A0A060IVL7_DANRE Loading...

Tripartite motif containing 69 protein

AlphaFold DB , UniProt , Accession A0A060IVL7, Species DANRE (Danio rerio, Zebrafish), Gene trim69, Length 548 aa.

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(Predicted Aligned Error values between residue pairs)

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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	41.3	Very low	36.2	Very low	246 Å²	246	170.6 Å²	170.6	100%	1.212	87%	0.867	S	S	*	*				0	124.8	0	-78.2	172.3	171.6	0	0	106.5	E3	M1-E3 PolarHBondContact O-N 2.9Å
2	R	33.8	Very low	36.1	Very low	251 Å²	251	172.6 Å²	172.6	95%	0.947	87%	0.87	S	S	*	*			trans	-71.9	125.5	-164.4	-75.2	178	174.7	177.6	-2.6	111.6
3	E	40	Very low	36	Very low	186 Å²	186	171.4 Å²	171.4	87%	0.869	87%	0.868	S	S	*	*			trans	-79.3	143.6	155.3	-67	178.5	144.9	0	0	109.4	M1	M1-E3 PolarHBondContact O-N 2.9Å
4	T	35.8	Very low	36.1	Very low	134 Å²	134	167.9 Å²	167.9	82%	0.822	86%	0.862	S	S	*	*			trans	-157.6	144.1	148.1	-9.7	0	0	0	0	109.7
5	P	47.4	Very low	35.9	Very low	121 Å²	121	169.6 Å²	169.6	79%	0.786	87%	0.865	S	S	*	*			trans	-111.9	177.6	-164.5	33.6	-15.8	0	0	0	114.4
6	A	37.8	Very low	36.2	Very low	96 Å²	96	167.3 Å²	167.3	79%	0.793	86%	0.862	S	S	*	*			trans	-13.4	144.7	168.9	0	0	0	0	0	120.5
7	N	30.5	Very low	36.5	Very low	167 Å²	167	164.2 Å²	164.2	89%	0.893	86%	0.855	S	S	*	*			trans	-149.7	139.6	138.9	-134.8	-2	0	0	0	113.3
8	F	33.2	Very low	36.7	Very low	192 Å²	192	162.2 Å²	162.2	84%	0.842	85%	0.854	S	S	*	*			trans	-73.1	149.1	172.8	-100.4	-108.3	0	0	0	111.5
9	Q	32	Very low	36.9	Very low	162 Å²	162	162.7 Å²	162.7	76%	0.757	86%	0.855	S	S	*	*				174.7	132.7	123.7	-99.3	172.6	-30	0	0	115.2
10	Q	32.9	Very low	37.1	Very low	163 Å²	163	162.1 Å²	162.1	76%	0.762	85%	0.852	S	S	*	*			trans	84.4	126.4	132.3	-78.5	170.9	-16.4	0	0	123.9
11	D	33.8	Very low	37.5	Very low	159 Å²	159	157.8 Å²	157.8	85%	0.85	84%	0.835	S	S	*	*			trans	-45.7	138.5	165.1	-66.4	-60.1	0	0	0	115.4
12	Q	34.4	Very low	37.3	Very low	194 Å²	194	151.3 Å²	151.3	91%	0.907	81%	0.812	S	S	*	*			trans	-140.5	131.1	149.1	-70.5	-166.7	-4.3	0	0	110.9
13	N	34.5	Very low	37.7	Very low	157 Å²	157	143.8 Å²	143.8	84%	0.84	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-59.2	154	175.6	-93.8	-30.8	0	0	0	113.4
14	P	37.4	Very low	37.8	Very low	122 Å²	122	141 Å²	141	79%	0.792	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-82.4	131.8	169.8	31.5	-30.3	0	0	0	112.5
15	E	33.4	Very low	38.1	Very low	194 Å²	194	141.8 Å²	141.8	91%	0.907	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-72.2	130.3	174.2	-70.4	-178.5	145.3	0	0	112.4
16	T	40.6	Very low	37.7	Very low	133 Å²	133	142.9 Å²	142.9	82%	0.816	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-80.7	143	164.8	27.1	0	0	0	0	112
17	P	41.1	Very low	37.8	Very low	115 Å²	115	142.3 Å²	142.3	75%	0.747	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-78.7	155.9	176	31.5	-32.9	0	0	0	112.7
18	P	40.9	Very low	38.2	Very low	128 Å²	128	141.8 Å²	141.8	83%	0.831	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-82.4	144.9	-170.3	31.4	-32.8	0	0	0	113.9
19	I	40.8	Very low	38.6	Very low	171 Å²	171	136.2 Å²	136.2	88%	0.877	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-82.3	124	174.9	-63.3	167.2	0	0	0	109
20	L	40	Very low	38.9	Very low	150 Å²	150	138.4 Å²	138.4	79%	0.785	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-81.4	145.4	173.5	-80.8	159.5	0	0	0	111.6
21	S	44.8	Very low	39	Very low	72 Å²	72	141 Å²	141	50%	0.503	75%	0.745	S	S	.	*	P	Polyproline II helix	trans	-91	158.6	-172.7	57.5	0	0	0	0	114.3	S23	S21-S23 VanDerWaalsContact C-N 3.3Å; S21-S23 PolarHBondContact O-N 2.77Å; S21-S23 VanDerWaalsContact O-N 3.16Å
22	P	38.6	Very low	39.1	Very low	111 Å²	111	136.5 Å²	136.5	72%	0.721	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-75.3	-3	-164.4	-16.1	31.8	0	0	0	116.5
23	S	42.1	Very low	39.2	Very low	92 Å²	92	137.2 Å²	137.2	64%	0.643	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-89.5	-3.4	-171.6	53.9	0	0	0	0	114.7	S21	S21-S23 VanDerWaalsContact C-N 3.3Å; S21-S23 PolarHBondContact O-N 2.77Å; S21-S23 VanDerWaalsContact O-N 3.16Å
24	Q	41.6	Very low	39	Very low	129 Å²	129	140.8 Å²	140.8	60%	0.603	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-101.7	-5.3	179.2	-67.7	-174.1	-20.8	0	0	114.3
25	Q	41.7	Very low	38.9	Very low	150 Å²	150	140.5 Å²	140.5	70%	0.701	72%	0.722	S	S	*	*	S	Bend	trans	-87.3	-19.7	178.4	-79.9	178.4	-29.7	0	0	114.3	S29	Q25-S29 PolarHBondContact O-OG 3.2Å
26	E	40.2	Very low	38.8	Very low	144 Å²	144	139.4 Å²	139.4	67%	0.673	72%	0.716	S	S	*	*	H	α-helix	trans	-81.3	-23.3	-176.8	-75.2	-167.6	135	0	0	114.5
27	S	38.4	Very low	38.5	Very low	83 Å²	83	141.8 Å²	141.8	58%	0.58	72%	0.718	S	S	*	*	H	α-helix	trans	-80.9	-21.9	-177.7	43.2	0	0	0	0	113.5
28	Q	40.5	Very low	38	Very low	156 Å²	156	140.8 Å²	140.8	73%	0.729	71%	0.714	S	S	*	*	H	α-helix	trans	-83.3	-30.8	173.4	-67.8	-174.9	-3	0	0	112.5	R30 R31	Q28-R30 VanDerWaalsContact C-N 3.35Å; Q28-R30 PolarHBondContact O-N 2.74Å; Q28-R31 PolarHBondContact O-N 3.21Å
29	S	40.2	Very low	37.6	Very low	76 Å²	76	143.3 Å²	143.3	53%	0.531	72%	0.717	S	S	.	*	H	α-helix	trans	-70.8	-24.3	179.6	-65.9	0	0	0	0	114.2	Q25	Q25-S29 PolarHBondContact O-OG 3.2Å
30	R	38.7	Very low	36.9	Very low	208 Å²	208	140.9 Å²	140.9	79%	0.785	72%	0.715	S	S	*	*	H	α-helix	trans	-80.9	-19.5	176.8	-72	-174.3	179.6	-166.9	1.4	114	Q28	Q28-R30 VanDerWaalsContact C-N 3.35Å; Q28-R30 PolarHBondContact O-N 2.74Å
31	R	35.4	Very low	36.2	Very low	217 Å²	217	139.1 Å²	139.1	82%	0.819	72%	0.716	S	S	*	*	H	α-helix	trans	-87	-23.4	-179.7	-147.5	173.4	-175.9	-179.5	0.1	112.7	Q28	Q28-R31 PolarHBondContact O-N 3.21Å
32	A	35.4	Very low	35.4	Very low	64 Å²	64	141.8 Å²	141.8	53%	0.529	73%	0.734	S	S	.	*	H	α-helix	trans	-79.3	-27.4	175.8	0	0	0	0	0	113.9	R34	A32-R34 VanDerWaalsContact C-N 3.33Å; A32-R34 PolarHBondContact O-N 2.88Å
33	R	36	Very low	35	Very low	210 Å²	210	144.8 Å²	144.8	79%	0.792	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-3.8	-177.8	-79.2	-173.3	-179.9	-163.8	0.8	115.8
34	R	31.1	Very low	34.6	Very low	232 Å²	232	146 Å²	146	88%	0.875	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-6.1	-178.9	-124.2	179.9	-175.2	-160	1	114	A32	A32-R34 VanDerWaalsContact C-N 3.33Å; A32-R34 PolarHBondContact O-N 2.88Å
35	T	34.5	Very low	33.9	Very low	115 Å²	115	144.7 Å²	144.7	71%	0.706	76%	0.761	S	S	*	*	S	Bend	trans	-105.6	-3.3	-173.7	-15	0	0	0	0	113.7
36	E	32	Very low	33.3	Very low	171 Å²	171	146.8 Å²	146.8	80%	0.799	77%	0.77	S	S	*	*	S	Bend	trans	-104.4	4.1	-176.9	-69.4	-175.4	155.9	0	0	114.3
37	Q	33.6	Very low	32.6	Very low	183 Å²	183	147.8 Å²	147.8	86%	0.855	78%	0.78	S	S	*	*	S	Bend	trans	-107.8	15.9	-173.6	-106.1	179	-1.3	0	0	115.9
38	S	31.7	Very low	32.1	Very low	95 Å²	95	153.7 Å²	153.7	66%	0.664	80%	0.796	S	S	*	*	S	Bend	trans	-118.3	16.5	-177	89.2	0	0	0	0	117
39	M	32.8	Very low	31.6	Very low	181 Å²	181	154.8 Å²	154.8	89%	0.892	80%	0.803	S	S	*	*			trans	-143.7	76.3	176.6	-72.5	-91.1	90.8	0	0	111.2
40	S	26.7	Very low	31	Very low	119 Å²	119	159.3 Å²	159.3	83%	0.832	82%	0.821	S	S	*	*			trans	-159	100	156.9	51.3	0	0	0	0	111.5
41	S	25	Very low	30.8	Very low	114 Å²	114	158.4 Å²	158.4	80%	0.797	82%	0.823	S	S	*	*			trans	-162.2	96.6	153.2	52.9	0	0	0	0	110.1
42	S	27.7	Very low	30.5	Very low	128 Å²	128	157.5 Å²	157.5	90%	0.895	83%	0.828	S	S	*	*			trans	-164.9	121.6	146.4	-52.4	0	0	0	0	109.5
43	L	29.6	Very low	30.4	Very low	173 Å²	173	164 Å²	164	91%	0.906	84%	0.844	S	S	*	*			trans	-102.8	169.1	167	-91.2	171.1	0	0	0	109.2
44	P	33.5	Very low	30	Very low	117 Å²	117	161.8 Å²	161.8	76%	0.76	85%	0.847	S	S	*	*			trans	-102.2	157.6	-131.3	38.7	-35.8	0	0	0	114.2
45	A	26.5	Very low	29.8	Very low	103 Å²	103	161.5 Å²	161.5	85%	0.851	85%	0.846	S	S	*	*			trans	-118.4	134.6	167.5	0	0	0	0	0	111.2
46	Q	29.2	Very low	29.6	Very low	193 Å²	193	161.9 Å²	161.9	90%	0.902	85%	0.85	S	S	*	*			trans	-73.7	145.9	-170.4	-72.8	150.1	-44.4	0	0	113.7
47	N	26.5	Very low	29.4	Very low	166 Å²	166	163 Å²	163	89%	0.888	86%	0.856	S	S	*	*			trans	-61.4	130.9	167.2	-84.6	-30.3	0	0	0	112.2
48	K	27.4	Very low	29.4	Very low	207 Å²	207	162 Å²	162	90%	0.9	85%	0.854	S	S	*	*			trans	-134	124.9	149.6	-88.4	-173.1	175.7	-179.6	0	109.5
49	M	29.5	Very low	29.5	Very low	178 Å²	178	162.6 Å²	162.6	88%	0.877	86%	0.856	S	S	*	*			trans	-65.9	135.8	167.2	-76.1	163.3	55.4	0	0	109.6
50	D	27.6	Very low	29.7	Very low	171 Å²	171	159.9 Å²	159.9	91%	0.914	85%	0.852	S	S	*	*			trans	-142.2	136.5	154	-117.3	-32.2	0	0	0	111.8
51	K	35.6	Very low	30.2	Very low	190 Å²	190	166.1 Å²	166.1	83%	0.826	86%	0.858	S	S	*	*			trans	-89.4	129.2	179.4	-76.8	174.9	173.2	174.5	0	108.9
52	Q	29.3	Very low	30.9	Very low	198 Å²	198	166.7 Å²	166.7	93%	0.925	86%	0.856	S	S	*	*			trans	-153.4	122.1	154.2	-120	167.7	14	0	0	112.8
53	K	33.2	Very low	31.7	Very low	199 Å²	199	163.9 Å²	163.9	87%	0.865	84%	0.836	S	S	*	*			trans	-83.5	135	163.3	-85.2	175.4	169.1	179.3	0	108.1
54	L	27.7	Very low	32.4	Very low	164 Å²	164	164.8 Å²	164.8	86%	0.859	83%	0.833	S	S	*	*			trans	179.1	125.4	137	-100	142.4	0	0	0	114
55	R	26.7	Very low	33.4	Very low	226 Å²	226	162.1 Å²	162.1	85%	0.853	82%	0.817	S	S	*	*			trans	59	141.8	149.2	-102.1	179.9	179.4	-169.3	-0.2	123
56	P	30.4	Very low	34.8	Very low	123 Å²	123	159 Å²	159	80%	0.799	79%	0.789	S	S	*	*			trans	-83.7	141.1	173.3	3.7	15.5	0	0	0	112.9
57	E	26.8	Very low	36.1	Very low	194 Å²	194	152 Å²	152	91%	0.907	77%	0.765	S	S	*	*			trans	-80.7	148.5	175.1	-66.6	-162.7	154	0	0	113.3
58	I	34.7	Very low	37.6	Very low	162 Å²	162	151.4 Å²	151.4	83%	0.831	76%	0.756	S	S	*	*			trans	-108.6	131.1	173.1	-61.2	166.7	0	0	0	107.7
59	P	32.8	Very low	39	Very low	108 Å²	108	148.9 Å²	148.9	70%	0.701	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-77.5	150.8	177.3	29.2	-31.2	0	0	0	112.6
60	P	37.6	Very low	40.6	Very low	125 Å²	125	144.9 Å²	144.9	81%	0.812	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-80.8	137.5	-171	32.7	-32.8	0	0	0	112.2
61	R	37.2	Very low	42.7	Very low	250 Å²	250	138.5 Å²	138.5	94%	0.943	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-83.7	122.8	170.7	-81.9	-178	170.4	-174.1	-2.5	110.8
62	V	39	Very low	44.2	Very low	125 Å²	125	138.5 Å²	138.5	76%	0.758	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-80.5	132.9	170.2	-175	0	0	0	0	109.9
63	S	44.8	Very low	46.5	Very low	70 Å²	70	134.6 Å²	134.6	49%	0.49	67%	0.672	S	S	.	*	P	Polyproline II helix	trans	-73.5	143.8	-177.4	79.8	0	0	0	0	113.4	S65 S66	S63-S65 PolarHBondContact O-N 3.14Å; S63-S65 PolarHBondContact OG-OG 3.1Å; S63-S66 PolarHBondContact O-N 3Å; S63-S66 VanDerWaalsContact O-N 3.15Å
64	K	44.6	Very low	49	Very low	191 Å²	191	125.9 Å²	125.9	83%	0.83	64%	0.635	S	S	*	*	H	α-helix	trans	-56.5	-20.2	-177.8	-70.2	-179	176.2	-178.4	0	115.3	S66	K64-S66 VanDerWaalsContact C-N 3.28Å; K64-S66 PolarHBondContact O-N 2.98Å
65	S	54.4	Low	51.7	Low	61 Å²	61	120.2 Å²	120.2	43%	0.427	61%	0.607	S	S	.	*	H	α-helix	trans	-73.1	-16.6	179.3	79.8	0	0	0	0	114.2	S63 R69	S63-S65 PolarHBondContact O-N 3.14Å; S63-S65 PolarHBondContact OG-OG 3.1Å; S65-R69 PolarHBondContact O-NE 3.31Å; S65-R69 PolarHBondContact O-NH2 3.01Å; S65-R69 PolarHBondContact OG-NH2 3.04Å
66	S	54.8	Low	54.6	Low	38 Å²	38	109.5 Å²	109.5	27%	0.266	57%	0.567	S	S	.	*	H	α-helix	trans	-88.4	-36.7	-178.2	-51.7	0	0	0	0	111.9	S63 K64 R69 L70	S63-S66 PolarHBondContact O-N 3Å; S63-S66 VanDerWaalsContact O-N 3.15Å; K64-S66 VanDerWaalsContact C-N 3.28Å; K64-S66 PolarHBondContact O-N 2.98Å; S66-R69 PolarHBondContact O-N 3.32Å; S66-L70 VanDerWaalsContact O-CD1 3.22Å; S66-L70 WeakPolarHBondContact O-CD1 3.46Å; S66-L70 PolarHBondContact O-N 3.38Å
67	A	58.3	Low	57.2	Low	47 Å²	47	106.4 Å²	106.4	39%	0.388	55%	0.548	S	S	.	.	H	α-helix	trans	-65.8	-39.8	-179.3	0	0	0	0	0	113.1	R69 L70 S71	A67-R69 VanDerWaalsContact C-N 3.28Å; A67-R69 PolarHBondContact O-N 2.7Å; A67-L70 PolarHBondContact O-N 2.88Å; A67-S71 PolarHBondContact O-N 3.27Å; A67-S71 VanDerWaalsContact O-N 3.08Å
68	Q	56.2	Low	60	Low	153 Å²	153	100.1 Å²	100.1	72%	0.715	52%	0.52	S	S	*	.	H	α-helix	trans	-69	-23.9	176.6	-74.4	176.1	-23.9	0	0	113.6	S71	Q68-S71 PolarHBondContact O-OG 2.79Å
69	R	58.5	Low	62.3	Low	153 Å²	153	94.7 Å²	94.7	58%	0.577	50%	0.496	S	S	*	.	H	α-helix	trans	-77.2	-42.7	174.1	-78.5	-177.8	-83.1	171.7	-5.8	111.2	S65 S66 A67 S71 R72	S65-R69 PolarHBondContact O-NE 3.31Å; S65-R69 PolarHBondContact O-NH2 3.01Å; S65-R69 PolarHBondContact OG-NH2 3.04Å; S66-R69 PolarHBondContact O-N 3.32Å; A67-R69 VanDerWaalsContact C-N 3.28Å; A67-R69 PolarHBondContact O-N 2.7Å; R69-S71 VanDerWaalsContact C-N 3.33Å; R69-S71 PolarHBondContact O-N 3.44Å; R69-R72 PolarHBondContact O-N 3.46Å
70	L	63.3	Low	64.6	Low	94 Å²	94	95.9 Å²	95.9	49%	0.492	50%	0.496	S	S	.	.	H	α-helix	trans	-64.7	-33.5	175.4	-90	90.3	0	0	0	113.1	S66 A67 R72 D73 L74 Y143	S66-L70 VanDerWaalsContact O-CD1 3.22Å; S66-L70 WeakPolarHBondContact O-CD1 3.46Å; S66-L70 PolarHBondContact O-N 3.38Å; A67-L70 PolarHBondContact O-N 2.88Å; L70-R72 VanDerWaalsContact C-N 3.28Å; L70-R72 PolarHBondContact O-N 3.19Å; L70-D73 PolarHBondContact O-N 3.09Å; L70-L74 WeakPolarHBondContact O-CG 3.33Å; L70-L74 PolarHBondContact O-N 3.07Å; L70-Y143 HydrophobicContact CB-CE2 4.42Å
71	S	70.3	Confident	66.8	Low	38 Å²	38	94.3 Å²	94.3	27%	0.266	48%	0.481	S	S	.	.	H	α-helix	trans	-60.6	-37.8	179.8	82.7	0	0	0	0	112.4	A67 Q68 R69 D73 L74 T75 Y143	A67-S71 PolarHBondContact O-N 3.27Å; A67-S71 VanDerWaalsContact O-N 3.08Å; Q68-S71 PolarHBondContact O-OG 2.79Å; R69-S71 VanDerWaalsContact C-N 3.33Å; R69-S71 PolarHBondContact O-N 3.44Å; S71-D73 VanDerWaalsContact C-N 3.34Å; S71-L74 PolarHBondContact O-N 3.3Å; S71-T75 VanDerWaalsContact O-CG2 3.26Å; S71-T75 WeakPolarHBondContact O-CG2 3.29Å; S71-T75 PolarHBondContact O-N 2.95Å; S71-Y143 VanDerWaalsContact CB-OH 3.3Å; S71-Y143 WeakPolarHBondContact CB-OH 3.48Å
72	R	68.1	Low	69	Low	189 Å²	189	84.7 Å²	84.7	71%	0.713	45%	0.447	S	S	*	.	H	α-helix	trans	-70	-31.7	-179.8	-165.1	177.2	68.4	178.2	2.7	112.5	R69 L70 L74 T75	R69-R72 PolarHBondContact O-N 3.46Å; L70-R72 VanDerWaalsContact C-N 3.28Å; L70-R72 PolarHBondContact O-N 3.19Å; R72-L74 PolarHBondContact O-N 2.92Å; R72-T75 PolarHBondContact O-OG1 3.48Å
73	D	77.6	Confident	71.2	Confident	117 Å²	117	79.7 Å²	79.7	63%	0.626	42%	0.416	S	S	*	.	H	α-helix	trans	-78.5	-11	178.7	-61.3	-19.8	0	0	0	112.1	L70 S71	L70-D73 PolarHBondContact O-N 3.09Å; S71-D73 VanDerWaalsContact C-N 3.34Å
74	L	84.8	Confident	73.1	Confident	15 Å²	15	83.6 Å²	83.6	8%	0.079	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	8.1	178.5	-63.6	178.3	0	0	0	113.7	L70 S71 R72 L82 F83 I139 V140 Y143	L70-L74 WeakPolarHBondContact O-CG 3.33Å; L70-L74 PolarHBondContact O-N 3.07Å; S71-L74 PolarHBondContact O-N 3.3Å; R72-L74 PolarHBondContact O-N 2.92Å; L74-L82 HydrophobicContact CB-CD2 3.76Å; L74-L82 WeakPolarHBondContact O-CA 3.21Å; L74-F83 WeakPolarHBondContact O-CD2 3.44Å; L74-F83 PolarHBondContact O-N 2.92Å; L74-I139 HydrophobicContact CD1-CG2 3.97Å; L74-I139 HydrophobicContact CD2-CB 4.46Å; L74-I139 HydrophobicContact CD2-CG2 3.66Å; L74-I139 HydrophobicContact CG-CG2 4.46Å; L74-V140 HydrophobicContact CB-CG2 4.15Å; L74-V140 HydrophobicContact CD2-CG2 4.14Å; L74-Y143 HydrophobicContact CD1-CD1 4.4Å; L74-Y143 HydrophobicContact CD1-CD2 4.14Å; L74-Y143 HydrophobicContact CD1-CG 3.89Å
75	T	85	Confident	75.2	Confident	46 Å²	46	81.5 Å²	81.5	28%	0.282	42%	0.417	S	S	.	.	B	Isolated β-bridge	trans	-96.4	139.4	178.3	49.3	0	0	0	0	113	S71 R72 D81 L82 F83	S71-T75 VanDerWaalsContact O-CG2 3.26Å; S71-T75 WeakPolarHBondContact O-CG2 3.29Å; S71-T75 PolarHBondContact O-N 2.95Å; R72-T75 PolarHBondContact O-OG1 3.48Å; T75-D81 CarbonylContact C-O 3.57Å; T75-D81 WeakPolarHBondContact CA-O 3.26Å; T75-L82 HydrophobicContact CG2-CD2 4.36Å; T75-F83 VanDerWaalsContact O-CZ 3.29Å; T75-F83 WeakPolarHBondContact O-CZ 3.27Å
76	C	87.9	Confident	77	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	40%	0.398	C	S	.	.			trans	-74.5	127.3	173.1	177.2	0	0	0	0	110.7	I78 C79 L80 D81 F83 C96	C76-I78 PolarHBondContact O-N 3.23Å; C76-I78 VanDerWaalsContact O-N 3.08Å; C76-C79 VanDerWaalsContact CB-SG 3.55Å; C76-L80 WeakPolarHBondContact O-CA 2.83Å; C76-L80 PolarHBondContact O-N 2.91Å; C76-D81 PolarHBondContact N-O 2.97Å; C76-F83 HydrophobicContact CB-CD1 3.65Å; C76-F83 HydrophobicContact CB-CE1 3.63Å; C76-C96 VanDerWaalsContact CB-SG 3.55Å
77	S	84.7	Confident	78.7	Confident	59 Å²	59	77 Å²	77	41%	0.413	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-2.5	-177.9	78.8	0	0	0	0	114.7	F95	S77-F95 WeakPolarHBondContact OG-CE1 3.27Å
78	I	84.6	Confident	80.4	Confident	62 Å²	62	75.7 Å²	75.7	32%	0.318	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-54.5	177.6	-58.5	169.3	0	0	0	110.6	C76 F95 C99 I100 P119	C76-I78 PolarHBondContact O-N 3.23Å; C76-I78 VanDerWaalsContact O-N 3.08Å; I78-F95 HydrophobicContact CD1-CB 4.23Å; I78-F95 HydrophobicContact CD1-CD1 3.58Å; I78-F95 HydrophobicContact CD1-CE1 4.25Å; I78-F95 HydrophobicContact CD1-CG 4.06Å; I78-F95 HydrophobicContact CG1-CD1 3.8Å; I78-F95 HydrophobicContact CG1-CE1 4.23Å; I78-C99 HydrophobicContact CB-CB 3.88Å; I78-C99 HydrophobicContact CD1-CB 3.75Å; I78-C99 HydrophobicContact CG1-CB 4.42Å; I78-C99 HydrophobicContact CG2-CB 3.87Å; I78-I100 HydrophobicContact CD1-CD1 4.49Å; I78-P119 HydrophobicContact CD1-CG 3.98Å; I78-P119 HydrophobicContact CG1-CG 4.37Å
79	C	84.6	Confident	82	Confident	47 Å²	47	68.6 Å²	68.6	32%	0.318	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-10.3	179.2	62.2	0	0	0	0	113.6	C76 D81 C99	C76-C79 VanDerWaalsContact CB-SG 3.55Å; C79-D81 PolarHBondContact O-N 3.44Å; C79-D81 VanDerWaalsContact O-N 3.11Å; C79-C99 VanDerWaalsContact SG-SG 3.69Å
80	L	81.3	Confident	83.4	Confident	133 Å²	133	64.9 Å²	64.9	70%	0.696	34%	0.336	S	S	*	.			trans	61.8	10.4	-177.9	-51	179	0	0	0	114.9	C76	C76-L80 WeakPolarHBondContact O-CA 2.83Å; C76-L80 PolarHBondContact O-N 2.91Å
81	D	82.1	Confident	84.6	Confident	93 Å²	93	61.4 Å²	61.4	50%	0.497	32%	0.32	S	S	.	.	S	Bend	trans	-100.9	166.7	174.4	-69.1	-37.1	0	0	0	111.9	T75 C76 C79	T75-D81 CarbonylContact C-O 3.57Å; T75-D81 WeakPolarHBondContact CA-O 3.26Å; C76-D81 PolarHBondContact N-O 2.97Å; C79-D81 PolarHBondContact O-N 3.44Å; C79-D81 VanDerWaalsContact O-N 3.11Å
82	L	83.7	Confident	85.4	Confident	47 Å²	47	66.1 Å²	66.1	25%	0.246	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-53.5	143.9	171.4	-67.9	173.9	0	0	0	111.6	L74 T75 K84 V140 Y143	L74-L82 HydrophobicContact CB-CD2 3.76Å; L74-L82 WeakPolarHBondContact O-CA 3.21Å; T75-L82 HydrophobicContact CG2-CD2 4.36Å; L82-K84 PolarHBondContact O-N 2.79Å; L82-V140 HydrophobicContact CB-CG1 4.1Å; L82-Y143 HydrophobicContact CD1-CD1 4.03Å; L82-Y143 HydrophobicContact CD1-CE1 4.07Å; L82-Y143 HydrophobicContact CD2-CD1 4.31Å; L82-Y143 HydrophobicContact CD2-CE1 4.25Å
83	F	85.8	Confident	86.6	Confident	20 Å²	20	59.5 Å²	59.5	9%	0.088	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-59.6	124.2	-176.6	-67	-70.3	0	0	0	112.9	L74 T75 C76 P86 T94 V136 V140	L74-F83 WeakPolarHBondContact O-CD2 3.44Å; L74-F83 PolarHBondContact O-N 2.92Å; T75-F83 VanDerWaalsContact O-CZ 3.29Å; T75-F83 WeakPolarHBondContact O-CZ 3.27Å; C76-F83 HydrophobicContact CB-CD1 3.65Å; C76-F83 HydrophobicContact CB-CE1 3.63Å; F83-P86 HydrophobicContact CB-CB 3.82Å; F83-P86 HydrophobicContact CB-CG 4.1Å; F83-P86 HydrophobicContact CD1-CB 4.38Å; F83-P86 HydrophobicContact CG-CB 4.13Å; F83-T94 HydrophobicContact CD1-CG2 4.28Å; F83-T94 HydrophobicContact CE1-CG2 4.09Å; F83-T94 WeakPolarHBondContact CE1-O 3.41Å; F83-T94 HydrophobicContact CZ-CG2 4.25Å; F83-T94 WeakPolarHBondContact CZ-O 3.31Å; F83-V136 HydrophobicContact CB-CG1 4.36Å; F83-V136 HydrophobicContact CD2-CG1 3.59Å; F83-V136 HydrophobicContact CE2-CG1 4.19Å; F83-V136 HydrophobicContact CG-CG1 4.18Å; F83-V140 HydrophobicContact CB-CG2 4.17Å; F83-V140 HydrophobicContact CD2-CG2 4.48Å
84	K	85.2	Confident	87.2	Confident	153 Å²	153	55 Å²	55	67%	0.665	30%	0.295	S	S	*	.	S	Bend	trans	-108.2	119.7	170	-64.4	177.6	-175.9	173.4	0	108.4	L82 C96	L82-K84 PolarHBondContact O-N 2.79Å; K84-C96 PolarHBondContact N-SG 3.03Å; K84-C96 WeakPolarHBondContact O-CA 3.32Å; K84-C96 VanDerWaalsContact O-CB 3.25Å; K84-C96 WeakPolarHBondContact O-CB 3.36Å
85	Q	88.2	Confident	87.6	Confident	146 Å²	146	54.2 Å²	54.2	68%	0.682	29%	0.291	S	S	*	.	S	Bend	trans	47.3	64.4	-171.7	-65.4	175.4	-26.9	0	0	111.3	V87 E97	Q85-V87 PolarHBondContact O-N 3.06Å; Q85-E97 HydrophobicContact CB-CB 4.27Å; Q85-E97 PolarHBondContact O-N 2.76Å
86	P	91.5	Very high	87.9	Confident	4 Å²	4	52.3 Å²	52.3	3%	0.026	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	132.8	-178.2	19.4	-28.1	0	0	0	111.3	F83 T94 F95 N133 V136 A137	F83-P86 HydrophobicContact CB-CB 3.82Å; F83-P86 HydrophobicContact CB-CG 4.1Å; F83-P86 HydrophobicContact CD1-CB 4.38Å; F83-P86 HydrophobicContact CG-CB 4.13Å; P86-T94 HydrophobicContact CB-CG2 3.56Å; P86-F95 CarbonylContact C-O 3.57Å; P86-F95 WeakPolarHBondContact CA-O 3.3Å; P86-N133 HydrophobicContact CB-CB 4.47Å; P86-N133 PolarHBondContact O-N 2.88Å; P86-V136 HydrophobicContact CB-CB 4.09Å; P86-V136 HydrophobicContact CB-CG1 3.88Å; P86-V136 HydrophobicContact CG-CB 3.94Å; P86-V136 HydrophobicContact CG-CG1 3.89Å; P86-A137 HydrophobicContact CG-CB 3.77Å
87	V	91.7	Very high	88.1	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.006	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.1	172.7	-60.5	0	0	0	0	109.3	Q85 T94 F95 E97 I100 Y130 R131	Q85-V87 PolarHBondContact O-N 3.06Å; V87-T94 WeakPolarHBondContact O-CA 3.39Å; V87-F95 PolarHBondContact N-O 2.66Å; V87-F95 PolarHBondContact O-N 3.11Å; V87-E97 HydrophobicContact CG1-CB 3.85Å; V87-E97 HydrophobicContact CG1-CG 4.21Å; V87-E97 HydrophobicContact CG2-CB 4.44Å; V87-I100 HydrophobicContact CG2-CG2 3.61Å; V87-Y130 HydrophobicContact CB-CD2 3.62Å; V87-Y130 HydrophobicContact CB-CE2 4.35Å; V87-Y130 HydrophobicContact CB-CG 3.98Å; V87-Y130 HydrophobicContact CG1-CD2 3.49Å; V87-Y130 VanDerWaalsContact CG1-CD2 3.49Å; V87-Y130 HydrophobicContact CG1-CE2 3.76Å; V87-Y130 HydrophobicContact CG1-CG 4.31Å; V87-Y130 HydrophobicContact CG2-CD2 3.98Å; V87-Y130 HydrophobicContact CG2-CG 3.95Å; V87-R131 CarbonylContact C-O 3.59Å; V87-R131 VanDerWaalsContact CA-O 3.31Å; V87-R131 WeakPolarHBondContact CA-O 3.32Å
88	S	93.1	Very high	88.3	Confident	19 Å²	19	56 Å²	56	13%	0.133	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	133.9	177.2	-59.1	0	0	0	0	110.3	T94 R131 N133	S88-T94 PolarHBondContact OG-OG1 2.92Å; S88-R131 PolarHBondContact N-O 2.76Å; S88-R131 PolarHBondContact O-N 3.45Å; S88-N133 WeakPolarHBondContact OG-CB 3.38Å; S88-N133 PolarHBondContact OG-ND2 3.47Å
89	L	90.6	Very high	88.4	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.021	30%	0.296	C	S	.	.			trans	-80.6	167.1	172.1	-63.7	-173.5	0	0	0	110.8	C91 D92 H93 F95 I100 W104 C118 F125	L89-C91 PolarHBondContact O-N 3.32Å; L89-D92 WeakPolarHBondContact O-CA 3.47Å; L89-D92 PolarHBondContact O-N 2.72Å; L89-H93 PolarHBondContact N-O 3.4Å; L89-F95 HydrophobicContact CD1-CD2 4.07Å; L89-F95 HydrophobicContact CD1-CE2 3.75Å; L89-F95 HydrophobicContact CG-CD2 4.18Å; L89-F95 HydrophobicContact CG-CE2 4.2Å; L89-I100 HydrophobicContact CD1-CD1 4.01Å; L89-I100 HydrophobicContact CD1-CG1 4.3Å; L89-I100 HydrophobicContact CD2-CG1 4.11Å; L89-W104 HydrophobicContact CD1-CZ2 4.29Å; L89-W104 HydrophobicContact CD2-CH2 3.56Å; L89-W104 HydrophobicContact CD2-CZ2 3.5Å; L89-C118 HydrophobicContact CD1-CB 3.85Å; L89-F125 HydrophobicContact CB-CE2 4.31Å; L89-F125 HydrophobicContact CD1-CE2 4.33Å
90	P	87.2	Confident	88.5	Confident	75 Å²	75	51.9 Å²	51.9	49%	0.487	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-3.4	176.9	-19.8	31.7	0	0	0	115.4	F125	P90-F125 HydrophobicContact CB-CD1 3.8Å; P90-F125 HydrophobicContact CB-CE1 3.65Å; P90-F125 HydrophobicContact CB-CZ 4.34Å; P90-F125 HydrophobicContact CG-CD1 3.83Å; P90-F125 HydrophobicContact CG-CE1 4.06Å; P90-F125 HydrophobicContact CG-CG 4.15Å
91	C	89.4	Confident	88.8	Confident	22 Å²	22	48.1 Å²	48.1	15%	0.149	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	14.9	167.2	61	0	0	0	0	113.2	L89 H93 C121 K123 F125	L89-C91 PolarHBondContact O-N 3.32Å; C91-H93 PolarHBondContact O-N 3.34Å; C91-H93 PolarHBondContact O-ND1 2.85Å; C91-H93 PolarHBondContact SG-ND1 2.84Å; C91-H93 VanDerWaalsContact SG-ND1 3.35Å; C91-C121 VanDerWaalsContact SG-SG 3.6Å; C91-K123 HydrophobicContact CB-CD 4.24Å; C91-F125 HydrophobicContact CB-CE1 4.3Å; C91-F125 HydrophobicContact CB-CZ 3.67Å
92	D	87.3	Confident	88.9	Confident	136 Å²	136	47.6 Å²	47.6	73%	0.727	27%	0.267	S	S	*	.	S	Bend	trans	64.4	-2.4	177.2	-52.2	-48.5	0	0	0	116.7	L89	L89-D92 WeakPolarHBondContact O-CA 3.47Å; L89-D92 PolarHBondContact O-N 2.72Å
93	H	91.4	Very high	88.8	Confident	50 Å²	50	49 Å²	49	23%	0.231	27%	0.269	C	S	.	.			trans	-64.7	135.1	166	-65.9	108.1	0	0	0	111.2	L89 C91 F95 Q120	L89-H93 PolarHBondContact N-O 3.4Å; C91-H93 PolarHBondContact O-N 3.34Å; C91-H93 PolarHBondContact O-ND1 2.85Å; C91-H93 PolarHBondContact SG-ND1 2.84Å; C91-H93 VanDerWaalsContact SG-ND1 3.35Å; H93-F95 HydrophobicContact CB-CE2 3.6Å; H93-F95 HydrophobicContact CB-CZ 3.83Å; H93-Q120 PolarHBondContact CD2-NE2 3.4Å; H93-Q120 PolarHBondContact CD2-OE1 3.23Å
94	T	91.7	Very high	88.7	Confident	22 Å²	22	49 Å²	49	14%	0.135	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.2	-174	-59.2	0	0	0	0	110.3	F83 P86 V87 S88 V136	F83-T94 HydrophobicContact CD1-CG2 4.28Å; F83-T94 HydrophobicContact CE1-CG2 4.09Å; F83-T94 WeakPolarHBondContact CE1-O 3.41Å; F83-T94 HydrophobicContact CZ-CG2 4.25Å; F83-T94 WeakPolarHBondContact CZ-O 3.31Å; P86-T94 HydrophobicContact CB-CG2 3.56Å; V87-T94 WeakPolarHBondContact O-CA 3.39Å; S88-T94 PolarHBondContact OG-OG1 2.92Å; T94-V136 HydrophobicContact CG2-CG1 4.41Å
95	F	92.3	Very high	88.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	162	-179.2	-55.8	-81.9	0	0	0	109.7	S77 I78 P86 V87 L89 H93 I100 P119 Q120	S77-F95 WeakPolarHBondContact OG-CE1 3.27Å; I78-F95 HydrophobicContact CD1-CB 4.23Å; I78-F95 HydrophobicContact CD1-CD1 3.58Å; I78-F95 HydrophobicContact CD1-CE1 4.25Å; I78-F95 HydrophobicContact CD1-CG 4.06Å; I78-F95 HydrophobicContact CG1-CD1 3.8Å; I78-F95 HydrophobicContact CG1-CE1 4.23Å; P86-F95 CarbonylContact C-O 3.57Å; P86-F95 WeakPolarHBondContact CA-O 3.3Å; V87-F95 PolarHBondContact N-O 2.66Å; V87-F95 PolarHBondContact O-N 3.11Å; L89-F95 HydrophobicContact CD1-CD2 4.07Å; L89-F95 HydrophobicContact CD1-CE2 3.75Å; L89-F95 HydrophobicContact CG-CD2 4.18Å; L89-F95 HydrophobicContact CG-CE2 4.2Å; H93-F95 HydrophobicContact CB-CE2 3.6Å; H93-F95 HydrophobicContact CB-CZ 3.83Å; F95-I100 HydrophobicContact CB-CB 4.05Å; F95-I100 HydrophobicContact CD2-CD1 4.18Å; F95-I100 HydrophobicContact CD2-CG1 4.47Å; F95-I100 HydrophobicContact CG-CD1 4.47Å; F95-P119 HydrophobicContact CE1-CB 4.25Å; F95-P119 HydrophobicContact CE1-CG 4.18Å; F95-P119 HydrophobicContact CZ-CB 4.36Å; F95-P119 HydrophobicContact CZ-CG 4.19Å; F95-Q120 HydrophobicContact CZ-CB 4.04Å
96	C	92.7	Very high	87.2	Confident	6 Å²	6	40 Å²	40	4%	0.041	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	140.2	166.4	-53.4	0	0	0	0	109.7	C76 K84 A98 C99 I100	C76-C96 VanDerWaalsContact CB-SG 3.55Å; K84-C96 PolarHBondContact N-SG 3.03Å; K84-C96 WeakPolarHBondContact O-CA 3.32Å; K84-C96 VanDerWaalsContact O-CB 3.25Å; K84-C96 WeakPolarHBondContact O-CB 3.36Å; C96-A98 VanDerWaalsContact C-N 3.32Å; C96-A98 PolarHBondContact O-N 3.11Å; C96-C99 HydrophobicContact CB-CB 4.01Å; C96-C99 WeakPolarHBondContact O-CB 2.9Å; C96-C99 PolarHBondContact O-N 3.43Å; C96-I100 PolarHBondContact O-N 2.73Å; C96-I100 VanDerWaalsContact O-N 3.07Å
97	E	91.3	Very high	85.5	Confident	62 Å²	62	46.5 Å²	46.5	29%	0.29	29%	0.287	S	S	.	.	H	α-helix	trans	-52.4	-47.8	-179.8	-177.5	168.4	-164.3	0	0	112.7	Q85 V87 C99 I100 T101 Y130	Q85-E97 HydrophobicContact CB-CB 4.27Å; Q85-E97 PolarHBondContact O-N 2.76Å; V87-E97 HydrophobicContact CG1-CB 3.85Å; V87-E97 HydrophobicContact CG1-CG 4.21Å; V87-E97 HydrophobicContact CG2-CB 4.44Å; E97-C99 VanDerWaalsContact C-N 3.33Å; E97-C99 PolarHBondContact O-N 2.91Å; E97-I100 WeakPolarHBondContact O-CG2 3.22Å; E97-T101 VanDerWaalsContact O-CB 3.28Å; E97-T101 WeakPolarHBondContact O-CB 3.18Å; E97-T101 PolarHBondContact O-N 3.36Å; E97-T101 VanDerWaalsContact O-N 3.08Å; E97-T101 PolarHBondContact O-OG1 3.12Å; E97-Y130 HydrophobicContact CG-CE2 4.01Å; E97-Y130 WeakPolarHBondContact CG-OH 3.47Å; E97-Y130 WeakPolarHBondContact OE1-CE2 3.25Å; E97-Y130 PolarHBondContact OE1-OH 3.41Å
98	A	87.8	Confident	83.6	Confident	75 Å²	75	57.9 Å²	57.9	62%	0.62	33%	0.33	S	S	*	.	H	α-helix	trans	-62.8	-39	177.7	0	0	0	0	0	112.6	C96 S102	C96-A98 VanDerWaalsContact C-N 3.32Å; C96-A98 PolarHBondContact O-N 3.11Å; A98-S102 VanDerWaalsContact O-CB 3.28Å; A98-S102 WeakPolarHBondContact O-CB 3.29Å; A98-S102 PolarHBondContact O-N 3Å
99	C	87.4	Confident	81.8	Confident	22 Å²	22	59 Å²	59	15%	0.149	34%	0.336	C	S	.	.	H	α-helix	trans	-67.3	-45.2	-177.7	-66.8	0	0	0	0	112	I78 C79 C96 E97 Y103	I78-C99 HydrophobicContact CB-CB 3.88Å; I78-C99 HydrophobicContact CD1-CB 3.75Å; I78-C99 HydrophobicContact CG1-CB 4.42Å; I78-C99 HydrophobicContact CG2-CB 3.87Å; C79-C99 VanDerWaalsContact SG-SG 3.69Å; C96-C99 HydrophobicContact CB-CB 4.01Å; C96-C99 WeakPolarHBondContact O-CB 2.9Å; C96-C99 PolarHBondContact O-N 3.43Å; E97-C99 VanDerWaalsContact C-N 3.33Å; E97-C99 PolarHBondContact O-N 2.91Å; C99-Y103 WeakPolarHBondContact O-CB 3.46Å; C99-Y103 PolarHBondContact O-N 3.13Å
100	I	87.1	Confident	80	Confident	0 Å²	0	69 Å²	69	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-73.3	-34	-179.9	-165.8	59.5	0	0	0	112	I78 V87 L89 F95 C96 E97 Y103 W104 P119 Y130	I78-I100 HydrophobicContact CD1-CD1 4.49Å; V87-I100 HydrophobicContact CG2-CG2 3.61Å; L89-I100 HydrophobicContact CD1-CD1 4.01Å; L89-I100 HydrophobicContact CD1-CG1 4.3Å; L89-I100 HydrophobicContact CD2-CG1 4.11Å; F95-I100 HydrophobicContact CB-CB 4.05Å; F95-I100 HydrophobicContact CD2-CD1 4.18Å; F95-I100 HydrophobicContact CD2-CG1 4.47Å; F95-I100 HydrophobicContact CG-CD1 4.47Å; C96-I100 PolarHBondContact O-N 2.73Å; C96-I100 VanDerWaalsContact O-N 3.07Å; E97-I100 WeakPolarHBondContact O-CG2 3.22Å; I100-Y103 HydrophobicContact CD1-CD1 4.24Å; I100-Y103 PolarHBondContact O-N 3.2Å; I100-W104 HydrophobicContact CD1-CZ2 4.27Å; I100-W104 HydrophobicContact CG1-CD2 4.25Å; I100-W104 HydrophobicContact CG1-CH2 4.2Å; I100-W104 HydrophobicContact CG1-CZ2 3.83Å; I100-W104 PolarHBondContact O-N 3.4Å; I100-P119 HydrophobicContact CD1-CG 3.78Å; I100-Y130 HydrophobicContact CG2-CD1 4.36Å
101	T	86.6	Confident	78.4	Confident	54 Å²	54	67.4 Å²	67.4	33%	0.331	37%	0.37	S	S	.	.	H	α-helix	trans	-65.8	-41.4	175.7	-59	0	0	0	0	111.6	E97 S105	E97-T101 VanDerWaalsContact O-CB 3.28Å; E97-T101 WeakPolarHBondContact O-CB 3.18Å; E97-T101 PolarHBondContact O-N 3.36Å; E97-T101 VanDerWaalsContact O-N 3.08Å; E97-T101 PolarHBondContact O-OG1 3.12Å; T101-S105 WeakPolarHBondContact O-CB 3.41Å; T101-S105 PolarHBondContact O-N 2.76Å; T101-S105 PolarHBondContact O-OG 3Å
102	S	84.4	Confident	76.8	Confident	82 Å²	82	74.4 Å²	74.4	57%	0.573	40%	0.4	S	S	*	.	H	α-helix	trans	-65.6	-42.5	174.3	-174.6	0	0	0	0	111.4	A98 W104 S105 G106	A98-S102 VanDerWaalsContact O-CB 3.28Å; A98-S102 WeakPolarHBondContact O-CB 3.29Å; A98-S102 PolarHBondContact O-N 3Å; S102-W104 VanDerWaalsContact C-N 3.34Å; S102-W104 PolarHBondContact O-N 3.47Å; S102-S105 CarbonylContact O-C 3.55Å; S102-S105 PolarHBondContact O-N 2.88Å; S102-G106 PolarHBondContact O-N 3.36Å
103	Y	83	Confident	75.2	Confident	77 Å²	77	73.4 Å²	73.4	30%	0.302	41%	0.411	S	S	.	.	H	α-helix	trans	-58.9	-42.5	177.1	-179.8	-96.8	0	0	0	112.6	C99 I100 S105 V109 P119	C99-Y103 WeakPolarHBondContact O-CB 3.46Å; C99-Y103 PolarHBondContact O-N 3.13Å; I100-Y103 HydrophobicContact CD1-CD1 4.24Å; I100-Y103 PolarHBondContact O-N 3.2Å; Y103-S105 PolarHBondContact O-N 2.97Å; Y103-V109 HydrophobicContact CE1-CG2 4.13Å; Y103-V109 HydrophobicContact CE2-CG2 4.03Å; Y103-P119 HydrophobicContact CD1-CG 3.7Å; Y103-P119 HydrophobicContact CD2-CG 4.13Å; Y103-P119 HydrophobicContact CE1-CB 4.43Å; Y103-P119 HydrophobicContact CE1-CG 3.73Å; Y103-P119 HydrophobicContact CE2-CB 4.29Å; Y103-P119 HydrophobicContact CE2-CG 4.16Å; Y103-P119 HydrophobicContact CG-CG 3.9Å
104	W	83.5	Confident	73.7	Confident	20 Å²	20	73.7 Å²	73.7	8%	0.076	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-7.4	175.4	-66.6	-23.5	0	0	0	115.1	L89 I100 S102 S117 K128 Y130	L89-W104 HydrophobicContact CD1-CZ2 4.29Å; L89-W104 HydrophobicContact CD2-CH2 3.56Å; L89-W104 HydrophobicContact CD2-CZ2 3.5Å; I100-W104 HydrophobicContact CD1-CZ2 4.27Å; I100-W104 HydrophobicContact CG1-CD2 4.25Å; I100-W104 HydrophobicContact CG1-CH2 4.2Å; I100-W104 HydrophobicContact CG1-CZ2 3.83Å; I100-W104 PolarHBondContact O-N 3.4Å; S102-W104 VanDerWaalsContact C-N 3.34Å; S102-W104 PolarHBondContact O-N 3.47Å; W104-S117 VanDerWaalsContact NE1-N 3.18Å; W104-S117 PolarHBondContact NE1-O 3.49Å; W104-K128 HydrophobicContact CB-CD 4.13Å; W104-K128 HydrophobicContact CB-CG 4.48Å; W104-K128 HydrophobicContact CD2-CB 4.45Å; W104-K128 HydrophobicContact CD2-CG 4.15Å; W104-K128 HydrophobicContact CE3-CB 3.58Å; W104-K128 HydrophobicContact CE3-CD 4.03Å; W104-K128 HydrophobicContact CE3-CG 3.68Å; W104-K128 HydrophobicContact CH2-CB 4.45Å; W104-K128 HydrophobicContact CZ3-CB 3.57Å; W104-K128 HydrophobicContact CZ3-CG 4.17Å; W104-K128 PolarHBondContact O-NZ 2.91Å; W104-Y130 AromaticContact CH2-CD1 3.99Å; W104-Y130 HydrophobicContact CH2-CD1 3.99Å; W104-Y130 AromaticContact CZ3-CD1 3.64Å; W104-Y130 HydrophobicContact CZ3-CD1 3.64Å; W104-Y130 HydrophobicContact CZ3-CE1 4.15Å
105	S	75.6	Confident	72.7	Confident	81 Å²	81	73.6 Å²	73.6	57%	0.566	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-6.6	-179.3	-52.6	0	0	0	0	112.4	T101 S102 Y103	T101-S105 WeakPolarHBondContact O-CB 3.41Å; T101-S105 PolarHBondContact O-N 2.76Å; T101-S105 PolarHBondContact O-OG 3Å; S102-S105 CarbonylContact O-C 3.55Å; S102-S105 PolarHBondContact O-N 2.88Å; Y103-S105 PolarHBondContact O-N 2.97Å
106	G	65.8	Low	72	Confident	28 Å²	28	73.6 Å²	73.6	29%	0.289	43%	0.427	S	S	.	.	S	Bend	trans	-79.9	147.1	-178.1	0	0	0	0	0	113.9	S102 R108	S102-G106 PolarHBondContact O-N 3.36Å; G106-R108 PolarHBondContact O-N 3.3Å
107	P	55.8	Low	71.7	Confident	140 Å²	140	73.8 Å²	73.8	91%	0.909	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-3	-173.7	24.4	-32.5	0	0	0	115.4
108	R	51.9	Low	71.6	Confident	241 Å²	241	70.9 Å²	70.9	91%	0.909	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-4.8	-174.1	-67.3	-174.3	-179.2	-177.4	1.1	114.6	G106	G106-R108 PolarHBondContact O-N 3.3Å
109	V	55.1	Low	71.5	Confident	41 Å²	41	68.9 Å²	68.9	25%	0.248	40%	0.396	C	S	.	.			trans	-112.6	107.7	179	-169	0	0	0	0	109	Y103 C111	Y103-V109 HydrophobicContact CE1-CG2 4.13Å; Y103-V109 HydrophobicContact CE2-CG2 4.03Å; V109-C111 HydrophobicContact CG1-CB 4.34Å; V109-C111 WeakPolarHBondContact CG1-SG 3.48Å; V109-C111 PolarHBondContact O-N 3.42Å
110	K	52.9	Low	71.4	Confident	216 Å²	216	73.1 Å²	73.1	94%	0.939	41%	0.414	S	S	*	.			trans	-73	65.3	170.5	-69.3	-175.3	179.6	-179.3	0	109.9
111	C	52.8	Low	71.4	Confident	41 Å²	41	75.9 Å²	75.9	28%	0.277	43%	0.432	S	S	.	.			trans	-79.3	124.5	166.7	-82.1	0	0	0	0	107.8	V109 A113 S115	V109-C111 HydrophobicContact CG1-CB 4.34Å; V109-C111 WeakPolarHBondContact CG1-SG 3.48Å; V109-C111 PolarHBondContact O-N 3.42Å; C111-A113 PolarHBondContact O-N 2.6Å; C111-S115 VanDerWaalsContact CB-O 3.32Å; C111-S115 WeakPolarHBondContact CB-O 3.49Å; C111-S115 WeakPolarHBondContact CB-OG 3.34Å
112	Q	55.5	Low	71.3	Confident	168 Å²	168	83.3 Å²	83.3	79%	0.785	45%	0.454	S	S	*	.			trans	-53.3	140.1	170.4	-68	176.5	-6.5	0	0	108.7	G114 S115	Q112-G114 PolarHBondContact O-N 3.37Å; Q112-S115 PolarHBondContact N-OG 3.3Å; Q112-S115 PolarHBondContact O-N 3.46Å; Q112-S115 PolarHBondContact O-OG 3.06Å
113	A	55	Low	71.2	Confident	116 Å²	116	85.3 Å²	85.3	96%	0.959	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.1	109.6	-172.6	0	0	0	0	0	111.3	C111	C111-A113 PolarHBondContact O-N 2.6Å
114	G	60.3	Low	71.2	Confident	56 Å²	56	86 Å²	86	58%	0.577	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.7	3	180	0	0	0	0	0	117.2	Q112 G127	Q112-G114 PolarHBondContact O-N 3.37Å; G114-G127 WeakPolarHBondContact O-CA 3.42Å; G114-G127 PolarHBondContact O-N 3.25Å
115	S	69.3	Low	71	Confident	19 Å²	19	86.2 Å²	86.2	13%	0.133	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	144.1	174.2	60.2	0	0	0	0	112.9	C111 Q112 F125	C111-S115 VanDerWaalsContact CB-O 3.32Å; C111-S115 WeakPolarHBondContact CB-O 3.49Å; C111-S115 WeakPolarHBondContact CB-OG 3.34Å; Q112-S115 PolarHBondContact N-OG 3.3Å; Q112-S115 PolarHBondContact O-N 3.46Å; Q112-S115 PolarHBondContact O-OG 3.06Å; S115-F125 WeakPolarHBondContact CA-O 3.46Å
116	G	78.8	Confident	70.8	Confident	0 Å²	0	91.7 Å²	91.7	0%	0	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	140.9	174.7	0	0	0	0	0	111.1	V124 F125	G116-V124 CarbonylContact O-C 3.58Å; G116-F125 PolarHBondContact N-O 3.21Å; G116-F125 PolarHBondContact O-N 3.31Å
117	S	85.9	Confident	70.9	Confident	11 Å²	11	91.7 Å²	91.7	8%	0.077	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	149.2	176.4	62	0	0	0	0	112.4	W104 K123	W104-S117 VanDerWaalsContact NE1-N 3.18Å; W104-S117 PolarHBondContact NE1-O 3.49Å; S117-K123 CarbonylContact C-O 3.59Å; S117-K123 WeakPolarHBondContact CA-O 3.48Å
118	C	88.1	Confident	71.8	Confident	0 Å²	0	90.1 Å²	90.1	0%	0	46%	0.461	C	S	.	.			trans	-80	126.6	174	178.5	0	0	0	0	111	L89 Q120 R122 K123 F125	L89-C118 HydrophobicContact CD1-CB 3.85Å; C118-Q120 VanDerWaalsContact C-N 3.26Å; C118-Q120 PolarHBondContact O-N 3.4Å; C118-Q120 PolarHBondContact SG-N 3.41Å; C118-Q120 VanDerWaalsContact SG-N 3.42Å; C118-R122 WeakPolarHBondContact O-CA 3.38Å; C118-R122 PolarHBondContact O-N 3.25Å; C118-K123 PolarHBondContact N-O 3.15Å; C118-F125 HydrophobicContact CB-CE2 4.09Å
119	P	85.6	Confident	72.9	Confident	33 Å²	33	82 Å²	82	21%	0.214	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-29.3	176.2	-25	33.8	0	0	0	114.7	I78 F95 I100 Y103	I78-P119 HydrophobicContact CD1-CG 3.98Å; I78-P119 HydrophobicContact CG1-CG 4.37Å; F95-P119 HydrophobicContact CE1-CB 4.25Å; F95-P119 HydrophobicContact CE1-CG 4.18Å; F95-P119 HydrophobicContact CZ-CB 4.36Å; F95-P119 HydrophobicContact CZ-CG 4.19Å; I100-P119 HydrophobicContact CD1-CG 3.78Å; Y103-P119 HydrophobicContact CD1-CG 3.7Å; Y103-P119 HydrophobicContact CD2-CG 4.13Å; Y103-P119 HydrophobicContact CE1-CB 4.43Å; Y103-P119 HydrophobicContact CE1-CG 3.73Å; Y103-P119 HydrophobicContact CE2-CB 4.29Å; Y103-P119 HydrophobicContact CE2-CG 4.16Å; Y103-P119 HydrophobicContact CG-CG 3.9Å
120	Q	86.4	Confident	74.5	Confident	112 Å²	112	83.3 Å²	83.3	52%	0.523	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-46.6	-172.3	-172.4	164.1	-19.3	0	0	112.9	H93 F95 C118	H93-Q120 PolarHBondContact CD2-NE2 3.4Å; H93-Q120 PolarHBondContact CD2-OE1 3.23Å; F95-Q120 HydrophobicContact CZ-CB 4.04Å; C118-Q120 VanDerWaalsContact C-N 3.26Å; C118-Q120 PolarHBondContact O-N 3.4Å; C118-Q120 PolarHBondContact SG-N 3.41Å; C118-Q120 VanDerWaalsContact SG-N 3.42Å
121	C	86.8	Confident	76.2	Confident	57 Å²	57	82.6 Å²	82.6	39%	0.385	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-1.6	-179.4	68.9	0	0	0	0	114.5	C91 K123	C91-C121 VanDerWaalsContact SG-SG 3.6Å; C121-K123 PolarHBondContact O-N 3.03Å
122	R	85.3	Confident	78	Confident	210 Å²	210	85.1 Å²	85.1	79%	0.792	45%	0.45	S	S	*	.			trans	60	9	179.7	-55.3	-178.2	-178	176.7	1.1	115.6	C118 V124	C118-R122 WeakPolarHBondContact O-CA 3.38Å; C118-R122 PolarHBondContact O-N 3.25Å; R122-V124 PolarHBondContact O-N 3.35Å
123	K	82.4	Confident	79.5	Confident	124 Å²	124	79 Å²	79	54%	0.539	42%	0.423	S	S	.	.			trans	-62.1	132.6	174.1	-164.2	172.6	-174.5	179.1	0	109.9	C91 S117 C118 C121 F125	C91-K123 HydrophobicContact CB-CD 4.24Å; S117-K123 CarbonylContact C-O 3.59Å; S117-K123 WeakPolarHBondContact CA-O 3.48Å; C118-K123 PolarHBondContact N-O 3.15Å; C121-K123 PolarHBondContact O-N 3.03Å; K123-F125 HydrophobicContact CB-CE1 4.48Å; K123-F125 HydrophobicContact CB-CZ 4.02Å; K123-F125 HydrophobicContact CD-CE1 3.98Å; K123-F125 HydrophobicContact CD-CZ 4.2Å; K123-F125 HydrophobicContact CG-CE1 4.04Å; K123-F125 HydrophobicContact CG-CZ 4.09Å; K123-F125 WeakPolarHBondContact O-CE2 3.49Å
124	V	82.3	Confident	81	Confident	91 Å²	91	83 Å²	83	55%	0.552	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	138.6	-179.8	-175.1	0	0	0	0	109.4	G116 R122	G116-V124 CarbonylContact O-C 3.58Å; R122-V124 PolarHBondContact O-N 3.35Å
125	F	78.8	Confident	82.2	Confident	25 Å²	25	86.2 Å²	86.2	11%	0.11	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	147.2	179.3	-49	-76.5	0	0	0	110.3	L89 P90 C91 S115 G116 C118 K123 G127	L89-F125 HydrophobicContact CB-CE2 4.31Å; L89-F125 HydrophobicContact CD1-CE2 4.33Å; P90-F125 HydrophobicContact CB-CD1 3.8Å; P90-F125 HydrophobicContact CB-CE1 3.65Å; P90-F125 HydrophobicContact CB-CZ 4.34Å; P90-F125 HydrophobicContact CG-CD1 3.83Å; P90-F125 HydrophobicContact CG-CE1 4.06Å; P90-F125 HydrophobicContact CG-CG 4.15Å; C91-F125 HydrophobicContact CB-CE1 4.3Å; C91-F125 HydrophobicContact CB-CZ 3.67Å; S115-F125 WeakPolarHBondContact CA-O 3.46Å; G116-F125 PolarHBondContact N-O 3.21Å; G116-F125 PolarHBondContact O-N 3.31Å; C118-F125 HydrophobicContact CB-CE2 4.09Å; K123-F125 HydrophobicContact CB-CE1 4.48Å; K123-F125 HydrophobicContact CB-CZ 4.02Å; K123-F125 HydrophobicContact CD-CE1 3.98Å; K123-F125 HydrophobicContact CD-CZ 4.2Å; K123-F125 HydrophobicContact CG-CE1 4.04Å; K123-F125 HydrophobicContact CG-CZ 4.09Å; K123-F125 WeakPolarHBondContact O-CE2 3.49Å; F125-G127 PolarHBondContact O-N 3.13Å
126	H	71.4	Confident	83	Confident	196 Å²	196	86.6 Å²	86.6	91%	0.907	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	106.5	170.9	-60.3	-71.4	0	0	0	108.3
127	G	69	Low	83.2	Confident	28 Å²	28	88.2 Å²	88.2	29%	0.289	43%	0.43	S	S	.	.	B	Isolated β-bridge	trans	99.2	153.4	-176.6	0	0	0	0	0	115	G114 F125 S129	G114-G127 WeakPolarHBondContact O-CA 3.42Å; G114-G127 PolarHBondContact O-N 3.25Å; F125-G127 PolarHBondContact O-N 3.13Å; G127-S129 PolarHBondContact O-N 2.94Å; G127-S129 VanDerWaalsContact O-N 3.14Å
128	K	73.5	Confident	83.1	Confident	107 Å²	107	92.1 Å²	92.1	47%	0.465	45%	0.45	S	S	.	.	S	Bend	trans	-83.6	62.4	169.3	-66	-174.3	-178.5	-168.3	0	110	W104	W104-K128 HydrophobicContact CB-CD 4.13Å; W104-K128 HydrophobicContact CB-CG 4.48Å; W104-K128 HydrophobicContact CD2-CB 4.45Å; W104-K128 HydrophobicContact CD2-CG 4.15Å; W104-K128 HydrophobicContact CE3-CB 3.58Å; W104-K128 HydrophobicContact CE3-CD 4.03Å; W104-K128 HydrophobicContact CE3-CG 3.68Å; W104-K128 HydrophobicContact CH2-CB 4.45Å; W104-K128 HydrophobicContact CZ3-CB 3.57Å; W104-K128 HydrophobicContact CZ3-CG 4.17Å; W104-K128 PolarHBondContact O-NZ 2.91Å
129	S	76.2	Confident	82.8	Confident	72 Å²	72	95.9 Å²	95.9	50%	0.503	47%	0.469	S	S	.	.			trans	-103.9	127.2	-178.3	-173.3	0	0	0	0	111.1	G127	G127-S129 PolarHBondContact O-N 2.94Å; G127-S129 VanDerWaalsContact O-N 3.14Å
130	Y	87.4	Confident	82.7	Confident	68 Å²	68	94.9 Å²	94.9	27%	0.267	46%	0.463	S	S	.	.			trans	-136	161	170.9	55.6	-106.6	0	0	0	109.8	V87 E97 I100 W104	V87-Y130 HydrophobicContact CB-CD2 3.62Å; V87-Y130 HydrophobicContact CB-CE2 4.35Å; V87-Y130 HydrophobicContact CB-CG 3.98Å; V87-Y130 HydrophobicContact CG1-CD2 3.49Å; V87-Y130 VanDerWaalsContact CG1-CD2 3.49Å; V87-Y130 HydrophobicContact CG1-CE2 3.76Å; V87-Y130 HydrophobicContact CG1-CG 4.31Å; V87-Y130 HydrophobicContact CG2-CD2 3.98Å; V87-Y130 HydrophobicContact CG2-CG 3.95Å; E97-Y130 HydrophobicContact CG-CE2 4.01Å; E97-Y130 WeakPolarHBondContact CG-OH 3.47Å; E97-Y130 WeakPolarHBondContact OE1-CE2 3.25Å; E97-Y130 PolarHBondContact OE1-OH 3.41Å; I100-Y130 HydrophobicContact CG2-CD1 4.36Å; W104-Y130 AromaticContact CH2-CD1 3.99Å; W104-Y130 HydrophobicContact CH2-CD1 3.99Å; W104-Y130 AromaticContact CZ3-CD1 3.64Å; W104-Y130 HydrophobicContact CZ3-CD1 3.64Å; W104-Y130 HydrophobicContact CZ3-CE1 4.15Å
131	R	89.4	Confident	82.4	Confident	200 Å²	200	94.8 Å²	94.8	76%	0.755	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	131.8	175.1	-67.1	-175.2	178.7	-176.5	-0.2	110.5	V87 S88 N133	V87-R131 CarbonylContact C-O 3.59Å; V87-R131 VanDerWaalsContact CA-O 3.31Å; V87-R131 WeakPolarHBondContact CA-O 3.32Å; S88-R131 PolarHBondContact N-O 2.76Å; S88-R131 PolarHBondContact O-N 3.45Å; R131-N133 PolarHBondContact O-N 2.69Å
132	P	89.6	Confident	82	Confident	95 Å²	95	95.8 Å²	95.8	62%	0.617	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.4	128.3	172	-24.3	34.2	0	0	0	111.5
133	N	87.9	Confident	81.6	Confident	39 Å²	39	87.6 Å²	87.6	21%	0.209	44%	0.439	C	S	.	.			trans	-100.6	85.9	178.6	-168.7	-30.1	0	0	0	110.1	P86 S88 R131 I135 V136 A137	P86-N133 HydrophobicContact CB-CB 4.47Å; P86-N133 PolarHBondContact O-N 2.88Å; S88-N133 WeakPolarHBondContact OG-CB 3.38Å; S88-N133 PolarHBondContact OG-ND2 3.47Å; R131-N133 PolarHBondContact O-N 2.69Å; N133-I135 PolarHBondContact O-N 3.41Å; N133-I135 PolarHBondContact OD1-N 3.02Å; N133-V136 HydrophobicContact CB-CB 4.41Å; N133-V136 HydrophobicContact CB-CG2 4.46Å; N133-V136 WeakPolarHBondContact ND2-CG2 3.26Å; N133-V136 PolarHBondContact O-N 3.45Å; N133-V136 PolarHBondContact OD1-N 2.92Å; N133-A137 PolarHBondContact O-N 3.1Å; N133-A137 VanDerWaalsContact O-N 3.07Å
134	R	85.7	Confident	81.1	Confident	201 Å²	201	84 Å²	84	76%	0.758	43%	0.429	S	S	*	.	H	α-helix	trans	-62.9	-27.1	-180	-66.9	-173.7	175.5	-175.3	-2.1	113.1	A137 N138	R134-A137 PolarHBondContact O-N 3.44Å; R134-N138 WeakPolarHBondContact O-CB 3.42Å; R134-N138 PolarHBondContact O-N 3.38Å; R134-N138 PolarHBondContact O-ND2 3.43Å; R134-N138 PolarHBondContact O-OD1 3.06Å; R134-N138 VanDerWaalsContact O-OD1 3.1Å
135	I	85.8	Confident	80.5	Confident	123 Å²	123	84.5 Å²	84.5	63%	0.631	43%	0.425	S	S	*	.	H	α-helix	trans	-67.6	-49.7	178.9	-60.3	174.3	0	0	0	109.8	N133 A137 N138 I139	N133-I135 PolarHBondContact O-N 3.41Å; N133-I135 PolarHBondContact OD1-N 3.02Å; I135-A137 VanDerWaalsContact C-N 3.3Å; I135-A137 PolarHBondContact O-N 2.81Å; I135-N138 PolarHBondContact O-N 2.88Å; I135-I139 HydrophobicContact CG2-CD1 3.86Å; I135-I139 VanDerWaalsContact O-CG1 3.24Å; I135-I139 WeakPolarHBondContact O-CG1 3.43Å; I135-I139 PolarHBondContact O-N 3.3Å
136	V	86.3	Confident	79.8	Confident	26 Å²	26	85.1 Å²	85.1	16%	0.158	44%	0.439	C	S	.	.	H	α-helix	trans	-64.6	-37.6	176.4	178.1	0	0	0	0	110.8	F83 P86 T94 N133 N138 I139 V140	F83-V136 HydrophobicContact CB-CG1 4.36Å; F83-V136 HydrophobicContact CD2-CG1 3.59Å; F83-V136 HydrophobicContact CE2-CG1 4.19Å; F83-V136 HydrophobicContact CG-CG1 4.18Å; P86-V136 HydrophobicContact CB-CB 4.09Å; P86-V136 HydrophobicContact CB-CG1 3.88Å; P86-V136 HydrophobicContact CG-CB 3.94Å; P86-V136 HydrophobicContact CG-CG1 3.89Å; T94-V136 HydrophobicContact CG2-CG1 4.41Å; N133-V136 HydrophobicContact CB-CB 4.41Å; N133-V136 HydrophobicContact CB-CG2 4.46Å; N133-V136 WeakPolarHBondContact ND2-CG2 3.26Å; N133-V136 PolarHBondContact O-N 3.45Å; N133-V136 PolarHBondContact OD1-N 2.92Å; V136-N138 PolarHBondContact O-N 3.35Å; V136-I139 PolarHBondContact O-N 2.88Å; V136-V140 HydrophobicContact CG1-CG2 4.36Å; V136-V140 WeakPolarHBondContact O-CG2 3.24Å; V136-V140 PolarHBondContact O-N 3Å
137	A	83.4	Confident	79.1	Confident	34 Å²	34	79.8 Å²	79.8	28%	0.281	42%	0.415	S	S	.	.	H	α-helix	trans	-58.4	-48.6	175.5	0	0	0	0	0	111.7	P86 N133 R134 I135 I139 V140 E141	P86-A137 HydrophobicContact CG-CB 3.77Å; N133-A137 PolarHBondContact O-N 3.1Å; N133-A137 VanDerWaalsContact O-N 3.07Å; R134-A137 PolarHBondContact O-N 3.44Å; I135-A137 VanDerWaalsContact C-N 3.3Å; I135-A137 PolarHBondContact O-N 2.81Å; A137-I139 VanDerWaalsContact C-N 3.34Å; A137-I139 PolarHBondContact O-N 2.95Å; A137-V140 PolarHBondContact O-N 3.13Å; A137-E141 WeakPolarHBondContact O-CB 3.5Å; A137-E141 PolarHBondContact O-N 3.33Å
138	N	83.8	Confident	78.3	Confident	93 Å²	93	86.1 Å²	86.1	50%	0.497	44%	0.438	S	S	.	.	H	α-helix	trans	-66.1	-35.2	179.4	-65.2	-1	0	0	0	112.3	R134 I135 V136 S142	R134-N138 WeakPolarHBondContact O-CB 3.42Å; R134-N138 PolarHBondContact O-N 3.38Å; R134-N138 PolarHBondContact O-ND2 3.43Å; R134-N138 PolarHBondContact O-OD1 3.06Å; R134-N138 VanDerWaalsContact O-OD1 3.1Å; I135-N138 PolarHBondContact O-N 2.88Å; V136-N138 PolarHBondContact O-N 3.35Å; N138-S142 WeakPolarHBondContact O-CB 3.48Å; N138-S142 PolarHBondContact O-N 3.39Å; N138-S142 PolarHBondContact O-OG 2.81Å
139	I	82.7	Confident	77.2	Confident	79 Å²	79	89.5 Å²	89.5	41%	0.405	46%	0.455	S	S	.	.	H	α-helix	trans	-68.5	-42.4	177	-66.6	165.2	0	0	0	110.6	L74 I135 V136 A137 S142 Y143	L74-I139 HydrophobicContact CD1-CG2 3.97Å; L74-I139 HydrophobicContact CD2-CB 4.46Å; L74-I139 HydrophobicContact CD2-CG2 3.66Å; L74-I139 HydrophobicContact CG-CG2 4.46Å; I135-I139 HydrophobicContact CG2-CD1 3.86Å; I135-I139 VanDerWaalsContact O-CG1 3.24Å; I135-I139 WeakPolarHBondContact O-CG1 3.43Å; I135-I139 PolarHBondContact O-N 3.3Å; V136-I139 PolarHBondContact O-N 2.88Å; A137-I139 VanDerWaalsContact C-N 3.34Å; A137-I139 PolarHBondContact O-N 2.95Å; I139-S142 PolarHBondContact O-N 2.82Å; I139-Y143 VanDerWaalsContact O-CB 3.27Å; I139-Y143 WeakPolarHBondContact O-CB 3.33Å; I139-Y143 PolarHBondContact O-N 3.14Å
140	V	83.1	Confident	75.9	Confident	12 Å²	12	90.6 Å²	90.6	7%	0.073	46%	0.463	C	S	.	.	H	α-helix	trans	-64.8	-41.8	175.3	172.8	0	0	0	0	111	L74 L82 F83 V136 A137 Y143 C144	L74-V140 HydrophobicContact CB-CG2 4.15Å; L74-V140 HydrophobicContact CD2-CG2 4.14Å; L82-V140 HydrophobicContact CB-CG1 4.1Å; F83-V140 HydrophobicContact CB-CG2 4.17Å; F83-V140 HydrophobicContact CD2-CG2 4.48Å; V136-V140 HydrophobicContact CG1-CG2 4.36Å; V136-V140 WeakPolarHBondContact O-CG2 3.24Å; V136-V140 PolarHBondContact O-N 3Å; A137-V140 PolarHBondContact O-N 3.13Å; V140-Y143 PolarHBondContact O-N 3.01Å; V140-C144 WeakPolarHBondContact O-CB 3.42Å; V140-C144 PolarHBondContact O-N 3.32Å; V140-C144 PolarHBondContact O-SG 3.18Å
141	E	80.3	Confident	73.9	Confident	111 Å²	111	90.5 Å²	90.5	52%	0.519	48%	0.483	S	S	.	.	H	α-helix	trans	-61.8	-46.7	176.5	-174.6	170.8	-157.1	0	0	111.7	A137 Y143 C144 Q145	A137-E141 WeakPolarHBondContact O-CB 3.5Å; A137-E141 PolarHBondContact O-N 3.33Å; E141-Y143 VanDerWaalsContact C-N 3.31Å; E141-Y143 PolarHBondContact O-N 3.31Å; E141-C144 PolarHBondContact O-N 2.94Å; E141-Q145 WeakPolarHBondContact O-CB 3.36Å; E141-Q145 WeakPolarHBondContact O-CG 3.3Å; E141-Q145 PolarHBondContact O-N 3.05Å
142	S	78.2	Confident	71.5	Confident	78 Å²	78	85.5 Å²	85.5	55%	0.545	47%	0.474	S	S	.	.	H	α-helix	trans	-63.6	-36.7	175.8	-57.8	0	0	0	0	112.2	N138 I139 G146	N138-S142 WeakPolarHBondContact O-CB 3.48Å; N138-S142 PolarHBondContact O-N 3.39Å; N138-S142 PolarHBondContact O-OG 2.81Å; I139-S142 PolarHBondContact O-N 2.82Å; S142-G146 PolarHBondContact O-N 3.45Å
143	Y	76.5	Confident	69	Low	37 Å²	37	93.2 Å²	93.2	15%	0.145	49%	0.491	C	S	.	.	H	α-helix	trans	-67.1	-43.3	175.7	178.8	-93.9	0	0	0	111.9	L70 S71 L74 L82 I139 V140 E141 G146 M147	L70-Y143 HydrophobicContact CB-CE2 4.42Å; S71-Y143 VanDerWaalsContact CB-OH 3.3Å; S71-Y143 WeakPolarHBondContact CB-OH 3.48Å; L74-Y143 HydrophobicContact CD1-CD1 4.4Å; L74-Y143 HydrophobicContact CD1-CD2 4.14Å; L74-Y143 HydrophobicContact CD1-CG 3.89Å; L82-Y143 HydrophobicContact CD1-CD1 4.03Å; L82-Y143 HydrophobicContact CD1-CE1 4.07Å; L82-Y143 HydrophobicContact CD2-CD1 4.31Å; L82-Y143 HydrophobicContact CD2-CE1 4.25Å; I139-Y143 VanDerWaalsContact O-CB 3.27Å; I139-Y143 WeakPolarHBondContact O-CB 3.33Å; I139-Y143 PolarHBondContact O-N 3.14Å; V140-Y143 PolarHBondContact O-N 3.01Å; E141-Y143 VanDerWaalsContact C-N 3.31Å; E141-Y143 PolarHBondContact O-N 3.31Å; Y143-G146 PolarHBondContact O-N 2.91Å; Y143-M147 HydrophobicContact CD1-SD 4.25Å; Y143-M147 HydrophobicContact CE1-CG 4.12Å; Y143-M147 HydrophobicContact CE1-SD 3.36Å; Y143-M147 WeakPolarHBondContact CE1-SD 3.29Å; Y143-M147 VanDerWaalsContact CZ-SD 3.51Å; Y143-M147 WeakPolarHBondContact O-CG 3.28Å; Y143-M147 PolarHBondContact O-N 3.17Å; Y143-M147 VanDerWaalsContact O-N 3.1Å; Y143-M147 PolarHBondContact OH-SD 2.88Å
144	C	72.4	Confident	66.6	Low	48 Å²	48	99.2 Å²	99.2	32%	0.324	52%	0.522	S	S	.	.	H	α-helix	trans	-64.4	-45.3	176.2	-70.7	0	0	0	0	111.8	V140 E141 G146 M147 E148	V140-C144 WeakPolarHBondContact O-CB 3.42Å; V140-C144 PolarHBondContact O-N 3.32Å; V140-C144 PolarHBondContact O-SG 3.18Å; E141-C144 PolarHBondContact O-N 2.94Å; C144-G146 VanDerWaalsContact C-N 3.32Å; C144-G146 PolarHBondContact O-N 2.98Å; C144-M147 PolarHBondContact O-N 3.46Å; C144-M147 VanDerWaalsContact O-N 3.11Å; C144-E148 PolarHBondContact O-N 2.98Å
145	Q	68.3	Low	64.1	Low	102 Å²	102	93.1 Å²	93.1	48%	0.477	52%	0.522	S	S	.	.	H	α-helix	trans	-60.7	-41.8	176.4	-73.2	173.8	1.8	0	0	111.4	E141 M147 E148 E149	E141-Q145 WeakPolarHBondContact O-CB 3.36Å; E141-Q145 WeakPolarHBondContact O-CG 3.3Å; E141-Q145 PolarHBondContact O-N 3.05Å; Q145-M147 VanDerWaalsContact C-N 3.31Å; Q145-M147 PolarHBondContact O-N 3.12Å; Q145-E148 PolarHBondContact O-N 3.47Å; Q145-E149 PolarHBondContact O-N 3.3Å
146	G	64.9	Low	62	Low	38 Å²	38	92.4 Å²	92.4	39%	0.392	53%	0.534	S	S	.	.	H	α-helix	trans	-66.8	-24.6	175	0	0	0	0	0	114.9	S142 Y143 C144	S142-G146 PolarHBondContact O-N 3.45Å; Y143-G146 PolarHBondContact O-N 2.91Å; C144-G146 VanDerWaalsContact C-N 3.32Å; C144-G146 PolarHBondContact O-N 2.98Å
147	M	57.7	Low	59.5	Low	84 Å²	84	97.4 Å²	97.4	41%	0.414	56%	0.564	S	S	.	*	H	α-helix	trans	-82.4	-31.1	173.5	-70.8	-163.2	88.7	0	0	112.8	Y143 C144 Q145 S150 G151	Y143-M147 HydrophobicContact CD1-SD 4.25Å; Y143-M147 HydrophobicContact CE1-CG 4.12Å; Y143-M147 HydrophobicContact CE1-SD 3.36Å; Y143-M147 WeakPolarHBondContact CE1-SD 3.29Å; Y143-M147 VanDerWaalsContact CZ-SD 3.51Å; Y143-M147 WeakPolarHBondContact O-CG 3.28Å; Y143-M147 PolarHBondContact O-N 3.17Å; Y143-M147 VanDerWaalsContact O-N 3.1Å; Y143-M147 PolarHBondContact OH-SD 2.88Å; C144-M147 PolarHBondContact O-N 3.46Å; C144-M147 VanDerWaalsContact O-N 3.11Å; Q145-M147 VanDerWaalsContact C-N 3.31Å; Q145-M147 PolarHBondContact O-N 3.12Å; M147-S150 PolarHBondContact O-N 3.4Å; M147-G151 PolarHBondContact O-N 3.03Å
148	E	51.8	Low	57.4	Low	162 Å²	162	100.8 Å²	100.8	76%	0.757	59%	0.586	S	S	*	*	H	α-helix	trans	-67.2	-34.9	175.1	-75.4	-179.5	165	0	0	112	C144 Q145 S150	C144-E148 PolarHBondContact O-N 2.98Å; Q145-E148 PolarHBondContact O-N 3.47Å; E148-S150 VanDerWaalsContact C-N 3.26Å; E148-S150 PolarHBondContact O-N 2.99Å
149	E	50.9	Low	55	Low	177 Å²	177	104.6 Å²	104.6	83%	0.827	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-13	172.7	-70	-176.7	164.5	0	0	114	Q145	Q145-E149 PolarHBondContact O-N 3.3Å
150	S	47.8	Very low	53.1	Low	95 Å²	95	106.5 Å²	106.5	66%	0.664	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	10.5	179	-73.5	0	0	0	0	115.4	M147 E148	M147-S150 PolarHBondContact O-N 3.4Å; E148-S150 VanDerWaalsContact C-N 3.26Å; E148-S150 PolarHBondContact O-N 2.99Å
151	G	46.2	Very low	51.1	Low	67 Å²	67	110 Å²	110	69%	0.691	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.5	50	158.8	0	0	0	0	0	117	M147	M147-G151 PolarHBondContact O-N 3.03Å
152	V	38.1	Very low	49.6	Very low	95 Å²	95	110.4 Å²	110.4	58%	0.576	66%	0.661	S	S	*	*			trans	-127	99.1	167.7	-176.6	0	0	0	0	110.3	L154	V152-L154 HydrophobicContact CG1-CD1 4.13Å; V152-L154 HydrophobicContact CG1-CG 4.18Å
153	R	38.2	Very low	48.8	Very low	257 Å²	257	113.1 Å²	113.1	97%	0.97	67%	0.674	S	S	*	*			trans	-80.4	114.6	165.4	-72	-177.6	170.1	-175.8	-3.2	109
154	L	36.8	Very low	48.4	Very low	165 Å²	165	114.1 Å²	114.1	86%	0.864	69%	0.685	S	S	*	*			trans	-131.2	125.9	163.4	-80.8	168.5	0	0	0	108.3	V152	V152-L154 HydrophobicContact CG1-CD1 4.13Å; V152-L154 HydrophobicContact CG1-CG 4.18Å
155	G	33.8	Very low	48.8	Very low	73 Å²	73	115.2 Å²	115.2	75%	0.753	69%	0.691	S	S	*	*			trans	136.9	69.4	173.7	0	0	0	0	0	112.9	V157	G155-V157 PolarHBondContact O-N 3.16Å; G155-V157 VanDerWaalsContact O-N 3.12Å
156	A	40.3	Very low	49.7	Very low	108 Å²	108	115.2 Å²	115.2	89%	0.893	69%	0.694	S	S	*	*			trans	-61.5	107.6	162.9	0	0	0	0	0	108.7
157	V	34.1	Very low	50.7	Low	130 Å²	130	114 Å²	114	79%	0.788	68%	0.679	S	S	*	*			trans	-82.1	114.4	154.8	-176.7	0	0	0	0	105	G155 E159	G155-V157 PolarHBondContact O-N 3.16Å; G155-V157 VanDerWaalsContact O-N 3.12Å; V157-E159 PolarHBondContact O-N 3.23Å; V157-E159 VanDerWaalsContact O-N 3.08Å
158	S	40.7	Very low	51.9	Low	106 Å²	106	118.8 Å²	118.8	74%	0.741	70%	0.703	S	S	*	*			trans	-48.5	111.5	170	41.1	0	0	0	0	110.2
159	E	32.7	Very low	53.3	Low	173 Å²	173	119.9 Å²	119.9	81%	0.808	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-60.4	138	167.4	-72.4	-164.1	149.5	0	0	109.4	V157 A161	V157-E159 PolarHBondContact O-N 3.23Å; V157-E159 VanDerWaalsContact O-N 3.08Å; E159-A161 PolarHBondContact O-N 3.14Å
160	P	42.5	Very low	54.7	Low	118 Å²	118	114.5 Å²	114.5	77%	0.766	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-60.9	131.5	161.3	-2.5	16.9	0	0	0	107.3
161	A	41.9	Very low	56.3	Low	85 Å²	85	120.2 Å²	120.2	70%	0.702	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-49.3	133	172.8	0	0	0	0	0	109.8	E159 T163	E159-A161 PolarHBondContact O-N 3.14Å; A161-T163 PolarHBondContact O-N 3.05Å
162	P	47.8	Very low	58	Low	120 Å²	120	121.9 Å²	121.9	78%	0.779	67%	0.671	S	S	*	*			trans	-66	109.3	-178.3	23.9	-30.1	0	0	0	108.9	T164	P162-T164 PolarHBondContact O-N 3.29Å; P162-T164 VanDerWaalsContact O-N 3.13Å
163	T	61.1	Low	60.3	Low	135 Å²	135	120.6 Å²	120.6	83%	0.828	66%	0.659	S	S	*	*			trans	-68.5	106.8	167.6	46.2	0	0	0	0	107.7	A161	A161-T163 PolarHBondContact O-N 3.05Å
164	T	68.1	Low	62.6	Low	59 Å²	59	109.6 Å²	109.6	36%	0.362	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-56.6	126.5	174.6	-29.1	0	0	0	0	108.8	P162 L166 E173	P162-T164 PolarHBondContact O-N 3.29Å; P162-T164 VanDerWaalsContact O-N 3.13Å; T164-L166 PolarHBondContact O-N 2.64Å; T164-E173 WeakPolarHBondContact CB-OE1 3.39Å; T164-E173 HydrophobicContact CG2-CB 4.19Å; T164-E173 HydrophobicContact CG2-CG 4.41Å; T164-E173 PolarHBondContact OG1-OE1 2.84Å
165	P	81.3	Confident	65	Low	71 Å²	71	106.4 Å²	106.4	46%	0.461	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-62	139.7	-179.8	24	-31.9	0	0	0	110.6	L174	P165-L174 HydrophobicContact CB-CD1 4.09Å; P165-L174 HydrophobicContact CG-CB 4.46Å; P165-L174 HydrophobicContact CG-CD1 4.34Å; P165-L174 WeakPolarHBondContact O-CB 3.37Å; P165-L174 WeakPolarHBondContact O-CG 3.28Å; P165-L174 PolarHBondContact O-N 3.14Å
166	L	87.6	Confident	67.6	Low	101 Å²	101	104.6 Å²	104.6	53%	0.529	57%	0.571	S	S	.	*	B	Isolated β-bridge	trans	-101.1	144.6	-176.4	-64.1	169.9	0	0	0	111.1	T164 M168 E172 E173	T164-L166 PolarHBondContact O-N 2.64Å; L166-M168 PolarHBondContact O-N 2.9Å; L166-E172 CarbonylContact C-O 3.57Å; L166-E172 WeakPolarHBondContact CA-O 3.5Å; L166-E173 HydrophobicContact CD2-CG 3.98Å
167	C	85.3	Confident	70.1	Confident	13 Å²	13	100.9 Å²	100.9	9%	0.088	53%	0.534	C	S	.	.	P	Polyproline II helix	trans	-67.2	126.6	172.3	179.3	0	0	0	0	110.5	R169 H170 R171 E172 L174 C186	C167-R169 PolarHBondContact O-N 3.39Å; C167-H170 PolarHBondContact O-N 3.06Å; C167-R171 WeakPolarHBondContact O-CA 3.18Å; C167-R171 PolarHBondContact O-N 3.12Å; C167-E172 WeakPolarHBondContact CB-O 3.43Å; C167-E172 PolarHBondContact N-O 3.05Å; C167-L174 HydrophobicContact CB-CD2 3.65Å; C167-C186 HydrophobicContact CB-CB 3.78Å; C167-C186 VanDerWaalsContact SG-SG 3.65Å
168	M	83	Confident	72.8	Confident	184 Å²	184	94.7 Å²	94.7	91%	0.906	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-27.2	-179	-64.1	-67.1	-82.6	0	0	113.6	L166	L166-M168 PolarHBondContact O-N 2.9Å
169	R	80.6	Confident	75.2	Confident	186 Å²	186	92 Å²	92	70%	0.702	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-39.7	-178.3	-70.2	176.3	58.6	142.2	-4.2	113.4	C167	C167-R169 PolarHBondContact O-N 3.39Å
170	H	81.4	Confident	78	Confident	64 Å²	64	87.9 Å²	87.9	30%	0.296	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-7.6	-170.7	-53.4	117.8	0	0	0	113.3	C167 E172 C186 V188 C189	C167-H170 PolarHBondContact O-N 3.06Å; H170-E172 HydrophobicContact CB-CB 4.37Å; H170-E172 HydrophobicContact CB-CG 4.27Å; H170-E172 PolarHBondContact O-N 2.87Å; H170-E172 VanDerWaalsContact O-N 3.14Å; H170-C186 PolarHBondContact ND1-SG 3.11Å; H170-C186 VanDerWaalsContact ND1-SG 3.41Å; H170-V188 HydrophobicContact CB-CB 4.35Å; H170-C189 PolarHBondContact CE1-SG 3.47Å; H170-C189 PolarHBondContact ND1-SG 3.05Å
171	R	80.9	Confident	80.2	Confident	214 Å²	214	85.5 Å²	85.5	81%	0.808	43%	0.434	S	S	*	.			trans	53.3	26.8	-174.5	-57.8	-171.2	-179.7	-160.3	1.4	113.9	C167	C167-R171 WeakPolarHBondContact O-CA 3.18Å; C167-R171 PolarHBondContact O-N 3.12Å
172	E	81.6	Confident	82.4	Confident	103 Å²	103	88 Å²	88	48%	0.481	43%	0.432	S	S	.	.			trans	-99.7	151.6	178.5	-77.7	-65.4	163.6	0	0	111.2	L166 C167 H170 L174 C186 V188	L166-E172 CarbonylContact C-O 3.57Å; L166-E172 WeakPolarHBondContact CA-O 3.5Å; C167-E172 WeakPolarHBondContact CB-O 3.43Å; C167-E172 PolarHBondContact N-O 3.05Å; H170-E172 HydrophobicContact CB-CB 4.37Å; H170-E172 HydrophobicContact CB-CG 4.27Å; H170-E172 PolarHBondContact O-N 2.87Å; H170-E172 VanDerWaalsContact O-N 3.14Å; E172-L174 PolarHBondContact O-N 3.35Å; E172-C186 HydrophobicContact CB-CB 3.71Å; E172-V188 HydrophobicContact CG-CG2 4.44Å
173	E	86.1	Confident	84.4	Confident	67 Å²	67	88.3 Å²	88.3	31%	0.313	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-61	134	177.2	-64.9	-174.1	132.1	0	0	111.7	T164 L166 K175	T164-E173 WeakPolarHBondContact CB-OE1 3.39Å; T164-E173 HydrophobicContact CG2-CB 4.19Å; T164-E173 HydrophobicContact CG2-CG 4.41Å; T164-E173 PolarHBondContact OG1-OE1 2.84Å; L166-E173 HydrophobicContact CD2-CG 3.98Å; E173-K175 HydrophobicContact CB-CD 4.43Å; E173-K175 HydrophobicContact CB-CG 4.12Å; E173-K175 PolarHBondContact O-N 3.19Å; E173-K175 WeakPolarHBondContact OE2-CE 3.39Å; E173-K175 IonicContact OE2-NZ 3.37Å; E173-K175 PolarHBondContact OE2-NZ 2.82Å
174	L	88.3	Confident	85.8	Confident	27 Å²	27	85.4 Å²	85.4	14%	0.141	40%	0.401	C	S	.	.			trans	-77.2	92.6	175	-62	178	0	0	0	110	P165 C167 E172 L184 C186	P165-L174 HydrophobicContact CB-CD1 4.09Å; P165-L174 HydrophobicContact CG-CB 4.46Å; P165-L174 HydrophobicContact CG-CD1 4.34Å; P165-L174 WeakPolarHBondContact O-CB 3.37Å; P165-L174 WeakPolarHBondContact O-CG 3.28Å; P165-L174 PolarHBondContact O-N 3.14Å; C167-L174 HydrophobicContact CB-CD2 3.65Å; E172-L174 PolarHBondContact O-N 3.35Å; L174-L184 HydrophobicContact CB-CB 4.06Å; L174-L184 HydrophobicContact CD1-CB 3.9Å; L174-L184 WeakPolarHBondContact CD2-O 3.45Å; L174-L184 HydrophobicContact CG-CB 4.45Å; L174-C186 HydrophobicContact CD2-CB 4.21Å
175	K	85.9	Confident	86.9	Confident	97 Å²	97	82.9 Å²	82.9	42%	0.422	39%	0.386	S	S	.	.			trans	-104.6	-11.6	-176	-70.6	-178.6	174.5	159.7	0	114.3	E173 V185 L187 V203	E173-K175 HydrophobicContact CB-CD 4.43Å; E173-K175 HydrophobicContact CB-CG 4.12Å; E173-K175 PolarHBondContact O-N 3.19Å; E173-K175 WeakPolarHBondContact OE2-CE 3.39Å; E173-K175 IonicContact OE2-NZ 3.37Å; E173-K175 PolarHBondContact OE2-NZ 2.82Å; K175-V185 PolarHBondContact N-O 3.02Å; K175-L187 HydrophobicContact CD-CD1 4.4Å; K175-V203 VanDerWaalsContact C-CG2 3.49Å; K175-V203 WeakPolarHBondContact O-CG2 3.37Å; K175-V203 PolarHBondContact O-N 3.08Å; K175-V203 VanDerWaalsContact O-N 3.09Å
176	L	89	Confident	87.2	Confident	35 Å²	35	79.5 Å²	79.5	18%	0.183	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	154.2	-179.2	-56.5	176.6	0	0	0	110.3	L184 V185 L187 L200 V201	L176-L184 CarbonylContact O-C 3.54Å; L176-L184 WeakPolarHBondContact O-CA 3.31Å; L176-V185 HydrophobicContact CB-CG2 3.8Å; L176-V185 WeakPolarHBondContact CB-O 3.43Å; L176-V185 PolarHBondContact N-O 2.77Å; L176-V185 PolarHBondContact O-N 2.77Å; L176-L187 HydrophobicContact CD1-CG 4.23Å; L176-L200 HydrophobicContact CD1-CD1 4.37Å; L176-V201 CarbonylContact C-O 3.5Å; L176-V201 VanDerWaalsContact CA-O 3.31Å; L176-V201 WeakPolarHBondContact CA-O 3.33Å
177	Y	92.9	Very high	87.1	Confident	30 Å²	30	79.7 Å²	79.7	12%	0.118	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	129.7	172.1	178.4	-95.2	0	0	0	108.3	E179 Q182 L184 L200 V201 A206 Y210	Y177-E179 HydrophobicContact CD1-CG 4.36Å; Y177-E179 HydrophobicContact CE1-CG 4.42Å; Y177-Q182 WeakPolarHBondContact OH-CA 3.5Å; Y177-Q182 WeakPolarHBondContact OH-CB 3.37Å; Y177-L184 HydrophobicContact CD2-CD2 4.11Å; Y177-L200 WeakPolarHBondContact O-CA 3.47Å; Y177-V201 HydrophobicContact CD1-CG2 4.32Å; Y177-V201 PolarHBondContact N-O 3.43Å; Y177-V201 PolarHBondContact O-N 3.02Å; Y177-A206 HydrophobicContact CD1-CB 3.85Å; Y177-A206 HydrophobicContact CG-CB 3.9Å; Y177-Y210 HydrophobicContact CD1-CE2 4.3Å; Y177-Y210 AromaticContact CE1-CE2 3.53Å; Y177-Y210 HydrophobicContact CE1-CE2 3.53Å; Y177-Y210 AromaticContact CE1-CZ 3.93Å; Y177-Y210 WeakPolarHBondContact CE1-OH 3.29Å; Y177-Y210 AromaticContact CZ-CE2 3.65Å; Y177-Y210 PolarHBondContact OH-OH 3.32Å
178	C	91.3	Very high	87.1	Confident	0 Å²	0	82.1 Å²	82.1	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	120.5	175	-167.1	0	0	0	0	109.4	D181 Q182 E183 H198 L200	C178-D181 HydrophobicContact CB-CB 4.26Å; C178-D181 PolarHBondContact SG-OD2 2.94Å; C178-Q182 VanDerWaalsContact O-CA 3.31Å; C178-Q182 WeakPolarHBondContact O-CA 3.44Å; C178-Q182 PolarHBondContact O-N 3.2Å; C178-E183 PolarHBondContact N-O 3.05Å; C178-H198 WeakPolarHBondContact SG-CB 3.36Å; C178-H198 PolarHBondContact SG-ND1 3.04Å; C178-L200 HydrophobicContact CB-CD2 3.67Å
179	E	90	Very high	87.2	Confident	49 Å²	49	74.1 Å²	74.1	23%	0.229	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-33.6	-176.1	-64.9	-162.3	143.1	0	0	112.7	Y177 T199 V201 R209	Y177-E179 HydrophobicContact CD1-CG 4.36Å; Y177-E179 HydrophobicContact CE1-CG 4.42Å; E179-T199 HydrophobicContact CG-CG2 4.49Å; E179-T199 PolarHBondContact N-O 3.11Å; E179-V201 HydrophobicContact CG-CG2 4.24Å; E179-R209 IonicContact OE1-CZ 2.7Å; E179-R209 IonicContact OE1-NH1 3.75Å; E179-R209 PolarHBondContact OE1-NH1 3.43Å; E179-R209 IonicContact OE2-NH1 2.72Å; E179-R209 PolarHBondContact OE2-NH1 3.39Å
180	E	92.1	Very high	87.3	Confident	88 Å²	88	65.6 Å²	65.6	41%	0.411	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-47.5	-178.8	-64.1	79.5	177.9	0	0	112.2	H198 T199	E180-H198 VanDerWaalsContact OE2-CB 3.32Å; E180-H198 WeakPolarHBondContact OE2-CB 3.32Å; E180-H198 IonicContact OE2-CG 3.73Å; E180-T199 WeakPolarHBondContact OE1-CB 3.31Å; E180-T199 PolarHBondContact OE1-N 3.1Å; E180-T199 PolarHBondContact OE1-OG1 3.42Å; E180-T199 PolarHBondContact OE2-N 3.37Å
181	D	88.1	Confident	87.5	Confident	68 Å²	68	69.2 Å²	69.2	36%	0.364	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-12.7	-178.7	-56.1	-51.7	0	0	0	112.9	C178 E183 H195 H198	C178-D181 HydrophobicContact CB-CB 4.26Å; C178-D181 PolarHBondContact SG-OD2 2.94Å; D181-E183 PolarHBondContact O-N 3.34Å; D181-H195 IonicContact OD2-CE1 3.51Å; D181-H195 PolarHBondContact OD2-CE1 3.04Å; D181-H195 IonicContact OD2-ND1 3.99Å; D181-H195 PolarHBondContact OD2-ND1 3.45Å; D181-H198 IonicContact OD1-CE1 3.41Å; D181-H198 PolarHBondContact OD1-CE1 3.31Å; D181-H198 IonicContact OD1-ND1 3.4Å; D181-H198 IonicContact OD2-CE1 3.41Å; D181-H198 PolarHBondContact OD2-CE1 3.12Å; D181-H198 IonicContact OD2-ND1 3.14Å; D181-H198 PolarHBondContact OD2-ND1 3.17Å
182	Q	89.1	Confident	87.7	Confident	138 Å²	138	60.3 Å²	60.3	65%	0.645	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	32.5	-178.1	-57.3	-176.5	2.3	0	0	114.5	Y177 C178	Y177-Q182 WeakPolarHBondContact OH-CA 3.5Å; Y177-Q182 WeakPolarHBondContact OH-CB 3.37Å; C178-Q182 VanDerWaalsContact O-CA 3.31Å; C178-Q182 WeakPolarHBondContact O-CA 3.44Å; C178-Q182 PolarHBondContact O-N 3.2Å
183	E	89.7	Confident	87.7	Confident	125 Å²	125	63.7 Å²	63.7	58%	0.584	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.3	155.2	-176.8	-71	-173.8	172.8	0	0	112.6	C178 D181	C178-E183 PolarHBondContact N-O 3.05Å; D181-E183 PolarHBondContact O-N 3.34Å
184	L	90.9	Very high	87.4	Confident	74 Å²	74	65.3 Å²	65.3	39%	0.387	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	127.1	172.7	-68.4	172.4	0	0	0	109.7	L174 L176 Y177 V203	L174-L184 HydrophobicContact CB-CB 4.06Å; L174-L184 HydrophobicContact CD1-CB 3.9Å; L174-L184 WeakPolarHBondContact CD2-O 3.45Å; L174-L184 HydrophobicContact CG-CB 4.45Å; L176-L184 CarbonylContact O-C 3.54Å; L176-L184 WeakPolarHBondContact O-CA 3.31Å; Y177-L184 HydrophobicContact CD2-CD2 4.11Å; L184-V203 HydrophobicContact CD2-CB 4.36Å; L184-V203 HydrophobicContact CD2-CG1 4.06Å; L184-V203 HydrophobicContact CD2-CG2 3.37Å
185	V	89.8	Confident	87.2	Confident	6 Å²	6	65.2 Å²	65.2	4%	0.036	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	149	-177.9	-59.3	0	0	0	0	111.5	K175 L176 C189 L200	K175-V185 PolarHBondContact N-O 3.02Å; L176-V185 HydrophobicContact CB-CG2 3.8Å; L176-V185 WeakPolarHBondContact CB-O 3.43Å; L176-V185 PolarHBondContact N-O 2.77Å; L176-V185 PolarHBondContact O-N 2.77Å; V185-C189 HydrophobicContact CB-CB 3.94Å; V185-C189 HydrophobicContact CG1-CB 4.46Å; V185-L200 HydrophobicContact CG2-CD2 3.94Å
186	C	87.9	Confident	86.9	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.344	C	S	.	.			trans	-82.5	166	170.6	68.9	0	0	0	0	110.5	C167 H170 E172 L174 V188 C189 G190	C167-C186 HydrophobicContact CB-CB 3.78Å; C167-C186 VanDerWaalsContact SG-SG 3.65Å; H170-C186 PolarHBondContact ND1-SG 3.11Å; H170-C186 VanDerWaalsContact ND1-SG 3.41Å; E172-C186 HydrophobicContact CB-CB 3.71Å; L174-C186 HydrophobicContact CD2-CB 4.21Å; C186-V188 PolarHBondContact O-N 3.04Å; C186-C189 PolarHBondContact O-N 2.83Å; C186-C189 VanDerWaalsContact O-N 3.13Å; C186-C189 VanDerWaalsContact SG-SG 3.69Å; C186-G190 PolarHBondContact O-N 3.28Å
187	L	84.9	Confident	86.8	Confident	106 Å²	106	73.1 Å²	73.1	56%	0.555	37%	0.374	S	S	*	.	H	α-helix	trans	-57.4	-33.1	-179.9	-78.1	118.1	0	0	0	113.5	K175 L176 G190 I191	K175-L187 HydrophobicContact CD-CD1 4.4Å; L176-L187 HydrophobicContact CD1-CG 4.23Å; L187-G190 PolarHBondContact O-N 2.92Å; L187-I191 PolarHBondContact O-N 3.1Å
188	V	85.4	Confident	86.7	Confident	63 Å²	63	74.7 Å²	74.7	38%	0.382	38%	0.382	S	S	.	.	H	α-helix	trans	-69.5	-41.3	178.9	-175.5	0	0	0	0	111.5	H170 E172 C186 G190 I191 S192	H170-V188 HydrophobicContact CB-CB 4.35Å; E172-V188 HydrophobicContact CG-CG2 4.44Å; C186-V188 PolarHBondContact O-N 3.04Å; V188-G190 VanDerWaalsContact C-N 3.32Å; V188-I191 VanDerWaalsContact O-CG1 3.3Å; V188-I191 WeakPolarHBondContact O-CG1 3.33Å; V188-S192 PolarHBondContact O-N 2.76Å
189	C	85.6	Confident	86.7	Confident	16 Å²	16	78 Å²	78	11%	0.108	40%	0.402	C	S	.	.	H	α-helix	trans	-64.4	-38.5	172	-73.8	0	0	0	0	111.1	H170 V185 C186 I191 S192 H195	H170-C189 PolarHBondContact CE1-SG 3.47Å; H170-C189 PolarHBondContact ND1-SG 3.05Å; V185-C189 HydrophobicContact CB-CB 3.94Å; V185-C189 HydrophobicContact CG1-CB 4.46Å; C186-C189 PolarHBondContact O-N 2.83Å; C186-C189 VanDerWaalsContact O-N 3.13Å; C186-C189 VanDerWaalsContact SG-SG 3.69Å; C189-I191 PolarHBondContact O-N 3.22Å; C189-S192 WeakPolarHBondContact O-CB 3.45Å; C189-S192 PolarHBondContact O-N 2.92Å; C189-S192 PolarHBondContact O-OG 3.29Å; C189-H195 PolarHBondContact O-CD2 3.13Å
190	G	83.3	Confident	86.7	Confident	8 Å²	8	78 Å²	78	8%	0.082	40%	0.404	C	S	.	.	H	α-helix	trans	-64	-25.1	-178.5	0	0	0	0	0	115	C186 L187 V188 L200	C186-G190 PolarHBondContact O-N 3.28Å; L187-G190 PolarHBondContact O-N 2.92Å; V188-G190 VanDerWaalsContact C-N 3.32Å; G190-L200 VanDerWaalsContact O-CD1 3.27Å; G190-L200 WeakPolarHBondContact O-CD1 3.03Å
191	I	83.8	Confident	86.6	Confident	139 Å²	139	75.7 Å²	75.7	71%	0.713	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-2.2	174.5	63.5	174.9	0	0	0	113.2	L187 V188 C189	L187-I191 PolarHBondContact O-N 3.1Å; V188-I191 VanDerWaalsContact O-CG1 3.3Å; V188-I191 WeakPolarHBondContact O-CG1 3.33Å; C189-I191 PolarHBondContact O-N 3.22Å
192	S	85.3	Confident	86.7	Confident	28 Å²	28	74.3 Å²	74.3	20%	0.196	39%	0.39	C	S	.	.	S	Bend	trans	-68.5	160.6	177.5	86.1	0	0	0	0	110.5	V188 C189 D194 H195 R196	V188-S192 PolarHBondContact O-N 2.76Å; C189-S192 WeakPolarHBondContact O-CB 3.45Å; C189-S192 PolarHBondContact O-N 2.92Å; C189-S192 PolarHBondContact O-OG 3.29Å; S192-D194 PolarHBondContact O-N 2.94Å; S192-D194 VanDerWaalsContact O-N 3.14Å; S192-D194 WeakPolarHBondContact OG-CB 3.49Å; S192-D194 PolarHBondContact OG-N 3.08Å; S192-D194 PolarHBondContact OG-OD2 3.2Å; S192-H195 PolarHBondContact O-N 3.38Å; S192-R196 WeakPolarHBondContact O-CB 3.23Å; S192-R196 PolarHBondContact O-N 3.45Å
193	Q	82.4	Confident	86.7	Confident	173 Å²	173	69.6 Å²	69.6	81%	0.808	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-25.8	175.2	-72.5	-167.7	0.5	0	0	112.5	H195	Q193-H195 PolarHBondContact O-N 3.27Å
194	D	79.7	Confident	86.7	Confident	101 Å²	101	69 Å²	69	54%	0.54	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-31.6	-176.5	-46.9	-50.3	0	0	0	112.6	S192	S192-D194 PolarHBondContact O-N 2.94Å; S192-D194 VanDerWaalsContact O-N 3.14Å; S192-D194 WeakPolarHBondContact OG-CB 3.49Å; S192-D194 PolarHBondContact OG-N 3.08Å; S192-D194 PolarHBondContact OG-OD2 3.2Å
195	H	83.3	Confident	86.5	Confident	26 Å²	26	69.6 Å²	69.6	12%	0.12	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	7.8	179.9	-58.6	-77.9	0	0	0	113.7	D181 C189 S192 Q193 A197 H198 L200	D181-H195 IonicContact OD2-CE1 3.51Å; D181-H195 PolarHBondContact OD2-CE1 3.04Å; D181-H195 IonicContact OD2-ND1 3.99Å; D181-H195 PolarHBondContact OD2-ND1 3.45Å; C189-H195 PolarHBondContact O-CD2 3.13Å; S192-H195 PolarHBondContact O-N 3.38Å; Q193-H195 PolarHBondContact O-N 3.27Å; H195-A197 PolarHBondContact O-N 3.39Å; H195-A197 VanDerWaalsContact O-N 3.12Å; H195-H198 HydrophobicContact CB-CB 4.38Å; H195-H198 AromaticContact ND1-ND1 3.65Å; H195-H198 WeakPolarHBondContact O-CB 3.49Å; H195-H198 PolarHBondContact O-N 3.2Å; H195-L200 HydrophobicContact CB-CD2 4.44Å
196	R	80.5	Confident	86.5	Confident	200 Å²	200	69.6 Å²	69.6	76%	0.755	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-28.9	-173.9	-173.6	174.1	-179	-179.3	1.7	114.1	S192	S192-R196 WeakPolarHBondContact O-CB 3.23Å; S192-R196 PolarHBondContact O-N 3.45Å
197	A	85.8	Confident	86.7	Confident	98 Å²	98	74.1 Å²	74.1	81%	0.81	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	3.4	179.2	0	0	0	0	0	113.1	H195	H195-A197 PolarHBondContact O-N 3.39Å; H195-A197 VanDerWaalsContact O-N 3.12Å
198	H	91.9	Very high	87.1	Confident	63 Å²	63	75.5 Å²	75.5	29%	0.292	40%	0.395	S	S	.	.	S	Bend	trans	-94.7	156.1	-176.6	-68.5	-175.1	0	0	0	111.5	C178 E180 D181 H195 L200	C178-H198 WeakPolarHBondContact SG-CB 3.36Å; C178-H198 PolarHBondContact SG-ND1 3.04Å; E180-H198 VanDerWaalsContact OE2-CB 3.32Å; E180-H198 WeakPolarHBondContact OE2-CB 3.32Å; E180-H198 IonicContact OE2-CG 3.73Å; D181-H198 IonicContact OD1-CE1 3.41Å; D181-H198 PolarHBondContact OD1-CE1 3.31Å; D181-H198 IonicContact OD1-ND1 3.4Å; D181-H198 IonicContact OD2-CE1 3.41Å; D181-H198 PolarHBondContact OD2-CE1 3.12Å; D181-H198 IonicContact OD2-ND1 3.14Å; D181-H198 PolarHBondContact OD2-ND1 3.17Å; H195-H198 HydrophobicContact CB-CB 4.38Å; H195-H198 AromaticContact ND1-ND1 3.65Å; H195-H198 WeakPolarHBondContact O-CB 3.49Å; H195-H198 PolarHBondContact O-N 3.2Å; H198-L200 PolarHBondContact O-N 3.3Å
199	T	90.6	Very high	87.4	Confident	69 Å²	69	80 Å²	80	42%	0.423	41%	0.405	S	S	.	.			trans	-84.3	109.1	179.2	-50.8	0	0	0	0	109.2	E179 E180	E179-T199 HydrophobicContact CG-CG2 4.49Å; E179-T199 PolarHBondContact N-O 3.11Å; E180-T199 WeakPolarHBondContact OE1-CB 3.31Å; E180-T199 PolarHBondContact OE1-N 3.1Å; E180-T199 PolarHBondContact OE1-OG1 3.42Å; E180-T199 PolarHBondContact OE2-N 3.37Å
200	L	89.9	Confident	87.7	Confident	50 Å²	50	83.7 Å²	83.7	26%	0.262	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	125.4	-179.9	-57.6	177.8	0	0	0	110.6	L176 Y177 C178 V185 G190 H195 H198	L176-L200 HydrophobicContact CD1-CD1 4.37Å; Y177-L200 WeakPolarHBondContact O-CA 3.47Å; C178-L200 HydrophobicContact CB-CD2 3.67Å; V185-L200 HydrophobicContact CG2-CD2 3.94Å; G190-L200 VanDerWaalsContact O-CD1 3.27Å; G190-L200 WeakPolarHBondContact O-CD1 3.03Å; H195-L200 HydrophobicContact CB-CD2 4.44Å; H198-L200 PolarHBondContact O-N 3.3Å
201	V	90.4	Very high	88.3	Confident	38 Å²	38	90.9 Å²	90.9	23%	0.23	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	157.9	176.5	-69.1	0	0	0	0	110.1	L176 Y177 E179 A206	L176-V201 CarbonylContact C-O 3.5Å; L176-V201 VanDerWaalsContact CA-O 3.31Å; L176-V201 WeakPolarHBondContact CA-O 3.33Å; Y177-V201 HydrophobicContact CD1-CG2 4.32Å; Y177-V201 PolarHBondContact N-O 3.43Å; Y177-V201 PolarHBondContact O-N 3.02Å; E179-V201 HydrophobicContact CG-CG2 4.24Å; V201-A206 HydrophobicContact CG2-CB 3.86Å
202	C	90.9	Very high	88.9	Confident	40 Å²	40	87 Å²	87	27%	0.27	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	149.1	174.9	83.1	0	0	0	0	110.8	Q204 D205 A206	C202-Q204 PolarHBondContact O-N 2.99Å; C202-D205 PolarHBondContact O-N 3.48Å; C202-D205 PolarHBondContact SG-N 3.14Å; C202-D205 VanDerWaalsContact SG-N 3.38Å; C202-D205 PolarHBondContact SG-OD2 3.12Å; C202-A206 PolarHBondContact O-N 3.46Å
203	V	89.3	Confident	89.4	Confident	39 Å²	39	88.8 Å²	88.8	24%	0.236	44%	0.443	C	S	.	.	H	α-helix	trans	-58.3	-35.4	-176.4	174.8	0	0	0	0	112.1	K175 L184 Q207	K175-V203 VanDerWaalsContact C-CG2 3.49Å; K175-V203 WeakPolarHBondContact O-CG2 3.37Å; K175-V203 PolarHBondContact O-N 3.08Å; K175-V203 VanDerWaalsContact O-N 3.09Å; L184-V203 HydrophobicContact CD2-CB 4.36Å; L184-V203 HydrophobicContact CD2-CG1 4.06Å; L184-V203 HydrophobicContact CD2-CG2 3.37Å; V203-Q207 WeakPolarHBondContact O-CB 3.25Å; V203-Q207 PolarHBondContact O-N 3.39Å
204	Q	88.1	Confident	90.1	Very high	112 Å²	112	86.1 Å²	86.1	52%	0.523	43%	0.434	S	S	.	.	H	α-helix	trans	-65.9	-38.6	178.1	-64	79.9	4.7	0	0	111.9	C202 K208	C202-Q204 PolarHBondContact O-N 2.99Å; Q204-K208 VanDerWaalsContact O-CG 3.26Å; Q204-K208 WeakPolarHBondContact O-CG 3.28Å; Q204-K208 PolarHBondContact O-N 3.49Å
205	D	88.3	Confident	90.9	Very high	87 Å²	87	85 Å²	85	47%	0.465	43%	0.431	S	S	.	.	H	α-helix	trans	-76.1	-40.5	179.3	-67.7	-23.9	0	0	0	111.4	C202 Q207 K208 R209	C202-D205 PolarHBondContact O-N 3.48Å; C202-D205 PolarHBondContact SG-N 3.14Å; C202-D205 VanDerWaalsContact SG-N 3.38Å; C202-D205 PolarHBondContact SG-OD2 3.12Å; D205-Q207 VanDerWaalsContact C-N 3.35Å; D205-Q207 PolarHBondContact O-N 2.79Å; D205-K208 PolarHBondContact O-N 3.29Å; D205-K208 IonicContact OD1-NZ 3.81Å; D205-R209 WeakPolarHBondContact O-CB 3.19Å; D205-R209 PolarHBondContact O-N 3.04Å
206	A	89.9	Confident	91.6	Very high	5 Å²	5	88.4 Å²	88.4	4%	0.041	45%	0.453	C	S	.	.	H	α-helix	trans	-57.5	-47.7	170.5	0	0	0	0	0	111.1	Y177 V201 C202 K208 R209 Y210	Y177-A206 HydrophobicContact CD1-CB 3.85Å; Y177-A206 HydrophobicContact CG-CB 3.9Å; V201-A206 HydrophobicContact CG2-CB 3.86Å; C202-A206 PolarHBondContact O-N 3.46Å; A206-K208 PolarHBondContact O-N 3.12Å; A206-R209 PolarHBondContact O-N 2.84Å; A206-Y210 WeakPolarHBondContact O-CD2 3.47Å; A206-Y210 PolarHBondContact O-N 3.5Å
207	Q	91.1	Very high	92.4	Very high	95 Å²	95	81.7 Å²	81.7	44%	0.444	44%	0.437	S	S	.	.	H	α-helix	trans	-60.3	-45.6	177.7	-176.4	-173.5	52.1	0	0	111.8	V203 D205 R209 R211	V203-Q207 WeakPolarHBondContact O-CB 3.25Å; V203-Q207 PolarHBondContact O-N 3.39Å; D205-Q207 VanDerWaalsContact C-N 3.35Å; D205-Q207 PolarHBondContact O-N 2.79Å; Q207-R209 VanDerWaalsContact C-N 3.35Å; Q207-R211 HydrophobicContact CG-CG 4.45Å; Q207-R211 VanDerWaalsContact O-CB 3.29Å; Q207-R211 WeakPolarHBondContact O-CB 3.49Å; Q207-R211 WeakPolarHBondContact O-CG 3.27Å; Q207-R211 PolarHBondContact O-N 3.22Å
208	K	93.2	Very high	93	Very high	136 Å²	136	79.7 Å²	79.7	59%	0.591	42%	0.42	S	S	*	.	H	α-helix	trans	-59.9	-45.6	176	-76.2	170.6	-172.1	168.2	0	111.1	Q204 D205 A206 R211 A212	Q204-K208 VanDerWaalsContact O-CG 3.26Å; Q204-K208 WeakPolarHBondContact O-CG 3.28Å; Q204-K208 PolarHBondContact O-N 3.49Å; D205-K208 PolarHBondContact O-N 3.29Å; D205-K208 IonicContact OD1-NZ 3.81Å; A206-K208 PolarHBondContact O-N 3.12Å; K208-R211 PolarHBondContact O-N 3.32Å; K208-A212 WeakPolarHBondContact O-CB 3.41Å; K208-A212 PolarHBondContact O-N 3.35Å
209	R	92.4	Very high	93.3	Very high	158 Å²	158	81.8 Å²	81.8	60%	0.596	43%	0.434	S	S	*	.	H	α-helix	trans	-62	-49.6	179.2	-170.6	179.5	-176.1	174.7	3.6	111.7	E179 D205 A206 Q207 A212 S213	E179-R209 IonicContact OE1-CZ 2.7Å; E179-R209 IonicContact OE1-NH1 3.75Å; E179-R209 PolarHBondContact OE1-NH1 3.43Å; E179-R209 IonicContact OE2-NH1 2.72Å; E179-R209 PolarHBondContact OE2-NH1 3.39Å; D205-R209 WeakPolarHBondContact O-CB 3.19Å; D205-R209 PolarHBondContact O-N 3.04Å; A206-R209 PolarHBondContact O-N 2.84Å; Q207-R209 VanDerWaalsContact C-N 3.35Å; R209-A212 PolarHBondContact O-N 2.84Å; R209-S213 PolarHBondContact O-N 3.41Å
210	Y	92.1	Very high	93.6	Very high	93 Å²	93	81 Å²	81	37%	0.365	44%	0.435	S	S	.	.	H	α-helix	trans	-66.4	-38.7	177.8	-75.6	-63.5	0	0	0	112.6	Y177 A206 A212 S213 L214	Y177-Y210 HydrophobicContact CD1-CE2 4.3Å; Y177-Y210 AromaticContact CE1-CE2 3.53Å; Y177-Y210 HydrophobicContact CE1-CE2 3.53Å; Y177-Y210 AromaticContact CE1-CZ 3.93Å; Y177-Y210 WeakPolarHBondContact CE1-OH 3.29Å; Y177-Y210 AromaticContact CZ-CE2 3.65Å; Y177-Y210 PolarHBondContact OH-OH 3.32Å; A206-Y210 WeakPolarHBondContact O-CD2 3.47Å; A206-Y210 PolarHBondContact O-N 3.5Å; Y210-A212 VanDerWaalsContact C-N 3.35Å; Y210-A212 PolarHBondContact O-N 3.41Å; Y210-S213 PolarHBondContact O-N 3.09Å; Y210-L214 WeakPolarHBondContact O-CB 3.34Å; Y210-L214 VanDerWaalsContact O-CG 3.28Å; Y210-L214 WeakPolarHBondContact O-CG 3.41Å; Y210-L214 PolarHBondContact O-N 3.46Å
211	R	95.6	Very high	94	Very high	159 Å²	159	84.6 Å²	84.6	60%	0.6	45%	0.453	S	S	*	.	H	α-helix	trans	-61.4	-42.5	172.9	-80.1	-175.1	173.7	-178.9	-0.5	112	Q207 K208 T215	Q207-R211 HydrophobicContact CG-CG 4.45Å; Q207-R211 VanDerWaalsContact O-CB 3.29Å; Q207-R211 WeakPolarHBondContact O-CB 3.49Å; Q207-R211 WeakPolarHBondContact O-CG 3.27Å; Q207-R211 PolarHBondContact O-N 3.22Å; K208-R211 PolarHBondContact O-N 3.32Å; R211-T215 VanDerWaalsContact O-CB 3.3Å; R211-T215 WeakPolarHBondContact O-CB 3.39Å; R211-T215 PolarHBondContact O-N 3.4Å; R211-T215 PolarHBondContact O-OG1 3.24Å
212	A	95.4	Very high	94.4	Very high	56 Å²	56	87.3 Å²	87.3	46%	0.463	46%	0.463	S	S	.	.	H	α-helix	trans	-63.4	-43.2	175.8	0	0	0	0	0	111.5	K208 R209 Y210 T215 T216	K208-A212 WeakPolarHBondContact O-CB 3.41Å; K208-A212 PolarHBondContact O-N 3.35Å; R209-A212 PolarHBondContact O-N 2.84Å; Y210-A212 VanDerWaalsContact C-N 3.35Å; Y210-A212 PolarHBondContact O-N 3.41Å; A212-T215 PolarHBondContact O-N 2.63Å; A212-T216 WeakPolarHBondContact O-CB 3.25Å; A212-T216 PolarHBondContact O-N 2.84Å; A212-T216 PolarHBondContact O-OG1 3.28Å
213	S	96.3	Very high	94.7	Very high	66 Å²	66	92.4 Å²	92.4	46%	0.462	48%	0.481	S	S	.	.	H	α-helix	trans	-61.2	-50.6	175.2	-175.5	0	0	0	0	111.9	R209 Y210 T215 T216 S217	R209-S213 PolarHBondContact O-N 3.41Å; Y210-S213 PolarHBondContact O-N 3.09Å; S213-T215 VanDerWaalsContact C-N 3.33Å; S213-T215 PolarHBondContact O-N 3.03Å; S213-T216 WeakPolarHBondContact O-CB 3.06Å; S213-T216 PolarHBondContact O-N 3.06Å; S213-T216 VanDerWaalsContact O-N 3.1Å; S213-S217 PolarHBondContact O-N 3.46Å; S213-S217 PolarHBondContact O-OG 3.45Å
214	L	97.1	Very high	95.2	Very high	118 Å²	118	96.3 Å²	96.3	62%	0.618	50%	0.496	S	S	*	.	H	α-helix	trans	-61.8	-39.4	177.7	-72.2	171.6	0	0	0	112.4	Y210 T216 S217 A218	Y210-L214 WeakPolarHBondContact O-CB 3.34Å; Y210-L214 VanDerWaalsContact O-CG 3.28Å; Y210-L214 WeakPolarHBondContact O-CG 3.41Å; Y210-L214 PolarHBondContact O-N 3.46Å; L214-T216 VanDerWaalsContact C-N 3.32Å; L214-S217 PolarHBondContact O-N 3.22Å; L214-A218 VanDerWaalsContact O-CB 3.28Å; L214-A218 WeakPolarHBondContact O-CB 3.39Å; L214-A218 PolarHBondContact O-N 2.93Å
215	T	97.5	Very high	95.7	Very high	78 Å²	78	95.1 Å²	95.1	48%	0.479	49%	0.493	S	S	.	.	H	α-helix	trans	-64.2	-40.2	175.2	-55.8	0	0	0	0	110.7	R211 A212 S213 A218 N219	R211-T215 VanDerWaalsContact O-CB 3.3Å; R211-T215 WeakPolarHBondContact O-CB 3.39Å; R211-T215 PolarHBondContact O-N 3.4Å; R211-T215 PolarHBondContact O-OG1 3.24Å; A212-T215 PolarHBondContact O-N 2.63Å; S213-T215 VanDerWaalsContact C-N 3.33Å; S213-T215 PolarHBondContact O-N 3.03Å; T215-A218 PolarHBondContact O-N 3.47Å; T215-N219 WeakPolarHBondContact O-CB 3.22Å; T215-N219 PolarHBondContact O-N 3.49Å; T215-N219 PolarHBondContact O-ND2 3.3Å
216	T	97.7	Very high	96.1	Very high	96 Å²	96	95.2 Å²	95.2	59%	0.589	49%	0.494	S	S	*	.	H	α-helix	trans	-63.4	-46.9	175.7	-55.9	0	0	0	0	111	A212 S213 L214 N219 A220	A212-T216 WeakPolarHBondContact O-CB 3.25Å; A212-T216 PolarHBondContact O-N 2.84Å; A212-T216 PolarHBondContact O-OG1 3.28Å; S213-T216 WeakPolarHBondContact O-CB 3.06Å; S213-T216 PolarHBondContact O-N 3.06Å; S213-T216 VanDerWaalsContact O-N 3.1Å; L214-T216 VanDerWaalsContact C-N 3.32Å; T216-N219 PolarHBondContact O-N 2.86Å; T216-A220 WeakPolarHBondContact O-CB 3.3Å; T216-A220 PolarHBondContact O-N 3Å
217	S	97.6	Very high	96.5	Very high	60 Å²	60	98.4 Å²	98.4	42%	0.42	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-41.8	176.1	-63.3	0	0	0	0	112.5	S213 L214 A220 L221	S213-S217 PolarHBondContact O-N 3.46Å; S213-S217 PolarHBondContact O-OG 3.45Å; L214-S217 PolarHBondContact O-N 3.22Å; S217-A220 PolarHBondContact O-N 3.08Å; S217-L221 WeakPolarHBondContact O-CB 3.36Å; S217-L221 WeakPolarHBondContact O-CG 3.45Å; S217-L221 PolarHBondContact O-N 2.89Å
218	A	97.8	Very high	96.9	Very high	55 Å²	55	96.6 Å²	96.6	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-63.1	-43.6	176.2	0	0	0	0	0	111.6	L214 T215 A220 L221 Q222	L214-A218 VanDerWaalsContact O-CB 3.28Å; L214-A218 WeakPolarHBondContact O-CB 3.39Å; L214-A218 PolarHBondContact O-N 2.93Å; T215-A218 PolarHBondContact O-N 3.47Å; A218-A220 VanDerWaalsContact C-N 3.35Å; A218-A220 PolarHBondContact O-N 3.28Å; A218-L221 PolarHBondContact O-N 2.96Å; A218-Q222 WeakPolarHBondContact O-CB 3.35Å; A218-Q222 PolarHBondContact O-N 3.15Å
219	N	97.6	Very high	97.1	Very high	107 Å²	107	94.2 Å²	94.2	57%	0.572	51%	0.508	S	S	*	.	H	α-helix	trans	-64.2	-39.4	175.6	-70.1	-19.3	0	0	0	112	T215 T216 Q222 K223	T215-N219 WeakPolarHBondContact O-CB 3.22Å; T215-N219 PolarHBondContact O-N 3.49Å; T215-N219 PolarHBondContact O-ND2 3.3Å; T216-N219 PolarHBondContact O-N 2.86Å; N219-Q222 PolarHBondContact O-N 2.73Å; N219-K223 PolarHBondContact O-N 3.45Å
220	A	98.1	Very high	97.4	Very high	54 Å²	54	90.5 Å²	90.5	45%	0.446	50%	0.497	S	S	.	.	H	α-helix	trans	-62.9	-48.8	175	0	0	0	0	0	111.2	T216 S217 A218 Q222 K223 E224	T216-A220 WeakPolarHBondContact O-CB 3.3Å; T216-A220 PolarHBondContact O-N 3Å; S217-A220 PolarHBondContact O-N 3.08Å; A218-A220 VanDerWaalsContact C-N 3.35Å; A218-A220 PolarHBondContact O-N 3.28Å; A220-Q222 VanDerWaalsContact C-N 3.32Å; A220-Q222 PolarHBondContact O-N 2.97Å; A220-K223 WeakPolarHBondContact O-CB 3.4Å; A220-K223 PolarHBondContact O-N 3.46Å; A220-K223 VanDerWaalsContact O-N 3.14Å; A220-E224 PolarHBondContact O-N 3.34Å
221	L	98.2	Very high	97.7	Very high	124 Å²	124	89 Å²	89	65%	0.649	50%	0.5	S	S	*	.	H	α-helix	trans	-61.9	-38.6	176	-72.6	172.4	0	0	0	112.4	S217 A218 K223 E224 L225	S217-L221 WeakPolarHBondContact O-CB 3.36Å; S217-L221 WeakPolarHBondContact O-CG 3.45Å; S217-L221 PolarHBondContact O-N 2.89Å; A218-L221 PolarHBondContact O-N 2.96Å; L221-K223 VanDerWaalsContact C-N 3.3Å; L221-K223 PolarHBondContact O-N 3.4Å; L221-E224 PolarHBondContact O-N 2.87Å; L221-L225 WeakPolarHBondContact O-CB 3.48Å; L221-L225 PolarHBondContact O-N 2.99Å
222	Q	98.1	Very high	97.8	Very high	96 Å²	96	86.7 Å²	86.7	45%	0.449	50%	0.495	S	S	.	.	H	α-helix	trans	-64.1	-37.1	176	-172.1	61.7	61.6	0	0	111.6	A218 N219 A220 N226	A218-Q222 WeakPolarHBondContact O-CB 3.35Å; A218-Q222 PolarHBondContact O-N 3.15Å; N219-Q222 PolarHBondContact O-N 2.73Å; A220-Q222 VanDerWaalsContact C-N 3.32Å; A220-Q222 PolarHBondContact O-N 2.97Å; Q222-N226 PolarHBondContact NE2-OD1 2.9Å; Q222-N226 VanDerWaalsContact NE2-OD1 3.12Å; Q222-N226 PolarHBondContact O-N 2.82Å; Q222-N226 PolarHBondContact O-ND2 2.93Å; Q222-N226 PolarHBondContact O-OD1 2.7Å
223	K	98.1	Very high	97.9	Very high	147 Å²	147	89.6 Å²	89.6	64%	0.639	50%	0.495	S	S	*	.	H	α-helix	trans	-65.1	-46.2	173.9	-173.3	-173.8	175.9	-169.5	0	111.2	N219 A220 L221 L225 N226 T227	N219-K223 PolarHBondContact O-N 3.45Å; A220-K223 WeakPolarHBondContact O-CB 3.4Å; A220-K223 PolarHBondContact O-N 3.46Å; A220-K223 VanDerWaalsContact O-N 3.14Å; L221-K223 VanDerWaalsContact C-N 3.3Å; L221-K223 PolarHBondContact O-N 3.4Å; K223-L225 VanDerWaalsContact C-N 3.34Å; K223-L225 PolarHBondContact O-N 2.78Å; K223-N226 PolarHBondContact O-N 3.37Å; K223-T227 PolarHBondContact O-N 2.62Å; K223-T227 PolarHBondContact O-OG1 2.78Å; K223-T227 VanDerWaalsContact O-OG1 3.08Å
224	E	98.3	Very high	98	Very high	120 Å²	120	91.3 Å²	91.3	56%	0.561	50%	0.495	S	S	*	.	H	α-helix	trans	-61	-42.3	176.3	-66.3	-54.5	140	0	0	111.8	A220 L221 N226 T227 A228	A220-E224 PolarHBondContact O-N 3.34Å; L221-E224 PolarHBondContact O-N 2.87Å; E224-N226 PolarHBondContact O-N 2.99Å; E224-T227 WeakPolarHBondContact O-CB 3.19Å; E224-T227 PolarHBondContact O-N 2.78Å; E224-A228 PolarHBondContact O-N 3.11Å
225	L	98.4	Very high	98	Very high	88 Å²	88	89.9 Å²	89.9	46%	0.461	49%	0.492	S	S	.	.	H	α-helix	trans	-59.8	-44.2	175.5	178.2	60.2	0	0	0	111.9	L221 K223 T227 A228 L229	L221-L225 WeakPolarHBondContact O-CB 3.48Å; L221-L225 PolarHBondContact O-N 2.99Å; K223-L225 VanDerWaalsContact C-N 3.34Å; K223-L225 PolarHBondContact O-N 2.78Å; L225-T227 VanDerWaalsContact C-N 3.33Å; L225-T227 PolarHBondContact O-N 2.74Å; L225-A228 PolarHBondContact O-N 3Å; L225-L229 HydrophobicContact CD1-CD1 4.43Å; L225-L229 HydrophobicContact CD1-CG 4.36Å; L225-L229 HydrophobicContact CG-CD1 4.25Å; L225-L229 WeakPolarHBondContact O-CG 3.4Å; L225-L229 PolarHBondContact O-N 2.85Å
226	N	97.9	Very high	98	Very high	89 Å²	89	92.1 Å²	92.1	48%	0.476	50%	0.497	S	S	.	.	H	α-helix	trans	-63.7	-39.9	177.8	-67.3	-10.4	0	0	0	111.7	Q222 K223 E224 A228 L229 E230	Q222-N226 PolarHBondContact NE2-OD1 2.9Å; Q222-N226 VanDerWaalsContact NE2-OD1 3.12Å; Q222-N226 PolarHBondContact O-N 2.82Å; Q222-N226 PolarHBondContact O-ND2 2.93Å; Q222-N226 PolarHBondContact O-OD1 2.7Å; K223-N226 PolarHBondContact O-N 3.37Å; E224-N226 PolarHBondContact O-N 2.99Å; N226-A228 VanDerWaalsContact C-N 3.34Å; N226-L229 PolarHBondContact O-N 2.83Å; N226-E230 PolarHBondContact O-N 2.88Å; N226-E230 VanDerWaalsContact O-N 3.09Å
227	T	98.3	Very high	98.1	Very high	71 Å²	71	91.6 Å²	91.6	44%	0.436	49%	0.487	S	S	.	.	H	α-helix	trans	-61.7	-43	173.5	-53.2	0	0	0	0	111.1	K223 E224 L225 E230 C231	K223-T227 PolarHBondContact O-N 2.62Å; K223-T227 PolarHBondContact O-OG1 2.78Å; K223-T227 VanDerWaalsContact O-OG1 3.08Å; E224-T227 WeakPolarHBondContact O-CB 3.19Å; E224-T227 PolarHBondContact O-N 2.78Å; L225-T227 VanDerWaalsContact C-N 3.33Å; L225-T227 PolarHBondContact O-N 2.74Å; T227-E230 PolarHBondContact O-N 2.73Å; T227-C231 PolarHBondContact O-N 2.79Å; T227-C231 PolarHBondContact O-SG 2.88Å; T227-C231 VanDerWaalsContact O-SG 3.4Å
228	A	98.3	Very high	98.1	Very high	58 Å²	58	93.9 Å²	93.9	48%	0.479	49%	0.491	S	S	.	.	H	α-helix	trans	-64	-42	178.6	0	0	0	0	0	112.7	E224 L225 N226 E230 C231 E232	E224-A228 PolarHBondContact O-N 3.11Å; L225-A228 PolarHBondContact O-N 3Å; N226-A228 VanDerWaalsContact C-N 3.34Å; A228-E230 VanDerWaalsContact C-N 3.3Å; A228-E230 PolarHBondContact O-N 2.81Å; A228-C231 PolarHBondContact O-N 2.84Å; A228-E232 PolarHBondContact O-N 2.94Å
229	L	98.4	Very high	98.1	Very high	86 Å²	86	94.5 Å²	94.5	45%	0.45	49%	0.489	S	S	.	.	H	α-helix	trans	-63.8	-35.6	175.5	-70.7	170.9	0	0	0	112.1	L225 N226 E232 R233	L225-L229 HydrophobicContact CD1-CD1 4.43Å; L225-L229 HydrophobicContact CD1-CG 4.36Å; L225-L229 HydrophobicContact CG-CD1 4.25Å; L225-L229 WeakPolarHBondContact O-CG 3.4Å; L225-L229 PolarHBondContact O-N 2.85Å; N226-L229 PolarHBondContact O-N 2.83Å; L229-E232 PolarHBondContact O-N 3.05Å; L229-R233 PolarHBondContact O-N 2.92Å
230	E	98.1	Very high	98.1	Very high	79 Å²	79	95.7 Å²	95.7	37%	0.369	49%	0.49	S	S	.	.	H	α-helix	trans	-67.4	-43.1	175	-175.9	66.1	175.2	0	0	111.5	N226 T227 A228 E232 R233 E234	N226-E230 PolarHBondContact O-N 2.88Å; N226-E230 VanDerWaalsContact O-N 3.09Å; T227-E230 PolarHBondContact O-N 2.73Å; A228-E230 VanDerWaalsContact C-N 3.3Å; A228-E230 PolarHBondContact O-N 2.81Å; E230-E232 VanDerWaalsContact C-N 3.3Å; E230-E232 PolarHBondContact O-N 2.76Å; E230-R233 VanDerWaalsContact CD-NH2 3.35Å; E230-R233 WeakPolarHBondContact O-CB 3.38Å; E230-R233 PolarHBondContact O-N 2.9Å; E230-R233 IonicContact OE1-CZ 3.8Å; E230-R233 IonicContact OE1-NE 3.5Å; E230-R233 IonicContact OE1-NH2 2.84Å; E230-R233 PolarHBondContact OE1-NH2 3.27Å; E230-R233 IonicContact OE2-CZ 3.87Å; E230-R233 IonicContact OE2-NE 3.54Å; E230-R233 PolarHBondContact OE2-NE 3.2Å; E230-R233 IonicContact OE2-NH2 3.93Å; E230-R233 PolarHBondContact OE2-NH2 3.29Å; E230-E234 WeakPolarHBondContact O-CG 3.32Å; E230-E234 PolarHBondContact O-N 3.05Å
231	C	98	Very high	98.1	Very high	62 Å²	62	97.7 Å²	97.7	42%	0.419	49%	0.488	S	S	.	.	H	α-helix	trans	-62	-36.5	173.8	-67.6	0	0	0	0	112.7	T227 A228 T235	T227-C231 PolarHBondContact O-N 2.79Å; T227-C231 PolarHBondContact O-SG 2.88Å; T227-C231 VanDerWaalsContact O-SG 3.4Å; A228-C231 PolarHBondContact O-N 2.84Å; C231-T235 WeakPolarHBondContact O-CB 3.11Å; C231-T235 PolarHBondContact O-N 3.04Å; C231-T235 PolarHBondContact O-OG1 3.42Å
232	E	98.2	Very high	98	Very high	110 Å²	110	97.3 Å²	97.3	51%	0.514	49%	0.486	S	S	.	.	H	α-helix	trans	-61	-48.3	172.6	-178.4	176.9	-134.3	0	0	110.5	A228 L229 E230 E234 T235 E236	A228-E232 PolarHBondContact O-N 2.94Å; L229-E232 PolarHBondContact O-N 3.05Å; E230-E232 VanDerWaalsContact C-N 3.3Å; E230-E232 PolarHBondContact O-N 2.76Å; E232-E234 PolarHBondContact O-N 3.32Å; E232-T235 WeakPolarHBondContact O-CB 3.48Å; E232-T235 PolarHBondContact O-N 3.18Å; E232-T235 VanDerWaalsContact O-N 3.14Å; E232-E236 WeakPolarHBondContact O-CG 3.49Å; E232-E236 PolarHBondContact O-N 2.78Å
233	R	98.2	Very high	98	Very high	118 Å²	118	99.5 Å²	99.5	45%	0.445	49%	0.494	S	S	.	.	H	α-helix	trans	-60	-43.2	177.7	-169.2	-175.7	71.4	75.3	-1.9	112.7	L229 E230 T235 E236 E237	L229-R233 PolarHBondContact O-N 2.92Å; E230-R233 VanDerWaalsContact CD-NH2 3.35Å; E230-R233 WeakPolarHBondContact O-CB 3.38Å; E230-R233 PolarHBondContact O-N 2.9Å; E230-R233 IonicContact OE1-CZ 3.8Å; E230-R233 IonicContact OE1-NE 3.5Å; E230-R233 IonicContact OE1-NH2 2.84Å; E230-R233 PolarHBondContact OE1-NH2 3.27Å; E230-R233 IonicContact OE2-CZ 3.87Å; E230-R233 IonicContact OE2-NE 3.54Å; E230-R233 PolarHBondContact OE2-NE 3.2Å; E230-R233 IonicContact OE2-NH2 3.93Å; E230-R233 PolarHBondContact OE2-NH2 3.29Å; R233-T235 VanDerWaalsContact C-N 3.33Å; R233-E236 PolarHBondContact O-N 2.98Å; R233-E237 IonicContact NH1-OE2 2.74Å; R233-E237 PolarHBondContact O-N 3.22Å
234	E	98.3	Very high	98	Very high	101 Å²	101	97.2 Å²	97.2	47%	0.472	49%	0.489	S	S	.	.	H	α-helix	trans	-61.1	-43.2	174.8	-72.4	177.6	166.9	0	0	111.2	E230 E232 E237 E238	E230-E234 WeakPolarHBondContact O-CG 3.32Å; E230-E234 PolarHBondContact O-N 3.05Å; E232-E234 PolarHBondContact O-N 3.32Å; E234-E237 WeakPolarHBondContact O-CB 3.47Å; E234-E237 PolarHBondContact O-N 3.32Å; E234-E238 PolarHBondContact O-N 3.39Å
235	T	97.1	Very high	97.8	Very high	89 Å²	89	94.7 Å²	94.7	55%	0.546	48%	0.477	S	S	.	.	H	α-helix	trans	-64.1	-43.4	177.6	-56.9	0	0	0	0	111.5	C231 E232 R233 E237 E238 V239	C231-T235 WeakPolarHBondContact O-CB 3.11Å; C231-T235 PolarHBondContact O-N 3.04Å; C231-T235 PolarHBondContact O-OG1 3.42Å; E232-T235 WeakPolarHBondContact O-CB 3.48Å; E232-T235 PolarHBondContact O-N 3.18Å; E232-T235 VanDerWaalsContact O-N 3.14Å; R233-T235 VanDerWaalsContact C-N 3.33Å; T235-E237 VanDerWaalsContact C-N 3.29Å; T235-E237 PolarHBondContact O-N 3.43Å; T235-E238 PolarHBondContact O-N 3.11Å; T235-V239 WeakPolarHBondContact O-CG2 3.46Å; T235-V239 PolarHBondContact O-N 2.87Å
236	E	98.1	Very high	97.7	Very high	125 Å²	125	94.2 Å²	94.2	58%	0.584	48%	0.478	S	S	*	.	H	α-helix	trans	-61.1	-38.5	175.2	-72.5	-173.8	155.7	0	0	112.2	E232 R233 V239 K240	E232-E236 WeakPolarHBondContact O-CG 3.49Å; E232-E236 PolarHBondContact O-N 2.78Å; R233-E236 PolarHBondContact O-N 2.98Å; E236-V239 PolarHBondContact O-N 3.31Å; E236-K240 WeakPolarHBondContact O-CB 3.36Å; E236-K240 PolarHBondContact O-N 3.28Å
237	E	98.3	Very high	97.7	Very high	84 Å²	84	92.8 Å²	92.8	39%	0.393	48%	0.478	S	S	.	.	H	α-helix	trans	-64.3	-43.5	175.7	-164.3	-175.9	141	0	0	111.7	R233 E234 T235 K240 K241	R233-E237 IonicContact NH1-OE2 2.74Å; R233-E237 PolarHBondContact O-N 3.22Å; E234-E237 WeakPolarHBondContact O-CB 3.47Å; E234-E237 PolarHBondContact O-N 3.32Å; T235-E237 VanDerWaalsContact C-N 3.29Å; T235-E237 PolarHBondContact O-N 3.43Å; E237-K240 WeakPolarHBondContact O-CB 3.37Å; E237-K240 PolarHBondContact O-N 3.43Å; E237-K241 WeakPolarHBondContact O-CG 3.14Å; E237-K241 PolarHBondContact O-N 3.28Å; E237-K241 WeakPolarHBondContact OE1-CE 3.31Å; E237-K241 IonicContact OE1-NZ 3.33Å; E237-K241 PolarHBondContact OE1-NZ 2.84Å
238	E	97.9	Very high	97.6	Very high	108 Å²	108	92.2 Å²	92.2	51%	0.505	47%	0.473	S	S	.	.	H	α-helix	trans	-65.3	-40.2	175.6	-69.5	-52.7	124.4	0	0	112.3	E234 T235 K240 K241 L242	E234-E238 PolarHBondContact O-N 3.39Å; T235-E238 PolarHBondContact O-N 3.11Å; E238-K240 VanDerWaalsContact C-N 3.29Å; E238-K240 PolarHBondContact O-N 2.9Å; E238-K241 PolarHBondContact O-N 3.25Å; E238-K241 WeakPolarHBondContact OE1-CD 3.27Å; E238-K241 IonicContact OE1-NZ 2.63Å; E238-K241 PolarHBondContact OE1-NZ 3.47Å; E238-L242 WeakPolarHBondContact O-CB 3.43Å; E238-L242 PolarHBondContact O-N 2.94Å
239	V	98.2	Very high	97.4	Very high	68 Å²	68	92.9 Å²	92.9	41%	0.412	47%	0.468	S	S	.	.	H	α-helix	trans	-59.7	-42.2	172.9	168.9	0	0	0	0	110.8	T235 E236 L242 K243	T235-V239 WeakPolarHBondContact O-CG2 3.46Å; T235-V239 PolarHBondContact O-N 2.87Å; E236-V239 PolarHBondContact O-N 3.31Å; V239-L242 PolarHBondContact O-N 3.24Å; V239-K243 HydrophobicContact CG1-CD 4.26Å; V239-K243 WeakPolarHBondContact O-CG 2.95Å; V239-K243 PolarHBondContact O-N 3.29Å
240	K	98.2	Very high	97.3	Very high	133 Å²	133	94.9 Å²	94.9	58%	0.578	47%	0.473	S	S	*	.	H	α-helix	trans	-64	-48.5	176.3	-175.5	-176.4	174.9	-171.9	0	111.3	E236 E237 E238 L242 K243 D244	E236-K240 WeakPolarHBondContact O-CB 3.36Å; E236-K240 PolarHBondContact O-N 3.28Å; E237-K240 WeakPolarHBondContact O-CB 3.37Å; E237-K240 PolarHBondContact O-N 3.43Å; E238-K240 VanDerWaalsContact C-N 3.29Å; E238-K240 PolarHBondContact O-N 2.9Å; K240-L242 VanDerWaalsContact C-N 3.28Å; K240-L242 PolarHBondContact O-N 3.41Å; K240-K243 PolarHBondContact O-N 3.04Å; K240-K243 VanDerWaalsContact O-N 3.15Å; K240-D244 PolarHBondContact O-N 2.89Å
241	K	97.4	Very high	97.3	Very high	96 Å²	96	97.5 Å²	97.5	42%	0.417	49%	0.485	S	S	.	.	H	α-helix	trans	-55.5	-43.3	176.5	-73.8	169.5	-173.3	158.9	0	111.7	E237 E238 H245	E237-K241 WeakPolarHBondContact O-CG 3.14Å; E237-K241 PolarHBondContact O-N 3.28Å; E237-K241 WeakPolarHBondContact OE1-CE 3.31Å; E237-K241 IonicContact OE1-NZ 3.33Å; E237-K241 PolarHBondContact OE1-NZ 2.84Å; E238-K241 PolarHBondContact O-N 3.25Å; E238-K241 WeakPolarHBondContact OE1-CD 3.27Å; E238-K241 IonicContact OE1-NZ 2.63Å; E238-K241 PolarHBondContact OE1-NZ 3.47Å; K241-H245 VanDerWaalsContact O-CB 3.29Å; K241-H245 WeakPolarHBondContact O-CB 3.32Å; K241-H245 PolarHBondContact O-N 3.43Å
242	L	97.2	Very high	97	Very high	115 Å²	115	97.7 Å²	97.7	60%	0.602	48%	0.477	S	S	*	.	H	α-helix	trans	-64	-44.4	177.4	-179.9	61.3	0	0	0	112.2	E238 V239 K240 H245 T246	E238-L242 WeakPolarHBondContact O-CB 3.43Å; E238-L242 PolarHBondContact O-N 2.94Å; V239-L242 PolarHBondContact O-N 3.24Å; K240-L242 VanDerWaalsContact C-N 3.28Å; K240-L242 PolarHBondContact O-N 3.41Å; L242-H245 PolarHBondContact O-N 2.91Å; L242-T246 WeakPolarHBondContact O-CB 3.42Å; L242-T246 PolarHBondContact O-N 3.18Å; L242-T246 PolarHBondContact O-OG1 2.88Å
243	K	98.1	Very high	96.9	Very high	143 Å²	143	97.1 Å²	97.1	62%	0.622	48%	0.476	S	S	*	.	H	α-helix	trans	-62.1	-47.5	177	-76	175.9	178.4	175	0	111.8	V239 K240 H245 T246 A247	V239-K243 HydrophobicContact CG1-CD 4.26Å; V239-K243 WeakPolarHBondContact O-CG 2.95Å; V239-K243 PolarHBondContact O-N 3.29Å; K240-K243 PolarHBondContact O-N 3.04Å; K240-K243 VanDerWaalsContact O-N 3.15Å; K243-H245 VanDerWaalsContact C-N 3.33Å; K243-H245 PolarHBondContact O-N 3.4Å; K243-T246 PolarHBondContact O-N 3.03Å; K243-A247 PolarHBondContact O-N 3.14Å
244	D	97.6	Very high	96.8	Very high	98 Å²	98	96.1 Å²	96.1	52%	0.524	48%	0.477	S	S	.	.	H	α-helix	trans	-61.8	-43.2	178.3	-69.2	-15.3	0	0	0	110.6	K240 T246 A247 D248	K240-D244 PolarHBondContact O-N 2.89Å; D244-T246 PolarHBondContact O-N 3Å; D244-A247 PolarHBondContact O-N 3.43Å; D244-D248 PolarHBondContact O-N 3.26Å
245	H	94.4	Very high	96.6	Very high	67 Å²	67	93.5 Å²	93.5	31%	0.31	47%	0.472	S	S	.	.	H	α-helix	trans	-64.3	-39.6	176.7	-170.6	44.6	0	0	0	112.8	K241 L242 K243 D248 L249	K241-H245 VanDerWaalsContact O-CB 3.29Å; K241-H245 WeakPolarHBondContact O-CB 3.32Å; K241-H245 PolarHBondContact O-N 3.43Å; L242-H245 PolarHBondContact O-N 2.91Å; K243-H245 VanDerWaalsContact C-N 3.33Å; K243-H245 PolarHBondContact O-N 3.4Å; H245-D248 IonicContact ND1-OD2 2.78Å; H245-D248 PolarHBondContact O-N 3.41Å; H245-L249 WeakPolarHBondContact O-CG 3.39Å; H245-L249 PolarHBondContact O-N 3.27Å
246	T	96.6	Very high	96.4	Very high	79 Å²	79	92.4 Å²	92.4	49%	0.485	46%	0.461	S	S	.	.	H	α-helix	trans	-66.1	-42.3	178.3	-59.9	0	0	0	0	111	L242 K243 D244 L249 K250	L242-T246 WeakPolarHBondContact O-CB 3.42Å; L242-T246 PolarHBondContact O-N 3.18Å; L242-T246 PolarHBondContact O-OG1 2.88Å; K243-T246 PolarHBondContact O-N 3.03Å; D244-T246 PolarHBondContact O-N 3Å; T246-L249 PolarHBondContact O-N 3.02Å; T246-K250 WeakPolarHBondContact O-CB 3.3Å; T246-K250 PolarHBondContact O-N 2.81Å
247	A	97.8	Very high	96.2	Very high	58 Å²	58	91.9 Å²	91.9	48%	0.479	46%	0.457	S	S	.	.	H	α-helix	trans	-62.6	-44.7	175.7	0	0	0	0	0	111.9	K243 D244 K250 Q251	K243-A247 PolarHBondContact O-N 3.14Å; D244-A247 PolarHBondContact O-N 3.43Å; A247-K250 PolarHBondContact O-N 3.1Å; A247-Q251 WeakPolarHBondContact O-CB 3.27Å; A247-Q251 PolarHBondContact O-N 3.4Å
248	D	95.4	Very high	96.1	Very high	60 Å²	60	91.1 Å²	91.1	32%	0.321	46%	0.461	S	S	.	.	H	α-helix	trans	-60.5	-43.2	174.5	164.7	64.1	0	0	0	112.1	D244 H245 R252	D244-D248 PolarHBondContact O-N 3.26Å; H245-D248 IonicContact ND1-OD2 2.78Å; H245-D248 PolarHBondContact O-N 3.41Å; D248-R252 WeakPolarHBondContact O-CG 3.41Å; D248-R252 PolarHBondContact O-N 3.05Å; D248-R252 IonicContact OD1-CZ 3.41Å; D248-R252 IonicContact OD1-NH1 3.58Å; D248-R252 PolarHBondContact OD1-NH1 2.97Å; D248-R252 IonicContact OD2-CZ 3.39Å; D248-R252 IonicContact OD2-NH1 2.63Å; D248-R252 PolarHBondContact OD2-NH1 3.3Å; D248-R252 IonicContact OD2-NH2 3.71Å; D248-R252 PolarHBondContact OD2-NH2 2.74Å
249	L	94.1	Very high	95.9	Very high	71 Å²	71	91.2 Å²	91.2	37%	0.372	46%	0.461	S	S	.	.	H	α-helix	trans	-62	-47.5	174.9	-78.2	168	0	0	0	112	H245 T246 Q251 R252 I253	H245-L249 WeakPolarHBondContact O-CG 3.39Å; H245-L249 PolarHBondContact O-N 3.27Å; T246-L249 PolarHBondContact O-N 3.02Å; L249-Q251 PolarHBondContact O-N 3.48Å; L249-R252 PolarHBondContact O-N 3Å; L249-I253 WeakPolarHBondContact O-CG1 3.22Å; L249-I253 PolarHBondContact O-N 3.01Å
250	K	97.3	Very high	95.7	Very high	129 Å²	129	91 Å²	91	56%	0.561	46%	0.457	S	S	*	.	H	α-helix	trans	-57.4	-49.6	177.7	179.6	178.2	172.2	-179.4	0	111.2	T246 A247 R252 I253 E254	T246-K250 WeakPolarHBondContact O-CB 3.3Å; T246-K250 PolarHBondContact O-N 2.81Å; A247-K250 PolarHBondContact O-N 3.1Å; K250-R252 VanDerWaalsContact C-N 3.3Å; K250-R252 PolarHBondContact O-N 2.99Å; K250-I253 PolarHBondContact O-N 3.4Å; K250-E254 WeakPolarHBondContact CE-OE1 3.49Å; K250-E254 IonicContact NZ-OE1 3.61Å; K250-E254 WeakPolarHBondContact O-CG 3.34Å; K250-E254 PolarHBondContact O-N 2.87Å
251	Q	96.9	Very high	95.5	Very high	133 Å²	133	90.2 Å²	90.2	62%	0.621	46%	0.456	S	S	*	.	H	α-helix	trans	-59.7	-40.8	179.3	-173.2	-177.5	14.9	0	0	111.9	A247 L249 E254 A255	A247-Q251 WeakPolarHBondContact O-CB 3.27Å; A247-Q251 PolarHBondContact O-N 3.4Å; L249-Q251 PolarHBondContact O-N 3.48Å; Q251-E254 PolarHBondContact O-N 2.85Å; Q251-A255 WeakPolarHBondContact O-CB 3.29Å; Q251-A255 PolarHBondContact O-N 2.82Å
252	R	92.3	Very high	95.4	Very high	67 Å²	67	91.1 Å²	91.1	25%	0.253	46%	0.461	S	S	.	.	H	α-helix	trans	-64.8	-43.1	176.4	-79	-163.5	-65.8	-102.7	-8.5	112.8	D248 L249 K250 E254 A255 Q256 R498	D248-R252 WeakPolarHBondContact O-CG 3.41Å; D248-R252 PolarHBondContact O-N 3.05Å; D248-R252 IonicContact OD1-CZ 3.41Å; D248-R252 IonicContact OD1-NH1 3.58Å; D248-R252 PolarHBondContact OD1-NH1 2.97Å; D248-R252 IonicContact OD2-CZ 3.39Å; D248-R252 IonicContact OD2-NH1 2.63Å; D248-R252 PolarHBondContact OD2-NH1 3.3Å; D248-R252 IonicContact OD2-NH2 3.71Å; D248-R252 PolarHBondContact OD2-NH2 2.74Å; L249-R252 PolarHBondContact O-N 3Å; K250-R252 VanDerWaalsContact C-N 3.3Å; K250-R252 PolarHBondContact O-N 2.99Å; R252-E254 VanDerWaalsContact C-N 3.34Å; R252-A255 PolarHBondContact O-N 3.21Å; R252-Q256 VanDerWaalsContact O-CG 3.31Å; R252-Q256 WeakPolarHBondContact O-CG 3.35Å; R252-Q256 PolarHBondContact O-N 2.85Å; R252-R498 VanDerWaalsContact NH2-NH2 3.13Å
253	I	94.9	Very high	95.3	Very high	98 Å²	98	86.7 Å²	86.7	50%	0.503	44%	0.437	S	S	.	.	H	α-helix	trans	-59.1	-51.5	176.4	-68.1	165.3	0	0	0	108.8	L249 K250 A255 Q256 F257	L249-I253 WeakPolarHBondContact O-CG1 3.22Å; L249-I253 PolarHBondContact O-N 3.01Å; K250-I253 PolarHBondContact O-N 3.4Å; I253-A255 VanDerWaalsContact C-N 3.32Å; I253-A255 PolarHBondContact O-N 3.11Å; I253-Q256 PolarHBondContact O-N 3.32Å; I253-F257 HydrophobicContact CG2-CD2 3.86Å; I253-F257 HydrophobicContact CG2-CE2 4.05Å; I253-F257 WeakPolarHBondContact O-CD2 3.47Å; I253-F257 PolarHBondContact O-N 2.86Å
254	E	97.3	Very high	95.2	Very high	97 Å²	97	83.8 Å²	83.8	45%	0.453	43%	0.428	S	S	.	.	H	α-helix	trans	-58.1	-42.7	178.9	-71.7	172.2	173	0	0	112.3	K250 Q251 R252 S258	K250-E254 WeakPolarHBondContact CE-OE1 3.49Å; K250-E254 IonicContact NZ-OE1 3.61Å; K250-E254 WeakPolarHBondContact O-CG 3.34Å; K250-E254 PolarHBondContact O-N 2.87Å; Q251-E254 PolarHBondContact O-N 2.85Å; R252-E254 VanDerWaalsContact C-N 3.34Å; E254-S258 VanDerWaalsContact O-CB 3.27Å; E254-S258 WeakPolarHBondContact O-CB 3.42Å; E254-S258 PolarHBondContact O-N 2.81Å; E254-S258 PolarHBondContact O-OG 2.82Å
255	A	94.4	Very high	95.1	Very high	45 Å²	45	85.7 Å²	85.7	37%	0.372	43%	0.429	S	S	.	.	H	α-helix	trans	-63.3	-47.3	178.1	0	0	0	0	0	112.2	Q251 R252 I253 F257 S258 E259	Q251-A255 WeakPolarHBondContact O-CB 3.29Å; Q251-A255 PolarHBondContact O-N 2.82Å; R252-A255 PolarHBondContact O-N 3.21Å; I253-A255 VanDerWaalsContact C-N 3.32Å; I253-A255 PolarHBondContact O-N 3.11Å; A255-F257 PolarHBondContact O-N 2.86Å; A255-S258 WeakPolarHBondContact O-CB 3.48Å; A255-S258 PolarHBondContact O-N 2.83Å; A255-E259 PolarHBondContact O-N 3.21Å
256	Q	92.1	Very high	95.1	Very high	67 Å²	67	87.5 Å²	87.5	31%	0.313	44%	0.437	S	S	.	.	H	α-helix	trans	-64.4	-41.5	179.2	-67.3	-67.2	-88.7	0	0	111.9	R252 I253 S258 E259 L260	R252-Q256 VanDerWaalsContact O-CG 3.31Å; R252-Q256 WeakPolarHBondContact O-CG 3.35Å; R252-Q256 PolarHBondContact O-N 2.85Å; I253-Q256 PolarHBondContact O-N 3.32Å; Q256-S258 VanDerWaalsContact C-N 3.34Å; Q256-E259 PolarHBondContact NE2-OE2 2.89Å; Q256-E259 PolarHBondContact O-N 3.37Å; Q256-L260 WeakPolarHBondContact O-CG 3.24Å; Q256-L260 PolarHBondContact O-N 2.91Å
257	F	94.9	Very high	95	Very high	113 Å²	113	86 Å²	86	50%	0.496	43%	0.425	S	S	.	.	H	α-helix	trans	-67.5	-34.8	174.5	-87.2	-88	0	0	0	112.6	I253 A255 E259 L260 H261	I253-F257 HydrophobicContact CG2-CD2 3.86Å; I253-F257 HydrophobicContact CG2-CE2 4.05Å; I253-F257 WeakPolarHBondContact O-CD2 3.47Å; I253-F257 PolarHBondContact O-N 2.86Å; A255-F257 PolarHBondContact O-N 2.86Å; F257-E259 VanDerWaalsContact C-N 3.35Å; F257-E259 PolarHBondContact O-N 2.94Å; F257-L260 PolarHBondContact O-N 3.23Å; F257-H261 WeakPolarHBondContact O-CB 3.28Å; F257-H261 VanDerWaalsContact O-CG 3.24Å; F257-H261 PolarHBondContact O-N 3.06Å
258	S	95.5	Very high	94.8	Very high	68 Å²	68	87.5 Å²	87.5	48%	0.476	42%	0.422	S	S	.	.	H	α-helix	trans	-63.3	-40.9	176.1	-62.5	0	0	0	0	111.9	E254 A255 Q256 L260 H261 Q262	E254-S258 VanDerWaalsContact O-CB 3.27Å; E254-S258 WeakPolarHBondContact O-CB 3.42Å; E254-S258 PolarHBondContact O-N 2.81Å; E254-S258 PolarHBondContact O-OG 2.82Å; A255-S258 WeakPolarHBondContact O-CB 3.48Å; A255-S258 PolarHBondContact O-N 2.83Å; Q256-S258 VanDerWaalsContact C-N 3.34Å; S258-L260 PolarHBondContact O-N 3.4Å; S258-H261 PolarHBondContact O-N 2.94Å; S258-Q262 VanDerWaalsContact O-CB 3.29Å; S258-Q262 WeakPolarHBondContact O-CB 3.39Å; S258-Q262 PolarHBondContact O-N 3.1Å
259	E	92.6	Very high	94.9	Very high	111 Å²	111	88 Å²	88	52%	0.519	42%	0.421	S	S	.	.	H	α-helix	trans	-59.5	-44.9	173.6	-71.8	172.3	-177.5	0	0	111.4	A255 Q256 F257 Q262 F263	A255-E259 PolarHBondContact O-N 3.21Å; Q256-E259 PolarHBondContact NE2-OE2 2.89Å; Q256-E259 PolarHBondContact O-N 3.37Å; F257-E259 VanDerWaalsContact C-N 3.35Å; F257-E259 PolarHBondContact O-N 2.94Å; E259-Q262 PolarHBondContact O-N 3.29Å; E259-F263 WeakPolarHBondContact O-CB 3.28Å; E259-F263 PolarHBondContact O-N 3.05Å
260	L	93.9	Very high	94.9	Very high	63 Å²	63	88.2 Å²	88.2	33%	0.33	42%	0.422	S	S	.	.	H	α-helix	trans	-65.6	-45	177.5	-64.3	175.3	0	0	0	112.4	Q256 F257 S258 Q262 F263 L264 L361	Q256-L260 WeakPolarHBondContact O-CG 3.24Å; Q256-L260 PolarHBondContact O-N 2.91Å; F257-L260 PolarHBondContact O-N 3.23Å; S258-L260 PolarHBondContact O-N 3.4Å; L260-Q262 VanDerWaalsContact C-N 3.33Å; L260-Q262 PolarHBondContact O-N 2.76Å; L260-F263 PolarHBondContact O-N 3.29Å; L260-L264 WeakPolarHBondContact O-CG 3.5Å; L260-L264 PolarHBondContact O-N 3.28Å; L260-L361 HydrophobicContact CD2-CD1 3.66Å
261	H	95.3	Very high	94.7	Very high	117 Å²	117	83.3 Å²	83.3	54%	0.542	40%	0.402	S	S	.	.	H	α-helix	trans	-61.1	-43.2	176.1	-69.5	164.6	0	0	0	111.5	F257 S258 L264 Y265	F257-H261 WeakPolarHBondContact O-CB 3.28Å; F257-H261 VanDerWaalsContact O-CG 3.24Å; F257-H261 PolarHBondContact O-N 3.06Å; S258-H261 PolarHBondContact O-N 2.94Å; H261-L264 PolarHBondContact O-N 2.93Å; H261-Y265 VanDerWaalsContact O-CB 3.29Å; H261-Y265 WeakPolarHBondContact O-CB 3.49Å; H261-Y265 PolarHBondContact O-N 3.04Å
262	Q	95.2	Very high	94.5	Very high	114 Å²	114	80.8 Å²	80.8	53%	0.533	39%	0.39	S	S	.	.	H	α-helix	trans	-62.2	-44	177.4	-177.6	174.4	3	0	0	111.3	S258 E259 L260 Y265 Q266	S258-Q262 VanDerWaalsContact O-CB 3.29Å; S258-Q262 WeakPolarHBondContact O-CB 3.39Å; S258-Q262 PolarHBondContact O-N 3.1Å; E259-Q262 PolarHBondContact O-N 3.29Å; L260-Q262 VanDerWaalsContact C-N 3.33Å; L260-Q262 PolarHBondContact O-N 2.76Å; Q262-Y265 PolarHBondContact O-N 3.17Å; Q262-Q266 HydrophobicContact CG-CG 4.48Å; Q262-Q266 WeakPolarHBondContact O-CB 3.4Å; Q262-Q266 VanDerWaalsContact O-CG 3.24Å; Q262-Q266 WeakPolarHBondContact O-CG 2.99Å; Q262-Q266 PolarHBondContact O-N 3.17Å
263	F	95	Very high	94.8	Very high	23 Å²	23	81.8 Å²	81.8	10%	0.101	40%	0.404	C	S	.	.	H	α-helix	trans	-57.7	-51.4	174.8	171.2	-90.5	0	0	0	111.7	E259 L260 Y265 Q266 E267 V357 L361 S364	E259-F263 WeakPolarHBondContact O-CB 3.28Å; E259-F263 PolarHBondContact O-N 3.05Å; L260-F263 PolarHBondContact O-N 3.29Å; F263-Y265 VanDerWaalsContact C-N 3.33Å; F263-Y265 PolarHBondContact O-N 3.23Å; F263-Q266 PolarHBondContact O-N 3.08Å; F263-E267 HydrophobicContact CE1-CG 3.92Å; F263-E267 HydrophobicContact CE2-CG 4.03Å; F263-E267 HydrophobicContact CZ-CG 3.64Å; F263-E267 PolarHBondContact O-N 3.17Å; F263-V357 HydrophobicContact CE1-CG1 3.98Å; F263-L361 HydrophobicContact CD1-CB 4.22Å; F263-L361 HydrophobicContact CD1-CD1 3.4Å; F263-L361 HydrophobicContact CD1-CG 4.36Å; F263-L361 HydrophobicContact CE1-CB 3.56Å; F263-L361 HydrophobicContact CE1-CD1 3.68Å; F263-L361 HydrophobicContact CE1-CG 4.19Å; F263-L361 HydrophobicContact CG-CD1 3.91Å; F263-L361 VanDerWaalsContact CZ-CA 3.44Å; F263-L361 HydrophobicContact CZ-CB 3.94Å; F263-L361 HydrophobicContact CZ-CD1 4.39Å; F263-L361 VanDerWaalsContact CZ-N 3.29Å; F263-S364 VanDerWaalsContact CD2-OG 3.31Å; F263-S364 WeakPolarHBondContact CD2-OG 3.31Å
264	L	95	Very high	94.7	Very high	81 Å²	81	82.1 Å²	82.1	42%	0.424	40%	0.402	S	S	.	.	H	α-helix	trans	-61.6	-42.5	-179.3	-68.9	174.8	0	0	0	111.8	L260 H261 E267 E268 V357	L260-L264 WeakPolarHBondContact O-CG 3.5Å; L260-L264 PolarHBondContact O-N 3.28Å; H261-L264 PolarHBondContact O-N 2.93Å; L264-E267 PolarHBondContact O-N 3.26Å; L264-E268 WeakPolarHBondContact O-CB 3.22Å; L264-E268 PolarHBondContact O-N 2.78Å; L264-V357 HydrophobicContact CD2-CG1 3.6Å
265	Y	96.1	Very high	94.6	Very high	139 Å²	139	80.8 Å²	80.8	55%	0.545	40%	0.397	S	S	.	.	H	α-helix	trans	-61.4	-44.3	176.1	179.4	-94.3	0	0	0	111.9	H261 Q262 F263 E268 K269	H261-Y265 VanDerWaalsContact O-CB 3.29Å; H261-Y265 WeakPolarHBondContact O-CB 3.49Å; H261-Y265 PolarHBondContact O-N 3.04Å; Q262-Y265 PolarHBondContact O-N 3.17Å; F263-Y265 VanDerWaalsContact C-N 3.33Å; F263-Y265 PolarHBondContact O-N 3.23Å; Y265-E268 PolarHBondContact O-N 2.77Å; Y265-K269 HydrophobicContact CD1-CG 4.18Å; Y265-K269 HydrophobicContact CE1-CG 3.76Å; Y265-K269 HydrophobicContact CE2-CD 4.46Å; Y265-K269 VanDerWaalsContact CE2-CE 3.44Å; Y265-K269 HydrophobicContact CE2-CG 4.24Å; Y265-K269 VanDerWaalsContact CZ-CE 3.49Å; Y265-K269 WeakPolarHBondContact O-CG 3.42Å; Y265-K269 PolarHBondContact O-N 3.33Å; Y265-K269 WeakPolarHBondContact OH-CE 3.42Å
266	Q	94.8	Very high	94.7	Very high	105 Å²	105	84.3 Å²	84.3	49%	0.491	40%	0.404	S	S	.	.	H	α-helix	trans	-63.7	-44.8	178.4	-75.1	173.9	-6.9	0	0	111.9	Q262 F263 E268 K269 L270	Q262-Q266 HydrophobicContact CG-CG 4.48Å; Q262-Q266 WeakPolarHBondContact O-CB 3.4Å; Q262-Q266 VanDerWaalsContact O-CG 3.24Å; Q262-Q266 WeakPolarHBondContact O-CG 2.99Å; Q262-Q266 PolarHBondContact O-N 3.17Å; F263-Q266 PolarHBondContact O-N 3.08Å; Q266-E268 PolarHBondContact O-N 3.05Å; Q266-K269 PolarHBondContact O-N 2.95Å; Q266-L270 VanDerWaalsContact O-CB 3.29Å; Q266-L270 WeakPolarHBondContact O-CB 3.35Å; Q266-L270 PolarHBondContact O-N 2.92Å
267	E	93.5	Very high	94.8	Very high	47 Å²	47	84.2 Å²	84.2	22%	0.22	41%	0.408	C	S	.	.	H	α-helix	trans	-61.3	-43.2	176.1	-78.6	-63.1	116.5	0	0	111.9	F263 L264 L270 L271	F263-E267 HydrophobicContact CE1-CG 3.92Å; F263-E267 HydrophobicContact CE2-CG 4.03Å; F263-E267 HydrophobicContact CZ-CG 3.64Å; F263-E267 PolarHBondContact O-N 3.17Å; L264-E267 PolarHBondContact O-N 3.26Å; E267-L270 PolarHBondContact O-N 2.83Å; E267-L271 WeakPolarHBondContact O-CG 3.02Å; E267-L271 PolarHBondContact O-N 3.15Å; E267-L271 VanDerWaalsContact O-N 3.09Å
268	E	94.5	Very high	94.7	Very high	89 Å²	89	80.5 Å²	80.5	42%	0.416	39%	0.392	S	S	.	.	H	α-helix	trans	-58.8	-50.8	174.9	-172.7	-150.2	134.6	0	0	111.3	L264 Y265 Q266 L270 L271 Q272	L264-E268 WeakPolarHBondContact O-CB 3.22Å; L264-E268 PolarHBondContact O-N 2.78Å; Y265-E268 PolarHBondContact O-N 2.77Å; Q266-E268 PolarHBondContact O-N 3.05Å; E268-L270 VanDerWaalsContact C-N 3.34Å; E268-L270 PolarHBondContact O-N 3.49Å; E268-L271 PolarHBondContact O-N 2.94Å; E268-Q272 WeakPolarHBondContact O-CG 3.09Å; E268-Q272 PolarHBondContact O-N 3.33Å; E268-Q272 PolarHBondContact OE1-NE2 3.43Å
269	K	96.5	Very high	94.7	Very high	71 Å²	71	81.8 Å²	81.8	31%	0.309	39%	0.391	S	S	.	.	H	α-helix	trans	-64.8	-39	-179	-66.9	-62.2	162.9	-136.7	0	112.1	Y265 Q266 L271 Q272 V273	Y265-K269 HydrophobicContact CD1-CG 4.18Å; Y265-K269 HydrophobicContact CE1-CG 3.76Å; Y265-K269 HydrophobicContact CE2-CD 4.46Å; Y265-K269 VanDerWaalsContact CE2-CE 3.44Å; Y265-K269 HydrophobicContact CE2-CG 4.24Å; Y265-K269 VanDerWaalsContact CZ-CE 3.49Å; Y265-K269 WeakPolarHBondContact O-CG 3.42Å; Y265-K269 PolarHBondContact O-N 3.33Å; Y265-K269 WeakPolarHBondContact OH-CE 3.42Å; Q266-K269 PolarHBondContact O-N 2.95Å; K269-L271 VanDerWaalsContact C-N 3.33Å; K269-L271 PolarHBondContact O-N 3.44Å; K269-Q272 PolarHBondContact O-N 3.31Å; K269-V273 WeakPolarHBondContact O-CG2 3.29Å; K269-V273 PolarHBondContact O-N 3.02Å
270	L	94.1	Very high	94.8	Very high	75 Å²	75	84.2 Å²	84.2	39%	0.393	40%	0.395	S	S	.	.	H	α-helix	trans	-59.7	-44.4	176	-179.1	63	0	0	0	111.5	Q266 E267 E268 V273 K274	Q266-L270 VanDerWaalsContact O-CB 3.29Å; Q266-L270 WeakPolarHBondContact O-CB 3.35Å; Q266-L270 PolarHBondContact O-N 2.92Å; E267-L270 PolarHBondContact O-N 2.83Å; E268-L270 VanDerWaalsContact C-N 3.34Å; E268-L270 PolarHBondContact O-N 3.49Å; L270-V273 PolarHBondContact O-N 3.22Å; L270-K274 HydrophobicContact CG-CD 4.34Å; L270-K274 WeakPolarHBondContact O-CG 3.38Å; L270-K274 PolarHBondContact O-N 2.91Å
271	L	93.2	Very high	94.8	Very high	26 Å²	26	87.2 Å²	87.2	14%	0.136	40%	0.402	C	S	.	.	H	α-helix	trans	-66.8	-41.5	178	-71.3	170.6	0	0	0	112.3	E267 E268 K269 V273 K274 L275 L353	E267-L271 WeakPolarHBondContact O-CG 3.02Å; E267-L271 PolarHBondContact O-N 3.15Å; E267-L271 VanDerWaalsContact O-N 3.09Å; E268-L271 PolarHBondContact O-N 2.94Å; K269-L271 VanDerWaalsContact C-N 3.33Å; K269-L271 PolarHBondContact O-N 3.44Å; L271-V273 VanDerWaalsContact C-N 3.35Å; L271-V273 PolarHBondContact O-N 2.72Å; L271-K274 PolarHBondContact O-N 3.03Å; L271-L275 PolarHBondContact O-N 3.4Å; L271-L353 HydrophobicContact CD1-CD1 3.33Å
272	Q	94.5	Very high	94.7	Very high	80 Å²	80	82.3 Å²	82.3	37%	0.374	38%	0.379	S	S	.	.	H	α-helix	trans	-61.1	-42.3	175.2	-74.2	173.6	0.5	0	0	112.1	E268 K269 L275 K276	E268-Q272 WeakPolarHBondContact O-CG 3.09Å; E268-Q272 PolarHBondContact O-N 3.33Å; E268-Q272 PolarHBondContact OE1-NE2 3.43Å; K269-Q272 PolarHBondContact O-N 3.31Å; Q272-L275 PolarHBondContact O-N 3.4Å; Q272-K276 WeakPolarHBondContact O-CG 3.06Å; Q272-K276 PolarHBondContact O-N 2.94Å
273	V	96.8	Very high	94.7	Very high	89 Å²	89	81 Å²	81	54%	0.539	38%	0.376	S	S	.	.	H	α-helix	trans	-64.6	-43.8	176.2	170.5	0	0	0	0	111	K269 L270 L271 L275 K276 T277	K269-V273 WeakPolarHBondContact O-CG2 3.29Å; K269-V273 PolarHBondContact O-N 3.02Å; L270-V273 PolarHBondContact O-N 3.22Å; L271-V273 VanDerWaalsContact C-N 3.35Å; L271-V273 PolarHBondContact O-N 2.72Å; V273-L275 VanDerWaalsContact C-N 3.34Å; V273-L275 PolarHBondContact O-N 2.68Å; V273-K276 PolarHBondContact O-N 3.03Å; V273-T277 WeakPolarHBondContact O-CB 3.41Å; V273-T277 PolarHBondContact O-N 3.47Å; V273-T277 PolarHBondContact O-OG1 2.92Å
274	K	94.2	Very high	94.7	Very high	105 Å²	105	84.5 Å²	84.5	46%	0.457	40%	0.395	S	S	.	.	H	α-helix	trans	-60.3	-43	176.3	-74.7	172.6	179.5	172.3	0	111.8	L270 L271 T277 E278 F349	L270-K274 HydrophobicContact CG-CD 4.34Å; L270-K274 WeakPolarHBondContact O-CG 3.38Å; L270-K274 PolarHBondContact O-N 2.91Å; L271-K274 PolarHBondContact O-N 3.03Å; K274-T277 PolarHBondContact O-N 2.92Å; K274-E278 PolarHBondContact O-N 3.29Å; K274-E278 VanDerWaalsContact O-N 3.12Å; K274-F349 HydrophobicContact CB-CE1 3.88Å
275	L	94.6	Very high	94.6	Very high	68 Å²	68	85.5 Å²	85.5	36%	0.356	39%	0.393	S	S	.	.	H	α-helix	trans	-63.4	-49.7	177.8	-179.9	61.1	0	0	0	111.9	L271 Q272 V273 T277 E278 E279 L344 F349	L271-L275 PolarHBondContact O-N 3.4Å; Q272-L275 PolarHBondContact O-N 3.4Å; V273-L275 VanDerWaalsContact C-N 3.34Å; V273-L275 PolarHBondContact O-N 2.68Å; L275-T277 PolarHBondContact O-N 3.46Å; L275-E278 PolarHBondContact O-N 3.04Å; L275-E278 VanDerWaalsContact O-N 3.14Å; L275-E279 PolarHBondContact O-N 3.32Å; L275-L344 HydrophobicContact CD1-CD1 4.23Å; L275-F349 HydrophobicContact CB-CD1 4.11Å; L275-F349 HydrophobicContact CB-CE1 3.94Å; L275-F349 HydrophobicContact CB-CZ 4.31Å; L275-F349 HydrophobicContact CD1-CD1 4.42Å; L275-F349 HydrophobicContact CD1-CD2 3.89Å; L275-F349 HydrophobicContact CD1-CE1 4.46Å; L275-F349 HydrophobicContact CD1-CE2 3.93Å; L275-F349 HydrophobicContact CD1-CG 4.14Å; L275-F349 HydrophobicContact CD1-CZ 4.22Å
276	K	95.6	Very high	94.6	Very high	119 Å²	119	81.9 Å²	81.9	52%	0.517	38%	0.382	S	S	.	.	H	α-helix	trans	-59.6	-32.8	176.6	-74.4	-177.5	177.9	-176.7	0	112.8	Q272 V273 R280	Q272-K276 WeakPolarHBondContact O-CG 3.06Å; Q272-K276 PolarHBondContact O-N 2.94Å; V273-K276 PolarHBondContact O-N 3.03Å; K276-R280 WeakPolarHBondContact O-CB 3.35Å; K276-R280 VanDerWaalsContact O-CG 3.24Å; K276-R280 WeakPolarHBondContact O-CG 3.37Å; K276-R280 PolarHBondContact O-N 3.08Å
277	T	95.3	Very high	94.6	Very high	66 Å²	66	81.9 Å²	81.9	41%	0.405	39%	0.386	S	S	.	.	H	α-helix	trans	-69.4	-42.1	177.4	-56.5	0	0	0	0	111.3	V273 K274 L275 R280 R281	V273-T277 WeakPolarHBondContact O-CB 3.41Å; V273-T277 PolarHBondContact O-N 3.47Å; V273-T277 PolarHBondContact O-OG1 2.92Å; K274-T277 PolarHBondContact O-N 2.92Å; L275-T277 PolarHBondContact O-N 3.46Å; T277-R280 PolarHBondContact O-N 3.43Å; T277-R281 PolarHBondContact O-N 3.47Å; T277-R281 VanDerWaalsContact O-N 3.08Å
278	E	93.5	Very high	94.7	Very high	34 Å²	34	85.4 Å²	85.4	16%	0.159	40%	0.402	C	S	.	.	H	α-helix	trans	-68	-43.9	176.7	-154.3	76.3	162.1	0	0	111	K274 L275 R280 R281 E282 L344 R348	K274-E278 PolarHBondContact O-N 3.29Å; K274-E278 VanDerWaalsContact O-N 3.12Å; L275-E278 PolarHBondContact O-N 3.04Å; L275-E278 VanDerWaalsContact O-N 3.14Å; E278-R280 PolarHBondContact O-N 2.83Å; E278-R281 VanDerWaalsContact CD-NH1 3.33Å; E278-R281 WeakPolarHBondContact O-CB 3.27Å; E278-R281 PolarHBondContact O-N 3.35Å; E278-R281 VanDerWaalsContact O-N 3.09Å; E278-R281 IonicContact OE1-NH1 2.82Å; E278-R281 PolarHBondContact OE1-NH1 2.7Å; E278-R281 IonicContact OE2-CZ 3.15Å; E278-R281 IonicContact OE2-NH1 2.97Å; E278-R281 PolarHBondContact OE2-NH1 2.98Å; E278-R281 IonicContact OE2-NH2 2.73Å; E278-E282 WeakPolarHBondContact O-CG 3.26Å; E278-E282 PolarHBondContact O-N 2.81Å; E278-L344 HydrophobicContact CB-CD2 4.16Å; E278-L344 HydrophobicContact CG-CD2 4.12Å; E278-R348 IonicContact OE1-NH1 3.66Å; E278-R348 PolarHBondContact OE1-NH1 2.92Å
279	E	94.3	Very high	94.7	Very high	95 Å²	95	82.5 Å²	82.5	44%	0.444	39%	0.389	S	S	.	.	H	α-helix	trans	-53.7	-49.8	172.8	177.8	-173.2	-149.6	0	0	111.7	L275 R281 E282 L283	L275-E279 PolarHBondContact O-N 3.32Å; E279-R281 VanDerWaalsContact C-N 3.29Å; E279-R281 PolarHBondContact O-N 2.81Å; E279-E282 PolarHBondContact O-N 2.88Å; E279-E282 VanDerWaalsContact O-N 3.17Å; E279-L283 HydrophobicContact CG-CD1 4.06Å; E279-L283 HydrophobicContact CG-CG 4.48Å; E279-L283 WeakPolarHBondContact O-CG 3.09Å; E279-L283 PolarHBondContact O-N 3.45Å
280	R	95.9	Very high	94.6	Very high	162 Å²	162	85.5 Å²	85.5	61%	0.611	40%	0.402	S	S	*	.	H	α-helix	trans	-59.4	-39.6	176.8	-76.8	173.3	-176.6	170.8	-0.9	112.4	K276 T277 E278 L283 I284	K276-R280 WeakPolarHBondContact O-CB 3.35Å; K276-R280 VanDerWaalsContact O-CG 3.24Å; K276-R280 WeakPolarHBondContact O-CG 3.37Å; K276-R280 PolarHBondContact O-N 3.08Å; T277-R280 PolarHBondContact O-N 3.43Å; E278-R280 PolarHBondContact O-N 2.83Å; R280-L283 PolarHBondContact O-N 2.77Å; R280-I284 VanDerWaalsContact O-CG1 3.28Å; R280-I284 WeakPolarHBondContact O-CG1 3.47Å; R280-I284 PolarHBondContact O-N 2.8Å
281	R	93.8	Very high	94.7	Very high	127 Å²	127	84.6 Å²	84.6	48%	0.479	41%	0.405	S	S	.	.	H	α-helix	trans	-63	-42.8	176.7	-172.3	-172.7	-66.1	145.6	6.2	111.2	T277 E278 E279 R285	T277-R281 PolarHBondContact O-N 3.47Å; T277-R281 VanDerWaalsContact O-N 3.08Å; E278-R281 VanDerWaalsContact CD-NH1 3.33Å; E278-R281 WeakPolarHBondContact O-CB 3.27Å; E278-R281 PolarHBondContact O-N 3.35Å; E278-R281 VanDerWaalsContact O-N 3.09Å; E278-R281 IonicContact OE1-NH1 2.82Å; E278-R281 PolarHBondContact OE1-NH1 2.7Å; E278-R281 IonicContact OE2-CZ 3.15Å; E278-R281 IonicContact OE2-NH1 2.97Å; E278-R281 PolarHBondContact OE2-NH1 2.98Å; E278-R281 IonicContact OE2-NH2 2.73Å; E279-R281 VanDerWaalsContact C-N 3.29Å; E279-R281 PolarHBondContact O-N 2.81Å; R281-R285 WeakPolarHBondContact O-CG 3.49Å; R281-R285 PolarHBondContact O-N 2.99Å
282	E	93.6	Very high	94.8	Very high	13 Å²	13	88.2 Å²	88.2	6%	0.061	42%	0.424	C	S	.	.	H	α-helix	trans	-65	-42.4	175.9	-61.8	-41.1	117.5	0	0	112.3	E278 E279 I284 R285 L286 P342 L344	E278-E282 WeakPolarHBondContact O-CG 3.26Å; E278-E282 PolarHBondContact O-N 2.81Å; E279-E282 PolarHBondContact O-N 2.88Å; E279-E282 VanDerWaalsContact O-N 3.17Å; E282-I284 PolarHBondContact O-N 2.84Å; E282-R285 PolarHBondContact O-N 3.46Å; E282-R285 IonicContact OE1-CZ 2.74Å; E282-R285 IonicContact OE1-NE 2.68Å; E282-R285 IonicContact OE1-NH2 3.99Å; E282-R285 PolarHBondContact OE1-NH2 2.87Å; E282-R285 IonicContact OE2-CZ 3.45Å; E282-R285 IonicContact OE2-NE 2.72Å; E282-R285 PolarHBondContact OE2-NE 2.89Å; E282-R285 IonicContact OE2-NH1 2.99Å; E282-R285 IonicContact OE2-NH2 3.63Å; E282-R285 PolarHBondContact OE2-NH2 2.89Å; E282-L286 PolarHBondContact O-N 2.77Å; E282-P342 HydrophobicContact CB-CB 3.85Å; E282-P342 HydrophobicContact CG-CB 3.99Å; E282-P342 WeakPolarHBondContact OE2-CA 3.07Å; E282-P342 VanDerWaalsContact OE2-CB 3.24Å; E282-P342 WeakPolarHBondContact OE2-CB 3.34Å; E282-L344 HydrophobicContact CG-CD2 4.29Å
283	L	95.2	Very high	94.9	Very high	88 Å²	88	86.7 Å²	86.7	46%	0.461	42%	0.418	S	S	.	.	H	α-helix	trans	-61.9	-43	178.1	-71.6	173.1	0	0	0	112.1	E279 R280 R285 L286 D287	E279-L283 HydrophobicContact CG-CD1 4.06Å; E279-L283 HydrophobicContact CG-CG 4.48Å; E279-L283 WeakPolarHBondContact O-CG 3.09Å; E279-L283 PolarHBondContact O-N 3.45Å; R280-L283 PolarHBondContact O-N 2.77Å; L283-R285 VanDerWaalsContact C-N 3.32Å; L283-R285 PolarHBondContact O-N 2.87Å; L283-L286 PolarHBondContact O-N 2.86Å; L283-D287 PolarHBondContact O-N 2.86Å
284	I	94.9	Very high	94.9	Very high	96 Å²	96	85 Å²	85	49%	0.492	41%	0.411	S	S	.	.	H	α-helix	trans	-58.6	-44.6	175.7	-69.8	164.6	0	0	0	110.7	R280 E282 L286 D287 E288	R280-I284 VanDerWaalsContact O-CG1 3.28Å; R280-I284 WeakPolarHBondContact O-CG1 3.47Å; R280-I284 PolarHBondContact O-N 2.8Å; E282-I284 PolarHBondContact O-N 2.84Å; I284-L286 VanDerWaalsContact C-N 3.31Å; I284-L286 PolarHBondContact O-N 2.84Å; I284-D287 PolarHBondContact O-N 3.07Å; I284-E288 HydrophobicContact CG2-CG 4.47Å; I284-E288 WeakPolarHBondContact O-CG 3.37Å; I284-E288 PolarHBondContact O-N 2.98Å
285	R	92.9	Very high	94.9	Very high	101 Å²	101	84.8 Å²	84.8	38%	0.381	42%	0.417	S	S	.	.	H	α-helix	trans	-62.1	-38.5	177.5	-70.9	-165.1	-79.7	169.4	-17.9	112.7	R281 E282 L283 H289	R281-R285 WeakPolarHBondContact O-CG 3.49Å; R281-R285 PolarHBondContact O-N 2.99Å; E282-R285 PolarHBondContact O-N 3.46Å; E282-R285 IonicContact OE1-CZ 2.74Å; E282-R285 IonicContact OE1-NE 2.68Å; E282-R285 IonicContact OE1-NH2 3.99Å; E282-R285 PolarHBondContact OE1-NH2 2.87Å; E282-R285 IonicContact OE2-CZ 3.45Å; E282-R285 IonicContact OE2-NE 2.72Å; E282-R285 PolarHBondContact OE2-NE 2.89Å; E282-R285 IonicContact OE2-NH1 2.99Å; E282-R285 IonicContact OE2-NH2 3.63Å; E282-R285 PolarHBondContact OE2-NH2 2.89Å; L283-R285 VanDerWaalsContact C-N 3.32Å; L283-R285 PolarHBondContact O-N 2.87Å; R285-H289 WeakPolarHBondContact O-CB 3.35Å; R285-H289 PolarHBondContact O-N 3.32Å; R285-H289 VanDerWaalsContact O-N 3.07Å
286	L	94.8	Very high	95	Very high	63 Å²	63	82.3 Å²	82.3	33%	0.33	40%	0.404	S	S	.	.	H	α-helix	trans	-67.5	-41.5	175.6	-73	177.1	0	0	0	112.1	E282 L283 I284 H289 K290 L339 P342	E282-L286 PolarHBondContact O-N 2.77Å; L283-L286 PolarHBondContact O-N 2.86Å; I284-L286 VanDerWaalsContact C-N 3.31Å; I284-L286 PolarHBondContact O-N 2.84Å; L286-H289 PolarHBondContact O-N 3.17Å; L286-K290 WeakPolarHBondContact O-CB 3.45Å; L286-K290 PolarHBondContact O-N 3.09Å; L286-L339 HydrophobicContact CD2-CD1 4.37Å; L286-L339 HydrophobicContact CD2-CD2 4.04Å; L286-P342 HydrophobicContact CD1-CG 4.03Å; L286-P342 HydrophobicContact CD2-CG 3.99Å; L286-P342 HydrophobicContact CG-CG 4.14Å
287	D	95.4	Very high	95	Very high	106 Å²	106	80.4 Å²	80.4	57%	0.567	40%	0.399	S	S	*	.	H	α-helix	trans	-65.2	-41.6	177.5	-80.4	-25	0	0	0	111.7	L283 I284 H289 K290 A291	L283-D287 PolarHBondContact O-N 2.86Å; I284-D287 PolarHBondContact O-N 3.07Å; D287-H289 PolarHBondContact O-N 2.96Å; D287-K290 PolarHBondContact O-N 3.17Å; D287-A291 WeakPolarHBondContact O-CB 3.48Å; D287-A291 PolarHBondContact O-N 3.42Å
288	E	94.3	Very high	95	Very high	120 Å²	120	79.7 Å²	79.7	56%	0.561	40%	0.397	S	S	*	.	H	α-helix	trans	-59.2	-46.2	172.5	-73.7	172.8	175.4	0	0	111.4	I284 K290 A291 L292	I284-E288 HydrophobicContact CG2-CG 4.47Å; I284-E288 WeakPolarHBondContact O-CG 3.37Å; I284-E288 PolarHBondContact O-N 2.98Å; E288-K290 PolarHBondContact O-N 2.83Å; E288-A291 WeakPolarHBondContact O-CB 3.42Å; E288-A291 PolarHBondContact O-N 2.83Å; E288-L292 WeakPolarHBondContact O-CG 3.43Å; E288-L292 PolarHBondContact O-N 2.97Å; E288-L292 VanDerWaalsContact O-N 3.07Å
289	H	94.5	Very high	95	Very high	28 Å²	28	81.6 Å²	81.6	13%	0.13	40%	0.402	C	S	.	.	H	α-helix	trans	-63.4	-41.4	177.1	-176.5	72.6	0	0	0	112.5	R285 L286 D287 A291 L292 L293 P337 L339	R285-H289 WeakPolarHBondContact O-CB 3.35Å; R285-H289 PolarHBondContact O-N 3.32Å; R285-H289 VanDerWaalsContact O-N 3.07Å; L286-H289 PolarHBondContact O-N 3.17Å; D287-H289 PolarHBondContact O-N 2.96Å; H289-A291 VanDerWaalsContact C-N 3.31Å; H289-A291 PolarHBondContact O-N 3.03Å; H289-L292 PolarHBondContact O-N 3.02Å; H289-L293 WeakPolarHBondContact NE2-CD1 3.45Å; H289-L293 PolarHBondContact O-N 3.29Å; H289-P337 PolarHBondContact CE1-O 2.69Å; H289-L339 HydrophobicContact CB-CD1 3.95Å
290	K	95.3	Very high	95	Very high	135 Å²	135	79.3 Å²	79.3	59%	0.587	39%	0.393	S	S	*	.	H	α-helix	trans	-62.4	-37.9	175.2	-178.7	-177.2	174.2	-174.5	0	111.9	L286 D287 E288 L293 S294	L286-K290 WeakPolarHBondContact O-CB 3.45Å; L286-K290 PolarHBondContact O-N 3.09Å; D287-K290 PolarHBondContact O-N 3.17Å; E288-K290 PolarHBondContact O-N 2.83Å; K290-L293 PolarHBondContact O-N 3.41Å; K290-S294 WeakPolarHBondContact O-CB 3.39Å; K290-S294 PolarHBondContact O-N 3.42Å; K290-S294 PolarHBondContact O-OG 3.28Å
291	A	96.1	Very high	95	Very high	55 Å²	55	79.8 Å²	79.8	46%	0.455	40%	0.395	S	S	.	.	H	α-helix	trans	-64.4	-44.5	175.7	0	0	0	0	0	111.4	D287 E288 H289 L293 S294 V295	D287-A291 WeakPolarHBondContact O-CB 3.48Å; D287-A291 PolarHBondContact O-N 3.42Å; E288-A291 WeakPolarHBondContact O-CB 3.42Å; E288-A291 PolarHBondContact O-N 2.83Å; H289-A291 VanDerWaalsContact C-N 3.31Å; H289-A291 PolarHBondContact O-N 3.03Å; A291-L293 PolarHBondContact O-N 3.36Å; A291-S294 WeakPolarHBondContact O-CB 3.43Å; A291-S294 PolarHBondContact O-N 3.23Å; A291-S294 VanDerWaalsContact O-N 3.13Å; A291-V295 WeakPolarHBondContact O-CG2 3.32Å; A291-V295 PolarHBondContact O-N 2.81Å
292	L	95.8	Very high	95	Very high	102 Å²	102	80.5 Å²	80.5	53%	0.534	40%	0.397	S	S	.	.	H	α-helix	trans	-59.6	-45.1	174.8	-67.4	173.1	0	0	0	112	E288 H289 S294 V295 E296 P337	E288-L292 WeakPolarHBondContact O-CG 3.43Å; E288-L292 PolarHBondContact O-N 2.97Å; E288-L292 VanDerWaalsContact O-N 3.07Å; H289-L292 PolarHBondContact O-N 3.02Å; L292-S294 VanDerWaalsContact C-N 3.29Å; L292-S294 PolarHBondContact O-N 3.01Å; L292-V295 PolarHBondContact O-N 3.42Å; L292-E296 PolarHBondContact O-N 3.07Å; L292-E296 VanDerWaalsContact O-N 3.08Å; L292-P337 HydrophobicContact CB-CB 4.21Å; L292-P337 HydrophobicContact CB-CG 4.01Å; L292-P337 HydrophobicContact CD1-CB 4.35Å
293	L	95.8	Very high	94.9	Very high	48 Å²	48	81.1 Å²	81.1	25%	0.251	40%	0.404	S	S	.	.	H	α-helix	trans	-61.1	-38.5	174.7	-76.2	173.4	0	0	0	112.2	H289 K290 A291 E296 I297 F334 P337	H289-L293 WeakPolarHBondContact NE2-CD1 3.45Å; H289-L293 PolarHBondContact O-N 3.29Å; K290-L293 PolarHBondContact O-N 3.41Å; A291-L293 PolarHBondContact O-N 3.36Å; L293-E296 PolarHBondContact O-N 3.45Å; L293-I297 WeakPolarHBondContact O-CB 3.42Å; L293-I297 WeakPolarHBondContact O-CG1 3.36Å; L293-I297 PolarHBondContact O-N 3.28Å; L293-F334 HydrophobicContact CD2-CE2 4.35Å; L293-F334 HydrophobicContact CD2-CZ 4.12Å; L293-P337 HydrophobicContact CD2-CG 3.94Å; L293-P337 HydrophobicContact CG-CG 4.25Å
294	S	96.4	Very high	94.8	Very high	55 Å²	55	80.4 Å²	80.4	39%	0.385	40%	0.404	S	S	.	.	H	α-helix	trans	-67.4	-37.1	179.4	-63.6	0	0	0	0	112.2	K290 A291 L292 S298	K290-S294 WeakPolarHBondContact O-CB 3.39Å; K290-S294 PolarHBondContact O-N 3.42Å; K290-S294 PolarHBondContact O-OG 3.28Å; A291-S294 WeakPolarHBondContact O-CB 3.43Å; A291-S294 PolarHBondContact O-N 3.23Å; A291-S294 VanDerWaalsContact O-N 3.13Å; L292-S294 VanDerWaalsContact C-N 3.29Å; L292-S294 PolarHBondContact O-N 3.01Å; S294-S298 WeakPolarHBondContact O-CB 3.44Å; S294-S298 PolarHBondContact O-N 3.32Å; S294-S298 PolarHBondContact O-OG 3.48Å
295	V	95.6	Very high	94.7	Very high	99 Å²	99	79.7 Å²	79.7	60%	0.6	40%	0.401	S	S	*	.	H	α-helix	trans	-62	-45.9	171.7	172.5	0	0	0	0	110.4	A291 L292 S298 R299	A291-V295 WeakPolarHBondContact O-CG2 3.32Å; A291-V295 PolarHBondContact O-N 2.81Å; L292-V295 PolarHBondContact O-N 3.42Å; V295-S298 PolarHBondContact O-N 2.96Å; V295-R299 PolarHBondContact O-N 3.44Å
296	E	95.3	Very high	94.5	Very high	17 Å²	17	79.1 Å²	79.1	8%	0.079	41%	0.405	C	S	.	.	H	α-helix	trans	-67.9	-42.7	-178.7	179.6	59.1	-172.9	0	0	112.6	L292 L293 S298 R299 L300 F334 E335	L292-E296 PolarHBondContact O-N 3.07Å; L292-E296 VanDerWaalsContact O-N 3.08Å; L293-E296 PolarHBondContact O-N 3.45Å; E296-S298 VanDerWaalsContact C-N 3.3Å; E296-S298 PolarHBondContact O-N 3.1Å; E296-R299 WeakPolarHBondContact O-CB 3.31Å; E296-R299 PolarHBondContact O-N 3.05Å; E296-R299 IonicContact OE1-CZ 3.83Å; E296-R299 IonicContact OE1-NE 3.93Å; E296-R299 IonicContact OE1-NH2 3.85Å; E296-R299 PolarHBondContact OE1-NH2 3.33Å; E296-R299 IonicContact OE2-CZ 3.03Å; E296-R299 IonicContact OE2-NE 3.92Å; E296-R299 PolarHBondContact OE2-NE 3.25Å; E296-R299 IonicContact OE2-NH2 2.97Å; E296-R299 PolarHBondContact OE2-NH2 2.92Å; E296-L300 PolarHBondContact O-N 2.95Å; E296-F334 HydrophobicContact CG-CD2 3.52Å; E296-F334 HydrophobicContact CG-CE2 3.56Å; E296-F334 WeakPolarHBondContact OE1-CA 3.37Å; E296-E335 PolarHBondContact OE1-N 3.07Å
297	I	95.6	Very high	94.2	Very high	78 Å²	78	80.3 Å²	80.3	40%	0.4	41%	0.411	S	S	.	.	H	α-helix	trans	-59.1	-43.4	172.5	-70.6	165.2	0	0	0	110.4	L293 R299 L300 R301	L293-I297 WeakPolarHBondContact O-CB 3.42Å; L293-I297 WeakPolarHBondContact O-CG1 3.36Å; L293-I297 PolarHBondContact O-N 3.28Å; I297-R299 VanDerWaalsContact C-N 3.32Å; I297-R299 PolarHBondContact O-N 3.05Å; I297-L300 PolarHBondContact O-N 3.44Å; I297-R301 HydrophobicContact CG2-CG 4.26Å; I297-R301 WeakPolarHBondContact O-CB 3.46Å; I297-R301 VanDerWaalsContact O-CG 3.31Å; I297-R301 WeakPolarHBondContact O-CG 3.22Å; I297-R301 PolarHBondContact O-N 2.93Å
298	S	95.9	Very high	94.1	Very high	52 Å²	52	80.6 Å²	80.6	36%	0.364	41%	0.409	S	S	.	.	H	α-helix	trans	-65.3	-35.8	178.7	-59.6	0	0	0	0	112.2	S294 V295 E296 R302	S294-S298 WeakPolarHBondContact O-CB 3.44Å; S294-S298 PolarHBondContact O-N 3.32Å; S294-S298 PolarHBondContact O-OG 3.48Å; V295-S298 PolarHBondContact O-N 2.96Å; E296-S298 VanDerWaalsContact C-N 3.3Å; E296-S298 PolarHBondContact O-N 3.1Å; S298-R302 WeakPolarHBondContact O-CG 3.34Å; S298-R302 PolarHBondContact O-N 2.9Å
299	R	94.3	Very high	93.9	Very high	74 Å²	74	79.8 Å²	79.8	28%	0.279	41%	0.409	S	S	.	.	H	α-helix	trans	-63.3	-46.5	175	-172.3	-176.2	71.2	101.5	6.1	111.5	V295 E296 I297 A303 K333	V295-R299 PolarHBondContact O-N 3.44Å; E296-R299 WeakPolarHBondContact O-CB 3.31Å; E296-R299 PolarHBondContact O-N 3.05Å; E296-R299 IonicContact OE1-CZ 3.83Å; E296-R299 IonicContact OE1-NE 3.93Å; E296-R299 IonicContact OE1-NH2 3.85Å; E296-R299 PolarHBondContact OE1-NH2 3.33Å; E296-R299 IonicContact OE2-CZ 3.03Å; E296-R299 IonicContact OE2-NE 3.92Å; E296-R299 PolarHBondContact OE2-NE 3.25Å; E296-R299 IonicContact OE2-NH2 2.97Å; E296-R299 PolarHBondContact OE2-NH2 2.92Å; I297-R299 VanDerWaalsContact C-N 3.32Å; I297-R299 PolarHBondContact O-N 3.05Å; R299-A303 PolarHBondContact O-N 3.35Å; R299-K333 PolarHBondContact NH2-O 3.37Å
300	L	94.4	Very high	93.6	Very high	46 Å²	46	81.6 Å²	81.6	24%	0.241	42%	0.416	C	S	.	.	H	α-helix	trans	-67.5	-43	177.9	-66.1	175.3	0	0	0	111.9	E296 I297 R302 A303 V304 P332 F334	E296-L300 PolarHBondContact O-N 2.95Å; I297-L300 PolarHBondContact O-N 3.44Å; L300-R302 VanDerWaalsContact C-N 3.35Å; L300-R302 PolarHBondContact O-N 3.07Å; L300-A303 PolarHBondContact O-N 2.8Å; L300-A303 VanDerWaalsContact O-N 3.15Å; L300-V304 WeakPolarHBondContact O-CG2 3.19Å; L300-V304 PolarHBondContact O-N 2.9Å; L300-P332 HydrophobicContact CD2-CB 4.04Å; L300-P332 HydrophobicContact CD2-CG 4.05Å; L300-P332 WeakPolarHBondContact CD2-O 3.29Å; L300-F334 HydrophobicContact CD1-CB 4.07Å; L300-F334 HydrophobicContact CD1-CD2 3.99Å; L300-F334 HydrophobicContact CD1-CG 4.45Å
301	R	95.8	Very high	93.2	Very high	172 Å²	172	81.9 Å²	81.9	65%	0.649	42%	0.423	S	S	*	.	H	α-helix	trans	-58.4	-43.8	175.9	-76.6	179.7	-178.5	-162	0.4	112.4	I297 A303 V304 N305	I297-R301 HydrophobicContact CG2-CG 4.26Å; I297-R301 WeakPolarHBondContact O-CB 3.46Å; I297-R301 VanDerWaalsContact O-CG 3.31Å; I297-R301 WeakPolarHBondContact O-CG 3.22Å; I297-R301 PolarHBondContact O-N 2.93Å; R301-A303 VanDerWaalsContact C-N 3.32Å; R301-A303 PolarHBondContact O-N 2.95Å; R301-V304 PolarHBondContact O-N 2.75Å; R301-N305 VanDerWaalsContact O-CG 3.31Å; R301-N305 PolarHBondContact O-N 3.5Å; R301-N305 PolarHBondContact O-OD1 3.25Å
302	R	93.6	Very high	92.9	Very high	143 Å²	143	83 Å²	83	54%	0.54	43%	0.428	S	S	.	.	H	α-helix	trans	-59.1	-44.5	174.9	-76.4	-171.6	-62.1	-95.1	1.8	111.8	S298 L300 V304 N305 D306	S298-R302 WeakPolarHBondContact O-CG 3.34Å; S298-R302 PolarHBondContact O-N 2.9Å; L300-R302 VanDerWaalsContact C-N 3.35Å; L300-R302 PolarHBondContact O-N 3.07Å; R302-V304 VanDerWaalsContact C-N 3.31Å; R302-V304 PolarHBondContact O-N 3Å; R302-N305 PolarHBondContact O-N 2.85Å; R302-D306 WeakPolarHBondContact O-CB 3.47Å; R302-D306 PolarHBondContact O-N 3.33Å
303	A	91	Very high	92.6	Very high	25 Å²	25	81.5 Å²	81.5	21%	0.207	42%	0.418	C	S	.	.	H	α-helix	trans	-64.9	-34.4	178.6	0	0	0	0	0	113.1	R299 L300 R301 I307 P332	R299-A303 PolarHBondContact O-N 3.35Å; L300-A303 PolarHBondContact O-N 2.8Å; L300-A303 VanDerWaalsContact O-N 3.15Å; R301-A303 VanDerWaalsContact C-N 3.32Å; R301-A303 PolarHBondContact O-N 2.95Å; A303-I307 WeakPolarHBondContact O-CG1 3.36Å; A303-I307 PolarHBondContact O-N 2.87Å; A303-P332 HydrophobicContact CB-CG 3.5Å
304	V	92.5	Very high	92.3	Very high	74 Å²	74	87.5 Å²	87.5	45%	0.448	45%	0.445	S	S	.	.	H	α-helix	trans	-66.3	-51.1	172.7	171.9	0	0	0	0	110.4	L300 R301 R302 D306 I307 E308	L300-V304 WeakPolarHBondContact O-CG2 3.19Å; L300-V304 PolarHBondContact O-N 2.9Å; R301-V304 PolarHBondContact O-N 2.75Å; R302-V304 VanDerWaalsContact C-N 3.31Å; R302-V304 PolarHBondContact O-N 3Å; V304-D306 VanDerWaalsContact C-N 3.33Å; V304-D306 PolarHBondContact O-N 3.26Å; V304-I307 WeakPolarHBondContact O-CB 3.39Å; V304-I307 PolarHBondContact O-N 3.13Å; V304-E308 HydrophobicContact CG1-CG 4.27Å; V304-E308 PolarHBondContact O-N 2.97Å
305	N	93.2	Very high	92.1	Very high	81 Å²	81	87.8 Å²	87.8	43%	0.433	44%	0.442	S	S	.	.	H	α-helix	trans	-59.6	-42.1	179.4	-68.4	10.8	0	0	0	111.9	R301 R302 I307 E308 D309	R301-N305 VanDerWaalsContact O-CG 3.31Å; R301-N305 PolarHBondContact O-N 3.5Å; R301-N305 PolarHBondContact O-OD1 3.25Å; R302-N305 PolarHBondContact O-N 2.85Å; N305-I307 PolarHBondContact O-N 2.86Å; N305-E308 PolarHBondContact O-N 2.87Å; N305-E308 VanDerWaalsContact O-N 3.16Å; N305-D309 WeakPolarHBondContact O-CB 3.4Å; N305-D309 VanDerWaalsContact O-CG 3.29Å; N305-D309 PolarHBondContact O-N 3.03Å
306	D	89.4	Confident	91.8	Very high	89 Å²	89	86.8 Å²	86.8	48%	0.476	44%	0.438	S	S	.	.	H	α-helix	trans	-57.8	-33.6	176.6	-72.1	-11.1	0	0	0	111.8	R302 V304 K310	R302-D306 WeakPolarHBondContact O-CB 3.47Å; R302-D306 PolarHBondContact O-N 3.33Å; V304-D306 VanDerWaalsContact C-N 3.33Å; V304-D306 PolarHBondContact O-N 3.26Å; D306-K310 WeakPolarHBondContact O-CG 3.38Å; D306-K310 PolarHBondContact O-N 3.5Å
307	I	89.2	Confident	91.5	Very high	88 Å²	88	95.1 Å²	95.1	45%	0.451	47%	0.47	S	S	.	.	H	α-helix	trans	-77.1	-46.1	176.1	-66.8	168.7	0	0	0	110.4	A303 V304 N305 D309 K310 L311	A303-I307 WeakPolarHBondContact O-CG1 3.36Å; A303-I307 PolarHBondContact O-N 2.87Å; V304-I307 WeakPolarHBondContact O-CB 3.39Å; V304-I307 PolarHBondContact O-N 3.13Å; N305-I307 PolarHBondContact O-N 2.86Å; I307-D309 VanDerWaalsContact C-N 3.33Å; I307-D309 PolarHBondContact O-N 3.03Å; I307-K310 PolarHBondContact O-N 3.35Å; I307-K310 VanDerWaalsContact O-N 3.16Å; I307-L311 HydrophobicContact CG2-CD1 3.97Å; I307-L311 HydrophobicContact CG2-CG 4.32Å; I307-L311 WeakPolarHBondContact O-CG 3.34Å; I307-L311 PolarHBondContact O-N 3.31Å
308	E	91.6	Very high	91	Very high	112 Å²	112	94.5 Å²	94.5	52%	0.523	47%	0.47	S	S	.	.	H	α-helix	trans	-59.9	-41.7	178	-70.2	178.9	163	0	0	112	V304 N305 K310 L311 S312	V304-E308 HydrophobicContact CG1-CG 4.27Å; V304-E308 PolarHBondContact O-N 2.97Å; N305-E308 PolarHBondContact O-N 2.87Å; N305-E308 VanDerWaalsContact O-N 3.16Å; E308-K310 VanDerWaalsContact C-N 3.3Å; E308-K310 PolarHBondContact O-N 2.94Å; E308-L311 PolarHBondContact O-N 2.91Å; E308-L311 VanDerWaalsContact O-N 3.15Å; E308-S312 PolarHBondContact O-N 2.99Å; E308-S312 PolarHBondContact O-OG 2.87Å
309	D	90	Very high	90.7	Very high	103 Å²	103	94.1 Å²	94.1	55%	0.551	46%	0.463	S	S	*	.	H	α-helix	trans	-59.5	-40.8	175.2	-75.6	-11.3	0	0	0	111	N305 I307 S312 E313	N305-D309 WeakPolarHBondContact O-CB 3.4Å; N305-D309 VanDerWaalsContact O-CG 3.29Å; N305-D309 PolarHBondContact O-N 3.03Å; I307-D309 VanDerWaalsContact C-N 3.33Å; I307-D309 PolarHBondContact O-N 3.03Å; D309-S312 PolarHBondContact O-N 3.13Å; D309-S312 PolarHBondContact O-OG 3.01Å; D309-E313 PolarHBondContact O-N 2.87Å
310	K	87.9	Confident	90.3	Very high	65 Å²	65	96.5 Å²	96.5	28%	0.283	48%	0.481	S	S	.	.	H	α-helix	trans	-73.7	-32.3	175.3	-66.4	-54.8	-178.4	-177.9	0	113.6	D306 I307 E308 S312 E313 L319 S322 L326	D306-K310 WeakPolarHBondContact O-CG 3.38Å; D306-K310 PolarHBondContact O-N 3.5Å; I307-K310 PolarHBondContact O-N 3.35Å; I307-K310 VanDerWaalsContact O-N 3.16Å; E308-K310 VanDerWaalsContact C-N 3.3Å; E308-K310 PolarHBondContact O-N 2.94Å; K310-S312 PolarHBondContact O-N 2.82Å; K310-E313 WeakPolarHBondContact O-CB 3.44Å; K310-E313 PolarHBondContact O-N 3.37Å; K310-L319 HydrophobicContact CB-CD1 4.27Å; K310-L319 WeakPolarHBondContact O-CD1 3.35Å; K310-S322 PolarHBondContact NZ-OG 2.82Å; K310-L326 HydrophobicContact CB-CD1 4.08Å; K310-L326 HydrophobicContact CG-CD1 3.51Å
311	L	87.5	Confident	89.9	Confident	141 Å²	141	105.1 Å²	105.1	74%	0.738	51%	0.51	S	S	*	.	H	α-helix	trans	-67.5	-28.5	173.3	-72.2	171.7	0	0	0	112.1	I307 E308	I307-L311 HydrophobicContact CG2-CD1 3.97Å; I307-L311 HydrophobicContact CG2-CG 4.32Å; I307-L311 WeakPolarHBondContact O-CG 3.34Å; I307-L311 PolarHBondContact O-N 3.31Å; E308-L311 PolarHBondContact O-N 2.91Å; E308-L311 VanDerWaalsContact O-N 3.15Å
312	S	89.9	Confident	89.2	Confident	78 Å²	78	98.8 Å²	98.8	55%	0.545	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-9.4	176.9	69.4	0	0	0	0	114.5	E308 D309 K310 Q314	E308-S312 PolarHBondContact O-N 2.99Å; E308-S312 PolarHBondContact O-OG 2.87Å; D309-S312 PolarHBondContact O-N 3.13Å; D309-S312 PolarHBondContact O-OG 3.01Å; K310-S312 PolarHBondContact O-N 2.82Å; S312-Q314 PolarHBondContact O-N 3.35Å
313	E	89.9	Confident	88.8	Confident	71 Å²	71	94.5 Å²	94.5	33%	0.332	48%	0.48	S	S	.	.			trans	-68	115.9	177	-177.7	62.4	-96.3	0	0	110.9	D309 K310 D315 T318 L319	D309-E313 PolarHBondContact O-N 2.87Å; K310-E313 WeakPolarHBondContact O-CB 3.44Å; K310-E313 PolarHBondContact O-N 3.37Å; E313-D315 PolarHBondContact OE1-N 3.05Å; E313-T318 HydrophobicContact CG-CG2 4.48Å; E313-L319 HydrophobicContact CB-CB 4.48Å; E313-L319 HydrophobicContact CB-CD1 4.43Å; E313-L319 HydrophobicContact CG-CB 4.02Å
314	Q	90.1	Very high	88.5	Confident	174 Å²	174	100 Å²	100	81%	0.813	50%	0.499	S	S	*	.			trans	-88.4	-23.4	-174.9	-65.7	-76.4	-13.3	0	0	112.5	S312 P316	S312-Q314 PolarHBondContact O-N 3.35Å; Q314-P316 VanDerWaalsContact O-CD 3.28Å; Q314-P316 WeakPolarHBondContact O-CD 3.15Å
315	D	91.8	Very high	87.9	Confident	62 Å²	62	98.5 Å²	98.5	33%	0.332	50%	0.498	S	S	.	.			trans	-79.2	115.2	180	174.1	35.4	0	0	0	111.6	E313 Y317 T318 L319	E313-D315 PolarHBondContact OE1-N 3.05Å; D315-Y317 VanDerWaalsContact C-N 3.25Å; D315-Y317 PolarHBondContact O-N 3.34Å; D315-Y317 PolarHBondContact OD1-N 3.01Å; D315-T318 PolarHBondContact O-N 3.39Å; D315-T318 WeakPolarHBondContact OD2-CB 3.4Å; D315-T318 PolarHBondContact OD2-N 2.92Å; D315-T318 PolarHBondContact OD2-OG1 3.08Å; D315-L319 WeakPolarHBondContact O-CB 3.29Å; D315-L319 PolarHBondContact O-N 3.34Å; D315-L319 VanDerWaalsContact O-N 3.08Å
316	P	87.9	Confident	87.3	Confident	78 Å²	78	97.3 Å²	97.3	51%	0.506	49%	0.491	S	S	.	.	H	α-helix	trans	-59.9	-33.6	-177.4	-23.9	35	0	0	0	113.4	Q314 L320	Q314-P316 VanDerWaalsContact O-CD 3.28Å; Q314-P316 WeakPolarHBondContact O-CD 3.15Å; P316-L320 WeakPolarHBondContact O-CB 3.27Å; P316-L320 WeakPolarHBondContact O-CD1 3.29Å; P316-L320 WeakPolarHBondContact O-CG 3.4Å; P316-L320 PolarHBondContact O-N 2.83Å; P316-L320 VanDerWaalsContact O-N 3.08Å
317	Y	88.9	Confident	87	Confident	191 Å²	191	99.6 Å²	99.6	75%	0.749	50%	0.503	S	S	*	.	H	α-helix	trans	-75.7	-42.8	-176.3	-61.7	-81.1	0	0	0	111.9	D315 R321	D315-Y317 VanDerWaalsContact C-N 3.25Å; D315-Y317 PolarHBondContact O-N 3.34Å; D315-Y317 PolarHBondContact OD1-N 3.01Å; Y317-R321 WeakPolarHBondContact O-CB 3.37Å; Y317-R321 PolarHBondContact O-N 2.99Å
318	T	86.5	Confident	86.6	Confident	66 Å²	66	102.3 Å²	102.3	41%	0.405	51%	0.514	S	S	.	.	H	α-helix	trans	-66.9	-39	176.8	-61.8	0	0	0	0	112.1	E313 D315 S322	E313-T318 HydrophobicContact CG-CG2 4.48Å; D315-T318 PolarHBondContact O-N 3.39Å; D315-T318 WeakPolarHBondContact OD2-CB 3.4Å; D315-T318 PolarHBondContact OD2-N 2.92Å; D315-T318 PolarHBondContact OD2-OG1 3.08Å; T318-S322 WeakPolarHBondContact O-CB 3.48Å; T318-S322 PolarHBondContact O-N 2.97Å; T318-S322 PolarHBondContact O-OG 2.66Å
319	L	88.3	Confident	86.1	Confident	44 Å²	44	106.4 Å²	106.4	23%	0.23	52%	0.524	C	S	.	.	H	α-helix	trans	-62	-56.5	173.6	179.5	59.3	0	0	0	111.2	K310 E313 D315 R321 S322 I323	K310-L319 HydrophobicContact CB-CD1 4.27Å; K310-L319 WeakPolarHBondContact O-CD1 3.35Å; E313-L319 HydrophobicContact CB-CB 4.48Å; E313-L319 HydrophobicContact CB-CD1 4.43Å; E313-L319 HydrophobicContact CG-CB 4.02Å; D315-L319 WeakPolarHBondContact O-CB 3.29Å; D315-L319 PolarHBondContact O-N 3.34Å; D315-L319 VanDerWaalsContact O-N 3.08Å; L319-R321 VanDerWaalsContact C-N 3.25Å; L319-R321 PolarHBondContact O-N 3.27Å; L319-S322 PolarHBondContact O-N 2.96Å; L319-S322 PolarHBondContact O-OG 2.76Å; L319-I323 HydrophobicContact CD1-CD1 4.21Å; L319-I323 HydrophobicContact CG-CD1 4.49Å; L319-I323 WeakPolarHBondContact O-CB 3.11Å; L319-I323 PolarHBondContact O-N 3.05Å
320	L	87.9	Confident	85.5	Confident	123 Å²	123	109.6 Å²	109.6	64%	0.644	54%	0.536	S	S	*	.	H	α-helix	trans	-62.5	-30.3	-176.9	-70	173.8	0	0	0	113	P316	P316-L320 WeakPolarHBondContact O-CB 3.27Å; P316-L320 WeakPolarHBondContact O-CD1 3.29Å; P316-L320 WeakPolarHBondContact O-CG 3.4Å; P316-L320 PolarHBondContact O-N 2.83Å; P316-L320 VanDerWaalsContact O-N 3.08Å
321	R	85.3	Confident	85.1	Confident	227 Å²	227	111.4 Å²	111.4	86%	0.857	55%	0.554	S	S	*	*	H	α-helix	trans	-72.3	-33.1	175.5	-164.8	175.7	-170.7	171.7	3.1	112.9	Y317 L319	Y317-R321 WeakPolarHBondContact O-CB 3.37Å; Y317-R321 PolarHBondContact O-N 2.99Å; L319-R321 VanDerWaalsContact C-N 3.25Å; L319-R321 PolarHBondContact O-N 3.27Å
322	S	81.4	Confident	85	Confident	40 Å²	40	107 Å²	107	28%	0.28	53%	0.534	S	S	.	.	H	α-helix	trans	-100	-13.2	-174.6	65.4	0	0	0	0	114.8	K310 T318 L319 K324	K310-S322 PolarHBondContact NZ-OG 2.82Å; T318-S322 WeakPolarHBondContact O-CB 3.48Å; T318-S322 PolarHBondContact O-N 2.97Å; T318-S322 PolarHBondContact O-OG 2.66Å; L319-S322 PolarHBondContact O-N 2.96Å; L319-S322 PolarHBondContact O-OG 2.76Å; S322-K324 PolarHBondContact O-N 2.77Å
323	I	85.4	Confident	84.9	Confident	53 Å²	53	111.1 Å²	111.1	27%	0.272	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-26.4	-176.1	-157.9	163.1	0	0	0	114.2	L319 G325 L326 L327	L319-I323 HydrophobicContact CD1-CD1 4.21Å; L319-I323 HydrophobicContact CG-CD1 4.49Å; L319-I323 WeakPolarHBondContact O-CB 3.11Å; L319-I323 PolarHBondContact O-N 3.05Å; I323-G325 VanDerWaalsContact C-N 3.25Å; I323-G325 PolarHBondContact O-N 3.5Å; I323-L326 PolarHBondContact O-N 3.42Å; I323-L327 HydrophobicContact CG1-CD1 4.05Å; I323-L327 HydrophobicContact CG1-CG 4.07Å; I323-L327 HydrophobicContact CG2-CD1 4.22Å; I323-L327 PolarHBondContact O-N 3.23Å; I323-L327 VanDerWaalsContact O-N 3.07Å
324	K	83.5	Confident	85.1	Confident	141 Å²	141	113 Å²	113	61%	0.613	55%	0.55	S	S	*	.	H	α-helix	trans	-55.7	-38.8	-176.3	-173	178.4	179.9	-179.1	0	112.7	S322 Q328	S322-K324 PolarHBondContact O-N 2.77Å; K324-Q328 WeakPolarHBondContact O-CB 3.27Å; K324-Q328 VanDerWaalsContact O-CG 3.29Å; K324-Q328 WeakPolarHBondContact O-CG 3.23Å; K324-Q328 PolarHBondContact O-N 3.5Å
325	G	80.7	Confident	85.1	Confident	41 Å²	41	111.2 Å²	111.2	42%	0.423	54%	0.541	S	S	.	.	H	α-helix	trans	-70.2	-31.5	179.5	0	0	0	0	0	113.8	I323 R329	I323-G325 VanDerWaalsContact C-N 3.25Å; I323-G325 PolarHBondContact O-N 3.5Å; G325-R329 VanDerWaalsContact O-CG 3.32Å; G325-R329 WeakPolarHBondContact O-CG 3.3Å; G325-R329 PolarHBondContact O-N 3Å
326	L	81.1	Confident	85	Confident	57 Å²	57	118.3 Å²	118.3	30%	0.298	56%	0.563	S	S	.	*	H	α-helix	trans	-75.2	-42.8	175.6	-74.2	176.3	0	0	0	111.6	K310 I323 Q328 R329	K310-L326 HydrophobicContact CB-CD1 4.08Å; K310-L326 HydrophobicContact CG-CD1 3.51Å; I323-L326 PolarHBondContact O-N 3.42Å; L326-Q328 PolarHBondContact O-N 3.27Å; L326-R329 PolarHBondContact O-N 2.89Å
327	L	81.2	Confident	85.1	Confident	137 Å²	137	115.9 Å²	115.9	72%	0.717	55%	0.547	S	S	*	.	H	α-helix	trans	-65.8	-25.5	179.1	-65.4	173.8	0	0	0	113.1	I323	I323-L327 HydrophobicContact CG1-CD1 4.05Å; I323-L327 HydrophobicContact CG1-CG 4.07Å; I323-L327 HydrophobicContact CG2-CD1 4.22Å; I323-L327 PolarHBondContact O-N 3.23Å; I323-L327 VanDerWaalsContact O-N 3.07Å
328	Q	81.8	Confident	85	Confident	144 Å²	144	113.2 Å²	113.2	67%	0.673	55%	0.551	S	S	*	*	H	α-helix	trans	-86.5	-18.5	176.7	-71.9	-179.5	-9.4	0	0	113.6	K324 L326	K324-Q328 WeakPolarHBondContact O-CB 3.27Å; K324-Q328 VanDerWaalsContact O-CG 3.29Å; K324-Q328 WeakPolarHBondContact O-CG 3.23Å; K324-Q328 PolarHBondContact O-N 3.5Å; L326-Q328 PolarHBondContact O-N 3.27Å
329	R	80.8	Confident	85.1	Confident	199 Å²	199	113.3 Å²	113.3	75%	0.751	55%	0.549	S	S	*	.	S	Bend	trans	-86.1	134.1	178.8	-77.9	174.9	93.5	146.7	3.9	110.2	G325 L326	G325-R329 VanDerWaalsContact O-CG 3.32Å; G325-R329 WeakPolarHBondContact O-CG 3.3Å; G325-R329 PolarHBondContact O-N 3Å; L326-R329 PolarHBondContact O-N 2.89Å
330	Q	78.8	Confident	84.9	Confident	169 Å²	169	115.7 Å²	115.7	79%	0.79	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-70.8	139.1	167.3	-69	-142.8	-11.6	0	0	110.3
331	P	77.9	Confident	84.7	Confident	103 Å²	103	114.8 Å²	114.8	67%	0.669	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-63.1	136.9	177.7	25.6	-32.9	0	0	0	109.9	K333	P331-K333 PolarHBondContact O-N 3.35Å
332	P	85.3	Confident	84.7	Confident	49 Å²	49	106.6 Å²	106.6	32%	0.318	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-62.1	125.1	177.9	24.5	-31.6	0	0	0	110.2	L300 A303	L300-P332 HydrophobicContact CD2-CB 4.04Å; L300-P332 HydrophobicContact CD2-CG 4.05Å; L300-P332 WeakPolarHBondContact CD2-O 3.29Å; A303-P332 HydrophobicContact CB-CG 3.5Å
333	K	89.3	Confident	84.9	Confident	164 Å²	164	109.3 Å²	109.3	71%	0.713	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-84.4	144.9	172	-66.4	-176.9	-178.6	177.9	0	109.8	R299 P331 E335	R299-K333 PolarHBondContact NH2-O 3.37Å; P331-K333 PolarHBondContact O-N 3.35Å; K333-E335 PolarHBondContact O-N 3.38Å
334	F	92.9	Very high	85	Confident	112 Å²	112	110.5 Å²	110.5	49%	0.491	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-62.7	122.5	174.6	174.4	-122.7	0	0	0	110.8	L293 E296 L300 R336	L293-F334 HydrophobicContact CD2-CE2 4.35Å; L293-F334 HydrophobicContact CD2-CZ 4.12Å; E296-F334 HydrophobicContact CG-CD2 3.52Å; E296-F334 HydrophobicContact CG-CE2 3.56Å; E296-F334 WeakPolarHBondContact OE1-CA 3.37Å; L300-F334 HydrophobicContact CD1-CB 4.07Å; L300-F334 HydrophobicContact CD1-CD2 3.99Å; L300-F334 HydrophobicContact CD1-CG 4.45Å; F334-R336 HydrophobicContact CD1-CB 4.36Å; F334-R336 HydrophobicContact CE1-CB 3.66Å; F334-R336 HydrophobicContact CE1-CG 4.09Å; F334-R336 HydrophobicContact CZ-CB 4.02Å; F334-R336 HydrophobicContact CZ-CG 4.28Å
335	E	90.6	Very high	85.1	Confident	136 Å²	136	107.1 Å²	107.1	64%	0.636	56%	0.562	S	S	*	*			trans	-100	103	173.2	-70	179.3	-162.9	0	0	109.1	E296 K333 P337	E296-E335 PolarHBondContact OE1-N 3.07Å; K333-E335 PolarHBondContact O-N 3.38Å; E335-P337 WeakPolarHBondContact O-CD 3.24Å
336	R	89.8	Confident	85.2	Confident	211 Å²	211	112.5 Å²	112.5	80%	0.796	58%	0.576	S	S	*	*			trans	-71.9	115.9	-179.7	-174	177.4	-177.2	173	1.9	110.1	F334	F334-R336 HydrophobicContact CD1-CB 4.36Å; F334-R336 HydrophobicContact CE1-CB 3.66Å; F334-R336 HydrophobicContact CE1-CG 4.09Å; F334-R336 HydrophobicContact CZ-CB 4.02Å; F334-R336 HydrophobicContact CZ-CG 4.28Å
337	P	89.4	Confident	85.3	Confident	26 Å²	26	112.5 Å²	112.5	17%	0.169	59%	0.589	C	S	.	*			trans	-64.3	145.4	173.1	-16	31.1	0	0	0	110	H289 L292 L293 E335	H289-P337 PolarHBondContact CE1-O 2.69Å; L292-P337 HydrophobicContact CB-CB 4.21Å; L292-P337 HydrophobicContact CB-CG 4.01Å; L292-P337 HydrophobicContact CD1-CB 4.35Å; L293-P337 HydrophobicContact CD2-CG 3.94Å; L293-P337 HydrophobicContact CG-CG 4.25Å; E335-P337 WeakPolarHBondContact O-CD 3.24Å
338	T	87.9	Confident	85.4	Confident	135 Å²	135	112.5 Å²	112.5	83%	0.828	58%	0.58	S	S	*	*			trans	-76.2	134.5	177.2	-47.3	0	0	0	0	110.3
339	L	87.6	Confident	85.7	Confident	69 Å²	69	107.2 Å²	107.2	36%	0.361	56%	0.555	S	S	.	*			trans	-132.1	123.2	170.8	-179.3	65.9	0	0	0	109.3	L286 H289	L286-L339 HydrophobicContact CD2-CD1 4.37Å; L286-L339 HydrophobicContact CD2-CD2 4.04Å; H289-L339 HydrophobicContact CB-CD1 3.95Å
340	T	84.6	Confident	85.7	Confident	93 Å²	93	101.5 Å²	101.5	57%	0.571	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-80.2	123.7	161.2	50	0	0	0	0	108.2
341	P	83.7	Confident	86.1	Confident	105 Å²	105	94.5 Å²	94.5	68%	0.682	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-54	131.2	178.5	-26.4	34.5	0	0	0	111.2
342	P	85.6	Confident	86.7	Confident	55 Å²	55	93.8 Å²	93.8	36%	0.357	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-64.9	140.6	175.5	28.4	-34.1	0	0	0	109.2	E282 L286	E282-P342 HydrophobicContact CB-CB 3.85Å; E282-P342 HydrophobicContact CG-CB 3.99Å; E282-P342 WeakPolarHBondContact OE2-CA 3.07Å; E282-P342 VanDerWaalsContact OE2-CB 3.24Å; E282-P342 WeakPolarHBondContact OE2-CB 3.34Å; L286-P342 HydrophobicContact CD1-CG 4.03Å; L286-P342 HydrophobicContact CD2-CG 3.99Å; L286-P342 HydrophobicContact CG-CG 4.14Å
343	S	84.9	Confident	86.9	Confident	96 Å²	96	94.9 Å²	94.9	67%	0.671	52%	0.521	S	S	*	.			trans	-141.3	133.5	172.8	57	0	0	0	0	110
344	L	87.3	Confident	87	Confident	79 Å²	79	95.4 Å²	95.4	41%	0.414	53%	0.526	S	S	.	.			trans	-86.9	124.2	169.3	-65.3	176.4	0	0	0	107.8	L275 E278 E282 E346	L275-L344 HydrophobicContact CD1-CD1 4.23Å; E278-L344 HydrophobicContact CB-CD2 4.16Å; E278-L344 HydrophobicContact CG-CD2 4.12Å; E282-L344 HydrophobicContact CG-CD2 4.29Å; L344-E346 PolarHBondContact O-N 2.94Å
345	C	85.3	Confident	86.8	Confident	69 Å²	69	95.2 Å²	95.2	47%	0.466	52%	0.523	S	S	.	.			trans	-70.9	94	179	-178.1	0	0	0	0	110	G347 R348 F349	C345-G347 VanDerWaalsContact C-N 3.27Å; C345-G347 PolarHBondContact O-N 2.87Å; C345-R348 HydrophobicContact CB-CB 4.09Å; C345-R348 VanDerWaalsContact O-CB 3.3Å; C345-R348 WeakPolarHBondContact O-CB 3.42Å; C345-R348 PolarHBondContact O-N 3.45Å; C345-F349 WeakPolarHBondContact O-CD2 3.37Å
346	E	83.3	Confident	86.8	Confident	155 Å²	155	93 Å²	93	72%	0.724	51%	0.509	S	S	*	.	H	α-helix	trans	-54.8	-42.2	179.1	-69.2	-177.5	-167.1	0	0	111.7	L344 R348 F349 A350	L344-E346 PolarHBondContact O-N 2.94Å; E346-R348 PolarHBondContact O-N 3.19Å; E346-F349 PolarHBondContact O-N 2.99Å; E346-A350 WeakPolarHBondContact O-CA 3.46Å; E346-A350 WeakPolarHBondContact O-CB 3.29Å; E346-A350 PolarHBondContact O-N 3.41Å
347	G	83.9	Confident	86.9	Confident	56 Å²	56	84.1 Å²	84.1	58%	0.577	48%	0.478	S	S	*	.	H	α-helix	trans	-56.8	-26.2	177.3	0	0	0	0	0	114.4	C345 G351	C345-G347 VanDerWaalsContact C-N 3.27Å; C345-G347 PolarHBondContact O-N 2.87Å; G347-G351 PolarHBondContact O-N 3.48Å
348	R	83.6	Confident	86.9	Confident	138 Å²	138	88.3 Å²	88.3	52%	0.521	49%	0.49	S	S	.	.	H	α-helix	trans	-74.6	-28.8	176.9	-174.5	179	-83.3	172.5	-4.3	112.6	E278 C345 E346 R356	E278-R348 IonicContact OE1-NH1 3.66Å; E278-R348 PolarHBondContact OE1-NH1 2.92Å; C345-R348 HydrophobicContact CB-CB 4.09Å; C345-R348 VanDerWaalsContact O-CB 3.3Å; C345-R348 WeakPolarHBondContact O-CB 3.42Å; C345-R348 PolarHBondContact O-N 3.45Å; E346-R348 PolarHBondContact O-N 3.19Å; R348-R356 PolarHBondContact O-NH1 3.25Å
349	F	87	Confident	86.9	Confident	33 Å²	33	86.9 Å²	86.9	15%	0.145	47%	0.473	C	S	.	.	H	α-helix	trans	-116.6	-38.8	-172.7	-59.5	-75.1	0	0	0	113.8	K274 L275 C345 E346	K274-F349 HydrophobicContact CB-CE1 3.88Å; L275-F349 HydrophobicContact CB-CD1 4.11Å; L275-F349 HydrophobicContact CB-CE1 3.94Å; L275-F349 HydrophobicContact CB-CZ 4.31Å; L275-F349 HydrophobicContact CD1-CD1 4.42Å; L275-F349 HydrophobicContact CD1-CD2 3.89Å; L275-F349 HydrophobicContact CD1-CE1 4.46Å; L275-F349 HydrophobicContact CD1-CE2 3.93Å; L275-F349 HydrophobicContact CD1-CG 4.14Å; L275-F349 HydrophobicContact CD1-CZ 4.22Å; C345-F349 WeakPolarHBondContact O-CD2 3.37Å; E346-F349 PolarHBondContact O-N 2.99Å
350	A	81.4	Confident	87	Confident	78 Å²	78	86.3 Å²	86.3	65%	0.645	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	10.5	-179.2	0	0	0	0	0	113.7	E346	E346-A350 WeakPolarHBondContact O-CA 3.46Å; E346-A350 WeakPolarHBondContact O-CB 3.29Å; E346-A350 PolarHBondContact O-N 3.41Å
351	G	86.8	Confident	87.2	Confident	22 Å²	22	83.4 Å²	83.4	23%	0.227	46%	0.455	C	S	.	.	S	Bend	trans	-61.3	-161.5	168.5	0	0	0	0	0	112.7	G347 L353	G347-G351 PolarHBondContact O-N 3.48Å; G351-L353 PolarHBondContact O-N 2.8Å
352	P	90.9	Very high	87.2	Confident	89 Å²	89	82.2 Å²	82.2	58%	0.578	44%	0.439	S	S	*	.	S	Bend	trans	-70.6	72.3	-178.1	31.1	-36.6	0	0	0	111.6	Y355 R356	P352-Y355 PolarHBondContact O-N 3.21Å; P352-R356 WeakPolarHBondContact O-CG 3.47Å; P352-R356 PolarHBondContact O-N 3.29Å
353	L	89.9	Confident	87	Confident	72 Å²	72	83.1 Å²	83.1	38%	0.377	46%	0.458	S	S	.	.	H	α-helix	trans	-63	-49.4	-166.9	175	60.7	0	0	0	110.8	L271 G351 Y355 R356 V357	L271-L353 HydrophobicContact CD1-CD1 3.33Å; G351-L353 PolarHBondContact O-N 2.8Å; L353-Y355 VanDerWaalsContact C-N 3.28Å; L353-Y355 PolarHBondContact O-N 3.08Å; L353-R356 PolarHBondContact O-N 3.17Å; L353-R356 VanDerWaalsContact O-N 3.15Å; L353-V357 HydrophobicContact CD1-CG2 3.87Å; L353-V357 HydrophobicContact CG-CG2 4.34Å; L353-V357 WeakPolarHBondContact O-CB 3.34Å; L353-V357 VanDerWaalsContact O-CG2 3.31Å; L353-V357 WeakPolarHBondContact O-CG2 3.41Å; L353-V357 PolarHBondContact O-N 3.49Å
354	Q	90.3	Very high	86.9	Confident	174 Å²	174	81.5 Å²	81.5	81%	0.813	45%	0.448	S	S	*	.	H	α-helix	trans	-56	-44.2	178.4	-67.5	179.5	-13.5	0	0	111.7	V357 W358	Q354-V357 PolarHBondContact O-N 3.06Å; Q354-W358 VanDerWaalsContact O-CB 3.26Å; Q354-W358 WeakPolarHBondContact O-CB 3.01Å; Q354-W358 PolarHBondContact O-N 3.32Å
355	Y	90.2	Very high	86.9	Confident	108 Å²	108	81.3 Å²	81.3	42%	0.424	45%	0.446	S	S	.	.	H	α-helix	trans	-68.4	-38.9	178.3	-177	-114.9	0	0	0	112.9	P352 L353 W358 K359	P352-Y355 PolarHBondContact O-N 3.21Å; L353-Y355 VanDerWaalsContact C-N 3.28Å; L353-Y355 PolarHBondContact O-N 3.08Å; Y355-W358 AromaticContact CD2-CE3 3.95Å; Y355-W358 HydrophobicContact CD2-CE3 3.95Å; Y355-W358 HydrophobicContact CD2-CZ3 4.37Å; Y355-W358 AromaticContact CE2-CE3 3.84Å; Y355-W358 HydrophobicContact CE2-CE3 3.84Å; Y355-W358 AromaticContact CE2-CZ3 3.79Å; Y355-W358 HydrophobicContact CE2-CZ3 3.79Å; Y355-W358 PolarHBondContact O-N 3.06Å; Y355-K359 HydrophobicContact CE1-CD 3.98Å; Y355-K359 HydrophobicContact CE1-CG 4.37Å; Y355-K359 PolarHBondContact O-N 3.05Å; Y355-K359 WeakPolarHBondContact OH-CE 3.25Å; Y355-K359 PolarHBondContact OH-NZ 2.99Å; Y355-K359 VanDerWaalsContact OH-NZ 3.11Å
356	R	89.8	Confident	86.9	Confident	91 Å²	91	83.7 Å²	83.7	34%	0.343	45%	0.446	S	S	.	.	H	α-helix	trans	-65	-43.2	175.4	-72.7	170.2	58.1	-165.1	-3.2	112.1	R348 P352 L353 K359 S360	R348-R356 PolarHBondContact O-NH1 3.25Å; P352-R356 WeakPolarHBondContact O-CG 3.47Å; P352-R356 PolarHBondContact O-N 3.29Å; L353-R356 PolarHBondContact O-N 3.17Å; L353-R356 VanDerWaalsContact O-N 3.15Å; R356-K359 PolarHBondContact O-N 3.46Å; R356-S360 PolarHBondContact O-N 2.75Å; R356-S360 PolarHBondContact O-OG 3Å
357	V	91.8	Very high	87.2	Confident	23 Å²	23	77.5 Å²	77.5	14%	0.139	42%	0.419	C	S	.	.	H	α-helix	trans	-64.3	-44.7	175.2	173.9	0	0	0	0	109.5	F263 L264 L353 Q354 K359 S360 L361	F263-V357 HydrophobicContact CE1-CG1 3.98Å; L264-V357 HydrophobicContact CD2-CG1 3.6Å; L353-V357 HydrophobicContact CD1-CG2 3.87Å; L353-V357 HydrophobicContact CG-CG2 4.34Å; L353-V357 WeakPolarHBondContact O-CB 3.34Å; L353-V357 VanDerWaalsContact O-CG2 3.31Å; L353-V357 WeakPolarHBondContact O-CG2 3.41Å; L353-V357 PolarHBondContact O-N 3.49Å; Q354-V357 PolarHBondContact O-N 3.06Å; V357-K359 PolarHBondContact O-N 3.48Å; V357-S360 CarbonylContact O-C 3.56Å; V357-S360 PolarHBondContact O-N 3.17Å; V357-S360 VanDerWaalsContact O-N 3.11Å; V357-L361 WeakPolarHBondContact O-CB 3.45Å; V357-L361 PolarHBondContact O-N 3.32Å
358	W	89.5	Confident	87.3	Confident	114 Å²	114	77.5 Å²	77.5	43%	0.432	41%	0.408	S	S	.	.	H	α-helix	trans	-59	-44.3	174.7	176.3	86	0	0	0	112.8	Q354 Y355 S360 L361 K362 I548	Q354-W358 VanDerWaalsContact O-CB 3.26Å; Q354-W358 WeakPolarHBondContact O-CB 3.01Å; Q354-W358 PolarHBondContact O-N 3.32Å; Y355-W358 AromaticContact CD2-CE3 3.95Å; Y355-W358 HydrophobicContact CD2-CE3 3.95Å; Y355-W358 HydrophobicContact CD2-CZ3 4.37Å; Y355-W358 AromaticContact CE2-CE3 3.84Å; Y355-W358 HydrophobicContact CE2-CE3 3.84Å; Y355-W358 AromaticContact CE2-CZ3 3.79Å; Y355-W358 HydrophobicContact CE2-CZ3 3.79Å; Y355-W358 PolarHBondContact O-N 3.06Å; W358-S360 PolarHBondContact O-N 2.83Å; W358-L361 WeakPolarHBondContact O-CB 3.39Å; W358-L361 PolarHBondContact O-N 2.97Å; W358-K362 PolarHBondContact O-N 3.43Å; W358-I548 HydrophobicContact CH2-CG2 3.6Å; W358-I548 HydrophobicContact CZ3-CG2 3.9Å
359	K	88.5	Confident	87.5	Confident	106 Å²	106	73.2 Å²	73.2	46%	0.461	40%	0.398	S	S	.	.	H	α-helix	trans	-59.2	-37.4	174.3	-84.5	-163.3	169.8	172.3	0	112.7	Y355 R356 V357 K362	Y355-K359 HydrophobicContact CE1-CD 3.98Å; Y355-K359 HydrophobicContact CE1-CG 4.37Å; Y355-K359 PolarHBondContact O-N 3.05Å; Y355-K359 WeakPolarHBondContact OH-CE 3.25Å; Y355-K359 PolarHBondContact OH-NZ 2.99Å; Y355-K359 VanDerWaalsContact OH-NZ 3.11Å; R356-K359 PolarHBondContact O-N 3.46Å; V357-K359 PolarHBondContact O-N 3.48Å; K359-K362 WeakPolarHBondContact O-CB 3.43Å
360	S	89	Confident	87.6	Confident	57 Å²	57	72.7 Å²	72.7	40%	0.399	40%	0.399	S	S	.	.	H	α-helix	trans	-75.2	-37.8	177.9	-53.8	0	0	0	0	110.9	R356 V357 W358 K362 G363	R356-S360 PolarHBondContact O-N 2.75Å; R356-S360 PolarHBondContact O-OG 3Å; V357-S360 CarbonylContact O-C 3.56Å; V357-S360 PolarHBondContact O-N 3.17Å; V357-S360 VanDerWaalsContact O-N 3.11Å; W358-S360 PolarHBondContact O-N 2.83Å; S360-K362 PolarHBondContact O-N 3.03Å; S360-G363 PolarHBondContact O-N 2.93Å
361	L	89.4	Confident	87.9	Confident	31 Å²	31	71.8 Å²	71.8	16%	0.162	39%	0.391	C	S	.	.	H	α-helix	trans	-60.4	-34.5	177.5	179.9	63.7	0	0	0	111.6	L260 F263 V357 W358 G363 S364 I365	L260-L361 HydrophobicContact CD2-CD1 3.66Å; F263-L361 HydrophobicContact CD1-CB 4.22Å; F263-L361 HydrophobicContact CD1-CD1 3.4Å; F263-L361 HydrophobicContact CD1-CG 4.36Å; F263-L361 HydrophobicContact CE1-CB 3.56Å; F263-L361 HydrophobicContact CE1-CD1 3.68Å; F263-L361 HydrophobicContact CE1-CG 4.19Å; F263-L361 HydrophobicContact CG-CD1 3.91Å; F263-L361 VanDerWaalsContact CZ-CA 3.44Å; F263-L361 HydrophobicContact CZ-CB 3.94Å; F263-L361 HydrophobicContact CZ-CD1 4.39Å; F263-L361 VanDerWaalsContact CZ-N 3.29Å; V357-L361 WeakPolarHBondContact O-CB 3.45Å; V357-L361 PolarHBondContact O-N 3.32Å; W358-L361 WeakPolarHBondContact O-CB 3.39Å; W358-L361 PolarHBondContact O-N 2.97Å; L361-G363 PolarHBondContact O-N 3.47Å; L361-G363 VanDerWaalsContact O-N 3.08Å; L361-S364 WeakPolarHBondContact O-CA 3.31Å; L361-S364 WeakPolarHBondContact O-CB 3.46Å; L361-S364 PolarHBondContact O-N 3.43Å; L361-I365 HydrophobicContact CG-CD1 4.39Å; L361-I365 HydrophobicContact CG-CG1 4.27Å; L361-I365 PolarHBondContact O-N 2.91Å
362	K	82.5	Confident	88.3	Confident	80 Å²	80	70.8 Å²	70.8	35%	0.348	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.1	-39.9	175.8	-176.9	-174	175.3	171.3	0	113.2	W358 K359 S360 S364 I365 I548	W358-K362 PolarHBondContact O-N 3.43Å; K359-K362 WeakPolarHBondContact O-CB 3.43Å; S360-K362 PolarHBondContact O-N 3.03Å; K362-S364 PolarHBondContact O-N 2.89Å; K362-I365 PolarHBondContact O-N 3.36Å; K362-I548 HydrophobicContact CD-CD1 3.99Å; K362-I548 HydrophobicContact CD-CG2 3.8Å; K362-I548 VanDerWaalsContact NZ-CB 3.33Å; K362-I548 VanDerWaalsContact NZ-CG2 3.26Å
363	G	81.4	Confident	88.5	Confident	74 Å²	74	69.2 Å²	69.2	76%	0.763	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-18.1	178.9	0	0	0	0	0	114.3	S360 L361	S360-G363 PolarHBondContact O-N 2.93Å; L361-G363 PolarHBondContact O-N 3.47Å; L361-G363 VanDerWaalsContact O-N 3.08Å
364	S	84.3	Confident	88.8	Confident	63 Å²	63	65.9 Å²	65.9	44%	0.441	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-12.3	179.6	-52.9	0	0	0	0	112.9	F263 L361 K362	F263-S364 VanDerWaalsContact CD2-OG 3.31Å; F263-S364 WeakPolarHBondContact CD2-OG 3.31Å; L361-S364 WeakPolarHBondContact O-CA 3.31Å; L361-S364 WeakPolarHBondContact O-CB 3.46Å; L361-S364 PolarHBondContact O-N 3.43Å; K362-S364 PolarHBondContact O-N 2.89Å
365	I	85.6	Confident	89.1	Confident	75 Å²	75	59.7 Å²	59.7	39%	0.385	32%	0.324	S	S	.	.			trans	-73.2	131.7	176.2	-64.2	171.8	0	0	0	108.9	L361 K362 V368	L361-I365 HydrophobicContact CG-CD1 4.39Å; L361-I365 HydrophobicContact CG-CG1 4.27Å; L361-I365 PolarHBondContact O-N 2.91Å; K362-I365 PolarHBondContact O-N 3.36Å; I365-V368 HydrophobicContact CB-CG2 4.48Å; I365-V368 WeakPolarHBondContact O-CG2 3.43Å
366	Y	86.8	Confident	89.4	Confident	119 Å²	119	57.7 Å²	57.7	47%	0.467	33%	0.326	S	S	.	.	S	Bend	trans	-143.9	128	174.4	176.3	-107.7	0	0	0	111.8	R424	Y366-R424 HydrophobicContact CE1-CB 4.23Å; Y366-R424 VanDerWaalsContact CE1-NH2 3.26Å; Y366-R424 PolarHBondContact OH-N 2.76Å
367	P	88.9	Confident	89.6	Confident	24 Å²	24	60.2 Å²	60.2	16%	0.156	34%	0.339	C	S	.	.	S	Bend	cis	-74.8	139.5	-2.3	32.2	-35.1	0	0	0	112.6	R424 Y493	P367-R424 HydrophobicContact CB-CB 4.23Å; P367-R424 WeakPolarHBondContact CB-O 3.08Å; P367-R424 HydrophobicContact CG-CB 4.1Å; P367-Y493 HydrophobicContact CG-CD2 4.13Å; P367-Y493 HydrophobicContact CG-CE2 3.75Å
368	V	85.8	Confident	89.8	Confident	57 Å²	57	59.2 Å²	59.2	35%	0.345	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-72.6	145.7	162.4	177	0	0	0	0	108.2	I365 S370	I365-V368 HydrophobicContact CB-CG2 4.48Å; I365-V368 WeakPolarHBondContact O-CG2 3.43Å; V368-S370 PolarHBondContact O-N 3.41Å; V368-S370 VanDerWaalsContact O-N 3.08Å
369	P	87.9	Confident	90.2	Very high	47 Å²	47	54 Å²	54	31%	0.305	32%	0.315	S	S	.	.	B	Isolated β-bridge	trans	-46.8	119	167.7	-28.2	33.6	0	0	0	111.7	Y426 P546	P369-Y426 CarbonylContact C-O 3.57Å; P369-Y426 VanDerWaalsContact CA-O 3.31Å; P369-Y426 WeakPolarHBondContact CA-O 3.43Å; P369-Y426 HydrophobicContact CB-CD1 4.25Å; P369-Y426 HydrophobicContact CG-CD1 3.98Å; P369-Y426 HydrophobicContact CG-CE1 4.29Å; P369-P546 HydrophobicContact CB-CG 3.9Å; P369-P546 HydrophobicContact CG-CG 4.07Å
370	S	88.7	Confident	90.4	Very high	23 Å²	23	49 Å²	49	16%	0.161	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-74.9	135.4	-177.4	-60.9	0	0	0	0	109.7	V368 I372 Y426	V368-S370 PolarHBondContact O-N 3.41Å; V368-S370 VanDerWaalsContact O-N 3.08Å; S370-I372 PolarHBondContact O-N 2.98Å; S370-Y426 WeakPolarHBondContact CB-O 3.48Å; S370-Y426 PolarHBondContact N-O 3.49Å; S370-Y426 PolarHBondContact OG-O 2.99Å
371	A	89.1	Confident	90.7	Very high	59 Å²	59	47.2 Å²	47.2	49%	0.488	28%	0.28	S	S	.	.			trans	-75.3	89.4	177	0	0	0	0	0	110.3	M545	A371-M545 HydrophobicContact CB-CE 3.47Å; A371-M545 VanDerWaalsContact CB-CE 3.47Å; A371-M545 HydrophobicContact CB-SD 4.02Å
372	I	93.4	Very high	90.8	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	29%	0.287	C	S	.	.			trans	-85.4	133.5	-179.6	-53.2	-53.8	0	0	0	110.7	S370 F420 W427 P525 F527 V543	S370-I372 PolarHBondContact O-N 2.98Å; I372-F420 HydrophobicContact CD1-CE2 4.19Å; I372-F420 HydrophobicContact CD1-CZ 3.77Å; I372-W427 HydrophobicContact CD1-CB 4.39Å; I372-W427 HydrophobicContact CD1-CD2 4.35Å; I372-W427 HydrophobicContact CD1-CE3 4.34Å; I372-W427 HydrophobicContact CD1-CG 4.38Å; I372-W427 HydrophobicContact CG1-CB 3.51Å; I372-W427 HydrophobicContact CG1-CD2 4.01Å; I372-W427 HydrophobicContact CG1-CE3 4.46Å; I372-W427 HydrophobicContact CG1-CG 3.57Å; I372-P525 HydrophobicContact CD1-CG 3.96Å; I372-P525 HydrophobicContact CG1-CG 4.37Å; I372-P525 HydrophobicContact CG2-CB 4.16Å; I372-P525 HydrophobicContact CG2-CG 4.04Å; I372-F527 HydrophobicContact CG2-CE2 4.43Å; I372-F527 HydrophobicContact CG2-CZ 4.05Å; I372-V543 HydrophobicContact CB-CG1 3.87Å; I372-V543 HydrophobicContact CB-CG2 4.31Å; I372-V543 HydrophobicContact CG2-CG2 4.29Å
373	T	96	Very high	91.3	Very high	56 Å²	56	46.4 Å²	46.4	34%	0.344	27%	0.273	S	S	.	.			trans	-117.9	157.4	166.1	61.3	0	0	0	0	109.9	L389 G416 G417	T373-L389 CarbonylContact C-O 3.55Å; T373-L389 WeakPolarHBondContact CA-O 3.45Å; T373-G416 CarbonylContact O-C 3.53Å; T373-G416 VanDerWaalsContact O-CA 3.24Å; T373-G416 WeakPolarHBondContact O-CA 3.32Å; T373-G417 PolarHBondContact O-N 3.02Å
374	F	97.2	Very high	91.9	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-83	147.3	174.4	-63.8	-51.2	0	0	0	111.8	L385 L389 T390 V392 L414 F527 V543	F374-L385 HydrophobicContact CB-CD1 4.17Å; F374-L385 HydrophobicContact CB-CD2 3.83Å; F374-L385 HydrophobicContact CD2-CD2 3.82Å; F374-L385 HydrophobicContact CG-CD2 4.06Å; F374-L389 WeakPolarHBondContact CB-O 3.39Å; F374-L389 VanDerWaalsContact CD2-O 3.27Å; F374-L389 WeakPolarHBondContact CD2-O 3.13Å; F374-L389 PolarHBondContact N-O 2.86Å; F374-T390 WeakPolarHBondContact CE2-O 3.28Å; F374-V392 HydrophobicContact CD2-CB 4.1Å; F374-V392 HydrophobicContact CD2-CG1 4.41Å; F374-V392 HydrophobicContact CE1-CG1 4.32Å; F374-V392 HydrophobicContact CE2-CB 3.82Å; F374-V392 HydrophobicContact CE2-CG1 3.73Å; F374-V392 HydrophobicContact CZ-CB 4.26Å; F374-V392 HydrophobicContact CZ-CG1 3.68Å; F374-L414 HydrophobicContact CB-CD1 3.75Å; F374-L414 HydrophobicContact CD1-CD1 3.74Å; F374-L414 HydrophobicContact CD1-CG 4.15Å; F374-L414 HydrophobicContact CD2-CD1 4.45Å; F374-L414 HydrophobicContact CE1-CD1 4.47Å; F374-L414 HydrophobicContact CG-CD1 3.74Å; F374-F527 AromaticContact CD1-CD2 3.79Å; F374-F527 HydrophobicContact CD1-CD2 3.79Å; F374-F527 AromaticContact CD1-CE2 3.78Å; F374-F527 HydrophobicContact CD1-CE2 3.78Å; F374-F527 HydrophobicContact CD1-CG 4.38Å; F374-F527 HydrophobicContact CD1-CZ 4.37Å; F374-F527 HydrophobicContact CE1-CB 4.41Å; F374-F527 AromaticContact CE1-CD1 3.89Å; F374-F527 HydrophobicContact CE1-CD1 3.89Å; F374-F527 AromaticContact CE1-CD2 3.5Å; F374-F527 HydrophobicContact CE1-CD2 3.5Å; F374-F527 VanDerWaalsContact CE1-CD2 3.5Å; F374-F527 AromaticContact CE1-CE1 3.92Å; F374-F527 HydrophobicContact CE1-CE1 3.92Å; F374-F527 AromaticContact CE1-CE2 3.54Å; F374-F527 HydrophobicContact CE1-CE2 3.54Å; F374-F527 AromaticContact CE1-CG 3.67Å; F374-F527 HydrophobicContact CE1-CG 3.67Å; F374-F527 AromaticContact CE1-CZ 3.76Å; F374-F527 HydrophobicContact CE1-CZ 3.76Å; F374-V543 HydrophobicContact CE1-CG2 3.87Å; F374-V543 HydrophobicContact CE2-CG2 4.19Å; F374-V543 HydrophobicContact CZ-CG2 3.64Å
375	N	96.3	Very high	92.4	Very high	44 Å²	44	42.1 Å²	42.1	24%	0.235	23%	0.229	C	C	.	.			trans	-98.8	105.3	176.1	-171.9	-18.3	0	0	0	111.6	K377 T378 A379 M415	N375-K377 PolarHBondContact O-N 3.11Å; N375-K377 WeakPolarHBondContact OD1-CB 3.45Å; N375-K377 PolarHBondContact OD1-N 2.75Å; N375-T378 HydrophobicContact CB-CG2 4.03Å; N375-T378 PolarHBondContact O-N 3.45Å; N375-T378 PolarHBondContact O-OG1 3.27Å; N375-A379 PolarHBondContact O-N 2.89Å; N375-M415 WeakPolarHBondContact CB-O 3.41Å; N375-M415 PolarHBondContact N-O 3.46Å
376	S	95.1	Very high	92.8	Very high	66 Å²	66	40.2 Å²	40.2	46%	0.462	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.1	-179.5	61.3	0	0	0	0	114.7	T378 R407	S376-T378 VanDerWaalsContact C-N 3.27Å; S376-T378 PolarHBondContact O-N 3.32Å; S376-R407 PolarHBondContact O-NH1 3.18Å; S376-R407 VanDerWaalsContact O-NH1 3.12Å
377	K	95.1	Very high	93.1	Very high	144 Å²	144	40.7 Å²	40.7	63%	0.626	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-27.2	176.9	-63.2	-176.7	179	179.3	0	112.4	N375 N404	N375-K377 PolarHBondContact O-N 3.11Å; N375-K377 WeakPolarHBondContact OD1-CB 3.45Å; N375-K377 PolarHBondContact OD1-N 2.75Å; K377-N404 PolarHBondContact O-ND2 2.86Å
378	T	96.6	Very high	93.3	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.012	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-23.3	-179.4	69.8	0	0	0	0	112.6	N375 S376 Q406 R407 F408 M415	N375-T378 HydrophobicContact CB-CG2 4.03Å; N375-T378 PolarHBondContact O-N 3.45Å; N375-T378 PolarHBondContact O-OG1 3.27Å; S376-T378 VanDerWaalsContact C-N 3.27Å; S376-T378 PolarHBondContact O-N 3.32Å; T378-Q406 WeakPolarHBondContact CA-O 3.46Å; T378-Q406 HydrophobicContact CG2-CB 4.38Å; T378-R407 WeakPolarHBondContact O-CA 3.41Å; T378-F408 VanDerWaalsContact O-CD2 3.29Å; T378-F408 WeakPolarHBondContact O-CD2 3.28Å; T378-F408 PolarHBondContact O-N 3.14Å; T378-M415 HydrophobicContact CG2-CB 4.21Å; T378-M415 HydrophobicContact CG2-CE 3.67Å; T378-M415 PolarHBondContact OG1-N 3.43Å
379	A	96	Very high	93.8	Very high	6 Å²	6	42.6 Å²	42.6	5%	0.05	25%	0.253	C	S	.	.	S	Bend	trans	-64.1	135.3	-170.9	0	0	0	0	0	113.2	N375 L385 R407 L414	N375-A379 PolarHBondContact O-N 2.89Å; A379-L385 HydrophobicContact CB-CD1 4.4Å; A379-R407 VanDerWaalsContact O-CG 3.24Å; A379-R407 WeakPolarHBondContact O-CG 3.42Å; A379-R407 PolarHBondContact O-NH1 3.37Å; A379-L414 HydrophobicContact CB-CB 3.96Å; A379-L414 HydrophobicContact CB-CD1 4.29Å
380	N	94.4	Very high	94.1	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	25%	0.249	C	C	.	.			trans	-58	142.8	172.9	-176	-68.1	0	0	0	111.9	W382 L383 F408 N409 A411 S413	N380-W382 PolarHBondContact O-N 3.06Å; N380-W382 VanDerWaalsContact O-N 3.1Å; N380-W382 WeakPolarHBondContact OD1-CB 3.38Å; N380-W382 VanDerWaalsContact OD1-CD1 3.24Å; N380-W382 PolarHBondContact OD1-N 2.86Å; N380-L383 HydrophobicContact CB-CD1 4.03Å; N380-L383 HydrophobicContact CB-CG 4.1Å; N380-L383 WeakPolarHBondContact O-CB 3.32Å; N380-L383 PolarHBondContact O-N 3.41Å; N380-F408 VanDerWaalsContact CA-O 3.26Å; N380-F408 WeakPolarHBondContact CA-O 3.34Å; N380-F408 HydrophobicContact CB-CB 4.39Å; N380-F408 PolarHBondContact ND2-O 3.12Å; N380-N409 PolarHBondContact ND2-O 2.75Å; N380-A411 WeakPolarHBondContact CB-O 3.31Å; N380-A411 PolarHBondContact ND2-O 3.49Å; N380-S413 PolarHBondContact N-O 2.98Å; N380-S413 VanDerWaalsContact N-O 3.11Å
381	P	93.6	Very high	94.3	Very high	18 Å²	18	41.9 Å²	41.9	12%	0.117	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-19.3	-179.8	-26.5	35.8	0	0	0	116.3	L383 Q395 F397 N398	P381-L383 PolarHBondContact O-N 2.85Å; P381-Q395 PolarHBondContact O-NE2 2.88Å; P381-Q395 VanDerWaalsContact O-NE2 3.13Å; P381-F397 HydrophobicContact CB-CD2 3.98Å; P381-F397 HydrophobicContact CB-CE2 3.62Å; P381-F397 HydrophobicContact CB-CZ 4.37Å; P381-F397 HydrophobicContact CG-CE2 4.22Å; P381-N398 PolarHBondContact O-N 3.41Å
382	W	92.4	Very high	94.6	Very high	83 Å²	83	39 Å²	39	31%	0.314	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	3.7	173.5	-67.3	93.3	0	0	0	113.5	N380 Y394 Q395 F397 L412	N380-W382 PolarHBondContact O-N 3.06Å; N380-W382 VanDerWaalsContact O-N 3.1Å; N380-W382 WeakPolarHBondContact OD1-CB 3.38Å; N380-W382 VanDerWaalsContact OD1-CD1 3.24Å; N380-W382 PolarHBondContact OD1-N 2.86Å; W382-Y394 HydrophobicContact CB-CD2 4.42Å; W382-Y394 HydrophobicContact CB-CE2 4.06Å; W382-Y394 HydrophobicContact CD2-CE2 4.35Å; W382-Y394 AromaticContact CE3-CE2 3.74Å; W382-Y394 HydrophobicContact CE3-CE2 3.74Å; W382-Y394 AromaticContact CE3-CZ 3.66Å; W382-Y394 WeakPolarHBondContact CZ3-OH 3.19Å; W382-Q395 VanDerWaalsContact O-CG 3.29Å; W382-Q395 WeakPolarHBondContact O-CG 3.46Å; W382-Q395 PolarHBondContact O-N 3.45Å; W382-F397 AromaticContact CD1-CD2 3.89Å; W382-F397 HydrophobicContact CD2-CB 3.98Å; W382-F397 HydrophobicContact CD2-CD2 4.17Å; W382-F397 AromaticContact CE2-CD2 3.67Å; W382-F397 HydrophobicContact CE3-CB 4.03Å; W382-F397 HydrophobicContact CG-CD2 4.32Å; W382-F397 HydrophobicContact CH2-CB 3.79Å; W382-F397 HydrophobicContact CZ2-CB 3.72Å; W382-F397 HydrophobicContact CZ2-CD2 4.14Å; W382-F397 HydrophobicContact CZ2-CG 4.27Å; W382-F397 HydrophobicContact CZ3-CB 3.94Å; W382-F397 AromaticContact NE1-CD2 3.47Å; W382-L412 HydrophobicContact CB-CD2 3.53Å; W382-L412 HydrophobicContact CG-CD2 4.21Å
383	L	93.6	Very high	94.5	Very high	11 Å²	11	44.1 Å²	44.1	6%	0.058	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139	179.4	-56.7	179.9	0	0	0	110.9	N380 P381 V392 R393 Q395 L412 L414 L529	N380-L383 HydrophobicContact CB-CD1 4.03Å; N380-L383 HydrophobicContact CB-CG 4.1Å; N380-L383 WeakPolarHBondContact O-CB 3.32Å; N380-L383 PolarHBondContact O-N 3.41Å; P381-L383 PolarHBondContact O-N 2.85Å; L383-V392 HydrophobicContact CB-CG2 4Å; L383-V392 HydrophobicContact CD1-CG2 4.12Å; L383-V392 HydrophobicContact CD2-CG2 4.28Å; L383-V392 HydrophobicContact CG-CG2 4.38Å; L383-R393 WeakPolarHBondContact CA-O 3.39Å; L383-Q395 PolarHBondContact O-NE2 2.95Å; L383-L412 HydrophobicContact CD2-CB 4.38Å; L383-L412 HydrophobicContact CD2-CD2 4.38Å; L383-L414 HydrophobicContact CD1-CB 4.48Å; L383-L414 HydrophobicContact CD1-CD2 3.97Å; L383-L529 HydrophobicContact CD1-CD1 4.28Å; L383-L529 HydrophobicContact CD2-CD1 3.89Å; L383-L529 HydrophobicContact CD2-CD2 3.81Å; L383-L529 HydrophobicContact CD2-CG 4.34Å
384	S	93.1	Very high	94.2	Very high	12 Å²	12	43.6 Å²	43.6	8%	0.084	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	146.9	164.8	32.5	0	0	0	0	111.3	V392 R393 Q395	S384-V392 WeakPolarHBondContact O-CA 3.09Å; S384-R393 PolarHBondContact N-O 3.44Å; S384-R393 PolarHBondContact O-N 3.11Å; S384-R393 WeakPolarHBondContact OG-CG 3.35Å; S384-R393 PolarHBondContact OG-NH1 3.21Å; S384-Q395 PolarHBondContact OG-OE1 3.34Å
385	L	94.6	Very high	93.8	Very high	36 Å²	36	45.7 Å²	45.7	19%	0.188	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	147.9	176.6	-58.8	174.3	0	0	0	109.6	F374 A379 L389 C391 V392 L414	F374-L385 HydrophobicContact CB-CD1 4.17Å; F374-L385 HydrophobicContact CB-CD2 3.83Å; F374-L385 HydrophobicContact CD2-CD2 3.82Å; F374-L385 HydrophobicContact CG-CD2 4.06Å; A379-L385 HydrophobicContact CB-CD1 4.4Å; L385-L389 HydrophobicContact CB-CD2 4.01Å; L385-L389 HydrophobicContact CD1-CD2 3.9Å; L385-C391 WeakPolarHBondContact CA-O 3.34Å; L385-V392 HydrophobicContact CD2-CB 3.6Å; L385-V392 HydrophobicContact CD2-CG2 3.68Å; L385-L414 HydrophobicContact CD2-CD1 3.65Å
386	T	94.4	Very high	93.4	Very high	34 Å²	34	49.1 Å²	49.1	21%	0.209	27%	0.268	C	S	.	.			trans	-68.8	162.4	165.4	56.1	0	0	0	0	110.9	S388 L389 C391	T386-S388 PolarHBondContact O-N 2.81Å; T386-S388 PolarHBondContact OG1-OG 3.28Å; T386-L389 PolarHBondContact O-N 3.06Å; T386-C391 HydrophobicContact CG2-CB 3.59Å; T386-C391 PolarHBondContact N-O 3.45Å; T386-C391 PolarHBondContact OG1-N 3.47Å
387	S	93.2	Very high	93	Very high	130 Å²	130	51.3 Å²	51.3	91%	0.909	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-31.5	174.8	52.2	0	0	0	0	113	L389	S387-L389 PolarHBondContact O-N 2.89Å
388	S	93	Very high	92.6	Very high	62 Å²	62	47 Å²	47	43%	0.434	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-11.6	175	60.9	0	0	0	0	114.3	T386 T390	T386-S388 PolarHBondContact O-N 2.81Å; T386-S388 PolarHBondContact OG1-OG 3.28Å; S388-T390 PolarHBondContact O-N 3.14Å; S388-T390 PolarHBondContact OG-OG1 2.99Å
389	L	95.4	Very high	92.1	Very high	59 Å²	59	51.9 Å²	51.9	31%	0.309	29%	0.287	S	S	.	.	S	Bend	trans	55.3	28.8	-173.1	-54.7	175.4	0	0	0	113.6	T373 F374 L385 T386 S387	T373-L389 CarbonylContact C-O 3.55Å; T373-L389 WeakPolarHBondContact CA-O 3.45Å; F374-L389 WeakPolarHBondContact CB-O 3.39Å; F374-L389 VanDerWaalsContact CD2-O 3.27Å; F374-L389 WeakPolarHBondContact CD2-O 3.13Å; F374-L389 PolarHBondContact N-O 2.86Å; L385-L389 HydrophobicContact CB-CD2 4.01Å; L385-L389 HydrophobicContact CD1-CD2 3.9Å; T386-L389 PolarHBondContact O-N 3.06Å; S387-L389 PolarHBondContact O-N 2.89Å
390	T	94.4	Very high	91.7	Very high	36 Å²	36	56 Å²	56	22%	0.221	32%	0.316	C	S	.	.			trans	-114.1	-4.9	179.4	54.1	0	0	0	0	113.4	F374 S388 K542 V543	F374-T390 WeakPolarHBondContact CE2-O 3.28Å; S388-T390 PolarHBondContact O-N 3.14Å; S388-T390 PolarHBondContact OG-OG1 2.99Å; T390-K542 WeakPolarHBondContact O-CA 3.45Å; T390-V543 PolarHBondContact O-N 2.95Å
391	C	94.2	Very high	91.4	Very high	18 Å²	18	58.1 Å²	58.1	12%	0.122	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	131.5	178.8	172.6	0	0	0	0	109.1	L385 T386 L541 K542	L385-C391 WeakPolarHBondContact CA-O 3.34Å; T386-C391 HydrophobicContact CG2-CB 3.59Å; T386-C391 PolarHBondContact N-O 3.45Å; T386-C391 PolarHBondContact OG1-N 3.47Å; C391-L541 WeakPolarHBondContact CA-O 3.47Å; C391-K542 HydrophobicContact CB-CG 4.01Å
392	V	94.1	Very high	91.2	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	132.5	178.2	60.7	0	0	0	0	109.4	F374 L383 S384 L385 L414 L529 P540 L541	F374-V392 HydrophobicContact CD2-CB 4.1Å; F374-V392 HydrophobicContact CD2-CG1 4.41Å; F374-V392 HydrophobicContact CE1-CG1 4.32Å; F374-V392 HydrophobicContact CE2-CB 3.82Å; F374-V392 HydrophobicContact CE2-CG1 3.73Å; F374-V392 HydrophobicContact CZ-CB 4.26Å; F374-V392 HydrophobicContact CZ-CG1 3.68Å; L383-V392 HydrophobicContact CB-CG2 4Å; L383-V392 HydrophobicContact CD1-CG2 4.12Å; L383-V392 HydrophobicContact CD2-CG2 4.28Å; L383-V392 HydrophobicContact CG-CG2 4.38Å; S384-V392 WeakPolarHBondContact O-CA 3.09Å; L385-V392 HydrophobicContact CD2-CB 3.6Å; L385-V392 HydrophobicContact CD2-CG2 3.68Å; V392-L414 HydrophobicContact CB-CD1 4.19Å; V392-L414 HydrophobicContact CG1-CD2 4.3Å; V392-L414 HydrophobicContact CG2-CD1 3.92Å; V392-L414 HydrophobicContact CG2-CD2 4.18Å; V392-L529 HydrophobicContact CG1-CD1 3.93Å; V392-L529 HydrophobicContact CG2-CD1 4.07Å; V392-P540 CarbonylContact O-C 3.49Å; V392-P540 VanDerWaalsContact O-CA 3.27Å; V392-P540 WeakPolarHBondContact O-CA 3.25Å; V392-P540 WeakPolarHBondContact O-CB 3.38Å; V392-L541 HydrophobicContact CG1-CB 3.75Å; V392-L541 PolarHBondContact N-O 3.27Å; V392-L541 PolarHBondContact O-N 3.01Å
393	R	91.4	Very high	91.1	Very high	108 Å²	108	66.5 Å²	66.5	41%	0.408	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	152	179.6	72.5	-174.7	111.8	90.1	-5.7	110.5	L383 S384 P540	L383-R393 WeakPolarHBondContact CA-O 3.39Å; S384-R393 PolarHBondContact N-O 3.44Å; S384-R393 PolarHBondContact O-N 3.11Å; S384-R393 WeakPolarHBondContact OG-CG 3.35Å; S384-R393 PolarHBondContact OG-NH1 3.21Å; R393-P540 HydrophobicContact CB-CB 3.79Å
394	Y	90.8	Very high	91.1	Very high	44 Å²	44	67.9 Å²	67.9	17%	0.173	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	146.8	164.6	176.8	-92.4	0	0	0	110.4	W382 L412 L532 V535 H536	W382-Y394 HydrophobicContact CB-CD2 4.42Å; W382-Y394 HydrophobicContact CB-CE2 4.06Å; W382-Y394 HydrophobicContact CD2-CE2 4.35Å; W382-Y394 AromaticContact CE3-CE2 3.74Å; W382-Y394 HydrophobicContact CE3-CE2 3.74Å; W382-Y394 AromaticContact CE3-CZ 3.66Å; W382-Y394 WeakPolarHBondContact CZ3-OH 3.19Å; Y394-L412 HydrophobicContact CD2-CD1 4.2Å; Y394-L412 HydrophobicContact CD2-CD2 4.37Å; Y394-L412 HydrophobicContact CE2-CD2 4.46Å; Y394-L532 HydrophobicContact CD2-CD2 4.41Å; Y394-L532 HydrophobicContact CE2-CD2 3.48Å; Y394-L532 VanDerWaalsContact CE2-CD2 3.48Å; Y394-V535 HydrophobicContact CD1-CG1 4.14Å; Y394-V535 HydrophobicContact CD2-CB 4.45Å; Y394-V535 HydrophobicContact CD2-CG1 3.37Å; Y394-V535 HydrophobicContact CD2-CG2 4.27Å; Y394-V535 HydrophobicContact CE2-CG1 3.77Å; Y394-V535 HydrophobicContact CG-CB 4.47Å; Y394-V535 HydrophobicContact CG-CG1 3.56Å; Y394-V535 HydrophobicContact CG-CG2 4.15Å; Y394-H536 AromaticContact CD1-ND1 3.65Å; Y394-H536 AromaticContact CE1-CE1 3.06Å; Y394-H536 WeakPolarHBondContact CE1-CE1 3.48Å; Y394-H536 AromaticContact CE1-ND1 3.09Å; Y394-H536 WeakPolarHBondContact CE1-ND1 3.33Å; Y394-H536 AromaticContact CZ-CE1 3.26Å; Y394-H536 AromaticContact CZ-ND1 3.76Å; Y394-H536 AromaticContact CZ-NE2 3.98Å; Y394-H536 PolarHBondContact OH-CE1 3.39Å
395	Q	88.6	Confident	91.1	Very high	46 Å²	46	72.5 Å²	72.5	22%	0.215	41%	0.41	C	S	.	.			trans	-145.5	174.4	175	59.8	166.4	23	0	0	110.7	P381 W382 L383 S384	P381-Q395 PolarHBondContact O-NE2 2.88Å; P381-Q395 VanDerWaalsContact O-NE2 3.13Å; W382-Q395 VanDerWaalsContact O-CG 3.29Å; W382-Q395 WeakPolarHBondContact O-CG 3.46Å; W382-Q395 PolarHBondContact O-N 3.45Å; L383-Q395 PolarHBondContact O-NE2 2.95Å; S384-Q395 PolarHBondContact OG-OE1 3.34Å
396	T	87.3	Confident	91.1	Very high	116 Å²	116	75.1 Å²	75.1	71%	0.712	42%	0.421	S	S	*	.	S	Bend	trans	-63.2	150.7	164.7	50	0	0	0	0	111.2	N398	T396-N398 PolarHBondContact O-N 3.45Å
397	F	87.4	Confident	91.1	Very high	111 Å²	111	74.6 Å²	74.6	49%	0.487	42%	0.416	S	S	.	.			trans	-54.1	124.9	-179	-178.3	-101.8	0	0	0	111.9	P381 W382	P381-F397 HydrophobicContact CB-CD2 3.98Å; P381-F397 HydrophobicContact CB-CE2 3.62Å; P381-F397 HydrophobicContact CB-CZ 4.37Å; P381-F397 HydrophobicContact CG-CE2 4.22Å; W382-F397 AromaticContact CD1-CD2 3.89Å; W382-F397 HydrophobicContact CD2-CB 3.98Å; W382-F397 HydrophobicContact CD2-CD2 4.17Å; W382-F397 AromaticContact CE2-CD2 3.67Å; W382-F397 HydrophobicContact CE3-CB 4.03Å; W382-F397 HydrophobicContact CG-CD2 4.32Å; W382-F397 HydrophobicContact CH2-CB 3.79Å; W382-F397 HydrophobicContact CZ2-CB 3.72Å; W382-F397 HydrophobicContact CZ2-CD2 4.14Å; W382-F397 HydrophobicContact CZ2-CG 4.27Å; W382-F397 HydrophobicContact CZ3-CB 3.94Å; W382-F397 AromaticContact NE1-CD2 3.47Å
398	N	86.9	Confident	91.2	Very high	54 Å²	54	68.4 Å²	68.4	29%	0.289	37%	0.372	S	S	.	.			trans	-98.9	100.1	177.8	-173.6	-4.2	0	0	0	111.5	P381 T396 S400 V401	P381-N398 PolarHBondContact O-N 3.41Å; T396-N398 PolarHBondContact O-N 3.45Å; N398-S400 PolarHBondContact ND2-OG 3.5Å; N398-S400 PolarHBondContact O-N 3.34Å; N398-S400 WeakPolarHBondContact OD1-CB 3.28Å; N398-S400 PolarHBondContact OD1-N 2.98Å; N398-S400 PolarHBondContact OD1-OG 3.22Å; N398-V401 HydrophobicContact CB-CG2 4.05Å; N398-V401 WeakPolarHBondContact ND2-CG2 3.43Å; N398-V401 PolarHBondContact O-N 3.41Å
399	S	85.8	Confident	91	Very high	105 Å²	105	69 Å²	69	73%	0.734	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-14.8	179.1	57.6	0	0	0	0	114.6	V401	S399-V401 VanDerWaalsContact C-N 3.27Å; S399-V401 PolarHBondContact O-N 3.41Å
400	S	87.1	Confident	90.5	Very high	92 Å²	92	69.2 Å²	69.2	64%	0.643	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-15.7	177.3	71	0	0	0	0	113.4	N398 Q402	N398-S400 PolarHBondContact ND2-OG 3.5Å; N398-S400 PolarHBondContact O-N 3.34Å; N398-S400 WeakPolarHBondContact OD1-CB 3.28Å; N398-S400 PolarHBondContact OD1-N 2.98Å; N398-S400 PolarHBondContact OD1-OG 3.22Å; S400-Q402 PolarHBondContact O-N 3.09Å
401	V	87.1	Confident	90.2	Very high	46 Å²	46	68.3 Å²	68.3	28%	0.279	38%	0.377	S	S	.	.	S	Bend	trans	-80.1	110.6	-178	178.1	0	0	0	0	109.6	N398 S399	N398-V401 HydrophobicContact CB-CG2 4.05Å; N398-V401 WeakPolarHBondContact ND2-CG2 3.43Å; N398-V401 PolarHBondContact O-N 3.41Å; S399-V401 VanDerWaalsContact C-N 3.27Å; S399-V401 PolarHBondContact O-N 3.41Å
402	Q	89.4	Confident	90.2	Very high	169 Å²	169	67.7 Å²	67.7	79%	0.79	37%	0.373	S	S	*	.			trans	-65.4	137.3	175.7	-67.8	-177	-15.6	0	0	111.7	S400 R407	S400-Q402 PolarHBondContact O-N 3.09Å; Q402-R407 PolarHBondContact O-NE 2.99Å; Q402-R407 PolarHBondContact O-NH2 3.44Å
403	D	90.8	Very high	90.2	Very high	107 Å²	107	67.7 Å²	67.7	57%	0.572	37%	0.373	S	S	*	.			trans	-69.2	148.8	172.5	-165.2	28	0	0	0	110.9	K449	D403-K449 IonicContact OD1-NZ 2.74Å; D403-K449 PolarHBondContact OD1-NZ 2.78Å; D403-K449 IonicContact OD2-NZ 3.2Å; D403-K449 PolarHBondContact OD2-NZ 2.91Å
404	N	94	Very high	90.5	Very high	41 Å²	41	62.6 Å²	62.6	22%	0.219	35%	0.353	C	S	.	.			trans	-150.2	165.4	173.7	72.1	71.7	0	0	0	110	K377 Q406 R407 K449	K377-N404 PolarHBondContact O-ND2 2.86Å; N404-Q406 VanDerWaalsContact C-N 3.25Å; N404-Q406 PolarHBondContact O-N 3.31Å; N404-Q406 WeakPolarHBondContact OD1-CA 3.32Å; N404-Q406 WeakPolarHBondContact OD1-CB 3.46Å; N404-Q406 PolarHBondContact OD1-N 3.27Å; N404-R407 PolarHBondContact ND2-NH2 3.15Å; N404-R407 WeakPolarHBondContact O-CB 3.38Å; N404-R407 PolarHBondContact O-N 3.48Å; N404-R407 VanDerWaalsContact O-N 3.14Å; N404-R407 PolarHBondContact OD1-N 2.98Å; N404-R407 VanDerWaalsContact OD1-N 3.12Å; N404-K449 PolarHBondContact O-NZ 3.28Å
405	P	93.3	Very high	90.8	Very high	108 Å²	108	60.7 Å²	60.7	70%	0.701	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-29.5	-176.7	-26.8	36.1	0	0	0	115	R407	P405-R407 VanDerWaalsContact C-N 3.34Å
406	Q	94.3	Very high	91.2	Very high	91 Å²	91	58.5 Å²	58.5	43%	0.425	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-12.5	-178.4	-61	-63	-33.7	0	0	113	T378 N404	T378-Q406 WeakPolarHBondContact CA-O 3.46Å; T378-Q406 HydrophobicContact CG2-CB 4.38Å; N404-Q406 VanDerWaalsContact C-N 3.25Å; N404-Q406 PolarHBondContact O-N 3.31Å; N404-Q406 WeakPolarHBondContact OD1-CA 3.32Å; N404-Q406 WeakPolarHBondContact OD1-CB 3.46Å; N404-Q406 PolarHBondContact OD1-N 3.27Å
407	R	95.4	Very high	91.6	Very high	23 Å²	23	54.9 Å²	54.9	9%	0.087	32%	0.322	C	S	.	.	S	Bend	trans	-80.6	130.4	-175.3	-167.4	-179.3	-61.2	-68	0.9	112	S376 T378 A379 Q402 N404 P405 K449	S376-R407 PolarHBondContact O-NH1 3.18Å; S376-R407 VanDerWaalsContact O-NH1 3.12Å; T378-R407 WeakPolarHBondContact O-CA 3.41Å; A379-R407 VanDerWaalsContact O-CG 3.24Å; A379-R407 WeakPolarHBondContact O-CG 3.42Å; A379-R407 PolarHBondContact O-NH1 3.37Å; Q402-R407 PolarHBondContact O-NE 2.99Å; Q402-R407 PolarHBondContact O-NH2 3.44Å; N404-R407 PolarHBondContact ND2-NH2 3.15Å; N404-R407 WeakPolarHBondContact O-CB 3.38Å; N404-R407 PolarHBondContact O-N 3.48Å; N404-R407 VanDerWaalsContact O-N 3.14Å; N404-R407 PolarHBondContact OD1-N 2.98Å; N404-R407 VanDerWaalsContact OD1-N 3.12Å; P405-R407 VanDerWaalsContact C-N 3.34Å; R407-K449 VanDerWaalsContact O-CE 3.29Å; R407-K449 WeakPolarHBondContact O-CE 3.38Å; R407-K449 PolarHBondContact O-NZ 2.99Å
408	F	95.1	Very high	92	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	32%	0.32	C	S	.	.			trans	-69.9	131.5	167.2	-66.4	-79.4	0	0	0	110.9	T378 N380 S413 M415 R448 I452 Y526	T378-F408 VanDerWaalsContact O-CD2 3.29Å; T378-F408 WeakPolarHBondContact O-CD2 3.28Å; T378-F408 PolarHBondContact O-N 3.14Å; N380-F408 VanDerWaalsContact CA-O 3.26Å; N380-F408 WeakPolarHBondContact CA-O 3.34Å; N380-F408 HydrophobicContact CB-CB 4.39Å; N380-F408 PolarHBondContact ND2-O 3.12Å; F408-S413 WeakPolarHBondContact CD2-O 3.07Å; F408-M415 HydrophobicContact CE2-CG 3.93Å; F408-M415 HydrophobicContact CZ-CG 4.3Å; F408-R448 WeakPolarHBondContact CA-O 3.19Å; F408-R448 HydrophobicContact CD1-CB 4.08Å; F408-R448 HydrophobicContact CE1-CB 4.41Å; F408-R448 VanDerWaalsContact CE1-CD 3.44Å; F408-I452 HydrophobicContact CD1-CD1 3.37Å; F408-I452 HydrophobicContact CE1-CD1 3.53Å; F408-Y526 HydrophobicContact CE1-CE2 4.21Å; F408-Y526 HydrophobicContact CE2-CE2 4.34Å; F408-Y526 HydrophobicContact CZ-CD2 4.12Å; F408-Y526 AromaticContact CZ-CE2 3.67Å; F408-Y526 HydrophobicContact CZ-CE2 3.67Å
409	N	88.5	Confident	92.4	Very high	74 Å²	74	53 Å²	53	40%	0.396	32%	0.32	S	S	.	.	S	Bend	trans	-107.8	-41.8	-177.7	70.4	-11.8	0	0	0	114.2	N380 R448 K449 G450	N380-N409 PolarHBondContact ND2-O 2.75Å; N409-R448 PolarHBondContact N-O 2.92Å; N409-K449 HydrophobicContact CB-CD 4.08Å; N409-K449 VanDerWaalsContact OD1-CA 3.27Å; N409-K449 WeakPolarHBondContact OD1-CA 3.36Å; N409-G450 PolarHBondContact OD1-N 2.69Å; N409-G450 VanDerWaalsContact OD1-N 3.1Å
410	A	85.3	Confident	93	Very high	65 Å²	65	48.2 Å²	48.2	54%	0.537	29%	0.286	S	S	.	.	S	Bend	trans	-97.4	-41	-175.2	0	0	0	0	0	112.3	G450	A410-G450 WeakPolarHBondContact CB-O 3.32Å
411	A	88.2	Confident	93.4	Very high	16 Å²	16	47.6 Å²	47.6	13%	0.132	28%	0.279	C	S	.	.	S	Bend	trans	-84.7	139.7	177.6	0	0	0	0	0	111.1	N380 S413 I452	N380-A411 WeakPolarHBondContact CB-O 3.31Å; N380-A411 PolarHBondContact ND2-O 3.49Å; A411-S413 VanDerWaalsContact CB-OG 3.27Å; A411-S413 WeakPolarHBondContact CB-OG 3.23Å; A411-S413 PolarHBondContact O-N 3.08Å; A411-I452 HydrophobicContact CB-CB 4.48Å; A411-I452 HydrophobicContact CB-CD1 3.83Å; A411-I452 HydrophobicContact CB-CG1 4.28Å
412	L	92.7	Very high	93.9	Very high	6 Å²	6	53.2 Å²	53.2	3%	0.031	30%	0.299	C	S	.	.	S	Bend	trans	-71.2	58.6	173.2	-66.5	-178.4	0	0	0	111.2	W382 L383 Y394 N528 L529 L532 V535	W382-L412 HydrophobicContact CB-CD2 3.53Å; W382-L412 HydrophobicContact CG-CD2 4.21Å; L383-L412 HydrophobicContact CD2-CB 4.38Å; L383-L412 HydrophobicContact CD2-CD2 4.38Å; Y394-L412 HydrophobicContact CD2-CD1 4.2Å; Y394-L412 HydrophobicContact CD2-CD2 4.37Å; Y394-L412 HydrophobicContact CE2-CD2 4.46Å; L412-N528 VanDerWaalsContact O-CA 3.28Å; L412-N528 WeakPolarHBondContact O-CA 3.39Å; L412-L529 HydrophobicContact CB-CB 4.45Å; L412-L529 PolarHBondContact O-N 2.8Å; L412-L532 HydrophobicContact CD1-CD2 3.92Å; L412-L532 HydrophobicContact CD1-CG 4.13Å; L412-L532 HydrophobicContact CD2-CD2 4.09Å; L412-L532 HydrophobicContact CG-CD2 4.36Å; L412-V535 HydrophobicContact CD1-CB 4.1Å; L412-V535 HydrophobicContact CD1-CG1 3.85Å; L412-V535 HydrophobicContact CD1-CG2 4.1Å
413	S	95.7	Very high	94.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	160.5	-168.3	-50.3	0	0	0	0	112.9	N380 F408 A411 Y526 F527 N528	N380-S413 PolarHBondContact N-O 2.98Å; N380-S413 VanDerWaalsContact N-O 3.11Å; F408-S413 WeakPolarHBondContact CD2-O 3.07Å; A411-S413 VanDerWaalsContact CB-OG 3.27Å; A411-S413 WeakPolarHBondContact CB-OG 3.23Å; A411-S413 PolarHBondContact O-N 3.08Å; S413-Y526 PolarHBondContact OG-OH 3.26Å; S413-Y526 VanDerWaalsContact OG-OH 3.04Å; S413-F527 VanDerWaalsContact CA-O 3.25Å; S413-F527 WeakPolarHBondContact CA-O 3.33Å; S413-N528 WeakPolarHBondContact OG-CB 3.27Å; S413-N528 PolarHBondContact OG-ND2 3.34Å
414	L	97.2	Very high	94.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	161.6	173	71.1	174.1	0	0	0	110	F374 A379 L383 L385 V392 F527 L529	F374-L414 HydrophobicContact CB-CD1 3.75Å; F374-L414 HydrophobicContact CD1-CD1 3.74Å; F374-L414 HydrophobicContact CD1-CG 4.15Å; F374-L414 HydrophobicContact CD2-CD1 4.45Å; F374-L414 HydrophobicContact CE1-CD1 4.47Å; F374-L414 HydrophobicContact CG-CD1 3.74Å; A379-L414 HydrophobicContact CB-CB 3.96Å; A379-L414 HydrophobicContact CB-CD1 4.29Å; L383-L414 HydrophobicContact CD1-CB 4.48Å; L383-L414 HydrophobicContact CD1-CD2 3.97Å; L385-L414 HydrophobicContact CD2-CD1 3.65Å; V392-L414 HydrophobicContact CB-CD1 4.19Å; V392-L414 HydrophobicContact CG1-CD2 4.3Å; V392-L414 HydrophobicContact CG2-CD1 3.92Å; V392-L414 HydrophobicContact CG2-CD2 4.18Å; L414-F527 HydrophobicContact CD2-CB 3.69Å; L414-F527 HydrophobicContact CG-CB 4.42Å; L414-F527 PolarHBondContact N-O 3.29Å; L414-F527 PolarHBondContact O-N 3.16Å; L414-F527 VanDerWaalsContact O-N 3.11Å; L414-L529 HydrophobicContact CD2-CD1 4.31Å
415	M	97.6	Very high	94.6	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.025	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	162.8	172.7	-63.7	-163.4	-75.5	0	0	111.8	N375 T378 F408 R448 F524 P525	N375-M415 WeakPolarHBondContact CB-O 3.41Å; N375-M415 PolarHBondContact N-O 3.46Å; T378-M415 HydrophobicContact CG2-CB 4.21Å; T378-M415 HydrophobicContact CG2-CE 3.67Å; T378-M415 PolarHBondContact OG1-N 3.43Å; F408-M415 HydrophobicContact CE2-CG 3.93Å; F408-M415 HydrophobicContact CZ-CG 4.3Å; M415-R448 PolarHBondContact SD-NH1 3.47Å; M415-R448 PolarHBondContact SD-NH2 2.63Å; M415-F524 HydrophobicContact CB-CB 4.26Å; M415-F524 HydrophobicContact CG-CB 4.49Å; M415-F524 HydrophobicContact SD-CB 3.89Å; M415-F524 HydrophobicContact SD-CD2 4.38Å; M415-F524 HydrophobicContact SD-CG 4.16Å; M415-P525 CarbonylContact C-O 3.55Å; M415-P525 WeakPolarHBondContact CA-O 3.49Å
416	G	97.1	Very high	94.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-64.3	156.5	164.6	0	0	0	0	0	112.4	T373 F524 P525	T373-G416 CarbonylContact O-C 3.53Å; T373-G416 VanDerWaalsContact O-CA 3.24Å; T373-G416 WeakPolarHBondContact O-CA 3.32Å; G416-F524 WeakPolarHBondContact O-CD1 3.46Å; G416-P525 PolarHBondContact N-O 3.4Å
417	G	95.1	Very high	94.8	Very high	40 Å²	40	35.6 Å²	35.6	41%	0.412	21%	0.205	S	C	.	.	S	Bend	trans	-75.7	-24.8	174.7	0	0	0	0	0	113.3	T373	T373-G417 PolarHBondContact O-N 3.02Å
418	Q	94.7	Very high	94.9	Very high	97 Å²	97	35.4 Å²	35.4	45%	0.453	21%	0.205	S	C	.	.			trans	-106.4	129.9	179.4	-171	171.7	6.6	0	0	110.8	F420 P525	Q418-F420 HydrophobicContact CG-CE1 3.93Å; Q418-F420 HydrophobicContact CG-CZ 4.27Å; Q418-P525 VanDerWaalsContact O-CD 3.22Å; Q418-P525 WeakPolarHBondContact O-CD 3.18Å
419	G	96.3	Very high	94.9	Very high	27 Å²	27	35.4 Å²	35.4	28%	0.278	21%	0.205	S	C	.	.			trans	-104	152.9	172	0	0	0	0	0	111.6	L523 F524	G419-L523 CarbonylContact C-O 3.6Å; G419-L523 WeakPolarHBondContact CA-O 3.49Å; G419-F524 VanDerWaalsContact N-CE1 3.33Å
420	F	97.6	Very high	95.2	Very high	6 Å²	6	34.9 Å²	34.9	3%	0.026	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-122.1	128.4	-175.4	-54.6	-66.3	0	0	0	111.1	I372 Q418 H425 W427 L494 Y496 L523 P525	I372-F420 HydrophobicContact CD1-CE2 4.19Å; I372-F420 HydrophobicContact CD1-CZ 3.77Å; Q418-F420 HydrophobicContact CG-CE1 3.93Å; Q418-F420 HydrophobicContact CG-CZ 4.27Å; F420-H425 HydrophobicContact CD1-CB 4.48Å; F420-H425 AromaticContact CD1-CD2 3.53Å; F420-H425 AromaticContact CD1-CE1 3.3Å; F420-H425 WeakPolarHBondContact CD1-CE1 3.13Å; F420-H425 AromaticContact CD1-CG 3.54Å; F420-H425 AromaticContact CD1-ND1 3.42Å; F420-H425 WeakPolarHBondContact CD1-ND1 3.14Å; F420-H425 AromaticContact CD1-NE2 3.37Å; F420-H425 WeakPolarHBondContact CD1-NE2 3.46Å; F420-H425 HydrophobicContact CE1-CB 4.29Å; F420-H425 AromaticContact CE1-CE1 3.62Å; F420-H425 AromaticContact CE1-CG 3.63Å; F420-H425 AromaticContact CE1-ND1 3.31Å; F420-H425 VanDerWaalsContact CE1-ND1 3.31Å; F420-H425 WeakPolarHBondContact CE1-ND1 2.99Å; F420-H425 HydrophobicContact CE2-CB 4.42Å; F420-H425 AromaticContact CG-CD2 3.65Å; F420-H425 AromaticContact CG-CG 3.91Å; F420-H425 AromaticContact CG-NE2 3.83Å; F420-H425 HydrophobicContact CZ-CB 4.26Å; F420-W427 HydrophobicContact CD2-CZ3 4.45Å; F420-W427 HydrophobicContact CE2-CE3 4.4Å; F420-W427 HydrophobicContact CE2-CH2 4.36Å; F420-W427 AromaticContact CE2-CZ3 3.88Å; F420-W427 HydrophobicContact CE2-CZ3 3.88Å; F420-L494 HydrophobicContact CB-CD2 3.8Å; F420-L494 HydrophobicContact CD2-CD2 3.95Å; F420-L494 HydrophobicContact CG-CD2 4.17Å; F420-Y496 VanDerWaalsContact O-CE2 3.27Å; F420-Y496 WeakPolarHBondContact O-CE2 3.5Å; F420-L523 PolarHBondContact N-O 3.23Å; F420-L523 PolarHBondContact O-N 3.05Å; F420-P525 HydrophobicContact CE2-CG 3.87Å
421	T	97.2	Very high	95.5	Very high	79 Å²	79	32 Å²	32	49%	0.485	18%	0.176	S	C	.	.	S	Bend	trans	-119.8	-3.7	177.7	54.1	0	0	0	0	113.3	Y496 T522	T421-Y496 VanDerWaalsContact O-CD1 3.31Å; T421-Y496 WeakPolarHBondContact O-CD1 3.25Å; T421-Y496 WeakPolarHBondContact O-CE1 3.38Å; T421-T522 HydrophobicContact CG2-CG2 3.96Å; T421-T522 WeakPolarHBondContact CG2-OG1 3.37Å
422	K	96.2	Very high	94.9	Very high	164 Å²	164	40 Å²	40	71%	0.713	20%	0.204	S	C	*	.	S	Bend	trans	-164.4	165.5	-178	62.8	-177.2	-179.8	-177.6	0	111.2	H425	K422-H425 PolarHBondContact O-NE2 3.42Å
423	G	95.4	Very high	94.2	Very high	23 Å²	23	42.7 Å²	42.7	24%	0.237	22%	0.223	C	C	.	.	S	Bend	trans	82.9	-170.3	171.5	0	0	0	0	0	114.1	Y496	G423-Y496 WeakPolarHBondContact O-CB 3.42Å; G423-Y496 PolarHBondContact O-N 3.02Å
424	R	96.3	Very high	93.6	Very high	70 Å²	70	43.2 Å²	43.2	26%	0.264	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.3	175.8	-66.5	177.9	-78.2	175.5	-4	108.5	Y366 P367 Y493 L494 D495	Y366-R424 HydrophobicContact CE1-CB 4.23Å; Y366-R424 VanDerWaalsContact CE1-NH2 3.26Å; Y366-R424 PolarHBondContact OH-N 2.76Å; P367-R424 HydrophobicContact CB-CB 4.23Å; P367-R424 WeakPolarHBondContact CB-O 3.08Å; P367-R424 HydrophobicContact CG-CB 4.1Å; R424-Y493 HydrophobicContact CB-CE2 4.29Å; R424-Y493 WeakPolarHBondContact CD-OH 3.37Å; R424-Y493 WeakPolarHBondContact CG-OH 3.43Å; R424-L494 CarbonylContact C-O 3.55Å; R424-L494 WeakPolarHBondContact CA-O 3.43Å; R424-D495 HydrophobicContact CG-CB 4.25Å
425	H	96.6	Very high	93.2	Very high	33 Å²	33	45.6 Å²	45.6	15%	0.153	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	146.7	-178.1	-55.9	-78.7	0	0	0	109.3	F420 K422 W427 Y493 L494	F420-H425 HydrophobicContact CD1-CB 4.48Å; F420-H425 AromaticContact CD1-CD2 3.53Å; F420-H425 AromaticContact CD1-CE1 3.3Å; F420-H425 WeakPolarHBondContact CD1-CE1 3.13Å; F420-H425 AromaticContact CD1-CG 3.54Å; F420-H425 AromaticContact CD1-ND1 3.42Å; F420-H425 WeakPolarHBondContact CD1-ND1 3.14Å; F420-H425 AromaticContact CD1-NE2 3.37Å; F420-H425 WeakPolarHBondContact CD1-NE2 3.46Å; F420-H425 HydrophobicContact CE1-CB 4.29Å; F420-H425 AromaticContact CE1-CE1 3.62Å; F420-H425 AromaticContact CE1-CG 3.63Å; F420-H425 AromaticContact CE1-ND1 3.31Å; F420-H425 VanDerWaalsContact CE1-ND1 3.31Å; F420-H425 WeakPolarHBondContact CE1-ND1 2.99Å; F420-H425 HydrophobicContact CE2-CB 4.42Å; F420-H425 AromaticContact CG-CD2 3.65Å; F420-H425 AromaticContact CG-CG 3.91Å; F420-H425 AromaticContact CG-NE2 3.83Å; F420-H425 HydrophobicContact CZ-CB 4.26Å; K422-H425 PolarHBondContact O-NE2 3.42Å; H425-W427 HydrophobicContact CB-CE3 4.42Å; H425-W427 HydrophobicContact CB-CZ3 4.07Å; H425-Y493 CarbonylContact O-C 3.6Å; H425-Y493 WeakPolarHBondContact O-CA 3.42Å; H425-L494 HydrophobicContact CB-CB 4.42Å; H425-L494 PolarHBondContact N-O 2.96Å; H425-L494 PolarHBondContact O-N 3.28Å
426	Y	96.5	Very high	92.9	Very high	19 Å²	19	45.4 Å²	45.4	8%	0.075	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	137.9	177.1	175.6	-104.4	0	0	0	108.9	P369 S370 E428 V492	P369-Y426 CarbonylContact C-O 3.57Å; P369-Y426 VanDerWaalsContact CA-O 3.31Å; P369-Y426 WeakPolarHBondContact CA-O 3.43Å; P369-Y426 HydrophobicContact CB-CD1 4.25Å; P369-Y426 HydrophobicContact CG-CD1 3.98Å; P369-Y426 HydrophobicContact CG-CE1 4.29Å; S370-Y426 WeakPolarHBondContact CB-O 3.48Å; S370-Y426 PolarHBondContact N-O 3.49Å; S370-Y426 PolarHBondContact OG-O 2.99Å; Y426-E428 HydrophobicContact CE1-CG 3.7Å; Y426-E428 VanDerWaalsContact CE1-OE1 3.23Å; Y426-E428 WeakPolarHBondContact CE1-OE1 3.47Å; Y426-E428 VanDerWaalsContact OH-CG 3.27Å; Y426-E428 WeakPolarHBondContact OH-CG 3.41Å; Y426-E428 PolarHBondContact OH-OE1 2.74Å; Y426-V492 CarbonylContact C-O 3.52Å; Y426-V492 VanDerWaalsContact CA-O 3.25Å; Y426-V492 WeakPolarHBondContact CA-O 3.31Å; Y426-V492 WeakPolarHBondContact CD2-O 3.5Å
427	W	96.5	Very high	92.7	Very high	1 Å²	1	45.4 Å²	45.4	0%	0.004	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	163.5	171.5	62.3	91.7	0	0	0	110.4	I372 F420 H425 V441 G491 V492 L494 P525	I372-W427 HydrophobicContact CD1-CB 4.39Å; I372-W427 HydrophobicContact CD1-CD2 4.35Å; I372-W427 HydrophobicContact CD1-CE3 4.34Å; I372-W427 HydrophobicContact CD1-CG 4.38Å; I372-W427 HydrophobicContact CG1-CB 3.51Å; I372-W427 HydrophobicContact CG1-CD2 4.01Å; I372-W427 HydrophobicContact CG1-CE3 4.46Å; I372-W427 HydrophobicContact CG1-CG 3.57Å; F420-W427 HydrophobicContact CD2-CZ3 4.45Å; F420-W427 HydrophobicContact CE2-CE3 4.4Å; F420-W427 HydrophobicContact CE2-CH2 4.36Å; F420-W427 AromaticContact CE2-CZ3 3.88Å; F420-W427 HydrophobicContact CE2-CZ3 3.88Å; H425-W427 HydrophobicContact CB-CE3 4.42Å; H425-W427 HydrophobicContact CB-CZ3 4.07Å; W427-V441 HydrophobicContact CH2-CG1 3.38Å; W427-V441 HydrophobicContact CZ2-CG1 3.59Å; W427-G491 CarbonylContact O-C 3.56Å; W427-G491 WeakPolarHBondContact O-CA 3.43Å; W427-V492 HydrophobicContact CD2-CB 4.15Å; W427-V492 HydrophobicContact CH2-CB 4.39Å; W427-V492 HydrophobicContact CH2-CG1 3.82Å; W427-V492 HydrophobicContact CZ2-CB 3.75Å; W427-V492 HydrophobicContact CZ2-CG1 3.39Å; W427-V492 HydrophobicContact CZ2-CG2 4.49Å; W427-V492 PolarHBondContact N-O 3.27Å; W427-V492 PolarHBondContact O-N 3.36Å; W427-L494 HydrophobicContact CH2-CB 4.37Å; W427-L494 HydrophobicContact CZ3-CB 4.25Å; W427-P525 HydrophobicContact CD2-CG 4.49Å; W427-P525 HydrophobicContact CH2-CG 4.15Å; W427-P525 HydrophobicContact CZ2-CB 3.83Å; W427-P525 HydrophobicContact CZ2-CG 3.87Å
428	E	96.3	Very high	92.7	Very high	18 Å²	18	44.4 Å²	44.4	8%	0.084	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	146.3	-175.8	-70	178.1	-163.3	0	0	111.6	Y426 R489 I490 A506 F544	Y426-E428 HydrophobicContact CE1-CG 3.7Å; Y426-E428 VanDerWaalsContact CE1-OE1 3.23Å; Y426-E428 WeakPolarHBondContact CE1-OE1 3.47Å; Y426-E428 VanDerWaalsContact OH-CG 3.27Å; Y426-E428 WeakPolarHBondContact OH-CG 3.41Å; Y426-E428 PolarHBondContact OH-OE1 2.74Å; E428-R489 HydrophobicContact CB-CG 4.09Å; E428-R489 WeakPolarHBondContact OE2-CD 3.28Å; E428-R489 IonicContact OE2-CZ 2.84Å; E428-R489 IonicContact OE2-NE 2.67Å; E428-R489 IonicContact OE2-NH1 3.27Å; E428-R489 PolarHBondContact OE2-NH1 3.33Å; E428-I490 CarbonylContact C-O 3.53Å; E428-I490 VanDerWaalsContact CA-O 3.28Å; E428-I490 WeakPolarHBondContact CA-O 3.45Å; E428-A506 HydrophobicContact CG-CB 3.79Å; E428-F544 HydrophobicContact CB-CB 3.84Å; E428-F544 HydrophobicContact CB-CD1 4.17Å; E428-F544 HydrophobicContact CB-CG 4.46Å; E428-F544 PolarHBondContact O-N 3.4Å; E428-F544 WeakPolarHBondContact OE2-CD1 3.35Å
429	V	95.6	Very high	92.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	124.6	-179.1	-168.1	0	0	0	0	109.3	V431 V439 R489 I490 F527 L541 K542	V429-V431 HydrophobicContact CG1-CG1 4.31Å; V429-V439 HydrophobicContact CG1-CG1 4.21Å; V429-R489 CarbonylContact O-C 3.58Å; V429-R489 VanDerWaalsContact O-CA 3.28Å; V429-R489 WeakPolarHBondContact O-CA 3.27Å; V429-R489 VanDerWaalsContact O-CG 3.25Å; V429-R489 WeakPolarHBondContact O-CG 3.24Å; V429-I490 PolarHBondContact N-O 3.16Å; V429-I490 PolarHBondContact O-N 3.32Å; V429-F527 HydrophobicContact CG1-CD1 4.45Å; V429-F527 HydrophobicContact CG1-CE1 4.44Å; V429-F527 HydrophobicContact CG2-CD1 4.34Å; V429-F527 HydrophobicContact CG2-CE1 3.7Å; V429-L541 HydrophobicContact CG1-CD2 4.49Å; V429-K542 CarbonylContact C-O 3.56Å; V429-K542 WeakPolarHBondContact CA-O 3.49Å
430	E	94.9	Very high	93	Very high	64 Å²	64	38.5 Å²	38.5	30%	0.299	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	129.7	175.4	-56.6	-176.2	149	0	0	110.1	R489 K542 F544	E430-R489 HydrophobicContact CG-CG 4.47Å; E430-R489 IonicContact OE1-NH2 2.76Å; E430-K542 HydrophobicContact CB-CB 4.26Å; E430-K542 HydrophobicContact CG-CB 4.46Å; E430-K542 PolarHBondContact N-O 3.36Å; E430-K542 WeakPolarHBondContact OE2-CD 3.4Å; E430-F544 HydrophobicContact CG-CB 4.07Å; E430-F544 HydrophobicContact CG-CD2 4.45Å; E430-F544 WeakPolarHBondContact OE1-CD2 3.28Å
431	V	91.4	Very high	93	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.024	19%	0.19	C	C	.	.			trans	-137.2	-3.4	-174.3	-57.5	0	0	0	0	114.5	V429 S433 S434 W437 L487 A488 I490 L541	V429-V431 HydrophobicContact CG1-CG1 4.31Å; V431-S433 PolarHBondContact O-N 2.93Å; V431-S434 PolarHBondContact O-N 2.95Å; V431-W437 HydrophobicContact CB-CD2 4.38Å; V431-W437 HydrophobicContact CB-CG 4.49Å; V431-W437 HydrophobicContact CB-CZ2 4.25Å; V431-W437 HydrophobicContact CG1-CD2 4.13Å; V431-W437 HydrophobicContact CG1-CG 4.35Å; V431-W437 HydrophobicContact CG1-CZ2 4.42Å; V431-W437 HydrophobicContact CG2-CZ2 3.84Å; V431-L487 HydrophobicContact CG2-CB 4.4Å; V431-L487 VanDerWaalsContact CG2-O 3.32Å; V431-L487 WeakPolarHBondContact CG2-O 2.88Å; V431-A488 PolarHBondContact N-O 3.41Å; V431-I490 HydrophobicContact CG1-CG1 4.08Å; V431-I490 HydrophobicContact CG2-CD1 4.18Å; V431-I490 HydrophobicContact CG2-CG1 3.86Å; V431-L541 HydrophobicContact CG1-CD2 3.87Å
432	Y	75.3	Confident	93	Very high	183 Å²	183	34.4 Å²	34.4	72%	0.718	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.9	-20.6	-168.3	-175.5	-113.3	0	0	0	117.7	A488	Y432-A488 HydrophobicContact CD2-CB 3.47Å; Y432-A488 VanDerWaalsContact CD2-CB 3.47Å; Y432-A488 HydrophobicContact CE2-CB 4.35Å; Y432-A488 HydrophobicContact CG-CB 3.99Å; Y432-A488 PolarHBondContact N-O 2.88Å
433	S	77.9	Confident	93.1	Very high	63 Å²	63	29.2 Å²	29.2	44%	0.441	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128	14	-174.3	40	0	0	0	0	113.4	V431 E539	V431-S433 PolarHBondContact O-N 2.93Å; S433-E539 WeakPolarHBondContact OG-CB 3.46Å; S433-E539 WeakPolarHBondContact OG-CG 3.47Å
434	S	84.9	Confident	93.2	Very high	11 Å²	11	32.4 Å²	32.4	8%	0.077	15%	0.152	C	C	.	.			trans	-103.1	128.4	174	-72	0	0	0	0	110.6	V431 L465 E539	V431-S434 PolarHBondContact O-N 2.95Å; S434-L465 WeakPolarHBondContact O-CD2 3.31Å; S434-E539 PolarHBondContact OG-O 2.79Å
435	T	87.8	Confident	93.2	Very high	50 Å²	50	33 Å²	33	31%	0.307	17%	0.167	S	C	.	.	S	Bend	trans	-86	-14.5	176	60.2	0	0	0	0	113	Y467 G468 N538	T435-Y467 CarbonylContact O-C 3.54Å; T435-Y467 PolarHBondContact O-N 3.5Å; T435-Y467 VanDerWaalsContact O-N 3.17Å; T435-G468 PolarHBondContact O-N 2.64Å; T435-N538 PolarHBondContact N-OD1 3.03Å; T435-N538 PolarHBondContact OG1-OD1 3.08Å; T435-N538 VanDerWaalsContact OG1-OD1 3.09Å
436	V	90.6	Very high	93.2	Very high	1 Å²	1	32 Å²	32	1%	0.006	16%	0.163	C	C	.	.	S	Bend	trans	-140.4	131.7	176.1	-70.2	0	0	0	0	110	L465 F531 K534 N538	V436-L465 VanDerWaalsContact CA-O 3.3Å; V436-L465 WeakPolarHBondContact CA-O 3.31Å; V436-F531 HydrophobicContact CG1-CD2 4.43Å; V436-K534 HydrophobicContact CG1-CB 4.33Å; V436-K534 HydrophobicContact CG2-CB 3.85Å; V436-N538 WeakPolarHBondContact CG2-ND2 3.43Å; V436-N538 PolarHBondContact O-ND2 3.4Å
437	W	93.7	Very high	93.1	Very high	1 Å²	1	35.7 Å²	35.7	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	162	174.1	48.7	-96.9	0	0	0	111	V431 V439 L463 S464 L465 Y471 I490 N528 L541	V431-W437 HydrophobicContact CB-CD2 4.38Å; V431-W437 HydrophobicContact CB-CG 4.49Å; V431-W437 HydrophobicContact CB-CZ2 4.25Å; V431-W437 HydrophobicContact CG1-CD2 4.13Å; V431-W437 HydrophobicContact CG1-CG 4.35Å; V431-W437 HydrophobicContact CG1-CZ2 4.42Å; V431-W437 HydrophobicContact CG2-CZ2 3.84Å; W437-V439 HydrophobicContact CE3-CG1 4.21Å; W437-V439 HydrophobicContact CE3-CG2 3.99Å; W437-V439 HydrophobicContact CZ3-CG2 3.76Å; W437-L463 HydrophobicContact CH2-CD2 4.06Å; W437-L463 HydrophobicContact CH2-CG 4.28Å; W437-L463 HydrophobicContact CZ3-CB 4.45Å; W437-L463 HydrophobicContact CZ3-CD2 4.26Å; W437-L463 HydrophobicContact CZ3-CG 4.15Å; W437-L463 WeakPolarHBondContact CZ3-O 3.32Å; W437-S464 CarbonylContact O-C 3.55Å; W437-S464 WeakPolarHBondContact O-CA 3.49Å; W437-S464 VanDerWaalsContact O-CB 3.29Å; W437-S464 WeakPolarHBondContact O-CB 3.42Å; W437-L465 HydrophobicContact CD2-CB 3.82Å; W437-L465 HydrophobicContact CE3-CB 4.46Å; W437-L465 HydrophobicContact CG-CB 4.18Å; W437-L465 HydrophobicContact CH2-CB 4.32Å; W437-L465 HydrophobicContact CZ2-CB 3.68Å; W437-L465 HydrophobicContact CZ2-CD2 4.38Å; W437-L465 PolarHBondContact N-O 3.37Å; W437-L465 VanDerWaalsContact N-O 3.1Å; W437-L465 PolarHBondContact O-N 3.41Å; W437-Y471 HydrophobicContact CH2-CD1 4.24Å; W437-Y471 HydrophobicContact CH2-CE1 4.23Å; W437-Y471 HydrophobicContact CZ2-CD1 4.21Å; W437-Y471 AromaticContact CZ2-CE1 3.79Å; W437-Y471 HydrophobicContact CZ2-CE1 3.79Å; W437-I490 HydrophobicContact CH2-CD1 3.61Å; W437-I490 HydrophobicContact CH2-CG1 3.7Å; W437-I490 HydrophobicContact CZ2-CD1 4.04Å; W437-I490 HydrophobicContact CZ2-CG1 4.15Å; W437-I490 HydrophobicContact CZ3-CD1 4.47Å; W437-I490 HydrophobicContact CZ3-CG1 4.15Å; W437-N528 CarbonylContact C-O 3.55Å; W437-N528 WeakPolarHBondContact CA-O 3.37Å; W437-L541 HydrophobicContact CB-CD2 4.3Å
438	T	95.7	Very high	93	Very high	18 Å²	18	36.1 Å²	36.1	11%	0.11	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	127	168	-57.3	0	0	0	0	109	T462 L463 S464 Y526 F527 N528	T438-T462 HydrophobicContact CG2-CG2 3.96Å; T438-L463 CarbonylContact C-O 3.12Å; T438-L463 WeakPolarHBondContact CA-O 3.29Å; T438-S464 WeakPolarHBondContact OG1-CB 3.37Å; T438-Y526 HydrophobicContact CG2-CE1 4.17Å; T438-F527 CarbonylContact O-C 3.47Å; T438-F527 WeakPolarHBondContact O-CA 3.32Å; T438-N528 PolarHBondContact N-O 3.37Å; T438-N528 PolarHBondContact O-N 3.49Å
439	V	97.6	Very high	92.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	151.2	-178.7	-59.3	0	0	0	0	110.2	V429 W437 T462 L463 I490 F503 Y526 F527	V429-V439 HydrophobicContact CG1-CG1 4.21Å; W437-V439 HydrophobicContact CE3-CG1 4.21Å; W437-V439 HydrophobicContact CE3-CG2 3.99Å; W437-V439 HydrophobicContact CZ3-CG2 3.76Å; V439-T462 CarbonylContact O-C 3.44Å; V439-T462 VanDerWaalsContact O-CA 3.28Å; V439-T462 WeakPolarHBondContact O-CA 3.33Å; V439-T462 WeakPolarHBondContact O-CB 3.33Å; V439-L463 PolarHBondContact N-O 3.08Å; V439-L463 PolarHBondContact O-N 3.5Å; V439-I490 HydrophobicContact CG2-CB 4.22Å; V439-I490 HydrophobicContact CG2-CG1 4.29Å; V439-I490 HydrophobicContact CG2-CG2 3.96Å; V439-F503 WeakPolarHBondContact O-CE1 3.41Å; V439-Y526 WeakPolarHBondContact CA-O 3.37Å; V439-F527 HydrophobicContact CG1-CD1 4.35Å
440	G	98.1	Very high	92.5	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.1	-137.7	175.6	0	0	0	0	0	112	W461 P525 Y526	G440-W461 WeakPolarHBondContact CA-O 3.1Å; G440-P525 WeakPolarHBondContact O-CA 3.32Å; G440-Y526 PolarHBondContact N-O 2.89Å; G440-Y526 PolarHBondContact O-N 3.17Å
441	V	98.4	Very high	92.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	149.9	175.1	-63.2	0	0	0	0	111.6	W427 W461 V492 V501 L523 F524	W427-V441 HydrophobicContact CH2-CG1 3.38Å; W427-V441 HydrophobicContact CZ2-CG1 3.59Å; V441-W461 HydrophobicContact CG2-CB 3.97Å; V441-W461 HydrophobicContact CG2-CD2 4.43Å; V441-W461 HydrophobicContact CG2-CE3 3.87Å; V441-W461 PolarHBondContact N-O 2.98Å; V441-W461 PolarHBondContact O-N 3.49Å; V441-V492 HydrophobicContact CG1-CG1 4.47Å; V441-V501 HydrophobicContact CG2-CB 4.31Å; V441-V501 HydrophobicContact CG2-CG1 3.88Å; V441-V501 HydrophobicContact CG2-CG2 3.45Å; V441-V501 VanDerWaalsContact CG2-CG2 3.45Å; V441-L523 HydrophobicContact CG2-CD1 4.5Å; V441-F524 CarbonylContact C-O 2.96Å; V441-F524 VanDerWaalsContact CA-O 3.27Å; V441-F524 WeakPolarHBondContact CA-O 3.36Å
442	A	98.2	Very high	92.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	149.1	174.6	0	0	0	0	0	110.7	V446 G459 F460 L523 F524 Y526	A442-V446 HydrophobicContact CB-CG1 4.45Å; A442-V446 HydrophobicContact CB-CG2 4.2Å; A442-G459 CarbonylContact C-O 3.59Å; A442-G459 VanDerWaalsContact CA-O 3.31Å; A442-G459 WeakPolarHBondContact CA-O 3.4Å; A442-F460 HydrophobicContact CB-CD1 3.62Å; A442-F460 HydrophobicContact CB-CE1 3.74Å; A442-F460 HydrophobicContact CB-CG 4.48Å; A442-L523 WeakPolarHBondContact O-CA 3.29Å; A442-F524 PolarHBondContact N-O 3.34Å; A442-F524 PolarHBondContact O-N 3.28Å; A442-Y526 HydrophobicContact CB-CD2 4.1Å; A442-Y526 HydrophobicContact CB-CG 4.12Å
443	R	97.9	Very high	92.8	Very high	54 Å²	54	40.2 Å²	40.2	20%	0.204	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	148.6	165.7	-88.9	-172.2	-172.5	169.3	10.2	111	S445 V446 R448 G459 W461 E521 L523	R443-S445 PolarHBondContact O-N 3.02Å; R443-V446 HydrophobicContact CB-CG1 3.49Å; R443-V446 VanDerWaalsContact CB-CG1 3.49Å; R443-V446 WeakPolarHBondContact O-CG2 3.39Å; R443-R448 PolarHBondContact O-NH2 3.09Å; R443-G459 PolarHBondContact N-O 3.35Å; R443-W461 HydrophobicContact CG-CH2 3.83Å; R443-W461 HydrophobicContact CG-CZ3 3.86Å; R443-E521 VanDerWaalsContact C-OE1 3.25Å; R443-E521 WeakPolarHBondContact CA-OE1 3.32Å; R443-E521 HydrophobicContact CB-CG 4.23Å; R443-E521 WeakPolarHBondContact CB-OE1 3.31Å; R443-E521 VanDerWaalsContact CD-CD 3.46Å; R443-E521 HydrophobicContact CG-CG 3.61Å; R443-E521 VanDerWaalsContact CG-OE1 3.25Å; R443-E521 WeakPolarHBondContact CG-OE1 3.43Å; R443-L523 HydrophobicContact CB-CD2 4.49Å; R443-L523 HydrophobicContact CG-CD2 3.75Å
444	E	96.7	Very high	93.5	Very high	91 Å²	91	39 Å²	39	43%	0.425	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-37	171.9	-173	166.4	-165.5	0	0	111	V446 R448 E521 T522 F524	E444-V446 VanDerWaalsContact C-N 3.35Å; E444-V446 PolarHBondContact O-N 3.01Å; E444-R448 PolarHBondContact O-NH2 3.39Å; E444-E521 PolarHBondContact N-OE1 3.15Å; E444-T522 PolarHBondContact N-O 3.21Å; E444-T522 WeakPolarHBondContact OE2-CB 3.49Å; E444-T522 PolarHBondContact OE2-OG1 3.4Å; E444-T522 VanDerWaalsContact OE2-OG1 3.11Å; E444-F524 HydrophobicContact CB-CD2 4.14Å; E444-F524 HydrophobicContact CB-CE2 3.77Å; E444-F524 HydrophobicContact CG-CE2 3.78Å
445	S	96.1	Very high	94	Very high	83 Å²	83	40.6 Å²	40.6	58%	0.58	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-3.4	-174	63.9	0	0	0	0	115.4	R443 E521	R443-S445 PolarHBondContact O-N 3.02Å; S445-E521 WeakPolarHBondContact CB-OE2 3.44Å; S445-E521 PolarHBondContact N-OE1 2.85Å; S445-E521 VanDerWaalsContact OG-CD 3.27Å; S445-E521 PolarHBondContact OG-OE1 3.45Å; S445-E521 VanDerWaalsContact OG-OE1 3.11Å; S445-E521 PolarHBondContact OG-OE2 2.96Å
446	V	96.3	Very high	94.4	Very high	10 Å²	10	39.7 Å²	39.7	6%	0.061	23%	0.227	C	C	.	.	S	Bend	trans	-64.8	149.1	-172.8	-52.3	0	0	0	0	112.9	A442 R443 E444 R448 N458 G459 F460	A442-V446 HydrophobicContact CB-CG1 4.45Å; A442-V446 HydrophobicContact CB-CG2 4.2Å; R443-V446 HydrophobicContact CB-CG1 3.49Å; R443-V446 VanDerWaalsContact CB-CG1 3.49Å; R443-V446 WeakPolarHBondContact O-CG2 3.39Å; E444-V446 VanDerWaalsContact C-N 3.35Å; E444-V446 PolarHBondContact O-N 3.01Å; V446-R448 WeakPolarHBondContact O-CD 3.4Å; V446-R448 PolarHBondContact O-N 2.91Å; V446-R448 PolarHBondContact O-NE 3.39Å; V446-N458 WeakPolarHBondContact CG1-O 3.44Å; V446-G459 WeakPolarHBondContact CG1-O 3.37Å; V446-F460 HydrophobicContact CB-CD2 4.48Å; V446-F460 HydrophobicContact CB-CE1 4.33Å; V446-F460 HydrophobicContact CB-CE2 3.62Å; V446-F460 HydrophobicContact CB-CZ 3.55Å; V446-F460 HydrophobicContact CG1-CD2 4.17Å; V446-F460 HydrophobicContact CG1-CE1 4.47Å; V446-F460 HydrophobicContact CG1-CE2 3.8Å; V446-F460 HydrophobicContact CG1-CZ 3.98Å; V446-F460 HydrophobicContact CG2-CE1 3.77Å; V446-F460 HydrophobicContact CG2-CE2 3.95Å; V446-F460 HydrophobicContact CG2-CZ 3.31Å
447	T	94.6	Very high	94.7	Very high	97 Å²	97	43.9 Å²	43.9	60%	0.595	26%	0.262	S	S	*	.			trans	-58.7	128.1	177.7	-54.4	0	0	0	0	111.4	K449	T447-K449 WeakPolarHBondContact CG2-O 3.37Å
448	R	94.8	Very high	94.8	Very high	11 Å²	11	47.6 Å²	47.6	4%	0.042	28%	0.282	C	S	.	.			trans	-100.4	-13.1	179	-50.3	-60	174.4	-163.6	-10.9	113.5	F408 N409 M415 R443 E444 V446	F408-R448 WeakPolarHBondContact CA-O 3.19Å; F408-R448 HydrophobicContact CD1-CB 4.08Å; F408-R448 HydrophobicContact CE1-CB 4.41Å; F408-R448 VanDerWaalsContact CE1-CD 3.44Å; N409-R448 PolarHBondContact N-O 2.92Å; M415-R448 PolarHBondContact SD-NH1 3.47Å; M415-R448 PolarHBondContact SD-NH2 2.63Å; R443-R448 PolarHBondContact O-NH2 3.09Å; E444-R448 PolarHBondContact O-NH2 3.39Å; V446-R448 WeakPolarHBondContact O-CD 3.4Å; V446-R448 PolarHBondContact O-N 2.91Å; V446-R448 PolarHBondContact O-NE 3.39Å
449	K	92.4	Very high	94.8	Very high	63 Å²	63	46.8 Å²	46.8	27%	0.274	28%	0.277	S	S	.	.	S	Bend	trans	-115.1	141.9	-170	-51.4	-62.3	-178.1	179.5	0	111.3	D403 N404 R407 N409 T447	D403-K449 IonicContact OD1-NZ 2.74Å; D403-K449 PolarHBondContact OD1-NZ 2.78Å; D403-K449 IonicContact OD2-NZ 3.2Å; D403-K449 PolarHBondContact OD2-NZ 2.91Å; N404-K449 PolarHBondContact O-NZ 3.28Å; R407-K449 VanDerWaalsContact O-CE 3.29Å; R407-K449 WeakPolarHBondContact O-CE 3.38Å; R407-K449 PolarHBondContact O-NZ 2.99Å; N409-K449 HydrophobicContact CB-CD 4.08Å; N409-K449 VanDerWaalsContact OD1-CA 3.27Å; N409-K449 WeakPolarHBondContact OD1-CA 3.36Å; T447-K449 WeakPolarHBondContact CG2-O 3.37Å
450	G	89	Confident	94.9	Very high	35 Å²	35	47 Å²	47	36%	0.361	28%	0.278	S	S	.	.	S	Bend	trans	76.6	-156.7	179	0	0	0	0	0	113.4	N409 A410 I452	N409-G450 PolarHBondContact OD1-N 2.69Å; N409-G450 VanDerWaalsContact OD1-N 3.1Å; A410-G450 WeakPolarHBondContact CB-O 3.32Å; G450-I452 PolarHBondContact O-N 2.93Å
451	V	87.2	Confident	94.9	Very high	132 Å²	132	47 Å²	47	80%	0.8	28%	0.278	S	S	*	.			trans	-71.7	126.8	-177.8	-178.1	0	0	0	0	110
452	I	90.2	Very high	94.9	Very high	29 Å²	29	47 Å²	47	15%	0.149	28%	0.278	C	S	.	.			trans	-110.1	114.3	-176.7	-57.5	-174.5	0	0	0	109.4	F408 A411 G450 T454 F460	F408-I452 HydrophobicContact CD1-CD1 3.37Å; F408-I452 HydrophobicContact CE1-CD1 3.53Å; A411-I452 HydrophobicContact CB-CB 4.48Å; A411-I452 HydrophobicContact CB-CD1 3.83Å; A411-I452 HydrophobicContact CB-CG1 4.28Å; G450-I452 PolarHBondContact O-N 2.93Å; I452-T454 HydrophobicContact CG2-CG2 4.22Å; I452-F460 HydrophobicContact CG2-CE1 4.21Å; I452-F460 HydrophobicContact CG2-CE2 3.88Å; I452-F460 HydrophobicContact CG2-CZ 3.53Å
453	N	90.4	Very high	94.9	Very high	96 Å²	96	47 Å²	47	51%	0.513	28%	0.278	S	S	.	.			trans	-96	106.8	174.3	-70.3	-10.6	0	0	0	109.3	M455 N458	N453-M455 PolarHBondContact O-N 3.24Å; N453-N458 WeakPolarHBondContact CB-ND2 3.48Å; N453-N458 WeakPolarHBondContact O-CB 3.36Å; N453-N458 PolarHBondContact O-ND2 3.07Å
454	T	92.9	Very high	94.7	Very high	36 Å²	36	45.1 Å²	45.1	22%	0.221	27%	0.273	C	S	.	.			trans	-80.5	82.8	-176.4	54	0	0	0	0	111.4	I452 F460 Y526	I452-T454 HydrophobicContact CG2-CG2 4.22Å; T454-F460 HydrophobicContact CG2-CD1 4.08Å; T454-F460 HydrophobicContact CG2-CE1 4.42Å; T454-F460 HydrophobicContact CG2-CG 4.23Å; T454-Y526 HydrophobicContact CG2-CE1 3.92Å
455	M	95.2	Very high	94.6	Very high	46 Å²	46	41.1 Å²	41.1	23%	0.227	26%	0.255	C	S	.	.	S	Bend	trans	-140.5	160.5	173.7	58.4	173.1	49.1	0	0	113.1	N453 A457 N458 G459 F460 G474	N453-M455 PolarHBondContact O-N 3.24Å; M455-A457 VanDerWaalsContact C-N 3.27Å; M455-A457 PolarHBondContact O-N 3.17Å; M455-A457 HydrophobicContact SD-CB 4.45Å; M455-N458 HydrophobicContact CG-CB 4.41Å; M455-N458 CarbonylContact O-C 3.54Å; M455-N458 WeakPolarHBondContact O-CA 3.36Å; M455-N458 PolarHBondContact O-N 3.05Å; M455-G459 PolarHBondContact O-N 3.4Å; M455-F460 CarbonylContact C-O 3.55Å; M455-F460 PolarHBondContact O-N 3.25Å; M455-F460 VanDerWaalsContact O-N 3.14Å; M455-G474 WeakPolarHBondContact CA-O 3.24Å; M455-G474 VanDerWaalsContact CB-O 3.28Å; M455-G474 WeakPolarHBondContact CB-O 3.41Å
456	P	96.9	Very high	94.3	Very high	30 Å²	30	38.1 Å²	38.1	20%	0.195	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-54.8	-39.1	-175.4	-32.7	35.6	0	0	0	114.1	N458 G459 F460 G474 F515	P456-N458 PolarHBondContact O-N 2.91Å; P456-N458 VanDerWaalsContact O-N 3.12Å; P456-G459 PolarHBondContact O-N 3.4Å; P456-F460 VanDerWaalsContact CA-O 3.25Å; P456-F460 WeakPolarHBondContact CA-O 3.29Å; P456-F460 WeakPolarHBondContact CD-O 3.29Å; P456-G474 WeakPolarHBondContact CD-O 3.48Å; P456-F515 HydrophobicContact CG-CD1 3.91Å; P456-F515 HydrophobicContact CG-CE1 3.93Å
457	A	95.5	Very high	93.8	Very high	90 Å²	90	43.6 Å²	43.6	74%	0.744	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-58	-27.5	177.2	0	0	0	0	0	113.3	M455	M455-A457 VanDerWaalsContact C-N 3.27Å; M455-A457 PolarHBondContact O-N 3.17Å; M455-A457 HydrophobicContact SD-CB 4.45Å
458	N	96.2	Very high	93.2	Very high	78 Å²	78	40.6 Å²	40.6	42%	0.417	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-100.6	9.7	177	-61.8	-24.4	0	0	0	112.8	V446 N453 M455 P456 F460	V446-N458 WeakPolarHBondContact CG1-O 3.44Å; N453-N458 WeakPolarHBondContact CB-ND2 3.48Å; N453-N458 WeakPolarHBondContact O-CB 3.36Å; N453-N458 PolarHBondContact O-ND2 3.07Å; M455-N458 HydrophobicContact CG-CB 4.41Å; M455-N458 CarbonylContact O-C 3.54Å; M455-N458 WeakPolarHBondContact O-CA 3.36Å; M455-N458 PolarHBondContact O-N 3.05Å; P456-N458 PolarHBondContact O-N 2.91Å; P456-N458 VanDerWaalsContact O-N 3.12Å; N458-F460 HydrophobicContact CB-CD2 4.01Å; N458-F460 HydrophobicContact CB-CE2 4.3Å; N458-F460 VanDerWaalsContact O-CD2 3.29Å; N458-F460 WeakPolarHBondContact O-CD2 3.26Å; N458-F460 WeakPolarHBondContact O-CE2 2.98Å
459	G	97.1	Very high	92.7	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.01	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	24.5	178.1	0	0	0	0	0	115.2	A442 R443 V446 M455 P456 W461	A442-G459 CarbonylContact C-O 3.59Å; A442-G459 VanDerWaalsContact CA-O 3.31Å; A442-G459 WeakPolarHBondContact CA-O 3.4Å; R443-G459 PolarHBondContact N-O 3.35Å; V446-G459 WeakPolarHBondContact CG1-O 3.37Å; M455-G459 PolarHBondContact O-N 3.4Å; P456-G459 PolarHBondContact O-N 3.4Å; G459-W461 WeakPolarHBondContact O-CZ3 3.45Å
460	F	98.1	Very high	92.7	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.018	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	134.1	177.4	-62.3	-93.5	0	0	0	111.6	A442 V446 I452 T454 M455 P456 N458 T462 Y526	A442-F460 HydrophobicContact CB-CD1 3.62Å; A442-F460 HydrophobicContact CB-CE1 3.74Å; A442-F460 HydrophobicContact CB-CG 4.48Å; V446-F460 HydrophobicContact CB-CD2 4.48Å; V446-F460 HydrophobicContact CB-CE1 4.33Å; V446-F460 HydrophobicContact CB-CE2 3.62Å; V446-F460 HydrophobicContact CB-CZ 3.55Å; V446-F460 HydrophobicContact CG1-CD2 4.17Å; V446-F460 HydrophobicContact CG1-CE1 4.47Å; V446-F460 HydrophobicContact CG1-CE2 3.8Å; V446-F460 HydrophobicContact CG1-CZ 3.98Å; V446-F460 HydrophobicContact CG2-CE1 3.77Å; V446-F460 HydrophobicContact CG2-CE2 3.95Å; V446-F460 HydrophobicContact CG2-CZ 3.31Å; I452-F460 HydrophobicContact CG2-CE1 4.21Å; I452-F460 HydrophobicContact CG2-CE2 3.88Å; I452-F460 HydrophobicContact CG2-CZ 3.53Å; T454-F460 HydrophobicContact CG2-CD1 4.08Å; T454-F460 HydrophobicContact CG2-CE1 4.42Å; T454-F460 HydrophobicContact CG2-CG 4.23Å; M455-F460 CarbonylContact C-O 3.55Å; M455-F460 PolarHBondContact O-N 3.25Å; M455-F460 VanDerWaalsContact O-N 3.14Å; P456-F460 VanDerWaalsContact CA-O 3.25Å; P456-F460 WeakPolarHBondContact CA-O 3.29Å; P456-F460 WeakPolarHBondContact CD-O 3.29Å; N458-F460 HydrophobicContact CB-CD2 4.01Å; N458-F460 HydrophobicContact CB-CE2 4.3Å; N458-F460 VanDerWaalsContact O-CD2 3.29Å; N458-F460 WeakPolarHBondContact O-CD2 3.26Å; N458-F460 WeakPolarHBondContact O-CE2 2.98Å; F460-T462 HydrophobicContact CB-CG2 4.24Å; F460-Y526 HydrophobicContact CD1-CD1 4.32Å; F460-Y526 HydrophobicContact CD1-CD2 4.3Å; F460-Y526 HydrophobicContact CD1-CE1 4.3Å; F460-Y526 HydrophobicContact CD1-CE2 4.3Å; F460-Y526 HydrophobicContact CD1-CG 4.29Å; F460-Y526 AromaticContact CE1-CD2 3.93Å; F460-Y526 HydrophobicContact CE1-CD2 3.93Å; F460-Y526 HydrophobicContact CE1-CE1 4.41Å; F460-Y526 AromaticContact CE1-CE2 3.69Å; F460-Y526 HydrophobicContact CE1-CE2 3.69Å; F460-Y526 HydrophobicContact CE1-CG 4.38Å; F460-Y526 AromaticContact CE1-CZ 3.93Å
461	W	98.5	Very high	93	Very high	1 Å²	1	46.5 Å²	46.5	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	97.7	171.5	-56.8	-94.4	0	0	0	107.3	G440 V441 R443 G459 V501 F515 D517 F519 L523	G440-W461 WeakPolarHBondContact CA-O 3.1Å; V441-W461 HydrophobicContact CG2-CB 3.97Å; V441-W461 HydrophobicContact CG2-CD2 4.43Å; V441-W461 HydrophobicContact CG2-CE3 3.87Å; V441-W461 PolarHBondContact N-O 2.98Å; V441-W461 PolarHBondContact O-N 3.49Å; R443-W461 HydrophobicContact CG-CH2 3.83Å; R443-W461 HydrophobicContact CG-CZ3 3.86Å; G459-W461 WeakPolarHBondContact O-CZ3 3.45Å; W461-V501 HydrophobicContact CB-CB 4.13Å; W461-V501 HydrophobicContact CB-CG1 4.24Å; W461-V501 HydrophobicContact CB-CG2 4.02Å; W461-V501 HydrophobicContact CG-CG2 4.25Å; W461-F515 HydrophobicContact CB-CB 4.39Å; W461-F515 HydrophobicContact CB-CD2 3.93Å; W461-F515 HydrophobicContact CB-CE2 4.3Å; W461-F515 HydrophobicContact CB-CG 4.03Å; W461-F515 AromaticContact CD1-CD1 3.76Å; W461-F515 AromaticContact CD1-CG 3.68Å; W461-F515 HydrophobicContact CG-CB 4.29Å; W461-F515 HydrophobicContact CG-CG 4.25Å; W461-D517 HydrophobicContact CZ2-CB 4.03Å; W461-D517 VanDerWaalsContact CZ2-OD2 3.23Å; W461-D517 WeakPolarHBondContact CZ2-OD2 3.45Å; W461-D517 PolarHBondContact NE1-OD2 3.05Å; W461-F519 HydrophobicContact CD2-CE1 4.32Å; W461-F519 AromaticContact CE2-CE1 3.83Å; W461-F519 AromaticContact CH2-CD1 3.96Å; W461-F519 HydrophobicContact CH2-CD1 3.96Å; W461-F519 HydrophobicContact CH2-CE1 4.04Å; W461-F519 AromaticContact CZ2-CD1 3.91Å; W461-F519 HydrophobicContact CZ2-CD1 3.91Å; W461-F519 AromaticContact CZ2-CE1 3.69Å; W461-F519 HydrophobicContact CZ2-CE1 3.69Å; W461-L523 HydrophobicContact CE3-CD2 4.49Å; W461-L523 HydrophobicContact CH2-CD2 4.03Å; W461-L523 HydrophobicContact CZ3-CD1 4.5Å; W461-L523 HydrophobicContact CZ3-CD2 3.56Å
462	T	98.3	Very high	93.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	151.2	-165.3	56	0	0	0	0	112.4	T438 V439 F460 G474 Y526	T438-T462 HydrophobicContact CG2-CG2 3.96Å; V439-T462 CarbonylContact O-C 3.44Å; V439-T462 VanDerWaalsContact O-CA 3.28Å; V439-T462 WeakPolarHBondContact O-CA 3.33Å; V439-T462 WeakPolarHBondContact O-CB 3.33Å; F460-T462 HydrophobicContact CB-CG2 4.24Å; T462-G474 PolarHBondContact O-N 3.24Å; T462-Y526 HydrophobicContact CG2-CD1 3.66Å; T462-Y526 HydrophobicContact CG2-CE1 4.14Å
463	L	97.8	Very high	93.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	137.3	167.3	-175.1	74.4	0	0	0	108.1	W437 T438 V439 M472 L481 I490 F503 L512	W437-L463 HydrophobicContact CH2-CD2 4.06Å; W437-L463 HydrophobicContact CH2-CG 4.28Å; W437-L463 HydrophobicContact CZ3-CB 4.45Å; W437-L463 HydrophobicContact CZ3-CD2 4.26Å; W437-L463 HydrophobicContact CZ3-CG 4.15Å; W437-L463 WeakPolarHBondContact CZ3-O 3.32Å; T438-L463 CarbonylContact C-O 3.12Å; T438-L463 WeakPolarHBondContact CA-O 3.29Å; V439-L463 PolarHBondContact N-O 3.08Å; V439-L463 PolarHBondContact O-N 3.5Å; L463-M472 CarbonylContact C-O 3.51Å; L463-M472 WeakPolarHBondContact CA-O 3.49Å; L463-L481 HydrophobicContact CD1-CD1 3.2Å; L463-I490 HydrophobicContact CD2-CD1 4.15Å; L463-I490 HydrophobicContact CD2-CG2 4.12Å; L463-F503 HydrophobicContact CB-CD1 3.54Å; L463-F503 HydrophobicContact CB-CD2 4.39Å; L463-F503 HydrophobicContact CB-CE1 3.63Å; L463-F503 HydrophobicContact CB-CE2 4.49Å; L463-F503 HydrophobicContact CB-CG 3.94Å; L463-F503 HydrophobicContact CB-CZ 4.13Å; L463-F503 HydrophobicContact CD2-CB 4.1Å; L463-F503 HydrophobicContact CD2-CD1 4.05Å; L463-F503 HydrophobicContact CD2-CG 4.23Å; L463-F503 HydrophobicContact CG-CD1 4.41Å; L463-L512 HydrophobicContact CD2-CD1 3.9Å
464	S	95.4	Very high	94	Very high	14 Å²	14	36.2 Å²	36.2	10%	0.098	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	151.3	-178.8	59	0	0	0	0	112.3	W437 T438 Y471 M472	W437-S464 CarbonylContact O-C 3.55Å; W437-S464 WeakPolarHBondContact O-CA 3.49Å; W437-S464 VanDerWaalsContact O-CB 3.29Å; W437-S464 WeakPolarHBondContact O-CB 3.42Å; T438-S464 WeakPolarHBondContact OG1-CB 3.37Å; S464-Y471 CarbonylContact O-C 3.6Å; S464-Y471 WeakPolarHBondContact O-CA 3.39Å; S464-M472 PolarHBondContact N-O 3.01Å; S464-M472 PolarHBondContact O-N 3.46Å; S464-M472 PolarHBondContact OG-O 3.45Å
465	L	93.8	Very high	94.2	Very high	8 Å²	8	35.6 Å²	35.6	4%	0.042	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	133.8	163.3	178.8	60	0	0	0	108.9	S434 V436 W437 Q470 Y471	S434-L465 WeakPolarHBondContact O-CD2 3.31Å; V436-L465 VanDerWaalsContact CA-O 3.3Å; V436-L465 WeakPolarHBondContact CA-O 3.31Å; W437-L465 HydrophobicContact CD2-CB 3.82Å; W437-L465 HydrophobicContact CE3-CB 4.46Å; W437-L465 HydrophobicContact CG-CB 4.18Å; W437-L465 HydrophobicContact CH2-CB 4.32Å; W437-L465 HydrophobicContact CZ2-CB 3.68Å; W437-L465 HydrophobicContact CZ2-CD2 4.38Å; W437-L465 PolarHBondContact N-O 3.37Å; W437-L465 VanDerWaalsContact N-O 3.1Å; W437-L465 PolarHBondContact O-N 3.41Å; L465-Q470 CarbonylContact C-O 3.55Å; L465-Q470 WeakPolarHBondContact CA-O 3.47Å; L465-Y471 HydrophobicContact CB-CD1 4.33Å; L465-Y471 HydrophobicContact CB-CE1 4.24Å; L465-Y471 HydrophobicContact CD1-CD1 3.98Å; L465-Y471 HydrophobicContact CD1-CD2 3.92Å; L465-Y471 HydrophobicContact CD1-CE1 3.8Å; L465-Y471 HydrophobicContact CD1-CE2 3.72Å; L465-Y471 HydrophobicContact CD1-CG 4.04Å; L465-Y471 HydrophobicContact CD2-CE1 4.21Å; L465-Y471 HydrophobicContact CG-CE1 4.31Å
466	S	89.9	Confident	94.1	Very high	19 Å²	19	37.8 Å²	37.8	13%	0.133	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.5	174.6	-67	0	0	0	0	110.8	G468 V469 Q470 M472	S466-G468 PolarHBondContact O-N 3.31Å; S466-V469 PolarHBondContact O-N 3.4Å; S466-V469 VanDerWaalsContact O-N 3.17Å; S466-Q470 PolarHBondContact N-O 3.13Å; S466-Q470 PolarHBondContact O-N 3.07Å; S466-M472 WeakPolarHBondContact OG-CE 3.38Å
467	Y	85.3	Confident	94	Very high	126 Å²	126	41.6 Å²	41.6	49%	0.494	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	30.4	175.6	-59.6	-77.9	0	0	0	114.9	T435 V469 K534	T435-Y467 CarbonylContact O-C 3.54Å; T435-Y467 PolarHBondContact O-N 3.5Å; T435-Y467 VanDerWaalsContact O-N 3.17Å; Y467-V469 PolarHBondContact O-N 3.3Å; Y467-K534 HydrophobicContact CD1-CG 4.36Å; Y467-K534 HydrophobicContact CE1-CG 4.26Å
468	G	83.3	Confident	94	Very high	34 Å²	34	41.1 Å²	41.1	35%	0.351	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	-2.3	177.4	0	0	0	0	0	115.3	T435 S466	T435-G468 PolarHBondContact O-N 2.64Å; S466-G468 PolarHBondContact O-N 3.31Å
469	V	84	Confident	94	Very high	112 Å²	112	39.9 Å²	39.9	68%	0.679	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127.7	-26.9	-169.2	-67.1	0	0	0	0	114.5	S466 Y467	S466-V469 PolarHBondContact O-N 3.4Å; S466-V469 VanDerWaalsContact O-N 3.17Å; Y467-V469 PolarHBondContact O-N 3.3Å
470	Q	91	Very high	94	Very high	100 Å²	100	45.4 Å²	45.4	47%	0.467	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	105.9	-172.9	-78.3	174.1	-7.3	0	0	111.5	L465 S466	L465-Q470 CarbonylContact C-O 3.55Å; L465-Q470 WeakPolarHBondContact CA-O 3.47Å; S466-Q470 PolarHBondContact N-O 3.13Å; S466-Q470 PolarHBondContact O-N 3.07Å
471	Y	95.4	Very high	93.9	Very high	20 Å²	20	46.8 Å²	46.8	8%	0.078	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	131.7	169.2	-65.6	-91	0	0	0	109.9	W437 S464 L465 L481 L483 P486 L487	W437-Y471 HydrophobicContact CH2-CD1 4.24Å; W437-Y471 HydrophobicContact CH2-CE1 4.23Å; W437-Y471 HydrophobicContact CZ2-CD1 4.21Å; W437-Y471 AromaticContact CZ2-CE1 3.79Å; W437-Y471 HydrophobicContact CZ2-CE1 3.79Å; S464-Y471 CarbonylContact O-C 3.6Å; S464-Y471 WeakPolarHBondContact O-CA 3.39Å; L465-Y471 HydrophobicContact CB-CD1 4.33Å; L465-Y471 HydrophobicContact CB-CE1 4.24Å; L465-Y471 HydrophobicContact CD1-CD1 3.98Å; L465-Y471 HydrophobicContact CD1-CD2 3.92Å; L465-Y471 HydrophobicContact CD1-CE1 3.8Å; L465-Y471 HydrophobicContact CD1-CE2 3.72Å; L465-Y471 HydrophobicContact CD1-CG 4.04Å; L465-Y471 HydrophobicContact CD2-CE1 4.21Å; L465-Y471 HydrophobicContact CG-CE1 4.31Å; Y471-L481 PolarHBondContact O-N 3.02Å; Y471-L483 HydrophobicContact CD1-CD1 3.68Å; Y471-L483 HydrophobicContact CD2-CB 4.47Å; Y471-L483 HydrophobicContact CD2-CD1 3.57Å; Y471-L483 HydrophobicContact CD2-CG 4.1Å; Y471-L483 HydrophobicContact CE1-CD1 3.92Å; Y471-L483 HydrophobicContact CE2-CD1 3.84Å; Y471-L483 HydrophobicContact CG-CD1 3.48Å; Y471-L483 VanDerWaalsContact CG-CD1 3.48Å; Y471-L483 HydrophobicContact CG-CG 4.24Å; Y471-P486 WeakPolarHBondContact OH-CA 3.28Å; Y471-L487 HydrophobicContact CD1-CD1 3.96Å; Y471-L487 HydrophobicContact CE1-CB 4.19Å; Y471-L487 HydrophobicContact CE1-CD1 3.68Å; Y471-L487 HydrophobicContact CE1-CG 3.88Å; Y471-L487 PolarHBondContact OH-N 3.47Å; Y471-L487 VanDerWaalsContact OH-N 3.13Å
472	M	96.6	Very high	93.5	Very high	33 Å²	33	52.7 Å²	52.7	16%	0.163	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	135.6	-176.1	-57.1	-174.1	-79.3	0	0	112	L463 S464 S466 P478 T479 L480	L463-M472 CarbonylContact C-O 3.51Å; L463-M472 WeakPolarHBondContact CA-O 3.49Å; S464-M472 PolarHBondContact N-O 3.01Å; S464-M472 PolarHBondContact O-N 3.46Å; S464-M472 PolarHBondContact OG-O 3.45Å; S466-M472 WeakPolarHBondContact OG-CE 3.38Å; M472-P478 HydrophobicContact SD-CB 4.29Å; M472-T479 CarbonylContact C-O 3.53Å; M472-T479 VanDerWaalsContact CA-O 3.29Å; M472-T479 WeakPolarHBondContact CA-O 3.3Å; M472-L480 HydrophobicContact CG-CD2 3.54Å; M472-L480 HydrophobicContact SD-CD2 3.63Å
473	A	97.8	Very high	93.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	135.4	161.3	0	0	0	0	0	109.1	T475 T479 Y513 F515	A473-T475 PolarHBondContact O-N 2.92Å; A473-T479 PolarHBondContact N-O 3.5Å; A473-T479 PolarHBondContact O-N 3.31Å; A473-T479 VanDerWaalsContact O-N 3.11Å; A473-Y513 HydrophobicContact CB-CD1 3.5Å; A473-Y513 VanDerWaalsContact CB-CD1 3.5Å; A473-Y513 HydrophobicContact CB-CD2 3.91Å; A473-Y513 HydrophobicContact CB-CE1 3.66Å; A473-Y513 HydrophobicContact CB-CE2 4.04Å; A473-Y513 HydrophobicContact CB-CG 3.63Å; A473-F515 HydrophobicContact CB-CE2 4.32Å; A473-F515 HydrophobicContact CB-CZ 3.86Å
474	G	96.1	Very high	92.4	Very high	9 Å²	9	65 Å²	65	9%	0.093	37%	0.373	C	S	.	.			trans	-69.5	43	-176.9	0	0	0	0	0	115.4	M455 P456 T462	M455-G474 WeakPolarHBondContact CA-O 3.24Å; M455-G474 VanDerWaalsContact CB-O 3.28Å; M455-G474 WeakPolarHBondContact CB-O 3.41Å; P456-G474 WeakPolarHBondContact CD-O 3.48Å; T462-G474 PolarHBondContact O-N 3.24Å
475	T	96.6	Very high	92	Very high	23 Å²	23	71.1 Å²	71.1	14%	0.141	40%	0.4	C	S	.	.			trans	-75.6	174.5	171.6	52.4	0	0	0	0	111.8	A473 P477 P478 T479 Y513 F515	A473-T475 PolarHBondContact O-N 2.92Å; T475-P477 VanDerWaalsContact C-C 3.41Å; T475-P477 CarbonylContact C-O 3.54Å; T475-P477 VanDerWaalsContact CB-O 3.29Å; T475-P477 WeakPolarHBondContact CB-O 3.44Å; T475-P477 CarbonylContact O-C 3.57Å; T475-P477 PolarHBondContact OG1-O 2.84Å; T475-P478 WeakPolarHBondContact O-CA 3.47Å; T475-P478 VanDerWaalsContact O-N 3.13Å; T475-T479 WeakPolarHBondContact OG1-CB 3.42Å; T475-T479 PolarHBondContact OG1-N 2.95Å; T475-T479 PolarHBondContact OG1-OG1 3.46Å; T475-Y513 HydrophobicContact CG2-CE1 4.32Å; T475-Y513 WeakPolarHBondContact CG2-OH 3.48Å; T475-F515 HydrophobicContact CG2-CD1 4.39Å; T475-F515 HydrophobicContact CG2-CE1 3.7Å; T475-F515 HydrophobicContact CG2-CZ 4.47Å
476	S	93.2	Very high	91.7	Very high	92 Å²	92	75.2 Å²	75.2	64%	0.643	43%	0.427	S	S	*	.	S	Bend	trans	-123.3	107	171.4	-173.2	0	0	0	0	109.9
477	P	94.4	Very high	91.8	Very high	109 Å²	109	74.6 Å²	74.6	71%	0.708	42%	0.422	S	S	*	.	S	Bend	cis	-66.9	162.1	-4.1	30.6	-36.1	0	0	0	112.7	T475	T475-P477 VanDerWaalsContact C-C 3.41Å; T475-P477 CarbonylContact C-O 3.54Å; T475-P477 VanDerWaalsContact CB-O 3.29Å; T475-P477 WeakPolarHBondContact CB-O 3.44Å; T475-P477 CarbonylContact O-C 3.57Å; T475-P477 PolarHBondContact OG1-O 2.84Å
478	P	94.6	Very high	92.2	Very high	80 Å²	80	69.2 Å²	69.2	52%	0.519	40%	0.404	S	S	.	.			trans	-58.3	136.1	178	-24.9	34.7	0	0	0	112.4	M472 T475	M472-P478 HydrophobicContact SD-CB 4.29Å; T475-P478 WeakPolarHBondContact O-CA 3.47Å; T475-P478 VanDerWaalsContact O-N 3.13Å
479	T	96.6	Very high	92.7	Very high	53 Å²	53	69.8 Å²	69.8	33%	0.325	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	115.6	178.1	-58.9	0	0	0	0	108.6	M472 A473 T475 Y513	M472-T479 CarbonylContact C-O 3.53Å; M472-T479 VanDerWaalsContact CA-O 3.29Å; M472-T479 WeakPolarHBondContact CA-O 3.3Å; A473-T479 PolarHBondContact N-O 3.5Å; A473-T479 PolarHBondContact O-N 3.31Å; A473-T479 VanDerWaalsContact O-N 3.11Å; T475-T479 WeakPolarHBondContact OG1-CB 3.42Å; T475-T479 PolarHBondContact OG1-N 2.95Å; T475-T479 PolarHBondContact OG1-OG1 3.46Å; T479-Y513 HydrophobicContact CG2-CE2 4Å
480	L	96.8	Very high	93.3	Very high	117 Å²	117	64.5 Å²	64.5	61%	0.613	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	138.4	175.2	-59.9	-177.8	0	0	0	110.5	M472	M472-L480 HydrophobicContact CG-CD2 3.54Å; M472-L480 HydrophobicContact SD-CD2 3.63Å
481	L	95.8	Very high	93.6	Very high	32 Å²	32	59.7 Å²	59.7	17%	0.168	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	125.7	176.6	-66.2	161.4	0	0	0	109.4	L463 Y471 L512 Y513	L463-L481 HydrophobicContact CD1-CD1 3.2Å; Y471-L481 PolarHBondContact O-N 3.02Å; L481-L512 WeakPolarHBondContact CD2-O 3.39Å; L481-Y513 HydrophobicContact CD2-CD2 4.18Å
482	S	91.6	Very high	93.7	Very high	126 Å²	126	58.8 Å²	58.8	88%	0.881	34%	0.337	S	S	*	.			trans	-92	113.2	173.3	-60.6	0	0	0	0	109
483	L	89.8	Confident	93.8	Very high	56 Å²	56	59 Å²	59	29%	0.293	34%	0.336	S	S	.	.			trans	-115.9	137.6	178.6	-53.7	-177.7	0	0	0	109.3	Y471 L487 L512	Y471-L483 HydrophobicContact CD1-CD1 3.68Å; Y471-L483 HydrophobicContact CD2-CB 4.47Å; Y471-L483 HydrophobicContact CD2-CD1 3.57Å; Y471-L483 HydrophobicContact CD2-CG 4.1Å; Y471-L483 HydrophobicContact CE1-CD1 3.92Å; Y471-L483 HydrophobicContact CE2-CD1 3.84Å; Y471-L483 HydrophobicContact CG-CD1 3.48Å; Y471-L483 VanDerWaalsContact CG-CD1 3.48Å; Y471-L483 HydrophobicContact CG-CG 4.24Å; L483-L487 HydrophobicContact CD1-CD1 3.54Å; L483-L487 HydrophobicContact CD1-CD2 4.08Å; L483-L487 HydrophobicContact CD1-CG 3.69Å; L483-L512 HydrophobicContact CD2-CD2 3.79Å
484	E	83.5	Confident	93.8	Very high	202 Å²	202	59 Å²	59	94%	0.944	34%	0.336	S	S	*	.	S	Bend	trans	-73.4	-34.2	177.2	-64.7	-179.6	177.8	0	0	111.7
485	E	85.6	Confident	93.9	Very high	142 Å²	142	59 Å²	59	66%	0.664	33%	0.334	S	S	*	.	S	Bend	trans	-127.6	147.1	-176.6	-65	-177.2	170.7	0	0	111.4
486	P	88.8	Confident	94	Very high	94 Å²	94	59.4 Å²	59.4	61%	0.61	33%	0.333	S	S	*	.			trans	-66.2	143.6	174.1	28.5	-33.9	0	0	0	111.1	Y471	Y471-P486 WeakPolarHBondContact OH-CA 3.28Å
487	L	92.1	Very high	94.1	Very high	7 Å²	7	64.1 Å²	64.1	4%	0.037	34%	0.343	C	S	.	.			trans	-81.8	124.7	-176.7	-60.9	176.8	0	0	0	110.5	V431 Y471 L483 I490 N505 L512	V431-L487 HydrophobicContact CG2-CB 4.4Å; V431-L487 VanDerWaalsContact CG2-O 3.32Å; V431-L487 WeakPolarHBondContact CG2-O 2.88Å; Y471-L487 HydrophobicContact CD1-CD1 3.96Å; Y471-L487 HydrophobicContact CE1-CB 4.19Å; Y471-L487 HydrophobicContact CE1-CD1 3.68Å; Y471-L487 HydrophobicContact CE1-CG 3.88Å; Y471-L487 PolarHBondContact OH-N 3.47Å; Y471-L487 VanDerWaalsContact OH-N 3.13Å; L483-L487 HydrophobicContact CD1-CD1 3.54Å; L483-L487 HydrophobicContact CD1-CD2 4.08Å; L483-L487 HydrophobicContact CD1-CG 3.69Å; L487-I490 HydrophobicContact CB-CD1 3.69Å; L487-I490 HydrophobicContact CD1-CD1 3.2Å; L487-I490 HydrophobicContact CG-CD1 4.02Å; L487-N505 HydrophobicContact CD2-CB 3.77Å; L487-L512 HydrophobicContact CD1-CD1 3.59Å; L487-L512 HydrophobicContact CD1-CD2 4.43Å; L487-L512 HydrophobicContact CD2-CD1 4.45Å; L487-L512 HydrophobicContact CD2-CD2 4.35Å
488	A	92.2	Very high	94.1	Very high	12 Å²	12	63.5 Å²	63.5	10%	0.099	33%	0.326	C	S	.	.	S	Bend	trans	-80.3	-35.2	171.1	0	0	0	0	0	112.4	V431 Y432 E507	V431-A488 PolarHBondContact N-O 3.41Å; Y432-A488 HydrophobicContact CD2-CB 3.47Å; Y432-A488 VanDerWaalsContact CD2-CB 3.47Å; Y432-A488 HydrophobicContact CE2-CB 4.35Å; Y432-A488 HydrophobicContact CG-CB 3.99Å; Y432-A488 PolarHBondContact N-O 2.88Å; A488-E507 WeakPolarHBondContact CB-OE1 3.48Å
489	R	94.4	Very high	94.2	Very high	47 Å²	47	59.9 Å²	59.9	18%	0.177	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	138	-174.6	-166.5	-174.4	-57.6	166.8	3	111.6	E428 V429 E430 A506 F544	E428-R489 HydrophobicContact CB-CG 4.09Å; E428-R489 WeakPolarHBondContact OE2-CD 3.28Å; E428-R489 IonicContact OE2-CZ 2.84Å; E428-R489 IonicContact OE2-NE 2.67Å; E428-R489 IonicContact OE2-NH1 3.27Å; E428-R489 PolarHBondContact OE2-NH1 3.33Å; V429-R489 CarbonylContact O-C 3.58Å; V429-R489 VanDerWaalsContact O-CA 3.28Å; V429-R489 WeakPolarHBondContact O-CA 3.27Å; V429-R489 VanDerWaalsContact O-CG 3.25Å; V429-R489 WeakPolarHBondContact O-CG 3.24Å; E430-R489 HydrophobicContact CG-CG 4.47Å; E430-R489 IonicContact OE1-NH2 2.76Å; R489-A506 HydrophobicContact CB-CB 3.95Å; R489-A506 HydrophobicContact CG-CB 3.76Å; R489-A506 PolarHBondContact O-N 2.91Å; R489-F544 VanDerWaalsContact CZ-CD2 3.47Å
490	I	96.6	Very high	94.3	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	123.7	179.3	-50.7	-59.7	0	0	0	109.8	E428 V429 V431 W437 V439 L463 L487 V492 F503 L512	E428-I490 CarbonylContact C-O 3.53Å; E428-I490 VanDerWaalsContact CA-O 3.28Å; E428-I490 WeakPolarHBondContact CA-O 3.45Å; V429-I490 PolarHBondContact N-O 3.16Å; V429-I490 PolarHBondContact O-N 3.32Å; V431-I490 HydrophobicContact CG1-CG1 4.08Å; V431-I490 HydrophobicContact CG2-CD1 4.18Å; V431-I490 HydrophobicContact CG2-CG1 3.86Å; W437-I490 HydrophobicContact CH2-CD1 3.61Å; W437-I490 HydrophobicContact CH2-CG1 3.7Å; W437-I490 HydrophobicContact CZ2-CD1 4.04Å; W437-I490 HydrophobicContact CZ2-CG1 4.15Å; W437-I490 HydrophobicContact CZ3-CD1 4.47Å; W437-I490 HydrophobicContact CZ3-CG1 4.15Å; V439-I490 HydrophobicContact CG2-CB 4.22Å; V439-I490 HydrophobicContact CG2-CG1 4.29Å; V439-I490 HydrophobicContact CG2-CG2 3.96Å; L463-I490 HydrophobicContact CD2-CD1 4.15Å; L463-I490 HydrophobicContact CD2-CG2 4.12Å; L487-I490 HydrophobicContact CB-CD1 3.69Å; L487-I490 HydrophobicContact CD1-CD1 3.2Å; L487-I490 HydrophobicContact CG-CD1 4.02Å; I490-V492 HydrophobicContact CG2-CG2 4.27Å; I490-F503 HydrophobicContact CG2-CD1 3.98Å; I490-L512 HydrophobicContact CD1-CD1 4.37Å
491	G	97.4	Very high	94.3	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	128	167.6	0	0	0	0	0	110	W427 F503 Y504	W427-G491 CarbonylContact O-C 3.56Å; W427-G491 WeakPolarHBondContact O-CA 3.43Å; G491-F503 CarbonylContact O-C 3.53Å; G491-F503 WeakPolarHBondContact O-CA 3.47Å; G491-Y504 PolarHBondContact N-O 3.19Å; G491-Y504 PolarHBondContact O-N 3.3Å
492	V	98.3	Very high	94.5	Very high	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	120.3	175.4	-173.8	0	0	0	0	108.4	Y426 W427 V441 I490 V501 F503	Y426-V492 CarbonylContact C-O 3.52Å; Y426-V492 VanDerWaalsContact CA-O 3.25Å; Y426-V492 WeakPolarHBondContact CA-O 3.31Å; Y426-V492 WeakPolarHBondContact CD2-O 3.5Å; W427-V492 HydrophobicContact CD2-CB 4.15Å; W427-V492 HydrophobicContact CH2-CB 4.39Å; W427-V492 HydrophobicContact CH2-CG1 3.82Å; W427-V492 HydrophobicContact CZ2-CB 3.75Å; W427-V492 HydrophobicContact CZ2-CG1 3.39Å; W427-V492 HydrophobicContact CZ2-CG2 4.49Å; W427-V492 PolarHBondContact N-O 3.27Å; W427-V492 PolarHBondContact O-N 3.36Å; V441-V492 HydrophobicContact CG1-CG1 4.47Å; I490-V492 HydrophobicContact CG2-CG2 4.27Å; V492-V501 HydrophobicContact CG1-CG1 4.33Å; V492-F503 HydrophobicContact CG1-CE1 4.22Å; V492-F503 HydrophobicContact CG2-CD1 4.06Å; V492-F503 HydrophobicContact CG2-CE1 3.92Å
493	Y	98.3	Very high	94.8	Very high	37 Å²	37	45 Å²	45	15%	0.145	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125.2	178.2	174.7	-98.6	0	0	0	110.2	P367 R424 H425 D495 V501 S502 Y504	P367-Y493 HydrophobicContact CG-CD2 4.13Å; P367-Y493 HydrophobicContact CG-CE2 3.75Å; R424-Y493 HydrophobicContact CB-CE2 4.29Å; R424-Y493 WeakPolarHBondContact CD-OH 3.37Å; R424-Y493 WeakPolarHBondContact CG-OH 3.43Å; H425-Y493 CarbonylContact O-C 3.6Å; H425-Y493 WeakPolarHBondContact O-CA 3.42Å; Y493-D495 HydrophobicContact CE1-CB 3.74Å; Y493-D495 PolarHBondContact OH-OD2 3.27Å; Y493-V501 CarbonylContact O-C 3.55Å; Y493-V501 WeakPolarHBondContact O-CA 3.4Å; Y493-S502 PolarHBondContact N-O 2.75Å; Y493-S502 PolarHBondContact O-N 2.83Å; Y493-Y504 HydrophobicContact CG-CE2 4.48Å
494	L	98.3	Very high	95.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.8	175.3	171.3	63	0	0	0	109.3	F420 R424 H425 W427 L500 V501 F519 L523	F420-L494 HydrophobicContact CB-CD2 3.8Å; F420-L494 HydrophobicContact CD2-CD2 3.95Å; F420-L494 HydrophobicContact CG-CD2 4.17Å; R424-L494 CarbonylContact C-O 3.55Å; R424-L494 WeakPolarHBondContact CA-O 3.43Å; H425-L494 HydrophobicContact CB-CB 4.42Å; H425-L494 PolarHBondContact N-O 2.96Å; H425-L494 PolarHBondContact O-N 3.28Å; W427-L494 HydrophobicContact CH2-CB 4.37Å; W427-L494 HydrophobicContact CZ3-CB 4.25Å; L494-L500 WeakPolarHBondContact CA-O 3.47Å; L494-V501 HydrophobicContact CD1-CG2 4.06Å; L494-F519 HydrophobicContact CD1-CD2 4.29Å; L494-F519 HydrophobicContact CD1-CE2 3.71Å; L494-F519 HydrophobicContact CD1-CZ 4.32Å; L494-L523 HydrophobicContact CD1-CD1 3.81Å; L494-L523 HydrophobicContact CD2-CB 4.35Å; L494-L523 HydrophobicContact CD2-CD1 4.38Å
495	D	97.5	Very high	95.7	Very high	10 Å²	10	36 Å²	36	5%	0.053	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	94.9	164.5	-167.5	-37.5	0	0	0	108.6	R424 Y493 K497 R498 G499 L500	R424-D495 HydrophobicContact CG-CB 4.25Å; Y493-D495 HydrophobicContact CE1-CB 3.74Å; Y493-D495 PolarHBondContact OH-OD2 3.27Å; D495-K497 VanDerWaalsContact C-N 3.33Å; D495-K497 PolarHBondContact O-N 2.76Å; D495-K497 PolarHBondContact OD1-N 2.89Å; D495-R498 HydrophobicContact CB-CB 4.27Å; D495-R498 PolarHBondContact O-N 3.42Å; D495-R498 PolarHBondContact OD1-N 3.05Å; D495-R498 VanDerWaalsContact OD1-N 3.1Å; D495-R498 WeakPolarHBondContact OD2-CD 3.36Å; D495-G499 PolarHBondContact O-N 3.05Å; D495-L500 HydrophobicContact CB-CB 4.04Å; D495-L500 HydrophobicContact CB-CD1 4.49Å; D495-L500 HydrophobicContact CB-CG 4.48Å; D495-L500 PolarHBondContact N-O 3.29Å; D495-L500 PolarHBondContact O-N 3Å
496	Y	97.5	Very high	96.2	Very high	31 Å²	31	29.8 Å²	29.8	12%	0.122	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-42.4	-171.4	-166.8	-77.7	0	0	0	111.4	F420 T421 G423 R498 G499 F519 E521 L523	F420-Y496 VanDerWaalsContact O-CE2 3.27Å; F420-Y496 WeakPolarHBondContact O-CE2 3.5Å; T421-Y496 VanDerWaalsContact O-CD1 3.31Å; T421-Y496 WeakPolarHBondContact O-CD1 3.25Å; T421-Y496 WeakPolarHBondContact O-CE1 3.38Å; G423-Y496 WeakPolarHBondContact O-CB 3.42Å; G423-Y496 PolarHBondContact O-N 3.02Å; Y496-R498 PolarHBondContact O-N 3.35Å; Y496-G499 PolarHBondContact O-N 2.67Å; Y496-F519 HydrophobicContact CD1-CB 4.45Å; Y496-F519 HydrophobicContact CD2-CB 4.31Å; Y496-F519 HydrophobicContact CD2-CD2 4.21Å; Y496-F519 HydrophobicContact CE1-CB 3.98Å; Y496-F519 HydrophobicContact CE2-CB 3.83Å; Y496-F519 HydrophobicContact CG-CD2 4.27Å; Y496-F519 WeakPolarHBondContact O-CD2 3.42Å; Y496-E521 WeakPolarHBondContact CE2-O 3.41Å; Y496-E521 PolarHBondContact OH-N 2.97Å; Y496-E521 PolarHBondContact OH-O 2.72Å; Y496-L523 HydrophobicContact CD2-CD1 4.32Å; Y496-L523 HydrophobicContact CD2-CG 4.49Å; Y496-L523 HydrophobicContact CE2-CD1 4.29Å; Y496-L523 HydrophobicContact CE2-CG 4.08Å
497	K	96.1	Very high	96.3	Very high	192 Å²	192	31.4 Å²	31.4	84%	0.835	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-37.4	-176.4	-176	179.6	178.4	-176.8	0	111.9	D495 G499	D495-K497 VanDerWaalsContact C-N 3.33Å; D495-K497 PolarHBondContact O-N 2.76Å; D495-K497 PolarHBondContact OD1-N 2.89Å; K497-G499 VanDerWaalsContact C-N 3.35Å
498	R	94	Very high	96.4	Very high	96 Å²	96	34.3 Å²	34.3	36%	0.362	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-4.3	179.9	-66.4	179.1	62.7	-150.8	1.3	113.4	R252 D495 Y496 L500	R252-R498 VanDerWaalsContact NH2-NH2 3.13Å; D495-R498 HydrophobicContact CB-CB 4.27Å; D495-R498 PolarHBondContact O-N 3.42Å; D495-R498 PolarHBondContact OD1-N 3.05Å; D495-R498 VanDerWaalsContact OD1-N 3.1Å; D495-R498 WeakPolarHBondContact OD2-CD 3.36Å; Y496-R498 PolarHBondContact O-N 3.35Å; R498-L500 HydrophobicContact CB-CD1 4.07Å; R498-L500 HydrophobicContact CB-CG 3.97Å
499	G	97.3	Very high	96.5	Very high	4 Å²	4	39 Å²	39	4%	0.041	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	28.7	178.3	0	0	0	0	0	113.9	D495 Y496 K497 R516 D517	D495-G499 PolarHBondContact O-N 3.05Å; Y496-G499 PolarHBondContact O-N 2.67Å; K497-G499 VanDerWaalsContact C-N 3.35Å; G499-R516 CarbonylContact O-C 3.54Å; G499-R516 VanDerWaalsContact O-CA 3.32Å; G499-R516 WeakPolarHBondContact O-CA 3.46Å; G499-D517 CarbonylContact C-O 3.58Å; G499-D517 WeakPolarHBondContact CA-O 3.4Å; G499-D517 PolarHBondContact O-N 3.26Å
500	L	97.9	Very high	96.5	Very high	9 Å²	9	40.1 Å²	40.1	5%	0.047	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	135	-172.8	-52.7	177	0	0	0	112.3	L494 D495 R498 T514 F515 R516	L494-L500 WeakPolarHBondContact CA-O 3.47Å; D495-L500 HydrophobicContact CB-CB 4.04Å; D495-L500 HydrophobicContact CB-CD1 4.49Å; D495-L500 HydrophobicContact CB-CG 4.48Å; D495-L500 PolarHBondContact N-O 3.29Å; D495-L500 PolarHBondContact O-N 3Å; R498-L500 HydrophobicContact CB-CD1 4.07Å; R498-L500 HydrophobicContact CB-CG 3.97Å; L500-T514 HydrophobicContact CD2-CG2 4.15Å; L500-F515 WeakPolarHBondContact CA-O 3.24Å; L500-R516 HydrophobicContact CD2-CB 4.38Å; L500-R516 HydrophobicContact CD2-CG 3.66Å
501	V	98.6	Very high	96.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	112.6	162.1	-176.7	0	0	0	0	107.4	V441 W461 V492 Y493 L494 F503 T514 F515 F519	V441-V501 HydrophobicContact CG2-CB 4.31Å; V441-V501 HydrophobicContact CG2-CG1 3.88Å; V441-V501 HydrophobicContact CG2-CG2 3.45Å; V441-V501 VanDerWaalsContact CG2-CG2 3.45Å; W461-V501 HydrophobicContact CB-CB 4.13Å; W461-V501 HydrophobicContact CB-CG1 4.24Å; W461-V501 HydrophobicContact CB-CG2 4.02Å; W461-V501 HydrophobicContact CG-CG2 4.25Å; V492-V501 HydrophobicContact CG1-CG1 4.33Å; Y493-V501 CarbonylContact O-C 3.55Å; Y493-V501 WeakPolarHBondContact O-CA 3.4Å; L494-V501 HydrophobicContact CD1-CG2 4.06Å; V501-F503 HydrophobicContact CG1-CE2 3.7Å; V501-F503 HydrophobicContact CG1-CZ 3.89Å; V501-T514 CarbonylContact O-C 3.16Å; V501-T514 WeakPolarHBondContact O-CA 3.44Å; V501-F515 HydrophobicContact CB-CB 4.35Å; V501-F515 HydrophobicContact CB-CD2 4.48Å; V501-F515 PolarHBondContact N-O 2.88Å; V501-F515 PolarHBondContact O-N 3.45Å; V501-F519 HydrophobicContact CG2-CE1 4.48Å; V501-F519 HydrophobicContact CG2-CZ 3.81Å
502	S	98.5	Very high	96.5	Very high	5 Å²	5	46.1 Å²	46.1	4%	0.035	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	145.2	-179.3	-59.2	0	0	0	0	111.2	Y493 Y513 T514	Y493-S502 PolarHBondContact N-O 2.75Å; Y493-S502 PolarHBondContact O-N 2.83Å; S502-Y513 CarbonylContact C-O 3.58Å; S502-Y513 VanDerWaalsContact CA-O 3.31Å; S502-Y513 WeakPolarHBondContact CA-O 3.47Å; S502-T514 WeakPolarHBondContact CB-OG1 3.45Å; S502-T514 WeakPolarHBondContact OG-CG2 3.19Å; S502-T514 PolarHBondContact OG-OG1 3.19Å
503	F	98.6	Very high	96.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	141.3	178.3	-64	-92.6	0	0	0	109.9	V439 L463 I490 G491 V492 V501 L512 Y513 F515	V439-F503 WeakPolarHBondContact O-CE1 3.41Å; L463-F503 HydrophobicContact CB-CD1 3.54Å; L463-F503 HydrophobicContact CB-CD2 4.39Å; L463-F503 HydrophobicContact CB-CE1 3.63Å; L463-F503 HydrophobicContact CB-CE2 4.49Å; L463-F503 HydrophobicContact CB-CG 3.94Å; L463-F503 HydrophobicContact CB-CZ 4.13Å; L463-F503 HydrophobicContact CD2-CB 4.1Å; L463-F503 HydrophobicContact CD2-CD1 4.05Å; L463-F503 HydrophobicContact CD2-CG 4.23Å; L463-F503 HydrophobicContact CG-CD1 4.41Å; I490-F503 HydrophobicContact CG2-CD1 3.98Å; G491-F503 CarbonylContact O-C 3.53Å; G491-F503 WeakPolarHBondContact O-CA 3.47Å; V492-F503 HydrophobicContact CG1-CE1 4.22Å; V492-F503 HydrophobicContact CG2-CD1 4.06Å; V492-F503 HydrophobicContact CG2-CE1 3.92Å; V501-F503 HydrophobicContact CG1-CE2 3.7Å; V501-F503 HydrophobicContact CG1-CZ 3.89Å; F503-L512 HydrophobicContact CB-CB 4.16Å; F503-L512 HydrophobicContact CB-CD1 4.42Å; F503-L512 WeakPolarHBondContact O-CB 3.5Å; F503-L512 PolarHBondContact O-N 3.4Å; F503-Y513 PolarHBondContact N-O 3.22Å; F503-Y513 PolarHBondContact O-N 3.25Å; F503-F515 HydrophobicContact CD2-CD2 4.4Å; F503-F515 HydrophobicContact CD2-CE2 4.26Å; F503-F515 AromaticContact CE2-CD2 3.75Å; F503-F515 HydrophobicContact CE2-CD2 3.75Å; F503-F515 AromaticContact CE2-CE2 3.58Å; F503-F515 HydrophobicContact CE2-CE2 3.58Å; F503-F515 HydrophobicContact CZ-CE2 4.44Å
504	Y	97.4	Very high	96.5	Very high	53 Å²	53	48.6 Å²	48.6	21%	0.208	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	148.6	-178.7	-60.3	-92.5	0	0	0	110.4	G491 Y493 A506 T510 H511	G491-Y504 PolarHBondContact N-O 3.19Å; G491-Y504 PolarHBondContact O-N 3.3Å; Y493-Y504 HydrophobicContact CG-CE2 4.48Å; Y504-A506 PolarHBondContact O-N 3.47Å; Y504-T510 CarbonylContact C-O 3.48Å; Y504-T510 WeakPolarHBondContact CA-O 3.21Å; Y504-H511 HydrophobicContact CD1-CB 4.27Å; Y504-H511 HydrophobicContact CE1-CB 4.09Å
505	N	95.5	Very high	96.5	Very high	18 Å²	18	49 Å²	49	10%	0.096	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	113.4	153.8	179.7	-17.1	0	0	0	106.2	L487 E507 S508 M509 T510 L512	L487-N505 HydrophobicContact CD2-CB 3.77Å; N505-E507 PolarHBondContact O-N 2.86Å; N505-E507 PolarHBondContact OD1-N 3.41Å; N505-S508 WeakPolarHBondContact CB-OG 3.34Å; N505-S508 VanDerWaalsContact CG-OG 3.3Å; N505-S508 PolarHBondContact ND2-OG 3.25Å; N505-M509 WeakPolarHBondContact O-CA 3.39Å; N505-M509 PolarHBondContact O-N 3.37Å; N505-T510 WeakPolarHBondContact CB-OG1 3.41Å; N505-T510 PolarHBondContact N-O 3.18Å; N505-T510 PolarHBondContact O-N 3.31Å; N505-L512 HydrophobicContact CB-CD2 4.39Å
506	A	94.5	Very high	96.5	Very high	10 Å²	10	56.2 Å²	56.2	8%	0.083	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-19.5	-173.1	0	0	0	0	0	113.5	E428 R489 Y504	E428-A506 HydrophobicContact CG-CB 3.79Å; R489-A506 HydrophobicContact CB-CB 3.95Å; R489-A506 HydrophobicContact CG-CB 3.76Å; R489-A506 PolarHBondContact O-N 2.91Å; Y504-A506 PolarHBondContact O-N 3.47Å
507	E	92.2	Very high	96.5	Very high	129 Å²	129	57.4 Å²	57.4	60%	0.603	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-46.1	179.9	-64.8	-171	166.1	0	0	111.9	A488 N505	A488-E507 WeakPolarHBondContact CB-OE1 3.48Å; N505-E507 PolarHBondContact O-N 2.86Å; N505-E507 PolarHBondContact OD1-N 3.41Å
508	S	93.5	Very high	96.5	Very high	68 Å²	68	53.4 Å²	53.4	48%	0.476	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-7.4	-179.1	60.3	0	0	0	0	113.5	N505 T510	N505-S508 WeakPolarHBondContact CB-OG 3.34Å; N505-S508 VanDerWaalsContact CG-OG 3.3Å; N505-S508 PolarHBondContact ND2-OG 3.25Å; S508-T510 PolarHBondContact O-N 3.2Å; S508-T510 WeakPolarHBondContact OG-CG2 3.41Å; S508-T510 PolarHBondContact OG-N 3.41Å; S508-T510 PolarHBondContact OG-OG1 3.45Å; S508-T510 VanDerWaalsContact OG-OG1 3.06Å
509	M	93.3	Very high	96.6	Very high	109 Å²	109	49.7 Å²	49.7	54%	0.537	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	24.2	-170.3	-67.2	-65.2	-65.3	0	0	113.5	N505	N505-M509 WeakPolarHBondContact O-CA 3.39Å; N505-M509 PolarHBondContact O-N 3.37Å
510	T	95.4	Very high	96.5	Very high	71 Å²	71	54.8 Å²	54.8	44%	0.436	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	136.7	175.4	59	0	0	0	0	110.6	Y504 N505 S508	Y504-T510 CarbonylContact C-O 3.48Å; Y504-T510 WeakPolarHBondContact CA-O 3.21Å; N505-T510 WeakPolarHBondContact CB-OG1 3.41Å; N505-T510 PolarHBondContact N-O 3.18Å; N505-T510 PolarHBondContact O-N 3.31Å; S508-T510 PolarHBondContact O-N 3.2Å; S508-T510 WeakPolarHBondContact OG-CG2 3.41Å; S508-T510 PolarHBondContact OG-N 3.41Å; S508-T510 PolarHBondContact OG-OG1 3.45Å; S508-T510 VanDerWaalsContact OG-OG1 3.06Å
511	H	97.1	Very high	96.4	Very high	106 Å²	106	56.4 Å²	56.4	49%	0.491	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	136.1	177	174.2	-103.2	0	0	0	110.6	Y504 Y513 T514	Y504-H511 HydrophobicContact CD1-CB 4.27Å; Y504-H511 HydrophobicContact CE1-CB 4.09Å; H511-Y513 PolarHBondContact NE2-O 3.29Å; H511-T514 PolarHBondContact NE2-OG1 3.07Å
512	L	97.3	Very high	96.4	Very high	20 Å²	20	57.8 Å²	57.8	11%	0.105	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	-54.2	177.5	-57.4	175.4	0	0	0	111.1	L463 L481 L483 L487 I490 F503 N505	L463-L512 HydrophobicContact CD2-CD1 3.9Å; L481-L512 WeakPolarHBondContact CD2-O 3.39Å; L483-L512 HydrophobicContact CD2-CD2 3.79Å; L487-L512 HydrophobicContact CD1-CD1 3.59Å; L487-L512 HydrophobicContact CD1-CD2 4.43Å; L487-L512 HydrophobicContact CD2-CD1 4.45Å; L487-L512 HydrophobicContact CD2-CD2 4.35Å; I490-L512 HydrophobicContact CD1-CD1 4.37Å; F503-L512 HydrophobicContact CB-CB 4.16Å; F503-L512 HydrophobicContact CB-CD1 4.42Å; F503-L512 WeakPolarHBondContact O-CB 3.5Å; F503-L512 PolarHBondContact O-N 3.4Å; N505-L512 HydrophobicContact CB-CD2 4.39Å
513	Y	98.1	Very high	96.4	Very high	52 Å²	52	57.6 Å²	57.6	20%	0.204	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	153	-176.2	-166.7	-97.5	0	0	0	111.8	A473 T475 T479 L481 S502 F503 H511 F515	A473-Y513 HydrophobicContact CB-CD1 3.5Å; A473-Y513 VanDerWaalsContact CB-CD1 3.5Å; A473-Y513 HydrophobicContact CB-CD2 3.91Å; A473-Y513 HydrophobicContact CB-CE1 3.66Å; A473-Y513 HydrophobicContact CB-CE2 4.04Å; A473-Y513 HydrophobicContact CB-CG 3.63Å; T475-Y513 HydrophobicContact CG2-CE1 4.32Å; T475-Y513 WeakPolarHBondContact CG2-OH 3.48Å; T479-Y513 HydrophobicContact CG2-CE2 4Å; L481-Y513 HydrophobicContact CD2-CD2 4.18Å; S502-Y513 CarbonylContact C-O 3.58Å; S502-Y513 VanDerWaalsContact CA-O 3.31Å; S502-Y513 WeakPolarHBondContact CA-O 3.47Å; F503-Y513 PolarHBondContact N-O 3.22Å; F503-Y513 PolarHBondContact O-N 3.25Å; H511-Y513 PolarHBondContact NE2-O 3.29Å; Y513-F515 AromaticContact CD1-CD2 3.78Å; Y513-F515 HydrophobicContact CD1-CD2 3.78Å; Y513-F515 HydrophobicContact CD1-CE1 4.47Å; Y513-F515 AromaticContact CD1-CE2 3.6Å; Y513-F515 HydrophobicContact CD1-CE2 3.6Å; Y513-F515 HydrophobicContact CD1-CG 4.3Å; Y513-F515 AromaticContact CD1-CZ 3.98Å; Y513-F515 HydrophobicContact CD1-CZ 3.98Å; Y513-F515 AromaticContact CE1-CD1 3.85Å; Y513-F515 HydrophobicContact CE1-CD1 3.85Å; Y513-F515 AromaticContact CE1-CD2 3.82Å; Y513-F515 HydrophobicContact CE1-CD2 3.82Å; Y513-F515 AromaticContact CE1-CE1 3.77Å; Y513-F515 HydrophobicContact CE1-CE1 3.77Å; Y513-F515 AromaticContact CE1-CE2 3.72Å; Y513-F515 HydrophobicContact CE1-CE2 3.72Å; Y513-F515 AromaticContact CE1-CG 3.89Å; Y513-F515 HydrophobicContact CE1-CG 3.89Å; Y513-F515 AromaticContact CE1-CZ 3.71Å; Y513-F515 HydrophobicContact CE1-CZ 3.71Å
514	T	98.4	Very high	96.4	Very high	37 Å²	37	58.9 Å²	58.9	23%	0.227	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	126.2	173.4	-65.8	0	0	0	0	111.6	L500 V501 S502 H511 R516	L500-T514 HydrophobicContact CD2-CG2 4.15Å; V501-T514 CarbonylContact O-C 3.16Å; V501-T514 WeakPolarHBondContact O-CA 3.44Å; S502-T514 WeakPolarHBondContact CB-OG1 3.45Å; S502-T514 WeakPolarHBondContact OG-CG2 3.19Å; S502-T514 PolarHBondContact OG-OG1 3.19Å; H511-T514 PolarHBondContact NE2-OG1 3.07Å; T514-R516 HydrophobicContact CG2-CG 4.48Å
515	F	98.4	Very high	96.4	Very high	10 Å²	10	56.4 Å²	56.4	4%	0.044	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	148.9	164.9	-63.6	-90.9	0	0	0	111.2	P456 W461 A473 T475 L500 V501 F503 Y513	P456-F515 HydrophobicContact CG-CD1 3.91Å; P456-F515 HydrophobicContact CG-CE1 3.93Å; W461-F515 HydrophobicContact CB-CB 4.39Å; W461-F515 HydrophobicContact CB-CD2 3.93Å; W461-F515 HydrophobicContact CB-CE2 4.3Å; W461-F515 HydrophobicContact CB-CG 4.03Å; W461-F515 AromaticContact CD1-CD1 3.76Å; W461-F515 AromaticContact CD1-CG 3.68Å; W461-F515 HydrophobicContact CG-CB 4.29Å; W461-F515 HydrophobicContact CG-CG 4.25Å; A473-F515 HydrophobicContact CB-CE2 4.32Å; A473-F515 HydrophobicContact CB-CZ 3.86Å; T475-F515 HydrophobicContact CG2-CD1 4.39Å; T475-F515 HydrophobicContact CG2-CE1 3.7Å; T475-F515 HydrophobicContact CG2-CZ 4.47Å; L500-F515 WeakPolarHBondContact CA-O 3.24Å; V501-F515 HydrophobicContact CB-CB 4.35Å; V501-F515 HydrophobicContact CB-CD2 4.48Å; V501-F515 PolarHBondContact N-O 2.88Å; V501-F515 PolarHBondContact O-N 3.45Å; F503-F515 HydrophobicContact CD2-CD2 4.4Å; F503-F515 HydrophobicContact CD2-CE2 4.26Å; F503-F515 AromaticContact CE2-CD2 3.75Å; F503-F515 HydrophobicContact CE2-CD2 3.75Å; F503-F515 AromaticContact CE2-CE2 3.58Å; F503-F515 HydrophobicContact CE2-CE2 3.58Å; F503-F515 HydrophobicContact CZ-CE2 4.44Å; Y513-F515 AromaticContact CD1-CD2 3.78Å; Y513-F515 HydrophobicContact CD1-CD2 3.78Å; Y513-F515 HydrophobicContact CD1-CE1 4.47Å; Y513-F515 AromaticContact CD1-CE2 3.6Å; Y513-F515 HydrophobicContact CD1-CE2 3.6Å; Y513-F515 HydrophobicContact CD1-CG 4.3Å; Y513-F515 AromaticContact CD1-CZ 3.98Å; Y513-F515 HydrophobicContact CD1-CZ 3.98Å; Y513-F515 AromaticContact CE1-CD1 3.85Å; Y513-F515 HydrophobicContact CE1-CD1 3.85Å; Y513-F515 AromaticContact CE1-CD2 3.82Å; Y513-F515 HydrophobicContact CE1-CD2 3.82Å; Y513-F515 AromaticContact CE1-CE1 3.77Å; Y513-F515 HydrophobicContact CE1-CE1 3.77Å; Y513-F515 AromaticContact CE1-CE2 3.72Å; Y513-F515 HydrophobicContact CE1-CE2 3.72Å; Y513-F515 AromaticContact CE1-CG 3.89Å; Y513-F515 HydrophobicContact CE1-CG 3.89Å; Y513-F515 AromaticContact CE1-CZ 3.71Å; Y513-F515 HydrophobicContact CE1-CZ 3.71Å
516	R	97.1	Very high	96.6	Very high	161 Å²	161	55.6 Å²	55.6	61%	0.608	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.2	124.3	172.4	-58.4	-172	174.6	-106.1	5.9	109	G499 L500 T514	G499-R516 CarbonylContact O-C 3.54Å; G499-R516 VanDerWaalsContact O-CA 3.32Å; G499-R516 WeakPolarHBondContact O-CA 3.46Å; L500-R516 HydrophobicContact CD2-CB 4.38Å; L500-R516 HydrophobicContact CD2-CG 3.66Å; T514-R516 HydrophobicContact CG2-CG 4.48Å
517	D	96.9	Very high	96.7	Very high	56 Å²	56	55.1 Å²	55.1	30%	0.299	28%	0.284	S	S	.	.			trans	-156	170.3	-178.7	-149.4	-30.9	0	0	0	111.4	W461 G499 F519	W461-D517 HydrophobicContact CZ2-CB 4.03Å; W461-D517 VanDerWaalsContact CZ2-OD2 3.23Å; W461-D517 WeakPolarHBondContact CZ2-OD2 3.45Å; W461-D517 PolarHBondContact NE1-OD2 3.05Å; G499-D517 CarbonylContact C-O 3.58Å; G499-D517 WeakPolarHBondContact CA-O 3.4Å; G499-D517 PolarHBondContact O-N 3.26Å; D517-F519 HydrophobicContact CB-CD1 4.32Å; D517-F519 HydrophobicContact CB-CE1 3.78Å
518	T	96.6	Very high	96.8	Very high	108 Å²	108	50 Å²	50	66%	0.663	26%	0.26	S	S	*	.			trans	-99.8	117	170.8	-57.4	0	0	0	0	109.7
519	F	97	Very high	96.7	Very high	18 Å²	18	47.1 Å²	47.1	8%	0.079	24%	0.24	C	C	.	.			trans	-92.3	129.2	178.9	-48.3	-44.4	0	0	0	110.9	W461 L494 Y496 V501 D517 L523	W461-F519 HydrophobicContact CD2-CE1 4.32Å; W461-F519 AromaticContact CE2-CE1 3.83Å; W461-F519 AromaticContact CH2-CD1 3.96Å; W461-F519 HydrophobicContact CH2-CD1 3.96Å; W461-F519 HydrophobicContact CH2-CE1 4.04Å; W461-F519 AromaticContact CZ2-CD1 3.91Å; W461-F519 HydrophobicContact CZ2-CD1 3.91Å; W461-F519 AromaticContact CZ2-CE1 3.69Å; W461-F519 HydrophobicContact CZ2-CE1 3.69Å; L494-F519 HydrophobicContact CD1-CD2 4.29Å; L494-F519 HydrophobicContact CD1-CE2 3.71Å; L494-F519 HydrophobicContact CD1-CZ 4.32Å; Y496-F519 HydrophobicContact CD1-CB 4.45Å; Y496-F519 HydrophobicContact CD2-CB 4.31Å; Y496-F519 HydrophobicContact CD2-CD2 4.21Å; Y496-F519 HydrophobicContact CE1-CB 3.98Å; Y496-F519 HydrophobicContact CE2-CB 3.83Å; Y496-F519 HydrophobicContact CG-CD2 4.27Å; Y496-F519 WeakPolarHBondContact O-CD2 3.42Å; V501-F519 HydrophobicContact CG2-CE1 4.48Å; V501-F519 HydrophobicContact CG2-CZ 3.81Å; D517-F519 HydrophobicContact CB-CD1 4.32Å; D517-F519 HydrophobicContact CB-CE1 3.78Å; F519-L523 HydrophobicContact CB-CD1 4.26Å; F519-L523 HydrophobicContact CD1-CD1 3.75Å; F519-L523 HydrophobicContact CD2-CD1 3.84Å; F519-L523 HydrophobicContact CE1-CD1 4.01Å; F519-L523 HydrophobicContact CE2-CD1 4.08Å; F519-L523 HydrophobicContact CG-CD1 3.68Å; F519-L523 HydrophobicContact CZ-CD1 4.2Å
520	T	95.1	Very high	96.2	Very high	110 Å²	110	42.5 Å²	42.5	68%	0.675	22%	0.22	S	C	*	.			trans	-121.2	-11.2	-176.6	52.9	0	0	0	0	113.4
521	E	95.9	Very high	95.3	Very high	44 Å²	44	44.5 Å²	44.5	21%	0.206	22%	0.223	C	C	.	.	S	Bend	trans	-135.2	174.1	-176.2	61.3	168.2	-104	0	0	111.5	R443 E444 S445 Y496 L523	R443-E521 VanDerWaalsContact C-OE1 3.25Å; R443-E521 WeakPolarHBondContact CA-OE1 3.32Å; R443-E521 HydrophobicContact CB-CG 4.23Å; R443-E521 WeakPolarHBondContact CB-OE1 3.31Å; R443-E521 VanDerWaalsContact CD-CD 3.46Å; R443-E521 HydrophobicContact CG-CG 3.61Å; R443-E521 VanDerWaalsContact CG-OE1 3.25Å; R443-E521 WeakPolarHBondContact CG-OE1 3.43Å; E444-E521 PolarHBondContact N-OE1 3.15Å; S445-E521 WeakPolarHBondContact CB-OE2 3.44Å; S445-E521 PolarHBondContact N-OE1 2.85Å; S445-E521 VanDerWaalsContact OG-CD 3.27Å; S445-E521 PolarHBondContact OG-OE1 3.45Å; S445-E521 VanDerWaalsContact OG-OE1 3.11Å; S445-E521 PolarHBondContact OG-OE2 2.96Å; Y496-E521 WeakPolarHBondContact CE2-O 3.41Å; Y496-E521 PolarHBondContact OH-N 2.97Å; Y496-E521 PolarHBondContact OH-O 2.72Å; E521-L523 PolarHBondContact O-N 3.05Å
522	T	98.1	Very high	93.9	Very high	29 Å²	29	43.2 Å²	43.2	18%	0.178	22%	0.219	C	C	.	.			trans	-61.7	129.7	176.4	-44.5	0	0	0	0	110.6	T421 E444 F524	T421-T522 HydrophobicContact CG2-CG2 3.96Å; T421-T522 WeakPolarHBondContact CG2-OG1 3.37Å; E444-T522 PolarHBondContact N-O 3.21Å; E444-T522 WeakPolarHBondContact OE2-CB 3.49Å; E444-T522 PolarHBondContact OE2-OG1 3.4Å; E444-T522 VanDerWaalsContact OE2-OG1 3.11Å; T522-F524 HydrophobicContact CG2-CD2 4.08Å; T522-F524 HydrophobicContact CG2-CE2 3.44Å; T522-F524 VanDerWaalsContact CG2-CE2 3.44Å; T522-F524 HydrophobicContact CG2-CZ 3.79Å
523	L	98.4	Very high	92.5	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	133.5	172.5	-62.3	-175.3	0	0	0	110.4	G419 F420 V441 A442 R443 W461 L494 Y496 F519 E521	G419-L523 CarbonylContact C-O 3.6Å; G419-L523 WeakPolarHBondContact CA-O 3.49Å; F420-L523 PolarHBondContact N-O 3.23Å; F420-L523 PolarHBondContact O-N 3.05Å; V441-L523 HydrophobicContact CG2-CD1 4.5Å; A442-L523 WeakPolarHBondContact O-CA 3.29Å; R443-L523 HydrophobicContact CB-CD2 4.49Å; R443-L523 HydrophobicContact CG-CD2 3.75Å; W461-L523 HydrophobicContact CE3-CD2 4.49Å; W461-L523 HydrophobicContact CH2-CD2 4.03Å; W461-L523 HydrophobicContact CZ3-CD1 4.5Å; W461-L523 HydrophobicContact CZ3-CD2 3.56Å; L494-L523 HydrophobicContact CD1-CD1 3.81Å; L494-L523 HydrophobicContact CD2-CB 4.35Å; L494-L523 HydrophobicContact CD2-CD1 4.38Å; Y496-L523 HydrophobicContact CD2-CD1 4.32Å; Y496-L523 HydrophobicContact CD2-CG 4.49Å; Y496-L523 HydrophobicContact CE2-CD1 4.29Å; Y496-L523 HydrophobicContact CE2-CG 4.08Å; F519-L523 HydrophobicContact CB-CD1 4.26Å; F519-L523 HydrophobicContact CD1-CD1 3.75Å; F519-L523 HydrophobicContact CD2-CD1 3.84Å; F519-L523 HydrophobicContact CE1-CD1 4.01Å; F519-L523 HydrophobicContact CE2-CD1 4.08Å; F519-L523 HydrophobicContact CG-CD1 3.68Å; F519-L523 HydrophobicContact CZ-CD1 4.2Å; E521-L523 PolarHBondContact O-N 3.05Å
524	F	98.4	Very high	91	Very high	27 Å²	27	47.7 Å²	47.7	12%	0.118	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	143.1	176.8	-71.2	-93.9	0	0	0	110.1	M415 G416 G419 V441 A442 E444 T522 Y526	M415-F524 HydrophobicContact CB-CB 4.26Å; M415-F524 HydrophobicContact CG-CB 4.49Å; M415-F524 HydrophobicContact SD-CB 3.89Å; M415-F524 HydrophobicContact SD-CD2 4.38Å; M415-F524 HydrophobicContact SD-CG 4.16Å; G416-F524 WeakPolarHBondContact O-CD1 3.46Å; G419-F524 VanDerWaalsContact N-CE1 3.33Å; V441-F524 CarbonylContact C-O 2.96Å; V441-F524 VanDerWaalsContact CA-O 3.27Å; V441-F524 WeakPolarHBondContact CA-O 3.36Å; A442-F524 PolarHBondContact N-O 3.34Å; A442-F524 PolarHBondContact O-N 3.28Å; E444-F524 HydrophobicContact CB-CD2 4.14Å; E444-F524 HydrophobicContact CB-CE2 3.77Å; E444-F524 HydrophobicContact CG-CE2 3.78Å; T522-F524 HydrophobicContact CG2-CD2 4.08Å; T522-F524 HydrophobicContact CG2-CE2 3.44Å; T522-F524 VanDerWaalsContact CG2-CE2 3.44Å; T522-F524 HydrophobicContact CG2-CZ 3.79Å; F524-Y526 PolarHBondContact O-N 2.89Å
525	P	98.3	Very high	89.6	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.5	134.5	163	-25.1	35.1	0	0	0	110.1	I372 M415 G416 Q418 F420 W427 G440 F527	I372-P525 HydrophobicContact CD1-CG 3.96Å; I372-P525 HydrophobicContact CG1-CG 4.37Å; I372-P525 HydrophobicContact CG2-CB 4.16Å; I372-P525 HydrophobicContact CG2-CG 4.04Å; M415-P525 CarbonylContact C-O 3.55Å; M415-P525 WeakPolarHBondContact CA-O 3.49Å; G416-P525 PolarHBondContact N-O 3.4Å; Q418-P525 VanDerWaalsContact O-CD 3.22Å; Q418-P525 WeakPolarHBondContact O-CD 3.18Å; F420-P525 HydrophobicContact CE2-CG 3.87Å; W427-P525 HydrophobicContact CD2-CG 4.49Å; W427-P525 HydrophobicContact CH2-CG 4.15Å; W427-P525 HydrophobicContact CZ2-CB 3.83Å; W427-P525 HydrophobicContact CZ2-CG 3.87Å; G440-P525 WeakPolarHBondContact O-CA 3.32Å; P525-F527 HydrophobicContact CB-CE2 3.59Å; P525-F527 HydrophobicContact CB-CZ 3.62Å
526	Y	98.1	Very high	88	Confident	1 Å²	1	51.4 Å²	51.4	0%	0.004	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	138.8	-178	174.5	-98.3	0	0	0	110.2	F408 S413 T438 V439 G440 A442 T454 F460 T462 F524 N528	F408-Y526 HydrophobicContact CE1-CE2 4.21Å; F408-Y526 HydrophobicContact CE2-CE2 4.34Å; F408-Y526 HydrophobicContact CZ-CD2 4.12Å; F408-Y526 AromaticContact CZ-CE2 3.67Å; F408-Y526 HydrophobicContact CZ-CE2 3.67Å; S413-Y526 PolarHBondContact OG-OH 3.26Å; S413-Y526 VanDerWaalsContact OG-OH 3.04Å; T438-Y526 HydrophobicContact CG2-CE1 4.17Å; V439-Y526 WeakPolarHBondContact CA-O 3.37Å; G440-Y526 PolarHBondContact N-O 2.89Å; G440-Y526 PolarHBondContact O-N 3.17Å; A442-Y526 HydrophobicContact CB-CD2 4.1Å; A442-Y526 HydrophobicContact CB-CG 4.12Å; T454-Y526 HydrophobicContact CG2-CE1 3.92Å; F460-Y526 HydrophobicContact CD1-CD1 4.32Å; F460-Y526 HydrophobicContact CD1-CD2 4.3Å; F460-Y526 HydrophobicContact CD1-CE1 4.3Å; F460-Y526 HydrophobicContact CD1-CE2 4.3Å; F460-Y526 HydrophobicContact CD1-CG 4.29Å; F460-Y526 AromaticContact CE1-CD2 3.93Å; F460-Y526 HydrophobicContact CE1-CD2 3.93Å; F460-Y526 HydrophobicContact CE1-CE1 4.41Å; F460-Y526 AromaticContact CE1-CE2 3.69Å; F460-Y526 HydrophobicContact CE1-CE2 3.69Å; F460-Y526 HydrophobicContact CE1-CG 4.38Å; F460-Y526 AromaticContact CE1-CZ 3.93Å; T462-Y526 HydrophobicContact CG2-CD1 3.66Å; T462-Y526 HydrophobicContact CG2-CE1 4.14Å; F524-Y526 PolarHBondContact O-N 2.89Å; Y526-N528 HydrophobicContact CE1-CB 3.97Å
527	F	96.9	Very high	86.6	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	140.6	-177.8	-46.1	-92.6	0	0	0	109.8	I372 F374 S413 L414 V429 T438 V439 P525 V543	I372-F527 HydrophobicContact CG2-CE2 4.43Å; I372-F527 HydrophobicContact CG2-CZ 4.05Å; F374-F527 AromaticContact CD1-CD2 3.79Å; F374-F527 HydrophobicContact CD1-CD2 3.79Å; F374-F527 AromaticContact CD1-CE2 3.78Å; F374-F527 HydrophobicContact CD1-CE2 3.78Å; F374-F527 HydrophobicContact CD1-CG 4.38Å; F374-F527 HydrophobicContact CD1-CZ 4.37Å; F374-F527 HydrophobicContact CE1-CB 4.41Å; F374-F527 AromaticContact CE1-CD1 3.89Å; F374-F527 HydrophobicContact CE1-CD1 3.89Å; F374-F527 AromaticContact CE1-CD2 3.5Å; F374-F527 HydrophobicContact CE1-CD2 3.5Å; F374-F527 VanDerWaalsContact CE1-CD2 3.5Å; F374-F527 AromaticContact CE1-CE1 3.92Å; F374-F527 HydrophobicContact CE1-CE1 3.92Å; F374-F527 AromaticContact CE1-CE2 3.54Å; F374-F527 HydrophobicContact CE1-CE2 3.54Å; F374-F527 AromaticContact CE1-CG 3.67Å; F374-F527 HydrophobicContact CE1-CG 3.67Å; F374-F527 AromaticContact CE1-CZ 3.76Å; F374-F527 HydrophobicContact CE1-CZ 3.76Å; S413-F527 VanDerWaalsContact CA-O 3.25Å; S413-F527 WeakPolarHBondContact CA-O 3.33Å; L414-F527 HydrophobicContact CD2-CB 3.69Å; L414-F527 HydrophobicContact CG-CB 4.42Å; L414-F527 PolarHBondContact N-O 3.29Å; L414-F527 PolarHBondContact O-N 3.16Å; L414-F527 VanDerWaalsContact O-N 3.11Å; V429-F527 HydrophobicContact CG1-CD1 4.45Å; V429-F527 HydrophobicContact CG1-CE1 4.44Å; V429-F527 HydrophobicContact CG2-CD1 4.34Å; V429-F527 HydrophobicContact CG2-CE1 3.7Å; T438-F527 CarbonylContact O-C 3.47Å; T438-F527 WeakPolarHBondContact O-CA 3.32Å; V439-F527 HydrophobicContact CG1-CD1 4.35Å; P525-F527 HydrophobicContact CB-CE2 3.59Å; P525-F527 HydrophobicContact CB-CZ 3.62Å; F527-V543 HydrophobicContact CE1-CG2 4.5Å; F527-V543 HydrophobicContact CZ-CG2 4.37Å
528	N	94.5	Very high	85.7	Confident	21 Å²	21	49 Å²	49	11%	0.112	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	132.8	176.2	171.9	-49.8	0	0	0	108.8	L412 S413 W437 T438 Y526 G530	L412-N528 VanDerWaalsContact O-CA 3.28Å; L412-N528 WeakPolarHBondContact O-CA 3.39Å; S413-N528 WeakPolarHBondContact OG-CB 3.27Å; S413-N528 PolarHBondContact OG-ND2 3.34Å; W437-N528 CarbonylContact C-O 3.55Å; W437-N528 WeakPolarHBondContact CA-O 3.37Å; T438-N528 PolarHBondContact N-O 3.37Å; T438-N528 PolarHBondContact O-N 3.49Å; Y526-N528 HydrophobicContact CE1-CB 3.97Å; N528-G530 VanDerWaalsContact C-N 3.27Å; N528-G530 PolarHBondContact O-N 3.45Å; N528-G530 WeakPolarHBondContact OD1-CA 3.45Å; N528-G530 PolarHBondContact OD1-N 2.89Å
529	L	91.6	Very high	84.9	Confident	9 Å²	9	48.8 Å²	48.8	5%	0.047	24%	0.244	C	C	.	.			trans	-87	8.8	-173.7	-75.1	73.1	0	0	0	113.3	L383 V392 L412 L414 V535 L541	L383-L529 HydrophobicContact CD1-CD1 4.28Å; L383-L529 HydrophobicContact CD2-CD1 3.89Å; L383-L529 HydrophobicContact CD2-CD2 3.81Å; L383-L529 HydrophobicContact CD2-CG 4.34Å; V392-L529 HydrophobicContact CG1-CD1 3.93Å; V392-L529 HydrophobicContact CG2-CD1 4.07Å; L412-L529 HydrophobicContact CB-CB 4.45Å; L412-L529 PolarHBondContact O-N 2.8Å; L414-L529 HydrophobicContact CD2-CD1 4.31Å; L529-V535 HydrophobicContact CB-CG2 3.76Å; L529-V535 HydrophobicContact CD2-CG2 4.29Å; L529-L541 HydrophobicContact CD1-CD1 3.94Å; L529-L541 HydrophobicContact CG-CD1 3.91Å; L529-L541 HydrophobicContact CG-CG 4.26Å
530	G	83.4	Confident	84.3	Confident	11 Å²	11	49.5 Å²	49.5	11%	0.113	25%	0.251	C	S	.	.			trans	86.8	-149	-178.9	0	0	0	0	0	113.8	N528	N528-G530 VanDerWaalsContact C-N 3.27Å; N528-G530 PolarHBondContact O-N 3.45Å; N528-G530 WeakPolarHBondContact OD1-CA 3.45Å; N528-G530 PolarHBondContact OD1-N 2.89Å
531	F	75.9	Confident	84.2	Confident	114 Å²	114	44.3 Å²	44.3	50%	0.5	22%	0.219	S	C	.	.			trans	-93.8	148	-174.4	-56.6	-73.9	0	0	0	112.4	V436 D533 K534 V535	V436-F531 HydrophobicContact CG1-CD2 4.43Å; F531-D533 VanDerWaalsContact C-N 3.26Å; F531-D533 WeakPolarHBondContact CB-OD1 3.18Å; F531-D533 PolarHBondContact O-N 3.41Å; F531-K534 PolarHBondContact O-N 3.2Å; F531-V535 WeakPolarHBondContact O-CB 3.17Å; F531-V535 PolarHBondContact O-N 3.03Å
532	L	67.4	Low	84.1	Confident	78 Å²	78	45.8 Å²	45.8	41%	0.408	23%	0.225	S	C	.	.	H	α-helix	trans	-59.3	-33.2	-177.3	-78.6	164.7	0	0	0	113.5	Y394 L412 K534 H536	Y394-L532 HydrophobicContact CD2-CD2 4.41Å; Y394-L532 HydrophobicContact CE2-CD2 3.48Å; Y394-L532 VanDerWaalsContact CE2-CD2 3.48Å; L412-L532 HydrophobicContact CD1-CD2 3.92Å; L412-L532 HydrophobicContact CD1-CG 4.13Å; L412-L532 HydrophobicContact CD2-CD2 4.09Å; L412-L532 HydrophobicContact CG-CD2 4.36Å; L532-K534 PolarHBondContact O-N 3.16Å; L532-H536 PolarHBondContact O-CD2 3.08Å; L532-H536 PolarHBondContact O-NE2 3.21Å
533	D	67.6	Low	83.8	Confident	98 Å²	98	44.8 Å²	44.8	52%	0.524	22%	0.219	S	C	.	.	H	α-helix	trans	-68.6	-18.6	-178.7	64.4	-36.8	0	0	0	113.8	F531	F531-D533 VanDerWaalsContact C-N 3.26Å; F531-D533 WeakPolarHBondContact CB-OD1 3.18Å; F531-D533 PolarHBondContact O-N 3.41Å
534	K	67.9	Low	83.4	Confident	68 Å²	68	47.1 Å²	47.1	30%	0.296	23%	0.229	S	C	.	.	H	α-helix	trans	-120.6	-17.2	-179.2	-68.5	-61.4	-176.9	-175.6	0	114.9	V436 Y467 F531 L532 H536 E537	V436-K534 HydrophobicContact CG1-CB 4.33Å; V436-K534 HydrophobicContact CG2-CB 3.85Å; Y467-K534 HydrophobicContact CD1-CG 4.36Å; Y467-K534 HydrophobicContact CE1-CG 4.26Å; F531-K534 PolarHBondContact O-N 3.2Å; L532-K534 PolarHBondContact O-N 3.16Å; K534-H536 PolarHBondContact O-N 2.93Å; K534-E537 PolarHBondContact O-N 2.59Å
535	V	68.6	Low	82.5	Confident	3 Å²	3	49.9 Å²	49.9	2%	0.018	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-24.3	-175.3	76.8	0	0	0	0	113.8	Y394 L412 L529 F531 E537 N538	Y394-V535 HydrophobicContact CD1-CG1 4.14Å; Y394-V535 HydrophobicContact CD2-CB 4.45Å; Y394-V535 HydrophobicContact CD2-CG1 3.37Å; Y394-V535 HydrophobicContact CD2-CG2 4.27Å; Y394-V535 HydrophobicContact CE2-CG1 3.77Å; Y394-V535 HydrophobicContact CG-CB 4.47Å; Y394-V535 HydrophobicContact CG-CG1 3.56Å; Y394-V535 HydrophobicContact CG-CG2 4.15Å; L412-V535 HydrophobicContact CD1-CB 4.1Å; L412-V535 HydrophobicContact CD1-CG1 3.85Å; L412-V535 HydrophobicContact CD1-CG2 4.1Å; L529-V535 HydrophobicContact CB-CG2 3.76Å; L529-V535 HydrophobicContact CD2-CG2 4.29Å; F531-V535 WeakPolarHBondContact O-CB 3.17Å; F531-V535 PolarHBondContact O-N 3.03Å; V535-E537 PolarHBondContact O-N 2.99Å; V535-N538 PolarHBondContact O-N 3.4Å; V535-N538 VanDerWaalsContact O-N 3.17Å
536	H	64.9	Low	81.1	Confident	122 Å²	122	51.8 Å²	51.8	57%	0.565	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-24.5	179.4	-62.5	-76.8	0	0	0	113.6	Y394 L532 K534	Y394-H536 AromaticContact CD1-ND1 3.65Å; Y394-H536 AromaticContact CE1-CE1 3.06Å; Y394-H536 WeakPolarHBondContact CE1-CE1 3.48Å; Y394-H536 AromaticContact CE1-ND1 3.09Å; Y394-H536 WeakPolarHBondContact CE1-ND1 3.33Å; Y394-H536 AromaticContact CZ-CE1 3.26Å; Y394-H536 AromaticContact CZ-ND1 3.76Å; Y394-H536 AromaticContact CZ-NE2 3.98Å; Y394-H536 PolarHBondContact OH-CE1 3.39Å; L532-H536 PolarHBondContact O-CD2 3.08Å; L532-H536 PolarHBondContact O-NE2 3.21Å; K534-H536 PolarHBondContact O-N 2.93Å
537	E	67.6	Low	79.3	Confident	139 Å²	139	61.8 Å²	61.8	65%	0.65	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-7.8	-179.9	-62.7	172.5	179.7	0	0	111.7	K534 V535	K534-E537 PolarHBondContact O-N 2.59Å; V535-E537 PolarHBondContact O-N 2.99Å
538	N	76.5	Confident	77.1	Confident	27 Å²	27	66.3 Å²	66.3	14%	0.144	32%	0.322	C	S	.	.	S	Bend	trans	-90.5	136.8	-174.7	-69.9	-13.1	0	0	0	111.6	T435 V436 V535	T435-N538 PolarHBondContact N-OD1 3.03Å; T435-N538 PolarHBondContact OG1-OD1 3.08Å; T435-N538 VanDerWaalsContact OG1-OD1 3.09Å; V436-N538 WeakPolarHBondContact CG2-ND2 3.43Å; V436-N538 PolarHBondContact O-ND2 3.4Å; V535-N538 PolarHBondContact O-N 3.4Å; V535-N538 VanDerWaalsContact O-N 3.17Å
539	E	80.3	Confident	76.3	Confident	105 Å²	105	68.6 Å²	68.6	49%	0.491	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-63.3	156.4	164.1	-75.4	-71.6	140.9	0	0	111.4	S433 S434	S433-E539 WeakPolarHBondContact OG-CB 3.46Å; S433-E539 WeakPolarHBondContact OG-CG 3.47Å; S434-E539 PolarHBondContact OG-O 2.79Å
540	P	85.7	Confident	75.5	Confident	33 Å²	33	71.7 Å²	71.7	21%	0.214	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-66	144	-179.4	24.6	-32.1	0	0	0	113.2	V392 R393	V392-P540 CarbonylContact O-C 3.49Å; V392-P540 VanDerWaalsContact O-CA 3.27Å; V392-P540 WeakPolarHBondContact O-CA 3.25Å; V392-P540 WeakPolarHBondContact O-CB 3.38Å; R393-P540 HydrophobicContact CB-CB 3.79Å
541	L	91.5	Very high	75	Confident	1 Å²	1	75.1 Å²	75.1	1%	0.005	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	130	168.7	-68.5	177.5	0	0	0	109.6	C391 V392 V429 V431 W437 L529	C391-L541 WeakPolarHBondContact CA-O 3.47Å; V392-L541 HydrophobicContact CG1-CB 3.75Å; V392-L541 PolarHBondContact N-O 3.27Å; V392-L541 PolarHBondContact O-N 3.01Å; V429-L541 HydrophobicContact CG1-CD2 4.49Å; V431-L541 HydrophobicContact CG1-CD2 3.87Å; W437-L541 HydrophobicContact CB-CD2 4.3Å; L529-L541 HydrophobicContact CD1-CD1 3.94Å; L529-L541 HydrophobicContact CG-CD1 3.91Å; L529-L541 HydrophobicContact CG-CG 4.26Å
542	K	93.4	Very high	75	Confident	75 Å²	75	72.8 Å²	72.8	33%	0.326	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	130.8	-178.9	-63	169.2	-166.3	164.8	0	109.7	T390 C391 V429 E430 F544	T390-K542 WeakPolarHBondContact O-CA 3.45Å; C391-K542 HydrophobicContact CB-CG 4.01Å; V429-K542 CarbonylContact C-O 3.56Å; V429-K542 WeakPolarHBondContact CA-O 3.49Å; E430-K542 HydrophobicContact CB-CB 4.26Å; E430-K542 HydrophobicContact CG-CB 4.46Å; E430-K542 PolarHBondContact N-O 3.36Å; E430-K542 WeakPolarHBondContact OE2-CD 3.4Å; K542-F544 PolarHBondContact O-N 2.93Å
543	V	93.4	Very high	75.4	Confident	8 Å²	8	72.4 Å²	72.4	5%	0.048	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	120.6	164	178.6	0	0	0	0	107	I372 F374 T390 F527 M545	I372-V543 HydrophobicContact CB-CG1 3.87Å; I372-V543 HydrophobicContact CB-CG2 4.31Å; I372-V543 HydrophobicContact CG2-CG2 4.29Å; F374-V543 HydrophobicContact CE1-CG2 3.87Å; F374-V543 HydrophobicContact CE2-CG2 4.19Å; F374-V543 HydrophobicContact CZ-CG2 3.64Å; T390-V543 PolarHBondContact O-N 2.95Å; F527-V543 HydrophobicContact CE1-CG2 4.5Å; F527-V543 HydrophobicContact CZ-CG2 4.37Å; V543-M545 PolarHBondContact O-N 3.48Å
544	F	89.2	Confident	76	Confident	49 Å²	49	70.7 Å²	70.7	22%	0.215	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	118.4	174	-179.7	-103.5	0	0	0	108.9	E428 E430 R489 K542 P546	E428-F544 HydrophobicContact CB-CB 3.84Å; E428-F544 HydrophobicContact CB-CD1 4.17Å; E428-F544 HydrophobicContact CB-CG 4.46Å; E428-F544 PolarHBondContact O-N 3.4Å; E428-F544 WeakPolarHBondContact OE2-CD1 3.35Å; E430-F544 HydrophobicContact CG-CB 4.07Å; E430-F544 HydrophobicContact CG-CD2 4.45Å; E430-F544 WeakPolarHBondContact OE1-CD2 3.28Å; R489-F544 VanDerWaalsContact CZ-CD2 3.47Å; K542-F544 PolarHBondContact O-N 2.93Å; F544-P546 HydrophobicContact CD1-CG 3.97Å; F544-P546 VanDerWaalsContact CE1-CA 3.45Å; F544-P546 HydrophobicContact CE1-CB 3.79Å; F544-P546 HydrophobicContact CE1-CG 3.7Å; F544-P546 HydrophobicContact CZ-CB 4.42Å
545	M	80.1	Confident	76.5	Confident	85 Å²	85	70.9 Å²	70.9	42%	0.419	34%	0.34	S	S	.	.			trans	-101.5	109.6	168.7	-70.9	-66	-72.9	0	0	106.3	A371 V543 K547	A371-M545 HydrophobicContact CB-CE 3.47Å; A371-M545 VanDerWaalsContact CB-CE 3.47Å; A371-M545 HydrophobicContact CB-SD 4.02Å; V543-M545 PolarHBondContact O-N 3.48Å; M545-K547 PolarHBondContact O-N 3.15Å
546	P	68.4	Low	77.1	Confident	41 Å²	41	76.2 Å²	76.2	27%	0.266	37%	0.365	S	S	.	.			trans	-55.1	110.1	175.6	-17.9	27	0	0	0	108.4	P369 F544 I548	P369-P546 HydrophobicContact CB-CG 3.9Å; P369-P546 HydrophobicContact CG-CG 4.07Å; F544-P546 HydrophobicContact CD1-CG 3.97Å; F544-P546 VanDerWaalsContact CE1-CA 3.45Å; F544-P546 HydrophobicContact CE1-CB 3.79Å; F544-P546 HydrophobicContact CE1-CG 3.7Å; F544-P546 HydrophobicContact CZ-CB 4.42Å; P546-I548 HydrophobicContact CB-CD1 4.01Å; P546-I548 HydrophobicContact CB-CG1 3.95Å; P546-I548 PolarHBondContact O-N 3.34Å; P546-I548 VanDerWaalsContact O-N 3.13Å
547	K	60.6	Low	78.2	Confident	210 Å²	210	72.3 Å²	72.3	91%	0.913	35%	0.348	S	S	*	.			trans	-70.6	106.8	167.6	-69.5	-175.3	-177.8	177.3	0	105.3	M545	M545-K547 PolarHBondContact O-N 3.15Å
548	I	51.2	Low	79.1	Confident	95 Å²	95	66.3 Å²	66.3	49%	0.487	32%	0.321	S	S	.	.			trans	-103.6	0	-175.2	-68.6	167.4	0	0	0	110.2	W358 K362 P546	W358-I548 HydrophobicContact CH2-CG2 3.6Å; W358-I548 HydrophobicContact CZ3-CG2 3.9Å; K362-I548 HydrophobicContact CD-CD1 3.99Å; K362-I548 HydrophobicContact CD-CG2 3.8Å; K362-I548 VanDerWaalsContact NZ-CB 3.33Å; K362-I548 VanDerWaalsContact NZ-CG2 3.26Å; P546-I548 HydrophobicContact CB-CD1 4.01Å; P546-I548 HydrophobicContact CB-CG1 3.95Å; P546-I548 PolarHBondContact O-N 3.34Å; P546-I548 VanDerWaalsContact O-N 3.13Å

Retrieved 548 of 548 residues in 331.6 ms (Link to these results)

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