.5	Very low	201 Å²	201	122.7 Å²	122.7	87%	0.874	72%	0.724	S	S	*	*			trans	72.7	162.1	154.2	-132.6	171.7	-178.6	179.7	0	122.6
201	A	35.3	Very low	36.6	Very low	85 Å²	85	120.6 Å²	120.6	70%	0.702	72%	0.718	S	S	*	*			trans	-129.7	172.9	-175.9	0	0	0	0	0	113.3
202	P	45.9	Very low	36.8	Very low	123 Å²	123	121.9 Å²	121.9	80%	0.799	72%	0.718	S	S	*	*				-157.9	166.4	128.3	40.5	-22.3	0	0	0	119.5
203	S	33.8	Very low	36	Very low	124 Å²	124	123.3 Å²	123.3	87%	0.867	71%	0.714	S	S	*	*			trans	38	157.6	140.4	-64.7	0	0	0	0	124.7
204	A	35.8	Very low	36.1	Very low	87 Å²	87	126.7 Å²	126.7	72%	0.719	72%	0.717	S	S	*	*			cis	-159	-174.7	-8.8	0	0	0	0	0	109.7
205	T	31.1	Very low	34.9	Very low	79 Å²	79	125.9 Å²	125.9	49%	0.485	71%	0.714	S	S	.	*				171.7	171.9	78.1	-51.5	0	0	0	0	110.7	R7 S8 Q9	R7-T205 WeakPolarHBondContact O-CG2 3.35Å; S8-T205 VanDerWaalsContact N-CG2 3.27Å; S8-T205 WeakPolarHBondContact O-CB 3Å; S8-T205 WeakPolarHBondContact O-CG2 3.5Å; Q9-T205 CarbonylContact C-O 3.59Å
206	S	31.4	Very low	34.7	Very low	74 Å²	74	127.2 Å²	127.2	52%	0.517	72%	0.719	S	S	.	*			trans	-105.6	-90.7	-147	36.7	0	0	0	0	126.3	Q9 E10	Q9-S206 VanDerWaalsContact CA-O 3.32Å; Q9-S206 WeakPolarHBondContact CA-O 3.32Å; E10-S206 PolarHBondContact N-O 2.86Å
207	P	56.8	Low	34.4	Very low	58 Å²	58	124.6 Å²	124.6	38%	0.377	72%	0.715	S	S	.	*			trans	-131.8	-162.4	-152.5	40.1	-17.2	0	0	0	115.3	S8 Q9	S8-P207 VanDerWaalsContact CB-O 3.28Å; S8-P207 WeakPolarHBondContact CB-O 3.43Å; Q9-P207 WeakPolarHBondContact CG-O 3.39Å; Q9-P207 PolarHBondContact OE1-O 3.23Å
208	P	49.9	Very low	34.4	Very low	78 Å²	78	128.8 Å²	128.8	51%	0.506	73%	0.725	S	S	.	*			cis	-146.8	172	4.3	47.9	-28.6	0	0	0	120.7
209	E	25.4	Very low	34.9	Very low	172 Å²	172	124.3 Å²	124.3	80%	0.804	72%	0.715	S	S	*	*			trans	53.4	129.9	131.6	-166.1	-176	156.3	0	0	127.2
210	Q	29.5	Very low	34.9	Very low	181 Å²	181	126.4 Å²	126.4	85%	0.846	73%	0.726	S	S	*	*				179.3	162.7	121	-101	-171.2	-6.4	0	0	117.5
211	L	34.7	Very low	34.7	Very low	146 Å²	146	123.3 Å²	123.3	76%	0.764	72%	0.719	S	S	*	*			trans	-123.5	159	175.8	-84.9	172.3	0	0	0	111.9
212	P	39.3	Very low	34.6	Very low	125 Å²	125	126.7 Å²	126.7	81%	0.812	72%	0.724	S	S	*	*			trans	-142.1	162.3	135.7	37.3	-23.2	0	0	0	116.2
213	H	28	Very low	33.9	Very low	160 Å²	160	125.2 Å²	125.2	74%	0.741	72%	0.722	S	S	*	*			trans	-105.5	-173	173.2	-72.9	-98.5	0	0	0	112.1
214	H	32.3	Very low	34.5	Very low	179 Å²	179	125.5 Å²	125.5	83%	0.829	72%	0.721	S	S	*	*			trans	73.7	144.6	159.5	95.6	-70.8	0	0	0	118.9
215	S	28.3	Very low	34.2	Very low	97 Å²	97	125 Å²	125	68%	0.678	72%	0.724	S	S	*	*			cis	-173.4	165.4	-15	44.5	0	0	0	0	113
216	S	25.4	Very low	34.3	Very low	110 Å²	110	132.6 Å²	132.6	77%	0.769	74%	0.744	S	S	*	*			trans	76.2	145.9	165.8	-151.2	0	0	0	0	116
217	T	31.6	Very low	34.2	Very low	129 Å²	129	137.1 Å²	137.1	79%	0.791	76%	0.759	S	S	*	*			cis	-148.3	162	26.2	-46.9	0	0	0	0	112.8
218	Q	29.3	Very low	33.2	Very low	178 Å²	178	140.2 Å²	140.2	83%	0.832	78%	0.779	S	S	*	*			trans	-133.3	-169.5	-178.5	-120.4	-163.9	24.6	0	0	109.4
219	P	46.4	Very low	32.5	Very low	97 Å²	97	143 Å²	143	63%	0.63	79%	0.788	S	S	*	*			cis	-134.4	171.8	-11.1	39.5	-23	0	0	0	115.7
220	L	31.3	Very low	32.6	Very low	171 Å²	171	145.6 Å²	145.6	90%	0.895	79%	0.792	S	S	*	*			trans	177.9	163.2	136.9	-126.1	65.8	0	0	0	110.2
221	D	27.3	Very low	32.7	Very low	136 Å²	136	147.1 Å²	147.1	73%	0.727	79%	0.792	S	S	*	*				-149.1	171	-71	-174.5	25.5	0	0	0	109.4
222	L	33.3	Very low	32.5	Very low	157 Å²	157	148.5 Å²	148.5	82%	0.822	79%	0.794	S	S	*	*			trans	76.1	148.9	176.8	-66.1	96.8	0	0	0	119.8
223	A	30.7	Very low	32	Very low	91 Å²	91	150.8 Å²	150.8	75%	0.752	80%	0.796	S	S	*	*			trans	-158	-163	-179.5	0	0	0	0	0	108.6
224	P	46.3	Very low	32.1	Very low	131 Å²	131	148.4 Å²	148.4	85%	0.851	80%	0.797	S	S	*	*			cis	-130.8	173.8	-21.3	40.3	-24.9	0	0	0	114.3
225	G	29.8	Very low	32.3	Very low	75 Å²	75	151 Å²	151	77%	0.773	80%	0.8	S	S	*	*			trans	-177.6	76	173.9	0	0	0	0	0	123.4
226	R	33.1	Very low	32.7	Very low	239 Å²	239	154.5 Å²	154.5	90%	0.902	81%	0.81	S	S	*	*			trans	45.7	126.8	143.6	-63.9	-173.7	176.8	-166.1	-1.4	124.7
227	M	30.4	Very low	33.4	Very low	169 Å²	169	155.1 Å²	155.1	83%	0.833	81%	0.811	S	S	*	*			trans	63.1	140	138.8	-94.5	66.1	171.2	0	0	122.9
228	P	35.3	Very low	33.4	Very low	124 Å²	124	154.2 Å²	154.2	81%	0.805	82%	0.817	S	S	*	*			trans	-88.3	165.7	170.9	37.7	-35.6	0	0	0	113.6
229	I	34.3	Very low	33.4	Very low	135 Å²	135	148.7 Å²	148.7	69%	0.692	81%	0.808	S	S	*	*			trans	-115.8	133.2	-175.1	-65.2	175.9	0	0	0	111.6	Y231	I229-Y231 HydrophobicContact CG2-CD2 3.81Å; I229-Y231 HydrophobicContact CG2-CE2 3.54Å
230	Y	28.4	Very low	32.9	Very low	228 Å²	228	155.5 Å²	155.5	89%	0.894	82%	0.823	S	S	*	*			trans	-74.5	139.3	164.7	-93.9	-103.1	0	0	0	110.9
231	Y	31.7	Very low	33.1	Very low	212 Å²	212	154.6 Å²	154.6	83%	0.831	83%	0.825	S	S	*	*			trans	-123.4	115.5	164.8	-92.5	-77.5	0	0	0	112.8	I229	I229-Y231 HydrophobicContact CG2-CD2 3.81Å; I229-Y231 HydrophobicContact CG2-CE2 3.54Å
232	Q	31.1	Very low	33.1	Very low	176 Å²	176	155.6 Å²	155.6	82%	0.822	83%	0.829	S	S	*	*			trans	-121.2	127	164.4	167.9	-166.2	-5.1	0	0	106.2
233	M	27.6	Very low	33	Very low	173 Å²	173	155.7 Å²	155.7	85%	0.852	83%	0.825	S	S	*	*			trans	-156.8	141.1	155.3	-87.4	-137.1	178.2	0	0	112.3
234	S	30.8	Very low	32.9	Very low	109 Å²	109	158.7 Å²	158.7	76%	0.762	82%	0.824	S	S	*	*			trans	-124	128.6	167.1	-39.2	0	0	0	0	107.8
235	R	35.3	Very low	32.2	Very low	234 Å²	234	158.1 Å²	158.1	88%	0.883	82%	0.818	S	S	*	*			trans	-149.1	149.2	161.9	-76.1	-156.7	178	-84	-6.5	112.1
236	L	38.3	Very low	33.1	Very low	170 Å²	170	160.1 Å²	160.1	89%	0.89	82%	0.817	S	S	*	*			trans	-87	153.3	172.5	-61	163.1	0	0	0	110.7
237	P	38.3	Very low	33.8	Very low	123 Å²	123	153.8 Å²	153.8	80%	0.799	81%	0.807	S	S	*	*			trans	-94	158.5	160.1	36.8	-31.3	0	0	0	111.9
238	A	32.5	Very low	33.8	Very low	110 Å²	110	152.7 Å²	152.7	91%	0.909	81%	0.81	S	S	*	*			trans	-156.8	151	172.8	0	0	0	0	0	111.9
239	G	29.6	Very low	33.4	Very low	63 Å²	63	149.8 Å²	149.8	65%	0.649	80%	0.803	S	S	*	*			trans	119.1	112.1	159.2	0	0	0	0	0	117
240	Y	35	Very low	33.2	Very low	240 Å²	240	148.6 Å²	148.6	94%	0.941	81%	0.813	S	S	*	*			trans	-141.4	152.3	158	-51.6	-69.3	0	0	0	108.2
241	T	35.7	Very low	33.1	Very low	152 Å²	152	143.2 Å²	143.2	93%	0.933	81%	0.809	S	S	*	*			trans	-123.1	170.4	-166.6	46.5	0	0	0	0	114.9
242	L	28.3	Very low	33.9	Very low	156 Å²	156	138.3 Å²	138.3	82%	0.817	80%	0.803	S	S	*	*			trans	-112	153.3	-166.5	175.4	71.1	0	0	0	112.7
243	H	29.8	Very low	33.8	Very low	159 Å²	159	136.1 Å²	136.1	74%	0.736	80%	0.801	S	S	*	*			trans	-146.4	131.8	156	-92.2	-86.8	0	0	0	112.1
244	E	28.6	Very low	34	Very low	155 Å²	155	135.4 Å²	135.4	72%	0.724	80%	0.8	S	S	*	*			trans	34	158.6	134	-66.1	175.1	98.2	0	0	123.1
245	T	31.8	Very low	33.8	Very low	118 Å²	118	136.1 Å²	136.1	72%	0.724	80%	0.8	S	S	*	*			cis	167	168.9	-43.9	28.9	0	0	0	0	108.6
246	P	48.9	Very low	34.4	Very low	117 Å²	117	130.7 Å²	130.7	76%	0.76	80%	0.795	S	S	*	*			cis	-123.5	-144.8	-20.4	40.9	-20.3	0	0	0	110
247	P	48.2	Very low	33.8	Very low	106 Å²	106	131.2 Å²	131.2	69%	0.688	79%	0.793	S	S	*	*			cis	-142.1	170.8	43.9	43.2	-23.4	0	0	0	118.3
248	T	29.7	Very low	33.1	Very low	146 Å²	146	132.4 Å²	132.4	90%	0.896	79%	0.788	S	S	*	*			trans	65.5	130.8	157	-49.5	0	0	0	0	119.3
249	G	27.1	Very low	32.8	Very low	64 Å²	64	132.4 Å²	132.4	66%	0.66	78%	0.781	S	S	*	*			cis	169.9	159.3	-6	0	0	0	0	0	113.6
250	A	30.2	Very low	32.7	Very low	109 Å²	109	137.1 Å²	137.1	90%	0.901	79%	0.786	S	S	*	*			trans	65.2	147.8	-176.8	0	0	0	0	0	116.1
251	S	26	Very low	32.3	Very low	116 Å²	116	131.6 Å²	131.6	81%	0.811	78%	0.783	S	S	*	*			cis	-145.7	158.3	-3.2	-154.1	0	0	0	0	109.9
252	P	50.1	Low	31.9	Very low	108 Å²	108	128.6 Å²	128.6	70%	0.701	77%	0.773	S	S	*	*			trans	-119.7	-169.2	-158.4	36.2	-19.7	0	0	0	117
253	V	29.1	Very low	32.2	Very low	130 Å²	130	128.7 Å²	128.7	79%	0.788	77%	0.774	S	S	*	*			trans	67.9	148.3	168	-100.7	0	0	0	0	117.4
254	L	31	Very low	32.1	Very low	159 Å²	159	129.3 Å²	129.3	83%	0.832	78%	0.777	S	S	*	*			cis	-140.7	168.8	15.9	-112.8	173.2	0	0	0	113.3
255	T	26.3	Very low	32.4	Very low	124 Å²	124	126.2 Å²	126.2	76%	0.761	78%	0.778	S	S	*	*			trans	-121.6	-156.5	171.4	47.7	0	0	0	0	110.4
256	P	48.4	Very low	32.5	Very low	119 Å²	119	125.1 Å²	125.1	77%	0.773	78%	0.781	S	S	*	*				-122.6	173.9	-84.2	39.4	-24.4	0	0	0	114.7
257	Q	24.7	Very low	31.6	Very low	181 Å²	181	123.9 Å²	123.9	85%	0.846	78%	0.781	S	S	*	*			trans	-160.8	133.7	165.3	-148.7	169.5	-1.9	0	0	108.2
258	E	25	Very low	30.8	Very low	148 Å²	148	122.8 Å²	122.8	69%	0.692	78%	0.781	S	S	*	*			cis	96.1	116	25.5	-160.9	-170.4	146.4	0	0	115.2	Q260	E258-Q260 PolarHBondContact OE1-NE2 2.7Å
259	S	26.2	Very low	30.8	Very low	110 Å²	110	123.5 Å²	123.5	77%	0.769	78%	0.779	S	S	*	*			trans	151.1	121.3	161.9	-71.6	0	0	0	0	107.6
260	Q	27.1	Very low	31	Very low	162 Å²	162	124.5 Å²	124.5	76%	0.757	79%	0.789	S	S	*	*			cis	91.6	90.2	31.4	-63.8	-155.7	54.1	0	0	116.2	E258	E258-Q260 PolarHBondContact OE1-NE2 2.7Å
261	S	25.3	Very low	31.1	Very low	124 Å²	124	122.8 Å²	122.8	87%	0.867	78%	0.782	S	S	*	*			trans	174	136.1	142	-75.2	0	0	0	0	108.5
262	A	28.7	Very low	31.4	Very low	89 Å²	89	126.5 Å²	126.5	74%	0.736	79%	0.787	S	S	*	*			cis	94.4	106.5	21.2	0	0	0	0	0	116.1
263	L	33.2	Very low	30.8	Very low	159 Å²	159	132.1 Å²	132.1	83%	0.832	79%	0.794	S	S	*	*			trans	69.9	155.8	143.6	-105.9	57.1	0	0	0	119.2
264	E	28.8	Very low	31.3	Very low	172 Å²	172	131.8 Å²	131.8	80%	0.804	79%	0.794	S	S	*	*			cis	-145.6	169.4	12.2	-164.2	166.5	125.2	0	0	114.3
265	A	35.1	Very low	31.1	Very low	89 Å²	89	134.2 Å²	134.2	74%	0.736	79%	0.793	S	S	*	*			trans	-49.2	-171.3	-176.9	0	0	0	0	0	118.8
266	A	32.9	Very low	31.2	Very low	96 Å²	96	136 Å²	136	79%	0.793	79%	0.792	S	S	*	*			cis	-155.9	-175.1	14.5	0	0	0	0	0	110.8
267	A	30.2	Very low	30.2	Very low	91 Å²	91	140.4 Å²	140.4	75%	0.752	79%	0.793	S	S	*	*			cis	-158.9	165.5	7.2	0	0	0	0	0	112.3
268	A	32.5	Very low	30.3	Very low	83 Å²	83	137.4 Å²	137.4	69%	0.686	78%	0.783	S	S	*	*			trans	60.8	141.7	152.7	0	0	0	0	0	120.8
269	N	29.7	Very low	30.4	Very low	161 Å²	161	137 Å²	137	86%	0.861	79%	0.785	S	S	*	*			cis	-154	135.2	-17.5	-85.1	-31.9	0	0	0	104.9
270	G	30.8	Very low	30.5	Very low	85 Å²	85	137.7 Å²	137.7	88%	0.876	78%	0.784	S	S	*	*				83.3	120.3	71.4	0	0	0	0	0	112.1
271	G	32.4	Very low	30.6	Very low	73 Å²	73	139.6 Å²	139.6	75%	0.753	79%	0.785	S	S	*	*			cis	172	169	-6.7	0	0	0	0	0	113.6
272	Q	32.4	Very low	31	Very low	194 Å²	194	142.1 Å²	142.1	91%	0.907	78%	0.775	S	S	*	*			trans	71	154.9	169.8	-60.1	-61.6	-14.3	0	0	120.7
273	R	37.6	Very low	30.8	Very low	226 Å²	226	146 Å²	146	85%	0.853	78%	0.778	S	S	*	*			trans	-116.2	159.9	167.1	-53	-160.5	-62.2	168.1	-3	109.2
274	P	38.9	Very low	30.7	Very low	123 Å²	123	141.6 Å²	141.6	80%	0.799	76%	0.76	S	S	*	*				-151	165	92.3	39.4	-22	0	0	0	117.2
275	R	27.3	Very low	30.7	Very low	210 Å²	210	141.6 Å²	141.6	79%	0.792	76%	0.76	S	S	*	*			trans	10	125.9	139.9	-165.6	-147.6	-164.8	-162	16.8	118.3
276	E	27.8	Very low	30.3	Very low	160 Å²	160	141.4 Å²	141.4	75%	0.748	76%	0.759	S	S	*	*				-173	-153.1	114.6	-98.2	179.3	-162.8	0	0	114.6
277	R	27.2	Very low	30.3	Very low	212 Å²	212	143.8 Å²	143.8	80%	0.8	76%	0.757	S	S	*	*			trans	-146.4	147	-139.1	175.2	-171.3	178.3	-171.8	3.2	113.8
278	N	27.3	Very low	30.1	Very low	118 Å²	118	145.9 Å²	145.9	63%	0.631	76%	0.756	S	S	*	*			trans	74.8	133.1	160.2	-80.2	2.7	0	0	0	121.4
279	L	27.8	Very low	29.9	Very low	141 Å²	141	146.9 Å²	146.9	74%	0.738	76%	0.758	S	S	*	*			trans	63.2	107.6	136.2	-87.1	82	0	0	0	124.3
280	V	26.9	Very low	30.6	Very low	124 Å²	124	144.1 Å²	144.1	75%	0.752	75%	0.749	S	S	*	*				80.3	141.8	107.6	163.6	0	0	0	0	122.7
281	R	28.9	Very low	30.5	Very low	202 Å²	202	147.1 Å²	147.1	76%	0.762	75%	0.745	S	S	*	*			trans	74.8	152.5	175.7	-79.1	-173.8	124.8	128.6	6.3	116.3
282	R	34	Very low	30.3	Very low	176 Å²	176	147.6 Å²	147.6	66%	0.664	74%	0.737	S	S	*	*			cis	-129.6	179.8	-2.4	-127	-178.5	179.6	128.3	-6.9	108.8
283	E	24.3	Very low	30.2	Very low	172 Å²	172	147.4 Å²	147.4	80%	0.804	73%	0.733	S	S	*	*			cis	-154.2	145	45.2	-139.3	144.7	78.3	0	0	107.7
284	S	31	Very low	30	Very low	65 Å²	65	140 Å²	140	46%	0.455	73%	0.726	S	S	.	*				54.5	125.7	64.1	-88.9	0	0	0	0	112
285	E	29	Very low	29.4	Very low	172 Å²	172	142.6 Å²	142.6	80%	0.804	73%	0.728	S	S	*	*			cis	-145.7	173.3	0.6	-102.4	142.1	71.2	0	0	108.1
286	A	27.6	Very low	29.6	Very low	85 Å²	85	134.9 Å²	134.9	70%	0.702	71%	0.714	S	S	*	*			cis	-158.4	157.9	37	0	0	0	0	0	114.5
287	L	33.1	Very low	29.5	Very low	147 Å²	147	136.5 Å²	136.5	77%	0.77	72%	0.722	S	S	*	*			trans	26	138.4	150.1	-72.7	79.6	0	0	0	120.8
288	D	26	Very low	29.3	Very low	135 Å²	135	129.5 Å²	129.5	72%	0.722	72%	0.715	S	S	*	*			cis	-147.3	-171.2	4	-143.2	-77.9	0	0	0	112.7
289	S	27.8	Very low	29.4	Very low	103 Å²	103	132.4 Å²	132.4	72%	0.72	73%	0.729	S	S	*	*			trans	-137.5	-159.7	-167.2	-66.6	0	0	0	0	109.6
290	P	44.7	Very low	29.7	Very low	104 Å²	104	131.7 Å²	131.7	68%	0.675	73%	0.731	S	S	*	*			cis	-140.5	-170.5	-4.9	43.7	-24.9	0	0	0	116.3
291	N	27.7	Very low	30.3	Very low	148 Å²	148	131.3 Å²	131.3	79%	0.791	73%	0.731	S	S	*	*			trans	70.1	170.6	152.4	-82.8	-18.1	0	0	0	120.2
292	S	28.5	Very low	30.4	Very low	83 Å²	83	127.8 Å²	127.8	58%	0.58	73%	0.731	S	S	*	*				-176.2	169.8	-59.2	64.5	0	0	0	0	110
293	K	30.9	Very low	30.1	Very low	190 Å²	190	125.8 Å²	125.8	83%	0.826	74%	0.739	S	S	*	*			trans	66.9	160.3	165.7	-71.4	-174.2	167.4	-164.1	0	116.7
294	G	32.8	Very low	30.1	Very low	69 Å²	69	126.3 Å²	126.3	71%	0.711	74%	0.741	S	S	*	*			trans	-142.4	152.9	162.3	0	0	0	0	0	109.7
295	E	27.5	Very low	29.8	Very low	178 Å²	178	128.7 Å²	128.7	83%	0.832	76%	0.756	S	S	*	*			trans	-153.4	162.3	167.5	-95.8	162.1	97.4	0	0	103.4
296	G	29.8	Very low	29.8	Very low	49 Å²	49	126.8 Å²	126.8	51%	0.505	76%	0.756	S	S	.	*			cis	126.9	117.6	19.3	0	0	0	0	0	106.9
297	Q	25.9	Very low	29.8	Very low	194 Å²	194	129.1 Å²	129.1	91%	0.907	76%	0.761	S	S	*	*			trans	62.1	168.9	-175	-68.6	85.7	-41.2	0	0	113.2
298	G	24.5	Very low	29.6	Very low	64 Å²	64	129.5 Å²	129.5	66%	0.66	76%	0.764	S	S	*	*			cis	149	157.1	-14	0	0	0	0	0	113.4
299	L	28	Very low	29.6	Very low	179 Å²	179	125.7 Å²	125.7	94%	0.937	76%	0.756	S	S	*	*			trans	75.7	143.9	169.5	-56.2	174.7	0	0	0	119.3
300	V	34.3	Very low	29.7	Very low	126 Å²	126	129.6 Å²	129.6	76%	0.764	76%	0.763	S	S	*	*			trans	-115.3	142.7	172.4	176.3	0	0	0	0	108.1	V302	V300-V302 HydrophobicContact CG1-CG2 4.18Å
301	P	40.9	Very low	29.1	Very low	116 Å²	116	131.4 Å²	131.4	75%	0.753	77%	0.767	S	S	*	*			trans	-127.9	142	135.2	34.6	-25.1	0	0	0	110.2
302	V	30.4	Very low	29.2	Very low	128 Å²	128	133.7 Å²	133.7	78%	0.776	77%	0.77	S	S	*	*			cis	71.8	84.9	36.2	-174.1	0	0	0	0	114.2	V300	V300-V302 HydrophobicContact CG1-CG2 4.18Å
303	V	27.9	Very low	29.3	Very low	135 Å²	135	135.1 Å²	135.1	82%	0.818	78%	0.78	S	S	*	*			trans	-161.3	142.5	154.9	179.7	0	0	0	0	105
304	E	23.6	Very low	29.3	Very low	183 Å²	183	129.1 Å²	129.1	86%	0.855	77%	0.772	S	S	*	*			cis	-155.2	-177.4	-32.2	-168.5	167	146	0	0	106.8
305	C	25.2	Very low	29.4	Very low	114 Å²	114	131.2 Å²	131.2	77%	0.77	78%	0.775	S	S	*	*			trans	-96.5	179	-163.9	-63.9	0	0	0	0	116.4
306	V	27.9	Very low	29.5	Very low	132 Å²	132	131.6 Å²	131.6	80%	0.8	78%	0.777	S	S	*	*			trans	89.2	112.2	156.4	-167.5	0	0	0	0	118.5
307	V	28.9	Very low	29.6	Very low	134 Å²	134	135.4 Å²	135.4	81%	0.812	79%	0.791	S	S	*	*				-176.7	99.8	119.5	151.2	0	0	0	0	104.9
308	D	27.8	Very low	30.4	Very low	156 Å²	156	131.6 Å²	131.6	83%	0.834	78%	0.783	S	S	*	*				82.8	156.9	90.5	-137.9	-31.2	0	0	0	113
309	G	27.1	Very low	30.7	Very low	54 Å²	54	137.8 Å²	137.8	56%	0.557	79%	0.786	S	S	*	*			trans	-102.2	-159.5	-154	0	0	0	0	0	117.9
310	Q	30.4	Very low	30.8	Very low	185 Å²	185	135.5 Å²	135.5	86%	0.864	78%	0.78	S	S	*	*			trans	74.7	139.9	161.6	-69.9	172.3	-7.6	0	0	116.4
311	L	30.5	Very low	30.5	Very low	143 Å²	143	135.5 Å²	135.5	75%	0.749	77%	0.771	S	S	*	*			cis	-142.2	172.4	2.7	-75.4	107.6	0	0	0	112.7
312	F	29.8	Very low	29.9	Very low	196 Å²	196	135.8 Å²	135.8	86%	0.86	77%	0.771	S	S	*	*			trans	-10	159.2	142.8	-62.1	-92.9	0	0	0	118.7
313	S	32.2	Very low	30	Very low	113 Å²	113	134.2 Å²	134.2	79%	0.79	77%	0.771	S	S	*	*			cis	-175.9	162.1	-3.8	166.8	0	0	0	0	106.9
314	G	30.6	Very low	30.4	Very low	63 Å²	63	132 Å²	132	65%	0.649	77%	0.768	S	S	*	*			cis	146.8	142.7	-5.1	0	0	0	0	0	112.2
315	S	34.1	Very low	31.2	Very low	113 Å²	113	129.8 Å²	129.8	79%	0.79	77%	0.769	S	S	*	*			trans	170.5	146.3	160.4	56.2	0	0	0	0	108.7
316	Q	30	Very low	31.6	Very low	187 Å²	187	128.4 Å²	128.4	87%	0.874	77%	0.766	S	S	*	*			cis	-145.9	149.7	3.6	-137.7	173	99.2	0	0	110.2
317	T	31.1	Very low	32	Very low	128 Å²	128	130.6 Å²	130.6	79%	0.785	77%	0.767	S	S	*	*			trans	-105.1	177.5	177.2	47.1	0	0	0	0	110.9
318	P	43.2	Very low	32.3	Very low	115 Å²	115	135.8 Å²	135.8	75%	0.747	77%	0.772	S	S	*	*			cis	-121.8	172.6	0.4	44.8	-31.2	0	0	0	112.4
319	R	30.3	Very low	32.4	Very low	193 Å²	193	132 Å²	132	73%	0.728	77%	0.77	S	S	*	*			cis	77.8	120.4	26.1	-166.9	175.2	-176.5	160.9	5.2	116.8	E321	R319-E321 IonicContact CZ-OE2 3.12Å; R319-E321 IonicContact NE-OE2 2.7Å; R319-E321 PolarHBondContact NE-OE2 3.3Å; R319-E321 VanDerWaalsContact NH2-CD 3.29Å; R319-E321 IonicContact NH2-OE1 2.65Å; R319-E321 PolarHBondContact NH2-OE1 3.03Å; R319-E321 VanDerWaalsContact NH2-OE1 3.14Å; R319-E321 IonicContact NH2-OE2 2.77Å; R319-E321 PolarHBondContact NH2-OE2 3.26Å
320	V	30.4	Very low	33	Very low	132 Å²	132	136.1 Å²	136.1	80%	0.8	78%	0.784	S	S	*	*			trans	163	120	145.9	151.6	0	0	0	0	105.9
321	E	28.1	Very low	34	Very low	125 Å²	125	133.7 Å²	133.7	58%	0.584	79%	0.785	S	S	*	*			cis	72.6	144.9	45.1	-83.2	178.9	129	0	0	114.8	R319	R319-E321 IonicContact CZ-OE2 3.12Å; R319-E321 IonicContact NE-OE2 2.7Å; R319-E321 PolarHBondContact NE-OE2 3.3Å; R319-E321 VanDerWaalsContact NH2-CD 3.29Å; R319-E321 IonicContact NH2-OE1 2.65Å; R319-E321 PolarHBondContact NH2-OE1 3.03Å; R319-E321 VanDerWaalsContact NH2-OE1 3.14Å; R319-E321 IonicContact NH2-OE2 2.77Å; R319-E321 PolarHBondContact NH2-OE2 3.26Å
322	V	29.1	Very low	34.1	Very low	122 Å²	122	133.7 Å²	133.7	74%	0.739	79%	0.785	S	S	*	*			cis	-153.7	158.8	-8.2	79.7	0	0	0	0	111.3
323	A	30.9	Very low	34.4	Very low	96 Å²	96	130.4 Å²	130.4	79%	0.793	78%	0.781	S	S	*	*			trans	57.3	159.1	153.3	0	0	0	0	0	122.6
324	A	36.2	Very low	34.3	Very low	89 Å²	89	131.2 Å²	131.2	74%	0.736	78%	0.777	S	S	*	*			trans	-103.5	175.8	171.2	0	0	0	0	0	111.6
325	P	41	Very low	34.9	Very low	136 Å²	136	136.5 Å²	136.5	88%	0.883	79%	0.789	S	S	*	*				-139.4	-178.6	120.8	38	-25.7	0	0	0	113.7
326	A	33.5	Very low	35.3	Very low	85 Å²	85	139.1 Å²	139.1	70%	0.702	79%	0.789	S	S	*	*			trans	-121.5	161.7	-171.9	0	0	0	0	0	113.6
327	H	37.2	Very low	35.5	Very low	177 Å²	177	137 Å²	137	82%	0.819	79%	0.788	S	S	*	*				175	144.6	127.8	-98.6	-64.1	0	0	0	115.5
328	R	34.7	Very low	35.7	Very low	243 Å²	243	140.3 Å²	140.3	92%	0.917	80%	0.795	S	S	*	*			trans	53.5	135	149.7	-76.6	-172.2	170.2	-160.9	-1.9	122.1
329	G	30.3	Very low	35.4	Very low	78 Å²	78	145.6 Å²	145.6	80%	0.804	80%	0.8	S	S	*	*			trans	161.5	119.4	147.4	0	0	0	0	0	114.9
330	T	39.7	Very low	35.6	Very low	140 Å²	140	142.3 Å²	142.3	86%	0.859	80%	0.801	S	S	*	*			trans	-109.4	157	159.3	48.1	0	0	0	0	109.1
331	P	50.8	Low	35.7	Very low	134 Å²	134	142.5 Å²	142.5	87%	0.87	80%	0.803	S	S	*	*				-140.8	-170.9	105.2	40.3	-27.5	0	0	0	114
332	D	33.4	Very low	35.8	Very low	142 Å²	142	140.1 Å²	140.1	76%	0.759	81%	0.812	S	S	*	*			trans	-114.9	142.3	-169.2	-175.8	-55	0	0	0	110.6
333	T	34.9	Very low	35.8	Very low	127 Å²	127	138.7 Å²	138.7	78%	0.779	81%	0.813	S	S	*	*			trans	-171.5	145.8	143.4	8.2	0	0	0	0	113.9
334	D	31.3	Very low	35.8	Very low	130 Å²	130	142.7 Å²	142.7	70%	0.695	82%	0.82	S	S	*	*			trans	30.9	128	156.2	-74.5	-44.1	0	0	0	123.4
335	L	41.9	Very low	35.4	Very low	174 Å²	174	143 Å²	143	91%	0.911	82%	0.822	S	S	*	*			trans	-116.2	94.2	148.2	-76.7	174.6	0	0	0	109.1
336	E	44.3	Very low	34.9	Very low	169 Å²	169	141.6 Å²	141.6	79%	0.79	82%	0.816	S	S	*	*			trans	-64.9	145.8	179.6	-76.1	-165.7	104.5	0	0	113.8	Q338	E336-Q338 PolarHBondContact O-N 2.87Å; E336-Q338 VanDerWaalsContact O-N 3.14Å
337	V	33.7	Very low	34.6	Very low	141 Å²	141	146.4 Å²	146.4	86%	0.855	82%	0.824	S	S	*	*			trans	-79.5	90	-179.1	-77	0	0	0	0	112.7	R339	V337-R339 PolarHBondContact O-N 3.07Å
338	Q	34.8	Very low	34.1	Very low	199 Å²	199	144.7 Å²	144.7	93%	0.93	82%	0.821	S	S	*	*			trans	-68.8	89.8	173.6	-69.7	-167.9	2.9	0	0	112.7	E336	E336-Q338 PolarHBondContact O-N 2.87Å; E336-Q338 VanDerWaalsContact O-N 3.14Å
339	R	36.1	Very low	33.7	Very low	225 Å²	225	141.9 Å²	141.9	85%	0.849	81%	0.811	S	S	*	*			trans	-84.2	171	159.2	-175.6	-176.5	-72.3	-177.9	-2.3	109.4	V337	V337-R339 PolarHBondContact O-N 3.07Å
340	V	34.4	Very low	33.6	Very low	124 Å²	124	146.6 Å²	146.6	75%	0.752	81%	0.805	S	S	*	*			trans	87.3	95.3	175	-172.9	0	0	0	0	111
341	V	33.4	Very low	33	Very low	137 Å²	137	145.8 Å²	145.8	83%	0.83	80%	0.799	S	S	*	*				65.4	122	70.8	-179.6	0	0	0	0	111.8
342	G	29.7	Very low	32	Very low	75 Å²	75	145.6 Å²	145.6	77%	0.773	80%	0.796	S	S	*	*			trans	-108.5	160.6	-172.8	0	0	0	0	0	115.8
343	A	29.3	Very low	31.8	Very low	92 Å²	92	143.2 Å²	143.2	76%	0.76	80%	0.795	S	S	*	*			trans	-148.3	138.8	157.6	0	0	0	0	0	106.1
344	L	31.4	Very low	31.5	Very low	179 Å²	179	141.6 Å²	141.6	94%	0.937	80%	0.795	S	S	*	*				68.8	67.5	51.7	-67.9	-177.9	0	0	0	115.4
345	A	28.2	Very low	31.5	Very low	95 Å²	95	142.4 Å²	142.4	79%	0.785	79%	0.794	S	S	*	*			trans	-172.1	131.7	139.9	0	0	0	0	0	107.2
346	S	29.2	Very low	30.8	Very low	108 Å²	108	144.3 Å²	144.3	76%	0.755	79%	0.79	S	S	*	*			cis	74.1	90	30.1	-160.6	0	0	0	0	114.7
347	Q	27.5	Very low	30.1	Very low	186 Å²	186	144.2 Å²	144.2	87%	0.869	79%	0.787	S	S	*	*				-175	145.1	108.2	-98.9	178.4	1.1	0	0	113.2
348	D	26.8	Very low	29.7	Very low	141 Å²	141	145 Å²	145	75%	0.754	78%	0.781	S	S	*	*			trans	-68.9	159.6	168.8	-57.3	-109	0	0	0	113
349	Y	27.4	Very low	29.5	Very low	184 Å²	184	142.4 Å²	142.4	72%	0.722	77%	0.769	S	S	*	*				-166.2	115.1	107.7	-123.3	-106.3	0	0	0	113.7
350	R	28.3	Very low	29.9	Very low	177 Å²	177	137.2 Å²	137.2	67%	0.668	76%	0.764	S	S	*	*			trans	36.5	146.9	134.1	-55.2	-147.6	-81.8	173	-10.1	120.2
351	V	27.5	Very low	29.7	Very low	123 Å²	123	135.4 Å²	135.4	75%	0.745	76%	0.757	S	S	*	*				-164	124.8	70	155.7	0	0	0	0	113.2
352	V	28.6	Very low	30.4	Very low	130 Å²	130	134.1 Å²	134.1	79%	0.788	75%	0.752	S	S	*	*			trans	53.7	134.1	140.6	179.2	0	0	0	0	119.4
353	A	28.3	Very low	30.4	Very low	91 Å²	91	137.9 Å²	137.9	75%	0.752	75%	0.753	S	S	*	*			cis	-131.2	-163.1	11.9	0	0	0	0	0	110.9
354	A	30.1	Very low	30.3	Very low	94 Å²	94	140.1 Å²	140.1	78%	0.777	75%	0.753	S	S	*	*			cis	-157.3	-173.9	1.8	0	0	0	0	0	108.1
355	Q	29.6	Very low	30.3	Very low	146 Å²	146	139 Å²	139	68%	0.682	75%	0.747	S	S	*	*			cis	-155.9	139.5	-4.8	-159.5	-148.2	130.2	0	0	108.7
356	R	29.3	Very low	30.7	Very low	214 Å²	214	138.9 Å²	138.9	81%	0.808	74%	0.74	S	S	*	*			trans	63.7	122.5	177.1	-60.1	-180	-173.8	-140.8	-3.4	114.8
357	K	27.6	Very low	30.7	Very low	168 Å²	168	141.7 Å²	141.7	73%	0.73	74%	0.741	S	S	*	*				63.2	125.3	72.1	-92.6	-170.7	175.3	-84.5	0	112.6
358	E	26.7	Very low	30.7	Very low	157 Å²	157	141.3 Å²	141.3	73%	0.734	74%	0.739	S	S	*	*			cis	-156.9	171.3	4.4	-158.5	144.4	-146	0	0	112.9
359	E	29.6	Very low	32.1	Very low	144 Å²	144	139.4 Å²	139.4	67%	0.673	73%	0.734	S	S	*	*			trans	-82.6	-178.1	-174.1	-120.9	-133.1	121.4	0	0	113.2	S361	E359-S361 WeakPolarHBondContact OE1-CB 3.49Å; E359-S361 PolarHBondContact OE1-N 3.45Å; E359-S361 PolarHBondContact OE1-OG 3.08Å
360	P	45.7	Very low	32.6	Very low	116 Å²	116	135.9 Å²	135.9	75%	0.753	73%	0.733	S	S	*	*			cis	-138.4	173.5	20.2	42.2	-21.9	0	0	0	121
361	S	30	Very low	32.6	Very low	87 Å²	87	133.6 Å²	133.6	61%	0.608	74%	0.735	S	S	*	*			trans	-69.3	-171.6	166.6	-47.6	0	0	0	0	112.9	E359	E359-S361 WeakPolarHBondContact OE1-CB 3.49Å; E359-S361 PolarHBondContact OE1-N 3.45Å; E359-S361 PolarHBondContact OE1-OG 3.08Å
362	P	47.4	Very low	33	Very low	110 Å²	110	136.2 Å²	136.2	71%	0.714	74%	0.738	S	S	*	*			cis	-145.3	-173.7	2.4	44.9	-25.1	0	0	0	117.8
363	L	30.4	Very low	33	Very low	153 Å²	153	139.8 Å²	139.8	80%	0.801	75%	0.746	S	S	*	*			trans	66	144.8	146.1	-81.7	169.1	0	0	0	124.2
364	N	27.5	Very low	33.1	Very low	140 Å²	140	138.4 Å²	138.4	75%	0.749	74%	0.741	S	S	*	*			trans	89.4	170.4	143.9	-103.1	-49.6	0	0	0	122.7
365	L	30.2	Very low	33.1	Very low	156 Å²	156	144 Å²	144	82%	0.817	75%	0.751	S	S	*	*			trans	-77.5	165.2	-161	-70	157.3	0	0	0	115.5
366	S	38	Very low	33.1	Very low	91 Å²	91	140.5 Å²	140.5	64%	0.636	75%	0.754	S	S	*	*			trans	-42.9	138.8	175.8	50.9	0	0	0	0	117.2
367	H	29	Very low	33.4	Very low	167 Å²	167	142.3 Å²	142.3	77%	0.773	76%	0.761	S	S	*	*				174.6	148.7	111.2	-93.9	-70.3	0	0	0	114.3
368	H	26.2	Very low	33.4	Very low	179 Å²	179	137.9 Å²	137.9	83%	0.829	76%	0.763	S	S	*	*			trans	70.4	155.6	160.4	-91.6	-102.5	0	0	0	120.7
369	P	56.3	Low	33.7	Very low	100 Å²	100	136.1 Å²	136.1	65%	0.649	77%	0.768	S	S	*	*			trans	-94.3	-176	-172.7	41	-36.5	0	0	0	112.5
370	P	38.6	Very low	33.6	Very low	110 Å²	110	133.8 Å²	133.8	71%	0.714	77%	0.773	S	S	*	*				-149.1	153.3	102.5	41	-25.8	0	0	0	117.3
371	D	28.1	Very low	32.9	Very low	130 Å²	130	139 Å²	139	70%	0.695	78%	0.778	S	S	*	*			trans	48.5	155.5	134.3	-74.2	-80.4	0	0	0	127.8
372	H	35.4	Very low	32.7	Very low	178 Å²	178	141.7 Å²	141.7	82%	0.824	79%	0.786	S	S	*	*			trans	82.5	88.9	150.3	-61.8	-21.9	0	0	0	121.8
373	Q	28.6	Very low	33.2	Very low	204 Å²	204	141.9 Å²	141.9	95%	0.953	79%	0.787	S	S	*	*			trans	-128.8	134.9	131.5	175.7	-176.2	85.6	0	0	106.7
374	G	31.5	Very low	32.9	Very low	62 Å²	62	138.9 Å²	138.9	64%	0.639	78%	0.784	S	S	*	*			cis	-175.8	167.7	-8.4	0	0	0	0	0	110.7
375	E	29.9	Very low	32.9	Very low	211 Å²	211	140 Å²	140	99%	0.986	79%	0.785	S	S	*	*			trans	59.4	-179.7	171.3	-63.8	-178.6	80.7	0	0	117.3
376	G	29.5	Very low	32.7	Very low	73 Å²	73	139.8 Å²	139.8	75%	0.753	78%	0.784	S	S	*	*			trans	-173.1	157.8	-178.5	0	0	0	0	0	120.1
377	R	34.6	Very low	32.2	Very low	252 Å²	252	139 Å²	139	95%	0.951	78%	0.783	S	S	*	*			trans	70.2	109	142.9	-165.5	-167.2	-58.6	-88.9	2.1	119.7
378	G	28.2	Very low	32.1	Very low	75 Å²	75	138.7 Å²	138.7	77%	0.773	78%	0.782	S	S	*	*			trans	160.4	84.6	154.9	0	0	0	0	0	113.8
379	S	32.3	Very low	32.2	Very low	120 Å²	120	137 Å²	137	84%	0.839	77%	0.772	S	S	*	*				84.6	101.2	61.9	177	0	0	0	0	115.9
380	A	29.2	Very low	30.8	Very low	95 Å²	95	137.6 Å²	137.6	79%	0.785	77%	0.77	S	S	*	*			trans	-176.4	108.1	136.9	0	0	0	0	0	116.4
381	R	30.9	Very low	30.5	Very low	226 Å²	226	140.4 Å²	140.4	85%	0.853	77%	0.774	S	S	*	*			trans	37.7	118.3	134.2	-68	179.4	171.1	175.4	-3.5	124.2
382	N	25	Very low	30.6	Very low	144 Å²	144	138 Å²	138	77%	0.77	77%	0.772	S	S	*	*				67.6	168.8	117.1	-58	5.1	0	0	0	121.4
383	P	57.4	Low	30.2	Very low	114 Å²	114	141.3 Å²	141.3	74%	0.74	78%	0.777	S	S	*	*				-140	-177.3	-51.7	41.9	-25.9	0	0	0	115
384	A	25.2	Very low	30.2	Very low	89 Å²	89	134.5 Å²	134.5	74%	0.736	76%	0.762	S	S	*	*			trans	69.9	162.7	161.4	0	0	0	0	0	117.1
385	E	26.8	Very low	30	Very low	164 Å²	164	141.3 Å²	141.3	77%	0.766	77%	0.774	S	S	*	*			cis	-157.5	164.2	1.2	-148.1	-179.3	107.8	0	0	112.6
386	L	26.1	Very low	29.8	Very low	152 Å²	152	140.8 Å²	140.8	80%	0.796	76%	0.764	S	S	*	*			trans	71.2	159.1	145.8	-145	68.7	0	0	0	123.3
387	A	28.1	Very low	30.5	Very low	75 Å²	75	142.9 Å²	142.9	62%	0.62	77%	0.765	S	S	*	*			trans	71.9	115	157.3	0	0	0	0	0	118.7
388	E	26.6	Very low	30.3	Very low	160 Å²	160	138 Å²	138	75%	0.748	75%	0.753	S	S	*	*				67.6	145.4	86.9	-79.3	-163.7	108.3	0	0	114.8
389	K	27.7	Very low	30.4	Very low	142 Å²	142	138.9 Å²	138.9	62%	0.617	75%	0.747	S	S	*	*			cis	170.3	177.6	-8.9	174	178.6	167.7	-171.7	0	107.4
390	N	27.7	Very low	30.4	Very low	114 Å²	114	139.7 Å²	139.7	61%	0.61	74%	0.737	S	S	*	*			trans	87.9	122.4	167.7	-53.1	-64.1	0	0	0	114.1
391	Q	32.4	Very low	30.3	Very low	169 Å²	169	143.6 Å²	143.6	79%	0.79	74%	0.739	S	S	*	*				78.3	149.7	53.1	-71.5	-172.3	97.8	0	0	113.6
392	A	29.8	Very low	30.2	Very low	80 Å²	80	140 Å²	140	66%	0.661	73%	0.732	S	S	*	*			cis	-179.8	131.3	-29.2	0	0	0	0	0	109.1
393	R	27.4	Very low	30.9	Very low	246 Å²	246	137.6 Å²	137.6	93%	0.928	72%	0.724	S	S	*	*			trans	173.9	152.4	155.6	-103.9	169.4	179.9	-150.7	-0.9	109.5
394	G	27.9	Very low	29.5	Very low	62 Å²	62	139 Å²	139	64%	0.639	73%	0.731	S	S	*	*			cis	146.7	130.5	-10.9	0	0	0	0	0	114
395	F	26.5	Very low	29.7	Very low	204 Å²	204	143 Å²	143	90%	0.895	73%	0.731	S	S	*	*			trans	91	143.6	166.7	-60.3	-79	0	0	0	120.5
396	Y	27.1	Very low	29.9	Very low	200 Å²	200	144.2 Å²	144.2	78%	0.784	74%	0.737	S	S	*	*			trans	-113	166.9	-175.3	-107.3	-86.4	0	0	0	108.3	Q398	Y396-Q398 HydrophobicContact CD1-CB 4.12Å
397	P	42.9	Very low	30	Very low	117 Å²	117	146.7 Å²	146.7	76%	0.76	74%	0.736	S	S	*	*				-137.7	166.4	61.7	40.9	-22.5	0	0	0	114
398	Q	32.1	Very low	30.6	Very low	151 Å²	151	148.3 Å²	148.3	71%	0.706	74%	0.74	S	S	*	*			cis	72.7	140.5	34.7	-172.7	163.2	6.8	0	0	112.8	Y396	Y396-Q398 HydrophobicContact CD1-CB 4.12Å
399	S	28.8	Very low	31.1	Very low	93 Å²	93	146.6 Å²	146.6	65%	0.65	74%	0.735	S	S	*	*			cis	-134	-168.1	4.3	65.2	0	0	0	0	110.1
400	H	32	Very low	31.5	Very low	136 Å²	136	145.7 Å²	145.7	63%	0.63	74%	0.744	S	S	*	*			cis	-158	-164.7	-3.9	-126.8	-27.3	0	0	0	107
401	Q	27.4	Very low	31.9	Very low	177 Å²	177	149.4 Å²	149.4	83%	0.827	76%	0.755	S	S	*	*			cis	-138.4	164	3.6	-155.9	166.4	83.3	0	0	111.4
402	E	30	Very low	31.8	Very low	150 Å²	150	145.4 Å²	145.4	70%	0.701	75%	0.751	S	S	*	*			trans	-107.7	-171.2	-172.2	-108.9	-177.4	94.9	0	0	111.6
403	P	39.8	Very low	31.9	Very low	94 Å²	94	149.6 Å²	149.6	61%	0.61	76%	0.758	S	S	*	*			cis	-133.7	164.4	-5.1	23.1	0.2	0	0	0	116.5
404	V	27.7	Very low	32.2	Very low	145 Å²	145	143.4 Å²	143.4	88%	0.879	75%	0.748	S	S	*	*			trans	-122.3	127.8	146.7	173.9	0	0	0	0	108.1
405	K	28.7	Very low	33	Very low	171 Å²	171	146.3 Å²	146.3	74%	0.743	75%	0.753	S	S	*	*			trans	-100.2	131.2	174.3	-75.1	179.1	176.2	174.2	0	110.2
406	H	31.6	Very low	33.2	Very low	190 Å²	190	141.2 Å²	141.2	88%	0.88	75%	0.749	S	S	*	*				-177.1	148.6	111.8	-97.3	-77.2	0	0	0	112
407	R	28.6	Very low	33.8	Very low	204 Å²	204	139.2 Å²	139.2	77%	0.77	75%	0.751	S	S	*	*			trans	-145.5	177.7	175	-111.6	-160.8	-173.8	-155.2	4.7	106.7
408	P	39	Very low	33.6	Very low	110 Å²	110	137.3 Å²	137.3	71%	0.714	75%	0.753	S	S	*	*			cis	-119	154.3	1	11.3	14.9	0	0	0	113.5
409	L	37.4	Very low	33.9	Very low	123 Å²	123	137.8 Å²	137.8	64%	0.644	76%	0.76	S	S	*	*				60.5	122.5	79.1	-161.3	87.4	0	0	0	116.6
410	P	37	Very low	33.8	Very low	123 Å²	123	141.6 Å²	141.6	80%	0.799	77%	0.772	S	S	*	*			trans	-119.3	179.1	133.5	37.3	-31.7	0	0	0	113.8
411	K	36.3	Very low	33.9	Very low	193 Å²	193	141.2 Å²	141.2	84%	0.839	78%	0.779	S	S	*	*			trans	-98.8	152.4	-149.8	-59.7	158.9	-178.8	170.7	0	115.8
412	A	30.3	Very low	34.7	Very low	85 Å²	85	138.2 Å²	138.2	70%	0.702	78%	0.775	S	S	*	*			trans	-7.9	155.3	133.9	0	0	0	0	0	119
413	M	30.4	Very low	34.5	Very low	167 Å²	167	137.4 Å²	137.4	82%	0.823	78%	0.781	S	S	*	*			cis	-167.9	153.6	7.4	-114.4	163.2	66.7	0	0	113.8
414	V	34.3	Very low	34	Very low	116 Å²	116	136.6 Å²	136.6	70%	0.703	79%	0.789	S	S	*	*			trans	55.8	108.2	141	178.9	0	0	0	0	123.4
415	V	45.1	Very low	34.3	Very low	123 Å²	123	136.2 Å²	136.2	75%	0.745	79%	0.787	S	S	*	*				21.4	135.7	127.1	-166.5	0	0	0	0	122.4
416	A	31.3	Very low	34.4	Very low	98 Å²	98	134.5 Å²	134.5	81%	0.81	79%	0.786	S	S	*	*			trans	-151.6	157	144.8	0	0	0	0	0	111.5
417	N	40	Very low	34.4	Very low	158 Å²	158	130.5 Å²	130.5	85%	0.845	78%	0.78	S	S	*	*			trans	-117.3	149.5	-176.9	-59.9	-20	0	0	0	112
418	G	36.9	Very low	34.3	Very low	76 Å²	76	124.2 Å²	124.2	78%	0.784	78%	0.778	S	S	*	*			trans	108.7	86.5	154.5	0	0	0	0	0	118.4
419	N	38.4	Very low	33.9	Very low	162 Å²	162	127.6 Å²	127.6	87%	0.866	79%	0.789	S	S	*	*			trans	7.4	127.7	155.6	-54.7	-6.9	0	0	0	121
420	L	27.6	Very low	33.8	Very low	172 Å²	172	129.6 Å²	129.6	90%	0.901	80%	0.8	S	S	*	*			trans	-151.6	144.1	143.2	-109.6	171.1	0	0	0	111.2
421	V	34.8	Very low	33.7	Very low	128 Å²	128	129.4 Å²	129.4	78%	0.776	80%	0.799	S	S	*	*			trans	-149.1	135.1	-174.8	168.3	0	0	0	0	105
422	P	43.5	Very low	33.2	Very low	114 Å²	114	127 Å²	127	74%	0.74	80%	0.8	S	S	*	*				-138.5	-168.7	64.2	31.4	-5.8	0	0	0	112.7
423	T	25	Very low	33.1	Very low	134 Å²	134	126.1 Å²	126.1	82%	0.822	80%	0.8	S	S	*	*			cis	-160.8	145.6	32.1	-52.1	0	0	0	0	111.2
424	G	30.5	Very low	33.1	Very low	76 Å²	76	123.2 Å²	123.2	78%	0.784	80%	0.795	S	S	*	*			trans	177.1	73.5	177.1	0	0	0	0	0	117.3
425	T	33.2	Very low	32.9	Very low	137 Å²	137	126 Å²	126	84%	0.84	80%	0.801	S	S	*	*			trans	-28.7	148.1	161.3	-42.1	0	0	0	0	116.7
426	D	32.2	Very low	32.2	Very low	135 Å²	135	126.2 Å²	126.2	72%	0.722	80%	0.797	S	S	*	*			cis	-171.4	157	-22.5	177.2	-120	0	0	0	109.6
427	S	30.1	Very low	32.1	Very low	106 Å²	106	128.8 Å²	128.8	74%	0.741	80%	0.796	S	S	*	*			trans	50.2	149.6	161.9	-69	0	0	0	0	122.3
428	G	27	Very low	31.5	Very low	72 Å²	72	127.5 Å²	127.5	74%	0.742	79%	0.793	S	S	*	*			trans	-176.9	-32.5	166.1	0	0	0	0	0	125
429	L	30	Very low	31.2	Very low	181 Å²	181	128.4 Å²	128.4	95%	0.948	79%	0.794	S	S	*	*			trans	62	164.4	179.9	-59.7	174.4	0	0	0	119
430	L	35.8	Very low	30.7	Very low	165 Å²	165	126.1 Å²	126.1	86%	0.864	79%	0.79	S	S	*	*			trans	-98.5	149.9	177.2	-56.2	174.1	0	0	0	111.6
431	P	36.1	Very low	30.7	Very low	119 Å²	119	123.4 Å²	123.4	77%	0.773	79%	0.785	S	S	*	*				-134.2	157.5	110.3	11.3	11.4	0	0	0	111.8
432	V	25.7	Very low	30.7	Very low	142 Å²	142	124.8 Å²	124.8	86%	0.861	79%	0.788	S	S	*	*			cis	78.3	113.4	47.1	179.2	0	0	0	0	114.7
433	G	27.2	Very low	30	Very low	68 Å²	68	125.3 Å²	125.3	70%	0.701	78%	0.784	S	S	*	*			trans	85.7	156.4	165.7	0	0	0	0	0	116.6
434	S	31.1	Very low	30.6	Very low	105 Å²	105	125.3 Å²	125.3	73%	0.734	78%	0.784	S	S	*	*			cis	-168.1	142.9	-13.6	-85.4	0	0	0	0	109.7
435	E	29.3	Very low	30.8	Very low	175 Å²	175	129.8 Å²	129.8	82%	0.818	78%	0.784	S	S	*	*			trans	63.4	167.7	150.6	-67.1	-174.5	167.3	0	0	117.2
436	I	30.7	Very low	30.7	Very low	128 Å²	128	127.9 Å²	127.9	66%	0.656	78%	0.782	S	S	*	*			cis	-160.2	171.9	-19.7	-109.9	170.4	0	0	0	108.4
437	L	28.8	Very low	30.6	Very low	151 Å²	151	132.6 Å²	132.6	79%	0.791	79%	0.79	S	S	*	*			trans	71.4	126	177.7	-65.7	152.4	0	0	0	115.1
438	V	28.2	Very low	30.8	Very low	131 Å²	131	130.8 Å²	130.8	79%	0.794	78%	0.782	S	S	*	*			cis	84	105	46	175.4	0	0	0	0	113.9
439	A	29.6	Very low	30.8	Very low	96 Å²	96	134.1 Å²	134.1	79%	0.793	79%	0.788	S	S	*	*			trans	-165.2	111.8	144.9	0	0	0	0	0	113.2
440	S	28.3	Very low	31	Very low	113 Å²	113	134.7 Å²	134.7	79%	0.79	78%	0.783	S	S	*	*			trans	17.6	139.2	144.2	-47.6	0	0	0	0	124.4
441	S	28.7	Very low	31.4	Very low	115 Å²	115	132.4 Å²	132.4	80%	0.804	78%	0.778	S	S	*	*			trans	72.9	153.9	149.2	-62.3	0	0	0	0	118.6
442	L	33.3	Very low	31.2	Very low	158 Å²	158	134.4 Å²	134.4	83%	0.827	78%	0.783	S	S	*	*			cis	-135.5	154.5	11.6	-164.4	75.9	0	0	0	112.1
443	D	30.2	Very low	31.7	Very low	124 Å²	124	136.4 Å²	136.4	66%	0.663	78%	0.78	S	S	*	*			trans	-74.1	132.7	169.3	-172	-65	0	0	0	111.8	Q445	D443-Q445 PolarHBondContact OD1-N 3.17Å
444	V	36.2	Very low	32	Very low	134 Å²	134	141 Å²	141	81%	0.812	78%	0.783	S	S	*	*			trans	-138.7	102.8	147.2	179.3	0	0	0	0	109.5	A446	V444-A446 PolarHBondContact O-N 3.32Å
445	Q	34.5	Very low	32.3	Very low	170 Å²	170	141.7 Å²	141.7	79%	0.794	79%	0.785	S	S	*	*			trans	-66	121.4	172.8	-177.7	177	108.9	0	0	113.6	D443	D443-Q445 PolarHBondContact OD1-N 3.17Å
446	A	32.2	Very low	32.8	Very low	97 Å²	97	138.8 Å²	138.8	80%	0.802	78%	0.779	S	S	*	*			trans	-138.2	146.3	162.8	0	0	0	0	0	110.2	V444	V444-A446 PolarHBondContact O-N 3.32Å
447	R	30.4	Very low	33.4	Very low	234 Å²	234	137.9 Å²	137.9	88%	0.883	78%	0.782	S	S	*	*			trans	-115.3	121.2	-150.8	-175.7	171.2	176.6	153.8	-2.7	115.3
448	A	33.6	Very low	34	Very low	69 Å²	69	135.8 Å²	135.8	57%	0.57	78%	0.777	S	S	*	*			trans	56.1	111.8	150.6	0	0	0	0	0	120.1
449	T	27.8	Very low	34.5	Very low	142 Å²	142	135.3 Å²	135.3	87%	0.871	78%	0.776	S	S	*	*				-142.9	121.6	120.3	-43.7	0	0	0	0	108
450	F	33.2	Very low	35.1	Very low	193 Å²	193	137.2 Å²	137.2	85%	0.846	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-100.6	135	170.3	-73.1	-78	0	0	0	108.7
451	P	44.7	Very low	35.6	Very low	117 Å²	117	136.1 Å²	136.1	76%	0.76	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-70.3	160	168.6	31.6	-34.2	0	0	0	110.8
452	D	32.2	Very low	36.6	Very low	161 Å²	161	135.7 Å²	135.7	86%	0.861	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-57.8	151.4	-176.2	-169	18.9	0	0	0	113.2
453	K	35.4	Very low	37.2	Very low	184 Å²	184	132.4 Å²	132.4	80%	0.8	75%	0.748	S	S	*	*			trans	-132.7	98.8	-179.8	-166	178.3	-175.6	-177.2	0	110.5
454	E	33.1	Very low	38.6	Very low	164 Å²	164	133.4 Å²	133.4	77%	0.766	75%	0.748	S	S	*	*			trans	-41.3	121.9	174.6	-173.9	-178.2	94.5	0	0	111.9	T456	E454-T456 PolarHBondContact O-N 2.9Å
455	P	38.6	Very low	40.3	Very low	119 Å²	119	129.5 Å²	129.5	77%	0.773	72%	0.723	S	S	*	*			trans	-75.8	93.6	-178.7	29.5	-33.6	0	0	0	110.2
456	T	38.3	Very low	42.6	Very low	115 Å²	115	123.8 Å²	123.8	71%	0.706	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-51.7	127.4	168.3	-43.1	0	0	0	0	109.3	E454	E454-T456 PolarHBondContact O-N 2.9Å
457	P	44.7	Very low	45.1	Very low	109 Å²	109	123.1 Å²	123.1	71%	0.708	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-61.2	138.1	180	24.7	-33.6	0	0	0	110
458	P	41	Very low	47.9	Very low	107 Å²	107	116.3 Å²	116.3	70%	0.695	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-63	147.4	179.7	27.2	-34.6	0	0	0	110.3	I460	P458-I460 PolarHBondContact O-N 2.89Å
459	P	38.7	Very low	50.7	Low	120 Å²	120	114.4 Å²	114.4	78%	0.779	65%	0.646	S	S	*	*			trans	-61.8	113.8	173.4	26.5	-33.2	0	0	0	109	T461	P459-T461 PolarHBondContact O-N 2.75Å
460	I	41.8	Very low	53.9	Low	136 Å²	136	112.3 Å²	112.3	70%	0.697	63%	0.628	S	S	*	*			trans	-58.4	108.2	175.5	25.2	172.7	0	0	0	109.3	P458 S462 L563	P458-I460 PolarHBondContact O-N 2.89Å; I460-S462 PolarHBondContact O-N 3.24Å; I460-S462 VanDerWaalsContact O-N 3.08Å; I460-L563 HydrophobicContact CD1-CD2 3.81Å
461	T	39.8	Very low	56.8	Low	90 Å²	90	108.8 Å²	108.8	55%	0.552	61%	0.612	S	S	*	*			trans	-69.7	104.9	177	41.9	0	0	0	0	108.9	P459 S463 H464	P459-T461 PolarHBondContact O-N 2.75Å; T461-S463 PolarHBondContact O-N 2.82Å; T461-H464 PolarHBondContact O-N 2.81Å; T461-H464 PolarHBondContact OG1-CD2 3.07Å
462	S	48.7	Very low	59.2	Low	106 Å²	106	104.8 Å²	104.8	74%	0.741	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-61.9	-6.2	-176.2	52.4	0	0	0	0	114.6	I460 H464	I460-S462 PolarHBondContact O-N 3.24Å; I460-S462 VanDerWaalsContact O-N 3.08Å; S462-H464 PolarHBondContact O-N 3.11Å
463	S	45.9	Very low	62.2	Low	89 Å²	89	98.2 Å²	98.2	62%	0.622	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-68.9	-3.9	176.7	49.3	0	0	0	0	115.9	T461	T461-S463 PolarHBondContact O-N 2.82Å
464	H	59.4	Low	65.1	Low	146 Å²	146	94 Å²	94	68%	0.676	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-121	-2.1	-175	-57.7	-67.1	0	0	0	115.5	T461 S462	T461-H464 PolarHBondContact O-N 2.81Å; T461-H464 PolarHBondContact OG1-CD2 3.07Å; S462-H464 PolarHBondContact O-N 3.11Å
465	L	73.4	Confident	68.1	Low	52 Å²	52	88.4 Å²	88.4	27%	0.272	52%	0.52	S	S	.	.	S	Bend	trans	-78.5	136.7	176.2	-73.7	84.4	0	0	0	110.1	S467 L563 F564	L465-S467 PolarHBondContact O-N 3.24Å; L465-S467 VanDerWaalsContact O-N 3.1Å; L465-L563 HydrophobicContact CD2-CB 3.89Å; L465-L563 HydrophobicContact CD2-CD2 4.32Å; L465-F564 HydrophobicContact CB-CE1 4.14Å; L465-F564 HydrophobicContact CD2-CD1 4.48Å; L465-F564 HydrophobicContact CD2-CE1 4.01Å; L465-F564 HydrophobicContact CD2-CE2 4.48Å; L465-F564 HydrophobicContact CD2-CZ 4.01Å; L465-F564 HydrophobicContact CG-CE1 4.47Å; L465-F564 HydrophobicContact CG-CZ 4.47Å
466	P	82.6	Confident	70.8	Confident	50 Å²	50	87.2 Å²	87.2	33%	0.325	51%	0.505	S	S	.	.			trans	-65.7	113.1	177.7	-17.9	29.5	0	0	0	111.1	H468 F469	P466-H468 PolarHBondContact O-N 3.09Å; P466-F469 HydrophobicContact CB-CD2 3.77Å; P466-F469 HydrophobicContact CB-CE2 4.19Å; P466-F469 HydrophobicContact CG-CD2 4.03Å; P466-F469 HydrophobicContact CG-CE2 4.29Å; P466-F469 PolarHBondContact O-N 3.21Å
467	S	83.4	Confident	73.4	Confident	83 Å²	83	82.4 Å²	82.4	58%	0.58	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-61.6	-27.3	-173.2	55	0	0	0	0	114	L465 F469 M470	L465-S467 PolarHBondContact O-N 3.24Å; L465-S467 VanDerWaalsContact O-N 3.1Å; S467-F469 PolarHBondContact O-N 3.12Å; S467-M470 WeakPolarHBondContact O-CB 3.39Å; S467-M470 PolarHBondContact O-N 2.92Å
468	H	89.5	Confident	75.7	Confident	90 Å²	90	79 Å²	79	42%	0.417	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-67.4	-15.7	176.2	53.6	-107	0	0	0	114	P466 I475 V485	P466-H468 PolarHBondContact O-N 3.09Å; H468-I475 HydrophobicContact CB-CD1 4.39Å; H468-V485 WeakPolarHBondContact O-CG2 3.37Å
469	F	93.5	Very high	78.1	Confident	29 Å²	29	76.3 Å²	76.3	13%	0.127	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-92.3	-6.9	171.1	-64.1	-47.2	0	0	0	113.3	P466 S467 P544 W552 F564 L566	P466-F469 HydrophobicContact CB-CD2 3.77Å; P466-F469 HydrophobicContact CB-CE2 4.19Å; P466-F469 HydrophobicContact CG-CD2 4.03Å; P466-F469 HydrophobicContact CG-CE2 4.29Å; P466-F469 PolarHBondContact O-N 3.21Å; S467-F469 PolarHBondContact O-N 3.12Å; F469-P544 HydrophobicContact CB-CG 4.03Å; F469-P544 HydrophobicContact CD1-CG 3.66Å; F469-P544 HydrophobicContact CD2-CG 3.59Å; F469-P544 HydrophobicContact CE1-CG 3.94Å; F469-P544 HydrophobicContact CE2-CG 3.88Å; F469-P544 HydrophobicContact CG-CG 3.49Å; F469-P544 VanDerWaalsContact CG-CG 3.49Å; F469-P544 HydrophobicContact CZ-CG 4.05Å; F469-W552 AromaticContact CD1-CH2 3.98Å; F469-W552 HydrophobicContact CD1-CH2 3.98Å; F469-W552 HydrophobicContact CD1-CZ3 4.19Å; F469-W552 AromaticContact CE1-CH2 3.74Å; F469-W552 HydrophobicContact CE1-CH2 3.74Å; F469-W552 AromaticContact CE1-CZ3 3.86Å; F469-W552 HydrophobicContact CE1-CZ3 3.86Å; F469-F564 HydrophobicContact CB-CD1 3.53Å; F469-F564 HydrophobicContact CB-CE1 3.73Å; F469-F564 HydrophobicContact CB-CG 4.27Å; F469-F564 HydrophobicContact CD2-CE1 4.4Å; F469-F564 WeakPolarHBondContact O-CB 3.26Å; F469-L566 HydrophobicContact CB-CD1 4.45Å; F469-L566 VanDerWaalsContact O-CD1 3.28Å; F469-L566 WeakPolarHBondContact O-CD1 3.23Å; F469-L566 WeakPolarHBondContact O-CD2 3.36Å; F469-L566 VanDerWaalsContact O-CG 3.25Å; F469-L566 WeakPolarHBondContact O-CG 3.33Å
470	M	93.9	Very high	80.7	Confident	98 Å²	98	72.7 Å²	72.7	48%	0.483	42%	0.422	S	S	.	.	S	Bend	trans	-72.5	132	177.9	-64.1	175	63.3	0	0	110.5	S467 G472 A473 V485	S467-M470 WeakPolarHBondContact O-CB 3.39Å; S467-M470 PolarHBondContact O-N 2.92Å; M470-G472 PolarHBondContact O-N 3.31Å; M470-A473 WeakPolarHBondContact O-CB 3.49Å; M470-A473 PolarHBondContact O-N 3.33Å; M470-V485 WeakPolarHBondContact O-CG1 3.41Å
471	K	94.2	Very high	83.3	Confident	120 Å²	120	69.5 Å²	69.5	52%	0.522	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	132.8	174.7	-172.9	-173.6	-175.3	167.7	0	111.8	A473 E486 F564 S565 L566	K471-A473 VanDerWaalsContact C-N 3.31Å; K471-E486 HydrophobicContact CG-CB 4.42Å; K471-E486 VanDerWaalsContact CG-CD 3.44Å; K471-E486 HydrophobicContact CG-CG 4.2Å; K471-E486 VanDerWaalsContact CG-OE1 3.28Å; K471-E486 WeakPolarHBondContact CG-OE1 3.21Å; K471-F564 WeakPolarHBondContact CB-O 3.28Å; K471-F564 PolarHBondContact N-O 2.71Å; K471-S565 WeakPolarHBondContact CD-O 3.25Å; K471-L566 HydrophobicContact CB-CD2 4.41Å
472	G	94.6	Very high	85.9	Confident	32 Å²	32	70.9 Å²	70.9	33%	0.33	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	-5	-175.5	0	0	0	0	0	114.3	M470 I474 E486	M470-G472 PolarHBondContact O-N 3.31Å; G472-I474 PolarHBondContact O-N 3.05Å; G472-E486 PolarHBondContact N-OE1 3.18Å; G472-E486 PolarHBondContact N-OE2 3.46Å
473	A	96	Very high	88.2	Confident	24 Å²	24	67.4 Å²	67.4	20%	0.198	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-59.7	132.9	166.5	0	0	0	0	0	109.9	M470 K471 R484 V485	M470-A473 WeakPolarHBondContact O-CB 3.49Å; M470-A473 PolarHBondContact O-N 3.33Å; K471-A473 VanDerWaalsContact C-N 3.31Å; A473-R484 WeakPolarHBondContact O-CA 3.38Å; A473-V485 HydrophobicContact CB-CB 4.43Å; A473-V485 HydrophobicContact CB-CG1 3.92Å; A473-V485 PolarHBondContact O-N 2.93Å
474	I	96.3	Very high	90.6	Very high	96 Å²	96	69 Å²	69	49%	0.492	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	119.7	-178.9	-53.5	-55.9	0	0	0	108.8	G472 L482 R484	G472-I474 PolarHBondContact O-N 3.05Å; I474-L482 HydrophobicContact CG2-CB 3.86Å; I474-L482 HydrophobicContact CG2-CD2 4.16Å; I474-L482 HydrophobicContact CG2-CG 4.41Å; I474-R484 HydrophobicContact CD1-CG 4.04Å
475	I	95.2	Very high	92.4	Very high	45 Å²	45	62.1 Å²	62.1	23%	0.231	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	123	176.4	-51.9	-56.7	0	0	0	107.6	H468 K483 V485 L488	H468-I475 HydrophobicContact CB-CD1 4.39Å; I475-K483 PolarHBondContact N-O 2.79Å; I475-K483 PolarHBondContact O-N 2.89Å; I475-V485 HydrophobicContact CD1-CB 4.37Å; I475-V485 HydrophobicContact CG1-CB 4.02Å; I475-L488 HydrophobicContact CB-CD1 4.43Å; I475-L488 HydrophobicContact CG1-CD1 4.01Å; I475-L488 HydrophobicContact CG2-CD1 4.41Å
476	Q	95	Very high	93.5	Very high	95 Å²	95	61 Å²	61	44%	0.444	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	117.1	169.2	-174.6	174.3	39	0	0	108.9	L482 S680	Q476-L482 HydrophobicContact CB-CD2 3.76Å; Q476-L482 HydrophobicContact CG-CD2 3.87Å; Q476-S680 PolarHBondContact OE1-OG 2.88Å
477	L	94.1	Very high	94.1	Very high	14 Å²	14	62.6 Å²	62.6	7%	0.073	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-73.9	157.4	172.4	-60.4	-176.8	0	0	0	110.2	T479 G480 E481 K483 L488 D492	L477-T479 WeakPolarHBondContact CB-OG1 3.45Å; L477-T479 PolarHBondContact O-N 3.39Å; L477-T479 VanDerWaalsContact O-N 3.07Å; L477-G480 PolarHBondContact O-N 3Å; L477-E481 HydrophobicContact CB-CB 4.31Å; L477-E481 WeakPolarHBondContact CB-O 3.47Å; L477-E481 HydrophobicContact CD1-CB 4.12Å; L477-E481 HydrophobicContact CD1-CG 4.26Å; L477-E481 PolarHBondContact N-O 3.34Å; L477-K483 HydrophobicContact CD1-CD 4.41Å; L477-L488 HydrophobicContact CD2-CD2 3.82Å; L477-D492 HydrophobicContact CD1-CB 3.67Å; L477-D492 HydrophobicContact CD2-CB 3.88Å; L477-D492 HydrophobicContact CG-CB 4.46Å
478	A	92.9	Very high	94.7	Very high	38 Å²	38	59.5 Å²	59.5	31%	0.314	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-5	178.7	0	0	0	0	0	113.3	G480 S496 S500 L503	A478-G480 VanDerWaalsContact C-N 3.3Å; A478-S496 PolarHBondContact N-OG 3.23Å; A478-S500 WeakPolarHBondContact CB-OG 3.46Å; A478-L503 HydrophobicContact CB-CD1 3.59Å
479	T	91.8	Very high	95	Very high	49 Å²	49	60.3 Å²	60.3	30%	0.301	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-9.1	166.8	60.3	0	0	0	0	113.5	L477 E481 R495 V499	L477-T479 WeakPolarHBondContact CB-OG1 3.45Å; L477-T479 PolarHBondContact O-N 3.39Å; L477-T479 VanDerWaalsContact O-N 3.07Å; T479-E481 VanDerWaalsContact C-N 3.28Å; T479-E481 VanDerWaalsContact OG1-CB 3.23Å; T479-E481 WeakPolarHBondContact OG1-CB 3.46Å; T479-E481 PolarHBondContact OG1-N 3.22Å; T479-R495 HydrophobicContact CG2-CB 4.12Å; T479-V499 HydrophobicContact CG2-CB 4.33Å; T479-V499 HydrophobicContact CG2-CG2 4.1Å
480	G	92.4	Very high	95.1	Very high	45 Å²	45	59.9 Å²	59.9	46%	0.464	32%	0.32	S	S	.	.	S	Bend	trans	84.7	-8.7	-168.7	0	0	0	0	0	114.4	L477 A478	L477-G480 PolarHBondContact O-N 3Å; A478-G480 VanDerWaalsContact C-N 3.3Å
481	E	95.7	Very high	95.2	Very high	69 Å²	69	61.5 Å²	61.5	32%	0.322	33%	0.326	S	S	.	.			trans	-65.2	131.5	177	-175.3	-175.6	147.1	0	0	110.8	L477 T479 R495	L477-E481 HydrophobicContact CB-CB 4.31Å; L477-E481 WeakPolarHBondContact CB-O 3.47Å; L477-E481 HydrophobicContact CD1-CB 4.12Å; L477-E481 HydrophobicContact CD1-CG 4.26Å; L477-E481 PolarHBondContact N-O 3.34Å; T479-E481 VanDerWaalsContact C-N 3.28Å; T479-E481 VanDerWaalsContact OG1-CB 3.23Å; T479-E481 WeakPolarHBondContact OG1-CB 3.46Å; T479-E481 PolarHBondContact OG1-N 3.22Å; E481-R495 IonicContact OE1-NH2 3.14Å; E481-R495 PolarHBondContact OE1-NH2 3.22Å; E481-R495 IonicContact OE2-CZ 3.9Å; E481-R495 VanDerWaalsContact OE2-CZ 3.27Å; E481-R495 IonicContact OE2-NH1 3.29Å; E481-R495 PolarHBondContact OE2-NH1 2.65Å; E481-R495 IonicContact OE2-NH2 2.74Å; E481-R495 PolarHBondContact OE2-NH2 2.83Å
482	L	96.5	Very high	95.2	Very high	119 Å²	119	55.9 Å²	55.9	62%	0.623	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	118.2	174.9	-63.8	-177.5	0	0	0	109.4	I474 Q476	I474-L482 HydrophobicContact CG2-CB 3.86Å; I474-L482 HydrophobicContact CG2-CD2 4.16Å; I474-L482 HydrophobicContact CG2-CG 4.41Å; Q476-L482 HydrophobicContact CB-CD2 3.76Å; Q476-L482 HydrophobicContact CG-CD2 3.87Å
483	K	96.6	Very high	95.2	Very high	33 Å²	33	55.6 Å²	55.6	14%	0.143	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	149.1	-177.3	-152.9	171.3	-165.5	-178.2	0	110.9	I475 L477 D487 L488 D492	I475-K483 PolarHBondContact N-O 2.79Å; I475-K483 PolarHBondContact O-N 2.89Å; L477-K483 HydrophobicContact CD1-CD 4.41Å; K483-D487 WeakPolarHBondContact CE-O 3.47Å; K483-D487 HydrophobicContact CG-CB 4.21Å; K483-D487 PolarHBondContact NZ-O 2.83Å; K483-L488 HydrophobicContact CD-CD2 4.42Å; K483-D492 VanDerWaalsContact CD-OD2 3.32Å; K483-D492 WeakPolarHBondContact CD-OD2 3.45Å; K483-D492 WeakPolarHBondContact CE-OD2 3.4Å; K483-D492 IonicContact NZ-OD1 3.74Å; K483-D492 PolarHBondContact NZ-OD1 2.52Å; K483-D492 IonicContact NZ-OD2 3.18Å; K483-D492 PolarHBondContact NZ-OD2 2.95Å
484	R	96.6	Very high	95.1	Very high	122 Å²	122	56.6 Å²	56.6	46%	0.46	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	148.1	173.6	-53.9	-174.1	169.5	-141.6	-2.2	110.2	A473 I474 E486 D487 L488	A473-R484 WeakPolarHBondContact O-CA 3.38Å; I474-R484 HydrophobicContact CD1-CG 4.04Å; R484-E486 VanDerWaalsContact C-N 3.27Å; R484-E486 HydrophobicContact CB-CG 4.24Å; R484-E486 WeakPolarHBondContact CD-OE1 3.29Å; R484-E486 IonicContact NH1-OE1 2.87Å; R484-E486 PolarHBondContact NH1-OE1 2.77Å; R484-E486 PolarHBondContact O-N 2.82Å; R484-D487 HydrophobicContact CB-CB 4.24Å; R484-D487 WeakPolarHBondContact CB-OD2 3.42Å; R484-D487 VanDerWaalsContact CD-OD2 3.29Å; R484-D487 WeakPolarHBondContact CD-OD2 3.48Å; R484-D487 WeakPolarHBondContact CG-OD2 3.28Å; R484-D487 PolarHBondContact O-N 2.86Å; R484-L488 PolarHBondContact O-N 3.43Å
485	V	96.5	Very high	95	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.006	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-56.8	-40.1	174.8	60.5	0	0	0	0	112	H468 M470 A473 I475 D487 L488 W552 L566	H468-V485 WeakPolarHBondContact O-CG2 3.37Å; M470-V485 WeakPolarHBondContact O-CG1 3.41Å; A473-V485 HydrophobicContact CB-CB 4.43Å; A473-V485 HydrophobicContact CB-CG1 3.92Å; A473-V485 PolarHBondContact O-N 2.93Å; I475-V485 HydrophobicContact CD1-CB 4.37Å; I475-V485 HydrophobicContact CG1-CB 4.02Å; V485-D487 PolarHBondContact O-N 2.8Å; V485-L488 PolarHBondContact O-N 2.86Å; V485-W552 HydrophobicContact CG2-CH2 4.47Å; V485-W552 HydrophobicContact CG2-CZ2 3.58Å; V485-W552 PolarHBondContact O-NE1 2.9Å; V485-L566 HydrophobicContact CG1-CD2 3.79Å; V485-L566 HydrophobicContact CG2-CD1 4.37Å; V485-L566 HydrophobicContact CG2-CD2 4.23Å
486	E	95.9	Very high	95	Very high	29 Å²	29	53.8 Å²	53.8	14%	0.136	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-68.6	-19.6	177.9	66	-94.9	-144.1	0	0	114.3	K471 G472 R484 L566	K471-E486 HydrophobicContact CG-CB 4.42Å; K471-E486 VanDerWaalsContact CG-CD 3.44Å; K471-E486 HydrophobicContact CG-CG 4.2Å; K471-E486 VanDerWaalsContact CG-OE1 3.28Å; K471-E486 WeakPolarHBondContact CG-OE1 3.21Å; G472-E486 PolarHBondContact N-OE1 3.18Å; G472-E486 PolarHBondContact N-OE2 3.46Å; R484-E486 VanDerWaalsContact C-N 3.27Å; R484-E486 HydrophobicContact CB-CG 4.24Å; R484-E486 WeakPolarHBondContact CD-OE1 3.29Å; R484-E486 IonicContact NH1-OE1 2.87Å; R484-E486 PolarHBondContact NH1-OE1 2.77Å; R484-E486 PolarHBondContact O-N 2.82Å; E486-L566 HydrophobicContact CB-CD2 4.13Å
487	D	95.8	Very high	94.8	Very high	83 Å²	83	50.2 Å²	50.2	44%	0.444	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-98.7	1.2	-177.1	-62.8	-37.5	0	0	0	113.1	K483 R484 V485	K483-D487 WeakPolarHBondContact CE-O 3.47Å; K483-D487 HydrophobicContact CG-CB 4.21Å; K483-D487 PolarHBondContact NZ-O 2.83Å; R484-D487 HydrophobicContact CB-CB 4.24Å; R484-D487 WeakPolarHBondContact CB-OD2 3.42Å; R484-D487 VanDerWaalsContact CD-OD2 3.29Å; R484-D487 WeakPolarHBondContact CD-OD2 3.48Å; R484-D487 WeakPolarHBondContact CG-OD2 3.28Å; R484-D487 PolarHBondContact O-N 2.86Å; V485-D487 PolarHBondContact O-N 2.8Å
488	L	95.6	Very high	94.8	Very high	19 Å²	19	56.5 Å²	56.5	10%	0.099	29%	0.291	C	S	.	.			trans	-63.6	137.8	-180	-81.7	172.4	0	0	0	112.4	I475 L477 K483 R484 V485 D492 F546 W552	I475-L488 HydrophobicContact CB-CD1 4.43Å; I475-L488 HydrophobicContact CG1-CD1 4.01Å; I475-L488 HydrophobicContact CG2-CD1 4.41Å; L477-L488 HydrophobicContact CD2-CD2 3.82Å; K483-L488 HydrophobicContact CD-CD2 4.42Å; R484-L488 PolarHBondContact O-N 3.43Å; V485-L488 PolarHBondContact O-N 2.86Å; L488-D492 HydrophobicContact CD2-CB 4.1Å; L488-F546 HydrophobicContact CB-CE2 3.77Å; L488-F546 HydrophobicContact CB-CZ 4.4Å; L488-F546 WeakPolarHBondContact O-CE2 3.46Å; L488-F546 WeakPolarHBondContact O-CZ 3.39Å; L488-W552 HydrophobicContact CD1-CZ2 3.91Å
489	Q	95.6	Very high	94.7	Very high	106 Å²	106	59.2 Å²	59.2	50%	0.495	30%	0.303	S	S	.	.			trans	-129.2	154	-177.7	-65.1	177.1	3.8	0	0	110.2	Q491 D492 F493	Q489-Q491 PolarHBondContact O-N 2.91Å; Q489-Q491 VanDerWaalsContact O-N 3.08Å; Q489-D492 PolarHBondContact N-OD2 2.93Å; Q489-D492 VanDerWaalsContact O-CB 3.28Å; Q489-D492 WeakPolarHBondContact O-CB 3.45Å; Q489-D492 PolarHBondContact O-N 2.91Å; Q489-F493 WeakPolarHBondContact O-CD2 3.31Å
490	T	95.4	Very high	94.6	Very high	21 Å²	21	58.6 Å²	58.6	13%	0.129	30%	0.301	C	S	.	.	H	α-helix	trans	-52.2	-34.6	177.2	-56.3	0	0	0	0	113.3	D492 F493 V494 Y548 G549 I578	T490-D492 PolarHBondContact O-N 2.88Å; T490-F493 PolarHBondContact O-N 2.77Å; T490-V494 WeakPolarHBondContact O-CG2 3.38Å; T490-V494 PolarHBondContact O-N 2.84Å; T490-Y548 HydrophobicContact CG2-CD1 4.37Å; T490-Y548 HydrophobicContact CG2-CD2 3.38Å; T490-Y548 HydrophobicContact CG2-CE1 4.35Å; T490-Y548 HydrophobicContact CG2-CE2 3.36Å; T490-Y548 HydrophobicContact CG2-CG 3.9Å; T490-G549 PolarHBondContact OG1-N 3.27Å; T490-I578 HydrophobicContact CG2-CD1 4.1Å
491	Q	95.8	Very high	94.1	Very high	131 Å²	131	60.3 Å²	60.3	61%	0.612	32%	0.319	S	S	*	.	H	α-helix	trans	-63.8	-26	176.3	-65.7	-174.4	42	0	0	113.5	Q489 V494 R495	Q489-Q491 PolarHBondContact O-N 2.91Å; Q489-Q491 VanDerWaalsContact O-N 3.08Å; Q491-V494 PolarHBondContact O-N 3.08Å; Q491-R495 WeakPolarHBondContact O-CB 3.23Å; Q491-R495 VanDerWaalsContact O-CG 3.23Å; Q491-R495 WeakPolarHBondContact O-CG 3.44Å; Q491-R495 PolarHBondContact O-N 2.9Å
492	D	95	Very high	93.6	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.011	32%	0.32	C	S	.	.	H	α-helix	trans	-70.5	-35.9	178.4	-56.8	-38.3	0	0	0	111.5	L477 K483 L488 Q489 T490 R495 S496	L477-D492 HydrophobicContact CD1-CB 3.67Å; L477-D492 HydrophobicContact CD2-CB 3.88Å; L477-D492 HydrophobicContact CG-CB 4.46Å; K483-D492 VanDerWaalsContact CD-OD2 3.32Å; K483-D492 WeakPolarHBondContact CD-OD2 3.45Å; K483-D492 WeakPolarHBondContact CE-OD2 3.4Å; K483-D492 IonicContact NZ-OD1 3.74Å; K483-D492 PolarHBondContact NZ-OD1 2.52Å; K483-D492 IonicContact NZ-OD2 3.18Å; K483-D492 PolarHBondContact NZ-OD2 2.95Å; L488-D492 HydrophobicContact CD2-CB 4.1Å; Q489-D492 PolarHBondContact N-OD2 2.93Å; Q489-D492 VanDerWaalsContact O-CB 3.28Å; Q489-D492 WeakPolarHBondContact O-CB 3.45Å; Q489-D492 PolarHBondContact O-N 2.91Å; T490-D492 PolarHBondContact O-N 2.88Å; D492-R495 IonicContact OD1-CZ 2.75Å; D492-R495 IonicContact OD1-NH2 2.72Å; D492-R495 PolarHBondContact OD1-NH2 3.12Å; D492-S496 WeakPolarHBondContact O-CB 3.46Å; D492-S496 PolarHBondContact O-N 3.25Å; D492-S496 PolarHBondContact O-OG 3.44Å
493	F	94.8	Very high	93.3	Very high	26 Å²	26	54.7 Å²	54.7	11%	0.114	30%	0.299	C	S	.	.	H	α-helix	trans	-68.6	-46.1	174.4	-63.2	-100.2	0	0	0	110.6	Q489 T490 S496 A497 I505 F546 I578 I580	Q489-F493 WeakPolarHBondContact O-CD2 3.31Å; T490-F493 PolarHBondContact O-N 2.77Å; F493-S496 PolarHBondContact O-N 3.44Å; F493-A497 PolarHBondContact O-N 3.24Å; F493-A497 VanDerWaalsContact O-N 3.08Å; F493-I505 HydrophobicContact CB-CD1 4.16Å; F493-F546 HydrophobicContact CD2-CD1 4.19Å; F493-F546 HydrophobicContact CD2-CE1 4.03Å; F493-F546 HydrophobicContact CD2-CZ 4.41Å; F493-F546 AromaticContact CE2-CD1 3.57Å; F493-F546 HydrophobicContact CE2-CD1 3.57Å; F493-F546 AromaticContact CE2-CD2 3.83Å; F493-F546 HydrophobicContact CE2-CD2 3.83Å; F493-F546 AromaticContact CE2-CE1 3.55Å; F493-F546 HydrophobicContact CE2-CE1 3.55Å; F493-F546 AromaticContact CE2-CE2 3.82Å; F493-F546 HydrophobicContact CE2-CE2 3.82Å; F493-F546 AromaticContact CE2-CG 3.71Å; F493-F546 HydrophobicContact CE2-CG 3.71Å; F493-F546 AromaticContact CE2-CZ 3.67Å; F493-F546 HydrophobicContact CE2-CZ 3.67Å; F493-F546 HydrophobicContact CZ-CB 4.1Å; F493-F546 AromaticContact CZ-CD1 3.91Å; F493-F546 HydrophobicContact CZ-CD1 3.91Å; F493-F546 AromaticContact CZ-CD2 3.84Å; F493-F546 HydrophobicContact CZ-CD2 3.84Å; F493-F546 HydrophobicContact CZ-CE1 4.33Å; F493-F546 HydrophobicContact CZ-CE2 4.27Å; F493-F546 AromaticContact CZ-CG 3.64Å; F493-F546 HydrophobicContact CZ-CG 3.64Å; F493-F546 HydrophobicContact CZ-CZ 4.5Å; F493-I578 HydrophobicContact CB-CD1 4.06Å; F493-I578 HydrophobicContact CD1-CD1 4.37Å; F493-I578 HydrophobicContact CD2-CD1 4.06Å; F493-I578 HydrophobicContact CG-CD1 3.91Å; F493-I580 HydrophobicContact CB-CD1 4.37Å; F493-I580 HydrophobicContact CD1-CD1 3.92Å; F493-I580 HydrophobicContact CD1-CG1 4.08Å; F493-I580 HydrophobicContact CG-CD1 4.49Å
494	V	93.9	Very high	93	Very high	46 Å²	46	56.4 Å²	56.4	28%	0.279	31%	0.307	S	S	.	.	H	α-helix	trans	-57.3	-57.4	175.7	176	0	0	0	0	111	T490 Q491 S496 A497 E498 I505	T490-V494 WeakPolarHBondContact O-CG2 3.38Å; T490-V494 PolarHBondContact O-N 2.84Å; Q491-V494 PolarHBondContact O-N 3.08Å; V494-S496 VanDerWaalsContact C-N 3.25Å; V494-S496 PolarHBondContact O-N 3.1Å; V494-A497 PolarHBondContact O-N 3.32Å; V494-A497 VanDerWaalsContact O-N 3.14Å; V494-E498 HydrophobicContact CG1-CG 4.36Å; V494-E498 WeakPolarHBondContact CG1-OE1 3.33Å; V494-E498 WeakPolarHBondContact O-CG 3.44Å; V494-E498 PolarHBondContact O-N 3.3Å; V494-I505 HydrophobicContact CG2-CD1 4.09Å
495	R	94.1	Very high	92.8	Very high	80 Å²	80	53.2 Å²	53.2	30%	0.302	30%	0.299	S	S	.	.	H	α-helix	trans	-58.1	-36.2	178.3	-68.6	-175.9	-58	140.3	0.9	112.6	T479 E481 Q491 D492 V499	T479-R495 HydrophobicContact CG2-CB 4.12Å; E481-R495 IonicContact OE1-NH2 3.14Å; E481-R495 PolarHBondContact OE1-NH2 3.22Å; E481-R495 IonicContact OE2-CZ 3.9Å; E481-R495 VanDerWaalsContact OE2-CZ 3.27Å; E481-R495 IonicContact OE2-NH1 3.29Å; E481-R495 PolarHBondContact OE2-NH1 2.65Å; E481-R495 IonicContact OE2-NH2 2.74Å; E481-R495 PolarHBondContact OE2-NH2 2.83Å; Q491-R495 WeakPolarHBondContact O-CB 3.23Å; Q491-R495 VanDerWaalsContact O-CG 3.23Å; Q491-R495 WeakPolarHBondContact O-CG 3.44Å; Q491-R495 PolarHBondContact O-N 2.9Å; D492-R495 IonicContact OD1-CZ 2.75Å; D492-R495 IonicContact OD1-NH2 2.72Å; D492-R495 PolarHBondContact OD1-NH2 3.12Å; R495-V499 WeakPolarHBondContact O-CB 3.49Å; R495-V499 VanDerWaalsContact O-CG2 3.31Å; R495-V499 WeakPolarHBondContact O-CG2 3.43Å; R495-V499 PolarHBondContact O-N 2.88Å
496	S	94.1	Very high	92.6	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.014	31%	0.31	C	S	.	.	H	α-helix	trans	-66.7	-40.4	178.3	-66.5	0	0	0	0	112.8	A478 D492 F493 V494 S500	A478-S496 PolarHBondContact N-OG 3.23Å; D492-S496 WeakPolarHBondContact O-CB 3.46Å; D492-S496 PolarHBondContact O-N 3.25Å; D492-S496 PolarHBondContact O-OG 3.44Å; F493-S496 PolarHBondContact O-N 3.44Å; V494-S496 VanDerWaalsContact C-N 3.25Å; V494-S496 PolarHBondContact O-N 3.1Å; S496-S500 WeakPolarHBondContact O-CB 3.29Å; S496-S500 PolarHBondContact O-N 2.98Å; S496-S500 VanDerWaalsContact O-N 3.17Å
497	A	92.4	Very high	92.4	Very high	20 Å²	20	56.6 Å²	56.6	17%	0.165	32%	0.322	C	S	.	.	H	α-helix	trans	-74.6	-33.9	176.5	0	0	0	0	0	112.7	F493 V494 I505	F493-A497 PolarHBondContact O-N 3.24Å; F493-A497 VanDerWaalsContact O-N 3.08Å; V494-A497 PolarHBondContact O-N 3.32Å; V494-A497 VanDerWaalsContact O-N 3.14Å; A497-I505 HydrophobicContact CB-CD1 4.19Å; A497-I505 HydrophobicContact CB-CG1 3.78Å
498	E	92.5	Very high	92.4	Very high	145 Å²	145	53.7 Å²	53.7	68%	0.678	31%	0.308	S	S	*	.	H	α-helix	trans	-67.9	-40.5	175.4	-71.4	172.1	164.5	0	0	112.8	V494	V494-E498 HydrophobicContact CG1-CG 4.36Å; V494-E498 WeakPolarHBondContact CG1-OE1 3.33Å; V494-E498 WeakPolarHBondContact O-CG 3.44Å; V494-E498 PolarHBondContact O-N 3.3Å
499	V	92.5	Very high	92.5	Very high	95 Å²	95	55.1 Å²	55.1	58%	0.576	32%	0.318	S	S	*	.	H	α-helix	trans	-79.7	-31.5	-178.1	171.6	0	0	0	0	112.5	T479 R495	T479-V499 HydrophobicContact CG2-CB 4.33Å; T479-V499 HydrophobicContact CG2-CG2 4.1Å; R495-V499 WeakPolarHBondContact O-CB 3.49Å; R495-V499 VanDerWaalsContact O-CG2 3.31Å; R495-V499 WeakPolarHBondContact O-CG2 3.43Å; R495-V499 PolarHBondContact O-N 2.88Å
500	S	88.8	Confident	92.6	Very high	36 Å²	36	50.1 Å²	50.1	25%	0.252	29%	0.294	S	S	.	.			trans	-104.8	96.6	176.8	-75.5	0	0	0	0	111.8	A478 S496 G502 L503	A478-S500 WeakPolarHBondContact CB-OG 3.46Å; S496-S500 WeakPolarHBondContact O-CB 3.29Å; S496-S500 PolarHBondContact O-N 2.98Å; S496-S500 VanDerWaalsContact O-N 3.17Å; S500-G502 PolarHBondContact O-N 2.86Å; S500-L503 PolarHBondContact O-N 3.11Å
501	G	82.9	Confident	92.7	Very high	81 Å²	81	52.5 Å²	52.5	84%	0.835	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	20.9	178	0	0	0	0	0	117.1
502	G	85.1	Confident	92.8	Very high	34 Å²	34	49.1 Å²	49.1	35%	0.351	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.2	9.5	168.5	0	0	0	0	0	113.1	S500 Q583	S500-G502 PolarHBondContact O-N 2.86Å; G502-Q583 PolarHBondContact O-N 3.15Å
503	L	89.6	Confident	92.9	Very high	36 Å²	36	51.6 Å²	51.6	19%	0.188	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	142.6	174.7	-64.8	-179.2	0	0	0	110.1	A478 S500 I580 S581 L582	A478-L503 HydrophobicContact CB-CD1 3.59Å; S500-L503 PolarHBondContact O-N 3.11Å; L503-I580 HydrophobicContact CB-CG2 4.06Å; L503-I580 HydrophobicContact CD1-CG2 4.04Å; L503-I580 HydrophobicContact CD2-CG2 3.87Å; L503-I580 HydrophobicContact CG-CG2 4.21Å; L503-S581 WeakPolarHBondContact CA-O 3.47Å; L503-L582 HydrophobicContact CD2-CD2 3.77Å; L503-L582 HydrophobicContact CD2-CG 4.19Å
504	K	91.1	Very high	93	Very high	69 Å²	69	54.9 Å²	54.9	30%	0.3	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	151.8	172.2	63.9	-178.9	177	68.3	0	110.7	D506 I580 S581 Q583	K504-D506 IonicContact NZ-OD1 2.85Å; K504-D506 PolarHBondContact NZ-OD1 3.42Å; K504-D506 IonicContact NZ-OD2 3.84Å; K504-D506 PolarHBondContact NZ-OD2 3.5Å; K504-I580 WeakPolarHBondContact O-CA 3.41Å; K504-S581 WeakPolarHBondContact CG-OG 3.44Å; K504-S581 PolarHBondContact N-O 2.87Å; K504-S581 PolarHBondContact NZ-OG 2.95Å; K504-S581 PolarHBondContact O-N 3.14Å; K504-Q583 HydrophobicContact CB-CB 4.5Å; K504-Q583 HydrophobicContact CD-CB 4.32Å; K504-Q583 HydrophobicContact CD-CG 4.34Å; K504-Q583 HydrophobicContact CG-CB 4.36Å
505	I	91.8	Very high	93	Very high	56 Å²	56	61.6 Å²	61.6	29%	0.287	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	122.2	169.8	-56.4	177.7	0	0	0	107.8	F493 V494 A497 I578 S579 I580	F493-I505 HydrophobicContact CB-CD1 4.16Å; V494-I505 HydrophobicContact CG2-CD1 4.09Å; A497-I505 HydrophobicContact CB-CD1 4.19Å; A497-I505 HydrophobicContact CB-CG1 3.78Å; I505-I578 HydrophobicContact CG2-CB 3.96Å; I505-I578 HydrophobicContact CG2-CG2 4.05Å; I505-S579 CarbonylContact C-O 3.58Å; I505-S579 VanDerWaalsContact CA-O 3.31Å; I505-S579 WeakPolarHBondContact CA-O 3.39Å; I505-I580 HydrophobicContact CG1-CG1 4.5Å
506	D	91.4	Very high	92.9	Very high	45 Å²	45	58.8 Å²	58.8	24%	0.241	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	120.9	169	-72.5	-43.1	0	0	0	109.2	K504 I578 S579 S581	K504-D506 IonicContact NZ-OD1 2.85Å; K504-D506 PolarHBondContact NZ-OD1 3.42Å; K504-D506 IonicContact NZ-OD2 3.84Å; K504-D506 PolarHBondContact NZ-OD2 3.5Å; D506-I578 WeakPolarHBondContact O-CA 3.44Å; D506-S579 PolarHBondContact N-O 3.46Å; D506-S579 PolarHBondContact O-N 2.99Å; D506-S579 VanDerWaalsContact O-N 3.08Å; D506-S581 WeakPolarHBondContact OD2-CB 3.32Å; D506-S581 PolarHBondContact OD2-OG 2.93Å
507	S	93.2	Very high	92.8	Very high	55 Å²	55	66.3 Å²	66.3	39%	0.385	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	129.1	173.8	56.3	0	0	0	0	110.8	G529	S507-G529 PolarHBondContact O-N 3.15Å
508	S	95.5	Very high	92.6	Very high	23 Å²	23	72.3 Å²	72.3	16%	0.161	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	107.6	-179.7	-57	0	0	0	0	109.3	V527 C577	S508-V527 WeakPolarHBondContact CA-O 3.38Å; S508-C577 PolarHBondContact N-O 3.03Å; S508-C577 WeakPolarHBondContact O-CB 3.35Å; S508-C577 PolarHBondContact O-N 2.97Å
509	T	97	Very high	92.5	Very high	48 Å²	48	71.4 Å²	71.4	29%	0.294	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	128.4	179.9	-52.2	0	0	0	0	110	V511 F526 V527 D575 V576	T509-V511 PolarHBondContact O-N 2.91Å; T509-F526 CarbonylContact O-C 3.57Å; T509-F526 VanDerWaalsContact O-CA 3.29Å; T509-F526 WeakPolarHBondContact O-CA 3.28Å; T509-V527 PolarHBondContact N-O 2.83Å; T509-V527 PolarHBondContact O-N 2.78Å; T509-D575 WeakPolarHBondContact CA-O 3.26Å; T509-V576 HydrophobicContact CG2-CG2 4.34Å
510	V	97.7	Very high	92.4	Very high	1 Å²	1	69.3 Å²	69.3	1%	0.006	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	122.5	171.9	-176.7	0	0	0	0	108.9	I513 F526 L571 Q572 V573 G574 D575	V510-I513 HydrophobicContact CG1-CD1 3.95Å; V510-I513 HydrophobicContact CG1-CG1 3.61Å; V510-F526 HydrophobicContact CB-CE1 4.48Å; V510-F526 HydrophobicContact CG2-CD1 4.11Å; V510-F526 HydrophobicContact CG2-CE1 3.49Å; V510-F526 VanDerWaalsContact CG2-CE1 3.49Å; V510-F526 HydrophobicContact CG2-CZ 4.09Å; V510-L571 HydrophobicContact CG2-CD1 4.07Å; V510-L571 HydrophobicContact CG2-CD2 4.22Å; V510-L571 HydrophobicContact CG2-CG 4.19Å; V510-Q572 WeakPolarHBondContact CB-O 3.34Å; V510-V573 HydrophobicContact CG1-CG2 4.41Å; V510-G574 PolarHBondContact O-N 3.32Å; V510-D575 HydrophobicContact CG2-CB 4.29Å; V510-D575 PolarHBondContact N-O 2.83Å
511	V	97.8	Very high	92.7	Very high	72 Å²	72	72 Å²	72	44%	0.436	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-28.9	179.4	176.8	0	0	0	0	112.1	T509 H525 V527 V573	T509-V511 PolarHBondContact O-N 2.91Å; V511-H525 PolarHBondContact N-O 3.43Å; V511-V527 HydrophobicContact CG2-CB 3.83Å; V511-V527 HydrophobicContact CG2-CG2 3.57Å; V511-V573 VanDerWaalsContact O-CG1 3.23Å; V511-V573 WeakPolarHBondContact O-CG1 3.42Å
512	D	97.4	Very high	93.4	Very high	60 Å²	60	69 Å²	69	32%	0.321	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	152.2	175.6	-169.2	17.3	0	0	0	111.3	Q514 H525	D512-Q514 PolarHBondContact OD2-NE2 2.93Å; D512-H525 HydrophobicContact CB-CB 4.05Å; D512-H525 PolarHBondContact N-O 3.36Å; D512-H525 PolarHBondContact O-N 2.88Å; D512-H525 IonicContact OD2-CD2 2.81Å
513	I	97.3	Very high	94	Very high	54 Å²	54	69.3 Å²	69.3	28%	0.277	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	107.2	-177.8	-55.4	-177.7	0	0	0	107.6	V510 V522 L524 V573	V510-I513 HydrophobicContact CG1-CD1 3.95Å; V510-I513 HydrophobicContact CG1-CG1 3.61Å; I513-V522 HydrophobicContact CG2-CG1 3.75Å; I513-L524 HydrophobicContact CB-CD2 4.13Å; I513-L524 HydrophobicContact CD1-CD2 4.36Å; I513-L524 HydrophobicContact CG1-CD2 3.76Å; I513-L524 HydrophobicContact CG2-CD2 3.83Å; I513-V573 HydrophobicContact CD1-CG2 4.42Å; I513-V573 HydrophobicContact CG1-CG2 4.06Å
514	Q	96.6	Very high	94.3	Very high	95 Å²	95	67.6 Å²	67.6	44%	0.444	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	145.2	-179.6	-59	-173.4	12.8	0	0	111.2	D512 S516 V522 M523	D512-Q514 PolarHBondContact OD2-NE2 2.93Å; Q514-S516 PolarHBondContact O-N 2.83Å; Q514-V522 VanDerWaalsContact O-CG1 3.31Å; Q514-V522 WeakPolarHBondContact O-CG1 3.41Å; Q514-M523 HydrophobicContact CB-CB 4.35Å; Q514-M523 PolarHBondContact N-O 2.98Å; Q514-M523 PolarHBondContact O-N 2.82Å
515	E	93.8	Very high	94.6	Very high	187 Å²	187	66.7 Å²	66.7	87%	0.874	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.2	127.5	163.8	-63.9	-175.6	170	0	0	108.3
516	S	92.1	Very high	94.9	Very high	21 Å²	21	64.6 Å²	64.6	15%	0.147	34%	0.344	C	S	.	.			trans	-79	164.2	-177.4	80.3	0	0	0	0	111.5	Q514 W518 F521	Q514-S516 PolarHBondContact O-N 2.83Å; S516-W518 PolarHBondContact O-N 2.96Å; S516-W518 VanDerWaalsContact O-N 3.17Å; S516-W518 PolarHBondContact OG-N 3.33Å; S516-W518 VanDerWaalsContact OG-N 3.14Å; S516-W518 PolarHBondContact OG-O 2.81Å; S516-W518 VanDerWaalsContact OG-O 3.07Å; S516-F521 WeakPolarHBondContact CB-O 3.47Å; S516-F521 PolarHBondContact N-O 2.79Å; S516-F521 VanDerWaalsContact N-O 3.15Å; S516-F521 VanDerWaalsContact OG-C 3.27Å; S516-F521 VanDerWaalsContact OG-CB 3.28Å; S516-F521 WeakPolarHBondContact OG-CB 3.27Å; S516-F521 PolarHBondContact OG-O 3.49Å
517	Q	91.7	Very high	95.1	Very high	160 Å²	160	63.8 Å²	63.8	75%	0.748	34%	0.341	S	S	*	.	S	Bend	trans	-63.6	-14.3	170.9	66.6	-177.5	6.5	0	0	113.7
518	W	89.1	Confident	95	Very high	146 Å²	146	63 Å²	63	55%	0.553	33%	0.333	S	S	*	.	S	Bend	trans	-96.4	120.1	180	-60.2	107.8	0	0	0	110.9	S516 G520 F521 E538	S516-W518 PolarHBondContact O-N 2.96Å; S516-W518 VanDerWaalsContact O-N 3.17Å; S516-W518 PolarHBondContact OG-N 3.33Å; S516-W518 VanDerWaalsContact OG-N 3.14Å; S516-W518 PolarHBondContact OG-O 2.81Å; S516-W518 VanDerWaalsContact OG-O 3.07Å; W518-G520 PolarHBondContact O-N 3.28Å; W518-G520 VanDerWaalsContact O-N 3.16Å; W518-F521 HydrophobicContact CB-CB 4.28Å; W518-F521 HydrophobicContact CB-CD2 4.12Å; W518-F521 HydrophobicContact CB-CG 4.49Å; W518-F521 PolarHBondContact O-N 2.92Å; W518-E538 VanDerWaalsContact CD1-OE1 3.32Å; W518-E538 PolarHBondContact NE1-OE2 3.39Å
519	P	90.8	Very high	94	Very high	126 Å²	126	63.7 Å²	63.7	82%	0.818	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	122.2	179.3	-27.9	35.9	0	0	0	112.4
520	G	90.9	Very high	93.1	Very high	51 Å²	51	69.8 Å²	69.8	53%	0.526	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.2	8	-179.2	0	0	0	0	0	115.7	W518 P541	W518-G520 PolarHBondContact O-N 3.28Å; W518-G520 VanDerWaalsContact O-N 3.16Å; G520-P541 WeakPolarHBondContact O-CD 3.33Å
521	F	95.1	Very high	92.2	Very high	91 Å²	91	77.3 Å²	77.3	40%	0.399	41%	0.405	S	S	.	.			trans	-121.7	151	174	-70.3	-101.4	0	0	0	112.3	S516 W518 V539 P540	S516-F521 WeakPolarHBondContact CB-O 3.47Å; S516-F521 PolarHBondContact N-O 2.79Å; S516-F521 VanDerWaalsContact N-O 3.15Å; S516-F521 VanDerWaalsContact OG-C 3.27Å; S516-F521 VanDerWaalsContact OG-CB 3.28Å; S516-F521 WeakPolarHBondContact OG-CB 3.27Å; S516-F521 PolarHBondContact OG-O 3.49Å; W518-F521 HydrophobicContact CB-CB 4.28Å; W518-F521 HydrophobicContact CB-CD2 4.12Å; W518-F521 HydrophobicContact CB-CG 4.49Å; W518-F521 PolarHBondContact O-N 2.92Å; F521-V539 CarbonylContact C-O 3.6Å; F521-V539 WeakPolarHBondContact CA-O 3.5Å; F521-P540 HydrophobicContact CD1-CG 4.35Å; F521-P540 HydrophobicContact CE1-CG 3.96Å
522	V	96.8	Very high	91.8	Very high	18 Å²	18	80.7 Å²	80.7	11%	0.109	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132	176.2	-179.8	0	0	0	0	108.3	I513 Q514 L524 E538 V539 P541 C555	I513-V522 HydrophobicContact CG2-CG1 3.75Å; Q514-V522 VanDerWaalsContact O-CG1 3.31Å; Q514-V522 WeakPolarHBondContact O-CG1 3.41Å; V522-L524 HydrophobicContact CG1-CD2 4.03Å; V522-L524 HydrophobicContact CG1-CG 4.38Å; V522-E538 WeakPolarHBondContact O-CA 3.38Å; V522-V539 PolarHBondContact N-O 2.98Å; V522-V539 PolarHBondContact O-N 3.1Å; V522-P541 HydrophobicContact CG2-CB 3.82Å; V522-C555 HydrophobicContact CG2-CB 4.31Å
523	M	97	Very high	91.6	Very high	41 Å²	41	81 Å²	81	20%	0.202	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	119.4	171.2	-179.8	69.2	76.1	0	0	108.8	Q514 I537 E538	Q514-M523 HydrophobicContact CB-CB 4.35Å; Q514-M523 PolarHBondContact N-O 2.98Å; Q514-M523 PolarHBondContact O-N 2.82Å; M523-I537 WeakPolarHBondContact CA-O 3.16Å; M523-E538 HydrophobicContact CE-CG 3.37Å; M523-E538 WeakPolarHBondContact CE-OE1 3.38Å; M523-E538 HydrophobicContact SD-CG 3.79Å
524	L	97.2	Very high	91.5	Very high	0 Å²	0	86.6 Å²	86.6	0%	0	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	125.6	176.2	-64.7	177.2	0	0	0	109.8	I513 V522 F526 S536 I537 V539 F545 L571	I513-L524 HydrophobicContact CB-CD2 4.13Å; I513-L524 HydrophobicContact CD1-CD2 4.36Å; I513-L524 HydrophobicContact CG1-CD2 3.76Å; I513-L524 HydrophobicContact CG2-CD2 3.83Å; V522-L524 HydrophobicContact CG1-CD2 4.03Å; V522-L524 HydrophobicContact CG1-CG 4.38Å; L524-F526 HydrophobicContact CB-CD2 4.13Å; L524-F526 HydrophobicContact CB-CE2 3.49Å; L524-F526 VanDerWaalsContact CB-CE2 3.49Å; L524-F526 HydrophobicContact CB-CZ 4.19Å; L524-F526 HydrophobicContact CD1-CE2 3.99Å; L524-F526 HydrophobicContact CD1-CZ 4.04Å; L524-F526 HydrophobicContact CG-CE2 4.39Å; L524-S536 WeakPolarHBondContact O-CA 3.39Å; L524-I537 HydrophobicContact CB-CG1 4.06Å; L524-I537 PolarHBondContact N-O 3.06Å; L524-I537 PolarHBondContact O-N 2.87Å; L524-V539 HydrophobicContact CD1-CG2 3.61Å; L524-V539 HydrophobicContact CG-CG2 4.15Å; L524-F545 HydrophobicContact CD1-CE1 4.39Å; L524-F545 HydrophobicContact CD1-CE2 3.66Å; L524-F545 HydrophobicContact CD1-CZ 3.54Å; L524-L571 HydrophobicContact CD1-CD2 4.01Å; L524-L571 HydrophobicContact CD2-CD2 4.18Å
525	H	97.3	Very high	91.4	Very high	50 Å²	50	85 Å²	85	23%	0.231	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	120.1	172.8	-62.7	-70	0	0	0	110	V511 D512 S536	V511-H525 PolarHBondContact N-O 3.43Å; D512-H525 HydrophobicContact CB-CB 4.05Å; D512-H525 PolarHBondContact N-O 3.36Å; D512-H525 PolarHBondContact O-N 2.88Å; D512-H525 IonicContact OD2-CD2 2.81Å; H525-S536 PolarHBondContact CE1-OG 3.23Å; H525-S536 VanDerWaalsContact CE1-OG 3.26Å; H525-S536 WeakPolarHBondContact ND1-CB 3.46Å; H525-S536 PolarHBondContact ND1-OG 3.48Å
526	F	97.1	Very high	91.5	Very high	13 Å²	13	79.3 Å²	79.3	6%	0.057	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	151.6	178.7	-70.2	-85.8	0	0	0	111.6	T509 V510 L524 V528 K534 V535 I537 F545 C577	T509-F526 CarbonylContact O-C 3.57Å; T509-F526 VanDerWaalsContact O-CA 3.29Å; T509-F526 WeakPolarHBondContact O-CA 3.28Å; V510-F526 HydrophobicContact CB-CE1 4.48Å; V510-F526 HydrophobicContact CG2-CD1 4.11Å; V510-F526 HydrophobicContact CG2-CE1 3.49Å; V510-F526 VanDerWaalsContact CG2-CE1 3.49Å; V510-F526 HydrophobicContact CG2-CZ 4.09Å; L524-F526 HydrophobicContact CB-CD2 4.13Å; L524-F526 HydrophobicContact CB-CE2 3.49Å; L524-F526 VanDerWaalsContact CB-CE2 3.49Å; L524-F526 HydrophobicContact CB-CZ 4.19Å; L524-F526 HydrophobicContact CD1-CE2 3.99Å; L524-F526 HydrophobicContact CD1-CZ 4.04Å; L524-F526 HydrophobicContact CG-CE2 4.39Å; F526-V528 HydrophobicContact CB-CG2 4.07Å; F526-K534 WeakPolarHBondContact O-CA 3.25Å; F526-V535 PolarHBondContact N-O 3.02Å; F526-V535 PolarHBondContact O-N 3.21Å; F526-I537 HydrophobicContact CD2-CD1 4.27Å; F526-I537 HydrophobicContact CD2-CG1 4.21Å; F526-I537 HydrophobicContact CE2-CD1 3.65Å; F526-I537 HydrophobicContact CE2-CG1 3.83Å; F526-F545 HydrophobicContact CZ-CD1 4.36Å; F526-F545 HydrophobicContact CZ-CE1 4.03Å; F526-C577 HydrophobicContact CE1-CB 4.06Å
527	V	96.3	Very high	91.6	Very high	27 Å²	27	81.2 Å²	81.2	16%	0.164	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	120.3	161.5	161.9	0	0	0	0	108.2	S508 T509 V511 Q532 S533 K534	S508-V527 WeakPolarHBondContact CA-O 3.38Å; T509-V527 PolarHBondContact N-O 2.83Å; T509-V527 PolarHBondContact O-N 2.78Å; V511-V527 HydrophobicContact CG2-CB 3.83Å; V511-V527 HydrophobicContact CG2-CG2 3.57Å; V527-Q532 HydrophobicContact CG1-CB 3.69Å; V527-Q532 HydrophobicContact CG1-CG 4.05Å; V527-S533 WeakPolarHBondContact CA-O 3.22Å; V527-K534 HydrophobicContact CG2-CG 3.92Å
528	V	90.6	Very high	91.9	Very high	38 Å²	38	77.1 Å²	77.1	23%	0.23	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.8	-167.5	-171.3	0	0	0	0	111.2	F526 S533 V535	F526-V528 HydrophobicContact CB-CG2 4.07Å; V528-S533 PolarHBondContact N-O 3.27Å; V528-S533 PolarHBondContact O-N 2.86Å; V528-S533 VanDerWaalsContact O-N 3.1Å; V528-V535 HydrophobicContact CG2-CB 4.18Å; V528-V535 HydrophobicContact CG2-CG2 3.8Å
529	G	75.6	Confident	92.2	Very high	38 Å²	38	70.9 Å²	70.9	39%	0.392	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	-177	172	0	0	0	0	0	116.2	S507 Q531 Q532	S507-G529 PolarHBondContact O-N 3.15Å; G529-Q531 PolarHBondContact O-N 3.07Å; G529-Q532 PolarHBondContact O-N 3.49Å; G529-Q532 VanDerWaalsContact O-N 3.11Å
530	E	76.8	Confident	92.4	Very high	176 Å²	176	67 Å²	67	82%	0.822	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-31.8	-177.8	72.6	-170.4	173.6	0	0	113.4	Q532	E530-Q532 PolarHBondContact O-N 3.05Å
531	Q	79.9	Confident	92.6	Very high	160 Å²	160	65.6 Å²	65.6	75%	0.748	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	0.4	-177.3	-58.2	176.6	21	0	0	112.4	G529 S533	G529-Q531 PolarHBondContact O-N 3.07Å; Q531-S533 PolarHBondContact O-N 3.43Å
532	Q	88.3	Confident	92.7	Very high	142 Å²	142	62.8 Å²	62.8	66%	0.664	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	40.5	-179	-59.7	-170.4	2.9	0	0	113.8	V527 G529 E530 K534	V527-Q532 HydrophobicContact CG1-CB 3.69Å; V527-Q532 HydrophobicContact CG1-CG 4.05Å; G529-Q532 PolarHBondContact O-N 3.49Å; G529-Q532 VanDerWaalsContact O-N 3.11Å; E530-Q532 PolarHBondContact O-N 3.05Å; Q532-K534 PolarHBondContact O-N 3.28Å
533	S	93.4	Very high	92.6	Very high	66 Å²	66	64.6 Å²	64.6	46%	0.462	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	125.3	-176.6	-171.6	0	0	0	0	110.6	V527 V528 Q531	V527-S533 WeakPolarHBondContact CA-O 3.22Å; V528-S533 PolarHBondContact N-O 3.27Å; V528-S533 PolarHBondContact O-N 2.86Å; V528-S533 VanDerWaalsContact O-N 3.1Å; Q531-S533 PolarHBondContact O-N 3.43Å
534	K	94.4	Very high	92.6	Very high	173 Å²	173	62.8 Å²	62.8	75%	0.752	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	119.9	179.1	-70	-174.5	178.3	-173.4	0	110.2	F526 V527 Q532	F526-K534 WeakPolarHBondContact O-CA 3.25Å; V527-K534 HydrophobicContact CG2-CG 3.92Å; Q532-K534 PolarHBondContact O-N 3.28Å
535	V	95.3	Very high	92.6	Very high	60 Å²	60	64 Å²	64	36%	0.364	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	135	-179	-177.9	0	0	0	0	109	F526 V528 I537	F526-V535 PolarHBondContact N-O 3.02Å; F526-V535 PolarHBondContact O-N 3.21Å; V528-V535 HydrophobicContact CG2-CB 4.18Å; V528-V535 HydrophobicContact CG2-CG2 3.8Å; V535-I537 HydrophobicContact CG1-CG2 4.23Å
536	S	95.6	Very high	92.6	Very high	69 Å²	69	62 Å²	62	48%	0.483	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132	177.2	-46.8	0	0	0	0	109	L524 H525	L524-S536 WeakPolarHBondContact O-CA 3.39Å; H525-S536 PolarHBondContact CE1-OG 3.23Å; H525-S536 VanDerWaalsContact CE1-OG 3.26Å; H525-S536 WeakPolarHBondContact ND1-CB 3.46Å; H525-S536 PolarHBondContact ND1-OG 3.48Å
537	I	95.4	Very high	92.6	Very high	60 Å²	60	61.6 Å²	61.6	31%	0.308	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	141.2	174.6	66.5	175.3	0	0	0	111.2	M523 L524 F526 V535 V539 F545	M523-I537 WeakPolarHBondContact CA-O 3.16Å; L524-I537 HydrophobicContact CB-CG1 4.06Å; L524-I537 PolarHBondContact N-O 3.06Å; L524-I537 PolarHBondContact O-N 2.87Å; F526-I537 HydrophobicContact CD2-CD1 4.27Å; F526-I537 HydrophobicContact CD2-CG1 4.21Å; F526-I537 HydrophobicContact CE2-CD1 3.65Å; F526-I537 HydrophobicContact CE2-CG1 3.83Å; V535-I537 HydrophobicContact CG1-CG2 4.23Å; I537-V539 HydrophobicContact CD1-CG1 3.85Å; I537-V539 HydrophobicContact CG1-CG1 4.12Å; I537-F545 HydrophobicContact CD1-CE1 4.18Å; I537-F545 HydrophobicContact CD1-CZ 4.22Å
538	E	96.8	Very high	92.6	Very high	75 Å²	75	67.1 Å²	67.1	35%	0.35	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124.4	169.7	-64.6	-176.1	137.6	0	0	109.2	W518 V522 M523	W518-E538 VanDerWaalsContact CD1-OE1 3.32Å; W518-E538 PolarHBondContact NE1-OE2 3.39Å; V522-E538 WeakPolarHBondContact O-CA 3.38Å; M523-E538 HydrophobicContact CE-CG 3.37Å; M523-E538 WeakPolarHBondContact CE-OE1 3.38Å; M523-E538 HydrophobicContact SD-CG 3.79Å
539	V	95.3	Very high	92.7	Very high	14 Å²	14	68.6 Å²	68.6	9%	0.085	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	151.9	-178.1	-66.1	0	0	0	0	111.9	F521 V522 L524 I537 H543 F545	F521-V539 CarbonylContact C-O 3.6Å; F521-V539 WeakPolarHBondContact CA-O 3.5Å; V522-V539 PolarHBondContact N-O 2.98Å; V522-V539 PolarHBondContact O-N 3.1Å; L524-V539 HydrophobicContact CD1-CG2 3.61Å; L524-V539 HydrophobicContact CG-CG2 4.15Å; I537-V539 HydrophobicContact CD1-CG1 3.85Å; I537-V539 HydrophobicContact CG1-CG1 4.12Å; V539-H543 HydrophobicContact CB-CB 4.13Å; V539-H543 HydrophobicContact CG2-CB 4.45Å; V539-F545 HydrophobicContact CG1-CZ 4.25Å; V539-F545 HydrophobicContact CG2-CE2 4.2Å; V539-F545 HydrophobicContact CG2-CZ 4.06Å
540	P	95.4	Very high	93.7	Very high	45 Å²	45	69.7 Å²	69.7	29%	0.292	36%	0.363	S	S	.	.			trans	-59	142.6	167.6	-22.8	34.5	0	0	0	110.9	F521 E542 H543	F521-P540 HydrophobicContact CD1-CG 4.35Å; F521-P540 HydrophobicContact CE1-CG 3.96Å; P540-E542 HydrophobicContact CB-CG 4.05Å; P540-E542 PolarHBondContact O-N 2.85Å; P540-E542 VanDerWaalsContact O-N 3.16Å; P540-H543 WeakPolarHBondContact O-CB 3.48Å; P540-H543 PolarHBondContact O-N 2.67Å
541	P	96	Very high	94.6	Very high	22 Å²	22	62 Å²	62	14%	0.143	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-23	-175.6	23.5	-32.4	0	0	0	113.7	G520 V522 H543 C555 S556	G520-P541 WeakPolarHBondContact O-CD 3.33Å; V522-P541 HydrophobicContact CG2-CB 3.82Å; P541-H543 VanDerWaalsContact C-N 3.29Å; P541-C555 HydrophobicContact CB-CB 4.12Å; P541-C555 PolarHBondContact O-N 3.39Å; P541-S556 PolarHBondContact O-N 3.26Å
542	E	95.8	Very high	95.4	Very high	31 Å²	31	55.5 Å²	55.5	15%	0.145	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-9.6	171.1	54	-95.6	-138.4	0	0	114.9	P540 P544 R559 T560 L563 F564	P540-E542 HydrophobicContact CB-CG 4.05Å; P540-E542 PolarHBondContact O-N 2.85Å; P540-E542 VanDerWaalsContact O-N 3.16Å; E542-P544 WeakPolarHBondContact O-CD 3.37Å; E542-R559 HydrophobicContact CB-CB 3.85Å; E542-R559 IonicContact OE1-CZ 3.27Å; E542-R559 IonicContact OE1-NE 2.89Å; E542-R559 IonicContact OE1-NH2 3.12Å; E542-R559 PolarHBondContact OE1-NH2 3.2Å; E542-R559 IonicContact OE2-CZ 2.75Å; E542-R559 IonicContact OE2-NE 2.66Å; E542-R559 PolarHBondContact OE2-NE 2.9Å; E542-R559 IonicContact OE2-NH2 2.67Å; E542-R559 PolarHBondContact OE2-NH2 2.67Å; E542-T560 VanDerWaalsContact C-OG1 3.27Å; E542-T560 VanDerWaalsContact CA-OG1 3.3Å; E542-T560 WeakPolarHBondContact CA-OG1 3.49Å; E542-T560 WeakPolarHBondContact O-CB 3.31Å; E542-T560 VanDerWaalsContact O-CG2 3.32Å; E542-T560 WeakPolarHBondContact O-CG2 3.42Å; E542-T560 PolarHBondContact O-OG1 3.1Å; E542-L563 HydrophobicContact CB-CD1 3.86Å; E542-L563 HydrophobicContact CG-CD1 3.63Å; E542-F564 HydrophobicContact CB-CE2 4.5Å; E542-F564 HydrophobicContact CG-CE2 4.5Å
543	H	95.8	Very high	95.9	Very high	57 Å²	57	48.8 Å²	48.8	26%	0.264	27%	0.268	S	S	.	.			trans	-61.6	122.5	-174.7	-173.2	-79.1	0	0	0	111.2	V539 P540 P541 F545 S554	V539-H543 HydrophobicContact CB-CB 4.13Å; V539-H543 HydrophobicContact CG2-CB 4.45Å; P540-H543 WeakPolarHBondContact O-CB 3.48Å; P540-H543 PolarHBondContact O-N 2.67Å; P541-H543 VanDerWaalsContact C-N 3.29Å; H543-F545 HydrophobicContact CB-CE2 4.17Å; H543-F545 AromaticContact ND1-CD2 3.84Å; H543-F545 AromaticContact ND1-CE1 3.93Å; H543-F545 AromaticContact ND1-CE2 3.37Å; H543-F545 WeakPolarHBondContact ND1-CE2 3.45Å; H543-F545 AromaticContact ND1-CZ 3.42Å; H543-F545 WeakPolarHBondContact ND1-CZ 3.44Å; H543-F545 WeakPolarHBondContact O-CD2 3.36Å; H543-F545 WeakPolarHBondContact O-CE2 3.14Å; H543-S554 VanDerWaalsContact O-CB 3.26Å; H543-S554 WeakPolarHBondContact O-CB 3.32Å
544	P	96.8	Very high	96.1	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.019	25%	0.246	C	C	.	.			trans	-79.7	137.4	-179.4	31.8	-33.5	0	0	0	111.7	F469 E542 W552 T560 L566	F469-P544 HydrophobicContact CB-CG 4.03Å; F469-P544 HydrophobicContact CD1-CG 3.66Å; F469-P544 HydrophobicContact CD2-CG 3.59Å; F469-P544 HydrophobicContact CE1-CG 3.94Å; F469-P544 HydrophobicContact CE2-CG 3.88Å; F469-P544 HydrophobicContact CG-CG 3.49Å; F469-P544 VanDerWaalsContact CG-CG 3.49Å; F469-P544 HydrophobicContact CZ-CG 4.05Å; E542-P544 WeakPolarHBondContact O-CD 3.37Å; P544-W552 HydrophobicContact CB-CE3 3.85Å; P544-W552 HydrophobicContact CB-CZ3 4.17Å; P544-T560 HydrophobicContact CB-CG2 4.15Å; P544-L566 HydrophobicContact CB-CD1 4.49Å
545	F	97.1	Very high	96.2	Very high	26 Å²	26	38.8 Å²	38.8	11%	0.114	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	146.7	170.7	-64.5	-92.5	0	0	0	109.2	L524 F526 I537 V539 H543 W552 S553 L571	L524-F545 HydrophobicContact CD1-CE1 4.39Å; L524-F545 HydrophobicContact CD1-CE2 3.66Å; L524-F545 HydrophobicContact CD1-CZ 3.54Å; F526-F545 HydrophobicContact CZ-CD1 4.36Å; F526-F545 HydrophobicContact CZ-CE1 4.03Å; I537-F545 HydrophobicContact CD1-CE1 4.18Å; I537-F545 HydrophobicContact CD1-CZ 4.22Å; V539-F545 HydrophobicContact CG1-CZ 4.25Å; V539-F545 HydrophobicContact CG2-CE2 4.2Å; V539-F545 HydrophobicContact CG2-CZ 4.06Å; H543-F545 HydrophobicContact CB-CE2 4.17Å; H543-F545 AromaticContact ND1-CD2 3.84Å; H543-F545 AromaticContact ND1-CE1 3.93Å; H543-F545 AromaticContact ND1-CE2 3.37Å; H543-F545 WeakPolarHBondContact ND1-CE2 3.45Å; H543-F545 AromaticContact ND1-CZ 3.42Å; H543-F545 WeakPolarHBondContact ND1-CZ 3.44Å; H543-F545 WeakPolarHBondContact O-CD2 3.36Å; H543-F545 WeakPolarHBondContact O-CE2 3.14Å; F545-W552 CarbonylContact O-C 3.49Å; F545-W552 WeakPolarHBondContact O-CA 3.48Å; F545-S553 PolarHBondContact N-O 3.14Å; F545-S553 PolarHBondContact O-N 2.84Å; F545-L571 HydrophobicContact CD2-CD2 4.07Å; F545-L571 HydrophobicContact CE2-CD2 4.41Å
546	F	97.4	Very high	96.3	Very high	8 Å²	8	37.7 Å²	37.7	4%	0.035	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	112.4	175.4	-157.9	-80	0	0	0	109.9	L488 F493 W552 C577 I578	L488-F546 HydrophobicContact CB-CE2 3.77Å; L488-F546 HydrophobicContact CB-CZ 4.4Å; L488-F546 WeakPolarHBondContact O-CE2 3.46Å; L488-F546 WeakPolarHBondContact O-CZ 3.39Å; F493-F546 HydrophobicContact CD2-CD1 4.19Å; F493-F546 HydrophobicContact CD2-CE1 4.03Å; F493-F546 HydrophobicContact CD2-CZ 4.41Å; F493-F546 AromaticContact CE2-CD1 3.57Å; F493-F546 HydrophobicContact CE2-CD1 3.57Å; F493-F546 AromaticContact CE2-CD2 3.83Å; F493-F546 HydrophobicContact CE2-CD2 3.83Å; F493-F546 AromaticContact CE2-CE1 3.55Å; F493-F546 HydrophobicContact CE2-CE1 3.55Å; F493-F546 AromaticContact CE2-CE2 3.82Å; F493-F546 HydrophobicContact CE2-CE2 3.82Å; F493-F546 AromaticContact CE2-CG 3.71Å; F493-F546 HydrophobicContact CE2-CG 3.71Å; F493-F546 AromaticContact CE2-CZ 3.67Å; F493-F546 HydrophobicContact CE2-CZ 3.67Å; F493-F546 HydrophobicContact CZ-CB 4.1Å; F493-F546 AromaticContact CZ-CD1 3.91Å; F493-F546 HydrophobicContact CZ-CD1 3.91Å; F493-F546 AromaticContact CZ-CD2 3.84Å; F493-F546 HydrophobicContact CZ-CD2 3.84Å; F493-F546 HydrophobicContact CZ-CE1 4.33Å; F493-F546 HydrophobicContact CZ-CE2 4.27Å; F493-F546 AromaticContact CZ-CG 3.64Å; F493-F546 HydrophobicContact CZ-CG 3.64Å; F493-F546 HydrophobicContact CZ-CZ 4.5Å; F546-W552 HydrophobicContact CB-CE3 4.24Å; F546-W552 HydrophobicContact CB-CH2 4.43Å; F546-W552 HydrophobicContact CB-CZ3 4.04Å; F546-W552 AromaticContact CD2-CD2 3.78Å; F546-W552 HydrophobicContact CD2-CD2 3.78Å; F546-W552 AromaticContact CD2-CE2 3.69Å; F546-W552 HydrophobicContact CD2-CE3 4.01Å; F546-W552 HydrophobicContact CD2-CG 4.31Å; F546-W552 HydrophobicContact CD2-CH2 4.1Å; F546-W552 AromaticContact CD2-CZ2 3.86Å; F546-W552 HydrophobicContact CD2-CZ2 3.86Å; F546-W552 HydrophobicContact CD2-CZ3 4.18Å; F546-W552 HydrophobicContact CE2-CD2 4.4Å; F546-W552 HydrophobicContact CE2-CZ2 4.5Å; F546-C577 CarbonylContact O-C 3.58Å; F546-C577 WeakPolarHBondContact O-CA 3.48Å; F546-I578 HydrophobicContact CD1-CD1 3.9Å; F546-I578 HydrophobicContact CD1-CG1 3.84Å; F546-I578 HydrophobicContact CE1-CD1 4.32Å; F546-I578 PolarHBondContact O-N 2.92Å
547	V	97.6	Very high	96.4	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.018	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	134.7	-177.7	177.7	0	0	0	0	110.4	G549 Q550 G551 L571 D575 V576	V547-G549 PolarHBondContact O-N 3.18Å; V547-Q550 HydrophobicContact CB-CB 4.06Å; V547-Q550 HydrophobicContact CG1-CB 3.91Å; V547-Q550 PolarHBondContact O-N 2.78Å; V547-G551 PolarHBondContact N-O 3.12Å; V547-G551 PolarHBondContact O-N 2.97Å; V547-L571 HydrophobicContact CG2-CD1 3.74Å; V547-D575 HydrophobicContact CG1-CB 3.87Å; V547-D575 HydrophobicContact CG2-CB 4.07Å; V547-V576 WeakPolarHBondContact CA-O 3.36Å
548	Y	95.3	Very high	96.5	Very high	144 Å²	144	35.1 Å²	35.1	57%	0.565	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	124.6	179	-170.7	-79.3	0	0	0	111.2	T490 Q550 V576 I578	T490-Y548 HydrophobicContact CG2-CD1 4.37Å; T490-Y548 HydrophobicContact CG2-CD2 3.38Å; T490-Y548 HydrophobicContact CG2-CE1 4.35Å; T490-Y548 HydrophobicContact CG2-CE2 3.36Å; T490-Y548 HydrophobicContact CG2-CG 3.9Å; Y548-Q550 PolarHBondContact O-N 2.94Å; Y548-V576 PolarHBondContact N-O 3.04Å; Y548-I578 HydrophobicContact CD2-CD1 4.43Å; Y548-I578 HydrophobicContact CD2-CG2 4.25Å
549	G	93.1	Very high	96.4	Very high	68 Å²	68	36.8 Å²	36.8	70%	0.701	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.9	-10.6	-179.7	0	0	0	0	0	115.9	T490 V547	T490-G549 PolarHBondContact OG1-N 3.27Å; V547-G549 PolarHBondContact O-N 3.18Å
550	Q	95.6	Very high	96.4	Very high	62 Å²	62	36.1 Å²	36.1	29%	0.29	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-24	-175.4	179.8	171.4	-54.9	0	0	113.1	V547 Y548 S553 H569	V547-Q550 HydrophobicContact CB-CB 4.06Å; V547-Q550 HydrophobicContact CG1-CB 3.91Å; V547-Q550 PolarHBondContact O-N 2.78Å; Y548-Q550 PolarHBondContact O-N 2.94Å; Q550-S553 PolarHBondContact NE2-OG 2.83Å; Q550-H569 HydrophobicContact CG-CB 4.05Å; Q550-H569 PolarHBondContact O-CE1 3.07Å; Q550-H569 PolarHBondContact O-ND1 3.05Å; Q550-H569 VanDerWaalsContact O-ND1 3.12Å
551	G	96.3	Very high	96.5	Very high	13 Å²	13	37.1 Å²	37.1	13%	0.134	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	76.5	-150.7	-177.7	0	0	0	0	0	112.9	V547 S553	V547-G551 PolarHBondContact N-O 3.12Å; V547-G551 PolarHBondContact O-N 2.97Å; G551-S553 PolarHBondContact O-N 2.74Å; G551-S553 PolarHBondContact O-OG 3.44Å
552	W	97.6	Very high	96.4	Very high	25 Å²	25	43.5 Å²	43.5	10%	0.095	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	129.3	-175.7	-66	116.3	0	0	0	112.6	F469 V485 L488 P544 F545 F546 L566 P567 C568 H569	F469-W552 AromaticContact CD1-CH2 3.98Å; F469-W552 HydrophobicContact CD1-CH2 3.98Å; F469-W552 HydrophobicContact CD1-CZ3 4.19Å; F469-W552 AromaticContact CE1-CH2 3.74Å; F469-W552 HydrophobicContact CE1-CH2 3.74Å; F469-W552 AromaticContact CE1-CZ3 3.86Å; F469-W552 HydrophobicContact CE1-CZ3 3.86Å; V485-W552 HydrophobicContact CG2-CH2 4.47Å; V485-W552 HydrophobicContact CG2-CZ2 3.58Å; V485-W552 PolarHBondContact O-NE1 2.9Å; L488-W552 HydrophobicContact CD1-CZ2 3.91Å; P544-W552 HydrophobicContact CB-CE3 3.85Å; P544-W552 HydrophobicContact CB-CZ3 4.17Å; F545-W552 CarbonylContact O-C 3.49Å; F545-W552 WeakPolarHBondContact O-CA 3.48Å; F546-W552 HydrophobicContact CB-CE3 4.24Å; F546-W552 HydrophobicContact CB-CH2 4.43Å; F546-W552 HydrophobicContact CB-CZ3 4.04Å; F546-W552 AromaticContact CD2-CD2 3.78Å; F546-W552 HydrophobicContact CD2-CD2 3.78Å; F546-W552 AromaticContact CD2-CE2 3.69Å; F546-W552 HydrophobicContact CD2-CE3 4.01Å; F546-W552 HydrophobicContact CD2-CG 4.31Å; F546-W552 HydrophobicContact CD2-CH2 4.1Å; F546-W552 AromaticContact CD2-CZ2 3.86Å; F546-W552 HydrophobicContact CD2-CZ2 3.86Å; F546-W552 HydrophobicContact CD2-CZ3 4.18Å; F546-W552 HydrophobicContact CE2-CD2 4.4Å; F546-W552 HydrophobicContact CE2-CZ2 4.5Å; W552-L566 HydrophobicContact CD2-CD1 4.2Å; W552-L566 HydrophobicContact CG-CD1 4.28Å; W552-P567 WeakPolarHBondContact CB-O 3.03Å; W552-C568 WeakPolarHBondContact O-CA 3.39Å; W552-H569 PolarHBondContact O-N 3.47Å; W552-H569 PolarHBondContact O-ND1 3.16Å
553	S	98.1	Very high	96.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	149.6	-179	-53.3	0	0	0	0	110.9	F545 Q550 G551 H569	F545-S553 PolarHBondContact N-O 3.14Å; F545-S553 PolarHBondContact O-N 2.84Å; Q550-S553 PolarHBondContact NE2-OG 2.83Å; G551-S553 PolarHBondContact O-N 2.74Å; G551-S553 PolarHBondContact O-OG 3.44Å; S553-H569 CarbonylContact C-O 3.55Å; S553-H569 WeakPolarHBondContact CA-O 3.43Å
554	S	97.8	Very high	96.3	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	169	176.5	69.6	0	0	0	0	112.2	H543 P557 T560 H569 R570 L571	H543-S554 VanDerWaalsContact O-CB 3.26Å; H543-S554 WeakPolarHBondContact O-CB 3.32Å; S554-P557 WeakPolarHBondContact OG-CA 3.1Å; S554-T560 VanDerWaalsContact CB-OG1 3.26Å; S554-T560 WeakPolarHBondContact CB-OG1 3.37Å; S554-T560 PolarHBondContact OG-OG1 2.82Å; S554-H569 PolarHBondContact N-O 2.92Å; S554-R570 WeakPolarHBondContact O-CA 3.45Å; S554-L571 PolarHBondContact O-N 3.17Å
555	C	96.9	Very high	96.2	Very high	29 Å²	29	45.1 Å²	45.1	20%	0.196	26%	0.258	C	S	.	.	S	Bend	trans	-69.9	-33.4	178.3	-57.4	0	0	0	0	112	V522 P541	V522-C555 HydrophobicContact CG2-CB 4.31Å; P541-C555 HydrophobicContact CB-CB 4.12Å; P541-C555 PolarHBondContact O-N 3.39Å
556	S	96.8	Very high	96.1	Very high	38 Å²	38	43.9 Å²	43.9	27%	0.266	25%	0.253	S	S	.	.			trans	-126.6	83.4	174.5	-167.6	0	0	0	0	111.7	P541 G558 R559 T560	P541-S556 PolarHBondContact O-N 3.26Å; S556-G558 VanDerWaalsContact C-N 3.25Å; S556-G558 PolarHBondContact O-N 2.94Å; S556-R559 PolarHBondContact O-N 3.34Å; S556-R559 WeakPolarHBondContact OG-CD 3.28Å; S556-T560 PolarHBondContact O-N 2.85Å; S556-T560 VanDerWaalsContact O-N 3.07Å; S556-T560 PolarHBondContact O-OG1 2.89Å
557	P	97.1	Very high	95.9	Very high	21 Å²	21	47.4 Å²	47.4	14%	0.136	28%	0.276	C	S	.	.	H	α-helix	trans	-60.7	-32.6	-175	-27.1	37.1	0	0	0	113.8	S554 R559 T560 T561 C568 H569 R570	S554-P557 WeakPolarHBondContact OG-CA 3.1Å; P557-R559 PolarHBondContact O-N 3.1Å; P557-T560 PolarHBondContact O-N 2.81Å; P557-T561 WeakPolarHBondContact O-CB 3.47Å; P557-T561 PolarHBondContact O-N 2.83Å; P557-T561 PolarHBondContact O-OG1 3.38Å; P557-T561 VanDerWaalsContact O-OG1 3.11Å; P557-C568 HydrophobicContact CB-CB 4.07Å; P557-C568 WeakPolarHBondContact CB-O 3.39Å; P557-H569 VanDerWaalsContact CG-O 3.27Å; P557-H569 WeakPolarHBondContact CG-O 3.26Å; P557-R570 HydrophobicContact CG-CB 3.91Å
558	G	97.1	Very high	95.8	Very high	54 Å²	54	48.3 Å²	48.3	56%	0.557	28%	0.282	S	S	*	.	H	α-helix	trans	-61.7	-41.9	174.7	0	0	0	0	0	112.8	S556 Q562	S556-G558 VanDerWaalsContact C-N 3.25Å; S556-G558 PolarHBondContact O-N 2.94Å; G558-Q562 WeakPolarHBondContact O-CB 3.3Å; G558-Q562 PolarHBondContact O-N 3.2Å
559	R	95.4	Very high	95.9	Very high	110 Å²	110	46.4 Å²	46.4	42%	0.415	28%	0.278	S	S	.	.	H	α-helix	trans	-68	-41.3	173.9	-69.3	171.7	61.3	114	-3.4	111	E542 S556 P557 Q562 L563	E542-R559 HydrophobicContact CB-CB 3.85Å; E542-R559 IonicContact OE1-CZ 3.27Å; E542-R559 IonicContact OE1-NE 2.89Å; E542-R559 IonicContact OE1-NH2 3.12Å; E542-R559 PolarHBondContact OE1-NH2 3.2Å; E542-R559 IonicContact OE2-CZ 2.75Å; E542-R559 IonicContact OE2-NE 2.66Å; E542-R559 PolarHBondContact OE2-NE 2.9Å; E542-R559 IonicContact OE2-NH2 2.67Å; E542-R559 PolarHBondContact OE2-NH2 2.67Å; S556-R559 PolarHBondContact O-N 3.34Å; S556-R559 WeakPolarHBondContact OG-CD 3.28Å; P557-R559 PolarHBondContact O-N 3.1Å; R559-Q562 PolarHBondContact O-N 2.96Å; R559-L563 WeakPolarHBondContact O-CB 3.26Å; R559-L563 WeakPolarHBondContact O-CG 3.44Å; R559-L563 PolarHBondContact O-N 2.75Å
560	T	96.4	Very high	96.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.7	-44.6	177.3	-48.2	0	0	0	0	112	E542 P544 S554 S556 P557 Q562 L563 F564 C568	E542-T560 VanDerWaalsContact C-OG1 3.27Å; E542-T560 VanDerWaalsContact CA-OG1 3.3Å; E542-T560 WeakPolarHBondContact CA-OG1 3.49Å; E542-T560 WeakPolarHBondContact O-CB 3.31Å; E542-T560 VanDerWaalsContact O-CG2 3.32Å; E542-T560 WeakPolarHBondContact O-CG2 3.42Å; E542-T560 PolarHBondContact O-OG1 3.1Å; P544-T560 HydrophobicContact CB-CG2 4.15Å; S554-T560 VanDerWaalsContact CB-OG1 3.26Å; S554-T560 WeakPolarHBondContact CB-OG1 3.37Å; S554-T560 PolarHBondContact OG-OG1 2.82Å; S556-T560 PolarHBondContact O-N 2.85Å; S556-T560 VanDerWaalsContact O-N 3.07Å; S556-T560 PolarHBondContact O-OG1 2.89Å; P557-T560 PolarHBondContact O-N 2.81Å; T560-Q562 VanDerWaalsContact C-N 3.34Å; T560-Q562 PolarHBondContact O-N 3.1Å; T560-L563 PolarHBondContact O-N 3.16Å; T560-F564 HydrophobicContact CG2-CD2 3.82Å; T560-F564 WeakPolarHBondContact O-CB 3.48Å; T560-F564 PolarHBondContact O-N 2.89Å; T560-C568 HydrophobicContact CG2-CB 4.41Å; T560-C568 WeakPolarHBondContact CG2-SG 3.43Å
561	T	95.7	Very high	96.2	Very high	65 Å²	65	48.5 Å²	48.5	40%	0.399	26%	0.263	S	S	.	.	H	α-helix	trans	-64.6	-37	174.2	-58.4	0	0	0	0	111.8	P557 S565 L566	P557-T561 WeakPolarHBondContact O-CB 3.47Å; P557-T561 PolarHBondContact O-N 2.83Å; P557-T561 PolarHBondContact O-OG1 3.38Å; P557-T561 VanDerWaalsContact O-OG1 3.11Å; T561-S565 WeakPolarHBondContact O-CA 3.41Å; T561-S565 PolarHBondContact O-N 3.15Å; T561-L566 WeakPolarHBondContact CA-O 3.18Å; T561-L566 PolarHBondContact OG1-O 2.8Å
562	Q	95.6	Very high	96.3	Very high	157 Å²	157	53.1 Å²	53.1	73%	0.734	28%	0.281	S	S	*	.	H	α-helix	trans	-67.2	-41.8	176.4	-173.2	178.6	17.7	0	0	113.1	G558 R559 T560	G558-Q562 WeakPolarHBondContact O-CB 3.3Å; G558-Q562 PolarHBondContact O-N 3.2Å; R559-Q562 PolarHBondContact O-N 2.96Å; T560-Q562 VanDerWaalsContact C-N 3.34Å; T560-Q562 PolarHBondContact O-N 3.1Å
563	L	94.4	Very high	96.3	Very high	45 Å²	45	56.1 Å²	56.1	24%	0.236	30%	0.302	C	S	.	.	H	α-helix	trans	-87.5	-38.2	-172.5	-68.7	170.6	0	0	0	113.4	I460 L465 E542 R559 T560	I460-L563 HydrophobicContact CD1-CD2 3.81Å; L465-L563 HydrophobicContact CD2-CB 3.89Å; L465-L563 HydrophobicContact CD2-CD2 4.32Å; E542-L563 HydrophobicContact CB-CD1 3.86Å; E542-L563 HydrophobicContact CG-CD1 3.63Å; R559-L563 WeakPolarHBondContact O-CB 3.26Å; R559-L563 WeakPolarHBondContact O-CG 3.44Å; R559-L563 PolarHBondContact O-N 2.75Å; T560-L563 PolarHBondContact O-N 3.16Å
564	F	95.1	Very high	96.2	Very high	12 Å²	12	58.4 Å²	58.4	5%	0.053	33%	0.326	C	S	.	.	H	α-helix	trans	-110.6	-12	-174.5	-62.2	-79.6	0	0	0	113.4	L465 F469 K471 E542 T560 L566	L465-F564 HydrophobicContact CB-CE1 4.14Å; L465-F564 HydrophobicContact CD2-CD1 4.48Å; L465-F564 HydrophobicContact CD2-CE1 4.01Å; L465-F564 HydrophobicContact CD2-CE2 4.48Å; L465-F564 HydrophobicContact CD2-CZ 4.01Å; L465-F564 HydrophobicContact CG-CE1 4.47Å; L465-F564 HydrophobicContact CG-CZ 4.47Å; F469-F564 HydrophobicContact CB-CD1 3.53Å; F469-F564 HydrophobicContact CB-CE1 3.73Å; F469-F564 HydrophobicContact CB-CG 4.27Å; F469-F564 HydrophobicContact CD2-CE1 4.4Å; F469-F564 WeakPolarHBondContact O-CB 3.26Å; K471-F564 WeakPolarHBondContact CB-O 3.28Å; K471-F564 PolarHBondContact N-O 2.71Å; E542-F564 HydrophobicContact CB-CE2 4.5Å; E542-F564 HydrophobicContact CG-CE2 4.5Å; T560-F564 HydrophobicContact CG2-CD2 3.82Å; T560-F564 WeakPolarHBondContact O-CB 3.48Å; T560-F564 PolarHBondContact O-N 2.89Å; F564-L566 HydrophobicContact CB-CD1 4.47Å; F564-L566 HydrophobicContact CB-CG 4.04Å; F564-L566 PolarHBondContact O-N 3.25Å; F564-L566 VanDerWaalsContact O-N 3.15Å
565	S	94.9	Very high	96.2	Very high	68 Å²	68	59.3 Å²	59.3	48%	0.476	33%	0.33	S	S	.	.			trans	59.1	13.7	-171.8	-65.8	0	0	0	0	115.2	K471 T561	K471-S565 WeakPolarHBondContact CD-O 3.25Å; T561-S565 WeakPolarHBondContact O-CA 3.41Å; T561-S565 PolarHBondContact O-N 3.15Å
566	L	93.4	Very high	96.2	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	34%	0.335	C	S	.	.			trans	-76.8	141.7	173.1	-60.1	-175	0	0	0	111.3	F469 K471 V485 E486 P544 W552 T561 F564 C568	F469-L566 HydrophobicContact CB-CD1 4.45Å; F469-L566 VanDerWaalsContact O-CD1 3.28Å; F469-L566 WeakPolarHBondContact O-CD1 3.23Å; F469-L566 WeakPolarHBondContact O-CD2 3.36Å; F469-L566 VanDerWaalsContact O-CG 3.25Å; F469-L566 WeakPolarHBondContact O-CG 3.33Å; K471-L566 HydrophobicContact CB-CD2 4.41Å; V485-L566 HydrophobicContact CG1-CD2 3.79Å; V485-L566 HydrophobicContact CG2-CD1 4.37Å; V485-L566 HydrophobicContact CG2-CD2 4.23Å; E486-L566 HydrophobicContact CB-CD2 4.13Å; P544-L566 HydrophobicContact CB-CD1 4.49Å; W552-L566 HydrophobicContact CD2-CD1 4.2Å; W552-L566 HydrophobicContact CG-CD1 4.28Å; T561-L566 WeakPolarHBondContact CA-O 3.18Å; T561-L566 PolarHBondContact OG1-O 2.8Å; F564-L566 HydrophobicContact CB-CD1 4.47Å; F564-L566 HydrophobicContact CB-CG 4.04Å; F564-L566 PolarHBondContact O-N 3.25Å; F564-L566 VanDerWaalsContact O-N 3.15Å; L566-C568 PolarHBondContact O-N 3.08Å
567	P	93.2	Very high	96.2	Very high	82 Å²	82	58.9 Å²	58.9	53%	0.532	33%	0.325	S	S	.	.			trans	-69.6	125.6	161.6	30.7	-31.3	0	0	0	108.8	W552	W552-P567 WeakPolarHBondContact CB-O 3.03Å
568	C	95.8	Very high	96.1	Very high	22 Å²	22	58.5 Å²	58.5	15%	0.149	32%	0.322	C	S	.	.			trans	-133.2	142	-178.6	-71.6	0	0	0	0	112.3	W552 P557 T560 L566	W552-C568 WeakPolarHBondContact O-CA 3.39Å; P557-C568 HydrophobicContact CB-CB 4.07Å; P557-C568 WeakPolarHBondContact CB-O 3.39Å; T560-C568 HydrophobicContact CG2-CB 4.41Å; T560-C568 WeakPolarHBondContact CG2-SG 3.43Å; L566-C568 PolarHBondContact O-N 3.08Å
569	H	97.6	Very high	95.8	Very high	103 Å²	103	58.6 Å²	58.6	48%	0.477	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	165.4	167.7	-54.6	92.1	0	0	0	110.7	Q550 W552 S553 S554 P557	Q550-H569 HydrophobicContact CG-CB 4.05Å; Q550-H569 PolarHBondContact O-CE1 3.07Å; Q550-H569 PolarHBondContact O-ND1 3.05Å; Q550-H569 VanDerWaalsContact O-ND1 3.12Å; W552-H569 PolarHBondContact O-N 3.47Å; W552-H569 PolarHBondContact O-ND1 3.16Å; S553-H569 CarbonylContact C-O 3.55Å; S553-H569 WeakPolarHBondContact CA-O 3.43Å; S554-H569 PolarHBondContact N-O 2.92Å; P557-H569 VanDerWaalsContact CG-O 3.27Å; P557-H569 WeakPolarHBondContact CG-O 3.26Å
570	R	97.8	Very high	95.5	Very high	168 Å²	168	56.4 Å²	56.4	63%	0.634	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	123.7	171.6	178.9	151.9	50.6	-123	-3.8	109.9	S554 P557	S554-R570 WeakPolarHBondContact O-CA 3.45Å; P557-R570 HydrophobicContact CG-CB 3.91Å
571	L	98.1	Very high	95.1	Very high	6 Å²	6	57.9 Å²	57.9	3%	0.031	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-63	136.7	172.5	-169.3	72.8	0	0	0	110.1	V510 L524 F545 V547 S554 D575	V510-L571 HydrophobicContact CG2-CD1 4.07Å; V510-L571 HydrophobicContact CG2-CD2 4.22Å; V510-L571 HydrophobicContact CG2-CG 4.19Å; L524-L571 HydrophobicContact CD1-CD2 4.01Å; L524-L571 HydrophobicContact CD2-CD2 4.18Å; F545-L571 HydrophobicContact CD2-CD2 4.07Å; F545-L571 HydrophobicContact CE2-CD2 4.41Å; V547-L571 HydrophobicContact CG2-CD1 3.74Å; S554-L571 PolarHBondContact O-N 3.17Å; L571-D575 WeakPolarHBondContact CA-OD2 3.28Å; L571-D575 HydrophobicContact CD1-CB 4Å
572	Q	97.5	Very high	94.7	Very high	111 Å²	111	58.3 Å²	58.3	52%	0.519	32%	0.32	S	S	.	.			trans	-134.7	161.4	-176	-70.2	168.6	110.2	0	0	111.9	V510 G574 D575	V510-Q572 WeakPolarHBondContact CB-O 3.34Å; Q572-G574 PolarHBondContact O-N 3.14Å; Q572-D575 PolarHBondContact N-OD2 3.14Å; Q572-D575 VanDerWaalsContact O-CB 3.28Å; Q572-D575 WeakPolarHBondContact O-CB 3.06Å; Q572-D575 VanDerWaalsContact O-CG 3.31Å; Q572-D575 PolarHBondContact O-N 3.46Å
573	V	97.4	Very high	93.9	Very high	88 Å²	88	55.9 Å²	55.9	53%	0.533	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	129.4	169.6	173.7	0	0	0	0	109.3	V510 V511 I513	V510-V573 HydrophobicContact CG1-CG2 4.41Å; V511-V573 VanDerWaalsContact O-CG1 3.23Å; V511-V573 WeakPolarHBondContact O-CG1 3.42Å; I513-V573 HydrophobicContact CD1-CG2 4.42Å; I513-V573 HydrophobicContact CG1-CG2 4.06Å
574	G	96.6	Very high	92.4	Very high	48 Å²	48	58.2 Å²	58.2	50%	0.495	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.6	-16.9	-170.6	0	0	0	0	0	114.1	V510 Q572 V576	V510-G574 PolarHBondContact O-N 3.32Å; Q572-G574 PolarHBondContact O-N 3.14Å; G574-V576 PolarHBondContact O-N 3.48Å
575	D	97.4	Very high	90.4	Very high	18 Å²	18	65.9 Å²	65.9	10%	0.096	37%	0.369	C	S	.	.			trans	-64.8	132.3	178.1	-71.8	0.6	0	0	0	110.7	T509 V510 V547 L571 Q572	T509-D575 WeakPolarHBondContact CA-O 3.26Å; V510-D575 HydrophobicContact CG2-CB 4.29Å; V510-D575 PolarHBondContact N-O 2.83Å; V547-D575 HydrophobicContact CG1-CB 3.87Å; V547-D575 HydrophobicContact CG2-CB 4.07Å; L571-D575 WeakPolarHBondContact CA-OD2 3.28Å; L571-D575 HydrophobicContact CD1-CB 4Å; Q572-D575 PolarHBondContact N-OD2 3.14Å; Q572-D575 VanDerWaalsContact O-CB 3.28Å; Q572-D575 WeakPolarHBondContact O-CB 3.06Å; Q572-D575 VanDerWaalsContact O-CG 3.31Å; Q572-D575 PolarHBondContact O-N 3.46Å
576	V	96.6	Very high	88	Confident	49 Å²	49	68.3 Å²	68.3	30%	0.297	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	96.8	177.3	-176.1	0	0	0	0	109.2	T509 V547 Y548 G574 I578	T509-V576 HydrophobicContact CG2-CG2 4.34Å; V547-V576 WeakPolarHBondContact CA-O 3.36Å; Y548-V576 PolarHBondContact N-O 3.04Å; G574-V576 PolarHBondContact O-N 3.48Å; V576-I578 HydrophobicContact CG1-CG2 4.5Å
577	C	96.3	Very high	85.3	Confident	9 Å²	9	72.8 Å²	72.8	6%	0.061	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	138.5	171.7	-67.2	0	0	0	0	110.1	S508 F526 F546	S508-C577 PolarHBondContact N-O 3.03Å; S508-C577 WeakPolarHBondContact O-CB 3.35Å; S508-C577 PolarHBondContact O-N 2.97Å; F526-C577 HydrophobicContact CE1-CB 4.06Å; F546-C577 CarbonylContact O-C 3.58Å; F546-C577 WeakPolarHBondContact O-CA 3.48Å
578	I	94.8	Very high	82.6	Confident	13 Å²	13	75.6 Å²	75.6	7%	0.067	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	143.4	176.8	57.7	170.4	0	0	0	111.8	T490 F493 I505 D506 F546 Y548 V576	T490-I578 HydrophobicContact CG2-CD1 4.1Å; F493-I578 HydrophobicContact CB-CD1 4.06Å; F493-I578 HydrophobicContact CD1-CD1 4.37Å; F493-I578 HydrophobicContact CD2-CD1 4.06Å; F493-I578 HydrophobicContact CG-CD1 3.91Å; I505-I578 HydrophobicContact CG2-CB 3.96Å; I505-I578 HydrophobicContact CG2-CG2 4.05Å; D506-I578 WeakPolarHBondContact O-CA 3.44Å; F546-I578 HydrophobicContact CD1-CD1 3.9Å; F546-I578 HydrophobicContact CD1-CG1 3.84Å; F546-I578 HydrophobicContact CE1-CD1 4.32Å; F546-I578 PolarHBondContact O-N 2.92Å; Y548-I578 HydrophobicContact CD2-CD1 4.43Å; Y548-I578 HydrophobicContact CD2-CG2 4.25Å; V576-I578 HydrophobicContact CG1-CG2 4.5Å
579	S	91.4	Very high	79.7	Confident	57 Å²	57	78.7 Å²	78.7	40%	0.399	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	163.9	169.4	64.9	0	0	0	0	110.3	I505 D506	I505-S579 CarbonylContact C-O 3.58Å; I505-S579 VanDerWaalsContact CA-O 3.31Å; I505-S579 WeakPolarHBondContact CA-O 3.39Å; D506-S579 PolarHBondContact N-O 3.46Å; D506-S579 PolarHBondContact O-N 2.99Å; D506-S579 VanDerWaalsContact O-N 3.08Å
580	I	90.3	Very high	76.8	Confident	63 Å²	63	80.7 Å²	80.7	32%	0.323	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136.2	169.1	-73.7	162.8	0	0	0	108.6	F493 L503 K504 I505	F493-I580 HydrophobicContact CB-CD1 4.37Å; F493-I580 HydrophobicContact CD1-CD1 3.92Å; F493-I580 HydrophobicContact CD1-CG1 4.08Å; F493-I580 HydrophobicContact CG-CD1 4.49Å; L503-I580 HydrophobicContact CB-CG2 4.06Å; L503-I580 HydrophobicContact CD1-CG2 4.04Å; L503-I580 HydrophobicContact CD2-CG2 3.87Å; L503-I580 HydrophobicContact CG-CG2 4.21Å; K504-I580 WeakPolarHBondContact O-CA 3.41Å; I505-I580 HydrophobicContact CG1-CG1 4.5Å
581	S	86.9	Confident	73.7	Confident	32 Å²	32	77.1 Å²	77.1	22%	0.224	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	157.5	169.1	68.1	0	0	0	0	111.5	L503 K504 D506 Q583	L503-S581 WeakPolarHBondContact CA-O 3.47Å; K504-S581 WeakPolarHBondContact CG-OG 3.44Å; K504-S581 PolarHBondContact N-O 2.87Å; K504-S581 PolarHBondContact NZ-OG 2.95Å; K504-S581 PolarHBondContact O-N 3.14Å; D506-S581 WeakPolarHBondContact OD2-CB 3.32Å; D506-S581 PolarHBondContact OD2-OG 2.93Å; S581-Q583 PolarHBondContact O-N 3.24Å
582	L	87.5	Confident	70.8	Confident	73 Å²	73	86 Å²	86	38%	0.382	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	126.1	170.8	-77	160.9	0	0	0	109.4	L503 S584 P674 E676 V677	L503-L582 HydrophobicContact CD2-CD2 3.77Å; L503-L582 HydrophobicContact CD2-CG 4.19Å; L582-S584 PolarHBondContact O-N 3.09Å; L582-S584 VanDerWaalsContact O-N 3.12Å; L582-P674 HydrophobicContact CD1-CB 3.92Å; L582-P674 HydrophobicContact CD1-CG 4.08Å; L582-E676 HydrophobicContact CD1-CG 4.09Å; L582-V677 HydrophobicContact CD1-CG2 3.65Å; L582-V677 HydrophobicContact CG-CG2 4.26Å
583	Q	79.9	Confident	67.5	Low	107 Å²	107	84.9 Å²	84.9	50%	0.5	51%	0.512	S	S	.	.			trans	-74.9	98.9	171.2	-171.4	177.1	107.9	0	0	108.3	G502 K504 S581 L585	G502-Q583 PolarHBondContact O-N 3.15Å; K504-Q583 HydrophobicContact CB-CB 4.5Å; K504-Q583 HydrophobicContact CD-CB 4.32Å; K504-Q583 HydrophobicContact CD-CG 4.34Å; K504-Q583 HydrophobicContact CG-CB 4.36Å; S581-Q583 PolarHBondContact O-N 3.24Å; Q583-L585 PolarHBondContact O-N 2.9Å
584	S	63	Low	64.5	Low	93 Å²	93	86.5 Å²	86.5	65%	0.65	53%	0.527	S	S	*	.			trans	-59.2	121.9	178.3	-178	0	0	0	0	110.8	L582 N586	L582-S584 PolarHBondContact O-N 3.09Å; L582-S584 VanDerWaalsContact O-N 3.12Å; S584-N586 PolarHBondContact O-N 3.2Å
585	L	53.1	Low	61.2	Low	174 Å²	174	89.9 Å²	89.9	91%	0.911	54%	0.542	S	S	*	.	S	Bend	trans	-66.9	3.5	-179.9	-75.8	162.3	0	0	0	114.3	Q583 S587	Q583-L585 PolarHBondContact O-N 2.9Å; L585-S587 PolarHBondContact O-N 2.78Å
586	N	43.7	Very low	58.2	Low	118 Å²	118	93.1 Å²	93.1	63%	0.631	57%	0.571	S	S	*	*			trans	-99.9	47.6	-174.2	-164.8	19.8	0	0	0	113.5	S584 N588	S584-N586 PolarHBondContact O-N 3.2Å; N586-N588 VanDerWaalsContact C-N 3.32Å; N586-N588 PolarHBondContact O-N 2.67Å; N586-N588 PolarHBondContact OD1-ND2 2.98Å; N586-N588 VanDerWaalsContact OD1-ND2 3.1Å
587	S	36.5	Very low	55.3	Low	94 Å²	94	96.5 Å²	96.5	66%	0.657	59%	0.594	S	S	*	*			trans	-84.9	75.3	164.4	62.8	0	0	0	0	110.2	L585 S589	L585-S587 PolarHBondContact O-N 2.78Å; S587-S589 PolarHBondContact O-N 3.46Å
588	N	37.4	Very low	52.6	Low	142 Å²	142	102.5 Å²	102.5	76%	0.759	63%	0.633	S	S	*	*			trans	-70.7	67.2	166.4	-86.4	-41.6	0	0	0	110.2	N586 V590	N586-N588 VanDerWaalsContact C-N 3.32Å; N586-N588 PolarHBondContact O-N 2.67Å; N586-N588 PolarHBondContact OD1-ND2 2.98Å; N586-N588 VanDerWaalsContact OD1-ND2 3.1Å; N588-V590 PolarHBondContact O-N 2.72Å
589	S	34.3	Very low	49.6	Very low	87 Å²	87	105.2 Å²	105.2	61%	0.608	66%	0.664	S	S	*	*			trans	-73	96.8	175.5	44	0	0	0	0	110	S587 S591	S587-S589 PolarHBondContact O-N 3.46Å; S589-S591 PolarHBondContact O-N 2.94Å
590	V	37.4	Very low	46.7	Very low	144 Å²	144	112.1 Å²	112.1	87%	0.873	69%	0.69	S	S	*	*			trans	-71.8	60.8	157.7	-172.5	0	0	0	0	108.7	N588 Q592	N588-V590 PolarHBondContact O-N 2.72Å; V590-Q592 PolarHBondContact O-N 3.05Å
591	S	31.1	Very low	44.1	Very low	94 Å²	94	117.8 Å²	117.8	66%	0.657	72%	0.72	S	S	*	*			trans	-81.7	104.8	165.2	-66.8	0	0	0	0	106.9	S589 A593	S589-S591 PolarHBondContact O-N 2.94Å; S591-A593 PolarHBondContact O-N 3.11Å
592	Q	38.8	Very low	41.3	Very low	192 Å²	192	119.7 Å²	119.7	90%	0.897	74%	0.744	S	S	*	*			trans	-70.6	67.2	-177.7	-170.6	-179.3	73.4	0	0	111.8	V590 S594	V590-Q592 PolarHBondContact O-N 3.05Å; Q592-S594 PolarHBondContact O-N 3.19Å
593	A	28.1	Very low	39	Very low	88 Å²	88	122 Å²	122	73%	0.727	76%	0.764	S	S	*	*			trans	-82.6	88.5	174.8	0	0	0	0	0	110	S591 C595	S591-A593 PolarHBondContact O-N 3.11Å; A593-C595 PolarHBondContact O-N 3.34Å
594	S	34.2	Very low	37.6	Very low	122 Å²	122	122.5 Å²	122.5	85%	0.853	78%	0.776	S	S	*	*			trans	-67.4	103.1	169.8	-174.8	0	0	0	0	110.2	Q592	Q592-S594 PolarHBondContact O-N 3.19Å
595	C	25.6	Very low	36	Very low	119 Å²	119	128.2 Å²	128.2	80%	0.804	78%	0.783	S	S	*	*			trans	-143.2	83.5	170.5	-168.3	0	0	0	0	110.4	A593	A593-C595 PolarHBondContact O-N 3.34Å
596	A	35.4	Very low	34.7	Very low	85 Å²	85	126.7 Å²	126.7	70%	0.702	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-68.1	145.2	176	0	0	0	0	0	111.8
597	P	35.6	Very low	34.2	Very low	120 Å²	120	130.5 Å²	130.5	78%	0.779	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-73.2	147.4	178.3	30.2	-35.1	0	0	0	112.3
598	P	40.3	Very low	34.3	Very low	136 Å²	136	131.2 Å²	131.2	88%	0.883	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-93.1	129.4	-172	34	-34.6	0	0	0	115.1
599	G	30.6	Very low	34	Very low	70 Å²	70	130.4 Å²	130.4	72%	0.722	77%	0.771	S	S	*	*			trans	152.8	146.6	164.4	0	0	0	0	0	112.5
600	Q	31	Very low	33.9	Very low	202 Å²	202	135.4 Å²	135.4	94%	0.944	78%	0.777	S	S	*	*			cis	-141.8	166.9	-8.3	-80.3	-137.3	86.3	0	0	110.1
601	L	36.6	Very low	33.5	Very low	182 Å²	182	133.7 Å²	133.7	95%	0.953	77%	0.767	S	S	*	*			trans	-76.6	139.7	177.8	-83.7	159.7	0	0	0	112.8
602	G	27.7	Very low	33.5	Very low	71 Å²	71	135.6 Å²	135.6	73%	0.732	77%	0.774	S	S	*	*			trans	-166.3	110.8	173.4	0	0	0	0	0	111.6
603	P	39.4	Very low	33.1	Very low	122 Å²	122	134.1 Å²	134.1	79%	0.792	77%	0.772	S	S	*	*			trans	-108.4	-171.1	-176	42.7	-35.4	0	0	0	112.1
604	P	49.1	Very low	33	Very low	118 Å²	118	133.3 Å²	133.3	77%	0.766	77%	0.772	S	S	*	*				-131.2	153.2	-64.8	38.3	-24.6	0	0	0	112.5
605	R	29.6	Very low	33.4	Very low	212 Å²	212	134.2 Å²	134.2	80%	0.8	78%	0.775	S	S	*	*			trans	-174.9	148.1	161.1	-108.1	-176.5	155.3	-161.3	-27.7	109.8
606	E	26.8	Very low	33.7	Very low	143 Å²	143	137.9 Å²	137.9	67%	0.668	77%	0.772	S	S	*	*			cis	-151.8	158.4	-12.5	-150.9	153.3	-134.6	0	0	108.7
607	R	32.7	Very low	33.5	Very low	198 Å²	198	140.8 Å²	140.8	75%	0.747	77%	0.771	S	S	*	*			trans	-101.5	150.1	178	-154.1	-159.4	-175.5	166.7	1.3	110.1
608	P	39.4	Very low	33.1	Very low	109 Å²	109	142.7 Å²	142.7	71%	0.708	77%	0.774	S	S	*	*				-124.3	128.4	117.8	-3.2	24.4	0	0	0	111.2
609	E	29.6	Very low	32.9	Very low	125 Å²	125	141.9 Å²	141.9	58%	0.584	77%	0.77	S	S	*	*				78.9	133.7	92.6	-81.9	-163.9	86.5	0	0	112.9
610	R	33.6	Very low	32.8	Very low	192 Å²	192	146 Å²	146	73%	0.725	78%	0.775	S	S	*	*			cis	-130.3	158.4	3.8	-91.7	147.5	-170.5	-164.6	1.8	109.3
611	T	29.1	Very low	33.1	Very low	108 Å²	108	141 Å²	141	66%	0.663	76%	0.763	S	S	*	*				54	119.5	72.7	-20.3	0	0	0	0	110.3
612	V	30	Very low	32.8	Very low	133 Å²	133	142 Å²	142	81%	0.806	76%	0.763	S	S	*	*				-144.4	156.6	50.9	171.9	0	0	0	0	113.9
613	L	30.8	Very low	32.9	Very low	161 Å²	161	142.2 Å²	142.2	84%	0.843	76%	0.764	S	S	*	*			trans	-41.3	129.1	175.8	-52.9	163.4	0	0	0	119.7
614	G	26.5	Very low	32.4	Very low	71 Å²	71	145.6 Å²	145.6	73%	0.732	77%	0.766	S	S	*	*				62.2	-173.8	129.9	0	0	0	0	0	121.4
615	P	41.8	Very low	31.4	Very low	142 Å²	142	144.2 Å²	144.2	92%	0.922	76%	0.76	S	S	*	*			cis	-111.1	-138.4	-3.7	41.2	-29.3	0	0	0	113.6
616	R	32.9	Very low	31.5	Very low	196 Å²	196	142.9 Å²	142.9	74%	0.74	76%	0.762	S	S	*	*			trans	-142.1	154.2	-151.7	-155.3	-156.7	173.8	-138.5	-5.3	112.6
617	E	29.9	Very low	32.5	Very low	145 Å²	145	141.4 Å²	141.4	68%	0.678	77%	0.766	S	S	*	*			trans	71.7	151.1	166.2	-47.7	-171.7	111.9	0	0	114.5
618	L	28.5	Very low	32.3	Very low	161 Å²	161	137.1 Å²	137.1	84%	0.843	77%	0.772	S	S	*	*				-154.3	161.4	50.7	-174.6	69.1	0	0	0	112.2
619	C	35	Very low	31.9	Very low	119 Å²	119	135.5 Å²	135.5	80%	0.804	78%	0.776	S	S	*	*			trans	-117.7	127	157.7	-63.3	0	0	0	0	109.2
620	D	29	Very low	31.8	Very low	156 Å²	156	139.3 Å²	139.3	83%	0.834	79%	0.794	S	S	*	*				-166.9	-172.3	126.2	-136.5	-57.2	0	0	0	111.4
621	S	38.1	Very low	31.5	Very low	97 Å²	97	134 Å²	134	68%	0.678	80%	0.798	S	S	*	*			trans	-99.7	150.6	-162.3	-42.8	0	0	0	0	113.1
622	E	28.9	Very low	31.6	Very low	204 Å²	204	133.9 Å²	133.9	95%	0.953	80%	0.802	S	S	*	*			trans	179.1	176.7	134.7	-107.6	-158.2	70.4	0	0	112.1
623	G	29.9	Very low	31.6	Very low	74 Å²	74	135.5 Å²	135.5	76%	0.763	80%	0.8	S	S	*	*			trans	124.1	131.8	165.6	0	0	0	0	0	114.9
624	K	29.2	Very low	31.7	Very low	193 Å²	193	133.3 Å²	133.3	84%	0.839	79%	0.793	S	S	*	*			trans	-134.9	150.4	-174.3	-169	163.2	62.1	-174.5	0	113
625	S	27.8	Very low	31.7	Very low	89 Å²	89	136.4 Å²	136.4	62%	0.622	80%	0.797	S	S	*	*			trans	70	111.6	154.7	45.6	0	0	0	0	121.9
626	Q	31.1	Very low	31.1	Very low	184 Å²	184	137.7 Å²	137.7	86%	0.86	79%	0.791	S	S	*	*				72.2	170.1	122.4	-74.9	-173.2	-15.6	0	0	120.5
627	P	49.1	Very low	31.4	Very low	113 Å²	113	133 Å²	133	73%	0.734	79%	0.786	S	S	*	*			cis	-130.5	-170.9	-10.3	19.7	5.6	0	0	0	115.1
628	A	28.7	Very low	31.3	Very low	107 Å²	107	130.8 Å²	130.8	88%	0.884	79%	0.787	S	S	*	*			trans	79.5	138.6	161.7	0	0	0	0	0	118.2
629	G	29.5	Very low	31.4	Very low	76 Å²	76	131.1 Å²	131.1	78%	0.784	78%	0.784	S	S	*	*			cis	-166	175.7	-0.9	0	0	0	0	0	114.9
630	E	28.6	Very low	31.3	Very low	205 Å²	205	131.4 Å²	131.4	96%	0.958	78%	0.784	S	S	*	*			trans	-56	164	-179.6	-73.5	151.9	72.1	0	0	115.4
631	G	27.6	Very low	31.2	Very low	79 Å²	79	130.7 Å²	130.7	81%	0.814	78%	0.776	S	S	*	*			cis	-170.2	-155.5	11.5	0	0	0	0	0	114.6
632	S	30	Very low	31.2	Very low	106 Å²	106	131.8 Å²	131.8	74%	0.741	78%	0.781	S	S	*	*			trans	-112.3	147.1	-164.5	-178.7	0	0	0	0	114.9
633	H	30.4	Very low	31	Very low	168 Å²	168	125 Å²	125	78%	0.778	77%	0.765	S	S	*	*			trans	173.4	138.7	138.5	-106	-114.8	0	0	0	107.9
634	V	32.3	Very low	30.9	Very low	114 Å²	114	126.5 Å²	126.5	69%	0.691	77%	0.771	S	S	*	*			cis	73.6	104.9	41.7	-178.8	0	0	0	0	114.1
635	V	27.9	Very low	31	Very low	136 Å²	136	126.9 Å²	126.9	82%	0.824	78%	0.775	S	S	*	*			trans	-174	139.5	139.1	137.3	0	0	0	0	111.7
636	E	27.8	Very low	31	Very low	170 Å²	170	127.4 Å²	127.4	79%	0.794	79%	0.785	S	S	*	*			trans	-115.2	151	162.4	-161.8	-142.5	106	0	0	106.3	S638	E636-S638 PolarHBondContact OE1-N 3.38Å
637	P	40.6	Very low	31	Very low	97 Å²	97	123.6 Å²	123.6	63%	0.63	78%	0.778	S	S	*	*				-159.4	161.8	97.3	40	-19.7	0	0	0	119.3
638	S	26.8	Very low	29.8	Very low	99 Å²	99	129.6 Å²	129.6	69%	0.692	79%	0.786	S	S	*	*			trans	72.6	136.6	137.8	63.8	0	0	0	0	123.8	E636	E636-S638 PolarHBondContact OE1-N 3.38Å
639	Q	31.1	Very low	29.9	Very low	168 Å²	168	129.8 Å²	129.8	79%	0.785	78%	0.778	S	S	*	*			trans	-102.6	177.4	160.2	-68.2	-162.5	-73.8	0	0	111.8
640	P	33.3	Very low	29.9	Very low	125 Å²	125	132.4 Å²	132.4	81%	0.812	78%	0.779	S	S	*	*				-143.4	162.8	97.2	38.3	-23.8	0	0	0	117.3
641	E	26.3	Very low	30.1	Very low	140 Å²	140	128.7 Å²	128.7	65%	0.654	77%	0.773	S	S	*	*			trans	-73	172.9	166.7	-98.9	-74.2	98.8	0	0	111.9	G643	E641-G643 PolarHBondContact OE2-N 3.36Å
642	P	39	Very low	30.2	Very low	121 Å²	121	128.8 Å²	128.8	79%	0.786	76%	0.761	S	S	*	*			cis	-143.8	148.7	31.7	39.7	-18.1	0	0	0	121.9
643	G	25	Very low	30.2	Very low	60 Å²	60	132.6 Å²	132.6	62%	0.619	77%	0.765	S	S	*	*				86	110.2	119.4	0	0	0	0	0	122.6	E641	E641-G643 PolarHBondContact OE2-N 3.36Å
644	A	27.1	Very low	30.1	Very low	107 Å²	107	131.2 Å²	131.2	88%	0.884	76%	0.758	S	S	*	*			trans	-155	126.3	145.9	0	0	0	0	0	112.3
645	Q	31.2	Very low	29.9	Very low	200 Å²	200	135.6 Å²	135.6	94%	0.935	76%	0.763	S	S	*	*			trans	-69	140.7	-162.9	-56.7	167	9.1	0	0	117.3
646	A	28	Very low	30.2	Very low	101 Å²	101	140.8 Å²	140.8	84%	0.835	77%	0.769	S	S	*	*			trans	-160.4	127.9	140.1	0	0	0	0	0	111.1
647	C	30	Very low	30.1	Very low	103 Å²	103	136 Å²	136	70%	0.696	77%	0.766	S	S	*	*			trans	-94.6	163	174.4	-60.3	0	0	0	0	110.3
648	W	24.2	Very low	30	Very low	239 Å²	239	141 Å²	141	91%	0.905	78%	0.783	S	S	*	*			cis	-156.7	-178.6	29.5	-60.1	80.6	0	0	0	109.7
649	P	30.5	Very low	30.1	Very low	111 Å²	111	145.9 Å²	145.9	72%	0.721	80%	0.795	S	S	*	*			cis	-126.8	164	-45.2	33.9	-18.9	0	0	0	113.4
650	T	30.5	Very low	29.9	Very low	132 Å²	132	141 Å²	141	81%	0.81	79%	0.789	S	S	*	*			trans	-128.1	165	159.2	-11.9	0	0	0	0	107.2
651	P	33.7	Very low	30.3	Very low	127 Å²	127	144.8 Å²	144.8	83%	0.825	80%	0.796	S	S	*	*				-148.2	-179.8	70.4	39.4	-18.8	0	0	0	116
652	S	29.2	Very low	31	Very low	81 Å²	81	144.4 Å²	144.4	57%	0.566	79%	0.794	S	S	*	*			trans	-129.4	175.1	175	50.1	0	0	0	0	110.7
653	F	30	Very low	30.6	Very low	186 Å²	186	143.7 Å²	143.7	82%	0.816	80%	0.799	S	S	*	*			trans	75.2	159.5	177.6	-52.5	-73.7	0	0	0	115
654	Q	27.4	Very low	31	Very low	138 Å²	138	150.3 Å²	150.3	65%	0.645	81%	0.805	S	S	*	*			cis	-155.9	148.1	22.6	-155.7	171.5	110.5	0	0	116.1
655	R	29.3	Very low	31.3	Very low	207 Å²	207	149.3 Å²	149.3	78%	0.781	80%	0.797	S	S	*	*			trans	34.3	124.9	155.7	-72.6	-175.7	-75.8	-164.8	-2.2	122.8
656	Y	33.6	Very low	31.2	Very low	245 Å²	245	144 Å²	144	96%	0.961	79%	0.787	S	S	*	*			trans	-3.3	136.8	141	-81.8	-96.8	0	0	0	120.3
657	G	25	Very low	31.6	Very low	70 Å²	70	146.9 Å²	146.9	72%	0.722	79%	0.788	S	S	*	*			trans	-150	152.9	153.4	0	0	0	0	0	110
658	M	39.8	Very low	32	Very low	200 Å²	200	149.9 Å²	149.9	99%	0.985	80%	0.796	S	S	*	*			trans	-84.1	118.4	-175.9	-79	161.4	52.3	0	0	113.1
659	Q	28.3	Very low	32.4	Very low	202 Å²	202	149.5 Å²	149.5	94%	0.944	79%	0.794	S	S	*	*			trans	-162.5	147.2	163.5	-163.6	167.4	61	0	0	105.3
660	G	27.1	Very low	32.6	Very low	65 Å²	65	150 Å²	150	67%	0.67	80%	0.798	S	S	*	*			cis	173	148.9	1.2	0	0	0	0	0	105.9	E662	G660-E662 PolarHBondContact O-N 3.34Å; G660-E662 VanDerWaalsContact O-N 3.11Å
661	E	41.5	Very low	32.8	Very low	205 Å²	205	149.3 Å²	149.3	96%	0.958	80%	0.798	S	S	*	*			trans	-70.4	101	-173.4	-179.7	-172.8	126.4	0	0	112.5
662	E	41.3	Very low	32.9	Very low	132 Å²	132	151.1 Å²	151.1	62%	0.617	79%	0.793	S	S	*	*			trans	-164.1	79.2	153.7	-157.4	178.6	169.5	0	0	113.5	G660 R664	G660-E662 PolarHBondContact O-N 3.34Å; G660-E662 VanDerWaalsContact O-N 3.11Å; E662-R664 HydrophobicContact CG-CG 4.16Å; E662-R664 IonicContact OE1-CZ 2.72Å; E662-R664 IonicContact OE1-NE 3.77Å; E662-R664 PolarHBondContact OE1-NE 3.06Å; E662-R664 IonicContact OE1-NH2 3.59Å; E662-R664 PolarHBondContact OE1-NH2 3.17Å; E662-R664 IonicContact OE2-NH2 3.24Å
663	A	30.8	Very low	33.5	Very low	107 Å²	107	152.9 Å²	152.9	88%	0.884	80%	0.795	S	S	*	*			trans	-95.5	91.4	167.1	0	0	0	0	0	109.9
664	R	31.8	Very low	33.9	Very low	198 Å²	198	146.8 Å²	146.8	75%	0.747	77%	0.774	S	S	*	*			trans	-58.9	142	-174.7	-71.2	-169.8	178.5	149.9	14.9	112.9	E662 A666	E662-R664 HydrophobicContact CG-CG 4.16Å; E662-R664 IonicContact OE1-CZ 2.72Å; E662-R664 IonicContact OE1-NE 3.77Å; E662-R664 PolarHBondContact OE1-NE 3.06Å; E662-R664 IonicContact OE1-NH2 3.59Å; E662-R664 PolarHBondContact OE1-NH2 3.17Å; E662-R664 IonicContact OE2-NH2 3.24Å; R664-A666 PolarHBondContact O-N 3.28Å; R664-A666 VanDerWaalsContact O-N 3.15Å
665	A	33.9	Very low	34.3	Very low	87 Å²	87	145 Å²	145	72%	0.719	77%	0.766	S	S	*	*			trans	-57	115.5	-179	0	0	0	0	0	112.4	L667	A665-L667 PolarHBondContact O-N 3.45Å; A665-L667 VanDerWaalsContact O-N 3.14Å
666	A	30.1	Very low	34.9	Very low	87 Å²	87	141.6 Å²	141.6	72%	0.719	76%	0.759	S	S	*	*			trans	-69.3	104.5	159.4	0	0	0	0	0	107.9	R664 L668	R664-A666 PolarHBondContact O-N 3.28Å; R664-A666 VanDerWaalsContact O-N 3.15Å; A666-L668 VanDerWaalsContact C-N 3.34Å; A666-L668 PolarHBondContact O-N 3Å
667	L	36	Very low	35.4	Very low	163 Å²	163	133.8 Å²	133.8	85%	0.853	74%	0.736	S	S	*	*			trans	-64.7	89.9	179.1	-70.4	169.9	0	0	0	110.5	A665 R669	A665-L667 PolarHBondContact O-N 3.45Å; A665-L667 VanDerWaalsContact O-N 3.14Å; L667-R669 PolarHBondContact O-N 3.16Å; L667-R669 VanDerWaalsContact O-N 3.14Å
668	L	37.3	Very low	36.2	Very low	165 Å²	165	136.4 Å²	136.4	86%	0.864	73%	0.728	S	S	*	*			trans	-64.1	112.8	170	-68	177.8	0	0	0	108.3	A666	A666-L668 VanDerWaalsContact C-N 3.34Å; A666-L668 PolarHBondContact O-N 3Å
669	R	33	Very low	36.1	Very low	232 Å²	232	132.8 Å²	132.8	88%	0.875	71%	0.712	S	S	*	*			trans	-56.7	141.4	-178.3	-70.8	175.8	171.4	159.4	-4.3	110.7	L667	L667-R669 PolarHBondContact O-N 3.16Å; L667-R669 VanDerWaalsContact O-N 3.14Å
670	P	34.6	Very low	36.5	Very low	122 Å²	122	126.4 Å²	126.4	79%	0.792	69%	0.69	S	S	*	*			trans	-50.4	147.3	165.2	-26.5	35.3	0	0	0	111.5	F672	P670-F672 PolarHBondContact O-N 3.37Å; P670-F672 VanDerWaalsContact O-N 3.1Å
671	S	34.9	Very low	37.3	Very low	116 Å²	116	130.1 Å²	130.1	81%	0.811	69%	0.693	S	S	*	*			trans	-54.5	113	-172.6	40	0	0	0	0	112.5	I673	S671-I673 PolarHBondContact O-N 3.34Å
672	F	36.8	Very low	37.3	Very low	165 Å²	165	128 Å²	128	72%	0.724	68%	0.683	S	S	*	*			trans	-69.8	112.5	175.5	-167.8	-91.8	0	0	0	109.3	P670	P670-F672 PolarHBondContact O-N 3.37Å; P670-F672 VanDerWaalsContact O-N 3.1Å
673	I	41.6	Very low	37	Very low	118 Å²	118	124.6 Å²	124.6	61%	0.605	68%	0.683	S	S	*	*			trans	-59.7	127	174.2	-61.8	172.9	0	0	0	108.2	S671 Q675 V677	S671-I673 PolarHBondContact O-N 3.34Å; I673-Q675 PolarHBondContact O-N 3.16Å; I673-V677 HydrophobicContact CG2-CB 4.04Å
674	P	37.4	Very low	37.1	Very low	59 Å²	59	130 Å²	130	38%	0.383	68%	0.68	S	S	.	*			trans	-53.5	132	178.5	-28.2	36.5	0	0	0	111.7	L582 E676 V677	L582-P674 HydrophobicContact CD1-CB 3.92Å; L582-P674 HydrophobicContact CD1-CG 4.08Å; P674-E676 HydrophobicContact CB-CG 4.36Å; P674-E676 VanDerWaalsContact CB-OE1 3.25Å; P674-E676 WeakPolarHBondContact CB-OE1 3.42Å; P674-E676 PolarHBondContact O-N 3.03Å; P674-E676 VanDerWaalsContact O-N 3.1Å; P674-V677 PolarHBondContact O-N 3.46Å
675	Q	35.8	Very low	37.3	Very low	101 Å²	101	125.7 Å²	125.7	47%	0.472	68%	0.681	S	S	.	*	G	3₁₀ helix	trans	-69.9	-14.2	-163.5	-170	156.4	-66.7	0	0	113	I673 V677 K678	I673-Q675 PolarHBondContact O-N 3.16Å; Q675-V677 VanDerWaalsContact C-N 3.32Å; Q675-V677 PolarHBondContact O-N 3.01Å; Q675-K678 VanDerWaalsContact CD-NZ 3.33Å; Q675-K678 HydrophobicContact CG-CB 4.3Å; Q675-K678 VanDerWaalsContact O-CB 3.26Å; Q675-K678 WeakPolarHBondContact O-CB 3.45Å; Q675-K678 PolarHBondContact O-N 2.9Å; Q675-K678 VanDerWaalsContact O-N 3.14Å
676	E	42.8	Very low	37.5	Very low	134 Å²	134	128.8 Å²	128.8	63%	0.626	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-65.1	-27.3	168.2	52.6	-102.8	87.7	0	0	114.3	L582 P674 K678 L679	L582-E676 HydrophobicContact CD1-CG 4.09Å; P674-E676 HydrophobicContact CB-CG 4.36Å; P674-E676 VanDerWaalsContact CB-OE1 3.25Å; P674-E676 WeakPolarHBondContact CB-OE1 3.42Å; P674-E676 PolarHBondContact O-N 3.03Å; P674-E676 VanDerWaalsContact O-N 3.1Å; E676-K678 PolarHBondContact O-N 3.35Å; E676-L679 PolarHBondContact O-N 3.2Å
677	V	44.5	Very low	38	Very low	81 Å²	81	129 Å²	129	49%	0.491	69%	0.687	S	S	.	*	G	3₁₀ helix	trans	-76.4	-16	172.8	-168	0	0	0	0	111.3	L582 I673 P674 Q675 L679	L582-V677 HydrophobicContact CD1-CG2 3.65Å; L582-V677 HydrophobicContact CG-CG2 4.26Å; I673-V677 HydrophobicContact CG2-CB 4.04Å; P674-V677 PolarHBondContact O-N 3.46Å; Q675-V677 VanDerWaalsContact C-N 3.32Å; Q675-V677 PolarHBondContact O-N 3.01Å; V677-L679 PolarHBondContact O-N 3.06Å
678	K	40.4	Very low	38.3	Very low	125 Å²	125	124.7 Å²	124.7	54%	0.543	68%	0.682	S	S	.	*	G	3₁₀ helix	trans	-78.8	6	173.9	-150.4	179.2	71.8	-172.5	0	113	Q675 E676	Q675-K678 VanDerWaalsContact CD-NZ 3.33Å; Q675-K678 HydrophobicContact CG-CB 4.3Å; Q675-K678 VanDerWaalsContact O-CB 3.26Å; Q675-K678 WeakPolarHBondContact O-CB 3.45Å; Q675-K678 PolarHBondContact O-N 2.9Å; Q675-K678 VanDerWaalsContact O-N 3.14Å; E676-K678 PolarHBondContact O-N 3.35Å
679	L	38	Very low	38	Very low	124 Å²	124	130.5 Å²	130.5	65%	0.649	70%	0.7	S	S	*	*	S	Bend	trans	-122.9	39.1	-170.4	-67.7	177.7	0	0	0	114.7	E676 V677	E676-L679 PolarHBondContact O-N 3.2Å; V677-L679 PolarHBondContact O-N 3.06Å
680	S	37.9	Very low	38.2	Very low	69 Å²	69	125.4 Å²	125.4	48%	0.483	69%	0.691	S	S	.	*	S	Bend	trans	-125.9	-5.7	157.5	85	0	0	0	0	115.1	Q476	Q476-S680 PolarHBondContact OE1-OG 2.88Å
681	I	43.7	Very low	38.4	Very low	143 Å²	143	125.6 Å²	125.6	73%	0.733	69%	0.686	S	S	*	*	S	Bend	trans	-93.3	-12	176.9	-19.9	179.1	0	0	0	112.8	G683	I681-G683 PolarHBondContact O-N 3.13Å
682	E	41.7	Very low	38.6	Very low	160 Å²	160	126.1 Å²	126.1	75%	0.748	68%	0.679	S	S	*	*	S	Bend	trans	-79.3	68.6	170.7	-168.5	82.7	-116	0	0	109.7	R684	E682-R684 PolarHBondContact O-N 3.04Å; E682-R684 VanDerWaalsContact O-N 3.12Å
683	G	33.3	Very low	38.7	Very low	60 Å²	60	123.8 Å²	123.8	62%	0.619	68%	0.676	S	S	*	*			trans	-62.8	110.9	178.1	0	0	0	0	0	111.2	I681 S685	I681-G683 PolarHBondContact O-N 3.13Å; G683-S685 VanDerWaalsContact C-N 3.31Å; G683-S685 PolarHBondContact O-N 3.18Å
684	R	33.7	Very low	38.6	Very low	220 Å²	220	124.2 Å²	124.2	83%	0.83	68%	0.681	S	S	*	*			trans	-66.2	82.6	-179.7	-65.3	-178.7	68.9	-160.7	2	111.8	E682 N686	E682-R684 PolarHBondContact O-N 3.04Å; E682-R684 VanDerWaalsContact O-N 3.12Å; R684-N686 PolarHBondContact O-N 3.49Å
685	S	35.2	Very low	38.6	Very low	109 Å²	109	128.5 Å²	128.5	76%	0.762	70%	0.701	S	S	*	*			trans	-74	57.2	-179.6	-175.9	0	0	0	0	113.4	G683 A687	G683-S685 VanDerWaalsContact C-N 3.31Å; G683-S685 PolarHBondContact O-N 3.18Å; S685-A687 PolarHBondContact O-N 2.99Å
686	N	39.4	Very low	38.8	Very low	152 Å²	152	130.5 Å²	130.5	81%	0.813	72%	0.717	S	S	*	*			trans	-78.6	64.5	170.6	-89.9	31.2	0	0	0	111	R684	R684-N686 PolarHBondContact O-N 3.49Å
687	A	40.5	Very low	38.5	Very low	92 Å²	92	130.2 Å²	130.2	76%	0.76	72%	0.724	S	S	*	*			trans	-138.4	71.3	177	0	0	0	0	0	110.4	S685	S685-A687 PolarHBondContact O-N 2.99Å
688	G	41.6	Very low	38	Very low	71 Å²	71	134.3 Å²	134.3	73%	0.732	74%	0.743	S	S	*	*			trans	144.3	37.8	169.3	0	0	0	0	0	119.2
689	K	31.2	Very low	37.8	Very low	287 Å²	287	135.2 Å²	135.2	100%	1.248	76%	0.762	S	S	*	*			trans	-171.1	0	145.2	-101.2	147.5	-168.5	178.4	0	110.9

Retrieved 689 of 689 residues in 2268.3 ms (Link to these results)

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