A0A077Z998_TRITR Loading...

Peptidase M41 and AAA and FtsH ext domain contain ing protein

AlphaFold DB , UniProt , Accession A0A077Z998, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 738 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	35.8	Very low	34.1	Very low	238 Å²	238	164.7 Å²	164.7	100%	1.172	86%	0.858	S	S	*	*				0	85.9	0	-78.8	166.2	149.1	0	0	105.4
2	T	36.8	Very low	33.9	Very low	135 Å²	135	157.3 Å²	157.3	83%	0.828	85%	0.851	S	S	*	*				-148.8	124.2	66.1	-53.2	0	0	0	0	108.1
3	L	29.8	Very low	33.9	Very low	159 Å²	159	156.2 Å²	156.2	83%	0.832	85%	0.845	S	S	*	*			trans	-80.6	129.9	177.3	-88.1	121.8	0	0	0	109.9
4	F	37.1	Very low	33.5	Very low	192 Å²	192	162.4 Å²	162.4	84%	0.842	85%	0.85	S	S	*	*			trans	-121.9	106.8	150.4	-106.6	-86.4	0	0	0	108.7
5	S	29.2	Very low	33.4	Very low	90 Å²	90	165 Å²	165	63%	0.629	85%	0.846	S	S	*	*			trans	-89.2	123.4	171.9	-179.8	0	0	0	0	108.3
6	F	34.1	Very low	33.1	Very low	204 Å²	204	163.6 Å²	163.6	90%	0.895	85%	0.848	S	S	*	*			trans	-116.6	112.1	157.9	-120.4	-92.3	0	0	0	108.2
7	R	30	Very low	33	Very low	236 Å²	236	161 Å²	161	89%	0.891	84%	0.84	S	S	*	*			trans	-108.5	112.6	-179.6	-169.3	176.2	-178.2	171	0.6	107.3
8	G	37.1	Very low	32.7	Very low	75 Å²	75	157.6 Å²	157.6	77%	0.773	83%	0.831	S	S	*	*			trans	-125.2	121.6	172.6	0	0	0	0	0	111
9	R	32.9	Very low	32.7	Very low	244 Å²	244	154.8 Å²	154.8	92%	0.921	83%	0.825	S	S	*	*			trans	-55.8	131.8	-178.5	-74.8	170.7	-179	168.4	-0.2	112.6
10	A	33.9	Very low	32.6	Very low	86 Å²	86	157.8 Å²	157.8	71%	0.711	83%	0.825	S	S	*	*				61	108.5	84.2	0	0	0	0	0	116
11	T	38.1	Very low	32.7	Very low	153 Å²	153	159.4 Å²	159.4	94%	0.939	83%	0.826	S	S	*	*				-175	143.5	129.1	29.4	0	0	0	0	108.9
12	G	31.7	Very low	32.7	Very low	76 Å²	76	153 Å²	153	78%	0.784	81%	0.805	S	S	*	*			trans	-89.9	162.3	-154.3	0	0	0	0	0	116.8
13	N	33.4	Very low	33	Very low	143 Å²	143	151.8 Å²	151.8	77%	0.765	80%	0.802	S	S	*	*			trans	-151.4	133.4	145.3	-122.2	-7.1	0	0	0	109.3	Y15	N13-Y15 PolarHBondContact O-N 3.31Å
14	R	28.5	Very low	33.8	Very low	242 Å²	242	150.4 Å²	150.4	91%	0.913	80%	0.795	S	S	*	*			trans	-66.5	123	-177.6	-67.8	173.9	-178.3	170.2	-0.1	109.4
15	Y	32.3	Very low	34.6	Very low	202 Å²	202	144.9 Å²	144.9	79%	0.792	78%	0.777	S	S	*	*			trans	-122	105.6	159.8	-74.9	-80.5	0	0	0	108.9	N13 V17	N13-Y15 PolarHBondContact O-N 3.31Å; Y15-V17 PolarHBondContact O-N 3.28Å
16	T	28.9	Very low	35.6	Very low	143 Å²	143	144 Å²	144	88%	0.877	77%	0.77	S	S	*	*			trans	-67.2	102.4	163.2	-46.1	0	0	0	0	107.2	C18	T16-C18 PolarHBondContact O-N 2.83Å
17	V	30.8	Very low	36.2	Very low	119 Å²	119	144.6 Å²	144.6	72%	0.721	77%	0.772	S	S	*	*			trans	-83.3	107.1	169.5	177.6	0	0	0	0	107.2	Y15 C19	Y15-V17 PolarHBondContact O-N 3.28Å; V17-C19 PolarHBondContact O-N 2.96Å
18	C	28.9	Very low	37.7	Very low	100 Å²	100	137 Å²	137	68%	0.676	77%	0.767	S	S	*	*			trans	-71.3	103.5	169.5	-157	0	0	0	0	107.7	T16 Y20	T16-C18 PolarHBondContact O-N 2.83Å; C18-Y20 PolarHBondContact O-N 3.49Å; C18-Y20 VanDerWaalsContact O-N 3.11Å
19	C	31.8	Very low	38.4	Very low	105 Å²	105	138.8 Å²	138.8	71%	0.709	75%	0.754	S	S	*	*			trans	-73.1	95.1	171.6	-67.7	0	0	0	0	109.2	V17 F21	V17-C19 PolarHBondContact O-N 2.96Å; C19-F21 PolarHBondContact O-N 3.02Å
20	Y	30.9	Very low	39.4	Very low	214 Å²	214	129 Å²	129	84%	0.839	73%	0.729	S	S	*	*			trans	-90.8	82.6	156.1	-93.5	-89	0	0	0	108	C18	C18-Y20 PolarHBondContact O-N 3.49Å; C18-Y20 VanDerWaalsContact O-N 3.11Å
21	F	35.3	Very low	40.6	Very low	191 Å²	191	136.3 Å²	136.3	84%	0.838	74%	0.738	S	S	*	*			trans	-101.9	123.4	158.2	-94.2	-84.1	0	0	0	107.4	C19 S23	C19-F21 PolarHBondContact O-N 3.02Å; F21-S23 PolarHBondContact O-N 2.88Å
22	S	34.4	Very low	41.6	Very low	105 Å²	105	135.9 Å²	135.9	73%	0.734	72%	0.723	S	S	*	*			trans	-46.4	127.5	169.1	179.3	0	0	0	0	110	D24	S22-D24 VanDerWaalsContact C-N 3.26Å; S22-D24 PolarHBondContact O-N 3.42Å
23	S	43.1	Very low	42.5	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	71%	0.71	S	S	*	*			trans	-78.1	2	-170.1	46.1	0	0	0	0	114.9	F21	F21-S23 PolarHBondContact O-N 2.88Å
24	D	48.1	Very low	43.3	Very low	129 Å²	129	138.1 Å²	138.1	69%	0.69	72%	0.716	S	S	*	*			trans	-104.3	107.7	-169.9	-66.1	-14	0	0	0	111.8	S22	S22-D24 VanDerWaalsContact C-N 3.26Å; S22-D24 PolarHBondContact O-N 3.42Å
25	T	54.1	Low	44.3	Very low	76 Å²	76	130.1 Å²	130.1	47%	0.466	71%	0.71	S	S	.	*	P	Polyproline II helix	trans	-61	129.1	169.6	50	0	0	0	0	110.3	K27 Y33	T25-K27 PolarHBondContact O-N 3.03Å; T25-Y33 HydrophobicContact CG2-CD2 4.34Å; T25-Y33 HydrophobicContact CG2-CG 4.31Å
26	P	49.8	Very low	44.8	Very low	72 Å²	72	123.5 Å²	123.5	47%	0.468	70%	0.697	S	S	.	*	P	Polyproline II helix	trans	-61.2	135	176	19.8	-27.7	0	0	0	111.4	G28 F29	P26-G28 PolarHBondContact O-N 3.47Å; P26-F29 HydrophobicContact CG-CB 4.37Å; P26-F29 PolarHBondContact O-N 3.01Å; P26-F29 VanDerWaalsContact O-N 3.14Å
27	K	47.1	Very low	45.4	Very low	216 Å²	216	126.1 Å²	126.1	94%	0.939	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.1	122.7	179.7	-73.5	-177.3	178.5	177.9	0	110.1	T25	T25-K27 PolarHBondContact O-N 3.03Å
28	G	61.4	Low	45.9	Very low	77 Å²	77	125 Å²	125	79%	0.794	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	106.2	-13.8	-179.3	0	0	0	0	0	115.6	P26	P26-G28 PolarHBondContact O-N 3.47Å
29	F	51.2	Low	46.2	Very low	112 Å²	112	129.1 Å²	129.1	49%	0.491	71%	0.711	S	S	.	*			trans	-108.6	10.9	-177.6	-82.2	-92.8	0	0	0	115.1	P26 R31 F32 Y33	P26-F29 HydrophobicContact CG-CB 4.37Å; P26-F29 PolarHBondContact O-N 3.01Å; P26-F29 VanDerWaalsContact O-N 3.14Å; F29-R31 PolarHBondContact O-N 3.25Å; F29-F32 HydrophobicContact CB-CD2 4.35Å; F29-F32 AromaticContact CD1-CD2 3.57Å; F29-F32 HydrophobicContact CD1-CD2 3.57Å; F29-F32 HydrophobicContact CD1-CE2 4.03Å; F29-F32 HydrophobicContact CD1-CG 4.31Å; F29-F32 HydrophobicContact CE1-CD2 4.29Å; F29-F32 HydrophobicContact CE1-CE2 4.38Å; F29-F32 HydrophobicContact CG-CD2 4.32Å; F29-F32 PolarHBondContact O-N 3.24Å; F29-Y33 HydrophobicContact CB-CE2 4.31Å
30	G	54.1	Low	46.3	Very low	39 Å²	39	136.1 Å²	136.1	40%	0.402	72%	0.722	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.7	-15.9	-176.6	0	0	0	0	0	115.7
31	R	59.1	Low	46.6	Very low	240 Å²	240	134.9 Å²	134.9	91%	0.906	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-12	175.1	-68.4	-173.7	178.7	-176.2	-0.4	114.4	F29	F29-R31 PolarHBondContact O-N 3.25Å
32	F	58.2	Low	46.6	Very low	143 Å²	143	132.6 Å²	132.6	63%	0.627	72%	0.718	S	S	*	*	S	Bend	trans	-105.9	-3.4	-171.3	-61.3	-79.8	0	0	0	114	F29	F29-F32 HydrophobicContact CB-CD2 4.35Å; F29-F32 AromaticContact CD1-CD2 3.57Å; F29-F32 HydrophobicContact CD1-CD2 3.57Å; F29-F32 HydrophobicContact CD1-CE2 4.03Å; F29-F32 HydrophobicContact CD1-CG 4.31Å; F29-F32 HydrophobicContact CE1-CD2 4.29Å; F29-F32 HydrophobicContact CE1-CE2 4.38Å; F29-F32 HydrophobicContact CG-CD2 4.32Å; F29-F32 PolarHBondContact O-N 3.24Å
33	Y	51.2	Low	46.5	Very low	129 Å²	129	137 Å²	137	51%	0.506	73%	0.727	S	S	.	*	S	Bend	trans	-115.6	120.6	-179.5	-71.9	-89.5	0	0	0	110.6	T25 F29 G35	T25-Y33 HydrophobicContact CG2-CD2 4.34Å; T25-Y33 HydrophobicContact CG2-CG 4.31Å; F29-Y33 HydrophobicContact CB-CE2 4.31Å; Y33-G35 PolarHBondContact O-N 3.17Å
34	P	50	Low	46.2	Very low	137 Å²	137	137.5 Å²	137.5	89%	0.89	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	116.4	175	22.1	-19.3	0	0	0	109.4
35	G	49.3	Very low	45.3	Very low	75 Å²	75	136.3 Å²	136.3	77%	0.773	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	140.2	-7.7	180	0	0	0	0	0	115.8	Y33 E37	Y33-G35 PolarHBondContact O-N 3.17Å; G35-E37 VanDerWaalsContact C-N 3.33Å; G35-E37 PolarHBondContact O-N 3.45Å
36	A	42.9	Very low	44.4	Very low	63 Å²	63	142.6 Å²	142.6	52%	0.521	76%	0.757	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.7	12.9	-174.2	0	0	0	0	0	115.9
37	E	41.1	Very low	43.4	Very low	198 Å²	198	148.4 Å²	148.4	93%	0.925	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	10.6	-173.4	-71.2	-170.7	156.9	0	0	115.5	G35	G35-E37 VanDerWaalsContact C-N 3.33Å; G35-E37 PolarHBondContact O-N 3.45Å
38	A	41.4	Very low	42.7	Very low	94 Å²	94	147.6 Å²	147.6	78%	0.777	78%	0.777	S	S	*	*	S	Bend	trans	-105.4	-1.5	-172.5	0	0	0	0	0	117.2
39	E	36.6	Very low	41.1	Very low	187 Å²	187	153.9 Å²	153.9	87%	0.874	78%	0.783	S	S	*	*			trans	-129.6	75.5	-178	-72.2	-173.4	167.8	0	0	112.8
40	R	32.9	Very low	40.2	Very low	252 Å²	252	153.6 Å²	153.6	95%	0.951	80%	0.801	S	S	*	*			trans	-141.1	93.1	154.9	-73.2	-169.2	-172.8	179.8	2.2	109.2
41	K	36.7	Very low	39	Very low	188 Å²	188	159.8 Å²	159.8	82%	0.817	82%	0.82	S	S	*	*			trans	-127.2	121.4	160.7	-82.5	-172.1	176.1	-178.8	0	108.7
42	D	35.5	Very low	37.6	Very low	144 Å²	144	156.3 Å²	156.3	77%	0.77	81%	0.814	S	S	*	*			trans	59.4	99.1	146	-47.7	-34.8	0	0	0	118.7
43	E	33.6	Very low	36.4	Very low	196 Å²	196	155.3 Å²	155.3	92%	0.916	83%	0.825	S	S	*	*				-172.7	148.7	126.2	-103.5	177.7	-176.5	0	0	112.7
44	P	35.5	Very low	35.4	Very low	120 Å²	120	153.8 Å²	153.8	78%	0.779	84%	0.839	S	S	*	*			trans	-91.9	148.1	-160.6	35.8	-32.9	0	0	0	114.3
45	A	30.5	Very low	34.7	Very low	105 Å²	105	156.5 Å²	156.5	87%	0.868	84%	0.84	S	S	*	*			trans	-66.9	127.3	176.1	0	0	0	0	0	112.6
46	K	34	Very low	34	Very low	207 Å²	207	158.5 Å²	158.5	90%	0.9	84%	0.839	S	S	*	*			trans	-104.2	120.3	160	-83.1	-175.8	175.6	-179.5	0	109.5
47	E	29.1	Very low	33.6	Very low	195 Å²	195	161 Å²	161	91%	0.911	85%	0.853	S	S	*	*			trans	-71.6	133.1	160.2	-70.4	178	143.3	0	0	109.3
48	E	31.7	Very low	33.1	Very low	198 Å²	198	159.8 Å²	159.8	93%	0.925	85%	0.847	S	S	*	*			trans	-140.5	119.4	154.9	-112.5	175	-166.3	0	0	109.3
49	K	27.8	Very low	32.7	Very low	210 Å²	210	164.5 Å²	164.5	91%	0.913	85%	0.85	S	S	*	*			trans	-82.7	135.1	165.2	-74.5	176	174.3	176.3	0	108.2
50	A	33.7	Very low	32.5	Very low	106 Å²	106	160.6 Å²	160.6	88%	0.876	85%	0.85	S	S	*	*			trans	-154.4	136.5	152	0	0	0	0	0	111.3
51	E	28.1	Very low	32.4	Very low	168 Å²	168	153.3 Å²	153.3	79%	0.785	84%	0.843	S	S	*	*			trans	-82.2	162.3	-174.6	-80.6	174.2	122.4	0	0	114
52	Q	30.4	Very low	32.1	Very low	167 Å²	167	148.2 Å²	148.2	78%	0.78	84%	0.844	S	S	*	*			trans	69.5	108.8	147	-71.8	163.6	30.9	0	0	120.3
53	S	33.3	Very low	31.8	Very low	123 Å²	123	150.5 Å²	150.5	86%	0.86	85%	0.85	S	S	*	*				-170.6	120.7	121.4	56	0	0	0	0	111.2
54	A	30	Very low	31.7	Very low	97 Å²	97	150.5 Å²	150.5	80%	0.802	85%	0.85	S	S	*	*			trans	-88.7	144.4	169	0	0	0	0	0	110.6
55	Q	35.2	Very low	31.6	Very low	194 Å²	194	151.8 Å²	151.8	91%	0.907	85%	0.85	S	S	*	*			trans	171.5	158.9	132.2	-95.7	-168	-0.4	0	0	112.5
56	P	33.2	Very low	31.5	Very low	116 Å²	116	152.9 Å²	152.9	75%	0.753	85%	0.849	S	S	*	*				-127.8	167.3	-127.4	41.8	-27	0	0	0	116.3
57	S	35.3	Very low	31.4	Very low	117 Å²	117	146.7 Å²	146.7	82%	0.818	83%	0.832	S	S	*	*			trans	-168.2	109.4	157.7	51.4	0	0	0	0	108.9
58	E	30.5	Very low	31.5	Very low	171 Å²	171	144.3 Å²	144.3	80%	0.799	83%	0.825	S	S	*	*				75	99.4	60.3	-145.7	-169.7	-122.6	0	0	114.3
59	K	33.1	Very low	31.5	Very low	193 Å²	193	146.8 Å²	146.8	84%	0.839	83%	0.826	S	S	*	*				175.5	147.1	111.4	-93.7	175.4	-177	176.8	0	114.9
60	A	32.3	Very low	31.7	Very low	106 Å²	106	144.7 Å²	144.7	88%	0.876	82%	0.82	S	S	*	*			trans	93.4	62.8	165.1	0	0	0	0	0	118.7
61	A	29.9	Very low	31.7	Very low	99 Å²	99	142.2 Å²	142.2	82%	0.818	80%	0.804	S	S	*	*			trans	-105.3	128.5	151.2	0	0	0	0	0	108.9
62	G	32.3	Very low	31.8	Very low	81 Å²	81	143.4 Å²	143.4	84%	0.835	81%	0.808	S	S	*	*			trans	-74.4	135.8	170.6	0	0	0	0	0	111.1
63	E	27.8	Very low	31.9	Very low	192 Å²	192	145.1 Å²	145.1	90%	0.897	81%	0.813	S	S	*	*			trans	-62.4	125.8	-173.9	-66.1	157.8	123.1	0	0	113.6
64	Q	32.6	Very low	31.8	Very low	196 Å²	196	147.6 Å²	147.6	92%	0.916	81%	0.808	S	S	*	*			trans	-141.3	118.4	145.2	-75.4	-168.5	-16.7	0	0	109.8
65	N	32	Very low	31.9	Very low	146 Å²	146	154.2 Å²	154.2	78%	0.781	81%	0.812	S	S	*	*			trans	-57.2	141.4	-173	-102.5	-31.9	0	0	0	114.7	S67	N65-S67 PolarHBondContact O-N 3.03Å
66	P	28.5	Very low	32.3	Very low	129 Å²	129	150.7 Å²	150.7	84%	0.838	81%	0.806	S	S	*	*	S	Bend	trans	-89	81.1	169.3	34.4	-28.5	0	0	0	110.3
67	S	31.8	Very low	32.3	Very low	77 Å²	77	151.1 Å²	151.1	54%	0.538	81%	0.809	S	S	.	*			trans	-130.9	-0.7	172.2	56.2	0	0	0	0	115.3	N65	N65-S67 PolarHBondContact O-N 3.03Å
68	D	31.4	Very low	32.1	Very low	145 Å²	145	155.4 Å²	155.4	78%	0.775	81%	0.813	S	S	*	*	G	3₁₀ helix	trans	-103.3	15.7	-166.9	-77.5	-2.2	0	0	0	116.3
69	W	31.4	Very low	32.4	Very low	249 Å²	249	151.4 Å²	151.4	94%	0.943	81%	0.81	S	S	*	*	G	3₁₀ helix	trans	-88	3.1	172.3	-91.6	69.9	0	0	0	114.7
70	Q	33.3	Very low	32.3	Very low	166 Å²	166	151.2 Å²	151.2	78%	0.776	81%	0.812	S	S	*	*	G	3₁₀ helix	trans	-92.3	4.4	175.5	-77.4	179.5	-8.3	0	0	114.4
71	G	32.7	Very low	32.4	Very low	54 Å²	54	152.4 Å²	152.4	56%	0.557	81%	0.808	S	S	*	*	S	Bend	trans	-90.1	-17.3	-178.8	0	0	0	0	0	115.9	F73	G71-F73 VanDerWaalsContact C-N 3.33Å; G71-F73 PolarHBondContact O-N 3.03Å
72	F	31	Very low	32.3	Very low	194 Å²	194	159.1 Å²	159.1	85%	0.851	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-8.7	-169.2	-134.4	-95.8	0	0	0	114.6
73	F	31.5	Very low	32.5	Very low	203 Å²	203	161.7 Å²	161.7	89%	0.89	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.9	14.4	-179	-81.1	-76.6	0	0	0	114.6	G71	G71-F73 VanDerWaalsContact C-N 3.33Å; G71-F73 PolarHBondContact O-N 3.03Å
74	K	32.7	Very low	32.7	Very low	175 Å²	175	156.7 Å²	156.7	76%	0.761	81%	0.812	S	S	*	*			trans	-99.5	113.8	178	-78.5	-178.4	178.6	173.7	0	112.1
75	R	32.1	Very low	32.8	Very low	235 Å²	235	151 Å²	151	89%	0.887	81%	0.805	S	S	*	*			trans	-35.2	137.1	173.7	-65	170	164.4	178.5	-6.7	113.6
76	P	42.1	Very low	32.9	Very low	121 Å²	121	150.7 Å²	150.7	79%	0.786	81%	0.811	S	S	*	*			trans	-70.4	143.7	170.5	30.4	-31.2	0	0	0	110.1	F78	P76-F78 PolarHBondContact O-N 3.38Å
77	P	34	Very low	33.2	Very low	125 Å²	125	148.6 Å²	148.6	81%	0.812	81%	0.813	S	S	*	*			trans	-80	119.9	-178.6	32	-30.2	0	0	0	109.7	A79	P77-A79 PolarHBondContact O-N 2.93Å
78	F	31	Very low	33.1	Very low	206 Å²	206	149 Å²	149	90%	0.904	83%	0.83	S	S	*	*			trans	-81.3	98.4	168.8	-160.1	-95.4	0	0	0	108.3	P76 Q80	P76-F78 PolarHBondContact O-N 3.38Å; F78-Q80 PolarHBondContact O-N 2.87Å
79	A	36.3	Very low	33.2	Very low	88 Å²	88	146 Å²	146	73%	0.727	83%	0.833	S	S	*	*			trans	-79.3	113.3	176.7	0	0	0	0	0	110.9	P77	P77-A79 PolarHBondContact O-N 2.93Å
80	Q	31.9	Very low	33.2	Very low	188 Å²	188	138.2 Å²	138.2	88%	0.879	83%	0.83	S	S	*	*			trans	-6.8	112.8	160.4	-74.4	162.9	-51.9	0	0	117.9	F78	F78-Q80 PolarHBondContact O-N 2.87Å
81	V	34.6	Very low	33.7	Very low	131 Å²	131	138.6 Å²	138.6	79%	0.794	83%	0.832	S	S	*	*			trans	-105.2	119.7	147.4	175.9	0	0	0	0	107.8
82	R	27.8	Very low	34.5	Very low	240 Å²	240	140.9 Å²	140.9	91%	0.906	84%	0.837	S	S	*	*			trans	-69.2	122.8	174.2	-80.6	173.9	155.5	169.4	-6.2	110.3
83	T	36	Very low	35.3	Very low	136 Å²	136	137.2 Å²	137.2	83%	0.834	83%	0.826	S	S	*	*			trans	-148.5	118.4	149	43.5	0	0	0	0	108.5
84	G	31.2	Very low	36.8	Very low	87 Å²	87	130.3 Å²	130.3	90%	0.897	80%	0.799	S	S	*	*			trans	-80.8	158.1	177.1	0	0	0	0	0	112.9
85	G	34.7	Very low	38.2	Very low	75 Å²	75	131 Å²	131	77%	0.773	80%	0.796	S	S	*	*			trans	144	118.1	170.3	0	0	0	0	0	112.3
86	P	35.6	Very low	40.1	Very low	140 Å²	140	128.2 Å²	128.2	91%	0.909	79%	0.786	S	S	*	*			trans	-95.2	149.2	-167.4	36.2	-32.1	0	0	0	114
87	G	33.6	Very low	41.1	Very low	85 Å²	85	125.5 Å²	125.5	88%	0.876	77%	0.765	S	S	*	*			trans	138.6	118	169.2	0	0	0	0	0	109.6
88	G	30.5	Very low	42.6	Very low	87 Å²	87	127.5 Å²	127.5	90%	0.897	76%	0.761	S	S	*	*			cis	128	102.1	25.5	0	0	0	0	0	106.5
89	G	32.4	Very low	44.4	Very low	82 Å²	82	120.5 Å²	120.5	85%	0.845	74%	0.737	S	S	*	*			trans	158	112.2	176.3	0	0	0	0	0	113.1
90	G	32.9	Very low	46.2	Very low	85 Å²	85	118.6 Å²	118.6	88%	0.876	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-76.9	151.2	-167.1	0	0	0	0	0	116.8
91	E	44	Very low	48.2	Very low	173 Å²	173	114.3 Å²	114.3	81%	0.808	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-95	141.4	170.9	-100.5	-177.8	110.2	0	0	111.6
92	P	49	Very low	50	Low	102 Å²	102	111 Å²	111	66%	0.662	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-80.4	141.9	177.7	32.6	-31.9	0	0	0	112.1	N94	P92-N94 PolarHBondContact O-N 3.17Å
93	D	47.2	Very low	52.5	Low	118 Å²	118	104.6 Å²	104.6	63%	0.631	67%	0.673	S	S	*	*			trans	-68.9	110.1	-175.1	-163.7	8.2	0	0	0	112.4	R95	D93-R95 VanDerWaalsContact C-N 3.3Å; D93-R95 PolarHBondContact O-N 3.26Å; D93-R95 WeakPolarHBondContact OD1-CD 3.2Å; D93-R95 WeakPolarHBondContact OD1-CG 3.36Å; D93-R95 VanDerWaalsContact OD2-CD 3.26Å; D93-R95 WeakPolarHBondContact OD2-CD 3.34Å
94	N	63.5	Low	54.5	Low	58 Å²	58	99.7 Å²	99.7	31%	0.31	65%	0.65	S	S	.	*			trans	-86.7	19.8	-176.3	-73.7	-44.4	0	0	0	114.2	P92 W96 L97 R224	P92-N94 PolarHBondContact O-N 3.17Å; N94-W96 VanDerWaalsContact C-N 3.3Å; N94-W96 PolarHBondContact O-N 3.43Å; N94-L97 PolarHBondContact O-N 3.11Å; N94-R224 PolarHBondContact ND2-NH2 3.34Å
95	R	62.6	Low	56.6	Low	188 Å²	188	98.6 Å²	98.6	71%	0.709	63%	0.633	S	S	*	*	H	α-helix	trans	-63	-29.3	-175.6	-74.3	170	92.3	-179.4	5.8	114.6	D93 L97 F98 S99	D93-R95 VanDerWaalsContact C-N 3.3Å; D93-R95 PolarHBondContact O-N 3.26Å; D93-R95 WeakPolarHBondContact OD1-CD 3.2Å; D93-R95 WeakPolarHBondContact OD1-CG 3.36Å; D93-R95 VanDerWaalsContact OD2-CD 3.26Å; D93-R95 WeakPolarHBondContact OD2-CD 3.34Å; R95-L97 VanDerWaalsContact C-N 3.3Å; R95-L97 PolarHBondContact O-N 3.09Å; R95-F98 PolarHBondContact O-N 3.18Å; R95-S99 PolarHBondContact O-N 2.98Å
96	W	71.1	Confident	58.5	Low	178 Å²	178	98.2 Å²	98.2	67%	0.674	62%	0.618	S	S	*	*	H	α-helix	trans	-68.8	-27.3	-179.6	84.8	-83.2	0	0	0	113.6	N94 S99 A100	N94-W96 VanDerWaalsContact C-N 3.3Å; N94-W96 PolarHBondContact O-N 3.43Å; W96-S99 WeakPolarHBondContact CA-OG 3.35Å; W96-S99 PolarHBondContact O-OG 3.18Å; W96-A100 PolarHBondContact O-N 3.16Å; W96-A100 VanDerWaalsContact O-N 3.07Å
97	L	63.2	Low	60.4	Low	64 Å²	64	97.2 Å²	97.2	34%	0.335	60%	0.603	S	S	.	*	H	α-helix	trans	-74.2	-38.6	179.3	-107.8	144.1	0	0	0	111.2	N94 R95 S99 A100 V101	N94-L97 PolarHBondContact O-N 3.11Å; R95-L97 VanDerWaalsContact C-N 3.3Å; R95-L97 PolarHBondContact O-N 3.09Å; L97-S99 VanDerWaalsContact C-N 3.34Å; L97-A100 PolarHBondContact O-N 2.61Å; L97-V101 WeakPolarHBondContact O-CG2 3.45Å; L97-V101 PolarHBondContact O-N 2.78Å; L97-V101 VanDerWaalsContact O-N 3.15Å
98	F	65.4	Low	62.4	Low	167 Å²	167	95.3 Å²	95.3	73%	0.732	58%	0.579	S	S	*	*	H	α-helix	trans	-64.7	-37.3	173.2	-81	-78.5	0	0	0	112.2	R95 S102	R95-F98 PolarHBondContact O-N 3.18Å; F98-S102 PolarHBondContact O-N 3.31Å; F98-S102 PolarHBondContact O-OG 3.17Å
99	S	69.4	Low	64.5	Low	58 Å²	58	94 Å²	94	41%	0.406	56%	0.559	S	S	.	*	H	α-helix	trans	-71	-34.9	175.8	57.2	0	0	0	0	113	R95 W96 L97 S102 I103	R95-S99 PolarHBondContact O-N 2.98Å; W96-S99 WeakPolarHBondContact CA-OG 3.35Å; W96-S99 PolarHBondContact O-OG 3.18Å; L97-S99 VanDerWaalsContact C-N 3.34Å; S99-S102 PolarHBondContact O-OG 3.27Å; S99-I103 WeakPolarHBondContact O-CD1 3.27Å; S99-I103 VanDerWaalsContact O-CG1 3.27Å; S99-I103 WeakPolarHBondContact O-CG1 3.48Å; S99-I103 PolarHBondContact O-N 3.13Å; S99-I103 VanDerWaalsContact O-N 3.15Å
100	A	74.4	Confident	66.7	Low	49 Å²	49	95.7 Å²	95.7	41%	0.405	55%	0.548	S	S	.	.	H	α-helix	trans	-66.2	-41.1	175.9	0	0	0	0	0	112.5	W96 L97 G104	W96-A100 PolarHBondContact O-N 3.16Å; W96-A100 VanDerWaalsContact O-N 3.07Å; L97-A100 PolarHBondContact O-N 2.61Å; A100-G104 PolarHBondContact O-N 3.44Å; A100-G104 VanDerWaalsContact O-N 3.1Å
101	V	74.3	Confident	68.8	Low	98 Å²	98	95.5 Å²	95.5	59%	0.594	53%	0.53	S	S	*	.	H	α-helix	trans	-67.8	-40	178.1	174.4	0	0	0	0	111.6	L97 G104 A105	L97-V101 WeakPolarHBondContact O-CG2 3.45Å; L97-V101 PolarHBondContact O-N 2.78Å; L97-V101 VanDerWaalsContact O-N 3.15Å; V101-G104 PolarHBondContact O-N 3.49Å; V101-A105 WeakPolarHBondContact O-CB 3.05Å; V101-A105 PolarHBondContact O-N 3.45Å
102	S	72	Confident	70.2	Confident	62 Å²	62	89.9 Å²	89.9	43%	0.434	51%	0.507	S	S	.	.	H	α-helix	trans	-68.2	-37.8	179	66.3	0	0	0	0	112.9	F98 S99 S106	F98-S102 PolarHBondContact O-N 3.31Å; F98-S102 PolarHBondContact O-OG 3.17Å; S99-S102 PolarHBondContact O-OG 3.27Å; S102-S106 WeakPolarHBondContact O-CB 3.38Å; S102-S106 PolarHBondContact O-N 2.87Å; S102-S106 PolarHBondContact O-OG 3.45Å
103	I	80.1	Confident	71.4	Confident	104 Å²	104	90.1 Å²	90.1	53%	0.533	50%	0.502	S	S	.	.	H	α-helix	trans	-64.4	-45.4	173.7	-68.8	164.3	0	0	0	110.6	S99 A105 S106 M107	S99-I103 WeakPolarHBondContact O-CD1 3.27Å; S99-I103 VanDerWaalsContact O-CG1 3.27Å; S99-I103 WeakPolarHBondContact O-CG1 3.48Å; S99-I103 PolarHBondContact O-N 3.13Å; S99-I103 VanDerWaalsContact O-N 3.15Å; I103-A105 PolarHBondContact O-N 3.3Å; I103-S106 PolarHBondContact O-N 2.91Å; I103-M107 PolarHBondContact O-N 3.23Å
104	G	76.8	Confident	72.8	Confident	34 Å²	34	93.4 Å²	93.4	35%	0.351	51%	0.507	S	S	.	.	H	α-helix	trans	-60.2	-43.8	177.7	0	0	0	0	0	113.1	A100 V101 M107 A108	A100-G104 PolarHBondContact O-N 3.44Å; A100-G104 VanDerWaalsContact O-N 3.1Å; V101-G104 PolarHBondContact O-N 3.49Å; G104-M107 PolarHBondContact O-N 3.48Å; G104-A108 PolarHBondContact O-N 2.81Å; G104-A108 VanDerWaalsContact O-N 3.08Å
105	A	75.4	Confident	73.3	Confident	63 Å²	63	98.4 Å²	98.4	52%	0.521	52%	0.523	S	S	.	.	H	α-helix	trans	-64.5	-39.1	175.8	0	0	0	0	0	112.4	V101 I103 A108 A109	V101-A105 WeakPolarHBondContact O-CB 3.05Å; V101-A105 PolarHBondContact O-N 3.45Å; I103-A105 PolarHBondContact O-N 3.3Å; A105-A108 PolarHBondContact O-N 2.95Å; A105-A109 WeakPolarHBondContact O-CB 3.2Å; A105-A109 PolarHBondContact O-N 3.35Å
106	S	74.5	Confident	73.7	Confident	68 Å²	68	96 Å²	96	48%	0.476	52%	0.515	S	S	.	.	H	α-helix	trans	-65.9	-42.9	178.4	-55.6	0	0	0	0	111.7	S102 I103 A109 I110	S102-S106 WeakPolarHBondContact O-CB 3.38Å; S102-S106 PolarHBondContact O-N 2.87Å; S102-S106 PolarHBondContact O-OG 3.45Å; I103-S106 PolarHBondContact O-N 2.91Å; S106-A109 PolarHBondContact O-N 3.4Å; S106-I110 VanDerWaalsContact O-CG1 3.31Å; S106-I110 WeakPolarHBondContact O-CG1 3Å; S106-I110 PolarHBondContact O-N 3.12Å
107	M	77.2	Confident	73.9	Confident	119 Å²	119	92.4 Å²	92.4	59%	0.586	51%	0.508	S	S	*	.	H	α-helix	trans	-63.7	-42.7	174.7	-73.3	-165	-46	0	0	112.1	I103 G104 A109 I110 V111	I103-M107 PolarHBondContact O-N 3.23Å; G104-M107 PolarHBondContact O-N 3.48Å; M107-A109 VanDerWaalsContact C-N 3.32Å; M107-A109 PolarHBondContact O-N 2.86Å; M107-I110 PolarHBondContact O-N 3.18Å; M107-V111 WeakPolarHBondContact O-CG2 3.42Å; M107-V111 PolarHBondContact O-N 2.97Å
108	A	75.5	Confident	74.5	Confident	45 Å²	45	90.9 Å²	90.9	37%	0.372	51%	0.508	S	S	.	.	H	α-helix	trans	-61.5	-42	177.1	0	0	0	0	0	111.6	G104 A105 I110 V111 V112	G104-A108 PolarHBondContact O-N 2.81Å; G104-A108 VanDerWaalsContact O-N 3.08Å; A105-A108 PolarHBondContact O-N 2.95Å; A108-I110 PolarHBondContact O-N 3.22Å; A108-V111 PolarHBondContact O-N 3.47Å; A108-V112 WeakPolarHBondContact O-CG2 3.46Å; A108-V112 PolarHBondContact O-N 2.77Å
109	A	74.9	Confident	75.4	Confident	59 Å²	59	86.4 Å²	86.4	49%	0.488	49%	0.487	S	S	.	.	H	α-helix	trans	-62.7	-40.6	175.6	0	0	0	0	0	112.5	A105 S106 M107 V112 L113	A105-A109 WeakPolarHBondContact O-CB 3.2Å; A105-A109 PolarHBondContact O-N 3.35Å; S106-A109 PolarHBondContact O-N 3.4Å; M107-A109 VanDerWaalsContact C-N 3.32Å; M107-A109 PolarHBondContact O-N 2.86Å; A109-V112 PolarHBondContact O-N 3.4Å; A109-L113 VanDerWaalsContact O-CB 3.31Å; A109-L113 WeakPolarHBondContact O-CB 3.42Å; A109-L113 PolarHBondContact O-N 3.01Å
110	I	77	Confident	76.1	Confident	117 Å²	117	88.1 Å²	88.1	60%	0.6	48%	0.484	S	S	*	.	H	α-helix	trans	-64.3	-42.8	176.4	-69.3	165.1	0	0	0	111.1	S106 M107 A108 L113 Y114	S106-I110 VanDerWaalsContact O-CG1 3.31Å; S106-I110 WeakPolarHBondContact O-CG1 3Å; S106-I110 PolarHBondContact O-N 3.12Å; M107-I110 PolarHBondContact O-N 3.18Å; A108-I110 PolarHBondContact O-N 3.22Å; I110-L113 PolarHBondContact O-N 3.2Å; I110-Y114 WeakPolarHBondContact O-CB 3.42Å; I110-Y114 PolarHBondContact O-N 3.08Å
111	V	77.3	Confident	76.7	Confident	82 Å²	82	91.7 Å²	91.7	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-62.8	-45.1	177	172.8	0	0	0	0	110.8	M107 A108 Y114 Y115	M107-V111 WeakPolarHBondContact O-CG2 3.42Å; M107-V111 PolarHBondContact O-N 2.97Å; A108-V111 PolarHBondContact O-N 3.47Å; V111-Y114 PolarHBondContact O-N 3.1Å; V111-Y115 HydrophobicContact CG1-CD2 4.13Å; V111-Y115 HydrophobicContact CG1-CE2 4.25Å; V111-Y115 WeakPolarHBondContact O-CD2 3.43Å; V111-Y115 PolarHBondContact O-N 2.77Å; V111-Y115 VanDerWaalsContact O-N 3.09Å
112	V	73.1	Confident	77.4	Confident	54 Å²	54	87.4 Å²	87.4	33%	0.327	47%	0.466	S	S	.	.	H	α-helix	trans	-62.4	-45.4	176.8	172.2	0	0	0	0	110.9	A108 A109 Y114 Y115 Y116 V206	A108-V112 WeakPolarHBondContact O-CG2 3.46Å; A108-V112 PolarHBondContact O-N 2.77Å; A109-V112 PolarHBondContact O-N 3.4Å; V112-Y114 VanDerWaalsContact C-N 3.32Å; V112-Y114 PolarHBondContact O-N 3.2Å; V112-Y115 PolarHBondContact O-N 3.4Å; V112-Y116 HydrophobicContact CG1-CD2 3.7Å; V112-Y116 HydrophobicContact CG1-CE2 3.67Å; V112-Y116 WeakPolarHBondContact O-CD2 3.13Å; V112-Y116 PolarHBondContact O-N 2.91Å; V112-V206 HydrophobicContact CG2-CG2 4.45Å
113	L	74.3	Confident	78.3	Confident	108 Å²	108	88.4 Å²	88.4	57%	0.565	47%	0.47	S	S	*	.	H	α-helix	trans	-62	-40.2	178.5	-168	71.5	0	0	0	111.7	A109 I110 Y115 Y116 L117	A109-L113 VanDerWaalsContact O-CB 3.31Å; A109-L113 WeakPolarHBondContact O-CB 3.42Å; A109-L113 PolarHBondContact O-N 3.01Å; I110-L113 PolarHBondContact O-N 3.2Å; L113-Y115 PolarHBondContact O-N 2.73Å; L113-Y116 PolarHBondContact O-N 2.75Å; L113-L117 HydrophobicContact CD2-CD1 4.42Å; L113-L117 HydrophobicContact CG-CD1 3.95Å; L113-L117 HydrophobicContact CG-CG 4.44Å; L113-L117 WeakPolarHBondContact O-CB 3.4Å; L113-L117 WeakPolarHBondContact O-CD1 3.43Å; L113-L117 WeakPolarHBondContact O-CG 3.48Å; L113-L117 PolarHBondContact O-N 2.95Å
114	Y	77	Confident	78.6	Confident	187 Å²	187	87 Å²	87	73%	0.733	46%	0.458	S	S	*	.	H	α-helix	trans	-62	-41.6	175.9	-172.6	-97.8	0	0	0	112.2	I110 V111 V112 L117	I110-Y114 WeakPolarHBondContact O-CB 3.42Å; I110-Y114 PolarHBondContact O-N 3.08Å; V111-Y114 PolarHBondContact O-N 3.1Å; V112-Y114 VanDerWaalsContact C-N 3.32Å; V112-Y114 PolarHBondContact O-N 3.2Å; Y114-L117 PolarHBondContact O-N 3.32Å
115	Y	73.3	Confident	79.1	Confident	162 Å²	162	93 Å²	93	64%	0.635	47%	0.474	S	S	*	.	H	α-helix	trans	-64.6	-41	175.2	-94.9	-84.9	0	0	0	112.8	V111 V112 L113 Y119	V111-Y115 HydrophobicContact CG1-CD2 4.13Å; V111-Y115 HydrophobicContact CG1-CE2 4.25Å; V111-Y115 WeakPolarHBondContact O-CD2 3.43Å; V111-Y115 PolarHBondContact O-N 2.77Å; V111-Y115 VanDerWaalsContact O-N 3.09Å; V112-Y115 PolarHBondContact O-N 3.4Å; L113-Y115 PolarHBondContact O-N 2.73Å; Y115-Y119 VanDerWaalsContact O-CD2 3.28Å; Y115-Y119 WeakPolarHBondContact O-CD2 3.43Å
116	Y	71.4	Confident	79.7	Confident	138 Å²	138	92.8 Å²	92.8	54%	0.541	46%	0.463	S	S	.	.	H	α-helix	trans	-70.6	-32.1	178.1	-85.1	-76.6	0	0	0	113.3	V112 L113 G118 N203	V112-Y116 HydrophobicContact CG1-CD2 3.7Å; V112-Y116 HydrophobicContact CG1-CE2 3.67Å; V112-Y116 WeakPolarHBondContact O-CD2 3.13Å; V112-Y116 PolarHBondContact O-N 2.91Å; L113-Y116 PolarHBondContact O-N 2.75Å; Y116-G118 VanDerWaalsContact C-N 3.27Å; Y116-G118 PolarHBondContact O-N 3.02Å; Y116-N203 PolarHBondContact OH-OD1 3.39Å
117	L	75.4	Confident	80.4	Confident	102 Å²	102	89.5 Å²	89.5	53%	0.534	44%	0.44	S	S	.	.	H	α-helix	trans	-70.1	-19.6	-178.2	-76.3	167	0	0	0	114	L113 Y114 K161	L113-L117 HydrophobicContact CD2-CD1 4.42Å; L113-L117 HydrophobicContact CG-CD1 3.95Å; L113-L117 HydrophobicContact CG-CG 4.44Å; L113-L117 WeakPolarHBondContact O-CB 3.4Å; L113-L117 WeakPolarHBondContact O-CD1 3.43Å; L113-L117 WeakPolarHBondContact O-CG 3.48Å; L113-L117 PolarHBondContact O-N 2.95Å; Y114-L117 PolarHBondContact O-N 3.32Å; L117-K161 WeakPolarHBondContact O-CE 3.4Å
118	G	76.9	Confident	80.9	Confident	33 Å²	33	84.9 Å²	84.9	34%	0.34	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-10.5	-178.4	0	0	0	0	0	115.9	Y116 K161 I162	Y116-G118 VanDerWaalsContact C-N 3.27Å; Y116-G118 PolarHBondContact O-N 3.02Å; G118-K161 WeakPolarHBondContact O-CA 3.42Å; G118-I162 PolarHBondContact O-N 3.49Å
119	Y	82.8	Confident	81.4	Confident	72 Å²	72	88 Å²	88	28%	0.282	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	144.2	-176.6	-67.6	-75.9	0	0	0	112	Y115 R149 I162	Y115-Y119 VanDerWaalsContact O-CD2 3.28Å; Y115-Y119 WeakPolarHBondContact O-CD2 3.43Å; Y119-R149 PolarHBondContact OH-NH2 2.9Å; Y119-I162 HydrophobicContact CD1-CB 4.29Å; Y119-I162 HydrophobicContact CE1-CB 4.43Å
120	R	84.9	Confident	81.8	Confident	94 Å²	94	87.3 Å²	87.3	36%	0.355	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.7	172.8	178.7	-179.4	170.8	-168.4	-5.4	109.6	I122 E126 E159 K161 I162 P163 W164	R120-I122 HydrophobicContact CG-CG2 4.41Å; R120-E126 IonicContact NH2-OE1 3.25Å; R120-E126 PolarHBondContact NH2-OE1 3.13Å; R120-E159 IonicContact NH1-OE1 2.94Å; R120-E159 PolarHBondContact NH1-OE1 2.91Å; R120-E159 IonicContact NH1-OE2 3.68Å; R120-K161 HydrophobicContact CB-CB 3.94Å; R120-K161 HydrophobicContact CB-CD 4.24Å; R120-I162 PolarHBondContact N-O 3.31Å; R120-P163 CarbonylContact O-C 3.55Å; R120-P163 VanDerWaalsContact O-CA 3.31Å; R120-P163 WeakPolarHBondContact O-CA 3.4Å; R120-W164 VanDerWaalsContact C-CD1 3.44Å; R120-W164 PolarHBondContact O-N 3.16Å
121	E	87.5	Confident	82.3	Confident	125 Å²	125	82.3 Å²	82.3	58%	0.584	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	132.1	173.5	-170.6	174.4	-172.6	0	0	109.7	W164	E121-W164 WeakPolarHBondContact CA-O 3.37Å; E121-W164 HydrophobicContact CB-CZ2 3.91Å; E121-W164 HydrophobicContact CG-CH2 4.29Å; E121-W164 HydrophobicContact CG-CZ2 3.95Å
122	I	88.8	Confident	82.7	Confident	7 Å²	7	78.6 Å²	78.6	4%	0.036	37%	0.372	C	S	.	.			trans	-127.4	159.7	175.2	58.8	163.1	0	0	0	109.5	R120 E126 F127 Y131 V150 P163 W164 F165	R120-I122 HydrophobicContact CG-CG2 4.41Å; I122-E126 HydrophobicContact CB-CB 4.44Å; I122-E126 HydrophobicContact CB-CG 4.44Å; I122-F127 HydrophobicContact CD1-CB 3.88Å; I122-Y131 HydrophobicContact CD1-CD2 4.06Å; I122-Y131 HydrophobicContact CD1-CE2 3.81Å; I122-Y131 HydrophobicContact CG2-CE2 4.32Å; I122-V150 HydrophobicContact CD1-CG2 4.35Å; I122-P163 HydrophobicContact CD1-CB 3.54Å; I122-P163 HydrophobicContact CG1-CB 3.93Å; I122-P163 HydrophobicContact CG2-CB 4.07Å; I122-W164 WeakPolarHBondContact CG1-O 3.15Å; I122-W164 PolarHBondContact N-O 3.34Å; I122-F165 HydrophobicContact CD1-CD1 4.33Å; I122-F165 HydrophobicContact CG1-CB 4.39Å; I122-F165 HydrophobicContact CG1-CD1 4.31Å; I122-F165 WeakPolarHBondContact O-CB 2.88Å
123	T	89.9	Confident	83.1	Confident	84 Å²	84	79 Å²	79	52%	0.515	38%	0.377	S	S	.	.			trans	-87.8	159.8	174.6	65.6	0	0	0	0	111.7	K125 E126 F127	T123-K125 PolarHBondContact O-N 2.98Å; T123-E126 PolarHBondContact N-OE2 3.31Å; T123-E126 PolarHBondContact O-N 2.95Å; T123-E126 VanDerWaalsContact O-N 3.08Å; T123-E126 WeakPolarHBondContact OG1-CB 3.32Å; T123-E126 PolarHBondContact OG1-N 3.46Å; T123-E126 VanDerWaalsContact OG1-N 3.16Å; T123-F127 PolarHBondContact O-N 3.24Å
124	W	86.7	Confident	83.4	Confident	74 Å²	74	81 Å²	81	28%	0.28	38%	0.381	S	S	.	.	H	α-helix	trans	-53.4	-41.6	171.5	174.9	-108.9	0	0	0	112.4	E126 F127 V128 F165 F173 L176 I180	W124-E126 PolarHBondContact O-N 3.33Å; W124-F127 AromaticContact CE3-CD1 3.78Å; W124-F127 HydrophobicContact CE3-CD1 3.78Å; W124-F127 HydrophobicContact CE3-CE1 4.43Å; W124-F127 HydrophobicContact CH2-CD1 4.27Å; W124-F127 HydrophobicContact CH2-CE1 4.21Å; W124-F127 AromaticContact CZ3-CD1 3.55Å; W124-F127 HydrophobicContact CZ3-CD1 3.55Å; W124-F127 AromaticContact CZ3-CE1 3.74Å; W124-F127 HydrophobicContact CZ3-CE1 3.74Å; W124-F127 WeakPolarHBondContact O-CB 3.48Å; W124-F127 PolarHBondContact O-N 3.5Å; W124-V128 HydrophobicContact CD2-CG2 4.24Å; W124-V128 HydrophobicContact CZ2-CG2 4.05Å; W124-V128 WeakPolarHBondContact O-CG2 3.36Å; W124-V128 PolarHBondContact O-N 2.83Å; W124-F165 HydrophobicContact CE3-CD2 4.31Å; W124-F165 AromaticContact CE3-CE2 3.6Å; W124-F165 HydrophobicContact CE3-CE2 3.6Å; W124-F165 AromaticContact CE3-CZ 3.81Å; W124-F165 HydrophobicContact CE3-CZ 3.81Å; W124-F165 AromaticContact CZ3-CE2 3.9Å; W124-F165 HydrophobicContact CZ3-CE2 3.9Å; W124-F165 AromaticContact CZ3-CZ 3.8Å; W124-F165 HydrophobicContact CZ3-CZ 3.8Å; W124-F173 HydrophobicContact CH2-CD2 4.19Å; W124-F173 HydrophobicContact CH2-CE2 4.17Å; W124-F173 AromaticContact CZ3-CD2 3.81Å; W124-F173 HydrophobicContact CZ3-CD2 3.81Å; W124-F173 AromaticContact CZ3-CE2 3.66Å; W124-F173 HydrophobicContact CZ3-CE2 3.66Å; W124-L176 HydrophobicContact CH2-CB 4.36Å; W124-L176 HydrophobicContact CZ2-CB 3.81Å; W124-I180 HydrophobicContact CH2-CD1 4.44Å; W124-I180 HydrophobicContact CZ2-CD1 3.53Å
125	K	87.9	Confident	83.6	Confident	160 Å²	160	74.6 Å²	74.6	70%	0.696	37%	0.372	S	S	*	.	H	α-helix	trans	-63.8	-40.4	177	-71	-173.7	177.6	-177.4	0	112.1	T123 V128 N129	T123-K125 PolarHBondContact O-N 2.98Å; K125-V128 PolarHBondContact O-N 3.22Å; K125-N129 WeakPolarHBondContact O-CB 3.35Å; K125-N129 PolarHBondContact O-N 3Å
126	E	87.4	Confident	84.1	Confident	58 Å²	58	67.1 Å²	67.1	27%	0.271	34%	0.344	S	S	.	.	H	α-helix	trans	-69	-39.2	177.6	-168.3	176.3	-172.3	0	0	111.4	R120 I122 T123 W124 V128 S130	R120-E126 IonicContact NH2-OE1 3.25Å; R120-E126 PolarHBondContact NH2-OE1 3.13Å; I122-E126 HydrophobicContact CB-CB 4.44Å; I122-E126 HydrophobicContact CB-CG 4.44Å; T123-E126 PolarHBondContact N-OE2 3.31Å; T123-E126 PolarHBondContact O-N 2.95Å; T123-E126 VanDerWaalsContact O-N 3.08Å; T123-E126 WeakPolarHBondContact OG1-CB 3.32Å; T123-E126 PolarHBondContact OG1-N 3.46Å; T123-E126 VanDerWaalsContact OG1-N 3.16Å; W124-E126 PolarHBondContact O-N 3.33Å; E126-V128 PolarHBondContact O-N 3.13Å; E126-S130 WeakPolarHBondContact O-CA 3.4Å; E126-S130 WeakPolarHBondContact O-CB 3.23Å; E126-S130 PolarHBondContact O-N 2.75Å; E126-S130 PolarHBondContact O-OG 3.35Å
127	F	89.5	Confident	84.7	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.322	C	S	.	.	I	π-helix	trans	-54.6	-52.1	170.7	169.5	-111.5	0	0	0	111.7	I122 T123 W124 Y131 L132 V137 L140 V150 F165 L177	I122-F127 HydrophobicContact CD1-CB 3.88Å; T123-F127 PolarHBondContact O-N 3.24Å; W124-F127 AromaticContact CE3-CD1 3.78Å; W124-F127 HydrophobicContact CE3-CD1 3.78Å; W124-F127 HydrophobicContact CE3-CE1 4.43Å; W124-F127 HydrophobicContact CH2-CD1 4.27Å; W124-F127 HydrophobicContact CH2-CE1 4.21Å; W124-F127 AromaticContact CZ3-CD1 3.55Å; W124-F127 HydrophobicContact CZ3-CD1 3.55Å; W124-F127 AromaticContact CZ3-CE1 3.74Å; W124-F127 HydrophobicContact CZ3-CE1 3.74Å; W124-F127 WeakPolarHBondContact O-CB 3.48Å; W124-F127 PolarHBondContact O-N 3.5Å; F127-Y131 PolarHBondContact O-N 3.14Å; F127-L132 HydrophobicContact CE1-CB 4.41Å; F127-L132 HydrophobicContact CE1-CD2 4.09Å; F127-L132 HydrophobicContact CZ-CB 4.24Å; F127-L132 HydrophobicContact CZ-CD1 4.36Å; F127-L132 HydrophobicContact CZ-CD2 4.42Å; F127-L132 PolarHBondContact O-N 3.39Å; F127-V137 HydrophobicContact CE2-CG2 3.86Å; F127-L140 HydrophobicContact CE1-CD1 4.47Å; F127-L140 HydrophobicContact CE2-CD2 3.67Å; F127-L140 HydrophobicContact CZ-CD1 3.78Å; F127-L140 HydrophobicContact CZ-CD2 3.76Å; F127-L140 HydrophobicContact CZ-CG 4.38Å; F127-V150 HydrophobicContact CD2-CG1 4.14Å; F127-V150 HydrophobicContact CD2-CG2 3.7Å; F127-V150 HydrophobicContact CE2-CG1 3.87Å; F127-V150 HydrophobicContact CE2-CG2 3.88Å; F127-F165 HydrophobicContact CB-CD1 4.26Å; F127-F165 HydrophobicContact CB-CE1 4.08Å; F127-F165 HydrophobicContact CD1-CE1 4.04Å; F127-F165 HydrophobicContact CD1-CZ 4.12Å; F127-F165 HydrophobicContact CD2-CE1 4.02Å; F127-F165 HydrophobicContact CE1-CZ 4.47Å; F127-F165 HydrophobicContact CG-CD1 4.4Å; F127-F165 AromaticContact CG-CE1 3.75Å; F127-F165 HydrophobicContact CG-CE1 3.75Å; F127-F165 HydrophobicContact CG-CZ 4.29Å; F127-L177 HydrophobicContact CE1-CD1 4.23Å
128	V	87.7	Confident	85.2	Confident	22 Å²	22	60.9 Å²	60.9	13%	0.133	32%	0.321	C	S	.	.	I	π-helix	trans	-64.8	-49.6	-177.9	174.3	0	0	0	0	111.5	W124 K125 E126 L132 S133 I180	W124-V128 HydrophobicContact CD2-CG2 4.24Å; W124-V128 HydrophobicContact CZ2-CG2 4.05Å; W124-V128 WeakPolarHBondContact O-CG2 3.36Å; W124-V128 PolarHBondContact O-N 2.83Å; K125-V128 PolarHBondContact O-N 3.22Å; E126-V128 PolarHBondContact O-N 3.13Å; V128-L132 HydrophobicContact CG2-CD2 4.46Å; V128-S133 WeakPolarHBondContact O-CB 3.35Å; V128-S133 PolarHBondContact O-N 3.14Å; V128-S133 PolarHBondContact O-OG 3.32Å; V128-I180 HydrophobicContact CG1-CD1 4.16Å; V128-I180 HydrophobicContact CG1-CG2 4.09Å; V128-I180 HydrophobicContact CG2-CD1 3.57Å
129	N	85.8	Confident	85.8	Confident	109 Å²	109	62.3 Å²	62.3	58%	0.583	32%	0.318	S	S	*	.	I	π-helix	trans	-80.7	-31	-171.5	-70.2	-13	0	0	0	114.1	K125 S133	K125-N129 WeakPolarHBondContact O-CB 3.35Å; K125-N129 PolarHBondContact O-N 3Å; N129-S133 PolarHBondContact O-OG 3.41Å
130	S	83.8	Confident	86.2	Confident	46 Å²	46	58.9 Å²	58.9	32%	0.322	30%	0.304	S	S	.	.	I	π-helix	trans	-101.7	-28.9	-171.7	-58.9	0	0	0	0	113.4	E126 K134	E126-S130 WeakPolarHBondContact O-CA 3.4Å; E126-S130 WeakPolarHBondContact O-CB 3.23Å; E126-S130 PolarHBondContact O-N 2.75Å; E126-S130 PolarHBondContact O-OG 3.35Å; S130-K134 VanDerWaalsContact O-CD 3.31Å; S130-K134 WeakPolarHBondContact O-CD 3.48Å
131	Y	85.9	Confident	86.4	Confident	12 Å²	12	54.5 Å²	54.5	5%	0.047	29%	0.288	C	S	.	.	I	π-helix	trans	-117.4	-50.6	-173	-58	-82.9	0	0	0	112.2	I122 F127 A136 L152 E159 P163	I122-Y131 HydrophobicContact CD1-CD2 4.06Å; I122-Y131 HydrophobicContact CD1-CE2 3.81Å; I122-Y131 HydrophobicContact CG2-CE2 4.32Å; F127-Y131 PolarHBondContact O-N 3.14Å; Y131-A136 PolarHBondContact O-N 3.19Å; Y131-L152 HydrophobicContact CD1-CD1 3.85Å; Y131-L152 HydrophobicContact CD1-CD2 3.34Å; Y131-L152 HydrophobicContact CD1-CG 4.24Å; Y131-L152 HydrophobicContact CE1-CD1 3.6Å; Y131-L152 HydrophobicContact CE1-CD2 3.97Å; Y131-L152 HydrophobicContact CE1-CG 4.41Å; Y131-L152 HydrophobicContact CG-CD2 4.09Å; Y131-E159 PolarHBondContact OH-OE2 3.17Å; Y131-P163 HydrophobicContact CE1-CG 4Å
132	L	85.8	Confident	86.5	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	26%	0.26	C	S	.	.	I	π-helix	trans	-68.7	-49.8	-176.4	-175.6	62.5	0	0	0	112.2	F127 V128 K134 G135 L177 I180 L184 I192	F127-L132 HydrophobicContact CE1-CB 4.41Å; F127-L132 HydrophobicContact CE1-CD2 4.09Å; F127-L132 HydrophobicContact CZ-CB 4.24Å; F127-L132 HydrophobicContact CZ-CD1 4.36Å; F127-L132 HydrophobicContact CZ-CD2 4.42Å; F127-L132 PolarHBondContact O-N 3.39Å; V128-L132 HydrophobicContact CG2-CD2 4.46Å; L132-K134 PolarHBondContact O-N 3.38Å; L132-G135 PolarHBondContact O-N 3.27Å; L132-G135 VanDerWaalsContact O-N 3.07Å; L132-L177 HydrophobicContact CD2-CD1 4.29Å; L132-I180 HydrophobicContact CD2-CB 4.47Å; L132-I180 HydrophobicContact CD2-CG2 3.63Å; L132-L184 HydrophobicContact CD2-CD1 4.3Å; L132-L184 HydrophobicContact CG-CD1 4.01Å; L132-I192 HydrophobicContact CD1-CD1 3.08Å
133	S	82.2	Confident	86.4	Confident	62 Å²	62	48.3 Å²	48.3	43%	0.434	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.7	179.5	65.3	0	0	0	0	113.8	V128 N129 G135	V128-S133 WeakPolarHBondContact O-CB 3.35Å; V128-S133 PolarHBondContact O-N 3.14Å; V128-S133 PolarHBondContact O-OG 3.32Å; N129-S133 PolarHBondContact O-OG 3.41Å; S133-G135 VanDerWaalsContact C-N 3.32Å
134	K	81.1	Confident	86	Confident	149 Å²	149	46.3 Å²	46.3	65%	0.648	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-0.5	178.6	-62	-170.7	-171	168.5	0	113.4	S130 L132 A136	S130-K134 VanDerWaalsContact O-CD 3.31Å; S130-K134 WeakPolarHBondContact O-CD 3.48Å; L132-K134 PolarHBondContact O-N 3.38Å; K134-A136 PolarHBondContact O-N 3.1Å
135	G	80.8	Confident	85.9	Confident	54 Å²	54	49.6 Å²	49.6	56%	0.557	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	24.4	-175.7	0	0	0	0	0	113.6	L132 S133	L132-G135 PolarHBondContact O-N 3.27Å; L132-G135 VanDerWaalsContact O-N 3.07Å; S133-G135 VanDerWaalsContact C-N 3.32Å
136	A	83.6	Confident	85.8	Confident	5 Å²	5	47.9 Å²	47.9	4%	0.041	25%	0.254	C	S	.	.			trans	-87.4	-2.6	-173.7	0	0	0	0	0	113.8	Y131 K134 L152 N153 A157	Y131-A136 PolarHBondContact O-N 3.19Å; K134-A136 PolarHBondContact O-N 3.1Å; A136-L152 CarbonylContact O-C 3.58Å; A136-L152 VanDerWaalsContact O-CA 3.26Å; A136-L152 WeakPolarHBondContact O-CA 2.93Å; A136-N153 PolarHBondContact O-N 3.36Å; A136-A157 HydrophobicContact CB-CB 4.14Å
137	V	85.3	Confident	85.9	Confident	15 Å²	15	47.5 Å²	47.5	9%	0.091	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123.3	-175.2	-176.1	0	0	0	0	109.8	F127 L140 V150 I192	F127-V137 HydrophobicContact CE2-CG2 3.86Å; V137-L140 HydrophobicContact CG1-CD2 3.8Å; V137-L140 HydrophobicContact CG1-CG 4.1Å; V137-V150 HydrophobicContact CG1-CG1 4.03Å; V137-V150 HydrophobicContact CG2-CG1 3.98Å; V137-I192 HydrophobicContact CB-CD1 4.01Å; V137-I192 HydrophobicContact CG1-CD1 4.17Å; V137-I192 HydrophobicContact CG1-CG2 3.84Å
138	D	84.6	Confident	85.9	Confident	94 Å²	94	47.5 Å²	47.5	50%	0.503	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-52.1	174.3	-179.2	44.2	0	0	0	110.7	H151 N153	D138-H151 PolarHBondContact N-O 3.2Å; D138-N153 HydrophobicContact CB-CB 4.15Å
139	K	89	Confident	86	Confident	62 Å²	62	47.1 Å²	47.1	27%	0.27	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	157.1	178.9	61.8	174.1	174.4	160.9	0	112.1	E141 H151	K139-E141 IonicContact NZ-OE1 2.94Å; K139-E141 PolarHBondContact NZ-OE1 3.19Å; K139-H151 HydrophobicContact CG-CB 3.64Å; K139-H151 PolarHBondContact N-O 2.81Å; K139-H151 PolarHBondContact O-N 3.47Å
140	L	91.1	Very high	86.2	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	126	174.2	-63.2	174.2	0	0	0	109.5	F127 V137 V148 V150 F173 L177 I192 A193 V194 V195	F127-L140 HydrophobicContact CE1-CD1 4.47Å; F127-L140 HydrophobicContact CE2-CD2 3.67Å; F127-L140 HydrophobicContact CZ-CD1 3.78Å; F127-L140 HydrophobicContact CZ-CD2 3.76Å; F127-L140 HydrophobicContact CZ-CG 4.38Å; V137-L140 HydrophobicContact CG1-CD2 3.8Å; V137-L140 HydrophobicContact CG1-CG 4.1Å; L140-V148 HydrophobicContact CB-CG1 3.97Å; L140-V148 HydrophobicContact CD2-CG1 4.12Å; L140-V150 HydrophobicContact CD2-CB 4.18Å; L140-V150 HydrophobicContact CD2-CG1 3.98Å; L140-V150 HydrophobicContact CD2-CG2 3.86Å; L140-F173 HydrophobicContact CD1-CZ 4Å; L140-L177 HydrophobicContact CD1-CD1 4.04Å; L140-L177 HydrophobicContact CD1-CD2 3.81Å; L140-I192 HydrophobicContact CD1-CG2 4.25Å; L140-I192 HydrophobicContact CG-CG2 3.99Å; L140-A193 PolarHBondContact N-O 3.02Å; L140-V194 HydrophobicContact CB-CG2 4.42Å; L140-V194 CarbonylContact O-C 3.43Å; L140-V194 WeakPolarHBondContact O-CA 3.29Å; L140-V195 PolarHBondContact O-N 3.48Å
141	E	90.5	Very high	86.3	Confident	2 Å²	2	42 Å²	42	1%	0.009	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	110.5	176	-74	-179.8	172.9	0	0	110.4	K139 V143 V148 R149 H151 V195 K197	K139-E141 IonicContact NZ-OE1 2.94Å; K139-E141 PolarHBondContact NZ-OE1 3.19Å; E141-V143 PolarHBondContact O-N 3.28Å; E141-V148 CarbonylContact O-C 3.59Å; E141-V148 WeakPolarHBondContact O-CA 3.33Å; E141-R149 HydrophobicContact CB-CB 4.18Å; E141-R149 PolarHBondContact N-O 3.39Å; E141-R149 PolarHBondContact O-N 2.99Å; E141-R149 IonicContact OE2-NH1 3.9Å; E141-R149 PolarHBondContact OE2-NH1 3.42Å; E141-R149 VanDerWaalsContact OE2-NH1 3.16Å; E141-H151 IonicContact OE1-NE2 3.51Å; E141-H151 PolarHBondContact OE1-NE2 3.43Å; E141-H151 IonicContact OE2-CD2 3.5Å; E141-H151 IonicContact OE2-CE1 2.89Å; E141-H151 IonicContact OE2-NE2 2.72Å; E141-H151 PolarHBondContact OE2-NE2 2.76Å; E141-V195 CarbonylContact C-O 3.54Å; E141-V195 WeakPolarHBondContact CA-O 3.38Å; E141-V195 HydrophobicContact CG-CB 4.17Å; E141-K197 VanDerWaalsContact CD-NZ 3.27Å; E141-K197 HydrophobicContact CG-CD 4.37Å; E141-K197 WeakPolarHBondContact OE1-CE 3.31Å; E141-K197 IonicContact OE1-NZ 3.76Å; E141-K197 PolarHBondContact OE1-NZ 3.24Å; E141-K197 IonicContact OE2-NZ 3.48Å; E141-K197 PolarHBondContact OE2-NZ 3.21Å
142	V	89.8	Confident	86.3	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	112.5	175	-177.5	0	0	0	0	108.4	V148 I167 F173 V194 V195 Y196 K197	V142-V148 HydrophobicContact CG2-CG2 4.08Å; V142-I167 HydrophobicContact CG1-CD1 3.8Å; V142-F173 HydrophobicContact CG2-CD1 4.37Å; V142-F173 HydrophobicContact CG2-CE1 3.88Å; V142-V194 HydrophobicContact CG2-CG1 3.53Å; V142-V195 PolarHBondContact N-O 3.46Å; V142-Y196 HydrophobicContact CB-CD1 3.82Å; V142-Y196 HydrophobicContact CB-CE1 4.16Å; V142-Y196 HydrophobicContact CG1-CD1 4.16Å; V142-Y196 HydrophobicContact CG1-CE1 4.46Å; V142-Y196 HydrophobicContact CG2-CD1 4.2Å; V142-Y196 HydrophobicContact CG2-CE1 4.04Å; V142-K197 PolarHBondContact O-N 3.21Å
143	V	85.2	Confident	86	Confident	1 Å²	1	45 Å²	45	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	123.6	-176.7	-174.6	0	0	0	0	110.7	E141 K145 K146 W147 K197 E199	E141-V143 PolarHBondContact O-N 3.28Å; V143-K145 PolarHBondContact O-N 3.37Å; V143-K146 PolarHBondContact O-N 2.74Å; V143-K146 VanDerWaalsContact O-N 3.09Å; V143-W147 HydrophobicContact CB-CD2 3.9Å; V143-W147 HydrophobicContact CB-CE3 4.22Å; V143-W147 HydrophobicContact CB-CH2 3.92Å; V143-W147 HydrophobicContact CB-CZ2 3.55Å; V143-W147 HydrophobicContact CB-CZ3 4.25Å; V143-W147 HydrophobicContact CG1-CH2 4.08Å; V143-W147 HydrophobicContact CG1-CZ2 3.41Å; V143-W147 VanDerWaalsContact CG1-CZ2 3.41Å; V143-W147 HydrophobicContact CG2-CD2 4.47Å; V143-W147 HydrophobicContact CG2-CE3 4.3Å; V143-W147 HydrophobicContact CG2-CH2 3.78Å; V143-W147 HydrophobicContact CG2-CZ2 3.94Å; V143-W147 HydrophobicContact CG2-CZ3 3.97Å; V143-W147 PolarHBondContact N-O 2.85Å; V143-W147 PolarHBondContact O-N 2.87Å; V143-K197 VanDerWaalsContact CA-O 3.29Å; V143-K197 WeakPolarHBondContact CA-O 3.13Å; V143-E199 HydrophobicContact CG1-CB 3.8Å; V143-E199 HydrophobicContact CG1-CG 3.89Å
144	N	82.3	Confident	85.5	Confident	41 Å²	41	47.3 Å²	47.3	22%	0.219	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	26.4	177.5	-65.8	-25.1	0	0	0	114.6	K146 K197 N198 E199	N144-K146 WeakPolarHBondContact O-CG 3.35Å; N144-K146 PolarHBondContact O-N 3.29Å; N144-K146 VanDerWaalsContact O-N 3.08Å; N144-K197 PolarHBondContact N-O 3.26Å; N144-N198 WeakPolarHBondContact OD1-CA 3.34Å; N144-E199 PolarHBondContact ND2-O 3.31Å; N144-E199 PolarHBondContact OD1-N 3.39Å; N144-E199 VanDerWaalsContact OD1-N 3.14Å; N144-E199 PolarHBondContact OD1-O 2.85Å; N144-E199 VanDerWaalsContact OD1-O 3.08Å
145	K	84.9	Confident	84.9	Confident	144 Å²	144	47.9 Å²	47.9	63%	0.626	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	17.2	-176.1	-54.4	-175.1	179	-174.9	0	114.9	V143 V170	V143-K145 PolarHBondContact O-N 3.37Å; K145-V170 HydrophobicContact CB-CG2 3.7Å; K145-V170 HydrophobicContact CD-CG2 4.28Å; K145-V170 HydrophobicContact CG-CG2 3.9Å
146	K	86.2	Confident	84.2	Confident	123 Å²	123	49.1 Å²	49.1	54%	0.535	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-35.3	-174.2	-75.6	178.6	-178.1	-179.4	0	113	V143 N144 I167	V143-K146 PolarHBondContact O-N 2.74Å; V143-K146 VanDerWaalsContact O-N 3.09Å; N144-K146 WeakPolarHBondContact O-CG 3.35Å; N144-K146 PolarHBondContact O-N 3.29Å; N144-K146 VanDerWaalsContact O-N 3.08Å; K146-I167 WeakPolarHBondContact O-CG1 3.47Å; K146-I167 PolarHBondContact O-N 3.22Å
147	W	88.8	Confident	83.2	Confident	50 Å²	50	50.1 Å²	50.1	19%	0.189	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	161.7	-176.1	56.2	-84.4	0	0	0	111.1	V143 R149 W164 F165	V143-W147 HydrophobicContact CB-CD2 3.9Å; V143-W147 HydrophobicContact CB-CE3 4.22Å; V143-W147 HydrophobicContact CB-CH2 3.92Å; V143-W147 HydrophobicContact CB-CZ2 3.55Å; V143-W147 HydrophobicContact CB-CZ3 4.25Å; V143-W147 HydrophobicContact CG1-CH2 4.08Å; V143-W147 HydrophobicContact CG1-CZ2 3.41Å; V143-W147 VanDerWaalsContact CG1-CZ2 3.41Å; V143-W147 HydrophobicContact CG2-CD2 4.47Å; V143-W147 HydrophobicContact CG2-CE3 4.3Å; V143-W147 HydrophobicContact CG2-CH2 3.78Å; V143-W147 HydrophobicContact CG2-CZ2 3.94Å; V143-W147 HydrophobicContact CG2-CZ3 3.97Å; V143-W147 PolarHBondContact N-O 2.85Å; V143-W147 PolarHBondContact O-N 2.87Å; W147-R149 HydrophobicContact CE3-CB 4.48Å; W147-R149 HydrophobicContact CZ3-CB 3.94Å; W147-W164 HydrophobicContact CB-CE3 3.93Å; W147-W164 HydrophobicContact CB-CZ3 4.18Å; W147-W164 HydrophobicContact CD2-CE3 4.37Å; W147-W164 HydrophobicContact CE3-CB 4.05Å; W147-W164 HydrophobicContact CE3-CE3 4.18Å; W147-W164 HydrophobicContact CG-CE3 4.31Å; W147-W164 HydrophobicContact CZ3-CB 4.28Å; W147-F165 CarbonylContact C-O 3.52Å; W147-F165 WeakPolarHBondContact CA-O 3.31Å; W147-F165 WeakPolarHBondContact CB-O 3.39Å
148	V	89.9	Confident	82.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	127.5	-176	-176.1	0	0	0	0	109	L140 E141 V142 W164 F165 I167 F173	L140-V148 HydrophobicContact CB-CG1 3.97Å; L140-V148 HydrophobicContact CD2-CG1 4.12Å; E141-V148 CarbonylContact O-C 3.59Å; E141-V148 WeakPolarHBondContact O-CA 3.33Å; V142-V148 HydrophobicContact CG2-CG2 4.08Å; V148-W164 CarbonylContact O-C 3.53Å; V148-W164 WeakPolarHBondContact O-CA 3.36Å; V148-W164 WeakPolarHBondContact O-CB 3.41Å; V148-F165 HydrophobicContact CB-CD1 4.42Å; V148-F165 HydrophobicContact CB-CD2 4.47Å; V148-F165 HydrophobicContact CB-CE1 3.92Å; V148-F165 HydrophobicContact CB-CE2 3.96Å; V148-F165 HydrophobicContact CB-CZ 3.66Å; V148-F165 HydrophobicContact CG1-CE1 4.08Å; V148-F165 HydrophobicContact CG1-CZ 3.93Å; V148-F165 HydrophobicContact CG2-CE2 3.99Å; V148-F165 HydrophobicContact CG2-CZ 4.04Å; V148-F165 PolarHBondContact N-O 3.25Å; V148-F165 PolarHBondContact O-N 2.96Å; V148-I167 HydrophobicContact CG2-CD1 4.03Å; V148-I167 HydrophobicContact CG2-CG1 4.29Å; V148-I167 HydrophobicContact CG2-CG2 3.64Å; V148-F173 HydrophobicContact CG1-CZ 4.1Å; V148-F173 HydrophobicContact CG2-CD2 4.43Å; V148-F173 HydrophobicContact CG2-CE1 4.17Å; V148-F173 HydrophobicContact CG2-CE2 4.08Å; V148-F173 HydrophobicContact CG2-CZ 3.93Å
149	R	89.7	Confident	81.3	Confident	15 Å²	15	53.4 Å²	53.4	6%	0.057	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	125.6	172.6	-173.4	-171.4	-70.4	146.4	-4.4	108.8	Y119 E141 W147 H151 I162 E199	Y119-R149 PolarHBondContact OH-NH2 2.9Å; E141-R149 HydrophobicContact CB-CB 4.18Å; E141-R149 PolarHBondContact N-O 3.39Å; E141-R149 PolarHBondContact O-N 2.99Å; E141-R149 IonicContact OE2-NH1 3.9Å; E141-R149 PolarHBondContact OE2-NH1 3.42Å; E141-R149 VanDerWaalsContact OE2-NH1 3.16Å; W147-R149 HydrophobicContact CE3-CB 4.48Å; W147-R149 HydrophobicContact CZ3-CB 3.94Å; R149-H151 WeakPolarHBondContact CD-NE2 3.35Å; R149-I162 HydrophobicContact CG-CG2 3.37Å; R149-E199 IonicContact CZ-OE1 3.91Å; R149-E199 IonicContact CZ-OE2 2.74Å; R149-E199 IonicContact NH1-OE1 3.61Å; R149-E199 PolarHBondContact NH1-OE1 3.31Å; R149-E199 VanDerWaalsContact NH2-CD 3.34Å; R149-E199 IonicContact NH2-OE1 3.99Å; R149-E199 PolarHBondContact NH2-OE1 3.14Å; R149-E199 IonicContact NH2-OE2 3.59Å; R149-E199 PolarHBondContact NH2-OE2 3.39Å
150	V	90.2	Very high	80.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	112.1	-178.2	-174	0	0	0	0	108.7	I122 F127 V137 L140 L152 I162 P163 F165	I122-V150 HydrophobicContact CD1-CG2 4.35Å; F127-V150 HydrophobicContact CD2-CG1 4.14Å; F127-V150 HydrophobicContact CD2-CG2 3.7Å; F127-V150 HydrophobicContact CE2-CG1 3.87Å; F127-V150 HydrophobicContact CE2-CG2 3.88Å; V137-V150 HydrophobicContact CG1-CG1 4.03Å; V137-V150 HydrophobicContact CG2-CG1 3.98Å; L140-V150 HydrophobicContact CD2-CB 4.18Å; L140-V150 HydrophobicContact CD2-CG1 3.98Å; L140-V150 HydrophobicContact CD2-CG2 3.86Å; V150-L152 HydrophobicContact CG1-CD2 3.84Å; V150-I162 WeakPolarHBondContact O-CG2 3.36Å; V150-P163 HydrophobicContact CB-CB 4.18Å; V150-P163 HydrophobicContact CB-CG 4.18Å; V150-P163 HydrophobicContact CG2-CB 4.48Å; V150-P163 PolarHBondContact N-O 2.98Å; V150-P163 WeakPolarHBondContact O-CD 3.23Å; V150-F165 HydrophobicContact CG2-CD1 4.16Å; V150-F165 HydrophobicContact CG2-CE1 3.8Å
151	H	86.4	Confident	79.9	Confident	46 Å²	46	61.1 Å²	61.1	21%	0.213	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	120.5	171.7	-71.3	-97.2	0	0	0	108.8	D138 K139 E141 R149	D138-H151 PolarHBondContact N-O 3.2Å; K139-H151 HydrophobicContact CG-CB 3.64Å; K139-H151 PolarHBondContact N-O 2.81Å; K139-H151 PolarHBondContact O-N 3.47Å; E141-H151 IonicContact OE1-NE2 3.51Å; E141-H151 PolarHBondContact OE1-NE2 3.43Å; E141-H151 IonicContact OE2-CD2 3.5Å; E141-H151 IonicContact OE2-CE1 2.89Å; E141-H151 IonicContact OE2-NE2 2.72Å; E141-H151 PolarHBondContact OE2-NE2 2.76Å; R149-H151 WeakPolarHBondContact CD-NE2 3.35Å
152	L	84.5	Confident	79.7	Confident	28 Å²	28	64 Å²	64	15%	0.147	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	140.8	179.7	-57.8	176.1	0	0	0	109.8	Y131 A136 V150 P154 A157 E159 P163	Y131-L152 HydrophobicContact CD1-CD1 3.85Å; Y131-L152 HydrophobicContact CD1-CD2 3.34Å; Y131-L152 HydrophobicContact CD1-CG 4.24Å; Y131-L152 HydrophobicContact CE1-CD1 3.6Å; Y131-L152 HydrophobicContact CE1-CD2 3.97Å; Y131-L152 HydrophobicContact CE1-CG 4.41Å; Y131-L152 HydrophobicContact CG-CD2 4.09Å; A136-L152 CarbonylContact O-C 3.58Å; A136-L152 VanDerWaalsContact O-CA 3.26Å; A136-L152 WeakPolarHBondContact O-CA 2.93Å; V150-L152 HydrophobicContact CG1-CD2 3.84Å; L152-P154 WeakPolarHBondContact O-CD 3.45Å; L152-A157 HydrophobicContact CB-CB 4.16Å; L152-A157 HydrophobicContact CD1-CB 3.84Å; L152-A157 HydrophobicContact CG-CB 4.44Å; L152-E159 HydrophobicContact CD1-CB 4.31Å; L152-P163 HydrophobicContact CD1-CG 4.01Å; L152-P163 HydrophobicContact CG-CG 4.32Å
153	N	79.7	Confident	79.6	Confident	53 Å²	53	64 Å²	64	28%	0.283	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-66.7	120.3	172.7	-179.2	-10.6	0	0	0	108	A136 D138 L155 T156 A157	A136-N153 PolarHBondContact O-N 3.36Å; D138-N153 HydrophobicContact CB-CB 4.15Å; N153-L155 PolarHBondContact O-N 2.8Å; N153-L155 PolarHBondContact OD1-N 3.34Å; N153-T156 WeakPolarHBondContact CB-OG1 3.47Å; N153-T156 PolarHBondContact O-N 2.93Å; N153-T156 PolarHBondContact O-OG1 3.42Å; N153-A157 PolarHBondContact O-N 3.1Å
154	P	71.9	Confident	79.9	Confident	110 Å²	110	66.5 Å²	66.5	71%	0.714	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-16.8	-173.8	21.2	-32.7	0	0	0	113.9	L152	L152-P154 WeakPolarHBondContact O-CD 3.45Å
155	L	67.9	Low	80.3	Confident	160 Å²	160	64.8 Å²	64.8	84%	0.838	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-25.1	176.2	-63.7	171.7	0	0	0	113.7	N153	N153-L155 PolarHBondContact O-N 2.8Å; N153-L155 PolarHBondContact OD1-N 3.34Å
156	T	66.4	Low	80.5	Confident	81 Å²	81	62.6 Å²	62.6	50%	0.497	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-24	-169.6	18.1	0	0	0	0	114.1	N153	N153-T156 WeakPolarHBondContact CB-OG1 3.47Å; N153-T156 PolarHBondContact O-N 2.93Å; N153-T156 PolarHBondContact O-OG1 3.42Å
157	A	63.2	Low	80.7	Confident	25 Å²	25	57.9 Å²	57.9	21%	0.207	32%	0.324	C	S	.	.			trans	-148.3	111.4	176.8	0	0	0	0	0	111.2	A136 L152 N153 E159	A136-A157 HydrophobicContact CB-CB 4.14Å; L152-A157 HydrophobicContact CB-CB 4.16Å; L152-A157 HydrophobicContact CD1-CB 3.84Å; L152-A157 HydrophobicContact CG-CB 4.44Å; N153-A157 PolarHBondContact O-N 3.1Å; A157-E159 PolarHBondContact O-N 3.45Å
158	A	61.2	Low	80.5	Confident	103 Å²	103	59.5 Å²	59.5	85%	0.851	36%	0.356	S	S	*	.			trans	-95.5	72	173.6	0	0	0	0	0	109.9
159	E	68.4	Low	80.3	Confident	76 Å²	76	61.8 Å²	61.8	36%	0.355	37%	0.373	S	S	.	.			trans	-94.2	130.7	166.7	-73.8	-161.2	150	0	0	110.1	R120 Y131 L152 A157 K161	R120-E159 IonicContact NH1-OE1 2.94Å; R120-E159 PolarHBondContact NH1-OE1 2.91Å; R120-E159 IonicContact NH1-OE2 3.68Å; Y131-E159 PolarHBondContact OH-OE2 3.17Å; L152-E159 HydrophobicContact CD1-CB 4.31Å; A157-E159 PolarHBondContact O-N 3.45Å; E159-K161 PolarHBondContact O-N 2.96Å
160	P	71.1	Confident	80.3	Confident	132 Å²	132	62.2 Å²	62.2	86%	0.857	38%	0.377	S	S	*	.	S	Bend	trans	-71.9	-14	-179.5	28.1	-34.2	0	0	0	113.3
161	K	80.6	Confident	80.1	Confident	92 Å²	92	67.2 Å²	67.2	40%	0.4	40%	0.404	S	S	.	.	S	Bend	trans	-112.7	138.9	-179.2	-64.6	-174.3	178.6	-173.2	0	109.6	L117 G118 R120 E159 P163	L117-K161 WeakPolarHBondContact O-CE 3.4Å; G118-K161 WeakPolarHBondContact O-CA 3.42Å; R120-K161 HydrophobicContact CB-CB 3.94Å; R120-K161 HydrophobicContact CB-CD 4.24Å; E159-K161 PolarHBondContact O-N 2.96Å; K161-P163 WeakPolarHBondContact O-CD 3.15Å
162	I	84.4	Confident	80.2	Confident	62 Å²	62	67.2 Å²	67.2	32%	0.318	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	120.6	178.8	-54.4	175.9	0	0	0	108.5	G118 Y119 R120 R149 V150	G118-I162 PolarHBondContact O-N 3.49Å; Y119-I162 HydrophobicContact CD1-CB 4.29Å; Y119-I162 HydrophobicContact CE1-CB 4.43Å; R120-I162 PolarHBondContact N-O 3.31Å; R149-I162 HydrophobicContact CG-CG2 3.37Å; V150-I162 WeakPolarHBondContact O-CG2 3.36Å
163	P	88.7	Confident	80.4	Confident	2 Å²	2	66.2 Å²	66.2	1%	0.013	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	142.1	176.3	-2.1	11.5	0	0	0	111.7	R120 I122 Y131 V150 L152 K161	R120-P163 CarbonylContact O-C 3.55Å; R120-P163 VanDerWaalsContact O-CA 3.31Å; R120-P163 WeakPolarHBondContact O-CA 3.4Å; I122-P163 HydrophobicContact CD1-CB 3.54Å; I122-P163 HydrophobicContact CG1-CB 3.93Å; I122-P163 HydrophobicContact CG2-CB 4.07Å; Y131-P163 HydrophobicContact CE1-CG 4Å; V150-P163 HydrophobicContact CB-CB 4.18Å; V150-P163 HydrophobicContact CB-CG 4.18Å; V150-P163 HydrophobicContact CG2-CB 4.48Å; V150-P163 PolarHBondContact N-O 2.98Å; V150-P163 WeakPolarHBondContact O-CD 3.23Å; L152-P163 HydrophobicContact CD1-CG 4.01Å; L152-P163 HydrophobicContact CG-CG 4.32Å; K161-P163 WeakPolarHBondContact O-CD 3.15Å
164	W	90.8	Very high	80.8	Confident	54 Å²	54	67.1 Å²	67.1	21%	0.205	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	155.8	172.6	73.3	-79.4	0	0	0	112.5	R120 E121 I122 W147 V148	R120-W164 VanDerWaalsContact C-CD1 3.44Å; R120-W164 PolarHBondContact O-N 3.16Å; E121-W164 WeakPolarHBondContact CA-O 3.37Å; E121-W164 HydrophobicContact CB-CZ2 3.91Å; E121-W164 HydrophobicContact CG-CH2 4.29Å; E121-W164 HydrophobicContact CG-CZ2 3.95Å; I122-W164 WeakPolarHBondContact CG1-O 3.15Å; I122-W164 PolarHBondContact N-O 3.34Å; W147-W164 HydrophobicContact CB-CE3 3.93Å; W147-W164 HydrophobicContact CB-CZ3 4.18Å; W147-W164 HydrophobicContact CD2-CE3 4.37Å; W147-W164 HydrophobicContact CE3-CB 4.05Å; W147-W164 HydrophobicContact CE3-CE3 4.18Å; W147-W164 HydrophobicContact CG-CE3 4.31Å; W147-W164 HydrophobicContact CZ3-CB 4.28Å; V148-W164 CarbonylContact O-C 3.53Å; V148-W164 WeakPolarHBondContact O-CA 3.36Å; V148-W164 WeakPolarHBondContact O-CB 3.41Å
165	F	91.8	Very high	81.6	Confident	5 Å²	5	70.4 Å²	70.4	2%	0.022	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	156.3	175.7	62.1	-89.5	0	0	0	112.1	I122 W124 F127 W147 V148 V150 I167 F173	I122-F165 HydrophobicContact CD1-CD1 4.33Å; I122-F165 HydrophobicContact CG1-CB 4.39Å; I122-F165 HydrophobicContact CG1-CD1 4.31Å; I122-F165 WeakPolarHBondContact O-CB 2.88Å; W124-F165 HydrophobicContact CE3-CD2 4.31Å; W124-F165 AromaticContact CE3-CE2 3.6Å; W124-F165 HydrophobicContact CE3-CE2 3.6Å; W124-F165 AromaticContact CE3-CZ 3.81Å; W124-F165 HydrophobicContact CE3-CZ 3.81Å; W124-F165 AromaticContact CZ3-CE2 3.9Å; W124-F165 HydrophobicContact CZ3-CE2 3.9Å; W124-F165 AromaticContact CZ3-CZ 3.8Å; W124-F165 HydrophobicContact CZ3-CZ 3.8Å; F127-F165 HydrophobicContact CB-CD1 4.26Å; F127-F165 HydrophobicContact CB-CE1 4.08Å; F127-F165 HydrophobicContact CD1-CE1 4.04Å; F127-F165 HydrophobicContact CD1-CZ 4.12Å; F127-F165 HydrophobicContact CD2-CE1 4.02Å; F127-F165 HydrophobicContact CE1-CZ 4.47Å; F127-F165 HydrophobicContact CG-CD1 4.4Å; F127-F165 AromaticContact CG-CE1 3.75Å; F127-F165 HydrophobicContact CG-CE1 3.75Å; F127-F165 HydrophobicContact CG-CZ 4.29Å; W147-F165 CarbonylContact C-O 3.52Å; W147-F165 WeakPolarHBondContact CA-O 3.31Å; W147-F165 WeakPolarHBondContact CB-O 3.39Å; V148-F165 HydrophobicContact CB-CD1 4.42Å; V148-F165 HydrophobicContact CB-CD2 4.47Å; V148-F165 HydrophobicContact CB-CE1 3.92Å; V148-F165 HydrophobicContact CB-CE2 3.96Å; V148-F165 HydrophobicContact CB-CZ 3.66Å; V148-F165 HydrophobicContact CG1-CE1 4.08Å; V148-F165 HydrophobicContact CG1-CZ 3.93Å; V148-F165 HydrophobicContact CG2-CE2 3.99Å; V148-F165 HydrophobicContact CG2-CZ 4.04Å; V148-F165 PolarHBondContact N-O 3.25Å; V148-F165 PolarHBondContact O-N 2.96Å; V150-F165 HydrophobicContact CG2-CD1 4.16Å; V150-F165 HydrophobicContact CG2-CE1 3.8Å; F165-I167 HydrophobicContact CD2-CG2 4.08Å; F165-I167 HydrophobicContact CE2-CG2 3.71Å; F165-F173 HydrophobicContact CE2-CD2 4.16Å; F165-F173 AromaticContact CE2-CE2 3.97Å; F165-F173 HydrophobicContact CE2-CE2 3.97Å; F165-F173 HydrophobicContact CZ-CD2 4.38Å; F165-F173 AromaticContact CZ-CE2 3.73Å; F165-F173 HydrophobicContact CZ-CE2 3.73Å
166	N	89.3	Confident	82.6	Confident	97 Å²	97	66.7 Å²	66.7	52%	0.519	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	147.8	178.6	-73.9	-55.2	0	0	0	112.7
167	I	89.2	Confident	83.8	Confident	24 Å²	24	63.1 Å²	63.1	12%	0.123	36%	0.362	C	S	.	.			trans	-123	142.1	175.3	54.8	166.4	0	0	0	110.7	V142 K146 V148 F165 V170 F173	V142-I167 HydrophobicContact CG1-CD1 3.8Å; K146-I167 WeakPolarHBondContact O-CG1 3.47Å; K146-I167 PolarHBondContact O-N 3.22Å; V148-I167 HydrophobicContact CG2-CD1 4.03Å; V148-I167 HydrophobicContact CG2-CG1 4.29Å; V148-I167 HydrophobicContact CG2-CG2 3.64Å; F165-I167 HydrophobicContact CD2-CG2 4.08Å; F165-I167 HydrophobicContact CE2-CG2 3.71Å; I167-V170 HydrophobicContact CD1-CG2 4.24Å; I167-F173 HydrophobicContact CB-CB 4.32Å; I167-F173 HydrophobicContact CD1-CB 4.42Å; I167-F173 HydrophobicContact CG2-CB 3.95Å; I167-F173 HydrophobicContact CG2-CD2 3.79Å; I167-F173 HydrophobicContact CG2-CG 3.91Å
168	G	84.3	Confident	84.9	Confident	84 Å²	84	65.9 Å²	65.9	87%	0.866	37%	0.371	S	S	*	.	S	Bend	trans	-78.4	-47.7	178.5	0	0	0	0	0	113
169	S	87.5	Confident	86.2	Confident	49 Å²	49	65.1 Å²	65.1	34%	0.343	35%	0.353	S	S	.	.			trans	-143.2	146.1	172.1	70.8	0	0	0	0	110.3	D171 S172 F173	S169-D171 VanDerWaalsContact C-N 3.29Å; S169-D171 PolarHBondContact O-N 2.88Å; S169-S172 PolarHBondContact N-OG 2.84Å; S169-S172 PolarHBondContact O-N 3.27Å; S169-S172 PolarHBondContact O-OG 3.45Å; S169-S172 WeakPolarHBondContact OG-CB 3.45Å; S169-S172 PolarHBondContact OG-N 3.38Å; S169-S172 PolarHBondContact OG-OG 2.83Å; S169-F173 PolarHBondContact O-N 3.4Å; S169-F173 VanDerWaalsContact O-N 3.1Å
170	V	88.4	Confident	87.1	Confident	23 Å²	23	62.6 Å²	62.6	14%	0.139	34%	0.341	C	S	.	.	H	α-helix	trans	-60	-42.7	179.2	179.1	0	0	0	0	110.5	K145 I167 S172 F173 E174 Y196	K145-V170 HydrophobicContact CB-CG2 3.7Å; K145-V170 HydrophobicContact CD-CG2 4.28Å; K145-V170 HydrophobicContact CG-CG2 3.9Å; I167-V170 HydrophobicContact CD1-CG2 4.24Å; V170-S172 PolarHBondContact O-N 3.05Å; V170-F173 PolarHBondContact O-N 3.04Å; V170-F173 VanDerWaalsContact O-N 3.17Å; V170-E174 HydrophobicContact CG1-CG 4.49Å; V170-E174 WeakPolarHBondContact CG1-OE1 3.43Å; V170-E174 PolarHBondContact O-N 2.9Å; V170-Y196 HydrophobicContact CG1-CE1 3.72Å
171	D	86.4	Confident	87.8	Confident	106 Å²	106	56.7 Å²	56.7	57%	0.567	30%	0.302	S	S	*	.	H	α-helix	trans	-62.7	-41.6	179.3	-53.5	-55.9	0	0	0	112.4	S169 F173 R175	S169-D171 VanDerWaalsContact C-N 3.29Å; S169-D171 PolarHBondContact O-N 2.88Å; D171-F173 VanDerWaalsContact C-N 3.32Å; D171-F173 PolarHBondContact O-N 3.44Å; D171-R175 WeakPolarHBondContact O-CB 3.42Å; D171-R175 VanDerWaalsContact O-CG 3.27Å; D171-R175 WeakPolarHBondContact O-CG 3.25Å; D171-R175 PolarHBondContact O-N 2.9Å; D171-R175 VanDerWaalsContact O-N 3.14Å
172	S	87.7	Confident	88.1	Confident	46 Å²	46	57.5 Å²	57.5	32%	0.322	31%	0.306	S	S	.	.	H	α-helix	trans	-65.1	-38.5	176.5	64.1	0	0	0	0	112	S169 V170 L176	S169-S172 PolarHBondContact N-OG 2.84Å; S169-S172 PolarHBondContact O-N 3.27Å; S169-S172 PolarHBondContact O-OG 3.45Å; S169-S172 WeakPolarHBondContact OG-CB 3.45Å; S169-S172 PolarHBondContact OG-N 3.38Å; S169-S172 PolarHBondContact OG-OG 2.83Å; V170-S172 PolarHBondContact O-N 3.05Å; S172-L176 WeakPolarHBondContact O-CB 3.35Å; S172-L176 WeakPolarHBondContact O-CD1 3.31Å; S172-L176 WeakPolarHBondContact O-CG 3.31Å; S172-L176 PolarHBondContact O-N 3.23Å
173	F	90	Very high	88.2	Confident	6 Å²	6	62 Å²	62	3%	0.026	33%	0.326	C	S	.	.	H	α-helix	trans	-68.1	-46.5	-179.8	163.7	-105.1	0	0	0	111.4	W124 L140 V142 V148 F165 I167 S169 V170 D171 R175 L176 L177 V194	W124-F173 HydrophobicContact CH2-CD2 4.19Å; W124-F173 HydrophobicContact CH2-CE2 4.17Å; W124-F173 AromaticContact CZ3-CD2 3.81Å; W124-F173 HydrophobicContact CZ3-CD2 3.81Å; W124-F173 AromaticContact CZ3-CE2 3.66Å; W124-F173 HydrophobicContact CZ3-CE2 3.66Å; L140-F173 HydrophobicContact CD1-CZ 4Å; V142-F173 HydrophobicContact CG2-CD1 4.37Å; V142-F173 HydrophobicContact CG2-CE1 3.88Å; V148-F173 HydrophobicContact CG1-CZ 4.1Å; V148-F173 HydrophobicContact CG2-CD2 4.43Å; V148-F173 HydrophobicContact CG2-CE1 4.17Å; V148-F173 HydrophobicContact CG2-CE2 4.08Å; V148-F173 HydrophobicContact CG2-CZ 3.93Å; F165-F173 HydrophobicContact CE2-CD2 4.16Å; F165-F173 AromaticContact CE2-CE2 3.97Å; F165-F173 HydrophobicContact CE2-CE2 3.97Å; F165-F173 HydrophobicContact CZ-CD2 4.38Å; F165-F173 AromaticContact CZ-CE2 3.73Å; F165-F173 HydrophobicContact CZ-CE2 3.73Å; I167-F173 HydrophobicContact CB-CB 4.32Å; I167-F173 HydrophobicContact CD1-CB 4.42Å; I167-F173 HydrophobicContact CG2-CB 3.95Å; I167-F173 HydrophobicContact CG2-CD2 3.79Å; I167-F173 HydrophobicContact CG2-CG 3.91Å; S169-F173 PolarHBondContact O-N 3.4Å; S169-F173 VanDerWaalsContact O-N 3.1Å; V170-F173 PolarHBondContact O-N 3.04Å; V170-F173 VanDerWaalsContact O-N 3.17Å; D171-F173 VanDerWaalsContact C-N 3.32Å; D171-F173 PolarHBondContact O-N 3.44Å; F173-R175 PolarHBondContact O-N 3.46Å; F173-L176 PolarHBondContact O-N 2.86Å; F173-L177 HydrophobicContact CZ-CD2 4.21Å; F173-L177 WeakPolarHBondContact O-CB 3.44Å; F173-L177 PolarHBondContact O-N 3.28Å; F173-V194 HydrophobicContact CE1-CG1 4.17Å
174	E	88.6	Confident	87.8	Confident	73 Å²	73	65.4 Å²	65.4	34%	0.341	34%	0.343	S	S	.	.	H	α-helix	trans	-61.1	-44.9	177.6	-74.2	173.9	-157.2	0	0	112	V170 L176 L177 E178 Y196	V170-E174 HydrophobicContact CG1-CG 4.49Å; V170-E174 WeakPolarHBondContact CG1-OE1 3.43Å; V170-E174 PolarHBondContact O-N 2.9Å; E174-L176 PolarHBondContact O-N 3.5Å; E174-L177 PolarHBondContact O-N 3.32Å; E174-E178 WeakPolarHBondContact O-CB 3.29Å; E174-E178 PolarHBondContact O-N 2.91Å; E174-Y196 VanDerWaalsContact CD-OH 3.31Å; E174-Y196 PolarHBondContact OE1-OH 2.79Å
175	R	88.1	Confident	87.3	Confident	178 Å²	178	70 Å²	70	67%	0.672	37%	0.372	S	S	*	.	H	α-helix	trans	-62.3	-43.4	177.2	-71.4	176.9	-172.6	-167.7	3.4	112.2	D171 F173 N179	D171-R175 WeakPolarHBondContact O-CB 3.42Å; D171-R175 VanDerWaalsContact O-CG 3.27Å; D171-R175 WeakPolarHBondContact O-CG 3.25Å; D171-R175 PolarHBondContact O-N 2.9Å; D171-R175 VanDerWaalsContact O-N 3.14Å; F173-R175 PolarHBondContact O-N 3.46Å; R175-N179 WeakPolarHBondContact O-CB 3.43Å; R175-N179 PolarHBondContact O-N 3.01Å; R175-N179 PolarHBondContact O-ND2 2.9Å
176	L	89.5	Confident	86.6	Confident	83 Å²	83	71.9 Å²	71.9	44%	0.435	38%	0.382	S	S	.	.	H	α-helix	trans	-65.8	-42.2	177.6	-74.9	167.4	0	0	0	111.4	W124 S172 F173 E174 N179 I180	W124-L176 HydrophobicContact CH2-CB 4.36Å; W124-L176 HydrophobicContact CZ2-CB 3.81Å; S172-L176 WeakPolarHBondContact O-CB 3.35Å; S172-L176 WeakPolarHBondContact O-CD1 3.31Å; S172-L176 WeakPolarHBondContact O-CG 3.31Å; S172-L176 PolarHBondContact O-N 3.23Å; F173-L176 PolarHBondContact O-N 2.86Å; E174-L176 PolarHBondContact O-N 3.5Å; L176-N179 PolarHBondContact O-N 2.77Å; L176-I180 VanDerWaalsContact O-CG1 3.32Å; L176-I180 WeakPolarHBondContact O-CG1 3.5Å; L176-I180 PolarHBondContact O-N 3.34Å; L176-I180 VanDerWaalsContact O-N 3.07Å
177	L	89.8	Confident	86	Confident	5 Å²	5	73 Å²	73	3%	0.026	39%	0.387	C	S	.	.	H	α-helix	trans	-62.8	-45.8	176.7	-175.7	67.9	0	0	0	111.1	F127 L132 L140 F173 E174 N179 I180 Q181 V194	F127-L177 HydrophobicContact CE1-CD1 4.23Å; L132-L177 HydrophobicContact CD2-CD1 4.29Å; L140-L177 HydrophobicContact CD1-CD1 4.04Å; L140-L177 HydrophobicContact CD1-CD2 3.81Å; F173-L177 HydrophobicContact CZ-CD2 4.21Å; F173-L177 WeakPolarHBondContact O-CB 3.44Å; F173-L177 PolarHBondContact O-N 3.28Å; E174-L177 PolarHBondContact O-N 3.32Å; L177-N179 PolarHBondContact O-N 2.93Å; L177-I180 PolarHBondContact O-N 3.34Å; L177-Q181 VanDerWaalsContact O-CG 3.3Å; L177-Q181 WeakPolarHBondContact O-CG 3.44Å; L177-Q181 PolarHBondContact O-N 2.88Å; L177-V194 HydrophobicContact CD2-CG2 3.64Å
178	E	87.3	Confident	85.4	Confident	83 Å²	83	75.3 Å²	75.3	39%	0.388	41%	0.41	S	S	.	.	H	α-helix	trans	-62.4	-42.9	178.5	-163.8	-170.2	154.7	0	0	111.9	E174 I180 Q181 K182 Y191	E174-E178 WeakPolarHBondContact O-CB 3.29Å; E174-E178 PolarHBondContact O-N 2.91Å; E178-I180 PolarHBondContact O-N 3.5Å; E178-Q181 PolarHBondContact O-N 2.93Å; E178-K182 HydrophobicContact CG-CD 4.49Å; E178-K182 WeakPolarHBondContact O-CG 3.26Å; E178-K182 PolarHBondContact O-N 3.35Å; E178-K182 WeakPolarHBondContact OE1-CE 3.49Å; E178-K182 IonicContact OE1-NZ 3.47Å; E178-K182 PolarHBondContact OE1-NZ 2.89Å; E178-Y191 HydrophobicContact CG-CE2 4.27Å
179	N	88.7	Confident	84.9	Confident	88 Å²	88	82.7 Å²	82.7	47%	0.471	41%	0.412	S	S	.	.	H	α-helix	trans	-62.2	-42.3	177.1	-72.3	-14.5	0	0	0	112	R175 L176 L177 K182 E183	R175-N179 WeakPolarHBondContact O-CB 3.43Å; R175-N179 PolarHBondContact O-N 3.01Å; R175-N179 PolarHBondContact O-ND2 2.9Å; L176-N179 PolarHBondContact O-N 2.77Å; L177-N179 PolarHBondContact O-N 2.93Å; N179-K182 WeakPolarHBondContact O-CB 3.5Å; N179-K182 PolarHBondContact O-N 3.19Å; N179-E183 WeakPolarHBondContact O-CG 3.22Å; N179-E183 PolarHBondContact O-N 3.16Å
180	I	86.9	Confident	84.5	Confident	23 Å²	23	85.7 Å²	85.7	12%	0.118	42%	0.424	C	S	.	.	H	α-helix	trans	-70.9	-38.8	179.2	-65.8	174.6	0	0	0	111.5	W124 V128 L132 L176 L177 E178 K182 E183 L184	W124-I180 HydrophobicContact CH2-CD1 4.44Å; W124-I180 HydrophobicContact CZ2-CD1 3.53Å; V128-I180 HydrophobicContact CG1-CD1 4.16Å; V128-I180 HydrophobicContact CG1-CG2 4.09Å; V128-I180 HydrophobicContact CG2-CD1 3.57Å; L132-I180 HydrophobicContact CD2-CB 4.47Å; L132-I180 HydrophobicContact CD2-CG2 3.63Å; L176-I180 VanDerWaalsContact O-CG1 3.32Å; L176-I180 WeakPolarHBondContact O-CG1 3.5Å; L176-I180 PolarHBondContact O-N 3.34Å; L176-I180 VanDerWaalsContact O-N 3.07Å; L177-I180 PolarHBondContact O-N 3.34Å; E178-I180 PolarHBondContact O-N 3.5Å; I180-K182 VanDerWaalsContact C-N 3.25Å; I180-K182 PolarHBondContact O-N 3.11Å; I180-E183 PolarHBondContact O-N 3.16Å; I180-L184 HydrophobicContact CG2-CD1 3.87Å; I180-L184 HydrophobicContact CG2-CG 4.27Å; I180-L184 WeakPolarHBondContact O-CB 3.48Å; I180-L184 WeakPolarHBondContact O-CG 3.01Å; I180-L184 PolarHBondContact O-N 3.28Å
181	Q	86.4	Confident	84.2	Confident	8 Å²	8	88.1 Å²	88.1	4%	0.037	43%	0.431	C	S	.	.	H	α-helix	trans	-64.1	-33.2	175.6	-69	-178	137.1	0	0	111.8	L177 E178 N185 I186 Y191	L177-Q181 VanDerWaalsContact O-CG 3.3Å; L177-Q181 WeakPolarHBondContact O-CG 3.44Å; L177-Q181 PolarHBondContact O-N 2.88Å; E178-Q181 PolarHBondContact O-N 2.93Å; Q181-N185 PolarHBondContact O-N 3.36Å; Q181-I186 HydrophobicContact CB-CB 4.49Å; Q181-I186 HydrophobicContact CB-CD1 4.31Å; Q181-I186 HydrophobicContact CG-CD1 4.18Å; Q181-I186 PolarHBondContact O-N 3.21Å; Q181-Y191 HydrophobicContact CB-CD1 4.02Å; Q181-Y191 HydrophobicContact CB-CE1 3.74Å
182	K	86.1	Confident	84	Confident	108 Å²	108	84.4 Å²	84.4	47%	0.47	41%	0.411	S	S	.	.	H	α-helix	trans	-66.6	-45.3	170.3	-75.4	169.5	170.3	163.7	0	112.1	E178 N179 I180 L184 N185 Y191	E178-K182 HydrophobicContact CG-CD 4.49Å; E178-K182 WeakPolarHBondContact O-CG 3.26Å; E178-K182 PolarHBondContact O-N 3.35Å; E178-K182 WeakPolarHBondContact OE1-CE 3.49Å; E178-K182 IonicContact OE1-NZ 3.47Å; E178-K182 PolarHBondContact OE1-NZ 2.89Å; N179-K182 WeakPolarHBondContact O-CB 3.5Å; N179-K182 PolarHBondContact O-N 3.19Å; I180-K182 VanDerWaalsContact C-N 3.25Å; I180-K182 PolarHBondContact O-N 3.11Å; K182-L184 VanDerWaalsContact C-N 3.28Å; K182-L184 PolarHBondContact O-N 3.46Å; K182-N185 PolarHBondContact O-N 3.3Å; K182-N185 VanDerWaalsContact O-N 3.13Å; K182-Y191 WeakPolarHBondContact CG-OH 3.45Å
183	E	85.9	Confident	83.9	Confident	158 Å²	158	85 Å²	85	74%	0.738	42%	0.419	S	S	*	.	H	α-helix	trans	-63.2	-32.4	176.5	-76.2	178.1	-179.3	0	0	112.8	N179 I180 N185	N179-E183 WeakPolarHBondContact O-CG 3.22Å; N179-E183 PolarHBondContact O-N 3.16Å; I180-E183 PolarHBondContact O-N 3.16Å; E183-N185 PolarHBondContact O-N 2.72Å
184	L	81.8	Confident	83.8	Confident	73 Å²	73	86.4 Å²	86.4	38%	0.382	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	4.3	176.1	-68.5	173.4	0	0	0	113.9	L132 I180 K182 I186	L132-L184 HydrophobicContact CD2-CD1 4.3Å; L132-L184 HydrophobicContact CG-CD1 4.01Å; I180-L184 HydrophobicContact CG2-CD1 3.87Å; I180-L184 HydrophobicContact CG2-CG 4.27Å; I180-L184 WeakPolarHBondContact O-CB 3.48Å; I180-L184 WeakPolarHBondContact O-CG 3.01Å; I180-L184 PolarHBondContact O-N 3.28Å; K182-L184 VanDerWaalsContact C-N 3.28Å; K182-L184 PolarHBondContact O-N 3.46Å; L184-I186 HydrophobicContact CB-CD1 4.06Å; L184-I186 HydrophobicContact CB-CG1 3.94Å; L184-I186 HydrophobicContact CD1-CD1 4.31Å; L184-I186 PolarHBondContact O-N 2.99Å
185	N	80.3	Confident	83.8	Confident	150 Å²	150	85.6 Å²	85.6	80%	0.802	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	36.4	-176.3	-73.1	-36.2	0	0	0	113.6	Q181 K182 E183 D187	Q181-N185 PolarHBondContact O-N 3.36Å; K182-N185 PolarHBondContact O-N 3.3Å; K182-N185 VanDerWaalsContact O-N 3.13Å; E183-N185 PolarHBondContact O-N 2.72Å; N185-D187 PolarHBondContact O-N 3.03Å
186	I	77.6	Confident	83.7	Confident	45 Å²	45	82.7 Å²	82.7	23%	0.231	42%	0.418	C	S	.	.			trans	-77.9	123.1	173.7	-57.4	174.5	0	0	0	107.4	Q181 L184 N190 Y191	Q181-I186 HydrophobicContact CB-CB 4.49Å; Q181-I186 HydrophobicContact CB-CD1 4.31Å; Q181-I186 HydrophobicContact CG-CD1 4.18Å; Q181-I186 PolarHBondContact O-N 3.21Å; L184-I186 HydrophobicContact CB-CD1 4.06Å; L184-I186 HydrophobicContact CB-CG1 3.94Å; L184-I186 HydrophobicContact CD1-CD1 4.31Å; L184-I186 PolarHBondContact O-N 2.99Å; I186-N190 HydrophobicContact CG2-CB 3.85Å; I186-N190 WeakPolarHBondContact CG2-O 3.4Å; I186-Y191 HydrophobicContact CB-CD1 4.4Å; I186-Y191 HydrophobicContact CB-CE1 4.41Å; I186-Y191 HydrophobicContact CG2-CD1 4.01Å; I186-Y191 HydrophobicContact CG2-CE1 4.47Å; I186-Y191 VanDerWaalsContact O-CE1 3.29Å; I186-Y191 WeakPolarHBondContact O-CE1 3.34Å
187	D	76.5	Confident	83.4	Confident	119 Å²	119	82.4 Å²	82.4	64%	0.636	41%	0.413	S	S	*	.			trans	-57.2	141.2	173.2	-91.9	-39.1	0	0	0	110.5	N185 R189 N190	N185-D187 PolarHBondContact O-N 3.03Å; D187-R189 PolarHBondContact O-N 2.83Å; D187-N190 WeakPolarHBondContact O-CA 3.26Å; D187-N190 PolarHBondContact O-N 3.4Å
188	A	75	Confident	82.9	Confident	73 Å²	73	88.8 Å²	88.8	60%	0.603	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-55.8	-21.7	-178.3	0	0	0	0	0	114	N190 Y191	A188-N190 VanDerWaalsContact C-N 3.33Å; A188-Y191 HydrophobicContact CB-CE2 4.4Å
189	R	74.8	Confident	82.1	Confident	239 Å²	239	87.9 Å²	87.9	90%	0.902	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-73.5	-23.4	174.8	-64.3	-177.3	-177.3	-178.5	1.6	113.6	D187	D187-R189 PolarHBondContact O-N 2.83Å
190	N	78.7	Confident	80.9	Confident	113 Å²	113	92 Å²	92	60%	0.604	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-106.3	14.9	-177.6	-63.7	-21.8	0	0	0	111.9	I186 D187 A188	I186-N190 HydrophobicContact CG2-CB 3.85Å; I186-N190 WeakPolarHBondContact CG2-O 3.4Å; D187-N190 WeakPolarHBondContact O-CA 3.26Å; D187-N190 PolarHBondContact O-N 3.4Å; A188-N190 VanDerWaalsContact C-N 3.33Å
191	Y	82.6	Confident	79.8	Confident	73 Å²	73	93.8 Å²	93.8	29%	0.286	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-61.5	138.8	172.2	-78.7	3	0	0	0	110.7	E178 Q181 K182 I186 A188 A193	E178-Y191 HydrophobicContact CG-CE2 4.27Å; Q181-Y191 HydrophobicContact CB-CD1 4.02Å; Q181-Y191 HydrophobicContact CB-CE1 3.74Å; K182-Y191 WeakPolarHBondContact CG-OH 3.45Å; I186-Y191 HydrophobicContact CB-CD1 4.4Å; I186-Y191 HydrophobicContact CB-CE1 4.41Å; I186-Y191 HydrophobicContact CG2-CD1 4.01Å; I186-Y191 HydrophobicContact CG2-CE1 4.47Å; I186-Y191 VanDerWaalsContact O-CE1 3.29Å; I186-Y191 WeakPolarHBondContact O-CE1 3.34Å; A188-Y191 HydrophobicContact CB-CE2 4.4Å; Y191-A193 PolarHBondContact O-N 3.24Å
192	I	82.2	Confident	78.5	Confident	29 Å²	29	96.8 Å²	96.8	15%	0.149	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-68.3	132	-176.8	-64	160.9	0	0	0	109	L132 V137 L140 V194	L132-I192 HydrophobicContact CD1-CD1 3.08Å; V137-I192 HydrophobicContact CB-CD1 4.01Å; V137-I192 HydrophobicContact CG1-CD1 4.17Å; V137-I192 HydrophobicContact CG1-CG2 3.84Å; L140-I192 HydrophobicContact CD1-CG2 4.25Å; L140-I192 HydrophobicContact CG-CG2 3.99Å; I192-V194 PolarHBondContact O-N 3.19Å
193	A	84.9	Confident	77.4	Confident	57 Å²	57	95.7 Å²	95.7	47%	0.471	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	125.2	179.2	0	0	0	0	0	110.9	L140 Y191	L140-A193 PolarHBondContact N-O 3.02Å; Y191-A193 PolarHBondContact O-N 3.24Å
194	V	87.7	Confident	76.2	Confident	37 Å²	37	91 Å²	91	22%	0.224	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.3	171.7	-175.2	0	0	0	0	108.8	L140 V142 F173 L177 I192 Y196	L140-V194 HydrophobicContact CB-CG2 4.42Å; L140-V194 CarbonylContact O-C 3.43Å; L140-V194 WeakPolarHBondContact O-CA 3.29Å; V142-V194 HydrophobicContact CG2-CG1 3.53Å; F173-V194 HydrophobicContact CE1-CG1 4.17Å; L177-V194 HydrophobicContact CD2-CG2 3.64Å; I192-V194 PolarHBondContact O-N 3.19Å; V194-Y196 HydrophobicContact CG1-CE1 4.27Å; V194-Y196 HydrophobicContact CG1-CE2 4.25Å
195	V	88.1	Confident	75.3	Confident	56 Å²	56	91.4 Å²	91.4	34%	0.339	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.7	-178.6	-179.5	0	0	0	0	109.3	L140 E141 V142 K197	L140-V195 PolarHBondContact O-N 3.48Å; E141-V195 CarbonylContact C-O 3.54Å; E141-V195 WeakPolarHBondContact CA-O 3.38Å; E141-V195 HydrophobicContact CG-CB 4.17Å; V142-V195 PolarHBondContact N-O 3.46Å; V195-K197 HydrophobicContact CG1-CG 4.38Å
196	Y	87.1	Confident	74.7	Confident	117 Å²	117	87.4 Å²	87.4	46%	0.459	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	125.4	177.9	-53.6	-91.3	0	0	0	109.8	V142 V170 E174 V194	V142-Y196 HydrophobicContact CB-CD1 3.82Å; V142-Y196 HydrophobicContact CB-CE1 4.16Å; V142-Y196 HydrophobicContact CG1-CD1 4.16Å; V142-Y196 HydrophobicContact CG1-CE1 4.46Å; V142-Y196 HydrophobicContact CG2-CD1 4.2Å; V142-Y196 HydrophobicContact CG2-CE1 4.04Å; V170-Y196 HydrophobicContact CG1-CE1 3.72Å; E174-Y196 VanDerWaalsContact CD-OH 3.31Å; E174-Y196 PolarHBondContact OE1-OH 2.79Å; V194-Y196 HydrophobicContact CG1-CE1 4.27Å; V194-Y196 HydrophobicContact CG1-CE2 4.25Å
197	K	83.3	Confident	74.2	Confident	77 Å²	77	89 Å²	89	34%	0.335	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.7	175	-74.7	-175.5	171.7	173.8	0	110.1	E141 V142 V143 N144 V195	E141-K197 VanDerWaalsContact CD-NZ 3.27Å; E141-K197 HydrophobicContact CG-CD 4.37Å; E141-K197 WeakPolarHBondContact OE1-CE 3.31Å; E141-K197 IonicContact OE1-NZ 3.76Å; E141-K197 PolarHBondContact OE1-NZ 3.24Å; E141-K197 IonicContact OE2-NZ 3.48Å; E141-K197 PolarHBondContact OE2-NZ 3.21Å; V142-K197 PolarHBondContact O-N 3.21Å; V143-K197 VanDerWaalsContact CA-O 3.29Å; V143-K197 WeakPolarHBondContact CA-O 3.13Å; N144-K197 PolarHBondContact N-O 3.26Å; V195-K197 HydrophobicContact CG1-CG 4.38Å
198	N	78.1	Confident	74	Confident	138 Å²	138	87.3 Å²	87.3	74%	0.738	47%	0.469	S	S	*	.			trans	-97.7	103.2	165.8	-68	-27.9	0	0	0	106.9	N144	N144-N198 WeakPolarHBondContact OD1-CA 3.34Å
199	E	70.8	Confident	73.9	Confident	64 Å²	64	87.6 Å²	87.6	30%	0.299	46%	0.46	S	S	.	.			trans	-94.4	141.7	173.4	-66.9	-176.4	-178.7	0	0	108.1	V143 N144 R149 D201	V143-E199 HydrophobicContact CG1-CB 3.8Å; V143-E199 HydrophobicContact CG1-CG 3.89Å; N144-E199 PolarHBondContact ND2-O 3.31Å; N144-E199 PolarHBondContact OD1-N 3.39Å; N144-E199 VanDerWaalsContact OD1-N 3.14Å; N144-E199 PolarHBondContact OD1-O 2.85Å; N144-E199 VanDerWaalsContact OD1-O 3.08Å; R149-E199 IonicContact CZ-OE1 3.91Å; R149-E199 IonicContact CZ-OE2 2.74Å; R149-E199 IonicContact NH1-OE1 3.61Å; R149-E199 PolarHBondContact NH1-OE1 3.31Å; R149-E199 VanDerWaalsContact NH2-CD 3.34Å; R149-E199 IonicContact NH2-OE1 3.99Å; R149-E199 PolarHBondContact NH2-OE1 3.14Å; R149-E199 IonicContact NH2-OE2 3.59Å; R149-E199 PolarHBondContact NH2-OE2 3.39Å; E199-D201 PolarHBondContact O-N 3.19Å
200	M	64.5	Low	74	Confident	176 Å²	176	80.2 Å²	80.2	87%	0.867	44%	0.443	S	S	*	.			trans	-56.9	118.7	170.7	-85.1	-173.2	168.4	0	0	108	S202	M200-S202 PolarHBondContact O-N 3.32Å
201	D	64	Low	73.8	Confident	59 Å²	59	77.9 Å²	77.9	32%	0.316	44%	0.436	S	S	.	.			trans	-59	103.4	179.4	-168.2	-2.7	0	0	0	107.8	E199 N203 S204	E199-D201 PolarHBondContact O-N 3.19Å; D201-N203 PolarHBondContact O-N 3.17Å; D201-N203 VanDerWaalsContact O-N 3.07Å; D201-N203 WeakPolarHBondContact OD1-CB 3.36Å; D201-N203 PolarHBondContact OD1-N 3.45Å; D201-S204 WeakPolarHBondContact O-CA 3.44Å; D201-S204 VanDerWaalsContact O-CB 3.31Å; D201-S204 WeakPolarHBondContact O-CB 3.29Å; D201-S204 PolarHBondContact O-N 2.96Å
202	S	58.6	Low	73.6	Confident	71 Å²	71	78.8 Å²	78.8	50%	0.497	44%	0.444	S	S	.	.	H	α-helix	trans	-58.3	-26.2	-176.9	56.2	0	0	0	0	110.7	M200 S204 V205 V206	M200-S202 PolarHBondContact O-N 3.32Å; S202-S204 VanDerWaalsContact C-N 3.28Å; S202-S204 PolarHBondContact O-N 3.48Å; S202-V205 PolarHBondContact O-N 2.93Å; S202-V206 WeakPolarHBondContact O-CB 3.36Å; S202-V206 VanDerWaalsContact O-CG2 3.32Å; S202-V206 WeakPolarHBondContact O-CG2 3.32Å; S202-V206 PolarHBondContact O-N 3.39Å
203	N	62	Low	73.4	Confident	85 Å²	85	82.2 Å²	82.2	46%	0.455	46%	0.463	S	S	.	.	H	α-helix	trans	-61.5	-34.6	172.4	-71.9	-12.2	0	0	0	112.4	Y116 D201 S207	Y116-N203 PolarHBondContact OH-OD1 3.39Å; D201-N203 PolarHBondContact O-N 3.17Å; D201-N203 VanDerWaalsContact O-N 3.07Å; D201-N203 WeakPolarHBondContact OD1-CB 3.36Å; D201-N203 PolarHBondContact OD1-N 3.45Å; N203-S207 WeakPolarHBondContact O-CB 3.36Å; N203-S207 PolarHBondContact O-N 2.89Å; N203-S207 PolarHBondContact O-OG 3.04Å
204	S	62.2	Low	73.1	Confident	59 Å²	59	85 Å²	85	41%	0.413	47%	0.469	S	S	.	.	H	α-helix	trans	-70.5	-31	176.9	-62.2	0	0	0	0	112.4	D201 S202 S207 N208	D201-S204 WeakPolarHBondContact O-CA 3.44Å; D201-S204 VanDerWaalsContact O-CB 3.31Å; D201-S204 WeakPolarHBondContact O-CB 3.29Å; D201-S204 PolarHBondContact O-N 2.96Å; S202-S204 VanDerWaalsContact C-N 3.28Å; S202-S204 PolarHBondContact O-N 3.48Å; S204-S207 PolarHBondContact O-OG 3.18Å; S204-N208 WeakPolarHBondContact O-CB 3.45Å; S204-N208 VanDerWaalsContact O-CG 3.26Å; S204-N208 PolarHBondContact O-N 2.75Å; S204-N208 PolarHBondContact O-ND2 3.49Å
205	V	62.2	Low	72.7	Confident	82 Å²	82	89.6 Å²	89.6	50%	0.497	49%	0.486	S	S	.	.	H	α-helix	trans	-79.4	-42.5	177.3	-177.4	0	0	0	0	110.5	S202 N208 L209	S202-V205 PolarHBondContact O-N 2.93Å; V205-N208 PolarHBondContact O-N 3.15Å; V205-L209 PolarHBondContact O-N 3.3Å; V205-L209 VanDerWaalsContact O-N 3.15Å
206	V	67.2	Low	72.3	Confident	67 Å²	67	91.7 Å²	91.7	41%	0.406	50%	0.495	S	S	.	.	H	α-helix	trans	-70.9	-38.1	179.2	177.1	0	0	0	0	111.7	V112 S202 N208 L209 P210	V112-V206 HydrophobicContact CG2-CG2 4.45Å; S202-V206 WeakPolarHBondContact O-CB 3.36Å; S202-V206 VanDerWaalsContact O-CG2 3.32Å; S202-V206 WeakPolarHBondContact O-CG2 3.32Å; S202-V206 PolarHBondContact O-N 3.39Å; V206-N208 VanDerWaalsContact C-N 3.26Å; V206-N208 PolarHBondContact O-N 3.24Å; V206-L209 WeakPolarHBondContact O-CB 3.47Å; V206-L209 PolarHBondContact O-N 3.26Å; V206-P210 WeakPolarHBondContact O-CD 3.48Å
207	S	68.6	Low	71.9	Confident	79 Å²	79	93 Å²	93	55%	0.552	50%	0.503	S	S	*	.	H	α-helix	trans	-67.9	-27.2	176.5	70.3	0	0	0	0	113	N203 S204 P210	N203-S207 WeakPolarHBondContact O-CB 3.36Å; N203-S207 PolarHBondContact O-N 2.89Å; N203-S207 PolarHBondContact O-OG 3.04Å; S204-S207 PolarHBondContact O-OG 3.18Å; S207-P210 WeakPolarHBondContact O-CD 3.27Å
208	N	72	Confident	71.6	Confident	82 Å²	82	95.2 Å²	95.2	44%	0.439	51%	0.513	S	S	.	.	H	α-helix	trans	-88.7	-8.6	176.2	-72.2	-38.1	0	0	0	112.9	S204 V205 V206 S211 I212	S204-N208 WeakPolarHBondContact O-CB 3.45Å; S204-N208 VanDerWaalsContact O-CG 3.26Å; S204-N208 PolarHBondContact O-N 2.75Å; S204-N208 PolarHBondContact O-ND2 3.49Å; V205-N208 PolarHBondContact O-N 3.15Å; V206-N208 VanDerWaalsContact C-N 3.26Å; V206-N208 PolarHBondContact O-N 3.24Å; N208-S211 WeakPolarHBondContact CA-OG 3.45Å; N208-S211 PolarHBondContact O-N 3.39Å; N208-S211 PolarHBondContact O-OG 3.46Å; N208-I212 HydrophobicContact CB-CD1 4.25Å; N208-I212 WeakPolarHBondContact O-CB 3.47Å; N208-I212 WeakPolarHBondContact O-CD1 3.25Å; N208-I212 WeakPolarHBondContact O-CG1 3.36Å; N208-I212 PolarHBondContact O-N 2.77Å
209	L	73.2	Confident	71.6	Confident	79 Å²	79	92.3 Å²	92.3	41%	0.414	50%	0.497	S	S	.	.	H	α-helix	trans	-59.6	-44.1	178.3	-138.6	99.6	0	0	0	112.5	V205 V206 S211 I212 L213	V205-L209 PolarHBondContact O-N 3.3Å; V205-L209 VanDerWaalsContact O-N 3.15Å; V206-L209 WeakPolarHBondContact O-CB 3.47Å; V206-L209 PolarHBondContact O-N 3.26Å; L209-S211 PolarHBondContact O-N 3.12Å; L209-I212 PolarHBondContact O-N 2.88Å; L209-L213 HydrophobicContact CD2-CD1 4.34Å; L209-L213 WeakPolarHBondContact O-CB 3.25Å; L209-L213 VanDerWaalsContact O-CG 3.31Å; L209-L213 WeakPolarHBondContact O-CG 3.39Å; L209-L213 PolarHBondContact O-N 2.96Å
210	P	75.4	Confident	71.8	Confident	85 Å²	85	95.2 Å²	95.2	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-62.2	-40.3	175.6	-23.6	34.6	0	0	0	113.2	V206 S207 L213 L214	V206-P210 WeakPolarHBondContact O-CD 3.48Å; S207-P210 WeakPolarHBondContact O-CD 3.27Å; P210-L213 PolarHBondContact O-N 2.75Å; P210-L214 VanDerWaalsContact O-CB 3.31Å; P210-L214 WeakPolarHBondContact O-CB 3.32Å; P210-L214 PolarHBondContact O-N 3.18Å
211	S	74.9	Confident	72.1	Confident	64 Å²	64	88 Å²	88	45%	0.448	48%	0.476	S	S	.	.	H	α-helix	trans	-70.7	-37.8	178.6	49.2	0	0	0	0	111.9	N208 L209 L214 F215	N208-S211 WeakPolarHBondContact CA-OG 3.45Å; N208-S211 PolarHBondContact O-N 3.39Å; N208-S211 PolarHBondContact O-OG 3.46Å; L209-S211 PolarHBondContact O-N 3.12Å; S211-L214 PolarHBondContact O-N 3.08Å; S211-F215 WeakPolarHBondContact O-CB 3.25Å; S211-F215 PolarHBondContact O-N 3.21Å
212	I	78.4	Confident	72.5	Confident	91 Å²	91	89.9 Å²	89.9	47%	0.467	48%	0.484	S	S	.	.	H	α-helix	trans	-64.1	-45.3	172.9	-66.8	163.4	0	0	0	110.9	N208 L209 L214 F215 L216	N208-I212 HydrophobicContact CB-CD1 4.25Å; N208-I212 WeakPolarHBondContact O-CB 3.47Å; N208-I212 WeakPolarHBondContact O-CD1 3.25Å; N208-I212 WeakPolarHBondContact O-CG1 3.36Å; N208-I212 PolarHBondContact O-N 2.77Å; L209-I212 PolarHBondContact O-N 2.88Å; I212-L214 VanDerWaalsContact C-N 3.33Å; I212-L214 PolarHBondContact O-N 3.25Å; I212-F215 PolarHBondContact O-N 2.86Å; I212-L216 HydrophobicContact CG2-CD1 4.01Å; I212-L216 HydrophobicContact CG2-CG 4.44Å; I212-L216 WeakPolarHBondContact O-CB 3.41Å; I212-L216 WeakPolarHBondContact O-CG 3.44Å; I212-L216 PolarHBondContact O-N 2.75Å
213	L	78.6	Confident	72.9	Confident	101 Å²	101	96.5 Å²	96.5	53%	0.529	50%	0.498	S	S	.	.	H	α-helix	trans	-62.6	-39.8	176.9	-75.9	172	0	0	0	111.9	L209 P210 L216 F217	L209-L213 HydrophobicContact CD2-CD1 4.34Å; L209-L213 WeakPolarHBondContact O-CB 3.25Å; L209-L213 VanDerWaalsContact O-CG 3.31Å; L209-L213 WeakPolarHBondContact O-CG 3.39Å; L209-L213 PolarHBondContact O-N 2.96Å; P210-L213 PolarHBondContact O-N 2.75Å; L213-L216 PolarHBondContact O-N 2.88Å; L213-F217 VanDerWaalsContact O-CB 3.24Å; L213-F217 WeakPolarHBondContact O-CB 3.26Å; L213-F217 PolarHBondContact O-N 2.79Å
214	L	79.3	Confident	72.8	Confident	116 Å²	116	98.2 Å²	98.2	61%	0.607	50%	0.498	S	S	*	.	H	α-helix	trans	-68.1	-38.2	176.4	-155.9	150.9	0	0	0	111.2	P210 S211 I212 F217 F218	P210-L214 VanDerWaalsContact O-CB 3.31Å; P210-L214 WeakPolarHBondContact O-CB 3.32Å; P210-L214 PolarHBondContact O-N 3.18Å; S211-L214 PolarHBondContact O-N 3.08Å; I212-L214 VanDerWaalsContact C-N 3.33Å; I212-L214 PolarHBondContact O-N 3.25Å; L214-F217 PolarHBondContact O-N 2.93Å; L214-F218 VanDerWaalsContact O-CB 3.28Å; L214-F218 WeakPolarHBondContact O-CB 3.43Å; L214-F218 PolarHBondContact O-N 3.44Å
215	F	79	Confident	72.1	Confident	133 Å²	133	103.3 Å²	103.3	58%	0.583	51%	0.513	S	S	*	.	H	α-helix	trans	-66	-42.9	174.5	-161.7	-97.1	0	0	0	112.3	S211 I212 F218 L219	S211-F215 WeakPolarHBondContact O-CB 3.25Å; S211-F215 PolarHBondContact O-N 3.21Å; I212-F215 PolarHBondContact O-N 2.86Å; F215-F218 PolarHBondContact O-N 3Å; F215-L219 HydrophobicContact CD1-CD1 3.75Å; F215-L219 HydrophobicContact CD1-CG 4.21Å; F215-L219 HydrophobicContact CE1-CD1 3.67Å; F215-L219 HydrophobicContact CE1-CG 4.12Å; F215-L219 WeakPolarHBondContact O-CG 3.49Å; F215-L219 PolarHBondContact O-N 3.24Å
216	L	78.5	Confident	71.5	Confident	100 Å²	100	103.1 Å²	103.1	52%	0.524	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-40.2	174.3	-73.1	171.9	0	0	0	111.7	I212 L213 F218 L219 W220	I212-L216 HydrophobicContact CG2-CD1 4.01Å; I212-L216 HydrophobicContact CG2-CG 4.44Å; I212-L216 WeakPolarHBondContact O-CB 3.41Å; I212-L216 WeakPolarHBondContact O-CG 3.44Å; I212-L216 PolarHBondContact O-N 2.75Å; L213-L216 PolarHBondContact O-N 2.88Å; L216-F218 VanDerWaalsContact C-N 3.34Å; L216-L219 PolarHBondContact O-N 3.18Å; L216-W220 WeakPolarHBondContact O-CB 3.33Å; L216-W220 PolarHBondContact O-N 2.65Å
217	F	79.3	Confident	70.6	Confident	144 Å²	144	105.2 Å²	105.2	63%	0.632	53%	0.533	S	S	*	.	H	α-helix	trans	-62.5	-40.9	172.8	-179.3	-100.8	0	0	0	111.7	L213 L214 W220 G221	L213-F217 VanDerWaalsContact O-CB 3.24Å; L213-F217 WeakPolarHBondContact O-CB 3.26Å; L213-F217 PolarHBondContact O-N 2.79Å; L214-F217 PolarHBondContact O-N 2.93Å; F217-W220 PolarHBondContact O-N 2.76Å; F217-G221 PolarHBondContact O-N 3.06Å
218	F	77.5	Confident	69.5	Low	125 Å²	125	109.1 Å²	109.1	55%	0.548	54%	0.54	S	S	.	.	H	α-helix	trans	-66.6	-43.4	176.9	-164	-95.6	0	0	0	112.2	L214 F215 L216 W220 G221 M222	L214-F218 VanDerWaalsContact O-CB 3.28Å; L214-F218 WeakPolarHBondContact O-CB 3.43Å; L214-F218 PolarHBondContact O-N 3.44Å; F215-F218 PolarHBondContact O-N 3Å; L216-F218 VanDerWaalsContact C-N 3.34Å; F218-W220 VanDerWaalsContact C-N 3.34Å; F218-W220 PolarHBondContact O-N 2.87Å; F218-G221 PolarHBondContact O-N 2.94Å; F218-M222 HydrophobicContact CD1-CE 3.82Å; F218-M222 HydrophobicContact CD1-CG 4.42Å; F218-M222 HydrophobicContact CD1-SD 4.16Å; F218-M222 HydrophobicContact CE1-CE 3.97Å; F218-M222 HydrophobicContact CE1-CG 4.24Å; F218-M222 HydrophobicContact CE1-SD 3.74Å; F218-M222 PolarHBondContact O-N 3.33Å
219	L	77.4	Confident	68.3	Low	77 Å²	77	108.6 Å²	108.6	40%	0.403	55%	0.548	S	S	.	.	H	α-helix	trans	-62.6	-39.6	173.4	-75.1	173.8	0	0	0	112.2	F215 L216 M222 R223	F215-L219 HydrophobicContact CD1-CD1 3.75Å; F215-L219 HydrophobicContact CD1-CG 4.21Å; F215-L219 HydrophobicContact CE1-CD1 3.67Å; F215-L219 HydrophobicContact CE1-CG 4.12Å; F215-L219 WeakPolarHBondContact O-CG 3.49Å; F215-L219 PolarHBondContact O-N 3.24Å; L216-L219 PolarHBondContact O-N 3.18Å; L219-M222 HydrophobicContact CD2-CE 3.68Å; L219-R223 PolarHBondContact O-N 3.34Å; L219-R223 VanDerWaalsContact O-N 3.12Å
220	W	74.4	Confident	66.9	Low	125 Å²	125	108.7 Å²	108.7	47%	0.473	57%	0.568	S	S	.	*	H	α-helix	trans	-67.4	-40.4	175.3	-174.7	81.3	0	0	0	111.9	L216 F217 F218 R223 R224	L216-W220 WeakPolarHBondContact O-CB 3.33Å; L216-W220 PolarHBondContact O-N 2.65Å; F217-W220 PolarHBondContact O-N 2.76Å; F218-W220 VanDerWaalsContact C-N 3.34Å; F218-W220 PolarHBondContact O-N 2.87Å; W220-R223 PolarHBondContact O-N 3.09Å; W220-R224 HydrophobicContact CD2-CG 4.32Å; W220-R224 HydrophobicContact CH2-CG 4.46Å; W220-R224 HydrophobicContact CZ2-CG 4.18Å; W220-R224 PolarHBondContact O-N 2.77Å
221	G	72	Confident	65.1	Low	23 Å²	23	112.4 Å²	112.4	24%	0.237	58%	0.579	C	S	.	*	H	α-helix	trans	-61.2	-43.8	173.6	0	0	0	0	0	113	F217 F218 R223 R224 F225	F217-G221 PolarHBondContact O-N 3.06Å; F218-G221 PolarHBondContact O-N 2.94Å; G221-R223 VanDerWaalsContact C-N 3.34Å; G221-R223 PolarHBondContact O-N 2.78Å; G221-R224 PolarHBondContact O-N 2.93Å; G221-F225 PolarHBondContact O-N 2.88Å
222	M	71.5	Confident	63.6	Low	99 Å²	99	113.9 Å²	113.9	49%	0.488	60%	0.596	S	S	.	*	H	α-helix	trans	-64.7	-35.4	175.1	-75.1	-170	-58.7	0	0	112.8	F218 L219 S226	F218-M222 HydrophobicContact CD1-CE 3.82Å; F218-M222 HydrophobicContact CD1-CG 4.42Å; F218-M222 HydrophobicContact CD1-SD 4.16Å; F218-M222 HydrophobicContact CE1-CE 3.97Å; F218-M222 HydrophobicContact CE1-CG 4.24Å; F218-M222 HydrophobicContact CE1-SD 3.74Å; F218-M222 PolarHBondContact O-N 3.33Å; L219-M222 HydrophobicContact CD2-CE 3.68Å; M222-S226 PolarHBondContact O-N 3.43Å
223	R	67.5	Low	61.5	Low	211 Å²	211	121.3 Å²	121.3	80%	0.796	62%	0.618	S	S	*	*	H	α-helix	trans	-72.3	-26.1	174.8	-103.3	-177	145.6	106.3	-2.1	113.8	L219 W220 G221 S226	L219-R223 PolarHBondContact O-N 3.34Å; L219-R223 VanDerWaalsContact O-N 3.12Å; W220-R223 PolarHBondContact O-N 3.09Å; G221-R223 VanDerWaalsContact C-N 3.34Å; G221-R223 PolarHBondContact O-N 2.78Å; R223-S226 PolarHBondContact O-OG 3.31Å
224	R	58.8	Low	59.2	Low	121 Å²	121	120.3 Å²	120.3	46%	0.457	63%	0.631	S	S	.	*	H	α-helix	trans	-84.2	-27.4	175.2	-75.9	-84.9	-112.3	139.9	-2	112.6	N94 W220 G221	N94-R224 PolarHBondContact ND2-NH2 3.34Å; W220-R224 HydrophobicContact CD2-CG 4.32Å; W220-R224 HydrophobicContact CH2-CG 4.46Å; W220-R224 HydrophobicContact CZ2-CG 4.18Å; W220-R224 PolarHBondContact O-N 2.77Å; G221-R224 PolarHBondContact O-N 2.93Å
225	F	48.9	Very low	57	Low	166 Å²	166	118.4 Å²	118.4	73%	0.728	64%	0.64	S	S	*	*	H	α-helix	trans	-76.7	-16.7	175.1	-100.4	-90	0	0	0	114.1	G221 S227 F228	G221-F225 PolarHBondContact O-N 2.88Å; F225-S227 PolarHBondContact O-N 2.73Å; F225-F228 PolarHBondContact O-N 2.66Å; F225-F228 VanDerWaalsContact O-N 3.13Å
226	S	49.8	Very low	54.7	Low	78 Å²	78	124.6 Å²	124.6	55%	0.545	66%	0.659	S	S	.	*	G	3₁₀ helix	trans	-66.9	-14.1	175.4	75.8	0	0	0	0	113.5	M222 R223 F228 A229	M222-S226 PolarHBondContact O-N 3.43Å; R223-S226 PolarHBondContact O-OG 3.31Å; S226-F228 VanDerWaalsContact C-N 3.31Å; S226-A229 WeakPolarHBondContact O-CB 3.43Å; S226-A229 PolarHBondContact O-N 3.37Å
227	S	48.6	Very low	52.5	Low	110 Å²	110	123.3 Å²	123.3	77%	0.769	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-82.9	-4.3	175	-51	0	0	0	0	113.7	F225	F225-S227 PolarHBondContact O-N 2.73Å
228	F	44.1	Very low	50.4	Low	161 Å²	161	120.1 Å²	120.1	71%	0.706	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-98	2.1	168.9	-158.1	-100.9	0	0	0	112.4	F225 S226 G230	F225-F228 PolarHBondContact O-N 2.66Å; F225-F228 VanDerWaalsContact O-N 3.13Å; S226-F228 VanDerWaalsContact C-N 3.31Å; F228-G230 PolarHBondContact O-N 3Å
229	A	46.2	Very low	48.5	Very low	72 Å²	72	119.4 Å²	119.4	60%	0.595	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	10	-177.3	0	0	0	0	0	114.9	S226	S226-A229 WeakPolarHBondContact O-CB 3.43Å; S226-A229 PolarHBondContact O-N 3.37Å
230	G	44.2	Very low	46.5	Very low	81 Å²	81	120.1 Å²	120.1	84%	0.835	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-4.6	175.7	0	0	0	0	0	115.5	F228	F228-G230 PolarHBondContact O-N 3Å
231	M	38.5	Very low	44.9	Very low	162 Å²	162	116.7 Å²	116.7	80%	0.798	73%	0.725	S	S	*	*			trans	-103	22.1	-175.5	-157.6	63.8	153.7	0	0	113.6	R233	M231-R233 PolarHBondContact O-N 3.21Å
232	A	42.5	Very low	44	Very low	95 Å²	95	123 Å²	123	79%	0.785	75%	0.751	S	S	*	*			trans	-95.8	25.6	-174.1	0	0	0	0	0	114.6
233	R	35.3	Very low	43.1	Very low	248 Å²	248	127.9 Å²	127.9	94%	0.936	77%	0.77	S	S	*	*	S	Bend	trans	-120.2	79.5	175.4	-165.5	176.7	179.5	160.3	-0.4	110.6	M231	M231-R233 PolarHBondContact O-N 3.21Å
234	G	30.2	Very low	42.6	Very low	79 Å²	79	120.9 Å²	120.9	81%	0.814	76%	0.764	S	S	*	*	S	Bend	trans	126.7	115.7	168.6	0	0	0	0	0	112.4
235	G	33.1	Very low	42.5	Very low	76 Å²	76	121.4 Å²	121.4	78%	0.784	77%	0.77	S	S	*	*			trans	140.4	81.1	173.2	0	0	0	0	0	113.3	G237	G235-G237 PolarHBondContact O-N 3.13Å
236	R	31.4	Very low	42.9	Very low	263 Å²	263	115.1 Å²	115.1	99%	0.992	75%	0.751	S	S	*	*			trans	-54.5	95.1	165.8	-177.4	178.7	-178.1	142.9	-2	109.7
237	G	30.9	Very low	43.4	Very low	74 Å²	74	114.3 Å²	114.3	76%	0.763	75%	0.749	S	S	*	*			trans	-170.2	62.2	-179.6	0	0	0	0	0	111.1	G235	G235-G237 PolarHBondContact O-N 3.13Å
238	G	35.1	Very low	44.1	Very low	77 Å²	77	110.3 Å²	110.3	79%	0.794	72%	0.721	S	S	*	*			trans	-87.7	129.9	-170.1	0	0	0	0	0	114.7
239	A	37.7	Very low	45.1	Very low	109 Å²	109	106 Å²	106	90%	0.901	71%	0.709	S	S	*	*			trans	68.4	81.2	134.7	0	0	0	0	0	119.3
240	G	37	Very low	46.4	Very low	93 Å²	93	103.5 Å²	103.5	96%	0.959	69%	0.688	S	S	*	*			trans	-122.4	23.4	169	0	0	0	0	0	115
241	G	39.8	Very low	48.1	Very low	52 Å²	52	108.3 Å²	108.3	54%	0.536	68%	0.681	S	S	.	*	S	Bend	trans	-125.9	132.1	-177.4	0	0	0	0	0	111.9	F243	G241-F243 PolarHBondContact O-N 3Å
242	I	52.3	Low	50.2	Low	155 Å²	155	102.7 Å²	102.7	80%	0.795	66%	0.656	S	S	*	*	S	Bend	trans	78.8	-26.6	169.2	-33.8	166.8	0	0	0	117.1	F245	I242-F245 WeakPolarHBondContact O-CD2 3.08Å
243	F	53.6	Low	52.1	Low	202 Å²	202	100.6 Å²	100.6	89%	0.886	63%	0.63	S	S	*	*			trans	-96.1	4.1	-178.9	-85.6	-88.2	0	0	0	116.4	G241 F245	G241-F243 PolarHBondContact O-N 3Å; F243-F245 PolarHBondContact O-N 3.48Å
244	G	56.8	Low	54.2	Low	64 Å²	64	96.1 Å²	96.1	66%	0.66	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-80.2	-1.3	-175	0	0	0	0	0	116.7	G246	G244-G246 VanDerWaalsContact C-N 3.28Å; G244-G246 PolarHBondContact O-N 3.02Å
245	F	56.1	Low	56.3	Low	133 Å²	133	96.9 Å²	96.9	58%	0.583	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-72.4	-13.3	-168.6	-74.3	-85.8	0	0	0	115.6	I242 F243	I242-F245 WeakPolarHBondContact O-CD2 3.08Å; F243-F245 PolarHBondContact O-N 3.48Å
246	G	58	Low	58.1	Low	33 Å²	33	96.8 Å²	96.8	34%	0.34	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-97.3	-5.8	-176.4	0	0	0	0	0	116	G244	G244-G246 VanDerWaalsContact C-N 3.28Å; G244-G246 PolarHBondContact O-N 3.02Å
247	A	61.2	Low	60.5	Low	61 Å²	61	89.5 Å²	89.5	50%	0.504	58%	0.58	S	S	.	*	S	Bend	trans	-70.9	142.3	178.8	0	0	0	0	0	110.8
248	S	61.8	Low	62.9	Low	26 Å²	26	86.7 Å²	86.7	18%	0.182	55%	0.547	C	S	.	.			trans	-67.3	135.9	174.9	60.1	0	0	0	0	110.7	A250 D346	S248-A250 PolarHBondContact O-N 3.13Å; S248-D346 VanDerWaalsContact CB-OD2 3.25Å; S248-D346 WeakPolarHBondContact CB-OD2 3.2Å; S248-D346 PolarHBondContact N-OD2 3.11Å; S248-D346 PolarHBondContact OG-OD2 3.1Å
249	T	66.6	Low	65.2	Low	72 Å²	72	92.1 Å²	92.1	44%	0.442	55%	0.549	S	S	.	.			trans	-79.2	15.7	172.8	40.7	0	0	0	0	112.7	R251 E331	T249-R251 PolarHBondContact O-N 2.78Å; T249-E331 WeakPolarHBondContact CB-OE2 3.25Å; T249-E331 PolarHBondContact OG1-OE2 3.49Å
250	A	72.7	Confident	67.7	Low	19 Å²	19	88.8 Å²	88.8	16%	0.157	52%	0.518	C	S	.	.			trans	-63.3	120.2	-171.6	0	0	0	0	0	111.8	S248 V252 I325 V327	S248-A250 PolarHBondContact O-N 3.13Å; A250-V252 PolarHBondContact O-N 2.91Å; A250-I325 HydrophobicContact CB-CG2 3.93Å; A250-V327 HydrophobicContact CB-CG2 3.56Å
251	R	79.6	Confident	70.2	Confident	181 Å²	181	87.3 Å²	87.3	68%	0.683	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.3	114.5	175.8	-61.8	-175.8	-172.5	-170.3	3.2	108.2	T249 T326	T249-R251 PolarHBondContact O-N 2.78Å; R251-T326 HydrophobicContact CB-CG2 3.87Å; R251-T326 PolarHBondContact N-O 3.06Å; R251-T326 VanDerWaalsContact N-O 3.14Å; R251-T326 PolarHBondContact O-N 3.28Å
252	V	82.7	Confident	72.6	Confident	45 Å²	45	85.7 Å²	85.7	27%	0.273	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	112.5	176.9	-171.2	0	0	0	0	110.7	A250 I325 T350 K354	A250-V252 PolarHBondContact O-N 2.91Å; V252-I325 HydrophobicContact CB-CG1 4.5Å; V252-I325 HydrophobicContact CG1-CG1 3.96Å; V252-I325 HydrophobicContact CG2-CG1 4.08Å; V252-I325 HydrophobicContact CG2-CG2 4.31Å; V252-T350 HydrophobicContact CG2-CG2 4.14Å; V252-K354 VanDerWaalsContact CB-NZ 3.27Å; V252-K354 HydrophobicContact CG1-CD 3.65Å
253	I	82	Confident	74.3	Confident	50 Å²	50	86 Å²	86	26%	0.256	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	123.6	176.1	-51	-177.1	0	0	0	107.7	D257 I258 F324	I253-D257 HydrophobicContact CG2-CB 3.8Å; I253-I258 HydrophobicContact CB-CG1 4.48Å; I253-I258 HydrophobicContact CG2-CG1 3.68Å; I253-F324 HydrophobicContact CB-CB 4.42Å; I253-F324 HydrophobicContact CD1-CD1 4.1Å; I253-F324 PolarHBondContact N-O 3.25Å; I253-F324 PolarHBondContact O-N 2.98Å; I253-F324 VanDerWaalsContact O-N 3.09Å
254	K	80.1	Confident	76	Confident	154 Å²	154	79.1 Å²	79.1	67%	0.67	43%	0.43	S	S	*	.			trans	-72.6	156.3	177.1	-65.9	-179.9	-179.2	176.4	0	109.7	G256 D257	K254-G256 PolarHBondContact O-N 3.09Å; K254-G256 VanDerWaalsContact O-N 3.1Å; K254-D257 PolarHBondContact O-N 3.44Å
255	Q	74.6	Confident	77.6	Confident	95 Å²	95	76.5 Å²	76.5	44%	0.444	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-49.7	-39.8	-176.3	-65.3	168.1	-11.3	0	0	113.5	N321 P323	Q255-N321 VanDerWaalsContact CG-O 3.29Å; Q255-N321 WeakPolarHBondContact CG-O 3.35Å; Q255-N321 PolarHBondContact NE2-O 2.68Å; Q255-P323 HydrophobicContact CG-CG 4.09Å
256	G	71	Confident	79.3	Confident	75 Å²	75	71 Å²	71	77%	0.773	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-76.9	-17.5	-177.8	0	0	0	0	0	115.7	K254	K254-G256 PolarHBondContact O-N 3.09Å; K254-G256 VanDerWaalsContact O-N 3.1Å
257	D	80.6	Confident	80.7	Confident	110 Å²	110	70 Å²	70	59%	0.588	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-88.6	-10	-176.1	-60.5	-34.9	0	0	0	112.3	I253 K254 K259	I253-D257 HydrophobicContact CG2-CB 3.8Å; K254-D257 PolarHBondContact O-N 3.44Å; D257-K259 PolarHBondContact O-N 3.38Å
258	I	82.3	Confident	82	Confident	14 Å²	14	67.6 Å²	67.6	7%	0.072	35%	0.349	C	S	.	.			trans	-81.5	99.9	-179.6	-53.3	171.9	0	0	0	109	I253 R261 A317 F324	I253-I258 HydrophobicContact CB-CG1 4.48Å; I253-I258 HydrophobicContact CG2-CG1 3.68Å; I258-R261 PolarHBondContact O-NH1 2.73Å; I258-A317 HydrophobicContact CD1-CB 3.82Å; I258-F324 HydrophobicContact CD1-CB 3.65Å
259	K	84	Confident	83.2	Confident	192 Å²	192	68.7 Å²	68.7	84%	0.835	35%	0.351	S	S	*	.			trans	-78.9	-20.1	179.9	-64.3	-176.9	-179.8	-179.5	0	114.6	D257	D257-K259 PolarHBondContact O-N 3.38Å
260	V	89.8	Confident	84.2	Confident	39 Å²	39	72.5 Å²	72.5	24%	0.236	36%	0.364	C	S	.	.			trans	-84.7	138.1	-173.3	-172.3	0	0	0	0	110.6	D264 A315	V260-D264 HydrophobicContact CG1-CB 4.2Å; V260-A315 HydrophobicContact CG1-CB 4.06Å
261	R	89.3	Confident	85.1	Confident	62 Å²	62	71.8 Å²	71.8	23%	0.234	36%	0.358	C	S	.	.			trans	-132	170.6	178.3	-69.8	-64.2	-175.3	-89.8	8.2	110.4	I258 K263 D264 G318 E319 N321	I258-R261 PolarHBondContact O-NH1 2.73Å; R261-K263 HydrophobicContact CB-CD 4.42Å; R261-K263 HydrophobicContact CB-CG 3.96Å; R261-K263 PolarHBondContact O-N 3.35Å; R261-D264 PolarHBondContact N-OD2 3.42Å; R261-D264 PolarHBondContact O-N 3.25Å; R261-G318 PolarHBondContact NE-O 3.24Å; R261-G318 PolarHBondContact NH1-O 2.78Å; R261-G318 PolarHBondContact NH2-O 2.79Å; R261-E319 VanDerWaalsContact CB-OE1 3.31Å; R261-E319 WeakPolarHBondContact CB-OE1 3.48Å; R261-N321 PolarHBondContact NH2-OD1 3.02Å
262	F	89.7	Confident	85.6	Confident	17 Å²	17	64 Å²	64	8%	0.075	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-64.1	-22.4	179.7	-75.6	-27.5	0	0	0	113.3	D264 V265 I275 M276 V279 L312 A315 E319 W717	F262-D264 PolarHBondContact O-N 3.13Å; F262-V265 PolarHBondContact O-N 3.28Å; F262-I275 HydrophobicContact CE1-CG2 4.23Å; F262-I275 HydrophobicContact CZ-CG2 3.89Å; F262-M276 HydrophobicContact CD2-CG 4.19Å; F262-M276 HydrophobicContact CE2-CG 3.7Å; F262-M276 HydrophobicContact CZ-CG 4.46Å; F262-V279 HydrophobicContact CE2-CG2 3.91Å; F262-V279 HydrophobicContact CZ-CG2 3.74Å; F262-L312 HydrophobicContact CE1-CD1 4.27Å; F262-A315 HydrophobicContact CD1-CB 3.65Å; F262-A315 HydrophobicContact CE1-CB 3.96Å; F262-E319 HydrophobicContact CB-CG 4.15Å; F262-E319 HydrophobicContact CD1-CG 4.12Å; F262-E319 HydrophobicContact CD2-CB 4.16Å; F262-E319 HydrophobicContact CD2-CG 3.53Å; F262-E319 HydrophobicContact CE1-CG 4.39Å; F262-E319 HydrophobicContact CE2-CB 3.97Å; F262-E319 HydrophobicContact CE2-CG 3.83Å; F262-E319 HydrophobicContact CG-CG 3.65Å; F262-E319 HydrophobicContact CZ-CB 4.33Å; F262-E319 HydrophobicContact CZ-CG 4.24Å; F262-E319 PolarHBondContact N-OE1 2.86Å; F262-W717 HydrophobicContact CD2-CH2 4.26Å
263	K	88.1	Confident	85.9	Confident	162 Å²	162	64.2 Å²	64.2	70%	0.704	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-64.4	-24.3	171.5	70.3	-178.8	-174.9	173.5	0	113.9	R261	R261-K263 HydrophobicContact CB-CD 4.42Å; R261-K263 HydrophobicContact CB-CG 3.96Å; R261-K263 PolarHBondContact O-N 3.35Å
264	D	89.5	Confident	86.3	Confident	58 Å²	58	65.4 Å²	65.4	31%	0.31	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-92	-4	-178.2	-51	-48	0	0	0	111.7	V260 R261 F262	V260-D264 HydrophobicContact CG1-CB 4.2Å; R261-D264 PolarHBondContact N-OD2 3.42Å; R261-D264 PolarHBondContact O-N 3.25Å; F262-D264 PolarHBondContact O-N 3.13Å
265	V	90.9	Very high	86.8	Confident	9 Å²	9	58 Å²	58	6%	0.055	30%	0.301	C	S	.	.			trans	-110	139.3	174.6	-175.1	0	0	0	0	107	F262 K272 M311 L312 A315	F262-V265 PolarHBondContact O-N 3.28Å; V265-K272 WeakPolarHBondContact O-CE 3.4Å; V265-K272 PolarHBondContact O-NZ 3.03Å; V265-M311 HydrophobicContact CG2-CB 4.49Å; V265-L312 HydrophobicContact CG1-CD1 4.11Å; V265-A315 HydrophobicContact CG2-CB 3.86Å
266	A	90.5	Very high	87.4	Confident	17 Å²	17	54.4 Å²	54.4	14%	0.14	28%	0.284	C	S	.	.			trans	-147.3	161.9	-178.4	0	0	0	0	0	110.9	C268 I442 V445	A266-C268 VanDerWaalsContact C-N 3.33Å; A266-C268 PolarHBondContact O-N 3.32Å; A266-I442 HydrophobicContact CB-CG1 3.87Å; A266-I442 WeakPolarHBondContact O-CG1 3.36Å; A266-V445 HydrophobicContact CB-CG2 4.17Å
267	G	86.9	Confident	88.1	Confident	12 Å²	12	54.3 Å²	54.3	12%	0.124	26%	0.264	C	S	.	.	S	Bend	trans	74.5	16.9	174	0	0	0	0	0	115.5	G438	G267-G438 VanDerWaalsContact CA-CA 3.41Å
268	C	89.3	Confident	88.4	Confident	11 Å²	11	49.3 Å²	49.3	7%	0.074	24%	0.237	C	C	.	.			trans	-141.9	47.1	176.1	60.1	0	0	0	0	111	A266 E270 A271 K272 V431	A266-C268 VanDerWaalsContact C-N 3.33Å; A266-C268 PolarHBondContact O-N 3.32Å; C268-E270 VanDerWaalsContact C-N 3.32Å; C268-E270 PolarHBondContact O-N 3.44Å; C268-A271 HydrophobicContact CB-CB 4.27Å; C268-A271 PolarHBondContact O-N 3.18Å; C268-A271 VanDerWaalsContact O-N 3.16Å; C268-K272 WeakPolarHBondContact O-CG 3.09Å; C268-K272 PolarHBondContact O-N 3.06Å; C268-V431 HydrophobicContact CB-CG1 4.15Å
269	E	87.2	Confident	88.6	Confident	49 Å²	49	48.7 Å²	48.7	23%	0.229	23%	0.233	C	C	.	.	H	α-helix	trans	-61.8	-35.8	-172.2	-59.9	-51	134.4	0	0	113.2	K272 L273 V708	E269-K272 PolarHBondContact O-N 3.19Å; E269-K272 IonicContact OE1-NZ 3.8Å; E269-K272 PolarHBondContact OE1-NZ 3.44Å; E269-K272 WeakPolarHBondContact OE2-CD 3.25Å; E269-K272 IonicContact OE2-NZ 2.87Å; E269-K272 PolarHBondContact OE2-NZ 3.37Å; E269-L273 WeakPolarHBondContact O-CB 3.36Å; E269-L273 PolarHBondContact O-N 2.94Å; E269-V708 HydrophobicContact CB-CB 3.85Å; E269-V708 HydrophobicContact CB-CG2 3.44Å; E269-V708 VanDerWaalsContact CB-CG2 3.44Å; E269-V708 HydrophobicContact CG-CG2 4.13Å
270	E	87.8	Confident	88.7	Confident	151 Å²	151	39.6 Å²	39.6	71%	0.706	19%	0.194	S	C	*	.	H	α-helix	trans	-61.3	-48	173.4	-61.8	-177.5	160.1	0	0	111.8	C268 K272 L273 E274	C268-E270 VanDerWaalsContact C-N 3.32Å; C268-E270 PolarHBondContact O-N 3.44Å; E270-K272 VanDerWaalsContact C-N 3.34Å; E270-K272 PolarHBondContact O-N 3.38Å; E270-L273 WeakPolarHBondContact O-CB 3.47Å; E270-L273 PolarHBondContact O-N 3.12Å; E270-E274 PolarHBondContact O-N 3.24Å
271	A	91.8	Very high	88.4	Confident	4 Å²	4	38.3 Å²	38.3	3%	0.033	19%	0.185	C	C	.	.	H	α-helix	trans	-65.8	-37.3	177.8	0	0	0	0	0	111.8	C268 L273 I275 L312 I429 V431	C268-A271 HydrophobicContact CB-CB 4.27Å; C268-A271 PolarHBondContact O-N 3.18Å; C268-A271 VanDerWaalsContact O-N 3.16Å; A271-L273 VanDerWaalsContact C-N 3.34Å; A271-I275 WeakPolarHBondContact O-CB 3.45Å; A271-I275 VanDerWaalsContact O-CG1 3.22Å; A271-I275 WeakPolarHBondContact O-CG1 3.48Å; A271-I275 PolarHBondContact O-N 3Å; A271-I275 VanDerWaalsContact O-N 3.16Å; A271-L312 HydrophobicContact CB-CD2 4.19Å; A271-I429 HydrophobicContact CB-CG2 3.63Å; A271-V431 HydrophobicContact CB-CG2 4.1Å
272	K	90	Very high	88.1	Confident	17 Å²	17	36.5 Å²	36.5	7%	0.074	18%	0.18	C	C	.	.	H	α-helix	trans	-62.2	-42.6	172.6	-75.4	175.8	-179.3	175	0	111.3	V265 C268 E269 E270 E274 I275 M276 L312	V265-K272 WeakPolarHBondContact O-CE 3.4Å; V265-K272 PolarHBondContact O-NZ 3.03Å; C268-K272 WeakPolarHBondContact O-CG 3.09Å; C268-K272 PolarHBondContact O-N 3.06Å; E269-K272 PolarHBondContact O-N 3.19Å; E269-K272 IonicContact OE1-NZ 3.8Å; E269-K272 PolarHBondContact OE1-NZ 3.44Å; E269-K272 WeakPolarHBondContact OE2-CD 3.25Å; E269-K272 IonicContact OE2-NZ 2.87Å; E269-K272 PolarHBondContact OE2-NZ 3.37Å; E270-K272 VanDerWaalsContact C-N 3.34Å; E270-K272 PolarHBondContact O-N 3.38Å; K272-E274 PolarHBondContact O-N 3.33Å; K272-I275 CarbonylContact O-C 3.56Å; K272-I275 PolarHBondContact O-N 2.94Å; K272-I275 VanDerWaalsContact O-N 3.11Å; K272-M276 WeakPolarHBondContact O-CB 3.32Å; K272-M276 VanDerWaalsContact O-CG 3.26Å; K272-M276 WeakPolarHBondContact O-CG 3.3Å; K272-M276 PolarHBondContact O-N 2.74Å; K272-L312 HydrophobicContact CG-CD1 3.82Å
273	L	88.7	Confident	87.7	Confident	51 Å²	51	38.6 Å²	38.6	27%	0.267	19%	0.189	S	C	.	.	H	α-helix	trans	-60.5	-46	-178.8	-176.8	66.9	0	0	0	111.6	E269 E270 A271 I275 M276 P711 L714	E269-L273 WeakPolarHBondContact O-CB 3.36Å; E269-L273 PolarHBondContact O-N 2.94Å; E270-L273 WeakPolarHBondContact O-CB 3.47Å; E270-L273 PolarHBondContact O-N 3.12Å; A271-L273 VanDerWaalsContact C-N 3.34Å; L273-I275 VanDerWaalsContact C-N 3.28Å; L273-I275 PolarHBondContact O-N 3.05Å; L273-M276 WeakPolarHBondContact O-CB 3.41Å; L273-M276 PolarHBondContact O-N 3.16Å; L273-P711 HydrophobicContact CD1-CG 3.78Å; L273-P711 HydrophobicContact CD2-CG 4.29Å; L273-L714 HydrophobicContact CD1-CD1 3.68Å
274	E	89.7	Confident	87.5	Confident	74 Å²	74	32.6 Å²	32.6	35%	0.346	17%	0.165	S	C	.	.	H	α-helix	trans	-61.4	-37.9	174.4	-72	-162.2	-148	0	0	112.2	E270 K272 E277 F278 I429	E270-E274 PolarHBondContact O-N 3.24Å; K272-E274 PolarHBondContact O-N 3.33Å; E274-E277 WeakPolarHBondContact O-CB 3.39Å; E274-E277 PolarHBondContact O-N 3.25Å; E274-F278 WeakPolarHBondContact O-CD2 3.48Å; E274-I429 HydrophobicContact CB-CD1 4.29Å; E274-I429 HydrophobicContact CB-CG1 4.11Å; E274-I429 WeakPolarHBondContact OE2-CG1 3.33Å
275	I	90.6	Very high	87	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-73.4	-31.9	179	-69.3	175.1	0	0	0	112.3	F262 A271 K272 L273 E277 F278 V279 L301 L312 T316 M406 I429	F262-I275 HydrophobicContact CE1-CG2 4.23Å; F262-I275 HydrophobicContact CZ-CG2 3.89Å; A271-I275 WeakPolarHBondContact O-CB 3.45Å; A271-I275 VanDerWaalsContact O-CG1 3.22Å; A271-I275 WeakPolarHBondContact O-CG1 3.48Å; A271-I275 PolarHBondContact O-N 3Å; A271-I275 VanDerWaalsContact O-N 3.16Å; K272-I275 CarbonylContact O-C 3.56Å; K272-I275 PolarHBondContact O-N 2.94Å; K272-I275 VanDerWaalsContact O-N 3.11Å; L273-I275 VanDerWaalsContact C-N 3.28Å; L273-I275 PolarHBondContact O-N 3.05Å; I275-E277 PolarHBondContact O-N 2.68Å; I275-F278 WeakPolarHBondContact O-CB 3.44Å; I275-F278 PolarHBondContact O-N 3.24Å; I275-V279 PolarHBondContact O-N 3.37Å; I275-L301 HydrophobicContact CD1-CD2 3.76Å; I275-L312 HydrophobicContact CD1-CD1 3.96Å; I275-L312 HydrophobicContact CD1-CD2 3.3Å; I275-L312 HydrophobicContact CD1-CG 3.37Å; I275-T316 HydrophobicContact CG2-CG2 3.56Å; I275-T316 WeakPolarHBondContact CG2-OG1 3.33Å; I275-M406 HydrophobicContact CD1-CE 4.24Å; I275-I429 HydrophobicContact CD1-CD1 4.35Å; I275-I429 HydrophobicContact CG1-CD1 3.68Å
276	M	88.6	Confident	86.5	Confident	18 Å²	18	37 Å²	37	9%	0.089	19%	0.186	C	C	.	.	H	α-helix	trans	-60.4	-28.3	175.5	-78	178	73.2	0	0	111.7	F262 K272 L273 F278 V279 N280 I710 L714 W717	F262-M276 HydrophobicContact CD2-CG 4.19Å; F262-M276 HydrophobicContact CE2-CG 3.7Å; F262-M276 HydrophobicContact CZ-CG 4.46Å; K272-M276 WeakPolarHBondContact O-CB 3.32Å; K272-M276 VanDerWaalsContact O-CG 3.26Å; K272-M276 WeakPolarHBondContact O-CG 3.3Å; K272-M276 PolarHBondContact O-N 2.74Å; L273-M276 WeakPolarHBondContact O-CB 3.41Å; L273-M276 PolarHBondContact O-N 3.16Å; M276-F278 VanDerWaalsContact C-N 3.3Å; M276-F278 PolarHBondContact O-N 3.38Å; M276-V279 PolarHBondContact O-N 3.21Å; M276-N280 WeakPolarHBondContact O-CB 3.39Å; M276-N280 PolarHBondContact O-N 3.46Å; M276-I710 HydrophobicContact CE-CD1 4.27Å; M276-I710 HydrophobicContact CE-CG2 3.99Å; M276-L714 HydrophobicContact CB-CD1 4.01Å; M276-L714 HydrophobicContact CB-CD2 4.4Å; M276-L714 HydrophobicContact CE-CB 4.36Å; M276-W717 HydrophobicContact CE-CD2 4.22Å; M276-W717 HydrophobicContact CE-CG 4.17Å; M276-W717 HydrophobicContact CE-CZ2 4.45Å
277	E	85.8	Confident	86.2	Confident	74 Å²	74	39.3 Å²	39.3	35%	0.346	19%	0.194	S	C	.	.	H	α-helix	trans	-57.8	-43.6	171.2	-61.3	-171.9	166.6	0	0	111.4	E274 I275 N280 F281 Y288 R427	E274-E277 WeakPolarHBondContact O-CB 3.39Å; E274-E277 PolarHBondContact O-N 3.25Å; I275-E277 PolarHBondContact O-N 2.68Å; E277-N280 PolarHBondContact O-N 2.98Å; E277-F281 WeakPolarHBondContact O-CB 3.3Å; E277-F281 PolarHBondContact O-N 3.21Å; E277-Y288 PolarHBondContact O-OH 3.23Å; E277-R427 IonicContact OE2-CZ 3.97Å; E277-R427 IonicContact OE2-NH2 3.81Å; E277-R427 PolarHBondContact OE2-NH2 3.39Å
278	F	85.9	Confident	86	Confident	5 Å²	5	41 Å²	41	2%	0.022	20%	0.197	C	C	.	.	H	α-helix	trans	-67.6	-39.4	178.2	-63.8	-93.8	0	0	0	112	E274 I275 M276 F281 L282 P296 A299 I404 R427 I429	E274-F278 WeakPolarHBondContact O-CD2 3.48Å; I275-F278 WeakPolarHBondContact O-CB 3.44Å; I275-F278 PolarHBondContact O-N 3.24Å; M276-F278 VanDerWaalsContact C-N 3.3Å; M276-F278 PolarHBondContact O-N 3.38Å; F278-F281 WeakPolarHBondContact O-CB 3.48Å; F278-F281 PolarHBondContact O-N 2.69Å; F278-L282 WeakPolarHBondContact O-CG 3.4Å; F278-L282 PolarHBondContact O-N 2.96Å; F278-P296 HydrophobicContact CE1-CB 3.74Å; F278-P296 HydrophobicContact CE1-CG 4.07Å; F278-P296 HydrophobicContact CZ-CB 4.18Å; F278-P296 HydrophobicContact CZ-CG 4.46Å; F278-A299 HydrophobicContact CE1-CB 4.14Å; F278-A299 HydrophobicContact CE2-CB 4.15Å; F278-A299 HydrophobicContact CZ-CB 3.57Å; F278-I404 HydrophobicContact CB-CD1 4.16Å; F278-I404 HydrophobicContact CD1-CD1 4.08Å; F278-I404 HydrophobicContact CD1-CG2 3.87Å; F278-I404 HydrophobicContact CE1-CG2 4.23Å; F278-R427 HydrophobicContact CE2-CB 4.45Å; F278-R427 HydrophobicContact CE2-CG 4.17Å; F278-R427 HydrophobicContact CZ-CB 3.91Å; F278-R427 HydrophobicContact CZ-CG 3.58Å; F278-I429 HydrophobicContact CE2-CD1 4.23Å
279	V	87.1	Confident	85.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-47.6	175.7	177.1	0	0	0	0	110.7	F262 I275 M276 F281 L282 K283 T316 E319 A320 W717	F262-V279 HydrophobicContact CE2-CG2 3.91Å; F262-V279 HydrophobicContact CZ-CG2 3.74Å; I275-V279 PolarHBondContact O-N 3.37Å; M276-V279 PolarHBondContact O-N 3.21Å; V279-F281 PolarHBondContact O-N 2.72Å; V279-L282 PolarHBondContact O-N 2.58Å; V279-K283 HydrophobicContact CG1-CD 4.4Å; V279-K283 PolarHBondContact O-N 3.21Å; V279-T316 HydrophobicContact CG2-CG2 3.65Å; V279-E319 HydrophobicContact CG1-CB 4.04Å; V279-E319 HydrophobicContact CG2-CB 4.31Å; V279-A320 HydrophobicContact CG1-CB 4.17Å; V279-W717 HydrophobicContact CG1-CE3 3.93Å; V279-W717 HydrophobicContact CG1-CZ3 4.05Å
280	N	85.6	Confident	85.5	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.011	25%	0.245	C	C	.	.	H	α-helix	trans	-64	-35.1	176.8	-173.2	35.4	0	0	0	111	M276 E277 K283 N284 Q287 Y288 L714 W717	M276-N280 WeakPolarHBondContact O-CB 3.39Å; M276-N280 PolarHBondContact O-N 3.46Å; E277-N280 PolarHBondContact O-N 2.98Å; N280-K283 PolarHBondContact O-N 3.49Å; N280-N284 WeakPolarHBondContact O-CA 3.36Å; N280-N284 WeakPolarHBondContact O-CB 3.39Å; N280-N284 PolarHBondContact O-N 3.36Å; N280-N284 PolarHBondContact OD1-ND2 2.76Å; N280-Q287 PolarHBondContact ND2-OE1 3.08Å; N280-Y288 PolarHBondContact ND2-OH 3.36Å; N280-L714 HydrophobicContact CB-CD2 3.62Å; N280-W717 HydrophobicContact CB-CB 4.5Å
281	F	83	Confident	85.5	Confident	11 Å²	11	50.4 Å²	50.4	5%	0.048	25%	0.247	C	C	.	.	H	α-helix	trans	-61.8	-46	173.6	178.7	-89.2	0	0	0	112	E277 F278 V279 K283 P285 Y288 I295	E277-F281 WeakPolarHBondContact O-CB 3.3Å; E277-F281 PolarHBondContact O-N 3.21Å; F278-F281 WeakPolarHBondContact O-CB 3.48Å; F278-F281 PolarHBondContact O-N 2.69Å; V279-F281 PolarHBondContact O-N 2.72Å; F281-K283 VanDerWaalsContact C-N 3.33Å; F281-K283 PolarHBondContact O-N 3.2Å; F281-P285 HydrophobicContact CE2-CB 4.43Å; F281-P285 HydrophobicContact CZ-CB 4.22Å; F281-P285 WeakPolarHBondContact O-CA 3.44Å; F281-P285 WeakPolarHBondContact O-CD 3.48Å; F281-Y288 VanDerWaalsContact CA-CE2 3.49Å; F281-Y288 HydrophobicContact CB-CD2 4.13Å; F281-Y288 HydrophobicContact CB-CE2 3.86Å; F281-Y288 AromaticContact CD2-CD2 3.49Å; F281-Y288 HydrophobicContact CD2-CD2 3.49Å; F281-Y288 VanDerWaalsContact CD2-CD2 3.49Å; F281-Y288 HydrophobicContact CD2-CE2 4.09Å; F281-Y288 AromaticContact CD2-CG 3.8Å; F281-Y288 HydrophobicContact CD2-CG 3.8Å; F281-Y288 HydrophobicContact CE2-CD2 4.27Å; F281-Y288 HydrophobicContact CE2-CG 4.39Å; F281-Y288 HydrophobicContact CG-CD2 4.29Å; F281-I295 HydrophobicContact CD1-CG2 3.82Å; F281-I295 HydrophobicContact CE1-CB 4.23Å; F281-I295 HydrophobicContact CE1-CD1 3.81Å; F281-I295 HydrophobicContact CE1-CG1 3.95Å; F281-I295 HydrophobicContact CE1-CG2 3.35Å; F281-I295 HydrophobicContact CE2-CB 4.28Å; F281-I295 HydrophobicContact CE2-CD1 4.1Å; F281-I295 HydrophobicContact CE2-CG1 3.61Å; F281-I295 HydrophobicContact CE2-CG2 4.12Å; F281-I295 HydrophobicContact CG-CG2 4.42Å; F281-I295 HydrophobicContact CZ-CB 3.94Å; F281-I295 HydrophobicContact CZ-CD1 3.24Å; F281-I295 HydrophobicContact CZ-CG1 3.23Å; F281-I295 HydrophobicContact CZ-CG2 3.58Å
282	L	82.6	Confident	85.1	Confident	24 Å²	24	53.2 Å²	53.2	13%	0.126	28%	0.276	C	S	.	.	H	α-helix	trans	-65.6	-34.4	177.8	-72.9	177.3	0	0	0	112.9	F278 V279 A320 V322 P356 I358 I404	F278-L282 WeakPolarHBondContact O-CG 3.4Å; F278-L282 PolarHBondContact O-N 2.96Å; V279-L282 PolarHBondContact O-N 2.58Å; L282-A320 HydrophobicContact CB-CB 4.15Å; L282-A320 HydrophobicContact CD1-CB 3.6Å; L282-V322 HydrophobicContact CD1-CG1 4.29Å; L282-V322 HydrophobicContact CD1-CG2 3.96Å; L282-P356 HydrophobicContact CD2-CB 4.46Å; L282-I358 HydrophobicContact CD1-CD1 4.11Å; L282-I358 HydrophobicContact CD1-CG1 4.14Å; L282-I404 HydrophobicContact CD1-CD1 3.75Å; L282-I404 HydrophobicContact CD2-CD1 3.61Å; L282-I404 HydrophobicContact CD2-CG1 4.24Å; L282-I404 HydrophobicContact CG-CD1 3.52Å
283	K	82.5	Confident	84.8	Confident	62 Å²	62	54.6 Å²	54.6	27%	0.27	29%	0.291	S	S	.	.	H	α-helix	trans	-80.2	-43.9	178.2	-72.4	-175.4	177	175.7	0	113.4	V279 N280 F281 P285 E319 W717 N718	V279-K283 HydrophobicContact CG1-CD 4.4Å; V279-K283 PolarHBondContact O-N 3.21Å; N280-K283 PolarHBondContact O-N 3.49Å; F281-K283 VanDerWaalsContact C-N 3.33Å; F281-K283 PolarHBondContact O-N 3.2Å; K283-P285 VanDerWaalsContact C-CD 3.42Å; K283-P285 WeakPolarHBondContact O-CD 3.35Å; K283-E319 WeakPolarHBondContact CE-O 3.48Å; K283-E319 PolarHBondContact NZ-O 3.49Å; K283-W717 WeakPolarHBondContact CD-O 3.34Å; K283-N718 PolarHBondContact NZ-OD1 2.96Å
284	N	82.8	Confident	84.2	Confident	36 Å²	36	60.8 Å²	60.8	19%	0.193	32%	0.316	C	S	.	.			trans	-125.7	58.7	-171.6	-65	-54.3	0	0	0	112.2	N280 Q286 Q287	N280-N284 WeakPolarHBondContact O-CA 3.36Å; N280-N284 WeakPolarHBondContact O-CB 3.39Å; N280-N284 PolarHBondContact O-N 3.36Å; N280-N284 PolarHBondContact OD1-ND2 2.76Å; N284-Q286 PolarHBondContact O-N 3.31Å; N284-Q286 VanDerWaalsContact O-N 3.09Å; N284-Q287 WeakPolarHBondContact O-CB 2.99Å; N284-Q287 PolarHBondContact O-N 3.46Å; N284-Q287 VanDerWaalsContact O-N 3.11Å
285	P	79.2	Confident	83.7	Confident	37 Å²	37	59 Å²	59	24%	0.24	31%	0.308	C	S	.	.	H	α-helix	trans	-59.8	-30.4	-175.3	23.6	-33.9	0	0	0	112.7	F281 K283 Q287 Y288 V289	F281-P285 HydrophobicContact CE2-CB 4.43Å; F281-P285 HydrophobicContact CZ-CB 4.22Å; F281-P285 WeakPolarHBondContact O-CA 3.44Å; F281-P285 WeakPolarHBondContact O-CD 3.48Å; K283-P285 VanDerWaalsContact C-CD 3.42Å; K283-P285 WeakPolarHBondContact O-CD 3.35Å; P285-Q287 VanDerWaalsContact C-N 3.26Å; P285-Q287 PolarHBondContact O-N 3.29Å; P285-Y288 PolarHBondContact O-N 2.86Å; P285-Y288 VanDerWaalsContact O-N 3.17Å; P285-V289 WeakPolarHBondContact O-CG2 3.49Å; P285-V289 PolarHBondContact O-N 2.96Å
286	Q	81.5	Confident	83.3	Confident	123 Å²	123	60.3 Å²	60.3	58%	0.575	32%	0.317	S	S	*	.	H	α-helix	trans	-61.3	-30.6	-179.9	-62.8	-61.7	-14.9	0	0	113.5	N284 Y288 K290	N284-Q286 PolarHBondContact O-N 3.31Å; N284-Q286 VanDerWaalsContact O-N 3.09Å; Q286-Y288 VanDerWaalsContact C-N 3.29Å; Q286-Y288 PolarHBondContact O-N 3.14Å; Q286-K290 WeakPolarHBondContact O-CB 3.22Å; Q286-K290 WeakPolarHBondContact O-CG 3.39Å; Q286-K290 PolarHBondContact O-N 2.78Å
287	Q	83.4	Confident	83	Confident	65 Å²	65	61.3 Å²	61.3	30%	0.304	32%	0.32	S	S	.	.	H	α-helix	trans	-60.7	-42	177.3	-179.2	178.2	-0.5	0	0	111	N280 N284 P285	N280-Q287 PolarHBondContact ND2-OE1 3.08Å; N284-Q287 WeakPolarHBondContact O-CB 2.99Å; N284-Q287 PolarHBondContact O-N 3.46Å; N284-Q287 VanDerWaalsContact O-N 3.11Å; P285-Q287 VanDerWaalsContact C-N 3.26Å; P285-Q287 PolarHBondContact O-N 3.29Å
288	Y	83.2	Confident	83.2	Confident	47 Å²	47	57.8 Å²	57.8	18%	0.184	30%	0.304	C	S	.	.	H	α-helix	trans	-81.3	-39	-178.6	-62.4	-79.8	0	0	0	112.1	E277 N280 F281 P285 Q286 K290 L291 G292 A293	E277-Y288 PolarHBondContact O-OH 3.23Å; N280-Y288 PolarHBondContact ND2-OH 3.36Å; F281-Y288 VanDerWaalsContact CA-CE2 3.49Å; F281-Y288 HydrophobicContact CB-CD2 4.13Å; F281-Y288 HydrophobicContact CB-CE2 3.86Å; F281-Y288 AromaticContact CD2-CD2 3.49Å; F281-Y288 HydrophobicContact CD2-CD2 3.49Å; F281-Y288 VanDerWaalsContact CD2-CD2 3.49Å; F281-Y288 HydrophobicContact CD2-CE2 4.09Å; F281-Y288 AromaticContact CD2-CG 3.8Å; F281-Y288 HydrophobicContact CD2-CG 3.8Å; F281-Y288 HydrophobicContact CE2-CD2 4.27Å; F281-Y288 HydrophobicContact CE2-CG 4.39Å; F281-Y288 HydrophobicContact CG-CD2 4.29Å; P285-Y288 PolarHBondContact O-N 2.86Å; P285-Y288 VanDerWaalsContact O-N 3.17Å; Q286-Y288 VanDerWaalsContact C-N 3.29Å; Q286-Y288 PolarHBondContact O-N 3.14Å; Y288-K290 VanDerWaalsContact C-N 3.34Å; Y288-K290 PolarHBondContact O-N 3.04Å; Y288-L291 PolarHBondContact O-N 3.19Å; Y288-L291 VanDerWaalsContact O-N 3.17Å; Y288-G292 PolarHBondContact O-N 3Å; Y288-A293 HydrophobicContact CD1-CB 4.4Å; Y288-A293 PolarHBondContact O-N 2.88Å
289	V	80.9	Confident	83.6	Confident	89 Å²	89	57.5 Å²	57.5	54%	0.539	30%	0.303	S	S	.	.	H	α-helix	trans	-61.9	-41.1	177.2	174	0	0	0	0	111.4	P285 L291 G292	P285-V289 WeakPolarHBondContact O-CG2 3.49Å; P285-V289 PolarHBondContact O-N 2.96Å; V289-L291 PolarHBondContact O-N 2.82Å; V289-G292 PolarHBondContact O-N 2.82Å
290	K	85.1	Confident	84	Confident	177 Å²	177	57.6 Å²	57.6	77%	0.77	30%	0.303	S	S	*	.	H	α-helix	trans	-59.9	-29.7	176.8	-77.5	177.3	-178.9	-171.8	0	113.4	Q286 Y288	Q286-K290 WeakPolarHBondContact O-CB 3.22Å; Q286-K290 WeakPolarHBondContact O-CG 3.39Å; Q286-K290 PolarHBondContact O-N 2.78Å; Y288-K290 VanDerWaalsContact C-N 3.34Å; Y288-K290 PolarHBondContact O-N 3.04Å
291	L	87.2	Confident	84.5	Confident	142 Å²	142	57.5 Å²	57.5	74%	0.743	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-4.6	178.2	-63.9	173.4	0	0	0	112.9	Y288 V289 A293	Y288-L291 PolarHBondContact O-N 3.19Å; Y288-L291 VanDerWaalsContact O-N 3.17Å; V289-L291 PolarHBondContact O-N 2.82Å; L291-A293 PolarHBondContact O-N 2.82Å
292	G	83.6	Confident	85	Confident	64 Å²	64	57.3 Å²	57.3	66%	0.66	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.4	15.8	-173.4	0	0	0	0	0	113.9	Y288 V289 K294	Y288-G292 PolarHBondContact O-N 3Å; V289-G292 PolarHBondContact O-N 2.82Å; G292-K294 PolarHBondContact O-N 2.96Å
293	A	84	Confident	85.5	Confident	46 Å²	46	56.5 Å²	56.5	38%	0.38	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-70.8	128.8	178.3	0	0	0	0	0	110.3	Y288 L291	Y288-A293 HydrophobicContact CD1-CB 4.4Å; Y288-A293 PolarHBondContact O-N 2.88Å; L291-A293 PolarHBondContact O-N 2.82Å
294	K	77	Confident	86	Confident	181 Å²	181	55.6 Å²	55.6	79%	0.787	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-77.4	142.8	176	-67.6	-177.9	-178.7	177.6	0	110.2	G292	G292-K294 PolarHBondContact O-N 2.96Å
295	I	78	Confident	86.5	Confident	37 Å²	37	58 Å²	58	19%	0.19	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-69.6	126.9	176.8	-43.2	177.7	0	0	0	108.7	F281 K297 T398	F281-I295 HydrophobicContact CD1-CG2 3.82Å; F281-I295 HydrophobicContact CE1-CB 4.23Å; F281-I295 HydrophobicContact CE1-CD1 3.81Å; F281-I295 HydrophobicContact CE1-CG1 3.95Å; F281-I295 HydrophobicContact CE1-CG2 3.35Å; F281-I295 HydrophobicContact CE2-CB 4.28Å; F281-I295 HydrophobicContact CE2-CD1 4.1Å; F281-I295 HydrophobicContact CE2-CG1 3.61Å; F281-I295 HydrophobicContact CE2-CG2 4.12Å; F281-I295 HydrophobicContact CG-CG2 4.42Å; F281-I295 HydrophobicContact CZ-CB 3.94Å; F281-I295 HydrophobicContact CZ-CD1 3.24Å; F281-I295 HydrophobicContact CZ-CG1 3.23Å; F281-I295 HydrophobicContact CZ-CG2 3.58Å; I295-K297 PolarHBondContact O-N 3.02Å; I295-T398 HydrophobicContact CB-CG2 4.36Å; I295-T398 HydrophobicContact CD1-CG2 4.15Å; I295-T398 HydrophobicContact CG1-CG2 3.96Å
296	P	82.6	Confident	87.2	Confident	27 Å²	27	57.9 Å²	57.9	18%	0.175	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-65.4	123.6	168.5	-10.1	23.7	0	0	0	109.1	F278 R427	F278-P296 HydrophobicContact CE1-CB 3.74Å; F278-P296 HydrophobicContact CE1-CG 4.07Å; F278-P296 HydrophobicContact CZ-CB 4.18Å; F278-P296 HydrophobicContact CZ-CG 4.46Å; P296-R427 HydrophobicContact CB-CG 4.26Å
297	K	83.3	Confident	87.8	Confident	38 Å²	38	52.8 Å²	52.8	17%	0.165	30%	0.3	C	S	.	.			trans	-73.7	-31.2	-174.4	-74.4	174.6	161.3	-159.4	0	112.7	I295 M393 D394 F396 V405 G423 D426	I295-K297 PolarHBondContact O-N 3.02Å; K297-M393 PolarHBondContact NZ-O 3.2Å; K297-D394 PolarHBondContact NZ-O 3.37Å; K297-F396 WeakPolarHBondContact CE-O 3.49Å; K297-F396 PolarHBondContact NZ-O 3.49Å; K297-V405 PolarHBondContact O-N 3.08Å; K297-V405 VanDerWaalsContact O-N 3.14Å; K297-G423 WeakPolarHBondContact CD-O 3.43Å; K297-D426 PolarHBondContact N-OD2 3.39Å
298	G	89.9	Confident	88.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	162.4	177.8	0	0	0	0	0	114.4	V405 R424 D426 R427	G298-V405 CarbonylContact C-O 3.59Å; G298-V405 WeakPolarHBondContact CA-O 3.17Å; G298-R424 WeakPolarHBondContact CA-O 3.45Å; G298-R424 PolarHBondContact N-O 3.08Å; G298-R424 VanDerWaalsContact N-O 3.13Å; G298-D426 PolarHBondContact O-N 3.07Å; G298-D426 VanDerWaalsContact O-N 3.13Å; G298-R427 PolarHBondContact O-N 2.74Å
299	A	93.4	Very high	88.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	138.8	178.5	0	0	0	0	0	110.5	F278 V405 M406 A407 R427 I429	F278-A299 HydrophobicContact CE1-CB 4.14Å; F278-A299 HydrophobicContact CE2-CB 4.15Å; F278-A299 HydrophobicContact CZ-CB 3.57Å; A299-V405 PolarHBondContact N-O 3Å; A299-M406 CarbonylContact O-C 3.53Å; A299-M406 VanDerWaalsContact O-CA 3.29Å; A299-M406 WeakPolarHBondContact O-CA 3.42Å; A299-A407 PolarHBondContact O-N 3.41Å; A299-R427 CarbonylContact C-O 3.55Å; A299-R427 VanDerWaalsContact CA-O 3.31Å; A299-R427 WeakPolarHBondContact CA-O 3.47Å; A299-R427 HydrophobicContact CB-CB 4.04Å; A299-I429 HydrophobicContact CB-CD1 4.09Å
300	I	94.6	Very high	89.3	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.6	172.6	-168.5	167.2	0	0	0	110.2	T302 I364 A407 T409 L415 L420 F425 R427 Q428 I429	I300-T302 HydrophobicContact CG1-CG2 4.09Å; I300-T302 HydrophobicContact CG2-CG2 4.22Å; I300-I364 HydrophobicContact CD1-CG2 4.08Å; I300-A407 CarbonylContact C-O 3.52Å; I300-A407 WeakPolarHBondContact CA-O 3.38Å; I300-A407 HydrophobicContact CG1-CB 4.25Å; I300-T409 HydrophobicContact CD1-CG2 3.98Å; I300-T409 HydrophobicContact CG1-CG2 4.32Å; I300-L415 HydrophobicContact CD1-CD1 3.31Å; I300-L420 HydrophobicContact CD1-CD2 4.34Å; I300-L420 HydrophobicContact CG2-CD2 4.14Å; I300-F425 HydrophobicContact CB-CB 4.31Å; I300-F425 HydrophobicContact CB-CD1 4.35Å; I300-F425 HydrophobicContact CB-CG 4.34Å; I300-F425 HydrophobicContact CG2-CB 4.34Å; I300-R427 PolarHBondContact N-O 3.49Å; I300-Q428 HydrophobicContact CG2-CB 3.97Å; I300-Q428 HydrophobicContact CG2-CG 3.67Å; I300-I429 PolarHBondContact O-N 3.43Å
301	L	96	Very high	89.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	118.9	174	-58.3	179.1	0	0	0	108.5	I275 K309 L312 A313 F360 M406 A407 A408 T409 I429	I275-L301 HydrophobicContact CD1-CD2 3.76Å; L301-K309 HydrophobicContact CB-CB 4.2Å; L301-K309 HydrophobicContact CB-CD 4.24Å; L301-K309 HydrophobicContact CB-CG 4.25Å; L301-K309 HydrophobicContact CD1-CB 4.32Å; L301-K309 VanDerWaalsContact CD1-O 3.26Å; L301-K309 WeakPolarHBondContact CD1-O 3.5Å; L301-L312 HydrophobicContact CD2-CD2 4.48Å; L301-A313 HydrophobicContact CD1-CB 4.17Å; L301-F360 HydrophobicContact CD1-CE2 4.47Å; L301-M406 HydrophobicContact CD1-CE 3.96Å; L301-M406 HydrophobicContact CD2-CE 4.22Å; L301-M406 HydrophobicContact CG-CE 4.22Å; L301-A407 PolarHBondContact N-O 3.38Å; L301-A408 HydrophobicContact CB-CB 4.4Å; L301-A408 WeakPolarHBondContact O-CA 3.36Å; L301-T409 PolarHBondContact O-N 3.06Å; L301-I429 WeakPolarHBondContact CA-O 3.38Å; L301-I429 HydrophobicContact CD2-CB 3.98Å; L301-I429 HydrophobicContact CD2-CD1 4.14Å; L301-I429 HydrophobicContact CD2-CG2 4.09Å
302	T	95	Very high	89.9	Confident	8 Å²	8	35.4 Å²	35.4	5%	0.049	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	152	-175.4	64.9	0	0	0	0	110.2	I300 T409 V412 I429 Y430 V431	I300-T302 HydrophobicContact CG1-CG2 4.09Å; I300-T302 HydrophobicContact CG2-CG2 4.22Å; T302-T409 HydrophobicContact CG2-CG2 3.99Å; T302-V412 HydrophobicContact CG2-CB 4.43Å; T302-V412 HydrophobicContact CG2-CG1 4.25Å; T302-V412 HydrophobicContact CG2-CG2 3.32Å; T302-I429 PolarHBondContact N-O 3.33Å; T302-I429 PolarHBondContact OG1-O 3.06Å; T302-Y430 WeakPolarHBondContact OG1-CA 3.48Å; T302-V431 PolarHBondContact O-N 2.89Å
303	G	93.3	Very high	90.4	Very high	6 Å²	6	32.3 Å²	32.3	6%	0.062	19%	0.191	C	C	.	.	S	Bend	trans	143.9	176.7	174.5	0	0	0	0	0	113.7	K309 N410	G303-K309 PolarHBondContact O-NZ 3.29Å; G303-N410 WeakPolarHBondContact O-CA 3.18Å; G303-N410 PolarHBondContact O-OD1 2.74Å
304	P	93.1	Very high	90.8	Very high	44 Å²	44	33.7 Å²	33.7	29%	0.286	19%	0.188	S	C	.	.	S	Bend	trans	-56.6	156.3	-179.1	-23.9	33.5	0	0	0	113.5	T307 K309	P304-T307 HydrophobicContact CB-CG2 4.02Å; P304-T307 HydrophobicContact CG-CG2 4.35Å; P304-T307 WeakPolarHBondContact O-CG2 2.89Å; P304-T307 PolarHBondContact O-OG1 2.81Å; P304-T307 VanDerWaalsContact O-OG1 3.11Å; P304-K309 PolarHBondContact O-NZ 2.88Å
305	P	93.4	Very high	91.5	Very high	87 Å²	87	25.1 Å²	25.1	57%	0.565	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	149.8	172.6	28.3	-34.9	0	0	0	110.6	T307	P305-T307 VanDerWaalsContact C-N 3.33Å; P305-T307 PolarHBondContact O-N 3.21Å
306	G	92.1	Very high	92.2	Very high	33 Å²	33	23.4 Å²	23.4	34%	0.34	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	2.7	175.8	0	0	0	0	0	116.5	G308 G472 A473	G306-G308 VanDerWaalsContact C-N 3.26Å; G306-G308 PolarHBondContact O-N 3.19Å; G306-G472 PolarHBondContact O-N 3.25Å; G306-A473 PolarHBondContact O-N 3.13Å
307	T	94	Very high	92.6	Very high	16 Å²	16	22.1 Å²	22.1	10%	0.098	13%	0.133	C	C	.	.	S	Bend	trans	-81.4	3.7	177.8	61.1	0	0	0	0	114.9	P304 P305 V431 P432	P304-T307 HydrophobicContact CB-CG2 4.02Å; P304-T307 HydrophobicContact CG-CG2 4.35Å; P304-T307 WeakPolarHBondContact O-CG2 2.89Å; P304-T307 PolarHBondContact O-OG1 2.81Å; P304-T307 VanDerWaalsContact O-OG1 3.11Å; P305-T307 VanDerWaalsContact C-N 3.33Å; P305-T307 PolarHBondContact O-N 3.21Å; T307-V431 PolarHBondContact OG1-O 2.95Å; T307-P432 WeakPolarHBondContact CG2-O 3.36Å
308	G	92.6	Very high	93	Very high	18 Å²	18	20.3 Å²	20.3	19%	0.186	13%	0.126	C	C	.	.	S	Bend	trans	87.3	16	175.1	0	0	0	0	0	115.9	G306 T310 M311 L312	G306-G308 VanDerWaalsContact C-N 3.26Å; G306-G308 PolarHBondContact O-N 3.19Å; G308-T310 PolarHBondContact O-N 3.22Å; G308-M311 CarbonylContact O-C 3.51Å; G308-M311 WeakPolarHBondContact O-CA 3.39Å; G308-M311 WeakPolarHBondContact O-CB 3.4Å; G308-M311 PolarHBondContact O-N 2.87Å; G308-L312 WeakPolarHBondContact O-CB 3.5Å; G308-L312 PolarHBondContact O-N 2.74Å
309	K	94	Very high	93	Very high	12 Å²	12	21.2 Å²	21.2	5%	0.052	13%	0.13	C	C	.	.	H	α-helix	trans	-47.9	-51.5	177.2	-62.8	-174.6	-70.9	-83.3	0	113.7	L301 G303 P304 M311 L312 A313 A408 T409 N410 V431	L301-K309 HydrophobicContact CB-CB 4.2Å; L301-K309 HydrophobicContact CB-CD 4.24Å; L301-K309 HydrophobicContact CB-CG 4.25Å; L301-K309 HydrophobicContact CD1-CB 4.32Å; L301-K309 VanDerWaalsContact CD1-O 3.26Å; L301-K309 WeakPolarHBondContact CD1-O 3.5Å; G303-K309 PolarHBondContact O-NZ 3.29Å; P304-K309 PolarHBondContact O-NZ 2.88Å; K309-M311 VanDerWaalsContact C-N 3.34Å; K309-M311 PolarHBondContact O-N 3.19Å; K309-L312 PolarHBondContact O-N 2.98Å; K309-A313 PolarHBondContact O-N 2.95Å; K309-A313 VanDerWaalsContact O-N 3.08Å; K309-A408 HydrophobicContact CB-CB 4.18Å; K309-A408 HydrophobicContact CD-CB 4.46Å; K309-T409 WeakPolarHBondContact CE-O 3.48Å; K309-N410 VanDerWaalsContact CE-OD1 3.3Å; K309-N410 WeakPolarHBondContact CE-OD1 3.48Å; K309-N410 PolarHBondContact NZ-OD1 3.03Å; K309-V431 HydrophobicContact CG-CB 4.25Å; K309-V431 HydrophobicContact CG-CG2 4.24Å
310	T	92.3	Very high	92.7	Very high	39 Å²	39	21.7 Å²	21.7	24%	0.239	13%	0.134	C	C	.	.	H	α-helix	trans	-68.2	-32.6	179	-48.5	0	0	0	0	112.3	G308 K314 F360 D362	G308-T310 PolarHBondContact O-N 3.22Å; T310-K314 WeakPolarHBondContact O-CG 3.37Å; T310-K314 PolarHBondContact O-N 3.27Å; T310-F360 HydrophobicContact CG2-CE1 3.7Å; T310-F360 HydrophobicContact CG2-CZ 4.15Å; T310-D362 PolarHBondContact OG1-OD2 2.94Å
311	M	92.6	Very high	92.4	Very high	85 Å²	85	25.7 Å²	25.7	42%	0.419	16%	0.155	S	C	.	.	H	α-helix	trans	-69.5	-40.3	174	-73.4	-152.6	-65.2	0	0	111.7	V265 G308 K309 K314 A315	V265-M311 HydrophobicContact CG2-CB 4.49Å; G308-M311 CarbonylContact O-C 3.51Å; G308-M311 WeakPolarHBondContact O-CA 3.39Å; G308-M311 WeakPolarHBondContact O-CB 3.4Å; G308-M311 PolarHBondContact O-N 2.87Å; K309-M311 VanDerWaalsContact C-N 3.34Å; K309-M311 PolarHBondContact O-N 3.19Å; M311-K314 PolarHBondContact O-N 3.26Å; M311-A315 WeakPolarHBondContact O-CB 3.16Å; M311-A315 PolarHBondContact O-N 2.8Å
312	L	94.1	Very high	92.1	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-63.3	-42.2	178.1	-175.1	60.6	0	0	0	111.4	F262 V265 A271 K272 I275 L301 G308 K309 A315 T316 V431	F262-L312 HydrophobicContact CE1-CD1 4.27Å; V265-L312 HydrophobicContact CG1-CD1 4.11Å; A271-L312 HydrophobicContact CB-CD2 4.19Å; K272-L312 HydrophobicContact CG-CD1 3.82Å; I275-L312 HydrophobicContact CD1-CD1 3.96Å; I275-L312 HydrophobicContact CD1-CD2 3.3Å; I275-L312 HydrophobicContact CD1-CG 3.37Å; L301-L312 HydrophobicContact CD2-CD2 4.48Å; G308-L312 WeakPolarHBondContact O-CB 3.5Å; G308-L312 PolarHBondContact O-N 2.74Å; K309-L312 PolarHBondContact O-N 2.98Å; L312-A315 PolarHBondContact O-N 2.95Å; L312-T316 PolarHBondContact O-N 3.16Å; L312-T316 PolarHBondContact O-OG1 3.42Å; L312-V431 HydrophobicContact CD2-CG2 4.14Å
313	A	93.1	Very high	91.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.4	-42.5	172.9	0	0	0	0	0	112.8	L301 K309 T316 A317 F324 F360 M406	L301-A313 HydrophobicContact CD1-CB 4.17Å; K309-A313 PolarHBondContact O-N 2.95Å; K309-A313 VanDerWaalsContact O-N 3.08Å; A313-T316 WeakPolarHBondContact O-CB 3.22Å; A313-T316 PolarHBondContact O-N 3.2Å; A313-A317 PolarHBondContact O-N 2.76Å; A313-F324 HydrophobicContact CB-CE2 4.25Å; A313-F324 HydrophobicContact CB-CZ 4.35Å; A313-F360 HydrophobicContact CB-CD2 3.39Å; A313-F360 HydrophobicContact CB-CE2 3.43Å; A313-F360 VanDerWaalsContact CB-CE2 3.43Å; A313-F360 HydrophobicContact CB-CG 4.08Å; A313-F360 HydrophobicContact CB-CZ 4.13Å; A313-M406 HydrophobicContact CB-CE 4.2Å; A313-M406 HydrophobicContact CB-SD 4.26Å
314	K	92.1	Very high	91.9	Very high	75 Å²	75	26.4 Å²	26.4	33%	0.326	16%	0.159	S	C	.	.	H	α-helix	trans	-64	-41.8	174.8	-74.2	174	-178.3	175.5	0	112.2	T310 M311 T316 A317 G318 F324	T310-K314 WeakPolarHBondContact O-CG 3.37Å; T310-K314 PolarHBondContact O-N 3.27Å; M311-K314 PolarHBondContact O-N 3.26Å; K314-T316 VanDerWaalsContact C-N 3.31Å; K314-T316 PolarHBondContact O-N 3.13Å; K314-A317 PolarHBondContact O-N 3.46Å; K314-G318 PolarHBondContact O-N 3.31Å; K314-F324 HydrophobicContact CG-CD1 4.26Å; K314-F324 HydrophobicContact CG-CE1 3.61Å; K314-F324 HydrophobicContact CG-CZ 3.77Å
315	A	92.2	Very high	91.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.8	-40.6	176.2	0	0	0	0	0	111.2	V260 F262 V265 M311 L312 A317 G318 E319	V260-A315 HydrophobicContact CG1-CB 4.06Å; F262-A315 HydrophobicContact CD1-CB 3.65Å; F262-A315 HydrophobicContact CE1-CB 3.96Å; V265-A315 HydrophobicContact CG2-CB 3.86Å; M311-A315 WeakPolarHBondContact O-CB 3.16Å; M311-A315 PolarHBondContact O-N 2.8Å; L312-A315 PolarHBondContact O-N 2.95Å; A315-A317 VanDerWaalsContact C-N 3.32Å; A315-A317 PolarHBondContact O-N 3.37Å; A315-G318 CarbonylContact O-C 3.26Å; A315-G318 PolarHBondContact O-N 3.04Å; A315-G318 VanDerWaalsContact O-N 3.13Å; A315-E319 WeakPolarHBondContact O-CB 3.26Å; A315-E319 VanDerWaalsContact O-CG 3.26Å; A315-E319 WeakPolarHBondContact O-CG 3.35Å; A315-E319 PolarHBondContact O-N 3.06Å
316	T	92.2	Very high	91.9	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.006	13%	0.127	C	C	.	.	H	α-helix	trans	-55.4	-46.5	175.4	-49.5	0	0	0	0	111.8	I275 V279 L312 A313 K314 E319 A320 I358 M406	I275-T316 HydrophobicContact CG2-CG2 3.56Å; I275-T316 WeakPolarHBondContact CG2-OG1 3.33Å; V279-T316 HydrophobicContact CG2-CG2 3.65Å; L312-T316 PolarHBondContact O-N 3.16Å; L312-T316 PolarHBondContact O-OG1 3.42Å; A313-T316 WeakPolarHBondContact O-CB 3.22Å; A313-T316 PolarHBondContact O-N 3.2Å; K314-T316 VanDerWaalsContact C-N 3.31Å; K314-T316 PolarHBondContact O-N 3.13Å; T316-E319 PolarHBondContact O-N 3.11Å; T316-A320 WeakPolarHBondContact O-CB 3.48Å; T316-A320 PolarHBondContact O-N 3.4Å; T316-I358 HydrophobicContact CG2-CD1 3.71Å; T316-M406 HydrophobicContact CG2-SD 4.25Å
317	A	91.4	Very high	92	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-68.7	-37.3	177.5	0	0	0	0	0	112.9	I258 A313 K314 A315 E319 N321 V322 F324 I358	I258-A317 HydrophobicContact CD1-CB 3.82Å; A313-A317 PolarHBondContact O-N 2.76Å; K314-A317 PolarHBondContact O-N 3.46Å; A315-A317 VanDerWaalsContact C-N 3.32Å; A315-A317 PolarHBondContact O-N 3.37Å; A317-E319 VanDerWaalsContact C-N 3.33Å; A317-N321 PolarHBondContact O-N 2.95Å; A317-V322 PolarHBondContact O-N 3.18Å; A317-F324 HydrophobicContact CB-CB 3.76Å; A317-F324 HydrophobicContact CB-CD2 3.58Å; A317-F324 HydrophobicContact CB-CE2 4.5Å; A317-F324 HydrophobicContact CB-CG 4.01Å; A317-I358 HydrophobicContact CB-CB 4.49Å; A317-I358 HydrophobicContact CB-CD1 3.98Å
318	G	91	Very high	91.9	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.2	-39.9	173.8	0	0	0	0	0	112.8	R261 K314 A315 N321	R261-G318 PolarHBondContact NE-O 3.24Å; R261-G318 PolarHBondContact NH1-O 2.78Å; R261-G318 PolarHBondContact NH2-O 2.79Å; K314-G318 PolarHBondContact O-N 3.31Å; A315-G318 CarbonylContact O-C 3.26Å; A315-G318 PolarHBondContact O-N 3.04Å; A315-G318 VanDerWaalsContact O-N 3.13Å; G318-N321 PolarHBondContact O-N 3.35Å; G318-N321 PolarHBondContact O-OD1 2.75Å
319	E	89.8	Confident	91.7	Very high	19 Å²	19	19.9 Å²	19.9	9%	0.089	11%	0.107	C	C	.	.	H	α-helix	trans	-77.8	-36	-178.8	-69.5	-68.2	178.6	0	0	113	R261 F262 V279 K283 A315 T316 A317 N321 W717	R261-E319 VanDerWaalsContact CB-OE1 3.31Å; R261-E319 WeakPolarHBondContact CB-OE1 3.48Å; F262-E319 HydrophobicContact CB-CG 4.15Å; F262-E319 HydrophobicContact CD1-CG 4.12Å; F262-E319 HydrophobicContact CD2-CB 4.16Å; F262-E319 HydrophobicContact CD2-CG 3.53Å; F262-E319 HydrophobicContact CE1-CG 4.39Å; F262-E319 HydrophobicContact CE2-CB 3.97Å; F262-E319 HydrophobicContact CE2-CG 3.83Å; F262-E319 HydrophobicContact CG-CG 3.65Å; F262-E319 HydrophobicContact CZ-CB 4.33Å; F262-E319 HydrophobicContact CZ-CG 4.24Å; F262-E319 PolarHBondContact N-OE1 2.86Å; V279-E319 HydrophobicContact CG1-CB 4.04Å; V279-E319 HydrophobicContact CG2-CB 4.31Å; K283-E319 WeakPolarHBondContact CE-O 3.48Å; K283-E319 PolarHBondContact NZ-O 3.49Å; A315-E319 WeakPolarHBondContact O-CB 3.26Å; A315-E319 VanDerWaalsContact O-CG 3.26Å; A315-E319 WeakPolarHBondContact O-CG 3.35Å; A315-E319 PolarHBondContact O-N 3.06Å; T316-E319 PolarHBondContact O-N 3.11Å; A317-E319 VanDerWaalsContact C-N 3.33Å; E319-N321 VanDerWaalsContact C-N 3.26Å; E319-N321 PolarHBondContact O-N 2.68Å; E319-W717 HydrophobicContact CB-CH2 4.33Å; E319-W717 HydrophobicContact CB-CZ3 3.98Å; E319-W717 HydrophobicContact CG-CH2 4.24Å; E319-W717 HydrophobicContact CG-CZ3 4.4Å; E319-W717 WeakPolarHBondContact OE2-CH2 3.48Å; E319-W717 WeakPolarHBondContact OE2-CZ3 3.46Å
320	A	87.9	Confident	91.4	Very high	10 Å²	10	22 Å²	22	8%	0.083	12%	0.124	C	C	.	.	H	α-helix	trans	-76.2	-11.2	172.6	0	0	0	0	0	113.4	V279 L282 T316 V322	V279-A320 HydrophobicContact CG1-CB 4.17Å; L282-A320 HydrophobicContact CB-CB 4.15Å; L282-A320 HydrophobicContact CD1-CB 3.6Å; T316-A320 WeakPolarHBondContact O-CB 3.48Å; T316-A320 PolarHBondContact O-N 3.4Å; A320-V322 VanDerWaalsContact C-N 3.27Å; A320-V322 HydrophobicContact CB-CG1 4.29Å; A320-V322 HydrophobicContact CB-CG2 3.93Å; A320-V322 PolarHBondContact O-N 3.37Å
321	N	87.4	Confident	91.2	Very high	86 Å²	86	22.9 Å²	22.9	46%	0.46	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	42.6	-173.2	-65.4	-52	0	0	0	113	Q255 R261 A317 G318 E319	Q255-N321 VanDerWaalsContact CG-O 3.29Å; Q255-N321 WeakPolarHBondContact CG-O 3.35Å; Q255-N321 PolarHBondContact NE2-O 2.68Å; R261-N321 PolarHBondContact NH2-OD1 3.02Å; A317-N321 PolarHBondContact O-N 2.95Å; G318-N321 PolarHBondContact O-N 3.35Å; G318-N321 PolarHBondContact O-OD1 2.75Å; E319-N321 VanDerWaalsContact C-N 3.26Å; E319-N321 PolarHBondContact O-N 2.68Å
322	V	89.6	Confident	90.8	Very high	8 Å²	8	19.1 Å²	19.1	5%	0.048	11%	0.107	C	C	.	.			trans	-114.1	155.9	178.2	-64	0	0	0	0	111.4	L282 A317 A320 P356 I358	L282-V322 HydrophobicContact CD1-CG1 4.29Å; L282-V322 HydrophobicContact CD1-CG2 3.96Å; A317-V322 PolarHBondContact O-N 3.18Å; A320-V322 VanDerWaalsContact C-N 3.27Å; A320-V322 HydrophobicContact CB-CG1 4.29Å; A320-V322 HydrophobicContact CB-CG2 3.93Å; A320-V322 PolarHBondContact O-N 3.37Å; V322-P356 HydrophobicContact CG1-CB 4.28Å; V322-P356 HydrophobicContact CG1-CG 4.32Å; V322-I358 HydrophobicContact CG2-CD1 3.97Å; V322-I358 HydrophobicContact CG2-CG1 3.79Å
323	P	91.7	Very high	90.3	Very high	19 Å²	19	22.5 Å²	22.5	12%	0.123	12%	0.124	C	C	.	.			trans	-60	141.1	176.8	-19.4	34	0	0	0	110.8	Q255 P356 C357 I358	Q255-P323 HydrophobicContact CG-CG 4.09Å; P323-P356 WeakPolarHBondContact CD-O 3.35Å; P323-C357 HydrophobicContact CB-CB 4.17Å; P323-C357 HydrophobicContact CG-CB 4.38Å; P323-C357 WeakPolarHBondContact O-CB 3.35Å; P323-I358 PolarHBondContact O-N 2.88Å
324	F	93.6	Very high	89.7	Confident	1 Å²	1	26.2 Å²	26.2	0%	0.004	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	116.5	177.7	-174.4	-108.1	0	0	0	109.5	I253 I258 A313 K314 A317 T326 I358 F360	I253-F324 HydrophobicContact CB-CB 4.42Å; I253-F324 HydrophobicContact CD1-CD1 4.1Å; I253-F324 PolarHBondContact N-O 3.25Å; I253-F324 PolarHBondContact O-N 2.98Å; I253-F324 VanDerWaalsContact O-N 3.09Å; I258-F324 HydrophobicContact CD1-CB 3.65Å; A313-F324 HydrophobicContact CB-CE2 4.25Å; A313-F324 HydrophobicContact CB-CZ 4.35Å; K314-F324 HydrophobicContact CG-CD1 4.26Å; K314-F324 HydrophobicContact CG-CE1 3.61Å; K314-F324 HydrophobicContact CG-CZ 3.77Å; A317-F324 HydrophobicContact CB-CB 3.76Å; A317-F324 HydrophobicContact CB-CD2 3.58Å; A317-F324 HydrophobicContact CB-CE2 4.5Å; A317-F324 HydrophobicContact CB-CG 4.01Å; F324-T326 HydrophobicContact CE1-CG2 4.35Å; F324-I358 HydrophobicContact CD2-CB 4.26Å; F324-I358 HydrophobicContact CD2-CG2 4Å; F324-I358 HydrophobicContact CE2-CG2 4.1Å; F324-F360 HydrophobicContact CD2-CB 4.46Å; F324-F360 HydrophobicContact CE1-CB 4.27Å; F324-F360 HydrophobicContact CE2-CB 3.47Å; F324-F360 VanDerWaalsContact CE2-CB 3.47Å; F324-F360 HydrophobicContact CE2-CG 4.08Å; F324-F360 HydrophobicContact CZ-CB 3.36Å; F324-F360 AromaticContact CZ-CD1 3.84Å; F324-F360 HydrophobicContact CZ-CD1 3.84Å; F324-F360 AromaticContact CZ-CG 3.66Å; F324-F360 HydrophobicContact CZ-CG 3.66Å
325	I	93.2	Very high	88.8	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	118.9	177	-56.7	176.9	0	0	0	106.7	A250 V252 T350 A351 K354 I358 L359 F360	A250-I325 HydrophobicContact CB-CG2 3.93Å; V252-I325 HydrophobicContact CB-CG1 4.5Å; V252-I325 HydrophobicContact CG1-CG1 3.96Å; V252-I325 HydrophobicContact CG2-CG1 4.08Å; V252-I325 HydrophobicContact CG2-CG2 4.31Å; I325-T350 HydrophobicContact CD1-CG2 4.44Å; I325-A351 HydrophobicContact CD1-CB 3.93Å; I325-K354 HydrophobicContact CD1-CD 4.46Å; I325-I358 PolarHBondContact N-O 3.46Å; I325-L359 HydrophobicContact CB-CD1 3.89Å; I325-L359 HydrophobicContact CG2-CD1 3.6Å; I325-L359 CarbonylContact O-C 3.49Å; I325-F360 PolarHBondContact O-N 3.28Å
326	T	93.4	Very high	88	Confident	29 Å²	29	37.5 Å²	37.5	18%	0.178	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	135.4	-179.4	-174.1	0	0	0	0	110.6	R251 F324 F360	R251-T326 HydrophobicContact CB-CG2 3.87Å; R251-T326 PolarHBondContact N-O 3.06Å; R251-T326 VanDerWaalsContact N-O 3.14Å; R251-T326 PolarHBondContact O-N 3.28Å; F324-T326 HydrophobicContact CE1-CG2 4.35Å; T326-F360 WeakPolarHBondContact CA-O 3.31Å
327	V	93	Very high	87.5	Confident	5 Å²	5	42.6 Å²	42.6	3%	0.03	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	142.7	175.6	-171.9	0	0	0	0	108.4	A250 F332 M347 F360 I361 D362	A250-V327 HydrophobicContact CB-CG2 3.56Å; V327-F332 HydrophobicContact CB-CZ 4.42Å; V327-F332 HydrophobicContact CG1-CE1 4.36Å; V327-F332 HydrophobicContact CG1-CE2 3.74Å; V327-F332 HydrophobicContact CG1-CZ 3.54Å; V327-M347 HydrophobicContact CB-SD 4.13Å; V327-M347 HydrophobicContact CG1-SD 4.46Å; V327-M347 HydrophobicContact CG2-CG 3.99Å; V327-M347 HydrophobicContact CG2-SD 3.65Å; V327-F360 PolarHBondContact N-O 3.12Å; V327-I361 WeakPolarHBondContact O-CA 3.44Å; V327-D362 PolarHBondContact O-N 3.47Å
328	S	93	Very high	87.1	Confident	27 Å²	27	44.3 Å²	44.3	19%	0.189	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	136.8	171	-177.1	0	0	0	0	110.1	S330 E331	S328-S330 PolarHBondContact O-N 3.2Å; S328-S330 PolarHBondContact OG-OG 3.31Å; S328-E331 WeakPolarHBondContact O-CB 3.46Å; S328-E331 PolarHBondContact O-N 3.16Å
329	G	87.7	Confident	86.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-58.6	-30.7	177.4	0	0	0	0	0	112.7	E331 F332 D362 V367	G329-E331 PolarHBondContact O-N 3.41Å; G329-F332 PolarHBondContact O-N 3.15Å; G329-D362 WeakPolarHBondContact CA-O 3.36Å; G329-D362 PolarHBondContact N-O 3.34Å; G329-V367 WeakPolarHBondContact O-CG1 3.28Å
330	S	87.8	Confident	86.8	Confident	58 Å²	58	44.5 Å²	44.5	41%	0.406	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-66.3	-21.5	175.1	44.4	0	0	0	0	113.9	S328 F332 L333	S328-S330 PolarHBondContact O-N 3.2Å; S328-S330 PolarHBondContact OG-OG 3.31Å; S330-F332 PolarHBondContact O-N 2.83Å; S330-L333 PolarHBondContact O-N 3.4Å
331	E	87.6	Confident	86.9	Confident	56 Å²	56	44.6 Å²	44.6	26%	0.262	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-72.3	-9.1	178.5	-69.3	174.6	-167.6	0	0	113.3	T249 S328 G329 R343	T249-E331 WeakPolarHBondContact CB-OE2 3.25Å; T249-E331 PolarHBondContact OG1-OE2 3.49Å; S328-E331 WeakPolarHBondContact O-CB 3.46Å; S328-E331 PolarHBondContact O-N 3.16Å; G329-E331 PolarHBondContact O-N 3.41Å; E331-R343 PolarHBondContact O-NH1 3.1Å
332	F	85.9	Confident	87.1	Confident	7 Å²	7	42.1 Å²	42.1	3%	0.031	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-93.7	-6	177.7	-59.1	-73.5	0	0	0	114.1	V327 G329 S330 G340 R343 V344 M347 V367 T385	V327-F332 HydrophobicContact CB-CZ 4.42Å; V327-F332 HydrophobicContact CG1-CE1 4.36Å; V327-F332 HydrophobicContact CG1-CE2 3.74Å; V327-F332 HydrophobicContact CG1-CZ 3.54Å; G329-F332 PolarHBondContact O-N 3.15Å; S330-F332 PolarHBondContact O-N 2.83Å; F332-G340 WeakPolarHBondContact O-CA 3.33Å; F332-R343 HydrophobicContact CD1-CB 3.91Å; F332-R343 HydrophobicContact CE1-CB 4.03Å; F332-V344 HydrophobicContact CD1-CG2 3.64Å; F332-V344 HydrophobicContact CE1-CB 4.44Å; F332-V344 HydrophobicContact CE1-CG2 3.58Å; F332-V344 HydrophobicContact CG-CG2 4.34Å; F332-V344 HydrophobicContact CZ-CG2 4.24Å; F332-M347 HydrophobicContact CE1-SD 4.48Å; F332-M347 HydrophobicContact CZ-CE 4.12Å; F332-M347 HydrophobicContact CZ-SD 3.74Å; F332-V367 HydrophobicContact CB-CG1 3.61Å; F332-V367 HydrophobicContact CD2-CG1 3.77Å; F332-V367 HydrophobicContact CG-CG1 4.07Å; F332-T385 HydrophobicContact CB-CG2 3.73Å; F332-T385 HydrophobicContact CG-CG2 4.22Å
333	L	82.4	Confident	87.1	Confident	72 Å²	72	42.8 Å²	42.8	38%	0.377	24%	0.24	S	C	.	.			trans	-98.2	110.9	179.3	-59	177.7	0	0	0	108.8	S330 A366 Q382	S330-L333 PolarHBondContact O-N 3.4Å; L333-A366 HydrophobicContact CD1-CB 4.35Å; L333-Q382 HydrophobicContact CD2-CB 4.26Å; L333-Q382 HydrophobicContact CD2-CG 4.33Å
334	E	80	Confident	87.1	Confident	77 Å²	77	42 Å²	42	36%	0.36	23%	0.234	S	C	.	.			trans	-134.6	163.5	-175.7	-76.4	-76.4	-168.7	0	0	111	F336 V339 R343 E381	E334-F336 PolarHBondContact O-N 3.18Å; E334-F336 VanDerWaalsContact O-N 3.13Å; E334-V339 HydrophobicContact CB-CB 4.44Å; E334-V339 HydrophobicContact CB-CG1 4.39Å; E334-V339 HydrophobicContact CG-CG1 4.23Å; E334-R343 VanDerWaalsContact CG-NH1 3.25Å; E334-R343 IonicContact OE1-CZ 3.63Å; E334-R343 VanDerWaalsContact OE1-CZ 3.24Å; E334-R343 IonicContact OE1-NH1 2.75Å; E334-R343 PolarHBondContact OE1-NH1 3.19Å; E334-R343 IonicContact OE1-NH2 3.5Å; E334-R343 PolarHBondContact OE1-NH2 3.35Å; E334-E381 PolarHBondContact N-OE1 3.22Å; E334-E381 VanDerWaalsContact O-CD 3.27Å
335	M	73.2	Confident	87	Confident	178 Å²	178	48 Å²	48	88%	0.877	26%	0.257	S	S	*	.	S	Bend	trans	-66.3	-17.3	179.6	-66.4	-175.6	65	0	0	113.8
336	F	76.6	Confident	86.8	Confident	135 Å²	135	50.6 Å²	50.6	59%	0.592	27%	0.271	S	S	*	.	S	Bend	trans	-105.8	114.2	-173.6	-62.9	-71.3	0	0	0	111.7	E334 G338 V339	E334-F336 PolarHBondContact O-N 3.18Å; E334-F336 VanDerWaalsContact O-N 3.13Å; F336-G338 PolarHBondContact O-N 3.34Å; F336-V339 HydrophobicContact CB-CG2 3.64Å; F336-V339 WeakPolarHBondContact O-CB 3.06Å; F336-V339 WeakPolarHBondContact O-CG2 3.29Å; F336-V339 PolarHBondContact O-N 3.4Å
337	V	80.5	Confident	86.7	Confident	107 Å²	107	49.3 Å²	49.3	65%	0.648	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	130	175.4	-175.8	0	0	0	0	110.6
338	G	83	Confident	86.6	Confident	37 Å²	37	49 Å²	49	38%	0.381	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.2	-12.9	177.3	0	0	0	0	0	114.7	F336 A342	F336-G338 PolarHBondContact O-N 3.34Å; G338-A342 WeakPolarHBondContact O-CB 3.19Å; G338-A342 PolarHBondContact O-N 3.45Å
339	V	86.8	Confident	86.4	Confident	22 Å²	22	49 Å²	49	13%	0.133	26%	0.262	C	S	.	.	H	α-helix	trans	-67.1	-44.3	172.2	175.5	0	0	0	0	110.8	E334 F336 A342 R343	E334-V339 HydrophobicContact CB-CB 4.44Å; E334-V339 HydrophobicContact CB-CG1 4.39Å; E334-V339 HydrophobicContact CG-CG1 4.23Å; F336-V339 HydrophobicContact CB-CG2 3.64Å; F336-V339 WeakPolarHBondContact O-CB 3.06Å; F336-V339 WeakPolarHBondContact O-CG2 3.29Å; F336-V339 PolarHBondContact O-N 3.4Å; V339-A342 PolarHBondContact O-N 2.95Å; V339-R343 HydrophobicContact CG1-CG 4.25Å; V339-R343 WeakPolarHBondContact O-CG 3.21Å; V339-R343 PolarHBondContact O-N 3.35Å
340	G	88.4	Confident	86.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-51.7	-58.2	176	0	0	0	0	0	113.6	F332 A342 R343 V344 T385	F332-G340 WeakPolarHBondContact O-CA 3.33Å; G340-A342 VanDerWaalsContact C-N 3.31Å; G340-A342 PolarHBondContact O-N 3.36Å; G340-R343 PolarHBondContact O-N 3.36Å; G340-V344 WeakPolarHBondContact O-CG2 3.31Å; G340-V344 PolarHBondContact O-N 3.28Å; G340-V344 VanDerWaalsContact O-N 3.08Å; G340-T385 WeakPolarHBondContact CA-OG1 3.38Å
341	P	90.6	Very high	86.6	Confident	12 Å²	12	47.5 Å²	47.5	8%	0.078	25%	0.251	C	S	.	.	H	α-helix	trans	-57.3	-38	175.6	-26.7	34.9	0	0	0	114.1	V344 R345 N384 T385 Q388	P341-V344 PolarHBondContact O-N 3.26Å; P341-R345 WeakPolarHBondContact O-CG 3.45Å; P341-R345 PolarHBondContact O-N 2.65Å; P341-R345 VanDerWaalsContact O-N 3.12Å; P341-N384 HydrophobicContact CG-CB 4.19Å; P341-T385 WeakPolarHBondContact CD-OG1 3.38Å; P341-Q388 HydrophobicContact CB-CB 3.92Å; P341-Q388 HydrophobicContact CB-CG 4.02Å
342	A	90.6	Very high	86.5	Confident	34 Å²	34	49.8 Å²	49.8	28%	0.281	26%	0.257	S	S	.	.	H	α-helix	trans	-64.4	-43.5	177.8	0	0	0	0	0	111.9	G338 V339 G340 V344 R345 D346	G338-A342 WeakPolarHBondContact O-CB 3.19Å; G338-A342 PolarHBondContact O-N 3.45Å; V339-A342 PolarHBondContact O-N 2.95Å; G340-A342 VanDerWaalsContact C-N 3.31Å; G340-A342 PolarHBondContact O-N 3.36Å; A342-V344 VanDerWaalsContact C-N 3.34Å; A342-V344 PolarHBondContact O-N 3.09Å; A342-R345 PolarHBondContact O-N 3.19Å; A342-D346 PolarHBondContact O-N 3.45Å
343	R	90.5	Very high	86.7	Confident	22 Å²	22	57.7 Å²	57.7	8%	0.083	29%	0.292	C	S	.	.	H	α-helix	trans	-62.1	-39.7	175.4	-72.1	-177.6	-175.7	173.8	5.5	112	E331 F332 E334 V339 G340 D346 M347	E331-R343 PolarHBondContact O-NH1 3.1Å; F332-R343 HydrophobicContact CD1-CB 3.91Å; F332-R343 HydrophobicContact CE1-CB 4.03Å; E334-R343 VanDerWaalsContact CG-NH1 3.25Å; E334-R343 IonicContact OE1-CZ 3.63Å; E334-R343 VanDerWaalsContact OE1-CZ 3.24Å; E334-R343 IonicContact OE1-NH1 2.75Å; E334-R343 PolarHBondContact OE1-NH1 3.19Å; E334-R343 IonicContact OE1-NH2 3.5Å; E334-R343 PolarHBondContact OE1-NH2 3.35Å; V339-R343 HydrophobicContact CG1-CG 4.25Å; V339-R343 WeakPolarHBondContact O-CG 3.21Å; V339-R343 PolarHBondContact O-N 3.35Å; G340-R343 PolarHBondContact O-N 3.36Å; R343-D346 PolarHBondContact O-N 3.19Å; R343-M347 VanDerWaalsContact O-CB 3.27Å; R343-M347 WeakPolarHBondContact O-CB 3.13Å; R343-M347 PolarHBondContact O-N 2.77Å
344	V	91.6	Very high	86.9	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.012	29%	0.291	C	S	.	.	H	α-helix	trans	-60.5	-47.5	175.6	174	0	0	0	0	110.7	F332 G340 P341 A342 D346 M347 F348 T385 Q388 L389 E392	F332-V344 HydrophobicContact CD1-CG2 3.64Å; F332-V344 HydrophobicContact CE1-CB 4.44Å; F332-V344 HydrophobicContact CE1-CG2 3.58Å; F332-V344 HydrophobicContact CG-CG2 4.34Å; F332-V344 HydrophobicContact CZ-CG2 4.24Å; G340-V344 WeakPolarHBondContact O-CG2 3.31Å; G340-V344 PolarHBondContact O-N 3.28Å; G340-V344 VanDerWaalsContact O-N 3.08Å; P341-V344 PolarHBondContact O-N 3.26Å; A342-V344 VanDerWaalsContact C-N 3.34Å; A342-V344 PolarHBondContact O-N 3.09Å; V344-D346 PolarHBondContact O-N 3.15Å; V344-M347 HydrophobicContact CG1-CE 4.41Å; V344-M347 PolarHBondContact O-N 3.48Å; V344-F348 HydrophobicContact CG1-CD2 3.78Å; V344-F348 HydrophobicContact CG1-CE2 3.82Å; V344-F348 VanDerWaalsContact O-CD2 3.25Å; V344-F348 WeakPolarHBondContact O-CD2 3.48Å; V344-F348 PolarHBondContact O-N 3.18Å; V344-T385 HydrophobicContact CG2-CG2 3.85Å; V344-Q388 HydrophobicContact CB-CG 4.14Å; V344-Q388 HydrophobicContact CG1-CG 4.04Å; V344-L389 HydrophobicContact CG1-CB 4.2Å; V344-L389 HydrophobicContact CG1-CD1 4.47Å; V344-E392 HydrophobicContact CG1-CG 4.26Å
345	R	90.7	Very high	87.1	Confident	128 Å²	128	56.4 Å²	56.4	48%	0.483	29%	0.289	S	S	.	.	H	α-helix	trans	-60.4	-44.6	177.6	-68.5	178.4	-165.7	145.8	6.8	112.5	P341 A342 F348 A349 Q388	P341-R345 WeakPolarHBondContact O-CG 3.45Å; P341-R345 PolarHBondContact O-N 2.65Å; P341-R345 VanDerWaalsContact O-N 3.12Å; A342-R345 PolarHBondContact O-N 3.19Å; R345-F348 PolarHBondContact O-N 3.31Å; R345-A349 WeakPolarHBondContact O-CB 3.21Å; R345-A349 PolarHBondContact O-N 3.49Å; R345-Q388 HydrophobicContact CG-CG 3.99Å; R345-Q388 VanDerWaalsContact CG-NE2 3.34Å
346	D	90.7	Very high	87.8	Confident	55 Å²	55	50.9 Å²	50.9	29%	0.294	27%	0.266	S	S	.	.	H	α-helix	trans	-68.2	-38.8	-179.8	-174.3	55	0	0	0	112.3	S248 A342 R343 V344 F348 A349 T350	S248-D346 VanDerWaalsContact CB-OD2 3.25Å; S248-D346 WeakPolarHBondContact CB-OD2 3.2Å; S248-D346 PolarHBondContact N-OD2 3.11Å; S248-D346 PolarHBondContact OG-OD2 3.1Å; A342-D346 PolarHBondContact O-N 3.45Å; R343-D346 PolarHBondContact O-N 3.19Å; V344-D346 PolarHBondContact O-N 3.15Å; D346-F348 PolarHBondContact O-N 3.29Å; D346-A349 PolarHBondContact O-N 2.97Å; D346-T350 WeakPolarHBondContact O-CB 3.46Å; D346-T350 PolarHBondContact O-N 2.99Å; D346-T350 PolarHBondContact O-OG1 3.08Å
347	M	91.1	Very high	88.4	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-57.3	-50.8	172.9	175.1	-168.8	66.2	0	0	110.7	V327 F332 R343 V344 A349 T350 A351 L359 I361	V327-M347 HydrophobicContact CB-SD 4.13Å; V327-M347 HydrophobicContact CG1-SD 4.46Å; V327-M347 HydrophobicContact CG2-CG 3.99Å; V327-M347 HydrophobicContact CG2-SD 3.65Å; F332-M347 HydrophobicContact CE1-SD 4.48Å; F332-M347 HydrophobicContact CZ-CE 4.12Å; F332-M347 HydrophobicContact CZ-SD 3.74Å; R343-M347 VanDerWaalsContact O-CB 3.27Å; R343-M347 WeakPolarHBondContact O-CB 3.13Å; R343-M347 PolarHBondContact O-N 2.77Å; V344-M347 HydrophobicContact CG1-CE 4.41Å; V344-M347 PolarHBondContact O-N 3.48Å; M347-A349 PolarHBondContact O-N 3.29Å; M347-T350 PolarHBondContact O-N 3.49Å; M347-A351 PolarHBondContact O-N 3.31Å; M347-L359 HydrophobicContact CE-CD2 3.89Å; M347-L359 HydrophobicContact CG-CD1 3.73Å; M347-L359 HydrophobicContact CG-CD2 4.22Å; M347-L359 HydrophobicContact SD-CD1 3.79Å; M347-L359 HydrophobicContact SD-CD2 4.06Å; M347-L359 HydrophobicContact SD-CG 4.37Å; M347-I361 HydrophobicContact CE-CD1 4.17Å; M347-I361 HydrophobicContact SD-CG1 4.49Å
348	F	90.6	Very high	89	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-35.2	178	-82.4	-69.7	0	0	0	112.9	V344 R345 D346 T350 A351 R352 L359 L389 E392 M393 F396 V405	V344-F348 HydrophobicContact CG1-CD2 3.78Å; V344-F348 HydrophobicContact CG1-CE2 3.82Å; V344-F348 VanDerWaalsContact O-CD2 3.25Å; V344-F348 WeakPolarHBondContact O-CD2 3.48Å; V344-F348 PolarHBondContact O-N 3.18Å; R345-F348 PolarHBondContact O-N 3.31Å; D346-F348 PolarHBondContact O-N 3.29Å; F348-T350 VanDerWaalsContact C-N 3.31Å; F348-T350 PolarHBondContact O-N 2.96Å; F348-A351 PolarHBondContact O-N 3.02Å; F348-R352 WeakPolarHBondContact O-CB 3.4Å; F348-R352 WeakPolarHBondContact O-CG 3.4Å; F348-R352 PolarHBondContact O-N 3.29Å; F348-L359 HydrophobicContact CD1-CD2 3.91Å; F348-L359 HydrophobicContact CE1-CD2 3.56Å; F348-L359 HydrophobicContact CZ-CD2 3.97Å; F348-L389 HydrophobicContact CE2-CD1 3.49Å; F348-L389 VanDerWaalsContact CE2-CD1 3.49Å; F348-L389 HydrophobicContact CZ-CD1 3.67Å; F348-E392 HydrophobicContact CB-CB 4.38Å; F348-E392 HydrophobicContact CB-CG 4.3Å; F348-E392 WeakPolarHBondContact CB-OE2 3.34Å; F348-E392 HydrophobicContact CD1-CB 4.31Å; F348-E392 HydrophobicContact CD2-CB 3.33Å; F348-E392 HydrophobicContact CD2-CG 3.58Å; F348-E392 HydrophobicContact CE1-CB 4.47Å; F348-E392 HydrophobicContact CE2-CB 3.53Å; F348-E392 HydrophobicContact CE2-CG 4.16Å; F348-E392 HydrophobicContact CG-CB 3.75Å; F348-E392 HydrophobicContact CG-CG 4.09Å; F348-E392 HydrophobicContact CZ-CB 4.1Å; F348-M393 HydrophobicContact CZ-CG 4.1Å; F348-F396 AromaticContact CD1-CE2 3.72Å; F348-F396 HydrophobicContact CD1-CE2 3.72Å; F348-F396 AromaticContact CD1-CZ 3.48Å; F348-F396 HydrophobicContact CD1-CZ 3.48Å; F348-F396 VanDerWaalsContact CD1-CZ 3.48Å; F348-F396 AromaticContact CE1-CE2 3.47Å; F348-F396 HydrophobicContact CE1-CE2 3.47Å; F348-F396 VanDerWaalsContact CE1-CE2 3.47Å; F348-F396 AromaticContact CE1-CZ 3.64Å; F348-F396 HydrophobicContact CE1-CZ 3.64Å; F348-F396 HydrophobicContact CZ-CE2 4.45Å; F348-V405 HydrophobicContact CE1-CG2 3.96Å
349	A	89	Confident	89.5	Confident	25 Å²	25	37.6 Å²	37.6	21%	0.207	19%	0.189	C	C	.	.	H	α-helix	trans	-62.4	-39.6	172.7	0	0	0	0	0	111.9	R345 D346 M347 K353	R345-A349 WeakPolarHBondContact O-CB 3.21Å; R345-A349 PolarHBondContact O-N 3.49Å; D346-A349 PolarHBondContact O-N 2.97Å; M347-A349 PolarHBondContact O-N 3.29Å; A349-K353 WeakPolarHBondContact O-CG 3.4Å; A349-K353 PolarHBondContact O-N 3.21Å; A349-K353 VanDerWaalsContact O-N 3.14Å
350	T	89.3	Confident	89.9	Confident	28 Å²	28	36.6 Å²	36.6	17%	0.172	18%	0.183	C	C	.	.	H	α-helix	trans	-67.6	-40.7	175.4	-62.6	0	0	0	0	111.8	V252 I325 D346 M347 F348 K353 K354	V252-T350 HydrophobicContact CG2-CG2 4.14Å; I325-T350 HydrophobicContact CD1-CG2 4.44Å; D346-T350 WeakPolarHBondContact O-CB 3.46Å; D346-T350 PolarHBondContact O-N 2.99Å; D346-T350 PolarHBondContact O-OG1 3.08Å; M347-T350 PolarHBondContact O-N 3.49Å; F348-T350 VanDerWaalsContact C-N 3.31Å; F348-T350 PolarHBondContact O-N 2.96Å; T350-K353 PolarHBondContact O-N 2.86Å; T350-K354 PolarHBondContact O-N 3.47Å
351	A	89.6	Confident	90.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-44.9	174.7	0	0	0	0	0	112	I325 M347 F348 K353 K354 A355 C357 L359 V403	I325-A351 HydrophobicContact CD1-CB 3.93Å; M347-A351 PolarHBondContact O-N 3.31Å; F348-A351 PolarHBondContact O-N 3.02Å; A351-K353 VanDerWaalsContact C-N 3.34Å; A351-K353 PolarHBondContact O-N 2.68Å; A351-K354 CarbonylContact O-C 3.43Å; A351-K354 PolarHBondContact O-N 3.34Å; A351-K354 VanDerWaalsContact O-N 3.1Å; A351-A355 PolarHBondContact O-N 2.96Å; A351-C357 PolarHBondContact O-SG 3.47Å; A351-L359 HydrophobicContact CB-CD2 4.47Å; A351-V403 HydrophobicContact CB-CG1 4.11Å
352	R	86.4	Confident	90.4	Very high	103 Å²	103	38.1 Å²	38.1	39%	0.389	19%	0.191	S	C	.	.	H	α-helix	trans	-58.5	-42.4	175.7	-74.7	-175.2	-69.6	-99.4	3.9	112.6	F348 K354 A355 E392 F396	F348-R352 WeakPolarHBondContact O-CB 3.4Å; F348-R352 WeakPolarHBondContact O-CG 3.4Å; F348-R352 PolarHBondContact O-N 3.29Å; R352-K354 PolarHBondContact O-N 3.16Å; R352-A355 PolarHBondContact O-N 3.36Å; R352-E392 IonicContact CZ-OE2 3.5Å; R352-E392 IonicContact NH1-OE2 3.4Å; R352-E392 PolarHBondContact NH1-OE2 2.7Å; R352-E392 IonicContact NH2-OE2 2.74Å; R352-F396 HydrophobicContact CG-CE1 4.44Å
353	K	88.6	Confident	90.5	Very high	173 Å²	173	40.9 Å²	40.9	75%	0.752	20%	0.198	S	C	*	.	H	α-helix	trans	-64.6	-23.4	177.9	-73.6	172.5	-176.9	173.7	0	113.7	A349 T350 A351	A349-K353 WeakPolarHBondContact O-CG 3.4Å; A349-K353 PolarHBondContact O-N 3.21Å; A349-K353 VanDerWaalsContact O-N 3.14Å; T350-K353 PolarHBondContact O-N 2.86Å; A351-K353 VanDerWaalsContact C-N 3.34Å; A351-K353 PolarHBondContact O-N 2.68Å
354	K	87.9	Confident	90.6	Very high	84 Å²	84	39.9 Å²	39.9	37%	0.365	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	11.7	-176.2	-66.2	-174.9	177.4	-179.4	0	113.2	V252 I325 T350 A351 R352 P356 C357	V252-K354 VanDerWaalsContact CB-NZ 3.27Å; V252-K354 HydrophobicContact CG1-CD 3.65Å; I325-K354 HydrophobicContact CD1-CD 4.46Å; T350-K354 PolarHBondContact O-N 3.47Å; A351-K354 CarbonylContact O-C 3.43Å; A351-K354 PolarHBondContact O-N 3.34Å; A351-K354 VanDerWaalsContact O-N 3.1Å; R352-K354 PolarHBondContact O-N 3.16Å; K354-P356 CarbonylContact O-C 3.59Å; K354-C357 HydrophobicContact CB-CB 4.44Å; K354-C357 WeakPolarHBondContact O-CB 3.31Å
355	A	84.3	Confident	90.6	Very high	39 Å²	39	41.9 Å²	41.9	32%	0.322	21%	0.205	S	C	.	.			trans	-62.4	139.4	178.8	0	0	0	0	0	111.3	A351 R352 A401 V403	A351-A355 PolarHBondContact O-N 2.96Å; R352-A355 PolarHBondContact O-N 3.36Å; A355-A401 HydrophobicContact CB-CB 4.19Å; A355-V403 HydrophobicContact CB-CG2 3.9Å
356	P	86.6	Confident	90.5	Very high	61 Å²	61	36.9 Å²	36.9	40%	0.396	19%	0.19	S	C	.	.	S	Bend	cis	-72.4	130.8	-2	29.7	-34	0	0	0	112.7	L282 V322 P323 K354 N402	L282-P356 HydrophobicContact CD2-CB 4.46Å; V322-P356 HydrophobicContact CG1-CB 4.28Å; V322-P356 HydrophobicContact CG1-CG 4.32Å; P323-P356 WeakPolarHBondContact CD-O 3.35Å; K354-P356 CarbonylContact O-C 3.59Å; P356-N402 VanDerWaalsContact CA-O 3.23Å; P356-N402 WeakPolarHBondContact CA-O 3.33Å; P356-N402 HydrophobicContact CB-CB 3.9Å
357	C	90.1	Very high	90.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	164.1	178.1	69.3	0	0	0	0	112.6	P323 A351 K354 N402 I404	P323-C357 HydrophobicContact CB-CB 4.17Å; P323-C357 HydrophobicContact CG-CB 4.38Å; P323-C357 WeakPolarHBondContact O-CB 3.35Å; A351-C357 PolarHBondContact O-SG 3.47Å; K354-C357 HydrophobicContact CB-CB 4.44Å; K354-C357 WeakPolarHBondContact O-CB 3.31Å; C357-N402 PolarHBondContact N-O 2.91Å; C357-I404 PolarHBondContact O-N 3.42Å
358	I	92	Very high	89.9	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125	170.8	-65.7	177	0	0	0	108.6	L282 T316 A317 V322 P323 F324 I325 I404 M406	L282-I358 HydrophobicContact CD1-CD1 4.11Å; L282-I358 HydrophobicContact CD1-CG1 4.14Å; T316-I358 HydrophobicContact CG2-CD1 3.71Å; A317-I358 HydrophobicContact CB-CB 4.49Å; A317-I358 HydrophobicContact CB-CD1 3.98Å; V322-I358 HydrophobicContact CG2-CD1 3.97Å; V322-I358 HydrophobicContact CG2-CG1 3.79Å; P323-I358 PolarHBondContact O-N 2.88Å; F324-I358 HydrophobicContact CD2-CB 4.26Å; F324-I358 HydrophobicContact CD2-CG2 4Å; F324-I358 HydrophobicContact CE2-CG2 4.1Å; I325-I358 PolarHBondContact N-O 3.46Å; I358-I404 WeakPolarHBondContact CA-O 3.44Å; I358-I404 HydrophobicContact CG1-CB 4.5Å; I358-M406 HydrophobicContact CG2-CG 4.13Å; I358-M406 HydrophobicContact CG2-SD 3.96Å
359	L	93.5	Very high	89.6	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	116.4	172.5	176	63.9	0	0	0	108.9	I325 M347 F348 A351 V403 I404 V405 M406	I325-L359 HydrophobicContact CB-CD1 3.89Å; I325-L359 HydrophobicContact CG2-CD1 3.6Å; I325-L359 CarbonylContact O-C 3.49Å; M347-L359 HydrophobicContact CE-CD2 3.89Å; M347-L359 HydrophobicContact CG-CD1 3.73Å; M347-L359 HydrophobicContact CG-CD2 4.22Å; M347-L359 HydrophobicContact SD-CD1 3.79Å; M347-L359 HydrophobicContact SD-CD2 4.06Å; M347-L359 HydrophobicContact SD-CG 4.37Å; F348-L359 HydrophobicContact CD1-CD2 3.91Å; F348-L359 HydrophobicContact CE1-CD2 3.56Å; F348-L359 HydrophobicContact CZ-CD2 3.97Å; A351-L359 HydrophobicContact CB-CD2 4.47Å; L359-V403 HydrophobicContact CB-CG1 4.44Å; L359-I404 PolarHBondContact N-O 3.24Å; L359-V405 HydrophobicContact CD2-CG1 4.43Å; L359-V405 HydrophobicContact CD2-CG2 4.4Å; L359-V405 CarbonylContact O-C 3.52Å; L359-V405 WeakPolarHBondContact O-CA 3.12Å; L359-M406 PolarHBondContact O-N 2.65Å
360	F	95.4	Very high	89.1	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.8	-179.7	-176.7	-106.9	0	0	0	111.8	L301 T310 A313 F324 I325 T326 V327 D362 M406 A408	L301-F360 HydrophobicContact CD1-CE2 4.47Å; T310-F360 HydrophobicContact CG2-CE1 3.7Å; T310-F360 HydrophobicContact CG2-CZ 4.15Å; A313-F360 HydrophobicContact CB-CD2 3.39Å; A313-F360 HydrophobicContact CB-CE2 3.43Å; A313-F360 VanDerWaalsContact CB-CE2 3.43Å; A313-F360 HydrophobicContact CB-CG 4.08Å; A313-F360 HydrophobicContact CB-CZ 4.13Å; F324-F360 HydrophobicContact CD2-CB 4.46Å; F324-F360 HydrophobicContact CE1-CB 4.27Å; F324-F360 HydrophobicContact CE2-CB 3.47Å; F324-F360 VanDerWaalsContact CE2-CB 3.47Å; F324-F360 HydrophobicContact CE2-CG 4.08Å; F324-F360 HydrophobicContact CZ-CB 3.36Å; F324-F360 AromaticContact CZ-CD1 3.84Å; F324-F360 HydrophobicContact CZ-CD1 3.84Å; F324-F360 AromaticContact CZ-CG 3.66Å; F324-F360 HydrophobicContact CZ-CG 3.66Å; I325-F360 PolarHBondContact O-N 3.28Å; T326-F360 WeakPolarHBondContact CA-O 3.31Å; V327-F360 PolarHBondContact N-O 3.12Å; F360-D362 HydrophobicContact CD1-CB 4.42Å; F360-D362 HydrophobicContact CE1-CB 3.67Å; F360-D362 HydrophobicContact CZ-CB 4.27Å; F360-M406 CarbonylContact C-O 3.41Å; F360-M406 VanDerWaalsContact CA-O 3.25Å; F360-M406 WeakPolarHBondContact CA-O 3.32Å; F360-M406 HydrophobicContact CD2-CB 3.86Å; F360-A408 HydrophobicContact CE2-CB 3.88Å; F360-A408 HydrophobicContact CZ-CB 3.6Å
361	I	94.8	Very high	88.1	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	104.5	175.6	-54.9	174	0	0	0	108.2	V327 M347 I364 L389 V405 M406 A407 A408	V327-I361 WeakPolarHBondContact O-CA 3.44Å; M347-I361 HydrophobicContact CE-CD1 4.17Å; M347-I361 HydrophobicContact SD-CG1 4.49Å; I361-I364 HydrophobicContact CG2-CB 4.32Å; I361-I364 HydrophobicContact CG2-CG1 4.43Å; I361-L389 HydrophobicContact CD1-CD1 4.12Å; I361-V405 HydrophobicContact CD1-CG1 4.35Å; I361-M406 PolarHBondContact N-O 2.92Å; I361-A407 CarbonylContact O-C 3.55Å; I361-A407 VanDerWaalsContact O-CA 3.25Å; I361-A407 WeakPolarHBondContact O-CA 3.27Å; I361-A408 PolarHBondContact O-N 3.37Å
362	D	94.2	Very high	86.8	Confident	43 Å²	43	46.7 Å²	46.7	23%	0.23	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	155.7	173.9	-144.5	-20.9	0	0	0	110.5	T310 V327 G329 F360 I364	T310-D362 PolarHBondContact OG1-OD2 2.94Å; V327-D362 PolarHBondContact O-N 3.47Å; G329-D362 WeakPolarHBondContact CA-O 3.36Å; G329-D362 PolarHBondContact N-O 3.34Å; F360-D362 HydrophobicContact CD1-CB 4.42Å; F360-D362 HydrophobicContact CE1-CB 3.67Å; F360-D362 HydrophobicContact CZ-CB 4.27Å; D362-I364 VanDerWaalsContact C-N 3.32Å; D362-I364 PolarHBondContact O-N 2.96Å
363	E	93	Very high	85.5	Confident	93 Å²	93	49 Å²	49	44%	0.435	26%	0.258	S	S	.	.	S	Bend	trans	47.7	48.3	178.6	-58.4	-174	157.4	0	0	114	D365 A366 A408	E363-D365 PolarHBondContact O-N 3.31Å; E363-A366 WeakPolarHBondContact O-CB 3.41Å; E363-A366 PolarHBondContact O-N 2.94Å; E363-A408 PolarHBondContact N-O 2.87Å
364	I	93.3	Very high	83.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-60.5	-21.6	-175.7	-170.7	165.7	0	0	0	113	I300 I361 D362 A366 V367 G368 L389 A407 A408 L415 L419 F425	I300-I364 HydrophobicContact CD1-CG2 4.08Å; I361-I364 HydrophobicContact CG2-CB 4.32Å; I361-I364 HydrophobicContact CG2-CG1 4.43Å; D362-I364 VanDerWaalsContact C-N 3.32Å; D362-I364 PolarHBondContact O-N 2.96Å; I364-A366 PolarHBondContact O-N 3.45Å; I364-V367 HydrophobicContact CG1-CG2 4.1Å; I364-V367 WeakPolarHBondContact O-CG2 3.38Å; I364-V367 PolarHBondContact O-N 3.43Å; I364-G368 WeakPolarHBondContact O-CA 3.38Å; I364-G368 PolarHBondContact O-N 3.23Å; I364-L389 HydrophobicContact CD1-CD2 4.43Å; I364-A407 HydrophobicContact CB-CB 4.12Å; I364-A407 HydrophobicContact CD1-CB 3.6Å; I364-A407 HydrophobicContact CG1-CB 4.45Å; I364-A407 HydrophobicContact CG2-CB 4.07Å; I364-A408 PolarHBondContact N-O 3.45Å; I364-A408 VanDerWaalsContact N-O 3.16Å; I364-L415 HydrophobicContact CG2-CD1 4.26Å; I364-L415 HydrophobicContact CG2-CD2 4.06Å; I364-L419 HydrophobicContact CD1-CD1 4.49Å; I364-F425 HydrophobicContact CD1-CD2 4.5Å; I364-F425 HydrophobicContact CD1-CE2 3.46Å; I364-F425 VanDerWaalsContact CD1-CE2 3.46Å; I364-F425 HydrophobicContact CD1-CZ 3.59Å
365	D	91.1	Very high	82.3	Confident	45 Å²	45	56.6 Å²	56.6	24%	0.241	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-62	-18.2	174.4	51.9	-58.6	0	0	0	113.9	E363 T409 L415	E363-D365 PolarHBondContact O-N 3.31Å; D365-T409 PolarHBondContact OD1-OG1 2.83Å; D365-T409 VanDerWaalsContact OD1-OG1 3.12Å; D365-L415 HydrophobicContact CB-CD2 3.93Å
366	A	88.9	Confident	81	Confident	22 Å²	22	59 Å²	59	18%	0.182	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-64.9	-35.5	170.4	0	0	0	0	0	112.7	L333 E363 I364 Q382	L333-A366 HydrophobicContact CD1-CB 4.35Å; E363-A366 WeakPolarHBondContact O-CB 3.41Å; E363-A366 PolarHBondContact O-N 2.94Å; I364-A366 PolarHBondContact O-N 3.45Å; A366-Q382 PolarHBondContact O-NE2 3.3Å
367	V	87.2	Confident	79.9	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.012	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-26.6	177.6	-69.4	0	0	0	0	113.3	G329 F332 I364 R369 T385 L389	G329-V367 WeakPolarHBondContact O-CG1 3.28Å; F332-V367 HydrophobicContact CB-CG1 3.61Å; F332-V367 HydrophobicContact CD2-CG1 3.77Å; F332-V367 HydrophobicContact CG-CG1 4.07Å; I364-V367 HydrophobicContact CG1-CG2 4.1Å; I364-V367 WeakPolarHBondContact O-CG2 3.38Å; I364-V367 PolarHBondContact O-N 3.43Å; V367-R369 PolarHBondContact O-N 2.97Å; V367-T385 HydrophobicContact CB-CG2 4.46Å; V367-T385 HydrophobicContact CG1-CG2 3.96Å; V367-L389 HydrophobicContact CG2-CD2 4.41Å
368	G	83.2	Confident	78.4	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.35	C	S	.	.	S	Bend	trans	-93.9	17.7	-170	0	0	0	0	0	115.1	I364 L415 D416	I364-G368 WeakPolarHBondContact O-CA 3.38Å; I364-G368 PolarHBondContact O-N 3.23Å; G368-L415 CarbonylContact O-C 3.45Å; G368-L415 VanDerWaalsContact O-CA 3.29Å; G368-L415 WeakPolarHBondContact O-CA 3.29Å; G368-D416 PolarHBondContact O-N 2.9Å
369	R	83.9	Confident	77.1	Confident	69 Å²	69	65.8 Å²	65.8	26%	0.26	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-67.3	147	-174.4	-168.8	176.2	172.6	149.5	0.9	112.7	V367 R371 M414	V367-R369 PolarHBondContact O-N 2.97Å; R369-R371 PolarHBondContact O-N 3.32Å; R369-M414 CarbonylContact C-O 3.54Å; R369-M414 VanDerWaalsContact CA-O 3.25Å; R369-M414 WeakPolarHBondContact CA-O 3.35Å; R369-M414 HydrophobicContact CG-CE 4.06Å; R369-M414 VanDerWaalsContact NE-CE 3.34Å
370	I	77.5	Confident	76.1	Confident	77 Å²	77	68.9 Å²	68.9	40%	0.395	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-52.4	128.1	172.3	-61.8	166	0	0	0	111	D413 M414 L415	I370-D413 WeakPolarHBondContact CD1-O 3.22Å; I370-M414 PolarHBondContact N-O 3.2Å; I370-L415 WeakPolarHBondContact CG1-O 3.32Å
371	R	69.6	Low	75.3	Confident	94 Å²	94	70 Å²	70	36%	0.355	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	143.7	179	-50	-179.4	-162.7	-155.2	-11.4	111.1	R369 E383 N387 D416	R369-R371 PolarHBondContact O-N 3.32Å; R371-E383 HydrophobicContact CG-CG 4.19Å; R371-N387 PolarHBondContact NH1-OD1 3.11Å; R371-N387 PolarHBondContact NH2-OD1 3.43Å; R371-D416 IonicContact CZ-OD2 2.67Å; R371-D416 IonicContact NE-OD2 2.6Å; R371-D416 PolarHBondContact NE-OD2 3.3Å; R371-D416 IonicContact NH2-OD2 2.85Å; R371-D416 PolarHBondContact NH2-OD2 3.2Å
372	G	61	Low	74.7	Confident	73 Å²	73	71.9 Å²	71.9	75%	0.753	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.3	3.1	164.4	0	0	0	0	0	118.6
373	Q	59.3	Low	74.2	Confident	152 Å²	152	73.1 Å²	73.1	71%	0.71	40%	0.403	S	S	*	.	S	Bend	trans	-95.9	0.5	-176.3	-128.3	-168.6	11.8	0	0	116.3
374	R	56	Low	73.9	Confident	180 Å²	180	72.5 Å²	72.5	68%	0.679	40%	0.403	S	S	*	.			trans	-137.5	118.4	173.3	-79	-159.5	-92.7	-171.9	-1.5	112.7	S376	R374-S376 PolarHBondContact O-N 2.87Å
375	F	52.9	Low	73.8	Confident	237 Å²	237	72.5 Å²	72.5	100%	1.039	40%	0.403	S	S	*	.			trans	-65.6	24.1	175.6	-116.1	-90.5	0	0	0	114.8
376	S	57.7	Low	73.7	Confident	90 Å²	90	70.5 Å²	70.5	63%	0.629	39%	0.392	S	S	*	.	S	Bend	trans	-122.9	138.9	-172	-169.2	0	0	0	0	112.3	R374 G378 G379	R374-S376 PolarHBondContact O-N 2.87Å; S376-G378 PolarHBondContact O-N 3.46Å; S376-G379 PolarHBondContact O-N 3.13Å
377	S	62.4	Low	73.8	Confident	121 Å²	121	72.2 Å²	72.2	85%	0.846	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	3.1	-166.6	-176	0	0	0	0	119.2
378	G	60.4	Low	74.1	Confident	56 Å²	56	73.2 Å²	73.2	58%	0.577	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-12.6	178.1	0	0	0	0	0	115.4	S376 S380	S376-G378 PolarHBondContact O-N 3.46Å; G378-S380 VanDerWaalsContact C-N 3.34Å; G378-S380 PolarHBondContact O-N 3.44Å
379	G	63.7	Low	74.5	Confident	26 Å²	26	73.4 Å²	73.4	27%	0.268	40%	0.404	S	S	.	.	H	α-helix	trans	-66.1	-30.3	-173.5	0	0	0	0	0	114.9	S376 E381 Q382 E383	S376-G379 PolarHBondContact O-N 3.13Å; G379-E381 PolarHBondContact O-N 3.18Å; G379-Q382 PolarHBondContact O-N 2.9Å; G379-E383 WeakPolarHBondContact O-CG 3.5Å; G379-E383 PolarHBondContact O-N 3.37Å; G379-E383 VanDerWaalsContact O-N 3.09Å
380	S	72.7	Confident	74.9	Confident	66 Å²	66	70.5 Å²	70.5	46%	0.462	39%	0.393	S	S	.	.	H	α-helix	trans	-67.5	-33.7	-171.6	57.6	0	0	0	0	114	G378 N384	G378-S380 VanDerWaalsContact C-N 3.34Å; G378-S380 PolarHBondContact O-N 3.44Å; S380-N384 WeakPolarHBondContact O-CB 3.47Å; S380-N384 PolarHBondContact O-N 2.88Å; S380-N384 PolarHBondContact O-ND2 3.19Å
381	E	79.3	Confident	75.5	Confident	24 Å²	24	71.1 Å²	71.1	11%	0.112	40%	0.4	C	S	.	.	H	α-helix	trans	-72.2	-46.3	179.3	-169.3	-163	-176.6	0	0	110.9	E334 G379 E383 N384 T385	E334-E381 PolarHBondContact N-OE1 3.22Å; E334-E381 VanDerWaalsContact O-CD 3.27Å; G379-E381 PolarHBondContact O-N 3.18Å; E381-E383 VanDerWaalsContact C-N 3.31Å; E381-E383 PolarHBondContact O-N 3.45Å; E381-N384 PolarHBondContact O-N 3.43Å; E381-T385 PolarHBondContact O-N 3.33Å; E381-T385 PolarHBondContact O-OG1 2.92Å; E381-T385 VanDerWaalsContact O-OG1 3.13Å
382	Q	81.4	Confident	76.5	Confident	40 Å²	40	68 Å²	68	19%	0.187	39%	0.39	C	S	.	.	H	α-helix	trans	-57.2	-45.5	177.4	-171.6	-179.3	20.4	0	0	111.1	L333 A366 G379 N384 T385 L386	L333-Q382 HydrophobicContact CD2-CB 4.26Å; L333-Q382 HydrophobicContact CD2-CG 4.33Å; A366-Q382 PolarHBondContact O-NE2 3.3Å; G379-Q382 PolarHBondContact O-N 2.9Å; Q382-N384 PolarHBondContact O-N 3.44Å; Q382-T385 PolarHBondContact O-N 3.02Å; Q382-L386 VanDerWaalsContact O-CB 3.32Å; Q382-L386 WeakPolarHBondContact O-CB 3.11Å; Q382-L386 PolarHBondContact O-N 3.41Å
383	E	83.5	Confident	77.8	Confident	69 Å²	69	64.7 Å²	64.7	32%	0.322	36%	0.355	S	S	.	.	H	α-helix	trans	-62.9	-40.8	177.5	-72.5	-179.4	-179.1	0	0	112.7	R371 G379 E381 L386 N387	R371-E383 HydrophobicContact CG-CG 4.19Å; G379-E383 WeakPolarHBondContact O-CG 3.5Å; G379-E383 PolarHBondContact O-N 3.37Å; G379-E383 VanDerWaalsContact O-N 3.09Å; E381-E383 VanDerWaalsContact C-N 3.31Å; E381-E383 PolarHBondContact O-N 3.45Å; E383-L386 PolarHBondContact O-N 2.96Å; E383-N387 WeakPolarHBondContact O-CB 3.11Å; E383-N387 VanDerWaalsContact O-CG 3.26Å; E383-N387 PolarHBondContact O-N 2.92Å; E383-N387 PolarHBondContact O-ND2 3.39Å; E383-N387 VanDerWaalsContact O-ND2 3.1Å
384	N	87.1	Confident	79	Confident	79 Å²	79	61 Å²	61	42%	0.422	34%	0.34	S	S	.	.	H	α-helix	trans	-66.1	-43.8	177	-75.2	-21.8	0	0	0	112	P341 S380 E381 Q382 N387 Q388	P341-N384 HydrophobicContact CG-CB 4.19Å; S380-N384 WeakPolarHBondContact O-CB 3.47Å; S380-N384 PolarHBondContact O-N 2.88Å; S380-N384 PolarHBondContact O-ND2 3.19Å; E381-N384 PolarHBondContact O-N 3.43Å; Q382-N384 PolarHBondContact O-N 3.44Å; N384-N387 PolarHBondContact O-N 2.63Å; N384-Q388 PolarHBondContact O-N 3.31Å
385	T	90.4	Very high	79.9	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.006	34%	0.337	C	S	.	.	H	α-helix	trans	-61.6	-44.5	175	-61.8	0	0	0	0	111.1	F332 G340 P341 V344 V367 E381 Q382 Q388 L389	F332-T385 HydrophobicContact CB-CG2 3.73Å; F332-T385 HydrophobicContact CG-CG2 4.22Å; G340-T385 WeakPolarHBondContact CA-OG1 3.38Å; P341-T385 WeakPolarHBondContact CD-OG1 3.38Å; V344-T385 HydrophobicContact CG2-CG2 3.85Å; V367-T385 HydrophobicContact CB-CG2 4.46Å; V367-T385 HydrophobicContact CG1-CG2 3.96Å; E381-T385 PolarHBondContact O-N 3.33Å; E381-T385 PolarHBondContact O-OG1 2.92Å; E381-T385 VanDerWaalsContact O-OG1 3.13Å; Q382-T385 PolarHBondContact O-N 3.02Å; T385-Q388 PolarHBondContact O-N 3.17Å; T385-L389 PolarHBondContact O-N 3.05Å
386	L	90.5	Very high	80.7	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-59.7	-48.9	176.2	178	55.2	0	0	0	111.6	Q382 E383 Q388 L389 L390 D416 L419	Q382-L386 VanDerWaalsContact O-CB 3.32Å; Q382-L386 WeakPolarHBondContact O-CB 3.11Å; Q382-L386 PolarHBondContact O-N 3.41Å; E383-L386 PolarHBondContact O-N 2.96Å; L386-Q388 VanDerWaalsContact C-N 3.27Å; L386-Q388 PolarHBondContact O-N 3.42Å; L386-L389 WeakPolarHBondContact O-CB 3.33Å; L386-L389 PolarHBondContact O-N 3.46Å; L386-L389 VanDerWaalsContact O-N 3.16Å; L386-L390 HydrophobicContact CD1-CG 4.33Å; L386-L390 HydrophobicContact CG-CD1 4.42Å; L386-L390 VanDerWaalsContact O-CG 3.31Å; L386-L390 WeakPolarHBondContact O-CG 3.46Å; L386-L390 PolarHBondContact O-N 3.1Å; L386-D416 HydrophobicContact CD2-CB 3.92Å; L386-D416 WeakPolarHBondContact CD2-OD2 3.31Å; L386-L419 HydrophobicContact CD1-CD1 3.74Å; L386-L419 HydrophobicContact CD1-CD2 3.77Å; L386-L419 HydrophobicContact CD1-CG 3.82Å
387	N	91	Very high	80.8	Confident	58 Å²	58	47 Å²	47	31%	0.31	29%	0.291	S	S	.	.	H	α-helix	trans	-58.8	-40.5	177.2	-73.7	-35.5	0	0	0	111.8	R371 E383 N384 L390 V391	R371-N387 PolarHBondContact NH1-OD1 3.11Å; R371-N387 PolarHBondContact NH2-OD1 3.43Å; E383-N387 WeakPolarHBondContact O-CB 3.11Å; E383-N387 VanDerWaalsContact O-CG 3.26Å; E383-N387 PolarHBondContact O-N 2.92Å; E383-N387 PolarHBondContact O-ND2 3.39Å; E383-N387 VanDerWaalsContact O-ND2 3.1Å; N384-N387 PolarHBondContact O-N 2.63Å; N387-L390 PolarHBondContact O-N 2.88Å; N387-V391 WeakPolarHBondContact O-CG2 3.38Å; N387-V391 PolarHBondContact O-N 3.14Å
388	Q	91.7	Very high	80.4	Confident	24 Å²	24	45.3 Å²	45.3	11%	0.112	28%	0.276	C	S	.	.	H	α-helix	trans	-64.6	-41.2	176.3	-173.4	61.6	53.8	0	0	112.3	P341 V344 R345 N384 T385 L386 L390 V391 E392	P341-Q388 HydrophobicContact CB-CB 3.92Å; P341-Q388 HydrophobicContact CB-CG 4.02Å; V344-Q388 HydrophobicContact CB-CG 4.14Å; V344-Q388 HydrophobicContact CG1-CG 4.04Å; R345-Q388 HydrophobicContact CG-CG 3.99Å; R345-Q388 VanDerWaalsContact CG-NE2 3.34Å; N384-Q388 PolarHBondContact O-N 3.31Å; T385-Q388 PolarHBondContact O-N 3.17Å; L386-Q388 VanDerWaalsContact C-N 3.27Å; L386-Q388 PolarHBondContact O-N 3.42Å; Q388-L390 VanDerWaalsContact C-N 3.33Å; Q388-L390 PolarHBondContact O-N 3.17Å; Q388-V391 PolarHBondContact O-N 3.17Å; Q388-E392 PolarHBondContact NE2-OE1 3.46Å; Q388-E392 WeakPolarHBondContact O-CG 2.94Å; Q388-E392 PolarHBondContact O-N 3.12Å
389	L	92.2	Very high	80.3	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-59	-45.7	174	175	60.3	0	0	0	110.9	V344 F348 I361 I364 V367 T385 L386 V391 E392 M393 L419	V344-L389 HydrophobicContact CG1-CB 4.2Å; V344-L389 HydrophobicContact CG1-CD1 4.47Å; F348-L389 HydrophobicContact CE2-CD1 3.49Å; F348-L389 VanDerWaalsContact CE2-CD1 3.49Å; F348-L389 HydrophobicContact CZ-CD1 3.67Å; I361-L389 HydrophobicContact CD1-CD1 4.12Å; I364-L389 HydrophobicContact CD1-CD2 4.43Å; V367-L389 HydrophobicContact CG2-CD2 4.41Å; T385-L389 PolarHBondContact O-N 3.05Å; L386-L389 WeakPolarHBondContact O-CB 3.33Å; L386-L389 PolarHBondContact O-N 3.46Å; L386-L389 VanDerWaalsContact O-N 3.16Å; L389-V391 PolarHBondContact O-N 3.12Å; L389-E392 PolarHBondContact O-N 3.41Å; L389-M393 HydrophobicContact CD1-CG 4.26Å; L389-M393 HydrophobicContact CD1-SD 4.48Å; L389-M393 WeakPolarHBondContact O-CG 3.47Å; L389-M393 PolarHBondContact O-N 2.97Å; L389-L419 HydrophobicContact CD2-CD2 4.16Å
390	L	91.7	Very high	80	Confident	8 Å²	8	51.8 Å²	51.8	4%	0.042	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-43.2	177.3	-64.4	178.1	0	0	0	112.3	L386 N387 Q388 M393 D394 A418 L419	L386-L390 HydrophobicContact CD1-CG 4.33Å; L386-L390 HydrophobicContact CG-CD1 4.42Å; L386-L390 VanDerWaalsContact O-CG 3.31Å; L386-L390 WeakPolarHBondContact O-CG 3.46Å; L386-L390 PolarHBondContact O-N 3.1Å; N387-L390 PolarHBondContact O-N 2.88Å; Q388-L390 VanDerWaalsContact C-N 3.33Å; Q388-L390 PolarHBondContact O-N 3.17Å; L390-M393 HydrophobicContact CD2-CE 4.42Å; L390-M393 PolarHBondContact O-N 3.01Å; L390-D394 WeakPolarHBondContact O-CB 3.5Å; L390-D394 VanDerWaalsContact O-CG 3.29Å; L390-D394 PolarHBondContact O-N 3.38Å; L390-A418 HydrophobicContact CD1-CB 3.99Å; L390-L419 HydrophobicContact CD2-CD2 3.43Å; L390-L419 VanDerWaalsContact CD2-CD2 3.43Å; L390-L419 HydrophobicContact CD2-CG 4.05Å; L390-L419 HydrophobicContact CG-CD2 4.41Å
391	V	91.4	Very high	79.4	Confident	90 Å²	90	50 Å²	50	55%	0.545	29%	0.29	S	S	.	.	H	α-helix	trans	-62.5	-42.7	177.3	170.2	0	0	0	0	111.5	N387 Q388 L389 G395	N387-V391 WeakPolarHBondContact O-CG2 3.38Å; N387-V391 PolarHBondContact O-N 3.14Å; Q388-V391 PolarHBondContact O-N 3.17Å; L389-V391 PolarHBondContact O-N 3.12Å; V391-G395 PolarHBondContact O-N 3.33Å
392	E	90.4	Very high	79.4	Confident	27 Å²	27	51.7 Å²	51.7	13%	0.126	30%	0.3	C	S	.	.	H	α-helix	trans	-67.2	-36.6	177.6	-67.9	-70.4	154.9	0	0	112.1	V344 F348 R352 Q388 L389 G395 F396	V344-E392 HydrophobicContact CG1-CG 4.26Å; F348-E392 HydrophobicContact CB-CB 4.38Å; F348-E392 HydrophobicContact CB-CG 4.3Å; F348-E392 WeakPolarHBondContact CB-OE2 3.34Å; F348-E392 HydrophobicContact CD1-CB 4.31Å; F348-E392 HydrophobicContact CD2-CB 3.33Å; F348-E392 HydrophobicContact CD2-CG 3.58Å; F348-E392 HydrophobicContact CE1-CB 4.47Å; F348-E392 HydrophobicContact CE2-CB 3.53Å; F348-E392 HydrophobicContact CE2-CG 4.16Å; F348-E392 HydrophobicContact CG-CB 3.75Å; F348-E392 HydrophobicContact CG-CG 4.09Å; F348-E392 HydrophobicContact CZ-CB 4.1Å; R352-E392 IonicContact CZ-OE2 3.5Å; R352-E392 IonicContact NH1-OE2 3.4Å; R352-E392 PolarHBondContact NH1-OE2 2.7Å; R352-E392 IonicContact NH2-OE2 2.74Å; Q388-E392 PolarHBondContact NE2-OE1 3.46Å; Q388-E392 WeakPolarHBondContact O-CG 2.94Å; Q388-E392 PolarHBondContact O-N 3.12Å; L389-E392 PolarHBondContact O-N 3.41Å; E392-G395 PolarHBondContact O-N 3.1Å; E392-F396 VanDerWaalsContact O-CD2 3.23Å; E392-F396 WeakPolarHBondContact O-CD2 3.41Å; E392-F396 WeakPolarHBondContact O-CE2 3.47Å
393	M	88	Confident	79.6	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.02	30%	0.295	C	S	.	.	H	α-helix	trans	-70.2	-39.8	176.6	-66.4	-155.3	-42.2	0	0	113.1	K297 F348 L389 L390 G395 V405 L419 R424 F425	K297-M393 PolarHBondContact NZ-O 3.2Å; F348-M393 HydrophobicContact CZ-CG 4.1Å; L389-M393 HydrophobicContact CD1-CG 4.26Å; L389-M393 HydrophobicContact CD1-SD 4.48Å; L389-M393 WeakPolarHBondContact O-CG 3.47Å; L389-M393 PolarHBondContact O-N 2.97Å; L390-M393 HydrophobicContact CD2-CE 4.42Å; L390-M393 PolarHBondContact O-N 3.01Å; M393-G395 VanDerWaalsContact C-N 3.29Å; M393-G395 PolarHBondContact O-N 3.05Å; M393-V405 HydrophobicContact SD-CG1 4.4Å; M393-L419 HydrophobicContact CE-CD2 4.25Å; M393-R424 HydrophobicContact CB-CG 4.5Å; M393-R424 HydrophobicContact CE-CB 3.35Å; M393-R424 HydrophobicContact CE-CG 3.7Å; M393-F425 HydrophobicContact CE-CD2 3.95Å; M393-F425 HydrophobicContact CE-CE2 3.81Å; M393-F425 HydrophobicContact CE-CZ 4.4Å; M393-F425 HydrophobicContact SD-CD2 4.36Å; M393-F425 HydrophobicContact SD-CE1 4.33Å; M393-F425 HydrophobicContact SD-CE2 3.82Å; M393-F425 HydrophobicContact SD-CZ 3.8Å
394	D	84.6	Confident	79.9	Confident	76 Å²	76	47.3 Å²	47.3	41%	0.406	28%	0.28	S	S	.	.	H	α-helix	trans	-67.2	-35.3	175.4	-68.6	-13.5	0	0	0	110.6	K297 L390 F396 R424	K297-D394 PolarHBondContact NZ-O 3.37Å; L390-D394 WeakPolarHBondContact O-CB 3.5Å; L390-D394 VanDerWaalsContact O-CG 3.29Å; L390-D394 PolarHBondContact O-N 3.38Å; D394-F396 PolarHBondContact O-N 3.33Å; D394-R424 WeakPolarHBondContact OD1-CG 3.3Å; D394-R424 IonicContact OD1-CZ 3.57Å; D394-R424 IonicContact OD1-NE 3.54Å; D394-R424 PolarHBondContact OD1-NE 3.08Å; D394-R424 IonicContact OD1-NH2 2.75Å; D394-R424 IonicContact OD2-CZ 3.75Å; D394-R424 IonicContact OD2-NE 3.71Å; D394-R424 IonicContact OD2-NH2 2.91Å; D394-R424 PolarHBondContact OD2-NH2 3.03Å
395	G	74.2	Confident	80.2	Confident	59 Å²	59	43.6 Å²	43.6	61%	0.608	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-12.4	-180	0	0	0	0	0	115.9	V391 E392 M393 Q397	V391-G395 PolarHBondContact O-N 3.33Å; E392-G395 PolarHBondContact O-N 3.1Å; M393-G395 VanDerWaalsContact C-N 3.29Å; M393-G395 PolarHBondContact O-N 3.05Å; G395-Q397 PolarHBondContact O-N 3.24Å; G395-Q397 VanDerWaalsContact O-N 3.13Å
396	F	69.9	Low	80.4	Confident	23 Å²	23	43.7 Å²	43.7	10%	0.101	26%	0.261	C	S	.	.			trans	-70.5	107	170.9	-70.7	-73.4	0	0	0	110.8	K297 F348 R352 E392 D394 V403 V405	K297-F396 WeakPolarHBondContact CE-O 3.49Å; K297-F396 PolarHBondContact NZ-O 3.49Å; F348-F396 AromaticContact CD1-CE2 3.72Å; F348-F396 HydrophobicContact CD1-CE2 3.72Å; F348-F396 AromaticContact CD1-CZ 3.48Å; F348-F396 HydrophobicContact CD1-CZ 3.48Å; F348-F396 VanDerWaalsContact CD1-CZ 3.48Å; F348-F396 AromaticContact CE1-CE2 3.47Å; F348-F396 HydrophobicContact CE1-CE2 3.47Å; F348-F396 VanDerWaalsContact CE1-CE2 3.47Å; F348-F396 AromaticContact CE1-CZ 3.64Å; F348-F396 HydrophobicContact CE1-CZ 3.64Å; F348-F396 HydrophobicContact CZ-CE2 4.45Å; R352-F396 HydrophobicContact CG-CE1 4.44Å; E392-F396 VanDerWaalsContact O-CD2 3.23Å; E392-F396 WeakPolarHBondContact O-CD2 3.41Å; E392-F396 WeakPolarHBondContact O-CE2 3.47Å; D394-F396 PolarHBondContact O-N 3.33Å; F396-V403 HydrophobicContact CE1-CB 3.99Å; F396-V403 HydrophobicContact CE1-CG1 4.4Å; F396-V403 HydrophobicContact CE1-CG2 4.29Å; F396-V403 HydrophobicContact CZ-CB 4.32Å; F396-V403 HydrophobicContact CZ-CG1 4.25Å; F396-V405 HydrophobicContact CE2-CG2 4.27Å
397	Q	60.8	Low	80.6	Confident	130 Å²	130	43.6 Å²	43.6	61%	0.607	26%	0.261	S	S	*	.			trans	-74.1	127.9	164.7	-66.5	-174.6	-2.4	0	0	109.2	G395 G399 Q400	G395-Q397 PolarHBondContact O-N 3.24Å; G395-Q397 VanDerWaalsContact O-N 3.13Å; Q397-G399 PolarHBondContact O-N 3.05Å; Q397-Q400 PolarHBondContact O-N 3.28Å
398	T	54.3	Low	80.8	Confident	86 Å²	86	40.9 Å²	40.9	53%	0.528	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	98.1	174.5	-45.4	0	0	0	0	108.7	I295	I295-T398 HydrophobicContact CB-CG2 4.36Å; I295-T398 HydrophobicContact CD1-CG2 4.15Å; I295-T398 HydrophobicContact CG1-CG2 3.96Å
399	G	56.5	Low	81	Confident	62 Å²	62	39.8 Å²	39.8	64%	0.639	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	134.6	-14.9	175.8	0	0	0	0	0	117.3	Q397	Q397-G399 PolarHBondContact O-N 3.05Å
400	Q	58.1	Low	81.1	Confident	156 Å²	156	43.1 Å²	43.1	73%	0.729	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-28.6	-176.6	-72.2	-178.4	-7.5	0	0	114.7	Q397	Q397-Q400 PolarHBondContact O-N 3.28Å
401	A	60.6	Low	81	Confident	29 Å²	29	48.5 Å²	48.5	24%	0.24	28%	0.278	C	S	.	.			trans	-147.3	120.4	177.4	0	0	0	0	0	110.3	A355 V403	A355-A401 HydrophobicContact CB-CB 4.19Å; A401-V403 HydrophobicContact CB-CG2 4.16Å; A401-V403 PolarHBondContact O-N 3.5Å
402	N	78.6	Confident	81	Confident	59 Å²	59	46.4 Å²	46.4	32%	0.316	27%	0.266	S	S	.	.			trans	-78.3	66	178.2	-67.8	-11.5	0	0	0	110.6	P356 C357	P356-N402 VanDerWaalsContact CA-O 3.23Å; P356-N402 WeakPolarHBondContact CA-O 3.33Å; P356-N402 HydrophobicContact CB-CB 3.9Å; C357-N402 PolarHBondContact N-O 2.91Å
403	V	86.7	Confident	81	Confident	13 Å²	13	50 Å²	50	8%	0.079	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	125.9	177.3	-178.2	0	0	0	0	108.8	A351 A355 L359 F396 A401	A351-V403 HydrophobicContact CB-CG1 4.11Å; A355-V403 HydrophobicContact CB-CG2 3.9Å; L359-V403 HydrophobicContact CB-CG1 4.44Å; F396-V403 HydrophobicContact CE1-CB 3.99Å; F396-V403 HydrophobicContact CE1-CG1 4.4Å; F396-V403 HydrophobicContact CE1-CG2 4.29Å; F396-V403 HydrophobicContact CZ-CB 4.32Å; F396-V403 HydrophobicContact CZ-CG1 4.25Å; A401-V403 HydrophobicContact CB-CG2 4.16Å; A401-V403 PolarHBondContact O-N 3.5Å
404	I	89.5	Confident	81	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.015	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	123.8	174.8	-61.7	174.3	0	0	0	108.1	F278 L282 C357 I358 L359 M406	F278-I404 HydrophobicContact CB-CD1 4.16Å; F278-I404 HydrophobicContact CD1-CD1 4.08Å; F278-I404 HydrophobicContact CD1-CG2 3.87Å; F278-I404 HydrophobicContact CE1-CG2 4.23Å; L282-I404 HydrophobicContact CD1-CD1 3.75Å; L282-I404 HydrophobicContact CD2-CD1 3.61Å; L282-I404 HydrophobicContact CD2-CG1 4.24Å; L282-I404 HydrophobicContact CG-CD1 3.52Å; C357-I404 PolarHBondContact O-N 3.42Å; I358-I404 WeakPolarHBondContact CA-O 3.44Å; I358-I404 HydrophobicContact CG1-CB 4.5Å; L359-I404 PolarHBondContact N-O 3.24Å; I404-M406 HydrophobicContact CG2-CG 4.26Å
405	V	92.8	Very high	81.2	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	112.6	178.3	-171.6	0	0	0	0	109.5	K297 G298 A299 F348 L359 I361 M393 F396 F425	K297-V405 PolarHBondContact O-N 3.08Å; K297-V405 VanDerWaalsContact O-N 3.14Å; G298-V405 CarbonylContact C-O 3.59Å; G298-V405 WeakPolarHBondContact CA-O 3.17Å; A299-V405 PolarHBondContact N-O 3Å; F348-V405 HydrophobicContact CE1-CG2 3.96Å; L359-V405 HydrophobicContact CD2-CG1 4.43Å; L359-V405 HydrophobicContact CD2-CG2 4.4Å; L359-V405 CarbonylContact O-C 3.52Å; L359-V405 WeakPolarHBondContact O-CA 3.12Å; I361-V405 HydrophobicContact CD1-CG1 4.35Å; M393-V405 HydrophobicContact SD-CG1 4.4Å; F396-V405 HydrophobicContact CE2-CG2 4.27Å; V405-F425 HydrophobicContact CB-CE1 4.46Å; V405-F425 HydrophobicContact CG1-CE1 3.94Å; V405-F425 HydrophobicContact CG1-CZ 4.11Å
406	M	94.4	Very high	82	Confident	3 Å²	3	46 Å²	46	2%	0.015	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	139.1	173	-65.9	-173.4	79.9	0	0	110	I275 A299 L301 A313 T316 I358 L359 F360 I361 I404	I275-M406 HydrophobicContact CD1-CE 4.24Å; A299-M406 CarbonylContact O-C 3.53Å; A299-M406 VanDerWaalsContact O-CA 3.29Å; A299-M406 WeakPolarHBondContact O-CA 3.42Å; L301-M406 HydrophobicContact CD1-CE 3.96Å; L301-M406 HydrophobicContact CD2-CE 4.22Å; L301-M406 HydrophobicContact CG-CE 4.22Å; A313-M406 HydrophobicContact CB-CE 4.2Å; A313-M406 HydrophobicContact CB-SD 4.26Å; T316-M406 HydrophobicContact CG2-SD 4.25Å; I358-M406 HydrophobicContact CG2-CG 4.13Å; I358-M406 HydrophobicContact CG2-SD 3.96Å; L359-M406 PolarHBondContact O-N 2.65Å; F360-M406 CarbonylContact C-O 3.41Å; F360-M406 VanDerWaalsContact CA-O 3.25Å; F360-M406 WeakPolarHBondContact CA-O 3.32Å; F360-M406 HydrophobicContact CD2-CB 3.86Å; I361-M406 PolarHBondContact N-O 2.92Å; I404-M406 HydrophobicContact CG2-CG 4.26Å
407	A	95.3	Very high	83	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	151.1	173.8	0	0	0	0	0	110.7	A299 I300 L301 I361 I364 F425	A299-A407 PolarHBondContact O-N 3.41Å; I300-A407 CarbonylContact C-O 3.52Å; I300-A407 WeakPolarHBondContact CA-O 3.38Å; I300-A407 HydrophobicContact CG1-CB 4.25Å; L301-A407 PolarHBondContact N-O 3.38Å; I361-A407 CarbonylContact O-C 3.55Å; I361-A407 VanDerWaalsContact O-CA 3.25Å; I361-A407 WeakPolarHBondContact O-CA 3.27Å; I364-A407 HydrophobicContact CB-CB 4.12Å; I364-A407 HydrophobicContact CD1-CB 3.6Å; I364-A407 HydrophobicContact CG1-CB 4.45Å; I364-A407 HydrophobicContact CG2-CB 4.07Å; A407-F425 HydrophobicContact CB-CD1 4.41Å; A407-F425 HydrophobicContact CB-CE1 3.63Å; A407-F425 HydrophobicContact CB-CE2 4.44Å; A407-F425 HydrophobicContact CB-CZ 3.64Å
408	A	95.6	Very high	84.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	140.2	172.1	0	0	0	0	0	111.2	L301 K309 F360 I361 E363 I364	L301-A408 HydrophobicContact CB-CB 4.4Å; L301-A408 WeakPolarHBondContact O-CA 3.36Å; K309-A408 HydrophobicContact CB-CB 4.18Å; K309-A408 HydrophobicContact CD-CB 4.46Å; F360-A408 HydrophobicContact CE2-CB 3.88Å; F360-A408 HydrophobicContact CZ-CB 3.6Å; I361-A408 PolarHBondContact O-N 3.37Å; E363-A408 PolarHBondContact N-O 2.87Å; I364-A408 PolarHBondContact N-O 3.45Å; I364-A408 VanDerWaalsContact N-O 3.16Å
409	T	94.7	Very high	86.2	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	150.3	171.1	-172.1	0	0	0	0	111.3	I300 L301 T302 K309 D365 R411 V412 L415	I300-T409 HydrophobicContact CD1-CG2 3.98Å; I300-T409 HydrophobicContact CG1-CG2 4.32Å; L301-T409 PolarHBondContact O-N 3.06Å; T302-T409 HydrophobicContact CG2-CG2 3.99Å; K309-T409 WeakPolarHBondContact CE-O 3.48Å; D365-T409 PolarHBondContact OD1-OG1 2.83Å; D365-T409 VanDerWaalsContact OD1-OG1 3.12Å; T409-R411 PolarHBondContact OG1-N 3.4Å; T409-R411 PolarHBondContact OG1-O 2.88Å; T409-V412 HydrophobicContact CG2-CG2 4.08Å; T409-L415 HydrophobicContact CG2-CD1 3.76Å
410	N	94.5	Very high	87.8	Confident	74 Å²	74	42 Å²	42	40%	0.396	21%	0.21	S	C	.	.	S	Bend	trans	-89.8	-14.5	167.3	-60.9	-40.3	0	0	0	112.2	G303 K309	G303-N410 WeakPolarHBondContact O-CA 3.18Å; G303-N410 PolarHBondContact O-OD1 2.74Å; K309-N410 VanDerWaalsContact CE-OD1 3.3Å; K309-N410 WeakPolarHBondContact CE-OD1 3.48Å; K309-N410 PolarHBondContact NZ-OD1 3.03Å
411	R	90.8	Very high	89.4	Confident	120 Å²	120	42.1 Å²	42.1	45%	0.453	20%	0.203	S	C	.	.			trans	-138.5	84.2	-166.8	-69.3	-166.8	66.2	-179.1	1	111.8	T409 D413 M414	T409-R411 PolarHBondContact OG1-N 3.4Å; T409-R411 PolarHBondContact OG1-O 2.88Å; R411-D413 VanDerWaalsContact C-N 3.26Å; R411-D413 VanDerWaalsContact C-OD1 3.25Å; R411-D413 VanDerWaalsContact CA-OD1 3.3Å; R411-D413 WeakPolarHBondContact CA-OD1 3.35Å; R411-D413 WeakPolarHBondContact CB-OD1 3.33Å; R411-D413 IonicContact CZ-OD2 3.78Å; R411-D413 IonicContact NE-OD1 3.43Å; R411-D413 IonicContact NE-OD2 3.16Å; R411-D413 IonicContact NH2-OD2 3.33Å; R411-D413 PolarHBondContact NH2-OD2 2.69Å; R411-D413 PolarHBondContact O-N 3.15Å; R411-M414 HydrophobicContact CB-CB 4.36Å; R411-M414 HydrophobicContact CB-CG 4.13Å; R411-M414 VanDerWaalsContact NH2-CG 3.3Å; R411-M414 PolarHBondContact NH2-SD 2.47Å; R411-M414 PolarHBondContact O-N 2.78Å
412	V	90.3	Very high	90.6	Very high	47 Å²	47	46.5 Å²	46.5	29%	0.285	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-68.2	-30.1	179.6	-159.9	0	0	0	0	111.7	T302 T409 M414 L415 L420	T302-V412 HydrophobicContact CG2-CB 4.43Å; T302-V412 HydrophobicContact CG2-CG1 4.25Å; T302-V412 HydrophobicContact CG2-CG2 3.32Å; T409-V412 HydrophobicContact CG2-CG2 4.08Å; V412-M414 PolarHBondContact O-N 3.13Å; V412-L415 PolarHBondContact O-N 2.83Å; V412-L415 VanDerWaalsContact O-N 3.15Å; V412-L420 HydrophobicContact CG1-CD1 4.43Å
413	D	90	Very high	90.8	Very high	101 Å²	101	44.9 Å²	44.9	54%	0.54	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-57	-30.9	176.6	59.7	-53.1	0	0	0	113	I370 R411	I370-D413 WeakPolarHBondContact CD1-O 3.22Å; R411-D413 VanDerWaalsContact C-N 3.26Å; R411-D413 VanDerWaalsContact C-OD1 3.25Å; R411-D413 VanDerWaalsContact CA-OD1 3.3Å; R411-D413 WeakPolarHBondContact CA-OD1 3.35Å; R411-D413 WeakPolarHBondContact CB-OD1 3.33Å; R411-D413 IonicContact CZ-OD2 3.78Å; R411-D413 IonicContact NE-OD1 3.43Å; R411-D413 IonicContact NE-OD2 3.16Å; R411-D413 IonicContact NH2-OD2 3.33Å; R411-D413 PolarHBondContact NH2-OD2 2.69Å; R411-D413 PolarHBondContact O-N 3.15Å
414	M	88.3	Confident	91	Very high	30 Å²	30	46 Å²	46	15%	0.148	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-86.6	-9	-177.3	-66.1	-60.9	-64.4	0	0	113.5	R369 I370 R411 V412	R369-M414 CarbonylContact C-O 3.54Å; R369-M414 VanDerWaalsContact CA-O 3.25Å; R369-M414 WeakPolarHBondContact CA-O 3.35Å; R369-M414 HydrophobicContact CG-CE 4.06Å; R369-M414 VanDerWaalsContact NE-CE 3.34Å; I370-M414 PolarHBondContact N-O 3.2Å; R411-M414 HydrophobicContact CB-CB 4.36Å; R411-M414 HydrophobicContact CB-CG 4.13Å; R411-M414 VanDerWaalsContact NH2-CG 3.3Å; R411-M414 PolarHBondContact NH2-SD 2.47Å; R411-M414 PolarHBondContact O-N 2.78Å; V412-M414 PolarHBondContact O-N 3.13Å
415	L	90	Very high	91	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.021	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-82.2	142.7	-173.4	-66.6	179.1	0	0	0	113.2	I300 I364 D365 G368 I370 T409 V412 K417	I300-L415 HydrophobicContact CD1-CD1 3.31Å; I364-L415 HydrophobicContact CG2-CD1 4.26Å; I364-L415 HydrophobicContact CG2-CD2 4.06Å; D365-L415 HydrophobicContact CB-CD2 3.93Å; G368-L415 CarbonylContact O-C 3.45Å; G368-L415 VanDerWaalsContact O-CA 3.29Å; G368-L415 WeakPolarHBondContact O-CA 3.29Å; I370-L415 WeakPolarHBondContact CG1-O 3.32Å; T409-L415 HydrophobicContact CG2-CD1 3.76Å; V412-L415 PolarHBondContact O-N 2.83Å; V412-L415 VanDerWaalsContact O-N 3.15Å; L415-K417 PolarHBondContact O-N 3.5Å
416	D	90.6	Very high	90.7	Very high	21 Å²	21	48.5 Å²	48.5	11%	0.112	24%	0.243	C	C	.	.			trans	-62.8	123.5	172.1	-173.3	-13.5	0	0	0	109.4	G368 R371 L386 A418 L419	G368-D416 PolarHBondContact O-N 2.9Å; R371-D416 IonicContact CZ-OD2 2.67Å; R371-D416 IonicContact NE-OD2 2.6Å; R371-D416 PolarHBondContact NE-OD2 3.3Å; R371-D416 IonicContact NH2-OD2 2.85Å; R371-D416 PolarHBondContact NH2-OD2 3.2Å; L386-D416 HydrophobicContact CD2-CB 3.92Å; L386-D416 WeakPolarHBondContact CD2-OD2 3.31Å; D416-A418 PolarHBondContact O-N 3.17Å; D416-A418 VanDerWaalsContact OD1-CB 3.31Å; D416-A418 WeakPolarHBondContact OD1-CB 3.49Å; D416-A418 PolarHBondContact OD1-N 3.1Å; D416-L419 WeakPolarHBondContact O-CB 3.49Å; D416-L419 PolarHBondContact O-N 3.42Å
417	K	90.4	Very high	90.5	Very high	166 Å²	166	52.9 Å²	52.9	72%	0.722	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-23.4	176.1	-63.1	-176.1	-179.9	-178.1	0	112.4	L415 L419 L420	L415-K417 PolarHBondContact O-N 3.5Å; K417-L419 VanDerWaalsContact C-N 3.3Å; K417-L419 PolarHBondContact O-N 3.43Å; K417-L420 PolarHBondContact O-N 2.73Å
418	A	91.2	Very high	90.3	Very high	12 Å²	12	57.7 Å²	57.7	10%	0.099	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-34.7	174.4	0	0	0	0	0	112.9	L390 D416 L420 R424	L390-A418 HydrophobicContact CD1-CB 3.99Å; D416-A418 PolarHBondContact O-N 3.17Å; D416-A418 VanDerWaalsContact OD1-CB 3.31Å; D416-A418 WeakPolarHBondContact OD1-CB 3.49Å; D416-A418 PolarHBondContact OD1-N 3.1Å; A418-L420 VanDerWaalsContact C-N 3.33Å; A418-R424 WeakPolarHBondContact O-CD 3.37Å; A418-R424 PolarHBondContact O-NH1 2.79Å
419	L	91.5	Very high	90.2	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-34.3	178.3	-73.9	167.3	0	0	0	112.1	I364 L386 L389 L390 M393 D416 K417 R421 R424 F425	I364-L419 HydrophobicContact CD1-CD1 4.49Å; L386-L419 HydrophobicContact CD1-CD1 3.74Å; L386-L419 HydrophobicContact CD1-CD2 3.77Å; L386-L419 HydrophobicContact CD1-CG 3.82Å; L389-L419 HydrophobicContact CD2-CD2 4.16Å; L390-L419 HydrophobicContact CD2-CD2 3.43Å; L390-L419 VanDerWaalsContact CD2-CD2 3.43Å; L390-L419 HydrophobicContact CD2-CG 4.05Å; L390-L419 HydrophobicContact CG-CD2 4.41Å; M393-L419 HydrophobicContact CE-CD2 4.25Å; D416-L419 WeakPolarHBondContact O-CB 3.49Å; D416-L419 PolarHBondContact O-N 3.42Å; K417-L419 VanDerWaalsContact C-N 3.3Å; K417-L419 PolarHBondContact O-N 3.43Å; L419-R421 VanDerWaalsContact C-N 3.3Å; L419-R421 PolarHBondContact O-N 2.98Å; L419-R424 WeakPolarHBondContact O-CB 3.2Å; L419-F425 HydrophobicContact CB-CD2 4.08Å; L419-F425 HydrophobicContact CD2-CD2 4.28Å; L419-F425 HydrophobicContact CD2-CE2 3.94Å; L419-F425 PolarHBondContact O-N 2.85Å
420	L	90.3	Very high	90.2	Very high	39 Å²	39	64.6 Å²	64.6	20%	0.204	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	3.8	-174.2	-58	-179.5	0	0	0	114.2	I300 V412 K417 A418 Q428	I300-L420 HydrophobicContact CD1-CD2 4.34Å; I300-L420 HydrophobicContact CG2-CD2 4.14Å; V412-L420 HydrophobicContact CG1-CD1 4.43Å; K417-L420 PolarHBondContact O-N 2.73Å; A418-L420 VanDerWaalsContact C-N 3.33Å; L420-Q428 HydrophobicContact CD2-CG 4.39Å
421	R	90.7	Very high	90.2	Very high	158 Å²	158	61.1 Å²	61.1	60%	0.596	29%	0.29	S	S	*	.	S	Bend	trans	-77.5	150.2	179.6	-74.1	-177.6	-177.3	171.9	0.4	111.5	L419 R424	L419-R421 VanDerWaalsContact C-N 3.3Å; L419-R421 PolarHBondContact O-N 2.98Å; R421-R424 WeakPolarHBondContact O-CB 3.3Å; R421-R424 PolarHBondContact O-N 3.14Å
422	P	85.4	Confident	90.3	Very high	121 Å²	121	57.5 Å²	57.5	79%	0.786	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	141.2	171	-24.7	34.4	0	0	0	112.9	D426	P422-D426 VanDerWaalsContact C-OD1 3.31Å; P422-D426 VanDerWaalsContact CA-OD1 3.27Å; P422-D426 WeakPolarHBondContact CA-OD1 3.37Å
423	G	83.3	Confident	90.3	Very high	25 Å²	25	57 Å²	57	26%	0.258	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-0.9	-167.2	0	0	0	0	0	115.3	K297 D426	K297-G423 WeakPolarHBondContact CD-O 3.43Å; G423-D426 WeakPolarHBondContact CA-OD1 3.4Å; G423-D426 PolarHBondContact N-OD1 3.02Å
424	R	90.7	Very high	90.4	Very high	36 Å²	36	52.7 Å²	52.7	14%	0.136	26%	0.26	C	S	.	.	S	Bend	trans	-133	-110.1	-171.1	-68.7	175.9	180	178.8	-1.3	109.3	G298 M393 D394 A418 L419 R421 D426	G298-R424 WeakPolarHBondContact CA-O 3.45Å; G298-R424 PolarHBondContact N-O 3.08Å; G298-R424 VanDerWaalsContact N-O 3.13Å; M393-R424 HydrophobicContact CB-CG 4.5Å; M393-R424 HydrophobicContact CE-CB 3.35Å; M393-R424 HydrophobicContact CE-CG 3.7Å; D394-R424 WeakPolarHBondContact OD1-CG 3.3Å; D394-R424 IonicContact OD1-CZ 3.57Å; D394-R424 IonicContact OD1-NE 3.54Å; D394-R424 PolarHBondContact OD1-NE 3.08Å; D394-R424 IonicContact OD1-NH2 2.75Å; D394-R424 IonicContact OD2-CZ 3.75Å; D394-R424 IonicContact OD2-NE 3.71Å; D394-R424 IonicContact OD2-NH2 2.91Å; D394-R424 PolarHBondContact OD2-NH2 3.03Å; A418-R424 WeakPolarHBondContact O-CD 3.37Å; A418-R424 PolarHBondContact O-NH1 2.79Å; L419-R424 WeakPolarHBondContact O-CB 3.2Å; R421-R424 WeakPolarHBondContact O-CB 3.3Å; R421-R424 PolarHBondContact O-N 3.14Å; R424-D426 VanDerWaalsContact C-N 3.34Å; R424-D426 PolarHBondContact N-OD1 2.93Å; R424-D426 PolarHBondContact O-N 3.2Å
425	F	90.8	Very high	90.5	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.276	C	S	.	.	S	Bend	trans	-87.6	80.1	166.7	-66	-66.7	0	0	0	109.4	I300 I364 M393 V405 A407 L419 R427	I300-F425 HydrophobicContact CB-CB 4.31Å; I300-F425 HydrophobicContact CB-CD1 4.35Å; I300-F425 HydrophobicContact CB-CG 4.34Å; I300-F425 HydrophobicContact CG2-CB 4.34Å; I364-F425 HydrophobicContact CD1-CD2 4.5Å; I364-F425 HydrophobicContact CD1-CE2 3.46Å; I364-F425 VanDerWaalsContact CD1-CE2 3.46Å; I364-F425 HydrophobicContact CD1-CZ 3.59Å; M393-F425 HydrophobicContact CE-CD2 3.95Å; M393-F425 HydrophobicContact CE-CE2 3.81Å; M393-F425 HydrophobicContact CE-CZ 4.4Å; M393-F425 HydrophobicContact SD-CD2 4.36Å; M393-F425 HydrophobicContact SD-CE1 4.33Å; M393-F425 HydrophobicContact SD-CE2 3.82Å; M393-F425 HydrophobicContact SD-CZ 3.8Å; V405-F425 HydrophobicContact CB-CE1 4.46Å; V405-F425 HydrophobicContact CG1-CE1 3.94Å; V405-F425 HydrophobicContact CG1-CZ 4.11Å; A407-F425 HydrophobicContact CB-CD1 4.41Å; A407-F425 HydrophobicContact CB-CE1 3.63Å; A407-F425 HydrophobicContact CB-CE2 4.44Å; A407-F425 HydrophobicContact CB-CZ 3.64Å; L419-F425 HydrophobicContact CB-CD2 4.08Å; L419-F425 HydrophobicContact CD2-CD2 4.28Å; L419-F425 HydrophobicContact CD2-CE2 3.94Å; L419-F425 PolarHBondContact O-N 2.85Å; F425-R427 VanDerWaalsContact C-N 3.31Å; F425-R427 PolarHBondContact O-N 2.81Å
426	D	85.4	Confident	90.4	Very high	59 Å²	59	56 Å²	56	32%	0.316	28%	0.279	S	S	.	.			trans	-72.1	-28.8	-173.7	-58	-20.2	0	0	0	112.3	K297 G298 P422 G423 R424	K297-D426 PolarHBondContact N-OD2 3.39Å; G298-D426 PolarHBondContact O-N 3.07Å; G298-D426 VanDerWaalsContact O-N 3.13Å; P422-D426 VanDerWaalsContact C-OD1 3.31Å; P422-D426 VanDerWaalsContact CA-OD1 3.27Å; P422-D426 WeakPolarHBondContact CA-OD1 3.37Å; G423-D426 WeakPolarHBondContact CA-OD1 3.4Å; G423-D426 PolarHBondContact N-OD1 3.02Å; R424-D426 VanDerWaalsContact C-N 3.34Å; R424-D426 PolarHBondContact N-OD1 2.93Å; R424-D426 PolarHBondContact O-N 3.2Å
427	R	89.8	Confident	90.4	Very high	95 Å²	95	56.6 Å²	56.6	36%	0.358	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	128.6	177.4	-64	-61.8	-159.8	166.7	10.5	109.9	E277 F278 P296 G298 A299 I300 F425	E277-R427 IonicContact OE2-CZ 3.97Å; E277-R427 IonicContact OE2-NH2 3.81Å; E277-R427 PolarHBondContact OE2-NH2 3.39Å; F278-R427 HydrophobicContact CE2-CB 4.45Å; F278-R427 HydrophobicContact CE2-CG 4.17Å; F278-R427 HydrophobicContact CZ-CB 3.91Å; F278-R427 HydrophobicContact CZ-CG 3.58Å; P296-R427 HydrophobicContact CB-CG 4.26Å; G298-R427 PolarHBondContact O-N 2.74Å; A299-R427 CarbonylContact C-O 3.55Å; A299-R427 VanDerWaalsContact CA-O 3.31Å; A299-R427 WeakPolarHBondContact CA-O 3.47Å; A299-R427 HydrophobicContact CB-CB 4.04Å; I300-R427 PolarHBondContact N-O 3.49Å; F425-R427 VanDerWaalsContact C-N 3.31Å; F425-R427 PolarHBondContact O-N 2.81Å
428	Q	91.9	Very high	90.5	Very high	100 Å²	100	48.8 Å²	48.8	47%	0.467	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	106.6	171.4	-56.9	-177.6	26.8	0	0	107.2	I300 L420	I300-Q428 HydrophobicContact CG2-CB 3.97Å; I300-Q428 HydrophobicContact CG2-CG 3.67Å; L420-Q428 HydrophobicContact CD2-CG 4.39Å
429	I	93.9	Very high	90.6	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	116.2	-176.8	-62.5	154.3	0	0	0	107	A271 E274 I275 F278 A299 I300 L301 T302 V431	A271-I429 HydrophobicContact CB-CG2 3.63Å; E274-I429 HydrophobicContact CB-CD1 4.29Å; E274-I429 HydrophobicContact CB-CG1 4.11Å; E274-I429 WeakPolarHBondContact OE2-CG1 3.33Å; I275-I429 HydrophobicContact CD1-CD1 4.35Å; I275-I429 HydrophobicContact CG1-CD1 3.68Å; F278-I429 HydrophobicContact CE2-CD1 4.23Å; A299-I429 HydrophobicContact CB-CD1 4.09Å; I300-I429 PolarHBondContact O-N 3.43Å; L301-I429 WeakPolarHBondContact CA-O 3.38Å; L301-I429 HydrophobicContact CD2-CB 3.98Å; L301-I429 HydrophobicContact CD2-CD1 4.14Å; L301-I429 HydrophobicContact CD2-CG2 4.09Å; T302-I429 PolarHBondContact N-O 3.33Å; T302-I429 PolarHBondContact OG1-O 3.06Å; I429-V431 HydrophobicContact CG2-CG2 4.5Å
430	Y	94.4	Very high	90.6	Very high	146 Å²	146	48.6 Å²	48.6	57%	0.573	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87	126.1	175	-176.9	-111.1	0	0	0	109.8	T302 P432	T302-Y430 WeakPolarHBondContact OG1-CA 3.48Å; Y430-P432 HydrophobicContact CD1-CB 4.24Å; Y430-P432 HydrophobicContact CE1-CB 3.74Å; Y430-P432 WeakPolarHBondContact O-CD 3.29Å
431	V	94.4	Very high	90.7	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.006	25%	0.246	C	C	.	.			trans	-108.1	94.1	177.1	-172.6	0	0	0	0	107.4	C268 A271 T302 T307 K309 L312 I429	C268-V431 HydrophobicContact CB-CG1 4.15Å; A271-V431 HydrophobicContact CB-CG2 4.1Å; T302-V431 PolarHBondContact O-N 2.89Å; T307-V431 PolarHBondContact OG1-O 2.95Å; K309-V431 HydrophobicContact CG-CB 4.25Å; K309-V431 HydrophobicContact CG-CG2 4.24Å; L312-V431 HydrophobicContact CD2-CG2 4.14Å; I429-V431 HydrophobicContact CG2-CG2 4.5Å
432	P	92.1	Very high	90.9	Very high	45 Å²	45	41.5 Å²	41.5	29%	0.292	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-66.8	169	-178.6	28.7	-34.9	0	0	0	111.8	T307 Y430	T307-P432 WeakPolarHBondContact CG2-O 3.36Å; Y430-P432 HydrophobicContact CD1-CB 4.24Å; Y430-P432 HydrophobicContact CE1-CB 3.74Å; Y430-P432 WeakPolarHBondContact O-CD 3.29Å
433	A	92.1	Very high	91.4	Very high	36 Å²	36	35.7 Å²	35.7	30%	0.298	18%	0.184	S	C	.	.	P	Polyproline II helix	trans	-64.4	145.3	161.1	0	0	0	0	0	109.3
434	P	92.1	Very high	91.8	Very high	10 Å²	10	41.1 Å²	41.1	7%	0.065	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-71.4	136.6	-173.5	29.2	-35.6	0	0	0	112.6	R439 I442 F470	P434-R439 HydrophobicContact CB-CG 3.98Å; P434-R439 HydrophobicContact CG-CG 3.79Å; P434-R439 PolarHBondContact O-NH1 3.03Å; P434-I442 HydrophobicContact CB-CD1 3.59Å; P434-I442 HydrophobicContact CG-CD1 3.72Å; P434-F470 WeakPolarHBondContact CG-O 3.5Å
435	D	89.6	Confident	91.8	Very high	89 Å²	89	41.4 Å²	41.4	48%	0.476	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-70.4	172.7	171.2	-61.6	-24.2	0	0	0	111.4	K437 G438 R439	D435-K437 VanDerWaalsContact C-N 3.28Å; D435-K437 PolarHBondContact O-N 2.86Å; D435-G438 CarbonylContact O-C 3.53Å; D435-G438 WeakPolarHBondContact O-CA 3.24Å; D435-G438 PolarHBondContact O-N 3.28Å; D435-R439 WeakPolarHBondContact O-CG 3.34Å; D435-R439 PolarHBondContact O-N 3.48Å
436	I	88.7	Confident	91.9	Very high	16 Å²	16	44 Å²	44	8%	0.082	21%	0.214	C	C	.	.	H	α-helix	trans	-51.9	-42	-179.9	-165.6	176	0	0	0	113.9	R439 A440 A464 Y694 F697 V698	I436-R439 PolarHBondContact O-N 2.89Å; I436-A440 PolarHBondContact O-N 3.39Å; I436-A440 VanDerWaalsContact O-N 3.1Å; I436-A464 HydrophobicContact CG1-CB 4.43Å; I436-Y694 HydrophobicContact CD1-CD2 3.79Å; I436-Y694 HydrophobicContact CD1-CE2 4.3Å; I436-Y694 HydrophobicContact CG1-CD2 3.74Å; I436-Y694 HydrophobicContact CG1-CE2 3.86Å; I436-F697 HydrophobicContact CD1-CB 3.61Å; I436-F697 HydrophobicContact CD1-CD2 3.87Å; I436-F697 HydrophobicContact CD1-CG 3.93Å; I436-V698 HydrophobicContact CG2-CG2 4Å
437	K	90.3	Very high	92.3	Very high	32 Å²	32	41.2 Å²	41.2	14%	0.139	20%	0.199	C	C	.	.	H	α-helix	trans	-67.5	-45.1	176.5	-60.4	-173.8	-178.4	-179	0	111.5	D435 R439 A440 S441 V698 T701 G703 D706	D435-K437 VanDerWaalsContact C-N 3.28Å; D435-K437 PolarHBondContact O-N 2.86Å; K437-R439 VanDerWaalsContact C-N 3.32Å; K437-R439 PolarHBondContact O-N 2.91Å; K437-A440 WeakPolarHBondContact O-CB 3.29Å; K437-A440 PolarHBondContact O-N 3.48Å; K437-S441 PolarHBondContact O-N 2.91Å; K437-S441 PolarHBondContact O-OG 3.26Å; K437-V698 VanDerWaalsContact CE-CG1 3.5Å; K437-V698 HydrophobicContact CG-CG2 4.17Å; K437-T701 WeakPolarHBondContact CE-OG1 3.42Å; K437-T701 PolarHBondContact NZ-OG1 2.63Å; K437-G703 WeakPolarHBondContact CE-O 3.46Å; K437-G703 PolarHBondContact NZ-O 3.46Å; K437-D706 HydrophobicContact CB-CB 3.98Å
438	G	91.8	Very high	92.2	Very high	2 Å²	2	44.6 Å²	44.6	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-60.1	-41.5	176.2	0	0	0	0	0	112.2	G267 D435 S441 I442	G267-G438 VanDerWaalsContact CA-CA 3.41Å; D435-G438 CarbonylContact O-C 3.53Å; D435-G438 WeakPolarHBondContact O-CA 3.24Å; D435-G438 PolarHBondContact O-N 3.28Å; G438-S441 PolarHBondContact O-N 2.87Å; G438-I442 WeakPolarHBondContact O-CG1 3.38Å; G438-I442 PolarHBondContact O-N 3.42Å
439	R	93.2	Very high	92.1	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.015	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-45	174.6	-68.9	-161.7	-58	-84.2	3.6	111.7	P434 D435 I436 K437 S441 I442 F443 A464 T467 I475 E566	P434-R439 HydrophobicContact CB-CG 3.98Å; P434-R439 HydrophobicContact CG-CG 3.79Å; P434-R439 PolarHBondContact O-NH1 3.03Å; D435-R439 WeakPolarHBondContact O-CG 3.34Å; D435-R439 PolarHBondContact O-N 3.48Å; I436-R439 PolarHBondContact O-N 2.89Å; K437-R439 VanDerWaalsContact C-N 3.32Å; K437-R439 PolarHBondContact O-N 2.91Å; R439-S441 VanDerWaalsContact C-N 3.3Å; R439-S441 PolarHBondContact O-N 3.42Å; R439-I442 PolarHBondContact O-N 3.07Å; R439-F443 WeakPolarHBondContact O-CD2 3.17Å; R439-F443 PolarHBondContact O-N 2.93Å; R439-A464 HydrophobicContact CB-CB 3.94Å; R439-A464 PolarHBondContact NE-O 3.47Å; R439-A464 PolarHBondContact NH2-O 3.02Å; R439-T467 VanDerWaalsContact CD-O 3.25Å; R439-T467 WeakPolarHBondContact CD-O 3.24Å; R439-T467 PolarHBondContact NE-O 2.89Å; R439-I475 HydrophobicContact CB-CD1 3.85Å; R439-I475 HydrophobicContact CG-CD1 3.71Å; R439-E566 IonicContact CZ-OE1 3.86Å; R439-E566 IonicContact NH1-OE1 3.33Å; R439-E566 PolarHBondContact NH1-OE1 3.48Å; R439-E566 IonicContact NH2-OE1 3.03Å; R439-E566 PolarHBondContact NH2-OE1 2.97Å
440	A	92.6	Very high	92	Very high	5 Å²	5	46.4 Å²	46.4	4%	0.041	24%	0.235	C	C	.	.	H	α-helix	trans	-58	-44.2	176.3	0	0	0	0	0	111.3	I436 K437 F443 R444 S460 R461 A464 Y694	I436-A440 PolarHBondContact O-N 3.39Å; I436-A440 VanDerWaalsContact O-N 3.1Å; K437-A440 WeakPolarHBondContact O-CB 3.29Å; K437-A440 PolarHBondContact O-N 3.48Å; A440-F443 PolarHBondContact O-N 2.83Å; A440-R444 PolarHBondContact O-N 2.85Å; A440-S460 WeakPolarHBondContact O-CB 3.27Å; A440-R461 HydrophobicContact CB-CG 4.48Å; A440-A464 HydrophobicContact CB-CB 3.85Å; A440-Y694 HydrophobicContact CB-CE2 3.86Å
441	S	92.5	Very high	91.7	Very high	34 Å²	34	42.5 Å²	42.5	24%	0.238	23%	0.233	C	C	.	.	H	α-helix	trans	-64.4	-40.5	175.4	-63.1	0	0	0	0	112.9	K437 G438 R439 R444 V445	K437-S441 PolarHBondContact O-N 2.91Å; K437-S441 PolarHBondContact O-OG 3.26Å; G438-S441 PolarHBondContact O-N 2.87Å; R439-S441 VanDerWaalsContact C-N 3.3Å; R439-S441 PolarHBondContact O-N 3.42Å; S441-R444 WeakPolarHBondContact O-CB 3.33Å; S441-R444 PolarHBondContact O-N 3.36Å; S441-V445 WeakPolarHBondContact O-CG2 3.41Å; S441-V445 PolarHBondContact O-N 3.4Å; S441-V445 VanDerWaalsContact O-N 3.13Å
442	I	94.4	Very high	91	Very high	14 Å²	14	43.3 Å²	43.3	7%	0.072	24%	0.24	C	C	.	.	H	α-helix	trans	-65.3	-44.4	175.8	-66.5	163.4	0	0	0	110.9	A266 P434 G438 R439 R444 V445 H446 I475	A266-I442 HydrophobicContact CB-CG1 3.87Å; A266-I442 WeakPolarHBondContact O-CG1 3.36Å; P434-I442 HydrophobicContact CB-CD1 3.59Å; P434-I442 HydrophobicContact CG-CD1 3.72Å; G438-I442 WeakPolarHBondContact O-CG1 3.38Å; G438-I442 PolarHBondContact O-N 3.42Å; R439-I442 PolarHBondContact O-N 3.07Å; I442-R444 VanDerWaalsContact C-N 3.26Å; I442-R444 PolarHBondContact O-N 2.92Å; I442-V445 PolarHBondContact O-N 3.02Å; I442-H446 PolarHBondContact O-CD2 2.91Å; I442-H446 PolarHBondContact O-N 2.68Å; I442-H446 VanDerWaalsContact O-N 3.09Å; I442-I475 HydrophobicContact CB-CD1 4.18Å; I442-I475 HydrophobicContact CD1-CD1 4.44Å; I442-I475 HydrophobicContact CG2-CB 4.03Å; I442-I475 HydrophobicContact CG2-CD1 4.01Å; I442-I475 HydrophobicContact CG2-CG2 3.73Å
443	F	94.8	Very high	90	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.5	-43.7	172.9	-87	-70.3	0	0	0	110.6	R439 A440 V445 H446 L447 L463 A464 T467 I475 V478	R439-F443 WeakPolarHBondContact O-CD2 3.17Å; R439-F443 PolarHBondContact O-N 2.93Å; A440-F443 PolarHBondContact O-N 2.83Å; F443-V445 VanDerWaalsContact C-N 3.31Å; F443-V445 PolarHBondContact O-N 2.85Å; F443-H446 PolarHBondContact O-N 3.38Å; F443-L447 HydrophobicContact CB-CD1 4.23Å; F443-L447 WeakPolarHBondContact O-CB 3.33Å; F443-L447 WeakPolarHBondContact O-CG 3.32Å; F443-L447 PolarHBondContact O-N 3.41Å; F443-L463 HydrophobicContact CD1-CB 4.03Å; F443-L463 HydrophobicContact CD1-CD1 3.86Å; F443-L463 HydrophobicContact CD2-CB 4.1Å; F443-L463 HydrophobicContact CE1-CB 3.83Å; F443-L463 HydrophobicContact CE1-CD1 3.91Å; F443-L463 HydrophobicContact CE1-CG 4.47Å; F443-L463 HydrophobicContact CE2-CB 3.95Å; F443-L463 HydrophobicContact CG-CB 4.17Å; F443-L463 HydrophobicContact CZ-CB 3.81Å; F443-A464 HydrophobicContact CD2-CB 4.31Å; F443-T467 WeakPolarHBondContact CE2-OG1 3.35Å; F443-T467 HydrophobicContact CZ-CG2 4.18Å; F443-I475 HydrophobicContact CD1-CG2 3.56Å; F443-I475 HydrophobicContact CD2-CD1 4.28Å; F443-I475 HydrophobicContact CD2-CG1 4.45Å; F443-I475 HydrophobicContact CD2-CG2 3.94Å; F443-I475 HydrophobicContact CE1-CB 4.46Å; F443-I475 HydrophobicContact CE1-CG2 3.56Å; F443-I475 HydrophobicContact CE2-CB 4.47Å; F443-I475 HydrophobicContact CE2-CD1 3.98Å; F443-I475 HydrophobicContact CE2-CG1 3.83Å; F443-I475 HydrophobicContact CE2-CG2 3.91Å; F443-I475 HydrophobicContact CG-CG2 3.74Å; F443-I475 HydrophobicContact CZ-CB 4.26Å; F443-I475 HydrophobicContact CZ-CG1 3.9Å; F443-I475 HydrophobicContact CZ-CG2 3.72Å; F443-V478 HydrophobicContact CE1-CG1 4.3Å
444	R	91.9	Very high	88.9	Confident	139 Å²	139	47.4 Å²	47.4	53%	0.525	25%	0.253	S	S	.	.	H	α-helix	trans	-58	-42	178	-169.5	178.3	-177.6	174.1	2.2	112.5	A440 S441 I442 F448	A440-R444 PolarHBondContact O-N 2.85Å; S441-R444 WeakPolarHBondContact O-CB 3.33Å; S441-R444 PolarHBondContact O-N 3.36Å; I442-R444 VanDerWaalsContact C-N 3.26Å; I442-R444 PolarHBondContact O-N 2.92Å; R444-F448 PolarHBondContact O-N 3.28Å
445	V	92	Very high	88.5	Confident	42 Å²	42	51.6 Å²	51.6	26%	0.255	28%	0.275	S	S	.	.	H	α-helix	trans	-62.8	-46.8	176	175.2	0	0	0	0	111.1	A266 S441 I442 F443 F448 P449	A266-V445 HydrophobicContact CB-CG2 4.17Å; S441-V445 WeakPolarHBondContact O-CG2 3.41Å; S441-V445 PolarHBondContact O-N 3.4Å; S441-V445 VanDerWaalsContact O-N 3.13Å; I442-V445 PolarHBondContact O-N 3.02Å; F443-V445 VanDerWaalsContact C-N 3.31Å; F443-V445 PolarHBondContact O-N 2.85Å; V445-F448 WeakPolarHBondContact O-CB 3.45Å; V445-F448 PolarHBondContact O-N 3.49Å; V445-P449 WeakPolarHBondContact O-CD 3.26Å
446	H	93	Very high	88.4	Confident	55 Å²	55	50.3 Å²	50.3	26%	0.255	27%	0.266	S	S	.	.	H	α-helix	trans	-77.8	-24.4	-177.6	-73.8	-69.4	0	0	0	114.5	I442 F443 P449 C479	I442-H446 PolarHBondContact O-CD2 2.91Å; I442-H446 PolarHBondContact O-N 2.68Å; I442-H446 VanDerWaalsContact O-N 3.09Å; F443-H446 PolarHBondContact O-N 3.38Å; H446-P449 WeakPolarHBondContact O-CD 3.11Å; H446-P449 WeakPolarHBondContact O-CG 3.44Å; H446-C479 HydrophobicContact CB-CB 4.15Å
447	L	92.6	Very high	88.2	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-78.9	-21.5	174.2	-71.1	171.7	0	0	0	112.3	F443 L450 K456 L459 L463 F499	F443-L447 HydrophobicContact CB-CD1 4.23Å; F443-L447 WeakPolarHBondContact O-CB 3.33Å; F443-L447 WeakPolarHBondContact O-CG 3.32Å; F443-L447 PolarHBondContact O-N 3.41Å; L447-L450 HydrophobicContact CD2-CD1 4.45Å; L447-L450 PolarHBondContact O-N 2.77Å; L447-L450 VanDerWaalsContact O-N 3.13Å; L447-K456 PolarHBondContact O-NZ 3.16Å; L447-L459 HydrophobicContact CD1-CD2 4.1Å; L447-L459 HydrophobicContact CD1-CG 4.19Å; L447-L459 HydrophobicContact CD2-CD2 4.08Å; L447-L463 HydrophobicContact CD1-CD1 4.47Å; L447-F499 HydrophobicContact CD2-CE1 3.7Å; L447-F499 HydrophobicContact CD2-CE2 4.44Å; L447-F499 HydrophobicContact CD2-CZ 3.43Å; L447-F499 VanDerWaalsContact CD2-CZ 3.43Å
448	F	88.1	Confident	88.1	Confident	165 Å²	165	54.3 Å²	54.3	72%	0.724	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-49.3	178.9	-172.4	-95.4	0	0	0	113.5	R444 V445 L450 K456	R444-F448 PolarHBondContact O-N 3.28Å; V445-F448 WeakPolarHBondContact O-CB 3.45Å; V445-F448 PolarHBondContact O-N 3.49Å; F448-L450 VanDerWaalsContact C-N 3.31Å; F448-L450 PolarHBondContact O-N 3.35Å; F448-K456 PolarHBondContact O-NZ 3Å
449	P	89.9	Confident	88	Confident	103 Å²	103	54.4 Å²	54.4	67%	0.669	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-12.1	177.6	29.8	-37.5	0	0	0	115	V445 H446	V445-P449 WeakPolarHBondContact O-CD 3.26Å; H446-P449 WeakPolarHBondContact O-CD 3.11Å; H446-P449 WeakPolarHBondContact O-CG 3.44Å
450	L	90.8	Very high	87.9	Confident	37 Å²	37	54.4 Å²	54.4	19%	0.194	29%	0.288	C	S	.	.	S	Bend	trans	-91	147.4	-174.1	-62.6	179.7	0	0	0	112.9	L447 F448 A452 K456 C479 A483 I494	L447-L450 HydrophobicContact CD2-CD1 4.45Å; L447-L450 PolarHBondContact O-N 2.77Å; L447-L450 VanDerWaalsContact O-N 3.13Å; F448-L450 VanDerWaalsContact C-N 3.31Å; F448-L450 PolarHBondContact O-N 3.35Å; L450-A452 PolarHBondContact O-N 3.49Å; L450-K456 PolarHBondContact O-NZ 3.43Å; L450-C479 HydrophobicContact CD1-CB 3.94Å; L450-A483 HydrophobicContact CD2-CB 4.18Å; L450-I494 HydrophobicContact CB-CD1 4.09Å; L450-I494 HydrophobicContact CD1-CD1 4.11Å; L450-I494 HydrophobicContact CD2-CD1 4.3Å; L450-I494 HydrophobicContact CG-CD1 4.4Å
451	A	88	Confident	87.8	Confident	64 Å²	64	56.4 Å²	56.4	53%	0.529	29%	0.294	S	S	.	.			trans	-88.8	84.4	171.2	0	0	0	0	0	110.2	K493 I494	A451-K493 WeakPolarHBondContact O-CA 3.42Å; A451-I494 PolarHBondContact O-N 3.01Å
452	A	81.4	Confident	87.6	Confident	18 Å²	18	59.7 Å²	59.7	15%	0.149	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-109.7	145.8	178.5	0	0	0	0	0	111.4	L450 L459 I494 F499	L450-A452 PolarHBondContact O-N 3.49Å; A452-L459 HydrophobicContact CB-CD2 4.22Å; A452-I494 WeakPolarHBondContact CA-O 3.15Å; A452-I494 HydrophobicContact CB-CB 4.29Å; A452-F499 HydrophobicContact CB-CE2 4.31Å; A452-F499 HydrophobicContact CB-CZ 4.48Å
453	E	69.5	Low	87.5	Confident	112 Å²	112	59 Å²	59	52%	0.523	30%	0.301	S	S	.	.	S	Bend	trans	-111.7	51.1	-175.2	-158.7	165.3	-139.3	0	0	113.6	K493 I494	E453-K493 HydrophobicContact CB-CB 4.07Å; E453-K493 HydrophobicContact CB-CD 3.84Å; E453-K493 VanDerWaalsContact CD-CD 3.4Å; E453-K493 HydrophobicContact CG-CD 3.94Å; E453-K493 WeakPolarHBondContact OE1-CD 3.39Å; E453-K493 IonicContact OE1-NZ 3.73Å; E453-K493 PolarHBondContact OE1-NZ 2.83Å; E453-K493 WeakPolarHBondContact OE2-CD 3.47Å; E453-I494 PolarHBondContact N-O 3.21Å
454	P	69.6	Low	87.3	Confident	54 Å²	54	59 Å²	59	35%	0.351	30%	0.301	S	S	.	.	S	Bend	trans	-132.2	178.5	134.6	11.8	9.9	0	0	0	112.2	K456 L459	P454-K456 PolarHBondContact O-N 3.39Å; P454-K456 VanDerWaalsContact O-N 3.15Å; P454-L459 HydrophobicContact CG-CB 4.22Å; P454-L459 HydrophobicContact CG-CD1 4.19Å; P454-L459 HydrophobicContact CG-CD2 4.07Å; P454-L459 HydrophobicContact CG-CG 4.38Å
455	D	84.2	Confident	87.1	Confident	98 Å²	98	52.9 Å²	52.9	52%	0.524	28%	0.28	S	S	.	.			trans	-54.1	121.6	167.5	177.8	13.8	0	0	0	109.6	T457 E458 L459	D455-T457 PolarHBondContact O-N 3.22Å; D455-T457 PolarHBondContact OD1-N 3.47Å; D455-T457 VanDerWaalsContact OD1-N 3.15Å; D455-T457 PolarHBondContact OD1-OG1 3.47Å; D455-E458 HydrophobicContact CB-CB 4.33Å; D455-E458 PolarHBondContact O-N 3.36Å; D455-L459 WeakPolarHBondContact O-CB 3.36Å; D455-L459 PolarHBondContact O-N 3.31Å
456	K	86.3	Confident	86.8	Confident	63 Å²	63	53.2 Å²	53.2	27%	0.274	28%	0.28	S	S	.	.	H	α-helix	trans	-59.5	-31.5	-175.8	-61.6	-171.7	179.8	-155.7	0	111.5	L447 F448 L450 P454 S460	L447-K456 PolarHBondContact O-NZ 3.16Å; F448-K456 PolarHBondContact O-NZ 3Å; L450-K456 PolarHBondContact O-NZ 3.43Å; P454-K456 PolarHBondContact O-N 3.39Å; P454-K456 VanDerWaalsContact O-N 3.15Å; K456-S460 VanDerWaalsContact O-CB 3.31Å; K456-S460 WeakPolarHBondContact O-CB 3.42Å; K456-S460 PolarHBondContact O-N 2.91Å; K456-S460 PolarHBondContact O-OG 2.97Å
457	T	85.9	Confident	86.6	Confident	39 Å²	39	50.6 Å²	50.6	24%	0.239	27%	0.267	C	S	.	.	H	α-helix	trans	-70.7	-52.4	-179.4	-46.4	0	0	0	0	110.6	D455 L459 S460 R461	D455-T457 PolarHBondContact O-N 3.22Å; D455-T457 PolarHBondContact OD1-N 3.47Å; D455-T457 VanDerWaalsContact OD1-N 3.15Å; D455-T457 PolarHBondContact OD1-OG1 3.47Å; T457-L459 VanDerWaalsContact C-N 3.34Å; T457-L459 PolarHBondContact O-N 2.92Å; T457-S460 PolarHBondContact O-N 2.9Å; T457-S460 PolarHBondContact O-OG 3.24Å; T457-R461 PolarHBondContact O-N 2.87Å
458	E	87.2	Confident	86.3	Confident	93 Å²	93	51.9 Å²	51.9	44%	0.435	28%	0.276	S	S	.	.	H	α-helix	trans	-62.6	-41.9	177.4	-166.7	-171.2	163.3	0	0	111.7	D455 S460 R461 K462	D455-E458 HydrophobicContact CB-CB 4.33Å; D455-E458 PolarHBondContact O-N 3.36Å; E458-S460 VanDerWaalsContact C-N 3.33Å; E458-S460 PolarHBondContact O-N 3.32Å; E458-R461 PolarHBondContact O-N 3.23Å; E458-K462 WeakPolarHBondContact O-CG 2.9Å; E458-K462 PolarHBondContact O-N 3.09Å; E458-K462 WeakPolarHBondContact OE1-CE 3.5Å; E458-K462 IonicContact OE1-NZ 2.81Å; E458-K462 PolarHBondContact OE1-NZ 3.09Å
459	L	89.6	Confident	86.3	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.016	27%	0.27	C	S	.	.	H	α-helix	trans	-59.2	-44	175.8	179.4	61.9	0	0	0	111.4	L447 A452 P454 D455 T457 R461 K462 L463 M496 F499	L447-L459 HydrophobicContact CD1-CD2 4.1Å; L447-L459 HydrophobicContact CD1-CG 4.19Å; L447-L459 HydrophobicContact CD2-CD2 4.08Å; A452-L459 HydrophobicContact CB-CD2 4.22Å; P454-L459 HydrophobicContact CG-CB 4.22Å; P454-L459 HydrophobicContact CG-CD1 4.19Å; P454-L459 HydrophobicContact CG-CD2 4.07Å; P454-L459 HydrophobicContact CG-CG 4.38Å; D455-L459 WeakPolarHBondContact O-CB 3.36Å; D455-L459 PolarHBondContact O-N 3.31Å; T457-L459 VanDerWaalsContact C-N 3.34Å; T457-L459 PolarHBondContact O-N 2.92Å; L459-R461 VanDerWaalsContact C-N 3.3Å; L459-R461 PolarHBondContact O-N 3.17Å; L459-K462 PolarHBondContact O-N 2.65Å; L459-L463 HydrophobicContact CD1-CD1 3.9Å; L459-L463 HydrophobicContact CD1-CD2 4.36Å; L459-L463 HydrophobicContact CD1-CG 3.9Å; L459-L463 HydrophobicContact CD2-CD1 4.42Å; L459-L463 HydrophobicContact CG-CD1 3.84Å; L459-L463 HydrophobicContact CG-CG 4.23Å; L459-L463 WeakPolarHBondContact O-CB 3.37Å; L459-L463 VanDerWaalsContact O-CG 3.3Å; L459-L463 WeakPolarHBondContact O-CG 3.34Å; L459-L463 PolarHBondContact O-N 3.4Å; L459-M496 HydrophobicContact CD1-SD 3.54Å; L459-M496 VanDerWaalsContact CD1-SD 3.54Å; L459-F499 HydrophobicContact CD1-CD2 4.41Å; L459-F499 HydrophobicContact CD2-CD2 4.26Å; L459-F499 HydrophobicContact CD2-CE2 3.7Å; L459-F499 HydrophobicContact CD2-CZ 4.09Å
460	S	91.6	Very high	86.4	Confident	4 Å²	4	43 Å²	43	3%	0.028	24%	0.243	C	C	.	.	H	α-helix	trans	-60.2	-39.3	179.5	72.6	0	0	0	0	112.8	A440 K456 T457 E458 A464	A440-S460 WeakPolarHBondContact O-CB 3.27Å; K456-S460 VanDerWaalsContact O-CB 3.31Å; K456-S460 WeakPolarHBondContact O-CB 3.42Å; K456-S460 PolarHBondContact O-N 2.91Å; K456-S460 PolarHBondContact O-OG 2.97Å; T457-S460 PolarHBondContact O-N 2.9Å; T457-S460 PolarHBondContact O-OG 3.24Å; E458-S460 VanDerWaalsContact C-N 3.33Å; E458-S460 PolarHBondContact O-N 3.32Å; S460-A464 VanDerWaalsContact O-CB 3.29Å; S460-A464 WeakPolarHBondContact O-CB 3.34Å; S460-A464 PolarHBondContact O-N 3.48Å
461	R	90.5	Very high	86.6	Confident	48 Å²	48	42.2 Å²	42.2	18%	0.181	24%	0.24	C	C	.	.	H	α-helix	trans	-67.6	-45.3	176.8	-69.8	179.4	-179.9	164	1.9	111.7	A440 T457 E458 L459 L463 A464 A465 Y694 D705	A440-R461 HydrophobicContact CB-CG 4.48Å; T457-R461 PolarHBondContact O-N 2.87Å; E458-R461 PolarHBondContact O-N 3.23Å; L459-R461 VanDerWaalsContact C-N 3.3Å; L459-R461 PolarHBondContact O-N 3.17Å; R461-L463 PolarHBondContact O-N 3.38Å; R461-A464 PolarHBondContact O-N 3.08Å; R461-A465 PolarHBondContact O-N 2.74Å; R461-A465 VanDerWaalsContact O-N 3.12Å; R461-Y694 HydrophobicContact CB-CD1 3.87Å; R461-Y694 HydrophobicContact CB-CD2 4.12Å; R461-Y694 HydrophobicContact CB-CE1 4.4Å; R461-Y694 HydrophobicContact CB-CG 3.72Å; R461-Y694 HydrophobicContact CG-CD1 3.74Å; R461-Y694 HydrophobicContact CG-CD2 4.34Å; R461-Y694 HydrophobicContact CG-CE1 3.8Å; R461-Y694 HydrophobicContact CG-CE2 4.38Å; R461-Y694 HydrophobicContact CG-CG 4.04Å; R461-D705 IonicContact CZ-OD1 2.75Å; R461-D705 IonicContact NE-OD1 2.74Å; R461-D705 IonicContact NH2-OD1 2.85Å; R461-D705 PolarHBondContact NH2-OD1 2.88Å; R461-D705 IonicContact NH2-OD2 3.61Å; R461-D705 PolarHBondContact NH2-OD2 2.72Å
462	K	88.7	Confident	86.8	Confident	103 Å²	103	39.8 Å²	39.8	45%	0.448	22%	0.221	S	C	.	.	H	α-helix	trans	-60.5	-45.8	176	-72	179.7	-177.3	170.8	0	111.8	E458 L459 A465 L466	E458-K462 WeakPolarHBondContact O-CG 2.9Å; E458-K462 PolarHBondContact O-N 3.09Å; E458-K462 WeakPolarHBondContact OE1-CE 3.5Å; E458-K462 IonicContact OE1-NZ 2.81Å; E458-K462 PolarHBondContact OE1-NZ 3.09Å; L459-K462 PolarHBondContact O-N 2.65Å; K462-A465 PolarHBondContact O-N 3.4Å; K462-L466 WeakPolarHBondContact O-CG 3.37Å; K462-L466 PolarHBondContact O-N 2.78Å
463	L	91.8	Very high	87.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-67.4	-37.7	179	-66.4	177.2	0	0	0	112.5	F443 L447 L459 R461 A465 L466 T467 M496 F499	F443-L463 HydrophobicContact CD1-CB 4.03Å; F443-L463 HydrophobicContact CD1-CD1 3.86Å; F443-L463 HydrophobicContact CD2-CB 4.1Å; F443-L463 HydrophobicContact CE1-CB 3.83Å; F443-L463 HydrophobicContact CE1-CD1 3.91Å; F443-L463 HydrophobicContact CE1-CG 4.47Å; F443-L463 HydrophobicContact CE2-CB 3.95Å; F443-L463 HydrophobicContact CG-CB 4.17Å; F443-L463 HydrophobicContact CZ-CB 3.81Å; L447-L463 HydrophobicContact CD1-CD1 4.47Å; L459-L463 HydrophobicContact CD1-CD1 3.9Å; L459-L463 HydrophobicContact CD1-CD2 4.36Å; L459-L463 HydrophobicContact CD1-CG 3.9Å; L459-L463 HydrophobicContact CD2-CD1 4.42Å; L459-L463 HydrophobicContact CG-CD1 3.84Å; L459-L463 HydrophobicContact CG-CG 4.23Å; L459-L463 WeakPolarHBondContact O-CB 3.37Å; L459-L463 VanDerWaalsContact O-CG 3.3Å; L459-L463 WeakPolarHBondContact O-CG 3.34Å; L459-L463 PolarHBondContact O-N 3.4Å; R461-L463 PolarHBondContact O-N 3.38Å; L463-A465 VanDerWaalsContact C-N 3.28Å; L463-A465 PolarHBondContact O-N 2.6Å; L463-L466 PolarHBondContact O-N 3.41Å; L463-L466 VanDerWaalsContact O-N 3.12Å; L463-T467 PolarHBondContact O-N 2.83Å; L463-T467 VanDerWaalsContact O-N 3.17Å; L463-T467 PolarHBondContact O-OG1 3.21Å; L463-M496 HydrophobicContact CD2-CE 4.03Å; L463-M496 HydrophobicContact CD2-SD 4.16Å; L463-F499 HydrophobicContact CD1-CB 4.39Å; L463-F499 HydrophobicContact CD1-CD1 3.67Å; L463-F499 HydrophobicContact CD1-CE1 4.02Å; L463-F499 HydrophobicContact CD1-CG 3.96Å; L463-F499 HydrophobicContact CD2-CB 3.63Å; L463-F499 HydrophobicContact CD2-CD1 4.39Å; L463-F499 HydrophobicContact CD2-CG 4.11Å
464	A	91	Very high	88.7	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.1	-36.1	175.5	0	0	0	0	0	112.6	I436 R439 A440 F443 S460 R461 Y694	I436-A464 HydrophobicContact CG1-CB 4.43Å; R439-A464 HydrophobicContact CB-CB 3.94Å; R439-A464 PolarHBondContact NE-O 3.47Å; R439-A464 PolarHBondContact NH2-O 3.02Å; A440-A464 HydrophobicContact CB-CB 3.85Å; F443-A464 HydrophobicContact CD2-CB 4.31Å; S460-A464 VanDerWaalsContact O-CB 3.29Å; S460-A464 WeakPolarHBondContact O-CB 3.34Å; S460-A464 PolarHBondContact O-N 3.48Å; R461-A464 PolarHBondContact O-N 3.08Å; A464-Y694 HydrophobicContact CB-CD2 4.45Å
465	A	87.2	Confident	89.9	Confident	10 Å²	10	36.1 Å²	36.1	8%	0.083	21%	0.206	C	C	.	.	H	α-helix	trans	-67.7	-36.4	172.9	0	0	0	0	0	112.1	R461 K462 L463 T467 L563	R461-A465 PolarHBondContact O-N 2.74Å; R461-A465 VanDerWaalsContact O-N 3.12Å; K462-A465 PolarHBondContact O-N 3.4Å; L463-A465 VanDerWaalsContact C-N 3.28Å; L463-A465 PolarHBondContact O-N 2.6Å; A465-T467 VanDerWaalsContact C-N 3.34Å; A465-T467 PolarHBondContact O-N 3.42Å; A465-L563 WeakPolarHBondContact O-CD1 3.33Å
466	L	86.3	Confident	90.4	Very high	48 Å²	48	33 Å²	33	25%	0.251	19%	0.194	S	C	.	.	H	α-helix	trans	-78.2	-11.4	-180	-67.9	173.9	0	0	0	114.9	K462 L463 P468 M496 L546	K462-L466 WeakPolarHBondContact O-CG 3.37Å; K462-L466 PolarHBondContact O-N 2.78Å; L463-L466 PolarHBondContact O-N 3.41Å; L463-L466 VanDerWaalsContact O-N 3.12Å; L466-P468 WeakPolarHBondContact O-CD 3.48Å; L466-M496 HydrophobicContact CD1-CE 3.59Å; L466-L546 HydrophobicContact CD2-CD1 4.07Å; L466-L546 HydrophobicContact CD2-CD2 4.42Å
467	T	89.4	Confident	90.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.198	C	C	.	.			trans	-122.5	55.7	-171.5	52.4	0	0	0	0	113.3	R439 F443 L463 A465 G469 F470 V503	R439-T467 VanDerWaalsContact CD-O 3.25Å; R439-T467 WeakPolarHBondContact CD-O 3.24Å; R439-T467 PolarHBondContact NE-O 2.89Å; F443-T467 WeakPolarHBondContact CE2-OG1 3.35Å; F443-T467 HydrophobicContact CZ-CG2 4.18Å; L463-T467 PolarHBondContact O-N 2.83Å; L463-T467 VanDerWaalsContact O-N 3.17Å; L463-T467 PolarHBondContact O-OG1 3.21Å; A465-T467 VanDerWaalsContact C-N 3.34Å; A465-T467 PolarHBondContact O-N 3.42Å; T467-G469 PolarHBondContact O-N 3.43Å; T467-F470 HydrophobicContact CG2-CD2 3.82Å; T467-F470 HydrophobicContact CG2-CE2 3.74Å; T467-F470 HydrophobicContact CG2-CG 4.31Å; T467-F470 HydrophobicContact CG2-CZ 4.15Å; T467-F470 PolarHBondContact O-N 2.92Å; T467-V503 HydrophobicContact CG2-CB 4.48Å; T467-V503 HydrophobicContact CG2-CG1 3.95Å; T467-V503 HydrophobicContact CG2-CG2 3.64Å
468	P	86.4	Confident	91.3	Very high	27 Å²	27	31.3 Å²	31.3	18%	0.175	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	137.2	179.4	28.9	-35.8	0	0	0	111.5	L466 F470 L563 P564	L466-P468 WeakPolarHBondContact O-CD 3.48Å; P468-F470 VanDerWaalsContact C-N 3.26Å; P468-F470 PolarHBondContact O-N 3.27Å; P468-L563 HydrophobicContact CB-CD1 4.45Å; P468-L563 HydrophobicContact CG-CD1 3.74Å; P468-P564 HydrophobicContact CG-CG 4.21Å
469	G	86.7	Confident	91.7	Very high	59 Å²	59	27.1 Å²	27.1	61%	0.608	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.8	2.3	177.3	0	0	0	0	0	116	T467	T467-G469 PolarHBondContact O-N 3.43Å
470	F	92.9	Very high	92	Very high	24 Å²	24	31.2 Å²	31.2	11%	0.105	19%	0.189	C	C	.	.			trans	-69.5	140.5	179.4	-83.7	36.2	0	0	0	111.7	P434 T467 P468 D474 I475 V478 V503 V506 V507	P434-F470 WeakPolarHBondContact CG-O 3.5Å; T467-F470 HydrophobicContact CG2-CD2 3.82Å; T467-F470 HydrophobicContact CG2-CE2 3.74Å; T467-F470 HydrophobicContact CG2-CG 4.31Å; T467-F470 HydrophobicContact CG2-CZ 4.15Å; T467-F470 PolarHBondContact O-N 2.92Å; P468-F470 VanDerWaalsContact C-N 3.26Å; P468-F470 PolarHBondContact O-N 3.27Å; F470-D474 HydrophobicContact CB-CB 4.14Å; F470-D474 HydrophobicContact CD2-CB 3.79Å; F470-D474 HydrophobicContact CE2-CB 4.48Å; F470-D474 HydrophobicContact CG-CB 4.12Å; F470-I475 HydrophobicContact CB-CG1 4.14Å; F470-V478 HydrophobicContact CD2-CG2 4.18Å; F470-V478 HydrophobicContact CE2-CG2 3.71Å; F470-V503 HydrophobicContact CZ-CG1 4.48Å; F470-V506 HydrophobicContact CE2-CB 4.49Å; F470-V506 HydrophobicContact CE2-CG1 3.93Å; F470-V506 HydrophobicContact CZ-CG1 4.16Å; F470-V507 HydrophobicContact CE1-CG2 3.91Å; F470-V507 HydrophobicContact CZ-CG2 3.53Å
471	T	93.9	Very high	92.1	Very high	20 Å²	20	32.4 Å²	32.4	12%	0.123	19%	0.194	C	C	.	.			trans	-81.7	167.1	172.4	71.8	0	0	0	0	111.3	A473 D474 I475	T471-A473 PolarHBondContact O-N 2.78Å; T471-D474 WeakPolarHBondContact CB-OD2 3.48Å; T471-D474 PolarHBondContact N-OD2 3.42Å; T471-D474 PolarHBondContact O-N 3.06Å; T471-D474 VanDerWaalsContact O-N 3.1Å; T471-D474 PolarHBondContact OG1-N 2.67Å; T471-D474 PolarHBondContact OG1-OD2 3.49Å; T471-I475 WeakPolarHBondContact O-CG1 3.37Å; T471-I475 PolarHBondContact O-N 2.89Å
472	G	93.4	Very high	92.3	Very high	13 Å²	13	30.1 Å²	30.1	13%	0.134	19%	0.186	C	C	.	.	H	α-helix	trans	-58.9	-35	176.2	0	0	0	0	0	113.2	G306 A476	G306-G472 PolarHBondContact O-N 3.25Å; G472-A476 PolarHBondContact O-N 2.91Å
473	A	94.5	Very high	92.6	Very high	47 Å²	47	26.4 Å²	26.4	39%	0.388	17%	0.174	S	C	.	.	H	α-helix	trans	-67.7	-38.5	174.4	0	0	0	0	0	112.8	G306 T471 I475 A476 N477	G306-A473 PolarHBondContact O-N 3.13Å; T471-A473 PolarHBondContact O-N 2.78Å; A473-I475 VanDerWaalsContact C-N 3.35Å; A473-A476 PolarHBondContact O-N 3.43Å; A473-N477 PolarHBondContact O-N 3.45Å
474	D	95.1	Very high	92.7	Very high	59 Å²	59	29.9 Å²	29.9	32%	0.316	19%	0.192	S	C	.	.	H	α-helix	trans	-65.5	-41.2	176.9	-57.4	-45.8	0	0	0	110.9	F470 T471 N477 V478	F470-D474 HydrophobicContact CB-CB 4.14Å; F470-D474 HydrophobicContact CD2-CB 3.79Å; F470-D474 HydrophobicContact CE2-CB 4.48Å; F470-D474 HydrophobicContact CG-CB 4.12Å; T471-D474 WeakPolarHBondContact CB-OD2 3.48Å; T471-D474 PolarHBondContact N-OD2 3.42Å; T471-D474 PolarHBondContact O-N 3.06Å; T471-D474 VanDerWaalsContact O-N 3.1Å; T471-D474 PolarHBondContact OG1-N 2.67Å; T471-D474 PolarHBondContact OG1-OD2 3.49Å; D474-N477 WeakPolarHBondContact O-CB 3.46Å; D474-N477 PolarHBondContact O-N 3.02Å; D474-N477 VanDerWaalsContact O-N 3.17Å; D474-V478 WeakPolarHBondContact O-CG2 3.43Å; D474-V478 PolarHBondContact O-N 3.48Å
475	I	95.7	Very high	92.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.3	-45.1	175.7	-67.2	169.7	0	0	0	111.3	R439 I442 F443 F470 T471 A473 N477 V478 C479	R439-I475 HydrophobicContact CB-CD1 3.85Å; R439-I475 HydrophobicContact CG-CD1 3.71Å; I442-I475 HydrophobicContact CB-CD1 4.18Å; I442-I475 HydrophobicContact CD1-CD1 4.44Å; I442-I475 HydrophobicContact CG2-CB 4.03Å; I442-I475 HydrophobicContact CG2-CD1 4.01Å; I442-I475 HydrophobicContact CG2-CG2 3.73Å; F443-I475 HydrophobicContact CD1-CG2 3.56Å; F443-I475 HydrophobicContact CD2-CD1 4.28Å; F443-I475 HydrophobicContact CD2-CG1 4.45Å; F443-I475 HydrophobicContact CD2-CG2 3.94Å; F443-I475 HydrophobicContact CE1-CB 4.46Å; F443-I475 HydrophobicContact CE1-CG2 3.56Å; F443-I475 HydrophobicContact CE2-CB 4.47Å; F443-I475 HydrophobicContact CE2-CD1 3.98Å; F443-I475 HydrophobicContact CE2-CG1 3.83Å; F443-I475 HydrophobicContact CE2-CG2 3.91Å; F443-I475 HydrophobicContact CG-CG2 3.74Å; F443-I475 HydrophobicContact CZ-CB 4.26Å; F443-I475 HydrophobicContact CZ-CG1 3.9Å; F443-I475 HydrophobicContact CZ-CG2 3.72Å; F470-I475 HydrophobicContact CB-CG1 4.14Å; T471-I475 WeakPolarHBondContact O-CG1 3.37Å; T471-I475 PolarHBondContact O-N 2.89Å; A473-I475 VanDerWaalsContact C-N 3.35Å; I475-N477 PolarHBondContact O-N 3.36Å; I475-V478 PolarHBondContact O-N 2.87Å; I475-C479 PolarHBondContact O-N 3.37Å; I475-C479 PolarHBondContact O-SG 2.95Å
476	A	94.7	Very high	93.2	Very high	32 Å²	32	30.2 Å²	30.2	26%	0.264	19%	0.193	S	C	.	.	H	α-helix	trans	-58.2	-39.2	174.9	0	0	0	0	0	111.5	G472 A473 N480	G472-A476 PolarHBondContact O-N 2.91Å; A473-A476 PolarHBondContact O-N 3.43Å; A476-N480 WeakPolarHBondContact O-CB 3.49Å; A476-N480 PolarHBondContact O-N 2.85Å; A476-N480 VanDerWaalsContact O-N 3.1Å
477	N	95.5	Very high	93.6	Very high	68 Å²	68	30.9 Å²	30.9	36%	0.364	21%	0.206	S	C	.	.	H	α-helix	trans	-67.6	-43.2	176.7	-168.1	34.7	0	0	0	112.4	A473 D474 I475 C479 N480 E481	A473-N477 PolarHBondContact O-N 3.45Å; D474-N477 WeakPolarHBondContact O-CB 3.46Å; D474-N477 PolarHBondContact O-N 3.02Å; D474-N477 VanDerWaalsContact O-N 3.17Å; I475-N477 PolarHBondContact O-N 3.36Å; N477-C479 VanDerWaalsContact C-N 3.35Å; N477-C479 PolarHBondContact O-N 3.48Å; N477-N480 PolarHBondContact O-N 3.33Å; N477-E481 WeakPolarHBondContact O-CB 3.47Å; N477-E481 WeakPolarHBondContact O-CG 3.4Å; N477-E481 PolarHBondContact O-N 2.95Å
478	V	95.4	Very high	93.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57	-47.9	174.9	170.1	0	0	0	0	111	F443 F470 D474 I475 N480 E481 A482 A502 V503 V506	F443-V478 HydrophobicContact CE1-CG1 4.3Å; F470-V478 HydrophobicContact CD2-CG2 4.18Å; F470-V478 HydrophobicContact CE2-CG2 3.71Å; D474-V478 WeakPolarHBondContact O-CG2 3.43Å; D474-V478 PolarHBondContact O-N 3.48Å; I475-V478 PolarHBondContact O-N 2.87Å; V478-N480 VanDerWaalsContact C-N 3.32Å; V478-N480 PolarHBondContact O-N 2.87Å; V478-E481 PolarHBondContact O-N 2.8Å; V478-A482 WeakPolarHBondContact O-CB 3.37Å; V478-A482 PolarHBondContact O-N 3.05Å; V478-A502 HydrophobicContact CG1-CB 4.2Å; V478-A502 WeakPolarHBondContact O-CB 3.35Å; V478-V503 HydrophobicContact CG1-CG2 3.73Å; V478-V503 HydrophobicContact CG2-CG2 4.29Å; V478-V506 HydrophobicContact CG2-CB 4.25Å; V478-V506 HydrophobicContact CG2-CG1 4.47Å; V478-V506 HydrophobicContact CG2-CG2 3.9Å
479	C	95.2	Very high	94	Very high	4 Å²	4	40.5 Å²	40.5	3%	0.027	25%	0.245	C	C	.	.	H	α-helix	trans	-60.9	-41.1	178.3	-72	0	0	0	0	112.2	H446 L450 I475 N477 A483	H446-C479 HydrophobicContact CB-CB 4.15Å; L450-C479 HydrophobicContact CD1-CB 3.94Å; I475-C479 PolarHBondContact O-N 3.37Å; I475-C479 PolarHBondContact O-SG 2.95Å; N477-C479 VanDerWaalsContact C-N 3.35Å; N477-C479 PolarHBondContact O-N 3.48Å; C479-A483 PolarHBondContact O-N 3.33Å
480	N	95.5	Very high	94.3	Very high	90 Å²	90	45.2 Å²	45.2	48%	0.481	26%	0.255	S	S	.	.	H	α-helix	trans	-69.3	-44.9	177.9	-173.6	59.2	0	0	0	112.4	A476 N477 V478 A482 A483 L484	A476-N480 WeakPolarHBondContact O-CB 3.49Å; A476-N480 PolarHBondContact O-N 2.85Å; A476-N480 VanDerWaalsContact O-N 3.1Å; N477-N480 PolarHBondContact O-N 3.33Å; V478-N480 VanDerWaalsContact C-N 3.32Å; V478-N480 PolarHBondContact O-N 2.87Å; N480-A482 VanDerWaalsContact C-N 3.34Å; N480-A482 PolarHBondContact O-N 3.33Å; N480-A483 WeakPolarHBondContact O-CB 3.45Å; N480-A483 PolarHBondContact O-N 3.48Å; N480-L484 WeakPolarHBondContact O-CG 3.34Å; N480-L484 PolarHBondContact O-N 3.14Å
481	E	94.4	Very high	94.2	Very high	29 Å²	29	47.1 Å²	47.1	14%	0.136	27%	0.267	C	S	.	.	H	α-helix	trans	-64.1	-37.9	176.9	-75.1	-66.9	137	0	0	111.8	N477 V478 A483 L484 I485 R488 A502 R505	N477-E481 WeakPolarHBondContact O-CB 3.47Å; N477-E481 WeakPolarHBondContact O-CG 3.4Å; N477-E481 PolarHBondContact O-N 2.95Å; V478-E481 PolarHBondContact O-N 2.8Å; E481-A483 VanDerWaalsContact C-N 3.3Å; E481-A483 PolarHBondContact O-N 3.46Å; E481-L484 PolarHBondContact O-N 2.87Å; E481-I485 WeakPolarHBondContact O-CB 3.42Å; E481-I485 VanDerWaalsContact O-CG1 3.26Å; E481-I485 WeakPolarHBondContact O-CG1 3.4Å; E481-I485 PolarHBondContact O-N 2.87Å; E481-R488 IonicContact OE2-NH2 3.99Å; E481-A502 HydrophobicContact CB-CB 3.92Å; E481-R505 VanDerWaalsContact OE2-CD 3.28Å; E481-R505 WeakPolarHBondContact OE2-CD 3.23Å; E481-R505 IonicContact OE2-CZ 2.68Å; E481-R505 IonicContact OE2-NE 2.65Å; E481-R505 PolarHBondContact OE2-NE 3.17Å
482	A	94.7	Very high	94	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60.8	-40.3	174.9	0	0	0	0	0	111.7	V478 N480 I485 A486 I494 H498 F499 A502	V478-A482 WeakPolarHBondContact O-CB 3.37Å; V478-A482 PolarHBondContact O-N 3.05Å; N480-A482 VanDerWaalsContact C-N 3.34Å; N480-A482 PolarHBondContact O-N 3.33Å; A482-I485 PolarHBondContact O-N 3.16Å; A482-A486 WeakPolarHBondContact O-CB 3.38Å; A482-A486 PolarHBondContact O-N 3.43Å; A482-I494 HydrophobicContact CB-CG2 4.09Å; A482-H498 HydrophobicContact CB-CB 4.46Å; A482-F499 HydrophobicContact CB-CD1 3.5Å; A482-F499 VanDerWaalsContact CB-CD1 3.5Å; A482-F499 HydrophobicContact CB-CE1 3.67Å; A482-F499 HydrophobicContact CB-CG 3.96Å; A482-F499 HydrophobicContact CB-CZ 4.26Å; A482-A502 HydrophobicContact CB-CB 3.93Å
483	A	94.6	Very high	94	Very high	25 Å²	25	58.7 Å²	58.7	21%	0.207	32%	0.315	C	S	.	.	H	α-helix	trans	-65.8	-41.6	174.2	0	0	0	0	0	112	L450 C479 N480 E481 A486 A487 I494	L450-A483 HydrophobicContact CD2-CB 4.18Å; C479-A483 PolarHBondContact O-N 3.33Å; N480-A483 WeakPolarHBondContact O-CB 3.45Å; N480-A483 PolarHBondContact O-N 3.48Å; E481-A483 VanDerWaalsContact C-N 3.3Å; E481-A483 PolarHBondContact O-N 3.46Å; A483-A486 PolarHBondContact O-N 2.74Å; A483-A487 WeakPolarHBondContact O-CB 3.36Å; A483-A487 PolarHBondContact O-N 2.75Å; A483-I494 HydrophobicContact CB-CD1 3.69Å
484	L	94.5	Very high	93.9	Very high	72 Å²	72	57 Å²	57	38%	0.377	30%	0.299	S	S	.	.	H	α-helix	trans	-65.6	-37.8	176.6	-69	175.1	0	0	0	112.6	N480 E481 A487 R488	N480-L484 WeakPolarHBondContact O-CG 3.34Å; N480-L484 PolarHBondContact O-N 3.14Å; E481-L484 PolarHBondContact O-N 2.87Å; L484-A487 PolarHBondContact O-N 3.4Å; L484-R488 VanDerWaalsContact O-CG 3.3Å; L484-R488 WeakPolarHBondContact O-CG 3.19Å; L484-R488 PolarHBondContact O-N 3.03Å
485	I	93.3	Very high	93.8	Very high	13 Å²	13	58.5 Å²	58.5	7%	0.067	30%	0.304	C	S	.	.	H	α-helix	trans	-66.1	-48.1	175.7	-69.7	165.8	0	0	0	109.9	E481 A482 A487 R488 D489 H498 Q501 A502	E481-I485 WeakPolarHBondContact O-CB 3.42Å; E481-I485 VanDerWaalsContact O-CG1 3.26Å; E481-I485 WeakPolarHBondContact O-CG1 3.4Å; E481-I485 PolarHBondContact O-N 2.87Å; A482-I485 PolarHBondContact O-N 3.16Å; I485-A487 VanDerWaalsContact C-N 3.26Å; I485-A487 PolarHBondContact O-N 2.77Å; I485-R488 WeakPolarHBondContact O-CB 3.36Å; I485-R488 PolarHBondContact O-N 2.82Å; I485-D489 PolarHBondContact O-N 2.85Å; I485-D489 VanDerWaalsContact O-N 3.07Å; I485-H498 HydrophobicContact CB-CB 4.47Å; I485-H498 HydrophobicContact CG2-CB 4.17Å; I485-Q501 HydrophobicContact CD1-CB 3.95Å; I485-Q501 VanDerWaalsContact CG2-OE1 3.32Å; I485-A502 HydrophobicContact CD1-CB 4.15Å
486	A	94.4	Very high	93.5	Very high	4 Å²	4	60.9 Å²	60.9	3%	0.033	32%	0.316	C	S	.	.	H	α-helix	trans	-56.7	-41.8	175.9	0	0	0	0	0	111.9	A482 A483 D489 L490 N491 I494 H498	A482-A486 WeakPolarHBondContact O-CB 3.38Å; A482-A486 PolarHBondContact O-N 3.43Å; A483-A486 PolarHBondContact O-N 2.74Å; A486-D489 PolarHBondContact O-N 2.86Å; A486-L490 PolarHBondContact O-N 3.4Å; A486-N491 PolarHBondContact O-N 3.41Å; A486-I494 HydrophobicContact CB-CB 4.42Å; A486-I494 HydrophobicContact CB-CG1 3.94Å; A486-I494 HydrophobicContact CB-CG2 4.45Å; A486-H498 WeakPolarHBondContact CB-ND1 3.49Å
487	A	95.1	Very high	93.3	Very high	63 Å²	63	65.1 Å²	65.1	52%	0.521	33%	0.328	S	S	.	.	H	α-helix	trans	-66.5	-35	177	0	0	0	0	0	113	A483 L484 I485 D489 L490	A483-A487 WeakPolarHBondContact O-CB 3.36Å; A483-A487 PolarHBondContact O-N 2.75Å; L484-A487 PolarHBondContact O-N 3.4Å; I485-A487 VanDerWaalsContact C-N 3.26Å; I485-A487 PolarHBondContact O-N 2.77Å; A487-D489 VanDerWaalsContact C-N 3.35Å; A487-L490 PolarHBondContact O-N 3.09Å
488	R	93.2	Very high	93.2	Very high	143 Å²	143	62 Å²	62	54%	0.54	31%	0.311	S	S	.	.	H	α-helix	trans	-66.7	-37.2	175	-74.5	174.8	-145	169.5	10	112.1	E481 L484 I485 L490	E481-R488 IonicContact OE2-NH2 3.99Å; L484-R488 VanDerWaalsContact O-CG 3.3Å; L484-R488 WeakPolarHBondContact O-CG 3.19Å; L484-R488 PolarHBondContact O-N 3.03Å; I485-R488 WeakPolarHBondContact O-CB 3.36Å; I485-R488 PolarHBondContact O-N 2.82Å; R488-L490 PolarHBondContact O-N 2.97Å
489	D	91.8	Very high	93.1	Very high	86 Å²	86	62 Å²	62	46%	0.46	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	3.7	178.2	-67	-12.5	0	0	0	112.6	I485 A486 A487 N491	I485-D489 PolarHBondContact O-N 2.85Å; I485-D489 VanDerWaalsContact O-N 3.07Å; A486-D489 PolarHBondContact O-N 2.86Å; A487-D489 VanDerWaalsContact C-N 3.35Å; D489-N491 PolarHBondContact O-N 3.39Å
490	L	92.5	Very high	92.8	Very high	157 Å²	157	65.8 Å²	65.8	82%	0.822	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	31.8	-176.8	-60.8	171.1	0	0	0	113.4	A486 A487 R488	A486-L490 PolarHBondContact O-N 3.4Å; A487-L490 PolarHBondContact O-N 3.09Å; R488-L490 PolarHBondContact O-N 2.97Å
491	N	90.7	Very high	92.5	Very high	65 Å²	65	64.6 Å²	64.6	35%	0.348	32%	0.32	S	S	.	.			trans	-82.2	134	176.9	-74	-27.9	0	0	0	110.8	A486 D489 K493 H498	A486-N491 PolarHBondContact O-N 3.41Å; D489-N491 PolarHBondContact O-N 3.39Å; N491-K493 VanDerWaalsContact C-N 3.29Å; N491-K493 PolarHBondContact O-N 2.93Å; N491-H498 PolarHBondContact ND2-CE1 2.92Å; N491-H498 PolarHBondContact ND2-NE2 3.44Å
492	E	90	Very high	92.5	Very high	188 Å²	188	63.2 Å²	63.2	88%	0.879	31%	0.314	S	S	*	.	S	Bend	trans	-68.4	-28.7	178.8	-64.5	-173.9	170.2	0	0	112.9
493	K	92.3	Very high	92.3	Very high	88 Å²	88	63.4 Å²	63.4	38%	0.383	32%	0.315	S	S	.	.	S	Bend	trans	-133.1	150.6	-178.7	-62.9	179.9	-170.8	172.7	0	111.4	A451 E453 N491 Q495	A451-K493 WeakPolarHBondContact O-CA 3.42Å; E453-K493 HydrophobicContact CB-CB 4.07Å; E453-K493 HydrophobicContact CB-CD 3.84Å; E453-K493 VanDerWaalsContact CD-CD 3.4Å; E453-K493 HydrophobicContact CG-CD 3.94Å; E453-K493 WeakPolarHBondContact OE1-CD 3.39Å; E453-K493 IonicContact OE1-NZ 3.73Å; E453-K493 PolarHBondContact OE1-NZ 2.83Å; E453-K493 WeakPolarHBondContact OE2-CD 3.47Å; N491-K493 VanDerWaalsContact C-N 3.29Å; N491-K493 PolarHBondContact O-N 2.93Å; K493-Q495 PolarHBondContact O-N 3.15Å
494	I	93.8	Very high	91.9	Very high	10 Å²	10	63 Å²	63	5%	0.051	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-80.8	119.8	178.1	-48.9	172.1	0	0	0	109.3	L450 A451 A452 E453 A482 A483 A486 H498 F499	L450-I494 HydrophobicContact CB-CD1 4.09Å; L450-I494 HydrophobicContact CD1-CD1 4.11Å; L450-I494 HydrophobicContact CD2-CD1 4.3Å; L450-I494 HydrophobicContact CG-CD1 4.4Å; A451-I494 PolarHBondContact O-N 3.01Å; A452-I494 WeakPolarHBondContact CA-O 3.15Å; A452-I494 HydrophobicContact CB-CB 4.29Å; E453-I494 PolarHBondContact N-O 3.21Å; A482-I494 HydrophobicContact CB-CG2 4.09Å; A483-I494 HydrophobicContact CB-CD1 3.69Å; A486-I494 HydrophobicContact CB-CB 4.42Å; A486-I494 HydrophobicContact CB-CG1 3.94Å; A486-I494 HydrophobicContact CB-CG2 4.45Å; I494-H498 HydrophobicContact CG2-CB 3.95Å; I494-F499 HydrophobicContact CB-CE2 4.18Å; I494-F499 HydrophobicContact CG2-CD2 3.92Å; I494-F499 HydrophobicContact CG2-CE2 3.39Å; I494-F499 HydrophobicContact CG2-CZ 3.77Å
495	Q	91.9	Very high	91.6	Very high	91 Å²	91	62.9 Å²	62.9	43%	0.425	30%	0.303	S	S	.	.			trans	-96.1	164.5	176.2	-61.3	178.8	-3.2	0	0	111.5	K493 K497 H498 F499	K493-Q495 PolarHBondContact O-N 3.15Å; Q495-K497 VanDerWaalsContact C-N 3.26Å; Q495-K497 PolarHBondContact O-N 2.93Å; Q495-H498 PolarHBondContact N-ND1 2.87Å; Q495-H498 VanDerWaalsContact N-ND1 3.1Å; Q495-H498 WeakPolarHBondContact O-CB 3.41Å; Q495-H498 PolarHBondContact O-N 3.44Å; Q495-F499 WeakPolarHBondContact O-CD2 3.08Å
496	M	89.9	Confident	91.4	Very high	50 Å²	50	64.1 Å²	64.1	25%	0.246	31%	0.312	C	S	.	.	H	α-helix	trans	-55	-40.2	177.9	-174.3	62.5	-177.6	0	0	112.8	L459 L463 L466 H498 F499 E500	L459-M496 HydrophobicContact CD1-SD 3.54Å; L459-M496 VanDerWaalsContact CD1-SD 3.54Å; L463-M496 HydrophobicContact CD2-CE 4.03Å; L463-M496 HydrophobicContact CD2-SD 4.16Å; L466-M496 HydrophobicContact CD1-CE 3.59Å; M496-H498 PolarHBondContact O-N 2.95Å; M496-F499 WeakPolarHBondContact O-CA 3.41Å; M496-F499 WeakPolarHBondContact O-CB 3.32Å; M496-F499 PolarHBondContact O-N 3.2Å; M496-E500 HydrophobicContact CE-CG 4.13Å; M496-E500 HydrophobicContact CG-CG 4.42Å; M496-E500 PolarHBondContact O-N 2.67Å
497	K	90.3	Very high	91	Very high	122 Å²	122	68 Å²	68	53%	0.53	34%	0.335	S	S	.	.	H	α-helix	trans	-53.6	-38.2	176.9	-175.8	-176.2	176.7	-171.3	0	112.8	Q495 Q501	Q495-K497 VanDerWaalsContact C-N 3.26Å; Q495-K497 PolarHBondContact O-N 2.93Å; K497-Q501 WeakPolarHBondContact O-CB 3.38Å; K497-Q501 VanDerWaalsContact O-CG 3.31Å; K497-Q501 WeakPolarHBondContact O-CG 3.35Å; K497-Q501 PolarHBondContact O-N 3.46Å
498	H	93.6	Very high	90.4	Very high	2 Å²	2	66.3 Å²	66.3	1%	0.009	32%	0.321	C	S	.	.	H	α-helix	trans	-70.1	-35.4	178.6	-50.4	143.9	0	0	0	111.6	A482 I485 A486 N491 I494 Q495 M496 A502	A482-H498 HydrophobicContact CB-CB 4.46Å; I485-H498 HydrophobicContact CB-CB 4.47Å; I485-H498 HydrophobicContact CG2-CB 4.17Å; A486-H498 WeakPolarHBondContact CB-ND1 3.49Å; N491-H498 PolarHBondContact ND2-CE1 2.92Å; N491-H498 PolarHBondContact ND2-NE2 3.44Å; I494-H498 HydrophobicContact CG2-CB 3.95Å; Q495-H498 PolarHBondContact N-ND1 2.87Å; Q495-H498 VanDerWaalsContact N-ND1 3.1Å; Q495-H498 WeakPolarHBondContact O-CB 3.41Å; Q495-H498 PolarHBondContact O-N 3.44Å; M496-H498 PolarHBondContact O-N 2.95Å; H498-A502 VanDerWaalsContact O-CB 3.3Å; H498-A502 WeakPolarHBondContact O-CB 3.47Å; H498-A502 PolarHBondContact O-N 3Å
499	F	93	Very high	90	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.3	-43	174.9	-72.7	-77.5	0	0	0	111.7	L447 A452 L459 L463 A482 I494 Q495 M496 Q501 A502 V503	L447-F499 HydrophobicContact CD2-CE1 3.7Å; L447-F499 HydrophobicContact CD2-CE2 4.44Å; L447-F499 HydrophobicContact CD2-CZ 3.43Å; L447-F499 VanDerWaalsContact CD2-CZ 3.43Å; A452-F499 HydrophobicContact CB-CE2 4.31Å; A452-F499 HydrophobicContact CB-CZ 4.48Å; L459-F499 HydrophobicContact CD1-CD2 4.41Å; L459-F499 HydrophobicContact CD2-CD2 4.26Å; L459-F499 HydrophobicContact CD2-CE2 3.7Å; L459-F499 HydrophobicContact CD2-CZ 4.09Å; L463-F499 HydrophobicContact CD1-CB 4.39Å; L463-F499 HydrophobicContact CD1-CD1 3.67Å; L463-F499 HydrophobicContact CD1-CE1 4.02Å; L463-F499 HydrophobicContact CD1-CG 3.96Å; L463-F499 HydrophobicContact CD2-CB 3.63Å; L463-F499 HydrophobicContact CD2-CD1 4.39Å; L463-F499 HydrophobicContact CD2-CG 4.11Å; A482-F499 HydrophobicContact CB-CD1 3.5Å; A482-F499 VanDerWaalsContact CB-CD1 3.5Å; A482-F499 HydrophobicContact CB-CE1 3.67Å; A482-F499 HydrophobicContact CB-CG 3.96Å; A482-F499 HydrophobicContact CB-CZ 4.26Å; I494-F499 HydrophobicContact CB-CE2 4.18Å; I494-F499 HydrophobicContact CG2-CD2 3.92Å; I494-F499 HydrophobicContact CG2-CE2 3.39Å; I494-F499 HydrophobicContact CG2-CZ 3.77Å; Q495-F499 WeakPolarHBondContact O-CD2 3.08Å; M496-F499 WeakPolarHBondContact O-CA 3.41Å; M496-F499 WeakPolarHBondContact O-CB 3.32Å; M496-F499 PolarHBondContact O-N 3.2Å; F499-Q501 VanDerWaalsContact C-N 3.35Å; F499-Q501 PolarHBondContact O-N 3.3Å; F499-A502 WeakPolarHBondContact O-CB 3.31Å; F499-A502 PolarHBondContact O-N 3.48Å; F499-A502 VanDerWaalsContact O-N 3.15Å; F499-V503 WeakPolarHBondContact O-CG2 3.4Å; F499-V503 PolarHBondContact O-N 3.42Å
500	E	89.8	Confident	89.6	Confident	84 Å²	84	62.4 Å²	62.4	39%	0.393	31%	0.313	S	S	.	.	H	α-helix	trans	-59	-46.8	175.5	-69.3	172.4	-180	0	0	111.2	M496 A502 V503 E504	M496-E500 HydrophobicContact CE-CG 4.13Å; M496-E500 HydrophobicContact CG-CG 4.42Å; M496-E500 PolarHBondContact O-N 2.67Å; E500-A502 VanDerWaalsContact C-N 3.31Å; E500-A502 PolarHBondContact O-N 3.26Å; E500-V503 PolarHBondContact O-N 3.22Å; E500-E504 WeakPolarHBondContact O-CG 3.31Å; E500-E504 PolarHBondContact O-N 2.9Å
501	Q	89.4	Confident	89.2	Confident	65 Å²	65	58.5 Å²	58.5	30%	0.304	29%	0.291	S	S	.	.	H	α-helix	trans	-62.9	-36.1	175.1	-72.3	179.1	-18.3	0	0	112.8	I485 K497 F499 R505	I485-Q501 HydrophobicContact CD1-CB 3.95Å; I485-Q501 VanDerWaalsContact CG2-OE1 3.32Å; K497-Q501 WeakPolarHBondContact O-CB 3.38Å; K497-Q501 VanDerWaalsContact O-CG 3.31Å; K497-Q501 WeakPolarHBondContact O-CG 3.35Å; K497-Q501 PolarHBondContact O-N 3.46Å; F499-Q501 VanDerWaalsContact C-N 3.35Å; F499-Q501 PolarHBondContact O-N 3.3Å; Q501-R505 VanDerWaalsContact O-CB 3.25Å; Q501-R505 WeakPolarHBondContact O-CB 3.4Å; Q501-R505 PolarHBondContact O-N 3.37Å
502	A	93	Very high	88.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.3	-44.4	175.6	0	0	0	0	0	111.6	V478 E481 A482 I485 H498 F499 E500 R505 V506	V478-A502 HydrophobicContact CG1-CB 4.2Å; V478-A502 WeakPolarHBondContact O-CB 3.35Å; E481-A502 HydrophobicContact CB-CB 3.92Å; A482-A502 HydrophobicContact CB-CB 3.93Å; I485-A502 HydrophobicContact CD1-CB 4.15Å; H498-A502 VanDerWaalsContact O-CB 3.3Å; H498-A502 WeakPolarHBondContact O-CB 3.47Å; H498-A502 PolarHBondContact O-N 3Å; F499-A502 WeakPolarHBondContact O-CB 3.31Å; F499-A502 PolarHBondContact O-N 3.48Å; F499-A502 VanDerWaalsContact O-N 3.15Å; E500-A502 VanDerWaalsContact C-N 3.31Å; E500-A502 PolarHBondContact O-N 3.26Å; A502-R505 PolarHBondContact O-N 3.04Å; A502-V506 WeakPolarHBondContact O-CG2 3.4Å; A502-V506 PolarHBondContact O-N 3.36Å
503	V	90.5	Very high	88.3	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.024	28%	0.284	C	S	.	.	H	α-helix	trans	-58.9	-49.4	174.7	172.4	0	0	0	0	109.9	T467 F470 V478 F499 E500 R505 V506 V507	T467-V503 HydrophobicContact CG2-CB 4.48Å; T467-V503 HydrophobicContact CG2-CG1 3.95Å; T467-V503 HydrophobicContact CG2-CG2 3.64Å; F470-V503 HydrophobicContact CZ-CG1 4.48Å; V478-V503 HydrophobicContact CG1-CG2 3.73Å; V478-V503 HydrophobicContact CG2-CG2 4.29Å; F499-V503 WeakPolarHBondContact O-CG2 3.4Å; F499-V503 PolarHBondContact O-N 3.42Å; E500-V503 PolarHBondContact O-N 3.22Å; V503-R505 VanDerWaalsContact C-N 3.29Å; V503-R505 PolarHBondContact O-N 2.88Å; V503-V506 PolarHBondContact O-N 3.08Å; V503-V506 VanDerWaalsContact O-N 3.13Å; V503-V507 HydrophobicContact CG1-CG2 4.28Å; V503-V507 WeakPolarHBondContact O-CG2 3.37Å; V503-V507 PolarHBondContact O-N 3.04Å
504	E	86.8	Confident	87.8	Confident	15 Å²	15	60.6 Å²	60.6	7%	0.07	31%	0.306	C	S	.	.	H	α-helix	trans	-57.6	-42.6	176.6	-76.3	176.3	-154.6	0	0	112.6	E500 V506 V507 A508 K547 R553 Y559	E500-E504 WeakPolarHBondContact O-CG 3.31Å; E500-E504 PolarHBondContact O-N 2.9Å; E504-V506 VanDerWaalsContact C-N 3.31Å; E504-V506 PolarHBondContact O-N 3.41Å; E504-V507 PolarHBondContact O-N 3.36Å; E504-A508 WeakPolarHBondContact O-CB 3.48Å; E504-A508 PolarHBondContact O-N 3.05Å; E504-K547 WeakPolarHBondContact OE1-CD 3.3Å; E504-K547 WeakPolarHBondContact OE1-CE 3.32Å; E504-K547 IonicContact OE1-NZ 2.69Å; E504-K547 PolarHBondContact OE1-NZ 3.18Å; E504-R553 IonicContact OE2-CZ 2.75Å; E504-R553 IonicContact OE2-NE 2.68Å; E504-R553 IonicContact OE2-NH2 3.11Å; E504-R553 PolarHBondContact OE2-NH2 3.42Å; E504-Y559 PolarHBondContact OE2-OH 2.96Å
505	R	88.4	Confident	87.1	Confident	70 Å²	70	63.8 Å²	63.8	26%	0.264	32%	0.321	S	S	.	.	H	α-helix	trans	-64.5	-36.7	178.6	-179.3	176.4	177	75.3	9.7	112	E481 Q501 A502 V503 G509 M510	E481-R505 VanDerWaalsContact OE2-CD 3.28Å; E481-R505 WeakPolarHBondContact OE2-CD 3.23Å; E481-R505 IonicContact OE2-CZ 2.68Å; E481-R505 IonicContact OE2-NE 2.65Å; E481-R505 PolarHBondContact OE2-NE 3.17Å; Q501-R505 VanDerWaalsContact O-CB 3.25Å; Q501-R505 WeakPolarHBondContact O-CB 3.4Å; Q501-R505 PolarHBondContact O-N 3.37Å; A502-R505 PolarHBondContact O-N 3.04Å; V503-R505 VanDerWaalsContact C-N 3.29Å; V503-R505 PolarHBondContact O-N 2.88Å; R505-G509 CarbonylContact O-C 3.53Å; R505-G509 WeakPolarHBondContact O-CA 3.42Å; R505-G509 PolarHBondContact O-N 3.02Å; R505-M510 PolarHBondContact NH2-SD 3.34Å; R505-M510 VanDerWaalsContact NH2-SD 3.39Å
506	V	88.9	Confident	86.4	Confident	40 Å²	40	65.2 Å²	65.2	24%	0.242	34%	0.335	C	S	.	.	H	α-helix	trans	-73.1	-40.5	177.2	173	0	0	0	0	111.3	F470 V478 A502 V503 E504	F470-V506 HydrophobicContact CE2-CB 4.49Å; F470-V506 HydrophobicContact CE2-CG1 3.93Å; F470-V506 HydrophobicContact CZ-CG1 4.16Å; V478-V506 HydrophobicContact CG2-CB 4.25Å; V478-V506 HydrophobicContact CG2-CG1 4.47Å; V478-V506 HydrophobicContact CG2-CG2 3.9Å; A502-V506 WeakPolarHBondContact O-CG2 3.4Å; A502-V506 PolarHBondContact O-N 3.36Å; V503-V506 PolarHBondContact O-N 3.08Å; V503-V506 VanDerWaalsContact O-N 3.13Å; E504-V506 VanDerWaalsContact C-N 3.31Å; E504-V506 PolarHBondContact O-N 3.41Å
507	V	86.2	Confident	86.1	Confident	86 Å²	86	64.2 Å²	64.2	52%	0.521	33%	0.331	S	S	.	.	H	α-helix	trans	-74.3	-54.2	-179.5	178.2	0	0	0	0	112.5	F470 V503 E504	F470-V507 HydrophobicContact CE1-CG2 3.91Å; F470-V507 HydrophobicContact CZ-CG2 3.53Å; V503-V507 HydrophobicContact CG1-CG2 4.28Å; V503-V507 WeakPolarHBondContact O-CG2 3.37Å; V503-V507 PolarHBondContact O-N 3.04Å; E504-V507 PolarHBondContact O-N 3.36Å
508	A	82.6	Confident	86.1	Confident	27 Å²	27	64.7 Å²	64.7	22%	0.223	34%	0.335	C	S	.	.	H	α-helix	trans	-101.4	-11.1	-169.5	0	0	0	0	0	113.2	E504 R553 Y559	E504-A508 WeakPolarHBondContact O-CB 3.48Å; E504-A508 PolarHBondContact O-N 3.05Å; A508-R553 HydrophobicContact CB-CB 4.01Å; A508-R553 VanDerWaalsContact CB-CD 3.5Å; A508-R553 HydrophobicContact CB-CG 4.42Å; A508-Y559 HydrophobicContact CB-CD2 4.46Å
509	G	85.7	Confident	86	Confident	24 Å²	24	70.7 Å²	70.7	25%	0.247	37%	0.366	C	S	.	.			trans	86.1	-166.3	-177.2	0	0	0	0	0	113.6	R505 R553	R505-G509 CarbonylContact O-C 3.53Å; R505-G509 WeakPolarHBondContact O-CA 3.42Å; R505-G509 PolarHBondContact O-N 3.02Å; G509-R553 PolarHBondContact O-NH1 3.5Å
510	M	82.6	Confident	85.9	Confident	122 Å²	122	77.3 Å²	77.3	60%	0.601	40%	0.397	S	S	*	.			trans	-70.1	136.5	-175.9	-55	-161.1	-72.7	0	0	111.9	R505 G554	R505-M510 PolarHBondContact NH2-SD 3.34Å; R505-M510 VanDerWaalsContact NH2-SD 3.39Å; M510-G554 PolarHBondContact O-N 3.25Å
511	E	84.2	Confident	86	Confident	76 Å²	76	77.9 Å²	77.9	36%	0.355	40%	0.4	S	S	.	.	B	Isolated β-bridge	trans	-68.3	127.6	171.1	-167.3	-166.8	147.4	0	0	110.7	K513 I551	E511-K513 HydrophobicContact CG-CG 4.37Å; E511-K513 PolarHBondContact O-N 3.46Å; E511-K513 WeakPolarHBondContact OE1-CE 3.24Å; E511-K513 WeakPolarHBondContact OE1-CG 3.5Å; E511-I551 HydrophobicContact CG-CG2 3.55Å
512	K	84.5	Confident	86.1	Confident	81 Å²	81	77 Å²	77	35%	0.352	40%	0.395	S	S	.	.			trans	-97.9	81.3	-179.2	-70.6	-179.4	172.5	171.4	0	111.3	T514 Q515 P552 G554	K512-T514 PolarHBondContact O-N 2.97Å; K512-Q515 HydrophobicContact CB-CB 4.03Å; K512-Q515 HydrophobicContact CD-CB 4.44Å; K512-Q515 PolarHBondContact O-N 3.27Å; K512-P552 HydrophobicContact CB-CB 4.46Å; K512-P552 HydrophobicContact CB-CG 4.39Å; K512-P552 PolarHBondContact N-O 2.95Å; K512-G554 WeakPolarHBondContact CE-O 3.41Å; K512-G554 PolarHBondContact NZ-O 3.07Å
513	K	77.4	Confident	86.2	Confident	168 Å²	168	78.6 Å²	78.6	73%	0.73	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.8	177.9	-63.6	-173.3	177.3	-174.7	0	114.3	E511	E511-K513 HydrophobicContact CG-CG 4.37Å; E511-K513 PolarHBondContact O-N 3.46Å; E511-K513 WeakPolarHBondContact OE1-CE 3.24Å; E511-K513 WeakPolarHBondContact OE1-CG 3.5Å
514	T	80.4	Confident	86.4	Confident	135 Å²	135	79.3 Å²	79.3	83%	0.828	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-18.8	-179.1	50.9	0	0	0	0	113.8	K512 V516	K512-T514 PolarHBondContact O-N 2.97Å; T514-V516 PolarHBondContact O-N 3.37Å; T514-V516 VanDerWaalsContact O-N 3.14Å
515	Q	79.5	Confident	86.8	Confident	78 Å²	78	79.4 Å²	79.4	36%	0.364	41%	0.411	S	S	.	.			trans	-85	88.9	-179.4	-172.9	171.6	1.3	0	0	109	K512 L517 P552	K512-Q515 HydrophobicContact CB-CB 4.03Å; K512-Q515 HydrophobicContact CD-CB 4.44Å; K512-Q515 PolarHBondContact O-N 3.27Å; Q515-L517 PolarHBondContact O-N 2.94Å; Q515-P552 HydrophobicContact CB-CG 4.49Å
516	V	77.5	Confident	87.1	Confident	121 Å²	121	76 Å²	76	73%	0.733	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-81.1	117.5	176.8	-173.3	0	0	0	0	108.9	T514	T514-V516 PolarHBondContact O-N 3.37Å; T514-V516 VanDerWaalsContact O-N 3.14Å
517	L	84.8	Confident	87.4	Confident	29 Å²	29	75.5 Å²	75.5	15%	0.152	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-79.1	145.3	171.8	-68.1	174	0	0	0	110.4	Q515 E521 K522 L557	Q515-L517 PolarHBondContact O-N 2.94Å; L517-E521 HydrophobicContact CB-CB 4.35Å; L517-E521 HydrophobicContact CD2-CB 4.45Å; L517-K522 HydrophobicContact CB-CB 4.39Å; L517-L557 HydrophobicContact CD1-CB 4.3Å; L517-L557 HydrophobicContact CD1-CD2 4.44Å; L517-L557 HydrophobicContact CD2-CD1 4.2Å; L517-L557 HydrophobicContact CD2-CD2 3.95Å
518	Q	90.1	Very high	87.8	Confident	131 Å²	131	72 Å²	72	61%	0.612	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-64.8	154.6	170.4	-62.3	-59	-43.1	0	0	110	E520 E521 K522	Q518-E520 VanDerWaalsContact C-N 3.26Å; Q518-E520 PolarHBondContact O-N 3.22Å; Q518-E521 HydrophobicContact CB-CB 4.45Å; Q518-E521 HydrophobicContact CB-CG 4.13Å; Q518-E521 PolarHBondContact N-OE2 3.15Å; Q518-E521 WeakPolarHBondContact O-CB 3.37Å; Q518-E521 PolarHBondContact O-N 2.92Å; Q518-K522 WeakPolarHBondContact O-CB 3.23Å; Q518-K522 PolarHBondContact O-N 3.42Å
519	L	90.5	Very high	88.4	Confident	129 Å²	129	71.6 Å²	71.6	68%	0.675	36%	0.363	S	S	*	.	H	α-helix	trans	-59.2	-38.2	-177.7	-175.7	62.3	0	0	0	112.2	K522 T523	L519-K522 PolarHBondContact O-N 3.18Å; L519-T523 WeakPolarHBondContact O-CB 3.12Å; L519-T523 PolarHBondContact O-N 3.36Å; L519-T523 PolarHBondContact O-OG1 2.83Å
520	E	91.6	Very high	88.9	Confident	138 Å²	138	70.4 Å²	70.4	65%	0.645	35%	0.351	S	S	*	.	H	α-helix	trans	-65.2	-39.8	175.9	-64.8	-169.9	-175.1	0	0	112.6	Q518 T523 T524	Q518-E520 VanDerWaalsContact C-N 3.26Å; Q518-E520 PolarHBondContact O-N 3.22Å; E520-T523 PolarHBondContact O-N 3.46Å; E520-T524 PolarHBondContact O-N 2.71Å; E520-T524 PolarHBondContact O-OG1 3.19Å
521	E	91.6	Very high	89.5	Confident	97 Å²	97	64.6 Å²	64.6	45%	0.453	32%	0.323	S	S	.	.	H	α-helix	trans	-67.5	-47.2	176	-64.5	175.3	149	0	0	110.4	L517 Q518 T523 T524 V525	L517-E521 HydrophobicContact CB-CB 4.35Å; L517-E521 HydrophobicContact CD2-CB 4.45Å; Q518-E521 HydrophobicContact CB-CB 4.45Å; Q518-E521 HydrophobicContact CB-CG 4.13Å; Q518-E521 PolarHBondContact N-OE2 3.15Å; Q518-E521 WeakPolarHBondContact O-CB 3.37Å; Q518-E521 PolarHBondContact O-N 2.92Å; E521-T523 VanDerWaalsContact C-N 3.26Å; E521-T523 PolarHBondContact O-N 3.23Å; E521-T524 WeakPolarHBondContact O-CB 3.17Å; E521-T524 PolarHBondContact O-N 3.04Å; E521-T524 VanDerWaalsContact O-N 3.08Å; E521-V525 WeakPolarHBondContact O-CG2 3.22Å; E521-V525 PolarHBondContact O-N 3.19Å
522	K	92.3	Very high	89.9	Confident	47 Å²	47	61.5 Å²	61.5	20%	0.204	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-40.2	176.2	-167.2	-179.6	-173.3	179.2	0	111.3	L517 Q518 L519 A526 I550 L669 E672	L517-K522 HydrophobicContact CB-CB 4.39Å; Q518-K522 WeakPolarHBondContact O-CB 3.23Å; Q518-K522 PolarHBondContact O-N 3.42Å; L519-K522 PolarHBondContact O-N 3.18Å; K522-A526 WeakPolarHBondContact O-CB 3.38Å; K522-A526 PolarHBondContact O-N 2.97Å; K522-I550 HydrophobicContact CD-CD1 4.31Å; K522-I550 VanDerWaalsContact CE-CD1 3.44Å; K522-I550 HydrophobicContact CG-CD1 3.92Å; K522-L669 HydrophobicContact CD-CD2 4.35Å; K522-L669 HydrophobicContact CG-CD2 3.95Å; K522-E672 IonicContact NZ-OE1 2.69Å; K522-E672 PolarHBondContact NZ-OE1 2.95Å
523	T	94.6	Very high	90.4	Very high	33 Å²	33	57.7 Å²	57.7	20%	0.202	29%	0.291	C	S	.	.	H	α-helix	trans	-64.5	-46.8	174.4	-55.4	0	0	0	0	110.9	L519 E520 E521 V525 A526 Y527 F593 L669	L519-T523 WeakPolarHBondContact O-CB 3.12Å; L519-T523 PolarHBondContact O-N 3.36Å; L519-T523 PolarHBondContact O-OG1 2.83Å; E520-T523 PolarHBondContact O-N 3.46Å; E521-T523 VanDerWaalsContact C-N 3.26Å; E521-T523 PolarHBondContact O-N 3.23Å; T523-V525 VanDerWaalsContact C-N 3.34Å; T523-V525 PolarHBondContact O-N 3.48Å; T523-A526 PolarHBondContact O-N 3.17Å; T523-Y527 HydrophobicContact CG2-CD2 3.9Å; T523-Y527 HydrophobicContact CG2-CE2 3.83Å; T523-Y527 WeakPolarHBondContact O-CD2 3.37Å; T523-Y527 PolarHBondContact O-N 3.47Å; T523-F593 HydrophobicContact CG2-CE1 4.28Å; T523-F593 HydrophobicContact CG2-CZ 4.13Å; T523-L669 HydrophobicContact CG2-CD1 4.3Å
524	T	94.3	Very high	91.2	Very high	19 Å²	19	49.7 Å²	49.7	12%	0.117	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-46	177.8	-53.5	0	0	0	0	111.3	E520 E521 A526 Y527 H528 E589 F593	E520-T524 PolarHBondContact O-N 2.71Å; E520-T524 PolarHBondContact O-OG1 3.19Å; E521-T524 WeakPolarHBondContact O-CB 3.17Å; E521-T524 PolarHBondContact O-N 3.04Å; E521-T524 VanDerWaalsContact O-N 3.08Å; T524-A526 PolarHBondContact O-N 3.4Å; T524-Y527 PolarHBondContact O-N 2.93Å; T524-H528 WeakPolarHBondContact O-CB 3.31Å; T524-H528 PolarHBondContact O-N 2.8Å; T524-E589 HydrophobicContact CG2-CG 4.22Å; T524-F593 HydrophobicContact CG2-CD2 4.44Å; T524-F593 HydrophobicContact CG2-CE2 4.13Å
525	V	94.2	Very high	91.9	Very high	16 Å²	16	43.3 Å²	43.3	10%	0.097	22%	0.218	C	C	.	.	H	α-helix	trans	-62.7	-42.1	176.4	175.8	0	0	0	0	111.4	E521 T523 Y527 H528 E529 I550 L557	E521-V525 WeakPolarHBondContact O-CG2 3.22Å; E521-V525 PolarHBondContact O-N 3.19Å; T523-V525 VanDerWaalsContact C-N 3.34Å; T523-V525 PolarHBondContact O-N 3.48Å; V525-Y527 PolarHBondContact O-N 3.28Å; V525-H528 WeakPolarHBondContact O-CB 3.42Å; V525-H528 PolarHBondContact O-N 3.05Å; V525-E529 HydrophobicContact CG1-CG 4.2Å; V525-E529 WeakPolarHBondContact O-CG 3.33Å; V525-E529 PolarHBondContact O-N 2.92Å; V525-I550 HydrophobicContact CG1-CB 4.23Å; V525-I550 HydrophobicContact CG1-CG2 4.14Å; V525-L557 HydrophobicContact CG1-CB 4.4Å; V525-L557 HydrophobicContact CG2-CB 3.86Å; V525-L557 HydrophobicContact CG2-CD1 4.2Å
526	A	95.3	Very high	92.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.7	-42	178	0	0	0	0	0	113	K522 T523 T524 A530 I550 L668 L669	K522-A526 WeakPolarHBondContact O-CB 3.38Å; K522-A526 PolarHBondContact O-N 2.97Å; T523-A526 PolarHBondContact O-N 3.17Å; T524-A526 PolarHBondContact O-N 3.4Å; A526-A530 WeakPolarHBondContact O-CB 3.41Å; A526-A530 PolarHBondContact O-N 2.89Å; A526-I550 HydrophobicContact CB-CD1 4.48Å; A526-I550 HydrophobicContact CB-CG2 4.07Å; A526-L668 HydrophobicContact CB-CB 4.29Å; A526-L669 HydrophobicContact CB-CD1 4.47Å; A526-L669 HydrophobicContact CB-CD2 3.75Å; A526-L669 HydrophobicContact CB-CG 3.8Å
527	Y	96	Very high	93.3	Very high	28 Å²	28	34 Å²	34	11%	0.11	17%	0.166	C	C	.	.	H	α-helix	trans	-70.6	-33.1	175	-83.5	-89	0	0	0	112.5	T523 T524 V525 G531 S588 F592 F593 V661 A665	T523-Y527 HydrophobicContact CG2-CD2 3.9Å; T523-Y527 HydrophobicContact CG2-CE2 3.83Å; T523-Y527 WeakPolarHBondContact O-CD2 3.37Å; T523-Y527 PolarHBondContact O-N 3.47Å; T524-Y527 PolarHBondContact O-N 2.93Å; V525-Y527 PolarHBondContact O-N 3.28Å; Y527-G531 PolarHBondContact O-N 2.94Å; Y527-S588 VanDerWaalsContact O-CB 3.29Å; Y527-S588 WeakPolarHBondContact O-CB 3.33Å; Y527-S588 PolarHBondContact O-OG 3.5Å; Y527-F592 HydrophobicContact CD1-CB 4.02Å; Y527-F592 AromaticContact CD1-CD1 3.96Å; Y527-F592 HydrophobicContact CD1-CD1 3.96Å; Y527-F592 AromaticContact CD1-CD2 3.62Å; Y527-F592 HydrophobicContact CD1-CD2 3.62Å; Y527-F592 HydrophobicContact CD1-CE1 4.32Å; Y527-F592 HydrophobicContact CD1-CE2 4.03Å; Y527-F592 AromaticContact CD1-CG 3.59Å; Y527-F592 HydrophobicContact CD1-CG 3.59Å; Y527-F592 HydrophobicContact CD1-CZ 4.34Å; Y527-F592 HydrophobicContact CE1-CB 4.25Å; Y527-F592 AromaticContact CE1-CD1 3.5Å; Y527-F592 HydrophobicContact CE1-CD1 3.5Å; Y527-F592 HydrophobicContact CE1-CD2 4.01Å; Y527-F592 AromaticContact CE1-CE1 3.72Å; Y527-F592 HydrophobicContact CE1-CE1 3.72Å; Y527-F592 HydrophobicContact CE1-CE2 4.23Å; Y527-F592 AromaticContact CE1-CG 3.66Å; Y527-F592 HydrophobicContact CE1-CG 3.66Å; Y527-F592 HydrophobicContact CE1-CZ 4.08Å; Y527-F593 HydrophobicContact CD2-CE1 4.47Å; Y527-F593 HydrophobicContact CD2-CE2 4.27Å; Y527-F593 AromaticContact CD2-CZ 3.61Å; Y527-F593 HydrophobicContact CD2-CZ 3.61Å; Y527-F593 HydrophobicContact CE2-CZ 4.31Å; Y527-F593 HydrophobicContact CG-CE2 4.13Å; Y527-F593 AromaticContact CG-CZ 3.92Å; Y527-F593 HydrophobicContact CG-CZ 3.92Å; Y527-V661 HydrophobicContact CD1-CG1 4.38Å; Y527-A665 HydrophobicContact CD1-CB 3.88Å; Y527-A665 HydrophobicContact CD2-CB 3.96Å; Y527-A665 HydrophobicContact CE1-CB 3.92Å; Y527-A665 HydrophobicContact CE2-CB 4.02Å; Y527-A665 HydrophobicContact CG-CB 3.91Å
528	H	95.1	Very high	93.7	Very high	14 Å²	14	34.9 Å²	34.9	7%	0.065	17%	0.169	C	C	.	.	H	α-helix	trans	-62.7	-53.8	173.7	-172.5	103.7	0	0	0	111.3	T524 V525 A530 G531 H532 G585 E589 D603	T524-H528 WeakPolarHBondContact O-CB 3.31Å; T524-H528 PolarHBondContact O-N 2.8Å; V525-H528 WeakPolarHBondContact O-CB 3.42Å; V525-H528 PolarHBondContact O-N 3.05Å; H528-A530 PolarHBondContact O-N 2.85Å; H528-G531 WeakPolarHBondContact O-CA 3.39Å; H528-G531 PolarHBondContact O-N 3.46Å; H528-G531 VanDerWaalsContact O-N 3.09Å; H528-H532 AromaticContact CD2-CD2 3.6Å; H528-H532 AromaticContact CD2-NE2 3.51Å; H528-H532 AromaticContact NE2-CD2 3.77Å; H528-H532 AromaticContact NE2-NE2 3.15Å; H528-H532 PolarHBondContact NE2-NE2 3.41Å; H528-H532 VanDerWaalsContact NE2-NE2 3.15Å; H528-H532 PolarHBondContact O-CD2 2.95Å; H528-H532 PolarHBondContact O-N 2.95Å; H528-G585 WeakPolarHBondContact O-CA 3.45Å; H528-E589 HydrophobicContact CB-CG 4.31Å; H528-E589 IonicContact CE1-OE1 3.58Å; H528-E589 IonicContact CG-OE1 3.31Å; H528-E589 IonicContact ND1-OE1 3.88Å; H528-E589 PolarHBondContact ND1-OE1 3.35Å; H528-D603 IonicContact CE1-OD2 2.91Å; H528-D603 IonicContact NE2-OD2 2.62Å; H528-D603 PolarHBondContact NE2-OD2 2.95Å
529	E	94.5	Very high	93.9	Very high	17 Å²	17	28.8 Å²	28.8	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-65.7	-37.5	179.4	-63.9	-58.4	156.4	0	0	112.3	V525 G531 H532 A533 V548 I550 G558 Y559 A560 L668	V525-E529 HydrophobicContact CG1-CG 4.2Å; V525-E529 WeakPolarHBondContact O-CG 3.33Å; V525-E529 PolarHBondContact O-N 2.92Å; E529-G531 VanDerWaalsContact C-N 3.27Å; E529-G531 PolarHBondContact O-N 3.13Å; E529-H532 PolarHBondContact O-N 3.33Å; E529-A533 WeakPolarHBondContact O-CB 3.25Å; E529-A533 PolarHBondContact O-N 3.26Å; E529-V548 HydrophobicContact CB-CG1 3.77Å; E529-I550 HydrophobicContact CG-CG2 4.32Å; E529-G558 WeakPolarHBondContact OE1-CA 3.44Å; E529-Y559 PolarHBondContact OE1-N 3.36Å; E529-A560 PolarHBondContact OE2-N 3.39Å; E529-L668 HydrophobicContact CB-CD1 4.38Å
530	A	95.6	Very high	93.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.1	-35.5	172.7	0	0	0	0	0	112	A526 H528 A533 V534 V661 V664 A665 L668	A526-A530 WeakPolarHBondContact O-CB 3.41Å; A526-A530 PolarHBondContact O-N 2.89Å; H528-A530 PolarHBondContact O-N 2.85Å; A530-A533 PolarHBondContact O-N 2.96Å; A530-V534 WeakPolarHBondContact O-CB 3.12Å; A530-V534 WeakPolarHBondContact O-CG2 3.34Å; A530-V534 PolarHBondContact O-N 3.39Å; A530-V661 HydrophobicContact CB-CG1 3.89Å; A530-V664 HydrophobicContact CB-CB 4.13Å; A530-V664 HydrophobicContact CB-CG1 3.84Å; A530-A665 HydrophobicContact CB-CB 3.9Å; A530-L668 HydrophobicContact CB-CD1 4.31Å
531	G	94.9	Very high	93.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.9	-46.6	175	0	0	0	0	0	112.4	Y527 H528 E529 T535	Y527-G531 PolarHBondContact O-N 2.94Å; H528-G531 WeakPolarHBondContact O-CA 3.39Å; H528-G531 PolarHBondContact O-N 3.46Å; H528-G531 VanDerWaalsContact O-N 3.09Å; E529-G531 VanDerWaalsContact C-N 3.27Å; E529-G531 PolarHBondContact O-N 3.13Å; G531-T535 WeakPolarHBondContact O-CB 3.46Å; G531-T535 VanDerWaalsContact O-CG2 3.22Å; G531-T535 WeakPolarHBondContact O-CG2 3.3Å; G531-T535 PolarHBondContact O-N 3.11Å; G531-T535 PolarHBondContact O-OG1 3.4Å
532	H	94.3	Very high	93.8	Very high	11 Å²	11	18.7 Å²	18.7	5%	0.051	9%	0.09	C	C	.	.	H	α-helix	trans	-61.6	-46.8	172.7	-71.6	-63.9	0	0	0	112.2	H528 E529 T535 G536 Y562 M581 T582 D603	H528-H532 AromaticContact CD2-CD2 3.6Å; H528-H532 AromaticContact CD2-NE2 3.51Å; H528-H532 AromaticContact NE2-CD2 3.77Å; H528-H532 AromaticContact NE2-NE2 3.15Å; H528-H532 PolarHBondContact NE2-NE2 3.41Å; H528-H532 VanDerWaalsContact NE2-NE2 3.15Å; H528-H532 PolarHBondContact O-CD2 2.95Å; H528-H532 PolarHBondContact O-N 2.95Å; E529-H532 PolarHBondContact O-N 3.33Å; H532-T535 PolarHBondContact O-OG1 2.84Å; H532-T535 VanDerWaalsContact O-OG1 3.04Å; H532-G536 PolarHBondContact O-N 3.15Å; H532-Y562 WeakPolarHBondContact CB-OH 3.45Å; H532-Y562 PolarHBondContact O-OH 3.24Å; H532-M581 PolarHBondContact ND1-O 3.29Å; H532-T582 PolarHBondContact CE1-O 2.63Å; H532-D603 IonicContact CE1-OD2 2.71Å; H532-D603 IonicContact NE2-OD2 3.71Å
533	A	94.2	Very high	93.6	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-61.9	-49.2	-176.2	0	0	0	0	0	112.8	E529 A530 G536 W537 L545 V548	E529-A533 WeakPolarHBondContact O-CB 3.25Å; E529-A533 PolarHBondContact O-N 3.26Å; A530-A533 PolarHBondContact O-N 2.96Å; A533-G536 PolarHBondContact O-N 2.93Å; A533-W537 WeakPolarHBondContact O-CB 3.26Å; A533-W537 PolarHBondContact O-N 3.46Å; A533-L545 HydrophobicContact CB-CD2 3.59Å; A533-V548 HydrophobicContact CB-CG2 3.74Å
534	V	94.9	Very high	93.2	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.006	8%	0.077	C	C	.	.	H	α-helix	trans	-69.3	-43.3	-177.8	173	0	0	0	0	111.3	A530 G536 W537 F538 H657 V661 V664 L683	A530-V534 WeakPolarHBondContact O-CB 3.12Å; A530-V534 WeakPolarHBondContact O-CG2 3.34Å; A530-V534 PolarHBondContact O-N 3.39Å; V534-G536 PolarHBondContact O-N 3.34Å; V534-W537 WeakPolarHBondContact O-CB 3.49Å; V534-W537 PolarHBondContact O-N 3.19Å; V534-F538 HydrophobicContact CG1-CD2 3.83Å; V534-F538 HydrophobicContact CG1-CE2 3.91Å; V534-F538 VanDerWaalsContact O-CD2 3.31Å; V534-F538 WeakPolarHBondContact O-CD2 3.48Å; V534-F538 PolarHBondContact O-N 3.18Å; V534-H657 HydrophobicContact CG1-CB 3.87Å; V534-V661 HydrophobicContact CB-CG2 3.78Å; V534-V661 HydrophobicContact CG1-CG2 3.78Å; V534-V661 HydrophobicContact CG2-CB 4.41Å; V534-V661 HydrophobicContact CG2-CG2 3.82Å; V534-V664 HydrophobicContact CG2-CG2 4.17Å; V534-L683 HydrophobicContact CG2-CD1 4.13Å; V534-L683 HydrophobicContact CG2-CD2 4.36Å
535	T	94.2	Very high	92.9	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.006	7%	0.072	C	C	.	.	H	α-helix	trans	-62.3	-44.1	176.2	53.8	0	0	0	0	111.1	G531 H532 W537 F538 L539 T650 M653 V654	G531-T535 WeakPolarHBondContact O-CB 3.46Å; G531-T535 VanDerWaalsContact O-CG2 3.22Å; G531-T535 WeakPolarHBondContact O-CG2 3.3Å; G531-T535 PolarHBondContact O-N 3.11Å; G531-T535 PolarHBondContact O-OG1 3.4Å; H532-T535 PolarHBondContact O-OG1 2.84Å; H532-T535 VanDerWaalsContact O-OG1 3.04Å; T535-W537 VanDerWaalsContact C-N 3.29Å; T535-W537 PolarHBondContact O-N 3.06Å; T535-F538 PolarHBondContact O-N 3.47Å; T535-L539 WeakPolarHBondContact O-CB 3.43Å; T535-L539 VanDerWaalsContact O-CD1 3.26Å; T535-L539 WeakPolarHBondContact O-CD1 3.37Å; T535-L539 WeakPolarHBondContact O-CG 3.36Å; T535-L539 PolarHBondContact O-N 3.29Å; T535-T650 HydrophobicContact CG2-CG2 3.95Å; T535-M653 HydrophobicContact CG2-SD 4.47Å; T535-V654 HydrophobicContact CG2-CG2 3.49Å; T535-V654 VanDerWaalsContact CG2-CG2 3.49Å
536	G	93.2	Very high	92.4	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.01	8%	0.075	C	C	.	.	H	α-helix	trans	-60.3	-35.3	174.1	0	0	0	0	0	113.7	H532 A533 V534 A542 R686	H532-G536 PolarHBondContact O-N 3.15Å; A533-G536 PolarHBondContact O-N 2.93Å; V534-G536 PolarHBondContact O-N 3.34Å; G536-A542 WeakPolarHBondContact O-CB 3.44Å; G536-R686 PolarHBondContact O-NH2 2.88Å
537	W	93.3	Very high	92.1	Very high	2 Å²	2	18 Å²	18	1%	0.008	9%	0.085	C	C	.	.	H	α-helix	trans	-65	-46.8	178.8	-160.6	-103.3	0	0	0	112.5	A533 V534 T535 R676 L679 I680 L683 G684 R686	A533-W537 WeakPolarHBondContact O-CB 3.26Å; A533-W537 PolarHBondContact O-N 3.46Å; V534-W537 WeakPolarHBondContact O-CB 3.49Å; V534-W537 PolarHBondContact O-N 3.19Å; T535-W537 VanDerWaalsContact C-N 3.29Å; T535-W537 PolarHBondContact O-N 3.06Å; W537-R676 HydrophobicContact CH2-CG 4.15Å; W537-R676 HydrophobicContact CZ3-CG 4.25Å; W537-L679 HydrophobicContact CH2-CB 4.39Å; W537-L679 HydrophobicContact CZ3-CB 4.27Å; W537-I680 HydrophobicContact CH2-CD1 4.44Å; W537-I680 HydrophobicContact CH2-CG1 3.62Å; W537-I680 HydrophobicContact CZ2-CG1 3.75Å; W537-L683 HydrophobicContact CB-CD1 4.25Å; W537-L683 HydrophobicContact CD2-CD1 4.36Å; W537-L683 HydrophobicContact CG-CD1 3.94Å; W537-G684 WeakPolarHBondContact CZ2-O 3.46Å; W537-G684 PolarHBondContact NE1-O 3.41Å; W537-R686 HydrophobicContact CD2-CB 4.4Å; W537-R686 HydrophobicContact CD2-CG 4.46Å; W537-R686 HydrophobicContact CZ2-CB 3.96Å; W537-R686 VanDerWaalsContact O-CG 3.27Å; W537-R686 WeakPolarHBondContact O-CG 3.41Å; W537-R686 PolarHBondContact O-NE 2.83Å; W537-R686 VanDerWaalsContact O-NE 3.09Å
538	F	93.7	Very high	91.9	Very high	48 Å²	48	16.7 Å²	16.7	21%	0.211	8%	0.08	C	C	.	.	H	α-helix	trans	-89.8	-2.2	-174.6	-68.8	-72.8	0	0	0	114.9	V534 T535 H657 P687 F688	V534-F538 HydrophobicContact CG1-CD2 3.83Å; V534-F538 HydrophobicContact CG1-CE2 3.91Å; V534-F538 VanDerWaalsContact O-CD2 3.31Å; V534-F538 WeakPolarHBondContact O-CD2 3.48Å; V534-F538 PolarHBondContact O-N 3.18Å; T535-F538 PolarHBondContact O-N 3.47Å; F538-H657 AromaticContact CD1-CD2 3.99Å; F538-H657 AromaticContact CD1-NE2 3.65Å; F538-H657 HydrophobicContact CD2-CB 4.43Å; F538-H657 AromaticContact CD2-CD2 3.54Å; F538-H657 AromaticContact CD2-CG 3.86Å; F538-H657 AromaticContact CD2-NE2 3.92Å; F538-H657 AromaticContact CE1-CD2 3.82Å; F538-H657 AromaticContact CE1-NE2 3.79Å; F538-H657 HydrophobicContact CE2-CB 4.32Å; F538-H657 AromaticContact CE2-CD2 3.37Å; F538-H657 WeakPolarHBondContact CE2-CD2 3.49Å; F538-H657 AromaticContact CE2-CG 3.93Å; F538-H657 AromaticContact CG-CD2 3.87Å; F538-H657 AromaticContact CG-NE2 3.73Å; F538-H657 AromaticContact CZ-CD2 3.52Å; F538-H657 AromaticContact CZ-NE2 4Å; F538-P687 HydrophobicContact CD1-CG 4.17Å; F538-F688 WeakPolarHBondContact O-CE2 3.44Å
539	L	93.5	Very high	91.7	Very high	2 Å²	2	16 Å²	16	1%	0.01	8%	0.076	C	C	.	.			trans	-89.7	130.6	173.5	-75.4	167.3	0	0	0	110.9	T535 H541 A542 H577 C580 M581 F649 M653 R686	T535-L539 WeakPolarHBondContact O-CB 3.43Å; T535-L539 VanDerWaalsContact O-CD1 3.26Å; T535-L539 WeakPolarHBondContact O-CD1 3.37Å; T535-L539 WeakPolarHBondContact O-CG 3.36Å; T535-L539 PolarHBondContact O-N 3.29Å; L539-H541 PolarHBondContact O-N 3.22Å; L539-A542 HydrophobicContact CB-CB 3.65Å; L539-A542 HydrophobicContact CD1-CB 4.37Å; L539-H577 HydrophobicContact CD1-CB 4.49Å; L539-H577 WeakPolarHBondContact CD1-O 3.47Å; L539-H577 HydrophobicContact CD2-CB 4.24Å; L539-C580 HydrophobicContact CD1-CB 3.96Å; L539-C580 HydrophobicContact CD2-CB 4.43Å; L539-M581 HydrophobicContact CD1-CB 3.99Å; L539-F649 HydrophobicContact CD2-CE1 3.9Å; L539-M653 HydrophobicContact CD2-CE 3.74Å; L539-M653 HydrophobicContact CD2-SD 4.08Å; L539-M653 HydrophobicContact CG-CE 4.16Å; L539-M653 HydrophobicContact CG-SD 3.95Å; L539-R686 PolarHBondContact O-NH2 2.99Å
540	E	91.4	Very high	91.6	Very high	97 Å²	97	15.5 Å²	15.5	45%	0.453	7%	0.074	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-44	-177.4	-177.6	-179.5	166.6	0	0	113.7	F688	E540-F688 HydrophobicContact CB-CD1 3.82Å; E540-F688 HydrophobicContact CB-CD2 4.18Å; E540-F688 HydrophobicContact CB-CE1 3.69Å; E540-F688 HydrophobicContact CB-CE2 4.07Å; E540-F688 HydrophobicContact CB-CG 4.05Å; E540-F688 HydrophobicContact CB-CZ 3.83Å; E540-F688 HydrophobicContact CG-CD1 3.6Å; E540-F688 HydrophobicContact CG-CE1 3.85Å; E540-F688 HydrophobicContact CG-CG 4.04Å; E540-F688 HydrophobicContact CG-CZ 4.48Å
541	H	91.1	Very high	91.2	Very high	53 Å²	53	16.8 Å²	16.8	25%	0.245	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	1.9	-173.1	-55	-41.6	0	0	0	113.9	L539 Q574 H577	L539-H541 PolarHBondContact O-N 3.22Å; H541-Q574 HydrophobicContact CB-CB 4.27Å; H541-Q574 HydrophobicContact CB-CG 3.86Å; H541-H577 HydrophobicContact CB-CB 4.19Å; H541-H577 WeakPolarHBondContact CB-ND1 3.41Å; H541-H577 AromaticContact CD2-CE1 3.68Å; H541-H577 AromaticContact CD2-ND1 3.41Å; H541-H577 PolarHBondContact CD2-ND1 3.39Å; H541-H577 AromaticContact CG-ND1 3.61Å; H541-H577 PolarHBondContact N-ND1 3.1Å
542	A	89.5	Confident	90.9	Very high	3 Å²	3	17.4 Å²	17.4	3%	0.025	8%	0.084	C	C	.	.	S	Bend	trans	-67.6	147.5	174.6	0	0	0	0	0	111.2	G536 L539 R686	G536-A542 WeakPolarHBondContact O-CB 3.44Å; L539-A542 HydrophobicContact CB-CB 3.65Å; L539-A542 HydrophobicContact CD1-CB 4.37Å; A542-R686 PolarHBondContact O-NH1 2.98Å; A542-R686 PolarHBondContact O-NH2 3.27Å
543	D	88.1	Confident	90.5	Very high	13 Å²	13	17.9 Å²	17.9	7%	0.07	9%	0.086	C	C	.	.	P	Polyproline II helix	trans	-60.5	135.9	175.4	-66.2	-42.8	0	0	0	110	L545 Y562 K565	D543-L545 PolarHBondContact O-N 2.96Å; D543-Y562 HydrophobicContact CB-CD1 4.37Å; D543-Y562 HydrophobicContact CB-CG 4.46Å; D543-Y562 WeakPolarHBondContact O-CD1 3.29Å; D543-K565 PolarHBondContact OD1-N 2.94Å
544	P	86.2	Confident	89.8	Confident	8 Å²	8	19.3 Å²	19.3	5%	0.052	10%	0.1	C	C	.	.	P	Polyproline II helix	trans	-55.2	137.2	175.9	-26.7	34.2	0	0	0	112.4	Y562 L563 E690	P544-Y562 CarbonylContact O-C 3.57Å; P544-Y562 WeakPolarHBondContact O-CA 3.43Å; P544-L563 HydrophobicContact CB-CB 4.39Å; P544-L563 WeakPolarHBondContact CD-O 3.38Å; P544-L563 PolarHBondContact O-N 2.89Å; P544-E690 WeakPolarHBondContact CB-OE1 3.36Å; P544-E690 HydrophobicContact CG-CG 4.37Å
545	L	88.5	Confident	89.1	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.01	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	126	179.5	-178	65.9	0	0	0	110.1	A533 D543 V548 A560 Y562 L679	A533-L545 HydrophobicContact CB-CD2 3.59Å; D543-L545 PolarHBondContact O-N 2.96Å; L545-V548 HydrophobicContact CD1-CG2 3.79Å; L545-V548 HydrophobicContact CD2-CG2 3.63Å; L545-V548 HydrophobicContact CG-CG2 4.02Å; L545-A560 HydrophobicContact CD1-CB 4.09Å; L545-Y562 HydrophobicContact CB-CD1 4.29Å; L545-Y562 HydrophobicContact CB-CE1 4.23Å; L545-Y562 HydrophobicContact CD1-CD1 3.95Å; L545-Y562 HydrophobicContact CD1-CE1 3.64Å; L545-Y562 HydrophobicContact CG-CE1 4.46Å; L545-L679 HydrophobicContact CD2-CD1 3.34Å; L545-L679 HydrophobicContact CG-CD1 4.04Å
546	L	83.9	Confident	88.5	Confident	33 Å²	33	30.9 Å²	30.9	17%	0.173	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-46.4	177.7	-66.5	175.9	0	0	0	111.5	L466 Q561 L563 R676	L466-L546 HydrophobicContact CD2-CD1 4.07Å; L466-L546 HydrophobicContact CD2-CD2 4.42Å; L546-Q561 HydrophobicContact CD1-CG 4.41Å; L546-Q561 PolarHBondContact N-O 3.36Å; L546-L563 HydrophobicContact CD1-CB 4.02Å; L546-L563 HydrophobicContact CD1-CD1 4.16Å; L546-L563 HydrophobicContact CD2-CB 4.33Å; L546-L563 HydrophobicContact CG-CB 4.02Å; L546-R676 PolarHBondContact O-N 3.27Å; L546-R676 VanDerWaalsContact O-N 3.11Å
547	K	87.3	Confident	88.1	Confident	45 Å²	45	34.1 Å²	34.1	20%	0.196	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	146.1	-169.5	-167.1	172.1	-174.5	168.2	0	111.4	E504 Q561 V673 L674	E504-K547 WeakPolarHBondContact OE1-CD 3.3Å; E504-K547 WeakPolarHBondContact OE1-CE 3.32Å; E504-K547 IonicContact OE1-NZ 2.69Å; E504-K547 PolarHBondContact OE1-NZ 3.18Å; K547-Q561 HydrophobicContact CB-CB 4.31Å; K547-Q561 PolarHBondContact N-O 3.02Å; K547-Q561 PolarHBondContact O-N 3.39Å; K547-V673 HydrophobicContact CD-CG1 4.17Å; K547-V673 HydrophobicContact CG-CG1 4.12Å; K547-L674 WeakPolarHBondContact CA-O 3.41Å; K547-L674 WeakPolarHBondContact CG-O 3.48Å
548	V	92.3	Very high	87.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.1	174.3	-175	0	0	0	0	108.7	E529 A533 L545 A560 L668 V673 L674 L679	E529-V548 HydrophobicContact CB-CG1 3.77Å; A533-V548 HydrophobicContact CB-CG2 3.74Å; L545-V548 HydrophobicContact CD1-CG2 3.79Å; L545-V548 HydrophobicContact CD2-CG2 3.63Å; L545-V548 HydrophobicContact CG-CG2 4.02Å; V548-A560 HydrophobicContact CG2-CB 4.45Å; V548-L668 HydrophobicContact CB-CD2 4.27Å; V548-L668 HydrophobicContact CG1-CD1 3.92Å; V548-L668 HydrophobicContact CG1-CD2 3.97Å; V548-V673 CarbonylContact O-C 3.57Å; V548-V673 WeakPolarHBondContact O-CA 3.48Å; V548-L674 PolarHBondContact N-O 3.06Å; V548-L674 PolarHBondContact O-N 3.01Å; V548-L679 HydrophobicContact CG2-CD1 4.4Å
549	S	91.3	Very high	87.3	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	144.2	178.8	-177.3	0	0	0	0	112.5	I551 G558 Y559 E672 V673	S549-I551 WeakPolarHBondContact OG-CB 3.17Å; S549-I551 WeakPolarHBondContact OG-CG1 3.33Å; S549-I551 PolarHBondContact OG-N 3.43Å; S549-I551 VanDerWaalsContact OG-N 3.14Å; S549-G558 CarbonylContact O-C 3.54Å; S549-G558 VanDerWaalsContact O-CA 3.3Å; S549-G558 WeakPolarHBondContact O-CA 3.15Å; S549-Y559 PolarHBondContact N-O 3.2Å; S549-Y559 PolarHBondContact O-N 3.39Å; S549-E672 VanDerWaalsContact CA-O 3.32Å; S549-E672 WeakPolarHBondContact CA-O 3.08Å; S549-E672 PolarHBondContact OG-O 3.37Å; S549-V673 WeakPolarHBondContact OG-CG2 3.22Å
550	I	91.7	Very high	87	Confident	5 Å²	5	35 Å²	35	3%	0.026	19%	0.188	C	C	.	.			trans	-104.1	16.9	172.5	60.4	168.2	0	0	0	112.2	K522 V525 A526 E529 L557 L668 L669 E672	K522-I550 HydrophobicContact CD-CD1 4.31Å; K522-I550 VanDerWaalsContact CE-CD1 3.44Å; K522-I550 HydrophobicContact CG-CD1 3.92Å; V525-I550 HydrophobicContact CG1-CB 4.23Å; V525-I550 HydrophobicContact CG1-CG2 4.14Å; A526-I550 HydrophobicContact CB-CD1 4.48Å; A526-I550 HydrophobicContact CB-CG2 4.07Å; E529-I550 HydrophobicContact CG-CG2 4.32Å; I550-L557 CarbonylContact C-O 3.54Å; I550-L668 WeakPolarHBondContact CD1-O 3.48Å; I550-L668 HydrophobicContact CG2-CB 4.27Å; I550-L668 HydrophobicContact CG2-CD1 4.36Å; I550-L668 HydrophobicContact CG2-CD2 4.39Å; I550-L669 HydrophobicContact CD1-CD2 4.26Å; I550-E672 HydrophobicContact CG1-CB 4.09Å; I550-E672 WeakPolarHBondContact CG1-O 3.47Å; I550-E672 PolarHBondContact N-O 3.48Å
551	I	88.6	Confident	86.7	Confident	27 Å²	27	31.7 Å²	31.7	14%	0.138	17%	0.172	C	C	.	.	S	Bend	trans	-85.2	125.6	177.9	-59	173.9	0	0	0	108.5	E511 S549 R553 E672 V673	E511-I551 HydrophobicContact CG-CG2 3.55Å; S549-I551 WeakPolarHBondContact OG-CB 3.17Å; S549-I551 WeakPolarHBondContact OG-CG1 3.33Å; S549-I551 PolarHBondContact OG-N 3.43Å; S549-I551 VanDerWaalsContact OG-N 3.14Å; I551-R553 PolarHBondContact O-N 3.1Å; I551-E672 HydrophobicContact CD1-CB 4.22Å; I551-E672 HydrophobicContact CG1-CB 3.92Å; I551-V673 HydrophobicContact CD1-CG2 3.58Å; I551-V673 HydrophobicContact CG1-CG2 4.32Å
552	P	88.2	Confident	86.4	Confident	13 Å²	13	31.2 Å²	31.2	8%	0.084	17%	0.169	C	C	.	.			trans	-64.6	124.9	-178.4	24.7	-33.1	0	0	0	111.3	K512 Q515	K512-P552 HydrophobicContact CB-CB 4.46Å; K512-P552 HydrophobicContact CB-CG 4.39Å; K512-P552 PolarHBondContact N-O 2.95Å; Q515-P552 HydrophobicContact CB-CG 4.49Å
553	R	84.7	Confident	86.1	Confident	22 Å²	22	31.4 Å²	31.4	8%	0.083	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-131.6	133.4	177.7	-69.6	-166.8	177.8	-97.3	3.1	110.5	E504 A508 G509 I551 K555 G556 Y559	E504-R553 IonicContact OE2-CZ 2.75Å; E504-R553 IonicContact OE2-NE 2.68Å; E504-R553 IonicContact OE2-NH2 3.11Å; E504-R553 PolarHBondContact OE2-NH2 3.42Å; A508-R553 HydrophobicContact CB-CB 4.01Å; A508-R553 VanDerWaalsContact CB-CD 3.5Å; A508-R553 HydrophobicContact CB-CG 4.42Å; G509-R553 PolarHBondContact O-NH1 3.5Å; I551-R553 PolarHBondContact O-N 3.1Å; R553-K555 PolarHBondContact O-N 3.47Å; R553-G556 PolarHBondContact N-O 3.48Å; R553-G556 VanDerWaalsContact N-O 3.13Å; R553-G556 PolarHBondContact O-N 3.13Å; R553-Y559 VanDerWaalsContact CD-CE1 3.44Å; R553-Y559 HydrophobicContact CG-CD1 4.38Å; R553-Y559 HydrophobicContact CG-CE1 3.98Å; R553-Y559 PolarHBondContact NE-OH 3.39Å
554	G	80.6	Confident	85.7	Confident	29 Å²	29	33.2 Å²	33.2	30%	0.299	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	-115.6	177.6	0	0	0	0	0	112.5	M510 K512	M510-G554 PolarHBondContact O-N 3.25Å; K512-G554 WeakPolarHBondContact CE-O 3.41Å; K512-G554 PolarHBondContact NZ-O 3.07Å
555	K	80.6	Confident	85.2	Confident	214 Å²	214	35.9 Å²	35.9	93%	0.93	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-16.3	177.1	-66.2	-176.2	-179.1	179.9	0	114	R553	R553-K555 PolarHBondContact O-N 3.47Å
556	G	80.8	Confident	84.4	Confident	32 Å²	32	40.2 Å²	40.2	33%	0.33	21%	0.213	S	C	.	.	B	Isolated β-bridge	trans	-91.1	151.9	-176.7	0	0	0	0	0	113.2	R553	R553-G556 PolarHBondContact N-O 3.48Å; R553-G556 VanDerWaalsContact N-O 3.13Å; R553-G556 PolarHBondContact O-N 3.13Å
557	L	85.2	Confident	84	Confident	68 Å²	68	41.3 Å²	41.3	36%	0.356	22%	0.217	S	C	.	.	S	Bend	trans	-90.4	-22.3	173.9	-61.4	-175.5	0	0	0	112.8	L517 V525 I550	L517-L557 HydrophobicContact CD1-CB 4.3Å; L517-L557 HydrophobicContact CD1-CD2 4.44Å; L517-L557 HydrophobicContact CD2-CD1 4.2Å; L517-L557 HydrophobicContact CD2-CD2 3.95Å; V525-L557 HydrophobicContact CG1-CB 4.4Å; V525-L557 HydrophobicContact CG2-CB 3.86Å; V525-L557 HydrophobicContact CG2-CD1 4.2Å; I550-L557 CarbonylContact C-O 3.54Å
558	G	85	Confident	83.4	Confident	14 Å²	14	48.8 Å²	48.8	14%	0.144	25%	0.245	C	C	.	.			trans	-147.4	172	171.7	0	0	0	0	0	109.3	E529 S549	E529-G558 WeakPolarHBondContact OE1-CA 3.44Å; S549-G558 CarbonylContact O-C 3.54Å; S549-G558 VanDerWaalsContact O-CA 3.3Å; S549-G558 WeakPolarHBondContact O-CA 3.15Å
559	Y	85.7	Confident	83	Confident	34 Å²	34	55.9 Å²	55.9	13%	0.133	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	146.1	171.2	68.3	-77.4	0	0	0	111.8	E504 A508 E529 S549 R553	E504-Y559 PolarHBondContact OE2-OH 2.96Å; A508-Y559 HydrophobicContact CB-CD2 4.46Å; E529-Y559 PolarHBondContact OE1-N 3.36Å; S549-Y559 PolarHBondContact N-O 3.2Å; S549-Y559 PolarHBondContact O-N 3.39Å; R553-Y559 VanDerWaalsContact CD-CE1 3.44Å; R553-Y559 HydrophobicContact CG-CD1 4.38Å; R553-Y559 HydrophobicContact CG-CE1 3.98Å; R553-Y559 PolarHBondContact NE-OH 3.39Å
560	A	86	Confident	82.8	Confident	24 Å²	24	60.6 Å²	60.6	20%	0.198	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.4	166.2	0	0	0	0	0	109.8	E529 L545 V548 Y562	E529-A560 PolarHBondContact OE2-N 3.39Å; L545-A560 HydrophobicContact CD1-CB 4.09Å; V548-A560 HydrophobicContact CG2-CB 4.45Å; A560-Y562 HydrophobicContact CB-CD2 4.41Å; A560-Y562 HydrophobicContact CB-CE2 3.6Å
561	Q	85.4	Confident	82.8	Confident	27 Å²	27	63.2 Å²	63.2	13%	0.126	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	111.9	177.2	-172.7	175.6	5.7	0	0	109.8	L546 K547	L546-Q561 HydrophobicContact CD1-CG 4.41Å; L546-Q561 PolarHBondContact N-O 3.36Å; K547-Q561 HydrophobicContact CB-CB 4.31Å; K547-Q561 PolarHBondContact N-O 3.02Å; K547-Q561 PolarHBondContact O-N 3.39Å
562	Y	85.6	Confident	82.9	Confident	42 Å²	42	68.9 Å²	68.9	17%	0.165	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	159.1	173.9	-62	-82.4	0	0	0	111	H532 D543 P544 L545 A560 P564 M581	H532-Y562 WeakPolarHBondContact CB-OH 3.45Å; H532-Y562 PolarHBondContact O-OH 3.24Å; D543-Y562 HydrophobicContact CB-CD1 4.37Å; D543-Y562 HydrophobicContact CB-CG 4.46Å; D543-Y562 WeakPolarHBondContact O-CD1 3.29Å; P544-Y562 CarbonylContact O-C 3.57Å; P544-Y562 WeakPolarHBondContact O-CA 3.43Å; L545-Y562 HydrophobicContact CB-CD1 4.29Å; L545-Y562 HydrophobicContact CB-CE1 4.23Å; L545-Y562 HydrophobicContact CD1-CD1 3.95Å; L545-Y562 HydrophobicContact CD1-CE1 3.64Å; L545-Y562 HydrophobicContact CG-CE1 4.46Å; A560-Y562 HydrophobicContact CB-CD2 4.41Å; A560-Y562 HydrophobicContact CB-CE2 3.6Å; Y562-P564 VanDerWaalsContact C-CD 3.46Å; Y562-P564 WeakPolarHBondContact O-CD 3.49Å; Y562-M581 HydrophobicContact CD2-CE 4.24Å; Y562-M581 HydrophobicContact CE1-CE 4.26Å; Y562-M581 HydrophobicContact CE1-CG 4.28Å; Y562-M581 HydrophobicContact CE1-SD 4.16Å; Y562-M581 HydrophobicContact CE2-CE 3.97Å; Y562-M581 HydrophobicContact CE2-SD 3.77Å; Y562-M581 VanDerWaalsContact CZ-SD 3.51Å; Y562-M581 PolarHBondContact OH-SD 3.33Å; Y562-M581 VanDerWaalsContact OH-SD 3.4Å
563	L	82.7	Confident	83.1	Confident	7 Å²	7	73.4 Å²	73.4	4%	0.037	36%	0.361	C	S	.	.			trans	-103.8	90.1	169.4	-173.8	69	0	0	0	109.4	A465 P468 P544 L546 K565 F697	A465-L563 WeakPolarHBondContact O-CD1 3.33Å; P468-L563 HydrophobicContact CB-CD1 4.45Å; P468-L563 HydrophobicContact CG-CD1 3.74Å; P544-L563 HydrophobicContact CB-CB 4.39Å; P544-L563 WeakPolarHBondContact CD-O 3.38Å; P544-L563 PolarHBondContact O-N 2.89Å; L546-L563 HydrophobicContact CD1-CB 4.02Å; L546-L563 HydrophobicContact CD1-CD1 4.16Å; L546-L563 HydrophobicContact CD2-CB 4.33Å; L546-L563 HydrophobicContact CG-CB 4.02Å; L563-K565 PolarHBondContact O-N 3.07Å; L563-F697 HydrophobicContact CD2-CE2 3.8Å; L563-F697 HydrophobicContact CD2-CZ 3.58Å; L563-F697 HydrophobicContact CG-CZ 4.43Å
564	P	79.2	Confident	83.4	Confident	51 Å²	51	73.9 Å²	73.9	33%	0.331	36%	0.364	S	S	.	.			trans	-48.9	130.6	176.1	-29	29.3	0	0	0	112.5	P468 Y562 E566	P468-P564 HydrophobicContact CG-CG 4.21Å; Y562-P564 VanDerWaalsContact C-CD 3.46Å; Y562-P564 WeakPolarHBondContact O-CD 3.49Å; P564-E566 PolarHBondContact O-N 3.33Å
565	K	76	Confident	84	Confident	65 Å²	65	74.4 Å²	74.4	28%	0.283	36%	0.36	S	S	.	.			trans	-66.9	127.1	169.7	-64.9	179	-176.6	174.1	0	109.4	D543 L563 Q567	D543-K565 PolarHBondContact OD1-N 2.94Å; L563-K565 PolarHBondContact O-N 3.07Å; K565-Q567 HydrophobicContact CB-CG 4.21Å; K565-Q567 PolarHBondContact O-N 2.88Å
566	E	70.6	Confident	84.7	Confident	92 Å²	92	66.8 Å²	66.8	43%	0.43	33%	0.327	S	S	.	.			trans	-73.8	76.1	173.6	-66.5	-171.6	167.9	0	0	110.4	R439 P564	R439-E566 IonicContact CZ-OE1 3.86Å; R439-E566 IonicContact NH1-OE1 3.33Å; R439-E566 PolarHBondContact NH1-OE1 3.48Å; R439-E566 IonicContact NH2-OE1 3.03Å; R439-E566 PolarHBondContact NH2-OE1 2.97Å; P564-E566 PolarHBondContact O-N 3.33Å
567	Q	75.9	Confident	85.3	Confident	57 Å²	57	66.7 Å²	66.7	27%	0.266	32%	0.318	S	S	.	.			trans	-127.3	136.9	176.5	59.3	175	31.7	0	0	110.7	K565 Y570	K565-Q567 HydrophobicContact CB-CG 4.21Å; K565-Q567 PolarHBondContact O-N 2.88Å; Q567-Y570 HydrophobicContact CG-CE1 4.18Å; Q567-Y570 VanDerWaalsContact NE2-CE1 3.27Å
568	Y	75.6	Confident	85.7	Confident	201 Å²	201	67.4 Å²	67.4	79%	0.788	32%	0.315	S	S	*	.	S	Bend	trans	-87.3	-20.4	179.7	-61.9	-76.2	0	0	0	113.3
569	L	84.2	Confident	86.1	Confident	149 Å²	149	66.7 Å²	66.7	78%	0.78	31%	0.309	S	S	*	.			trans	-114.2	124.3	-176.4	-58.8	176.4	0	0	0	109.5
570	Y	87.3	Confident	86.6	Confident	99 Å²	99	65.1 Å²	65.1	39%	0.388	30%	0.302	S	S	.	.			trans	-108.6	132.2	175.7	-70.7	-87	0	0	0	110.5	Q567 L575	Q567-Y570 HydrophobicContact CG-CE1 4.18Å; Q567-Y570 VanDerWaalsContact NE2-CE1 3.27Å; Y570-L575 HydrophobicContact CD1-CD2 4.24Å; Y570-L575 HydrophobicContact CG-CD2 4.14Å
571	T	90.8	Very high	87	Confident	60 Å²	60	64.6 Å²	64.6	37%	0.368	30%	0.296	S	S	.	.			trans	-86.5	164.9	171.5	83	0	0	0	0	111.1	E573 Q574 L575	T571-E573 VanDerWaalsContact C-N 3.27Å; T571-E573 VanDerWaalsContact CB-OE2 3.26Å; T571-E573 WeakPolarHBondContact CB-OE2 3.23Å; T571-E573 PolarHBondContact O-N 3.28Å; T571-E573 PolarHBondContact OG1-N 2.99Å; T571-E573 PolarHBondContact OG1-OE2 3.5Å; T571-Q574 HydrophobicContact CG2-CG 4.48Å; T571-Q574 VanDerWaalsContact N-OE1 3.11Å; T571-Q574 PolarHBondContact O-N 2.82Å; T571-Q574 WeakPolarHBondContact OG1-CG 3.41Å; T571-Q574 PolarHBondContact OG1-N 3.3Å; T571-L575 WeakPolarHBondContact O-CG 3.39Å; T571-L575 PolarHBondContact O-N 3.06Å
572	K	90.2	Very high	87.4	Confident	146 Å²	146	63.9 Å²	63.9	64%	0.635	29%	0.293	S	S	*	.	H	α-helix	trans	-59.1	-40.6	177.2	-173.9	176.6	179.8	175.7	0	111.5	L575 F576	K572-L575 PolarHBondContact O-N 3.08Å; K572-F576 WeakPolarHBondContact O-CB 3.49Å; K572-F576 PolarHBondContact O-N 3Å
573	E	92.4	Very high	87.9	Confident	108 Å²	108	62 Å²	62	51%	0.505	29%	0.286	S	S	.	.	H	α-helix	trans	-66.4	-39.9	179.4	-56.6	72.1	-155.7	0	0	111.3	T571 F576 H577	T571-E573 VanDerWaalsContact C-N 3.27Å; T571-E573 VanDerWaalsContact CB-OE2 3.26Å; T571-E573 WeakPolarHBondContact CB-OE2 3.23Å; T571-E573 PolarHBondContact O-N 3.28Å; T571-E573 PolarHBondContact OG1-N 2.99Å; T571-E573 PolarHBondContact OG1-OE2 3.5Å; E573-F576 PolarHBondContact O-N 3.41Å; E573-H577 PolarHBondContact O-N 3.34Å
574	Q	92.3	Very high	88.5	Confident	33 Å²	33	61.7 Å²	61.7	15%	0.154	29%	0.285	C	S	.	.	H	α-helix	trans	-66	-43.5	177.2	-64.4	178.5	-18.4	0	0	111.6	H541 T571 H577 R578	H541-Q574 HydrophobicContact CB-CB 4.27Å; H541-Q574 HydrophobicContact CB-CG 3.86Å; T571-Q574 HydrophobicContact CG2-CG 4.48Å; T571-Q574 VanDerWaalsContact N-OE1 3.11Å; T571-Q574 PolarHBondContact O-N 2.82Å; T571-Q574 WeakPolarHBondContact OG1-CG 3.41Å; T571-Q574 PolarHBondContact OG1-N 3.3Å; Q574-H577 PolarHBondContact O-N 3.46Å; Q574-R578 WeakPolarHBondContact O-CB 3.43Å; Q574-R578 PolarHBondContact O-N 3.4Å
575	L	92.3	Very high	89.2	Confident	39 Å²	39	59.2 Å²	59.2	20%	0.204	27%	0.269	C	S	.	.	H	α-helix	trans	-64.1	-41.7	174.4	-67	176.4	0	0	0	111.3	Y570 T571 K572 R578 M579 Q614	Y570-L575 HydrophobicContact CD1-CD2 4.24Å; Y570-L575 HydrophobicContact CG-CD2 4.14Å; T571-L575 WeakPolarHBondContact O-CG 3.39Å; T571-L575 PolarHBondContact O-N 3.06Å; K572-L575 PolarHBondContact O-N 3.08Å; L575-R578 WeakPolarHBondContact O-CB 3.32Å; L575-R578 PolarHBondContact O-N 2.96Å; L575-M579 WeakPolarHBondContact O-CG 3.17Å; L575-M579 PolarHBondContact O-N 2.95Å; L575-Q614 HydrophobicContact CD1-CG 3.56Å
576	F	94.4	Very high	90.1	Very high	55 Å²	55	59.4 Å²	59.4	24%	0.241	27%	0.268	C	S	.	.	H	α-helix	trans	-59.8	-47.6	175.7	-176.7	-102	0	0	0	111.8	K572 E573 R578 M579 C580 A646 F649	K572-F576 WeakPolarHBondContact O-CB 3.49Å; K572-F576 PolarHBondContact O-N 3Å; E573-F576 PolarHBondContact O-N 3.41Å; F576-R578 VanDerWaalsContact C-N 3.31Å; F576-R578 PolarHBondContact O-N 3.2Å; F576-M579 WeakPolarHBondContact O-CB 3.44Å; F576-M579 PolarHBondContact O-N 3.15Å; F576-C580 VanDerWaalsContact CE1-SG 3.53Å; F576-C580 PolarHBondContact O-N 3.38Å; F576-C580 PolarHBondContact O-SG 3.31Å; F576-A646 HydrophobicContact CD2-CB 4.28Å; F576-A646 HydrophobicContact CE2-CB 3.78Å; F576-A646 HydrophobicContact CZ-CB 4.38Å; F576-F649 HydrophobicContact CE1-CB 4.32Å; F576-F649 HydrophobicContact CE1-CD1 4.12Å; F576-F649 HydrophobicContact CE1-CD2 4.45Å; F576-F649 HydrophobicContact CE1-CG 4.04Å; F576-F649 HydrophobicContact CZ-CB 3.96Å; F576-F649 HydrophobicContact CZ-CG 4.18Å
577	H	94.6	Very high	91.3	Very high	29 Å²	29	55 Å²	55	13%	0.134	25%	0.247	C	C	.	.	H	α-helix	trans	-61.3	-38.5	175.5	-72.8	177.8	0	0	0	112.5	L539 H541 E573 Q574 C580 M581	L539-H577 HydrophobicContact CD1-CB 4.49Å; L539-H577 WeakPolarHBondContact CD1-O 3.47Å; L539-H577 HydrophobicContact CD2-CB 4.24Å; H541-H577 HydrophobicContact CB-CB 4.19Å; H541-H577 WeakPolarHBondContact CB-ND1 3.41Å; H541-H577 AromaticContact CD2-CE1 3.68Å; H541-H577 AromaticContact CD2-ND1 3.41Å; H541-H577 PolarHBondContact CD2-ND1 3.39Å; H541-H577 AromaticContact CG-ND1 3.61Å; H541-H577 PolarHBondContact N-ND1 3.1Å; E573-H577 PolarHBondContact O-N 3.34Å; Q574-H577 PolarHBondContact O-N 3.46Å; H577-C580 PolarHBondContact O-N 3.07Å; H577-M581 PolarHBondContact O-N 2.85Å
578	R	93.1	Very high	92.2	Very high	83 Å²	83	52.3 Å²	52.3	31%	0.313	24%	0.235	S	C	.	.	H	α-helix	trans	-63.9	-40.4	175.1	-167.6	172.8	-176.4	150.4	3.4	112.1	Q574 L575 F576 T582 M610	Q574-R578 WeakPolarHBondContact O-CB 3.43Å; Q574-R578 PolarHBondContact O-N 3.4Å; L575-R578 WeakPolarHBondContact O-CB 3.32Å; L575-R578 PolarHBondContact O-N 2.96Å; F576-R578 VanDerWaalsContact C-N 3.31Å; F576-R578 PolarHBondContact O-N 3.2Å; R578-T582 WeakPolarHBondContact O-CB 3.31Å; R578-T582 PolarHBondContact O-N 3.44Å; R578-T582 VanDerWaalsContact O-N 3.09Å; R578-T582 PolarHBondContact O-OG1 2.72Å; R578-M610 HydrophobicContact CB-SD 4.4Å; R578-M610 HydrophobicContact CG-CE 4.37Å; R578-M610 HydrophobicContact CG-SD 3.92Å
579	M	94.5	Very high	93.1	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.3	-45.3	171.6	-66.7	173.3	75	0	0	111.3	L575 F576 M581 T582 L583 I607 M610 A611 Q614 I642 V643 A646	L575-M579 WeakPolarHBondContact O-CG 3.17Å; L575-M579 PolarHBondContact O-N 2.95Å; F576-M579 WeakPolarHBondContact O-CB 3.44Å; F576-M579 PolarHBondContact O-N 3.15Å; M579-M581 PolarHBondContact O-N 3.44Å; M579-T582 PolarHBondContact O-N 3.31Å; M579-L583 WeakPolarHBondContact O-CG 3.3Å; M579-L583 PolarHBondContact O-N 2.89Å; M579-I607 HydrophobicContact CE-CG2 3.69Å; M579-M610 HydrophobicContact CG-CB 4.32Å; M579-M610 HydrophobicContact CG-CE 3.97Å; M579-A611 HydrophobicContact CE-CB 3.89Å; M579-Q614 PolarHBondContact SD-NE2 3.23Å; M579-I642 HydrophobicContact CE-CG2 3.66Å; M579-I642 HydrophobicContact SD-CG2 3.92Å; M579-V643 HydrophobicContact CE-CG2 3.89Å; M579-A646 HydrophobicContact CB-CB 4.24Å
580	C	95.8	Very high	93.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.4	-43.4	179.8	-68.2	0	0	0	0	112.7	L539 F576 H577 L583 G584 F649 T650	L539-C580 HydrophobicContact CD1-CB 3.96Å; L539-C580 HydrophobicContact CD2-CB 4.43Å; F576-C580 VanDerWaalsContact CE1-SG 3.53Å; F576-C580 PolarHBondContact O-N 3.38Å; F576-C580 PolarHBondContact O-SG 3.31Å; H577-C580 PolarHBondContact O-N 3.07Å; C580-L583 PolarHBondContact O-N 3.44Å; C580-G584 PolarHBondContact O-N 3.4Å; C580-F649 HydrophobicContact CB-CD1 4.37Å; C580-T650 WeakPolarHBondContact CA-OG1 3.31Å; C580-T650 VanDerWaalsContact CB-OG1 3.32Å; C580-T650 WeakPolarHBondContact CB-OG1 3.35Å; C580-T650 WeakPolarHBondContact O-CG2 3.37Å; C580-T650 PolarHBondContact O-OG1 2.98Å
581	M	94.4	Very high	94	Very high	13 Å²	13	35.5 Å²	35.5	6%	0.064	16%	0.163	C	C	.	.	H	α-helix	trans	-62.7	-42.4	175.2	176.4	-83.1	-77.2	0	0	111.4	H532 L539 Y562 H577 M579 L583 G584	H532-M581 PolarHBondContact ND1-O 3.29Å; L539-M581 HydrophobicContact CD1-CB 3.99Å; Y562-M581 HydrophobicContact CD2-CE 4.24Å; Y562-M581 HydrophobicContact CE1-CE 4.26Å; Y562-M581 HydrophobicContact CE1-CG 4.28Å; Y562-M581 HydrophobicContact CE1-SD 4.16Å; Y562-M581 HydrophobicContact CE2-CE 3.97Å; Y562-M581 HydrophobicContact CE2-SD 3.77Å; Y562-M581 VanDerWaalsContact CZ-SD 3.51Å; Y562-M581 PolarHBondContact OH-SD 3.33Å; Y562-M581 VanDerWaalsContact OH-SD 3.4Å; H577-M581 PolarHBondContact O-N 2.85Å; M579-M581 PolarHBondContact O-N 3.44Å; M581-L583 VanDerWaalsContact C-N 3.26Å; M581-L583 PolarHBondContact O-N 3.24Å; M581-G584 PolarHBondContact O-N 3.15Å
582	T	94	Very high	94.2	Very high	12 Å²	12	34.4 Å²	34.4	7%	0.074	15%	0.154	C	C	.	.	H	α-helix	trans	-69.2	-24.6	178.8	-48.7	0	0	0	0	111.9	H532 R578 M579 G584 D603 K606 I607	H532-T582 PolarHBondContact CE1-O 2.63Å; R578-T582 WeakPolarHBondContact O-CB 3.31Å; R578-T582 PolarHBondContact O-N 3.44Å; R578-T582 VanDerWaalsContact O-N 3.09Å; R578-T582 PolarHBondContact O-OG1 2.72Å; M579-T582 PolarHBondContact O-N 3.31Å; T582-G584 VanDerWaalsContact C-N 3.34Å; T582-D603 HydrophobicContact CG2-CB 3.7Å; T582-K606 HydrophobicContact CG2-CB 4.48Å; T582-I607 HydrophobicContact CG2-CD1 3.74Å; T582-I607 HydrophobicContact CG2-CG1 3.67Å
583	L	95.1	Very high	94.3	Very high	3 Å²	3	30.5 Å²	30.5	2%	0.016	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-10.3	171.9	-75.2	169.7	0	0	0	113.6	M579 C580 M581 G585 R586 A587 L604 I607 A646 L647 T650	M579-L583 WeakPolarHBondContact O-CG 3.3Å; M579-L583 PolarHBondContact O-N 2.89Å; C580-L583 PolarHBondContact O-N 3.44Å; M581-L583 VanDerWaalsContact C-N 3.26Å; M581-L583 PolarHBondContact O-N 3.24Å; L583-G585 VanDerWaalsContact C-N 3.34Å; L583-G585 PolarHBondContact O-N 3.38Å; L583-R586 PolarHBondContact O-N 3.2Å; L583-A587 WeakPolarHBondContact O-CB 3.48Å; L583-A587 PolarHBondContact O-N 2.93Å; L583-L604 HydrophobicContact CD2-CD2 4.21Å; L583-I607 HydrophobicContact CB-CD1 4.41Å; L583-I607 HydrophobicContact CD1-CD1 4.39Å; L583-I607 HydrophobicContact CD2-CD1 3.34Å; L583-I607 HydrophobicContact CG-CD1 3.4Å; L583-I607 HydrophobicContact CG-CG1 4.35Å; L583-A646 HydrophobicContact CD1-CB 3.79Å; L583-L647 HydrophobicContact CD1-CB 3.99Å; L583-L647 HydrophobicContact CD2-CD1 4.29Å; L583-T650 HydrophobicContact CB-CG2 4.2Å
584	G	95.1	Very high	94.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-57.6	-41.8	-173.5	0	0	0	0	0	113.7	C580 M581 T582 A587 S588	C580-G584 PolarHBondContact O-N 3.4Å; M581-G584 PolarHBondContact O-N 3.15Å; T582-G584 VanDerWaalsContact C-N 3.34Å; G584-A587 PolarHBondContact O-N 3.36Å; G584-S588 WeakPolarHBondContact O-CB 3.5Å; G584-S588 PolarHBondContact O-N 3.41Å
585	G	94.3	Very high	94.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.8	-49.5	179	0	0	0	0	0	113	H528 L583 A587 S588 E589	H528-G585 WeakPolarHBondContact O-CA 3.45Å; L583-G585 VanDerWaalsContact C-N 3.34Å; L583-G585 PolarHBondContact O-N 3.38Å; G585-A587 PolarHBondContact O-N 3.45Å; G585-S588 WeakPolarHBondContact O-CB 3.43Å; G585-S588 PolarHBondContact O-N 3.25Å; G585-E589 PolarHBondContact O-N 3Å; G585-E589 VanDerWaalsContact O-N 3.07Å
586	R	94.6	Very high	94.3	Very high	69 Å²	69	36.2 Å²	36.2	26%	0.26	18%	0.177	S	C	.	.	H	α-helix	trans	-63.4	-41.4	177.3	-172.1	173.9	-178.4	-175.7	-0.3	112.6	L583 S588 E589 E590 I596 A600	L583-R586 PolarHBondContact O-N 3.2Å; R586-S588 VanDerWaalsContact C-N 3.34Å; R586-E589 PolarHBondContact O-N 3.46Å; R586-E590 PolarHBondContact O-N 3.34Å; R586-I596 HydrophobicContact CG-CG2 4.32Å; R586-I596 VanDerWaalsContact NH2-CD1 3.26Å; R586-A600 HydrophobicContact CB-CB 3.94Å; R586-A600 HydrophobicContact CG-CB 4.29Å
587	A	95.6	Very high	94.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-39.9	178.2	0	0	0	0	0	111.8	L583 G584 G585 E590 I591 T650 R651 V654	L583-A587 WeakPolarHBondContact O-CB 3.48Å; L583-A587 PolarHBondContact O-N 2.93Å; G584-A587 PolarHBondContact O-N 3.36Å; G585-A587 PolarHBondContact O-N 3.45Å; A587-E590 PolarHBondContact O-N 2.9Å; A587-I591 WeakPolarHBondContact O-CD1 3.09Å; A587-I591 VanDerWaalsContact O-CG1 3.31Å; A587-I591 WeakPolarHBondContact O-CG1 3.48Å; A587-I591 PolarHBondContact O-N 3.48Å; A587-I591 VanDerWaalsContact O-N 3.12Å; A587-T650 HydrophobicContact CB-CG2 3.79Å; A587-R651 HydrophobicContact CB-CG 4.09Å; A587-V654 HydrophobicContact CB-CG2 4.28Å
588	S	96.1	Very high	93.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.4	-48.7	174.8	-177.2	0	0	0	0	111.9	Y527 G584 G585 R586 E590 I591 F592	Y527-S588 VanDerWaalsContact O-CB 3.29Å; Y527-S588 WeakPolarHBondContact O-CB 3.33Å; Y527-S588 PolarHBondContact O-OG 3.5Å; G584-S588 WeakPolarHBondContact O-CB 3.5Å; G584-S588 PolarHBondContact O-N 3.41Å; G585-S588 WeakPolarHBondContact O-CB 3.43Å; G585-S588 PolarHBondContact O-N 3.25Å; R586-S588 VanDerWaalsContact C-N 3.34Å; S588-E590 VanDerWaalsContact C-N 3.29Å; S588-E590 PolarHBondContact O-N 2.98Å; S588-I591 PolarHBondContact O-N 3.15Å; S588-F592 VanDerWaalsContact O-CD2 3.31Å; S588-F592 WeakPolarHBondContact O-CD2 3.42Å; S588-F592 PolarHBondContact O-N 2.89Å
589	E	94.5	Very high	93.6	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.019	22%	0.223	C	C	.	.	H	α-helix	trans	-56.5	-44	177.7	-72.9	-178	-163	0	0	112.6	T524 H528 G585 R586 F593 S597	T524-E589 HydrophobicContact CG2-CG 4.22Å; H528-E589 HydrophobicContact CB-CG 4.31Å; H528-E589 IonicContact CE1-OE1 3.58Å; H528-E589 IonicContact CG-OE1 3.31Å; H528-E589 IonicContact ND1-OE1 3.88Å; H528-E589 PolarHBondContact ND1-OE1 3.35Å; G585-E589 PolarHBondContact O-N 3Å; G585-E589 VanDerWaalsContact O-N 3.07Å; R586-E589 PolarHBondContact O-N 3.46Å; E589-F593 HydrophobicContact CB-CD2 4.31Å; E589-F593 HydrophobicContact CG-CD2 4.47Å; E589-F593 WeakPolarHBondContact O-CA 3.5Å; E589-F593 WeakPolarHBondContact O-CB 3.35Å; E589-F593 PolarHBondContact O-N 2.97Å; E589-S597 VanDerWaalsContact CD-OG 3.31Å; E589-S597 PolarHBondContact OE1-OG 3.44Å; E589-S597 WeakPolarHBondContact OE2-CB 3.41Å; E589-S597 PolarHBondContact OE2-N 3.4Å; E589-S597 PolarHBondContact OE2-OG 3Å
590	E	94.4	Very high	93.3	Very high	61 Å²	61	39.2 Å²	39.2	29%	0.285	22%	0.224	S	C	.	.	H	α-helix	trans	-63.5	-42.6	179.8	-174.3	178.5	178.5	0	0	112.3	R586 A587 S588 G594 I596 R651	R586-E590 PolarHBondContact O-N 3.34Å; A587-E590 PolarHBondContact O-N 2.9Å; S588-E590 VanDerWaalsContact C-N 3.29Å; S588-E590 PolarHBondContact O-N 2.98Å; E590-G594 WeakPolarHBondContact O-CA 3.46Å; E590-G594 PolarHBondContact O-N 3.05Å; E590-I596 HydrophobicContact CB-CG2 4.29Å; E590-R651 VanDerWaalsContact CD-CZ 3.45Å; E590-R651 IonicContact OE1-CZ 3.6Å; E590-R651 IonicContact OE1-NE 2.79Å; E590-R651 IonicContact OE1-NH1 3.7Å; E590-R651 IonicContact OE1-NH2 2.81Å; E590-R651 PolarHBondContact OE1-NH2 3.15Å; E590-R651 IonicContact OE2-CZ 3.24Å; E590-R651 IonicContact OE2-NE 3.19Å; E590-R651 PolarHBondContact OE2-NE 3.23Å; E590-R651 IonicContact OE2-NH2 3.62Å; E590-R651 PolarHBondContact OE2-NH2 3.19Å
591	I	94.7	Very high	93.1	Very high	30 Å²	30	45.4 Å²	45.4	15%	0.154	25%	0.253	C	S	.	.	H	α-helix	trans	-73.1	-37.7	-177.1	-69.5	161.6	0	0	0	112.3	A587 S588 V654 E655	A587-I591 WeakPolarHBondContact O-CD1 3.09Å; A587-I591 VanDerWaalsContact O-CG1 3.31Å; A587-I591 WeakPolarHBondContact O-CG1 3.48Å; A587-I591 PolarHBondContact O-N 3.48Å; A587-I591 VanDerWaalsContact O-N 3.12Å; S588-I591 PolarHBondContact O-N 3.15Å; I591-V654 HydrophobicContact CD1-CB 3.66Å; I591-V654 HydrophobicContact CD1-CG1 3.47Å; I591-V654 VanDerWaalsContact CD1-CG1 3.47Å; I591-E655 HydrophobicContact CD1-CG 3.75Å; I591-E655 HydrophobicContact CG1-CG 4.2Å; I591-E655 HydrophobicContact CG2-CG 4.4Å
592	F	94.9	Very high	92.9	Very high	38 Å²	38	49.4 Å²	49.4	17%	0.167	27%	0.274	C	S	.	.	H	α-helix	trans	-89.6	-37.3	-176.5	-74.7	-80.3	0	0	0	113.5	Y527 S588 R658 V661 E662	Y527-F592 HydrophobicContact CD1-CB 4.02Å; Y527-F592 AromaticContact CD1-CD1 3.96Å; Y527-F592 HydrophobicContact CD1-CD1 3.96Å; Y527-F592 AromaticContact CD1-CD2 3.62Å; Y527-F592 HydrophobicContact CD1-CD2 3.62Å; Y527-F592 HydrophobicContact CD1-CE1 4.32Å; Y527-F592 HydrophobicContact CD1-CE2 4.03Å; Y527-F592 AromaticContact CD1-CG 3.59Å; Y527-F592 HydrophobicContact CD1-CG 3.59Å; Y527-F592 HydrophobicContact CD1-CZ 4.34Å; Y527-F592 HydrophobicContact CE1-CB 4.25Å; Y527-F592 AromaticContact CE1-CD1 3.5Å; Y527-F592 HydrophobicContact CE1-CD1 3.5Å; Y527-F592 HydrophobicContact CE1-CD2 4.01Å; Y527-F592 AromaticContact CE1-CE1 3.72Å; Y527-F592 HydrophobicContact CE1-CE1 3.72Å; Y527-F592 HydrophobicContact CE1-CE2 4.23Å; Y527-F592 AromaticContact CE1-CG 3.66Å; Y527-F592 HydrophobicContact CE1-CG 3.66Å; Y527-F592 HydrophobicContact CE1-CZ 4.08Å; S588-F592 VanDerWaalsContact O-CD2 3.31Å; S588-F592 WeakPolarHBondContact O-CD2 3.42Å; S588-F592 PolarHBondContact O-N 2.89Å; F592-R658 HydrophobicContact CE1-CG 3.83Å; F592-R658 HydrophobicContact CE2-CG 4.43Å; F592-R658 HydrophobicContact CZ-CG 3.54Å; F592-R658 WeakPolarHBondContact CZ-O 3.4Å; F592-V661 HydrophobicContact CD2-CG1 4.38Å; F592-V661 HydrophobicContact CE2-CB 3.86Å; F592-V661 HydrophobicContact CE2-CG1 3.55Å; F592-V661 HydrophobicContact CZ-CB 3.98Å; F592-V661 HydrophobicContact CZ-CG1 4.05Å; F592-E662 HydrophobicContact CE1-CB 4.28Å; F592-E662 HydrophobicContact CZ-CB 4.44Å
593	F	93.8	Very high	92.8	Very high	64 Å²	64	49.9 Å²	49.9	28%	0.281	28%	0.277	S	S	.	.	H	α-helix	trans	-108.1	-15.5	-176.3	-53.8	-66.3	0	0	0	114.3	T523 T524 Y527 E589 R595	T523-F593 HydrophobicContact CG2-CE1 4.28Å; T523-F593 HydrophobicContact CG2-CZ 4.13Å; T524-F593 HydrophobicContact CG2-CD2 4.44Å; T524-F593 HydrophobicContact CG2-CE2 4.13Å; Y527-F593 HydrophobicContact CD2-CE1 4.47Å; Y527-F593 HydrophobicContact CD2-CE2 4.27Å; Y527-F593 AromaticContact CD2-CZ 3.61Å; Y527-F593 HydrophobicContact CD2-CZ 3.61Å; Y527-F593 HydrophobicContact CE2-CZ 4.31Å; Y527-F593 HydrophobicContact CG-CE2 4.13Å; Y527-F593 AromaticContact CG-CZ 3.92Å; Y527-F593 HydrophobicContact CG-CZ 3.92Å; E589-F593 HydrophobicContact CB-CD2 4.31Å; E589-F593 HydrophobicContact CG-CD2 4.47Å; E589-F593 WeakPolarHBondContact O-CA 3.5Å; E589-F593 WeakPolarHBondContact O-CB 3.35Å; E589-F593 PolarHBondContact O-N 2.97Å; F593-R595 HydrophobicContact CB-CG 3.78Å; F593-R595 PolarHBondContact O-N 3.04Å; F593-R595 VanDerWaalsContact O-N 3.13Å
594	G	91.5	Very high	92.7	Very high	69 Å²	69	52.1 Å²	52.1	71%	0.711	29%	0.288	S	S	*	.	S	Bend	trans	66.7	8	-174.5	0	0	0	0	0	114.2	E590	E590-G594 WeakPolarHBondContact O-CA 3.46Å; E590-G594 PolarHBondContact O-N 3.05Å
595	R	92	Very high	92.5	Very high	137 Å²	137	57.1 Å²	57.1	52%	0.517	31%	0.311	S	S	.	.			trans	-131.6	149.9	178.3	64.6	-176.6	-177.9	-174.9	1.3	109.2	F593	F593-R595 HydrophobicContact CB-CG 3.78Å; F593-R595 PolarHBondContact O-N 3.04Å; F593-R595 VanDerWaalsContact O-N 3.13Å
596	I	91.7	Very high	92.4	Very high	93 Å²	93	62.4 Å²	62.4	48%	0.477	33%	0.334	S	S	.	.			trans	-108.7	136.4	177	51.2	170	0	0	0	109.3	R586 E590	R586-I596 HydrophobicContact CG-CG2 4.32Å; R586-I596 VanDerWaalsContact NH2-CD1 3.26Å; E590-I596 HydrophobicContact CB-CG2 4.29Å
597	S	90.7	Very high	92.3	Very high	47 Å²	47	59.1 Å²	59.1	33%	0.329	32%	0.322	S	S	.	.			trans	-91.7	170	175.4	79.7	0	0	0	0	112.3	E589 G599	E589-S597 VanDerWaalsContact CD-OG 3.31Å; E589-S597 PolarHBondContact OE1-OG 3.44Å; E589-S597 WeakPolarHBondContact OE2-CB 3.41Å; E589-S597 PolarHBondContact OE2-N 3.4Å; E589-S597 PolarHBondContact OE2-OG 3Å; S597-G599 PolarHBondContact OG-N 3.31Å; S597-G599 VanDerWaalsContact OG-N 3.09Å
598	T	91	Very high	92.1	Very high	129 Å²	129	61.9 Å²	61.9	79%	0.791	34%	0.339	S	S	*	.	S	Bend	trans	-79.4	-5.4	167.9	52.3	0	0	0	0	112.8	A600 Q601	T598-A600 PolarHBondContact O-N 3.22Å; T598-Q601 WeakPolarHBondContact O-CB 3.28Å; T598-Q601 PolarHBondContact O-N 3.4Å
599	G	86.4	Confident	91.8	Very high	52 Å²	52	67.3 Å²	67.3	54%	0.536	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-30.3	-178.2	0	0	0	0	0	113.4	S597 Q601	S597-G599 PolarHBondContact OG-N 3.31Å; S597-G599 VanDerWaalsContact OG-N 3.09Å; G599-Q601 PolarHBondContact O-N 3.09Å; G599-Q601 VanDerWaalsContact O-N 3.15Å
600	A	89.2	Confident	91.6	Very high	2 Å²	2	68.7 Å²	68.7	2%	0.017	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	10.5	179.1	0	0	0	0	0	114.8	R586 T598 D603 L604	R586-A600 HydrophobicContact CB-CB 3.94Å; R586-A600 HydrophobicContact CG-CB 4.29Å; T598-A600 PolarHBondContact O-N 3.22Å; A600-D603 PolarHBondContact O-N 2.98Å; A600-L604 VanDerWaalsContact O-CG 3.23Å; A600-L604 WeakPolarHBondContact O-CG 3.44Å; A600-L604 PolarHBondContact O-N 3.05Å
601	Q	90.8	Very high	91.5	Very high	131 Å²	131	65.8 Å²	65.8	61%	0.612	36%	0.358	S	S	*	.	H	α-helix	trans	-61.1	-47	-176.5	180	176.9	-11.3	0	0	112.2	T598 G599 D603 L604 Q605	T598-Q601 WeakPolarHBondContact O-CB 3.28Å; T598-Q601 PolarHBondContact O-N 3.4Å; G599-Q601 PolarHBondContact O-N 3.09Å; G599-Q601 VanDerWaalsContact O-N 3.15Å; Q601-D603 VanDerWaalsContact C-N 3.3Å; Q601-D603 PolarHBondContact O-N 3.41Å; Q601-L604 PolarHBondContact O-N 3.46Å; Q601-Q605 PolarHBondContact O-N 2.95Å
602	D	89.7	Confident	91.2	Very high	96 Å²	96	68.1 Å²	68.1	51%	0.513	37%	0.365	S	S	.	.	H	α-helix	trans	-64.9	-37	-179	-74.6	-9.8	0	0	0	111.3	Q605 K606	D602-Q605 PolarHBondContact O-N 3.23Å; D602-K606 WeakPolarHBondContact O-CG 3.28Å; D602-K606 PolarHBondContact O-N 3.16Å; D602-K606 VanDerWaalsContact O-N 3.08Å
603	D	92.3	Very high	90.8	Very high	23 Å²	23	70.3 Å²	70.3	12%	0.123	39%	0.39	C	S	.	.	H	α-helix	trans	-64.4	-47.8	176.5	-63.9	-39.4	0	0	0	111.5	H528 H532 T582 A600 Q601 Q605 K606 I607	H528-D603 IonicContact CE1-OD2 2.91Å; H528-D603 IonicContact NE2-OD2 2.62Å; H528-D603 PolarHBondContact NE2-OD2 2.95Å; H532-D603 IonicContact CE1-OD2 2.71Å; H532-D603 IonicContact NE2-OD2 3.71Å; T582-D603 HydrophobicContact CG2-CB 3.7Å; A600-D603 PolarHBondContact O-N 2.98Å; Q601-D603 VanDerWaalsContact C-N 3.3Å; Q601-D603 PolarHBondContact O-N 3.41Å; D603-Q605 VanDerWaalsContact C-N 3.28Å; D603-Q605 PolarHBondContact O-N 3.44Å; D603-K606 PolarHBondContact O-N 3.38Å; D603-K606 VanDerWaalsContact O-N 3.17Å; D603-I607 VanDerWaalsContact O-CD1 3.24Å; D603-I607 WeakPolarHBondContact O-CD1 3.41Å; D603-I607 VanDerWaalsContact O-CG1 3.23Å; D603-I607 WeakPolarHBondContact O-CG1 3.22Å; D603-I607 PolarHBondContact O-N 2.92Å
604	L	92.8	Very high	90.4	Very high	50 Å²	50	69.4 Å²	69.4	26%	0.262	39%	0.387	S	S	.	.	H	α-helix	trans	-62	-37	177.7	-66.7	168.6	0	0	0	111.8	L583 A600 Q601 T608	L583-L604 HydrophobicContact CD2-CD2 4.21Å; A600-L604 VanDerWaalsContact O-CG 3.23Å; A600-L604 WeakPolarHBondContact O-CG 3.44Å; A600-L604 PolarHBondContact O-N 3.05Å; Q601-L604 PolarHBondContact O-N 3.46Å; L604-T608 VanDerWaalsContact O-CB 3.24Å; L604-T608 WeakPolarHBondContact O-CB 3.49Å; L604-T608 PolarHBondContact O-N 2.95Å; L604-T608 PolarHBondContact O-OG1 3.26Å
605	Q	92.4	Very high	89.8	Confident	104 Å²	104	66.6 Å²	66.6	49%	0.486	36%	0.356	S	S	.	.	H	α-helix	trans	-63	-46.7	174.7	-175.6	176.7	-15.8	0	0	111.3	Q601 D602 D603 T608 Q609	Q601-Q605 PolarHBondContact O-N 2.95Å; D602-Q605 PolarHBondContact O-N 3.23Å; D603-Q605 VanDerWaalsContact C-N 3.28Å; D603-Q605 PolarHBondContact O-N 3.44Å; Q605-T608 PolarHBondContact O-N 3.33Å; Q605-Q609 WeakPolarHBondContact O-CG 3.5Å; Q605-Q609 PolarHBondContact O-N 3.42Å
606	K	90.6	Very high	88.6	Confident	111 Å²	111	66.5 Å²	66.5	48%	0.483	37%	0.373	S	S	.	.	H	α-helix	trans	-61.5	-45.6	177.1	-69.7	168.3	-171.3	164.1	0	111.9	T582 D602 D603 T608 Q609 M610	T582-K606 HydrophobicContact CG2-CB 4.48Å; D602-K606 WeakPolarHBondContact O-CG 3.28Å; D602-K606 PolarHBondContact O-N 3.16Å; D602-K606 VanDerWaalsContact O-N 3.08Å; D603-K606 PolarHBondContact O-N 3.38Å; D603-K606 VanDerWaalsContact O-N 3.17Å; K606-T608 VanDerWaalsContact C-N 3.32Å; K606-T608 PolarHBondContact O-N 2.92Å; K606-Q609 PolarHBondContact O-N 2.87Å; K606-M610 WeakPolarHBondContact O-CG 3.46Å; K606-M610 PolarHBondContact O-N 2.96Å
607	I	93.4	Very high	87	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.005	38%	0.376	C	S	.	.	H	α-helix	trans	-61.2	-44.5	178.4	-68.3	154.7	0	0	0	110.7	M579 T582 L583 D603 M610 A611 V643	M579-I607 HydrophobicContact CE-CG2 3.69Å; T582-I607 HydrophobicContact CG2-CD1 3.74Å; T582-I607 HydrophobicContact CG2-CG1 3.67Å; L583-I607 HydrophobicContact CB-CD1 4.41Å; L583-I607 HydrophobicContact CD1-CD1 4.39Å; L583-I607 HydrophobicContact CD2-CD1 3.34Å; L583-I607 HydrophobicContact CG-CD1 3.4Å; L583-I607 HydrophobicContact CG-CG1 4.35Å; D603-I607 VanDerWaalsContact O-CD1 3.24Å; D603-I607 WeakPolarHBondContact O-CD1 3.41Å; D603-I607 VanDerWaalsContact O-CG1 3.23Å; D603-I607 WeakPolarHBondContact O-CG1 3.22Å; D603-I607 PolarHBondContact O-N 2.92Å; I607-M610 HydrophobicContact CG1-CE 4.29Å; I607-M610 PolarHBondContact O-N 3.33Å; I607-A611 WeakPolarHBondContact O-CB 3.3Å; I607-A611 PolarHBondContact O-N 3.36Å; I607-V643 HydrophobicContact CG2-CG1 4.13Å; I607-V643 HydrophobicContact CG2-CG2 3.81Å
608	T	91.8	Very high	85.4	Confident	57 Å²	57	66.3 Å²	66.3	35%	0.35	37%	0.368	S	S	.	.	H	α-helix	trans	-61.1	-47.3	178.2	-59.6	0	0	0	0	110.4	L604 Q605 K606 M610 A611 Y612	L604-T608 VanDerWaalsContact O-CB 3.24Å; L604-T608 WeakPolarHBondContact O-CB 3.49Å; L604-T608 PolarHBondContact O-N 2.95Å; L604-T608 PolarHBondContact O-OG1 3.26Å; Q605-T608 PolarHBondContact O-N 3.33Å; K606-T608 VanDerWaalsContact C-N 3.32Å; K606-T608 PolarHBondContact O-N 2.92Å; T608-M610 PolarHBondContact O-N 2.88Å; T608-A611 PolarHBondContact O-N 3.24Å; T608-Y612 HydrophobicContact CG2-CD2 3.69Å; T608-Y612 HydrophobicContact CG2-CE2 3.42Å; T608-Y612 VanDerWaalsContact CG2-CE2 3.42Å; T608-Y612 WeakPolarHBondContact O-CD2 3.31Å; T608-Y612 PolarHBondContact O-N 2.74Å
609	Q	90.3	Very high	83.3	Confident	115 Å²	115	63 Å²	63	54%	0.537	36%	0.36	S	S	.	.	H	α-helix	trans	-60.8	-43.3	176.1	-71.6	174.9	-1.6	0	0	112.5	Q605 K606 A611 Y612 A613	Q605-Q609 WeakPolarHBondContact O-CG 3.5Å; Q605-Q609 PolarHBondContact O-N 3.42Å; K606-Q609 PolarHBondContact O-N 2.87Å; Q609-A611 VanDerWaalsContact C-N 3.32Å; Q609-A611 PolarHBondContact O-N 3.29Å; Q609-Y612 PolarHBondContact O-N 3.23Å; Q609-A613 WeakPolarHBondContact O-CB 3.45Å; Q609-A613 PolarHBondContact O-N 3.39Å
610	M	90.3	Very high	81.7	Confident	33 Å²	33	67.3 Å²	67.3	16%	0.163	37%	0.37	C	S	.	.	H	α-helix	trans	-64.1	-35.2	175.7	-73.8	-172	-69.2	0	0	112.6	R578 M579 K606 I607 T608 Q614	R578-M610 HydrophobicContact CB-SD 4.4Å; R578-M610 HydrophobicContact CG-CE 4.37Å; R578-M610 HydrophobicContact CG-SD 3.92Å; M579-M610 HydrophobicContact CG-CB 4.32Å; M579-M610 HydrophobicContact CG-CE 3.97Å; K606-M610 WeakPolarHBondContact O-CG 3.46Å; K606-M610 PolarHBondContact O-N 2.96Å; I607-M610 HydrophobicContact CG1-CE 4.29Å; I607-M610 PolarHBondContact O-N 3.33Å; T608-M610 PolarHBondContact O-N 2.88Å; M610-Q614 WeakPolarHBondContact O-CG 3.34Å; M610-Q614 PolarHBondContact O-N 2.91Å; M610-Q614 PolarHBondContact O-NE2 3.13Å; M610-Q614 VanDerWaalsContact O-NE2 3.11Å
611	A	91.4	Very high	79.8	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-70.8	-44.8	177.3	0	0	0	0	0	111.4	M579 I607 T608 Q609 A613 Q614 V639 V643	M579-A611 HydrophobicContact CE-CB 3.89Å; I607-A611 WeakPolarHBondContact O-CB 3.3Å; I607-A611 PolarHBondContact O-N 3.36Å; T608-A611 PolarHBondContact O-N 3.24Å; Q609-A611 VanDerWaalsContact C-N 3.32Å; Q609-A611 PolarHBondContact O-N 3.29Å; A611-A613 VanDerWaalsContact C-N 3.34Å; A611-A613 PolarHBondContact O-N 2.86Å; A611-Q614 PolarHBondContact O-N 2.83Å; A611-V639 HydrophobicContact CB-CB 4.38Å; A611-V639 HydrophobicContact CB-CG1 3.77Å; A611-V639 HydrophobicContact CB-CG2 4.25Å; A611-V643 HydrophobicContact CB-CG2 3.96Å
612	Y	89	Confident	77.8	Confident	79 Å²	79	72.4 Å²	72.4	31%	0.31	41%	0.41	S	S	.	.	H	α-helix	trans	-60.6	-43.6	173.2	-80.5	-72.9	0	0	0	111.4	T608 Q609 Q614 T615 A618 I635 D636 V639	T608-Y612 HydrophobicContact CG2-CD2 3.69Å; T608-Y612 HydrophobicContact CG2-CE2 3.42Å; T608-Y612 VanDerWaalsContact CG2-CE2 3.42Å; T608-Y612 WeakPolarHBondContact O-CD2 3.31Å; T608-Y612 PolarHBondContact O-N 2.74Å; Q609-Y612 PolarHBondContact O-N 3.23Å; Y612-Q614 PolarHBondContact O-N 3.47Å; Y612-Q614 VanDerWaalsContact O-N 3.16Å; Y612-T615 PolarHBondContact O-N 3.5Å; Y612-T615 PolarHBondContact O-OG1 3.02Å; Y612-A618 HydrophobicContact CD1-CB 4.26Å; Y612-A618 WeakPolarHBondContact O-CB 3.37Å; Y612-I635 HydrophobicContact CD1-CG2 3.7Å; Y612-I635 HydrophobicContact CE1-CG2 3.73Å; Y612-D636 PolarHBondContact OH-OD1 3.22Å; Y612-V639 HydrophobicContact CD1-CG2 3.81Å; Y612-V639 HydrophobicContact CD2-CG1 4.49Å; Y612-V639 HydrophobicContact CD2-CG2 4.47Å; Y612-V639 HydrophobicContact CE1-CG2 3.99Å; Y612-V639 HydrophobicContact CE2-CG1 4.26Å; Y612-V639 HydrophobicContact CG-CG2 4.06Å
613	A	85.6	Confident	76.3	Confident	83 Å²	83	76.1 Å²	76.1	69%	0.686	43%	0.427	S	S	*	.	H	α-helix	trans	-62.9	-21.6	178.6	0	0	0	0	0	114	Q609 A611	Q609-A613 WeakPolarHBondContact O-CB 3.45Å; Q609-A613 PolarHBondContact O-N 3.39Å; A611-A613 VanDerWaalsContact C-N 3.34Å; A611-A613 PolarHBondContact O-N 2.86Å
614	Q	85.3	Confident	75	Confident	45 Å²	45	81.4 Å²	81.4	21%	0.21	46%	0.456	C	S	.	.	H	α-helix	trans	-81.7	-15	174	-77.2	174.4	76.8	0	0	113.4	L575 M579 M610 A611 Y612	L575-Q614 HydrophobicContact CD1-CG 3.56Å; M579-Q614 PolarHBondContact SD-NE2 3.23Å; M610-Q614 WeakPolarHBondContact O-CG 3.34Å; M610-Q614 PolarHBondContact O-N 2.91Å; M610-Q614 PolarHBondContact O-NE2 3.13Å; M610-Q614 VanDerWaalsContact O-NE2 3.11Å; A611-Q614 PolarHBondContact O-N 2.83Å; Y612-Q614 PolarHBondContact O-N 3.47Å; Y612-Q614 VanDerWaalsContact O-N 3.16Å
615	T	78.4	Confident	73.9	Confident	11 Å²	11	84.6 Å²	84.6	7%	0.067	47%	0.468	C	S	.	.	S	Bend	trans	-85	124.3	176.9	60.7	0	0	0	0	110	Y612 E617 A618 I635 E638 V639	Y612-T615 PolarHBondContact O-N 3.5Å; Y612-T615 PolarHBondContact O-OG1 3.02Å; T615-E617 PolarHBondContact O-N 3.39Å; T615-A618 PolarHBondContact O-N 3.39Å; T615-A618 WeakPolarHBondContact OG1-CB 3.41Å; T615-I635 HydrophobicContact CG2-CG2 4.3Å; T615-E638 HydrophobicContact CG2-CB 4.5Å; T615-E638 HydrophobicContact CG2-CG 4.2Å; T615-V639 HydrophobicContact CG2-CG2 4.03Å
616	P	67	Low	73.2	Confident	134 Å²	134	84.1 Å²	84.1	87%	0.87	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.9	-170.9	-25.5	32.3	0	0	0	115.4
617	E	58.7	Low	72.8	Confident	119 Å²	119	81.9 Å²	81.9	56%	0.556	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-9.5	-172	-63.5	-178.2	161	0	0	113.5	T615 G619 Y627 T631 I635	T615-E617 PolarHBondContact O-N 3.39Å; E617-G619 VanDerWaalsContact C-N 3.35Å; E617-Y627 WeakPolarHBondContact O-CD1 3.26Å; E617-Y627 WeakPolarHBondContact O-CE1 3.33Å; E617-T631 WeakPolarHBondContact OE2-CG2 3.43Å; E617-I635 HydrophobicContact CB-CD1 4.04Å
618	A	56.4	Low	72.5	Confident	18 Å²	18	84.7 Å²	84.7	15%	0.149	48%	0.482	C	S	.	.			trans	-93.8	11	179.6	0	0	0	0	0	113.6	Y612 T615 D620 I635	Y612-A618 HydrophobicContact CD1-CB 4.26Å; Y612-A618 WeakPolarHBondContact O-CB 3.37Å; T615-A618 PolarHBondContact O-N 3.39Å; T615-A618 WeakPolarHBondContact OG1-CB 3.41Å; A618-D620 PolarHBondContact O-N 3.19Å; A618-I635 HydrophobicContact CB-CD1 4.48Å; A618-I635 HydrophobicContact CB-CG2 4.29Å
619	G	48.5	Very low	72.4	Confident	60 Å²	60	87.6 Å²	87.6	62%	0.619	49%	0.492	S	S	*	.			trans	-65.4	116.1	176.4	0	0	0	0	0	111.7	E617	E617-G619 VanDerWaalsContact C-N 3.35Å
620	D	53.1	Low	72.3	Confident	141 Å²	141	89.4 Å²	89.4	75%	0.754	50%	0.5	S	S	*	.	S	Bend	trans	71.2	113.3	-175.6	-83.1	-24.6	0	0	0	117	A618 V622	A618-D620 PolarHBondContact O-N 3.19Å; D620-V622 HydrophobicContact CB-CG2 4.39Å; D620-V622 PolarHBondContact O-N 3.26Å
621	V	47.4	Very low	72.2	Confident	152 Å²	152	89.2 Å²	89.2	92%	0.921	50%	0.501	S	S	*	.			trans	-69.5	76.3	169.8	-168.6	0	0	0	0	108.5
622	V	50.2	Low	72	Confident	89 Å²	89	89.3 Å²	89.3	54%	0.539	50%	0.502	S	S	.	.			trans	-71.1	143.3	166.3	-171.7	0	0	0	0	107.6	D620 D624	D620-V622 HydrophobicContact CB-CG2 4.39Å; D620-V622 PolarHBondContact O-N 3.26Å; V622-D624 CarbonylContact C-O 3.54Å; V622-D624 CarbonylContact O-C 3.59Å; V622-D624 VanDerWaalsContact O-C 3.26Å; V622-D624 PolarHBondContact O-N 3.08Å
623	I	56.9	Low	72.1	Confident	173 Å²	173	90.4 Å²	90.4	89%	0.887	51%	0.51	S	S	*	.	S	Bend	trans	-50.7	-28.3	-172.6	-64.8	168.7	0	0	0	112.7
624	D	65.3	Low	72.3	Confident	135 Å²	135	91.8 Å²	91.8	72%	0.722	51%	0.505	S	S	*	.	S	Bend	trans	-113.6	135.9	162	-84.4	-41.6	0	0	0	109.7	V622 P626	V622-D624 CarbonylContact C-O 3.54Å; V622-D624 CarbonylContact O-C 3.59Å; V622-D624 VanDerWaalsContact O-C 3.26Å; V622-D624 PolarHBondContact O-N 3.08Å; D624-P626 WeakPolarHBondContact O-CD 3.4Å
625	K	70.4	Confident	72.5	Confident	117 Å²	117	90 Å²	90	51%	0.509	50%	0.497	S	S	.	.			trans	-55.9	120.3	173.9	-62.6	177.1	-176.1	179.5	0	108.3	Y627 A632	K625-Y627 HydrophobicContact CB-CD2 4.24Å; K625-Y627 HydrophobicContact CB-CE2 3.92Å; K625-Y627 HydrophobicContact CD-CE2 3.96Å; K625-Y627 HydrophobicContact CG-CE2 4.24Å; K625-Y627 PolarHBondContact O-N 2.62Å; K625-A632 HydrophobicContact CD-CB 4.44Å
626	P	78.5	Confident	73.2	Confident	94 Å²	94	91.8 Å²	91.8	61%	0.61	51%	0.506	S	S	*	.	S	Bend	trans	-75.1	12.8	-176.1	30.7	-35.4	0	0	0	113.8	D624	D624-P626 WeakPolarHBondContact O-CD 3.4Å
627	Y	82.1	Confident	74.4	Confident	63 Å²	63	90.8 Å²	90.8	25%	0.247	49%	0.49	C	S	.	.	S	Bend	trans	-135.8	164.3	-174	47.2	-104.6	0	0	0	111.9	E617 K625 T631 A632 I635	E617-Y627 WeakPolarHBondContact O-CD1 3.26Å; E617-Y627 WeakPolarHBondContact O-CE1 3.33Å; K625-Y627 HydrophobicContact CB-CD2 4.24Å; K625-Y627 HydrophobicContact CB-CE2 3.92Å; K625-Y627 HydrophobicContact CD-CE2 3.96Å; K625-Y627 HydrophobicContact CG-CE2 4.24Å; K625-Y627 PolarHBondContact O-N 2.62Å; Y627-T631 HydrophobicContact CD2-CG2 4.2Å; Y627-T631 HydrophobicContact CG-CG2 4.11Å; Y627-A632 HydrophobicContact CD2-CB 4.09Å; Y627-A632 HydrophobicContact CE2-CB 3.67Å; Y627-I635 HydrophobicContact CD1-CD1 4.4Å; Y627-I635 HydrophobicContact CD2-CD1 4.35Å; Y627-I635 HydrophobicContact CE1-CD1 4.04Å; Y627-I635 HydrophobicContact CE2-CD1 3.97Å
628	S	87	Confident	75.9	Confident	60 Å²	60	89.6 Å²	89.6	42%	0.42	48%	0.484	S	S	.	.			trans	-67.2	158.4	-178.7	79.6	0	0	0	0	112.6	Q630 T631 A632	S628-Q630 PolarHBondContact O-N 3.06Å; S628-T631 VanDerWaalsContact O-CB 3.31Å; S628-T631 WeakPolarHBondContact O-CB 3.45Å; S628-T631 PolarHBondContact O-N 2.94Å; S628-T631 VanDerWaalsContact O-N 3.08Å; S628-T631 PolarHBondContact OG-N 2.91Å; S628-T631 PolarHBondContact OG-OG1 3.16Å; S628-A632 PolarHBondContact O-N 2.62Å
629	E	88.6	Confident	77.7	Confident	119 Å²	119	89.2 Å²	89.2	56%	0.556	48%	0.48	S	S	*	.	H	α-helix	trans	-62.5	-31.2	176.3	-170	61.9	-168.1	0	0	112.6	T631 A632 Q633	E629-T631 VanDerWaalsContact C-N 3.35Å; E629-A632 WeakPolarHBondContact O-CB 3.45Å; E629-A632 PolarHBondContact O-N 3.07Å; E629-Q633 WeakPolarHBondContact O-CG 3.39Å; E629-Q633 PolarHBondContact O-N 3.3Å
630	Q	89	Confident	79.8	Confident	152 Å²	152	94.1 Å²	94.1	71%	0.71	48%	0.48	S	S	*	.	H	α-helix	trans	-63.9	-42.1	173.6	-68.5	-179	-3.6	0	0	111.4	S628 A632 Q633 L634	S628-Q630 PolarHBondContact O-N 3.06Å; Q630-A632 VanDerWaalsContact C-N 3.34Å; Q630-Q633 PolarHBondContact O-N 3.01Å; Q630-L634 WeakPolarHBondContact O-CG 3.42Å; Q630-L634 PolarHBondContact O-N 3.47Å; Q630-L634 VanDerWaalsContact O-N 3.11Å
631	T	87.7	Confident	81.8	Confident	29 Å²	29	90.5 Å²	90.5	18%	0.178	46%	0.463	C	S	.	.	H	α-helix	trans	-62.6	-42.8	174.1	-51.6	0	0	0	0	111.1	E617 Y627 S628 E629 Q633 L634 I635	E617-T631 WeakPolarHBondContact OE2-CG2 3.43Å; Y627-T631 HydrophobicContact CD2-CG2 4.2Å; Y627-T631 HydrophobicContact CG-CG2 4.11Å; S628-T631 VanDerWaalsContact O-CB 3.31Å; S628-T631 WeakPolarHBondContact O-CB 3.45Å; S628-T631 PolarHBondContact O-N 2.94Å; S628-T631 VanDerWaalsContact O-N 3.08Å; S628-T631 PolarHBondContact OG-N 2.91Å; S628-T631 PolarHBondContact OG-OG1 3.16Å; E629-T631 VanDerWaalsContact C-N 3.35Å; T631-Q633 VanDerWaalsContact C-N 3.3Å; T631-Q633 PolarHBondContact O-N 2.96Å; T631-L634 PolarHBondContact O-N 3.28Å; T631-L634 VanDerWaalsContact O-N 3.16Å; T631-I635 HydrophobicContact CG2-CD1 4.09Å; T631-I635 WeakPolarHBondContact O-CG1 3.47Å; T631-I635 PolarHBondContact O-N 3.07Å
632	A	87.6	Confident	84	Confident	2 Å²	2	84.3 Å²	84.3	2%	0.017	42%	0.424	C	S	.	.	H	α-helix	trans	-56.9	-44.3	175.6	0	0	0	0	0	111.8	K625 Y627 S628 E629 Q630 L634 I635 D636	K625-A632 HydrophobicContact CD-CB 4.44Å; Y627-A632 HydrophobicContact CD2-CB 4.09Å; Y627-A632 HydrophobicContact CE2-CB 3.67Å; S628-A632 PolarHBondContact O-N 2.62Å; E629-A632 WeakPolarHBondContact O-CB 3.45Å; E629-A632 PolarHBondContact O-N 3.07Å; Q630-A632 VanDerWaalsContact C-N 3.34Å; A632-L634 PolarHBondContact O-N 3.24Å; A632-I635 PolarHBondContact O-N 3.24Å; A632-D636 PolarHBondContact O-N 3.07Å
633	Q	90	Very high	86.1	Confident	102 Å²	102	81.5 Å²	81.5	48%	0.477	41%	0.408	S	S	.	.	H	α-helix	trans	-64.2	-38.2	177.3	-70.1	175.1	6.1	0	0	112.9	E629 Q630 T631 D636 Q637	E629-Q633 WeakPolarHBondContact O-CG 3.39Å; E629-Q633 PolarHBondContact O-N 3.3Å; Q630-Q633 PolarHBondContact O-N 3.01Å; T631-Q633 VanDerWaalsContact C-N 3.3Å; T631-Q633 PolarHBondContact O-N 2.96Å; Q633-D636 PolarHBondContact O-N 3.26Å; Q633-Q637 VanDerWaalsContact O-CG 3.3Å; Q633-Q637 WeakPolarHBondContact O-CG 3.47Å; Q633-Q637 PolarHBondContact O-N 2.96Å
634	L	90.7	Very high	87.9	Confident	112 Å²	112	76.1 Å²	76.1	59%	0.586	39%	0.385	S	S	*	.	H	α-helix	trans	-65.2	-44.1	175.7	-71.6	171.8	0	0	0	111.4	Q630 T631 A632 D636 Q637 E638	Q630-L634 WeakPolarHBondContact O-CG 3.42Å; Q630-L634 PolarHBondContact O-N 3.47Å; Q630-L634 VanDerWaalsContact O-N 3.11Å; T631-L634 PolarHBondContact O-N 3.28Å; T631-L634 VanDerWaalsContact O-N 3.16Å; A632-L634 PolarHBondContact O-N 3.24Å; L634-D636 PolarHBondContact O-N 3.28Å; L634-Q637 PolarHBondContact O-N 3.35Å; L634-E638 PolarHBondContact O-N 2.9Å
635	I	89.8	Confident	89.4	Confident	9 Å²	9	72.4 Å²	72.4	5%	0.046	37%	0.365	C	S	.	.	H	α-helix	trans	-59.2	-47.8	175.4	-66.6	167.2	0	0	0	110	Y612 T615 E617 A618 Y627 T631 A632 Q637 E638 V639	Y612-I635 HydrophobicContact CD1-CG2 3.7Å; Y612-I635 HydrophobicContact CE1-CG2 3.73Å; T615-I635 HydrophobicContact CG2-CG2 4.3Å; E617-I635 HydrophobicContact CB-CD1 4.04Å; A618-I635 HydrophobicContact CB-CD1 4.48Å; A618-I635 HydrophobicContact CB-CG2 4.29Å; Y627-I635 HydrophobicContact CD1-CD1 4.4Å; Y627-I635 HydrophobicContact CD2-CD1 4.35Å; Y627-I635 HydrophobicContact CE1-CD1 4.04Å; Y627-I635 HydrophobicContact CE2-CD1 3.97Å; T631-I635 HydrophobicContact CG2-CD1 4.09Å; T631-I635 WeakPolarHBondContact O-CG1 3.47Å; T631-I635 PolarHBondContact O-N 3.07Å; A632-I635 PolarHBondContact O-N 3.24Å; I635-Q637 VanDerWaalsContact C-N 3.29Å; I635-Q637 PolarHBondContact O-N 2.98Å; I635-E638 PolarHBondContact O-N 3.25Å; I635-V639 HydrophobicContact CG2-CG2 4.24Å; I635-V639 WeakPolarHBondContact O-CB 3.31Å; I635-V639 VanDerWaalsContact O-CG2 3.31Å; I635-V639 WeakPolarHBondContact O-CG2 3.44Å; I635-V639 PolarHBondContact O-N 3.31Å
636	D	91.6	Very high	90.6	Very high	48 Å²	48	66.8 Å²	66.8	26%	0.257	34%	0.341	S	S	.	.	H	α-helix	trans	-61.3	-36.6	179.8	-73.3	-2.4	0	0	0	112.6	Y612 A632 Q633 L634 R640	Y612-D636 PolarHBondContact OH-OD1 3.22Å; A632-D636 PolarHBondContact O-N 3.07Å; Q633-D636 PolarHBondContact O-N 3.26Å; L634-D636 PolarHBondContact O-N 3.28Å; D636-R640 VanDerWaalsContact O-CG 3.29Å; D636-R640 WeakPolarHBondContact O-CG 3.28Å; D636-R640 PolarHBondContact O-N 3.01Å; D636-R640 VanDerWaalsContact O-N 3.07Å
637	Q	92.9	Very high	91.3	Very high	112 Å²	112	64 Å²	64	52%	0.523	32%	0.32	S	S	.	.	H	α-helix	trans	-69	-42.8	175.9	-74.2	175.4	16.6	0	0	111.8	Q633 L634 I635 R640 T641	Q633-Q637 VanDerWaalsContact O-CG 3.3Å; Q633-Q637 WeakPolarHBondContact O-CG 3.47Å; Q633-Q637 PolarHBondContact O-N 2.96Å; L634-Q637 PolarHBondContact O-N 3.35Å; I635-Q637 VanDerWaalsContact C-N 3.29Å; I635-Q637 PolarHBondContact O-N 2.98Å; Q637-R640 PolarHBondContact O-N 3.41Å; Q637-T641 PolarHBondContact O-N 3.45Å; Q637-T641 PolarHBondContact O-OG1 3.48Å
638	E	91.1	Very high	92	Very high	95 Å²	95	68.9 Å²	68.9	44%	0.444	34%	0.339	S	S	.	.	H	α-helix	trans	-64.2	-46.6	176.8	-174.8	62.8	-167.6	0	0	110.8	T615 L634 I635 R640 T641 I642	T615-E638 HydrophobicContact CG2-CB 4.5Å; T615-E638 HydrophobicContact CG2-CG 4.2Å; L634-E638 PolarHBondContact O-N 2.9Å; I635-E638 PolarHBondContact O-N 3.25Å; E638-R640 VanDerWaalsContact C-N 3.33Å; E638-R640 PolarHBondContact O-N 2.95Å; E638-T641 WeakPolarHBondContact O-CA 3.39Å; E638-T641 WeakPolarHBondContact O-CB 3.32Å; E638-T641 PolarHBondContact O-N 3.05Å; E638-I642 HydrophobicContact CG-CD1 4.11Å; E638-I642 WeakPolarHBondContact O-CG1 3.22Å; E638-I642 PolarHBondContact O-N 2.86Å
639	V	93	Very high	92.4	Very high	9 Å²	9	70 Å²	70	6%	0.055	34%	0.336	C	S	.	.	H	α-helix	trans	-56.4	-46.3	175.7	165.8	0	0	0	0	111.2	A611 Y612 T615 I635 T641 I642 V643	A611-V639 HydrophobicContact CB-CB 4.38Å; A611-V639 HydrophobicContact CB-CG1 3.77Å; A611-V639 HydrophobicContact CB-CG2 4.25Å; Y612-V639 HydrophobicContact CD1-CG2 3.81Å; Y612-V639 HydrophobicContact CD2-CG1 4.49Å; Y612-V639 HydrophobicContact CD2-CG2 4.47Å; Y612-V639 HydrophobicContact CE1-CG2 3.99Å; Y612-V639 HydrophobicContact CE2-CG1 4.26Å; Y612-V639 HydrophobicContact CG-CG2 4.06Å; T615-V639 HydrophobicContact CG2-CG2 4.03Å; I635-V639 HydrophobicContact CG2-CG2 4.24Å; I635-V639 WeakPolarHBondContact O-CB 3.31Å; I635-V639 VanDerWaalsContact O-CG2 3.31Å; I635-V639 WeakPolarHBondContact O-CG2 3.44Å; I635-V639 PolarHBondContact O-N 3.31Å; V639-T641 VanDerWaalsContact C-N 3.29Å; V639-T641 PolarHBondContact O-N 3.48Å; V639-I642 PolarHBondContact O-N 3.08Å; V639-V643 HydrophobicContact CG1-CG2 4.48Å; V639-V643 VanDerWaalsContact O-CG2 3.29Å; V639-V643 WeakPolarHBondContact O-CG2 3.45Å; V639-V643 PolarHBondContact O-N 2.91Å
640	R	93.6	Very high	92.8	Very high	163 Å²	163	64.3 Å²	64.3	62%	0.615	31%	0.309	S	S	*	.	H	α-helix	trans	-59.7	-40.8	175.3	-77.4	179.1	-136.5	-177.5	1.8	112.1	D636 Q637 E638 V643 S644	D636-R640 VanDerWaalsContact O-CG 3.29Å; D636-R640 WeakPolarHBondContact O-CG 3.28Å; D636-R640 PolarHBondContact O-N 3.01Å; D636-R640 VanDerWaalsContact O-N 3.07Å; Q637-R640 PolarHBondContact O-N 3.41Å; E638-R640 VanDerWaalsContact C-N 3.33Å; E638-R640 PolarHBondContact O-N 2.95Å; R640-V643 PolarHBondContact O-N 3.04Å; R640-S644 VanDerWaalsContact O-CB 3.23Å; R640-S644 WeakPolarHBondContact O-CB 3.4Å; R640-S644 PolarHBondContact O-N 3Å; R640-S644 PolarHBondContact O-OG 3.49Å
641	T	94.5	Very high	93.1	Very high	65 Å²	65	61.3 Å²	61.3	40%	0.399	29%	0.291	S	S	.	.	H	α-helix	trans	-62.6	-51.7	179.1	-56.4	0	0	0	0	110.4	Q637 E638 V639 V643 S644 D645	Q637-T641 PolarHBondContact O-N 3.45Å; Q637-T641 PolarHBondContact O-OG1 3.48Å; E638-T641 WeakPolarHBondContact O-CA 3.39Å; E638-T641 WeakPolarHBondContact O-CB 3.32Å; E638-T641 PolarHBondContact O-N 3.05Å; V639-T641 VanDerWaalsContact C-N 3.29Å; V639-T641 PolarHBondContact O-N 3.48Å; T641-V643 VanDerWaalsContact C-N 3.35Å; T641-V643 PolarHBondContact O-N 2.87Å; T641-S644 PolarHBondContact O-N 3.36Å; T641-S644 VanDerWaalsContact O-N 3.16Å; T641-S644 PolarHBondContact O-OG 3.06Å; T641-D645 PolarHBondContact O-N 3.28Å
642	I	93.5	Very high	93.5	Very high	22 Å²	22	66 Å²	66	11%	0.113	31%	0.309	C	S	.	.	H	α-helix	trans	-56.4	-47.8	178.2	-60.8	168.4	0	0	0	111	M579 E638 V639 D645 A646	M579-I642 HydrophobicContact CE-CG2 3.66Å; M579-I642 HydrophobicContact SD-CG2 3.92Å; E638-I642 HydrophobicContact CG-CD1 4.11Å; E638-I642 WeakPolarHBondContact O-CG1 3.22Å; E638-I642 PolarHBondContact O-N 2.86Å; V639-I642 PolarHBondContact O-N 3.08Å; I642-D645 PolarHBondContact O-N 3.49Å; I642-A646 WeakPolarHBondContact O-CB 3.31Å; I642-A646 PolarHBondContact O-N 2.88Å
643	V	95	Very high	93.8	Very high	31 Å²	31	66.9 Å²	66.9	19%	0.188	31%	0.314	C	S	.	.	H	α-helix	trans	-65.9	-39.9	-179.8	175.7	0	0	0	0	111.5	M579 I607 A611 V639 R640 T641 A646 L647	M579-V643 HydrophobicContact CE-CG2 3.89Å; I607-V643 HydrophobicContact CG2-CG1 4.13Å; I607-V643 HydrophobicContact CG2-CG2 3.81Å; A611-V643 HydrophobicContact CB-CG2 3.96Å; V639-V643 HydrophobicContact CG1-CG2 4.48Å; V639-V643 VanDerWaalsContact O-CG2 3.29Å; V639-V643 WeakPolarHBondContact O-CG2 3.45Å; V639-V643 PolarHBondContact O-N 2.91Å; R640-V643 PolarHBondContact O-N 3.04Å; T641-V643 VanDerWaalsContact C-N 3.35Å; T641-V643 PolarHBondContact O-N 2.87Å; V643-A646 PolarHBondContact O-N 3.34Å; V643-L647 WeakPolarHBondContact O-CB 3.31Å; V643-L647 PolarHBondContact O-N 3.47Å
644	S	95.1	Very high	94.1	Very high	60 Å²	60	62.1 Å²	62.1	42%	0.42	29%	0.291	S	S	.	.	H	α-helix	trans	-66.7	-37.9	178.5	73	0	0	0	0	112.7	R640 T641 L647 R648	R640-S644 VanDerWaalsContact O-CB 3.23Å; R640-S644 WeakPolarHBondContact O-CB 3.4Å; R640-S644 PolarHBondContact O-N 3Å; R640-S644 PolarHBondContact O-OG 3.49Å; T641-S644 PolarHBondContact O-N 3.36Å; T641-S644 VanDerWaalsContact O-N 3.16Å; T641-S644 PolarHBondContact O-OG 3.06Å; S644-L647 PolarHBondContact O-N 3.32Å; S644-R648 WeakPolarHBondContact O-CB 3.27Å; S644-R648 PolarHBondContact O-N 3.05Å
645	D	95.1	Very high	94.3	Very high	56 Å²	56	62.3 Å²	62.3	30%	0.299	29%	0.289	S	S	.	.	H	α-helix	trans	-67.8	-43.1	176.4	-77.1	-25	0	0	0	111	T641 I642 R648 F649	T641-D645 PolarHBondContact O-N 3.28Å; I642-D645 PolarHBondContact O-N 3.49Å; D645-R648 PolarHBondContact O-N 2.9Å; D645-R648 IonicContact OD1-CZ 3.52Å; D645-R648 IonicContact OD1-NH1 3.85Å; D645-R648 IonicContact OD1-NH2 3.36Å; D645-R648 PolarHBondContact OD1-NH2 2.88Å; D645-F649 WeakPolarHBondContact O-CB 3.39Å; D645-F649 PolarHBondContact O-N 3Å
646	A	95.7	Very high	94.6	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.7	-46	174	0	0	0	0	0	111.2	F576 M579 L583 I642 V643 R648 F649 T650	F576-A646 HydrophobicContact CD2-CB 4.28Å; F576-A646 HydrophobicContact CE2-CB 3.78Å; F576-A646 HydrophobicContact CZ-CB 4.38Å; M579-A646 HydrophobicContact CB-CB 4.24Å; L583-A646 HydrophobicContact CD1-CB 3.79Å; I642-A646 WeakPolarHBondContact O-CB 3.31Å; I642-A646 PolarHBondContact O-N 2.88Å; V643-A646 PolarHBondContact O-N 3.34Å; A646-R648 PolarHBondContact O-N 3.37Å; A646-F649 PolarHBondContact O-N 3.25Å; A646-T650 PolarHBondContact O-N 3.21Å; A646-T650 PolarHBondContact O-OG1 3.09Å; A646-T650 VanDerWaalsContact O-OG1 3.04Å
647	L	94.9	Very high	94.7	Very high	34 Å²	34	67.9 Å²	67.9	18%	0.178	31%	0.313	C	S	.	.	H	α-helix	trans	-62.7	-43.9	178.2	-178.5	61.6	0	0	0	112.3	L583 V643 S644 F649 T650 R651	L583-L647 HydrophobicContact CD1-CB 3.99Å; L583-L647 HydrophobicContact CD2-CD1 4.29Å; V643-L647 WeakPolarHBondContact O-CB 3.31Å; V643-L647 PolarHBondContact O-N 3.47Å; S644-L647 PolarHBondContact O-N 3.32Å; L647-F649 VanDerWaalsContact C-N 3.31Å; L647-F649 PolarHBondContact O-N 3.02Å; L647-T650 PolarHBondContact O-N 3.41Å; L647-R651 HydrophobicContact CD1-CG 4.28Å; L647-R651 WeakPolarHBondContact O-CB 3.26Å; L647-R651 WeakPolarHBondContact O-CG 3.2Å; L647-R651 PolarHBondContact O-N 3.35Å
648	R	96.1	Very high	94.7	Very high	167 Å²	167	68 Å²	68	63%	0.63	31%	0.309	S	S	*	.	H	α-helix	trans	-60.5	-43.7	177.1	-177.4	178.6	64.8	-142.6	-10.3	111.1	S644 D645 A646 K652	S644-R648 WeakPolarHBondContact O-CB 3.27Å; S644-R648 PolarHBondContact O-N 3.05Å; D645-R648 PolarHBondContact O-N 2.9Å; D645-R648 IonicContact OD1-CZ 3.52Å; D645-R648 IonicContact OD1-NH1 3.85Å; D645-R648 IonicContact OD1-NH2 3.36Å; D645-R648 PolarHBondContact OD1-NH2 2.88Å; A646-R648 PolarHBondContact O-N 3.37Å; R648-K652 PolarHBondContact O-N 3.32Å
649	F	96.1	Very high	94.9	Very high	83 Å²	83	70.3 Å²	70.3	36%	0.364	32%	0.32	S	S	.	.	H	α-helix	trans	-63.8	-48.2	177	-176.5	-90.2	0	0	0	111.6	L539 F576 C580 D645 A646 L647 R651 K652 M653	L539-F649 HydrophobicContact CD2-CE1 3.9Å; F576-F649 HydrophobicContact CE1-CB 4.32Å; F576-F649 HydrophobicContact CE1-CD1 4.12Å; F576-F649 HydrophobicContact CE1-CD2 4.45Å; F576-F649 HydrophobicContact CE1-CG 4.04Å; F576-F649 HydrophobicContact CZ-CB 3.96Å; F576-F649 HydrophobicContact CZ-CG 4.18Å; C580-F649 HydrophobicContact CB-CD1 4.37Å; D645-F649 WeakPolarHBondContact O-CB 3.39Å; D645-F649 PolarHBondContact O-N 3Å; A646-F649 PolarHBondContact O-N 3.25Å; L647-F649 VanDerWaalsContact C-N 3.31Å; L647-F649 PolarHBondContact O-N 3.02Å; F649-R651 PolarHBondContact O-N 2.97Å; F649-K652 PolarHBondContact O-N 3.45Å; F649-M653 HydrophobicContact CD1-CE 4.47Å; F649-M653 HydrophobicContact CE1-CE 3.44Å; F649-M653 VanDerWaalsContact CE1-CE 3.44Å; F649-M653 HydrophobicContact CE1-SD 4.41Å; F649-M653 HydrophobicContact CZ-CE 3.76Å; F649-M653 PolarHBondContact O-N 3.37Å
650	T	96.4	Very high	95	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.8	-44.2	178.3	-59.8	0	0	0	0	112.2	T535 C580 L583 A587 A646 L647 K652 M653 V654	T535-T650 HydrophobicContact CG2-CG2 3.95Å; C580-T650 WeakPolarHBondContact CA-OG1 3.31Å; C580-T650 VanDerWaalsContact CB-OG1 3.32Å; C580-T650 WeakPolarHBondContact CB-OG1 3.35Å; C580-T650 WeakPolarHBondContact O-CG2 3.37Å; C580-T650 PolarHBondContact O-OG1 2.98Å; L583-T650 HydrophobicContact CB-CG2 4.2Å; A587-T650 HydrophobicContact CB-CG2 3.79Å; A646-T650 PolarHBondContact O-N 3.21Å; A646-T650 PolarHBondContact O-OG1 3.09Å; A646-T650 VanDerWaalsContact O-OG1 3.04Å; L647-T650 PolarHBondContact O-N 3.41Å; T650-K652 PolarHBondContact O-N 3.14Å; T650-M653 PolarHBondContact O-N 3.36Å; T650-V654 HydrophobicContact CG2-CG2 4.2Å; T650-V654 VanDerWaalsContact O-CG2 3.31Å; T650-V654 WeakPolarHBondContact O-CG2 3.18Å; T650-V654 PolarHBondContact O-N 3.47Å
651	R	95.5	Very high	95.1	Very high	88 Å²	88	62.7 Å²	62.7	33%	0.332	29%	0.294	S	S	.	.	H	α-helix	trans	-58	-48.5	177.5	-77.1	178.2	179.8	169.9	0.7	111.7	A587 E590 L647 F649 M653 V654 E655	A587-R651 HydrophobicContact CB-CG 4.09Å; E590-R651 VanDerWaalsContact CD-CZ 3.45Å; E590-R651 IonicContact OE1-CZ 3.6Å; E590-R651 IonicContact OE1-NE 2.79Å; E590-R651 IonicContact OE1-NH1 3.7Å; E590-R651 IonicContact OE1-NH2 2.81Å; E590-R651 PolarHBondContact OE1-NH2 3.15Å; E590-R651 IonicContact OE2-CZ 3.24Å; E590-R651 IonicContact OE2-NE 3.19Å; E590-R651 PolarHBondContact OE2-NE 3.23Å; E590-R651 IonicContact OE2-NH2 3.62Å; E590-R651 PolarHBondContact OE2-NH2 3.19Å; L647-R651 HydrophobicContact CD1-CG 4.28Å; L647-R651 WeakPolarHBondContact O-CB 3.26Å; L647-R651 WeakPolarHBondContact O-CG 3.2Å; L647-R651 PolarHBondContact O-N 3.35Å; F649-R651 PolarHBondContact O-N 2.97Å; R651-M653 VanDerWaalsContact C-N 3.3Å; R651-M653 PolarHBondContact O-N 3.18Å; R651-V654 PolarHBondContact O-N 2.7Å; R651-E655 WeakPolarHBondContact O-CG 3.31Å; R651-E655 PolarHBondContact O-N 3.01Å
652	K	96	Very high	95.2	Very high	128 Å²	128	62.8 Å²	62.8	56%	0.557	29%	0.29	S	S	*	.	H	α-helix	trans	-58.6	-43.3	177.1	-170.2	-175.2	-179.2	-151.5	0	111.5	R648 F649 T650 E655 E656	R648-K652 PolarHBondContact O-N 3.32Å; F649-K652 PolarHBondContact O-N 3.45Å; T650-K652 PolarHBondContact O-N 3.14Å; K652-E655 PolarHBondContact O-N 3.21Å; K652-E656 WeakPolarHBondContact CE-OE1 3.5Å; K652-E656 IonicContact NZ-OE1 2.86Å; K652-E656 WeakPolarHBondContact O-CB 3.5Å; K652-E656 WeakPolarHBondContact O-CG 3.2Å; K652-E656 PolarHBondContact O-N 3.02Å
653	M	94.3	Very high	95.3	Very high	21 Å²	21	66.9 Å²	66.9	10%	0.103	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-42	178.4	179.7	174.4	-78.2	0	0	112.8	T535 L539 F649 T650 R651 E656 H657	T535-M653 HydrophobicContact CG2-SD 4.47Å; L539-M653 HydrophobicContact CD2-CE 3.74Å; L539-M653 HydrophobicContact CD2-SD 4.08Å; L539-M653 HydrophobicContact CG-CE 4.16Å; L539-M653 HydrophobicContact CG-SD 3.95Å; F649-M653 HydrophobicContact CD1-CE 4.47Å; F649-M653 HydrophobicContact CE1-CE 3.44Å; F649-M653 VanDerWaalsContact CE1-CE 3.44Å; F649-M653 HydrophobicContact CE1-SD 4.41Å; F649-M653 HydrophobicContact CZ-CE 3.76Å; F649-M653 PolarHBondContact O-N 3.37Å; T650-M653 PolarHBondContact O-N 3.36Å; R651-M653 VanDerWaalsContact C-N 3.3Å; R651-M653 PolarHBondContact O-N 3.18Å; M653-E656 PolarHBondContact O-N 3.42Å; M653-H657 PolarHBondContact O-N 3.11Å; M653-H657 PolarHBondContact O-ND1 3.44Å
654	V	95.1	Very high	95.3	Very high	1 Å²	1	65.4 Å²	65.4	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-68.1	-36.1	177	174.4	0	0	0	0	111.1	T535 A587 I591 T650 R651 H657 R658 V661	T535-V654 HydrophobicContact CG2-CG2 3.49Å; T535-V654 VanDerWaalsContact CG2-CG2 3.49Å; A587-V654 HydrophobicContact CB-CG2 4.28Å; I591-V654 HydrophobicContact CD1-CB 3.66Å; I591-V654 HydrophobicContact CD1-CG1 3.47Å; I591-V654 VanDerWaalsContact CD1-CG1 3.47Å; T650-V654 HydrophobicContact CG2-CG2 4.2Å; T650-V654 VanDerWaalsContact O-CG2 3.31Å; T650-V654 WeakPolarHBondContact O-CG2 3.18Å; T650-V654 PolarHBondContact O-N 3.47Å; R651-V654 PolarHBondContact O-N 2.7Å; V654-H657 CarbonylContact O-C 3.46Å; V654-R658 VanDerWaalsContact O-CA 3.3Å; V654-R658 WeakPolarHBondContact O-CA 3.35Å; V654-R658 PolarHBondContact O-N 3.34Å; V654-V661 HydrophobicContact CG1-CG2 4.31Å
655	E	95.2	Very high	95.3	Very high	117 Å²	117	62.6 Å²	62.6	55%	0.547	28%	0.278	S	S	.	.	H	α-helix	trans	-65.3	-45.1	172.6	-75.5	175.4	-179.5	0	0	112.1	I591 R651 K652 H657 R658	I591-E655 HydrophobicContact CD1-CG 3.75Å; I591-E655 HydrophobicContact CG1-CG 4.2Å; I591-E655 HydrophobicContact CG2-CG 4.4Å; R651-E655 WeakPolarHBondContact O-CG 3.31Å; R651-E655 PolarHBondContact O-N 3.01Å; K652-E655 PolarHBondContact O-N 3.21Å; E655-H657 VanDerWaalsContact C-N 3.29Å; E655-H657 PolarHBondContact O-N 3.28Å; E655-R658 WeakPolarHBondContact O-CB 3.4Å; E655-R658 PolarHBondContact O-N 3.3Å
656	E	95.2	Very high	95.4	Very high	121 Å²	121	64.7 Å²	64.7	57%	0.565	29%	0.285	S	S	*	.	H	α-helix	trans	-61.6	-36.5	177	-75	172.2	-177	0	0	112	K652 M653	K652-E656 WeakPolarHBondContact CE-OE1 3.5Å; K652-E656 IonicContact NZ-OE1 2.86Å; K652-E656 WeakPolarHBondContact O-CB 3.5Å; K652-E656 WeakPolarHBondContact O-CG 3.2Å; K652-E656 PolarHBondContact O-N 3.02Å; M653-E656 PolarHBondContact O-N 3.42Å
657	H	94.3	Very high	95.4	Very high	53 Å²	53	66.9 Å²	66.9	25%	0.245	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	26.4	-179.1	-58.5	84	0	0	0	113.1	V534 F538 M653 V654 E655 E659 G660 V661	V534-H657 HydrophobicContact CG1-CB 3.87Å; F538-H657 AromaticContact CD1-CD2 3.99Å; F538-H657 AromaticContact CD1-NE2 3.65Å; F538-H657 HydrophobicContact CD2-CB 4.43Å; F538-H657 AromaticContact CD2-CD2 3.54Å; F538-H657 AromaticContact CD2-CG 3.86Å; F538-H657 AromaticContact CD2-NE2 3.92Å; F538-H657 AromaticContact CE1-CD2 3.82Å; F538-H657 AromaticContact CE1-NE2 3.79Å; F538-H657 HydrophobicContact CE2-CB 4.32Å; F538-H657 AromaticContact CE2-CD2 3.37Å; F538-H657 WeakPolarHBondContact CE2-CD2 3.49Å; F538-H657 AromaticContact CE2-CG 3.93Å; F538-H657 AromaticContact CG-CD2 3.87Å; F538-H657 AromaticContact CG-NE2 3.73Å; F538-H657 AromaticContact CZ-CD2 3.52Å; F538-H657 AromaticContact CZ-NE2 4Å; M653-H657 PolarHBondContact O-N 3.11Å; M653-H657 PolarHBondContact O-ND1 3.44Å; V654-H657 CarbonylContact O-C 3.46Å; E655-H657 VanDerWaalsContact C-N 3.29Å; E655-H657 PolarHBondContact O-N 3.28Å; H657-E659 VanDerWaalsContact C-N 3.29Å; H657-E659 PolarHBondContact O-N 3.37Å; H657-G660 WeakPolarHBondContact O-CA 3.29Å; H657-G660 PolarHBondContact O-N 3.12Å; H657-V661 PolarHBondContact O-N 3.22Å; H657-V661 VanDerWaalsContact O-N 3.16Å
658	R	94.2	Very high	95.4	Very high	115 Å²	115	65.3 Å²	65.3	43%	0.434	28%	0.284	S	S	.	.	H	α-helix	trans	-53.2	-43.9	-175.3	-175.1	-177.5	176.5	115.8	4.1	112.7	F592 V654 E655 G660 V661 E662	F592-R658 HydrophobicContact CE1-CG 3.83Å; F592-R658 HydrophobicContact CE2-CG 4.43Å; F592-R658 HydrophobicContact CZ-CG 3.54Å; F592-R658 WeakPolarHBondContact CZ-O 3.4Å; V654-R658 VanDerWaalsContact O-CA 3.3Å; V654-R658 WeakPolarHBondContact O-CA 3.35Å; V654-R658 PolarHBondContact O-N 3.34Å; E655-R658 WeakPolarHBondContact O-CB 3.4Å; E655-R658 PolarHBondContact O-N 3.3Å; R658-G660 VanDerWaalsContact C-N 3.3Å; R658-G660 PolarHBondContact O-N 3.31Å; R658-V661 PolarHBondContact O-N 3.17Å; R658-E662 PolarHBondContact O-N 3.44Å
659	E	94.8	Very high	95.3	Very high	142 Å²	142	59.6 Å²	59.6	66%	0.664	27%	0.266	S	S	*	.	H	α-helix	trans	-62.8	-36.2	178.2	-64.6	-173.2	178.8	0	0	112.8	H657 E662 K663	H657-E659 VanDerWaalsContact C-N 3.29Å; H657-E659 PolarHBondContact O-N 3.37Å; E659-E662 PolarHBondContact O-N 3.07Å; E659-K663 VanDerWaalsContact O-CG 3.32Å; E659-K663 WeakPolarHBondContact O-CG 3.39Å; E659-K663 PolarHBondContact O-N 3.02Å
660	G	94.2	Very high	95.2	Very high	12 Å²	12	62.5 Å²	62.5	12%	0.124	28%	0.281	C	S	.	.	H	α-helix	trans	-65.5	-44.2	177.3	0	0	0	0	0	111.6	H657 R658 E662 K663 V664	H657-G660 WeakPolarHBondContact O-CA 3.29Å; H657-G660 PolarHBondContact O-N 3.12Å; R658-G660 VanDerWaalsContact C-N 3.3Å; R658-G660 PolarHBondContact O-N 3.31Å; G660-E662 PolarHBondContact O-N 2.69Å; G660-K663 PolarHBondContact O-N 2.86Å; G660-V664 WeakPolarHBondContact O-CG2 3.4Å; G660-V664 PolarHBondContact O-N 2.96Å
661	V	95.4	Very high	95	Very high	0 Å²	0	69 Å²	69	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.6	-44.3	176.3	-177.8	0	0	0	0	111	Y527 A530 V534 F592 V654 H657 R658 K663 V664 A665	Y527-V661 HydrophobicContact CD1-CG1 4.38Å; A530-V661 HydrophobicContact CB-CG1 3.89Å; V534-V661 HydrophobicContact CB-CG2 3.78Å; V534-V661 HydrophobicContact CG1-CG2 3.78Å; V534-V661 HydrophobicContact CG2-CB 4.41Å; V534-V661 HydrophobicContact CG2-CG2 3.82Å; F592-V661 HydrophobicContact CD2-CG1 4.38Å; F592-V661 HydrophobicContact CE2-CB 3.86Å; F592-V661 HydrophobicContact CE2-CG1 3.55Å; F592-V661 HydrophobicContact CZ-CB 3.98Å; F592-V661 HydrophobicContact CZ-CG1 4.05Å; V654-V661 HydrophobicContact CG1-CG2 4.31Å; H657-V661 PolarHBondContact O-N 3.22Å; H657-V661 VanDerWaalsContact O-N 3.16Å; R658-V661 PolarHBondContact O-N 3.17Å; V661-K663 PolarHBondContact O-N 3.09Å; V661-V664 PolarHBondContact O-N 2.71Å; V661-A665 VanDerWaalsContact O-CB 3.26Å; V661-A665 WeakPolarHBondContact O-CB 3.1Å; V661-A665 PolarHBondContact O-N 3.36Å
662	E	96.3	Very high	94.7	Very high	67 Å²	67	68.7 Å²	68.7	31%	0.313	31%	0.308	S	S	.	.	H	α-helix	trans	-64	-41.4	179.3	-173.2	176	172.7	0	0	112.4	F592 R658 E659 G660 K666	F592-E662 HydrophobicContact CE1-CB 4.28Å; F592-E662 HydrophobicContact CZ-CB 4.44Å; R658-E662 PolarHBondContact O-N 3.44Å; E659-E662 PolarHBondContact O-N 3.07Å; G660-E662 PolarHBondContact O-N 2.69Å; E662-K666 HydrophobicContact CG-CD 4.23Å; E662-K666 WeakPolarHBondContact O-CB 3.32Å; E662-K666 VanDerWaalsContact O-CG 3.31Å; E662-K666 WeakPolarHBondContact O-CG 3.26Å; E662-K666 PolarHBondContact O-N 2.88Å; E662-K666 WeakPolarHBondContact OE1-CE 3.32Å; E662-K666 IonicContact OE1-NZ 2.63Å; E662-K666 PolarHBondContact OE1-NZ 3.2Å
663	K	95.7	Very high	94.5	Very high	109 Å²	109	64.3 Å²	64.3	47%	0.474	29%	0.292	S	S	.	.	H	α-helix	trans	-61.9	-47.5	175.7	-75.1	172.7	-175.5	172.6	0	111.9	E659 G660 V661 R667	E659-K663 VanDerWaalsContact O-CG 3.32Å; E659-K663 WeakPolarHBondContact O-CG 3.39Å; E659-K663 PolarHBondContact O-N 3.02Å; G660-K663 PolarHBondContact O-N 2.86Å; V661-K663 PolarHBondContact O-N 3.09Å; K663-R667 PolarHBondContact O-N 2.96Å; K663-R667 VanDerWaalsContact O-N 3.07Å
664	V	96.1	Very high	94.5	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.5	-45.7	179.2	174	0	0	0	0	110.6	A530 V534 G660 V661 K666 R667 L668 L674 L679 L682 L683	A530-V664 HydrophobicContact CB-CB 4.13Å; A530-V664 HydrophobicContact CB-CG1 3.84Å; V534-V664 HydrophobicContact CG2-CG2 4.17Å; G660-V664 WeakPolarHBondContact O-CG2 3.4Å; G660-V664 PolarHBondContact O-N 2.96Å; V661-V664 PolarHBondContact O-N 2.71Å; V664-K666 PolarHBondContact O-N 3.43Å; V664-R667 PolarHBondContact O-N 3.38Å; V664-L668 HydrophobicContact CG1-CD1 4.04Å; V664-L668 HydrophobicContact CG1-CG 4.45Å; V664-L668 WeakPolarHBondContact O-CB 3.16Å; V664-L668 WeakPolarHBondContact O-CG 3.3Å; V664-L668 PolarHBondContact O-N 3.06Å; V664-L674 HydrophobicContact CG1-CD1 4.03Å; V664-L679 HydrophobicContact CG1-CD2 3.95Å; V664-L679 HydrophobicContact CG2-CD2 3.88Å; V664-L682 HydrophobicContact CG2-CB 4.5Å; V664-L682 HydrophobicContact CG2-CD1 4.16Å; V664-L683 HydrophobicContact CG2-CD1 4.17Å; V664-L683 HydrophobicContact CG2-CD2 4.05Å; V664-L683 HydrophobicContact CG2-CG 4.12Å
665	A	95.7	Very high	94.2	Very high	0 Å²	0	65 Å²	65	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.5	-43.6	178.8	0	0	0	0	0	112.4	Y527 A530 V661 L668 L669	Y527-A665 HydrophobicContact CD1-CB 3.88Å; Y527-A665 HydrophobicContact CD2-CB 3.96Å; Y527-A665 HydrophobicContact CE1-CB 3.92Å; Y527-A665 HydrophobicContact CE2-CB 4.02Å; Y527-A665 HydrophobicContact CG-CB 3.91Å; A530-A665 HydrophobicContact CB-CB 3.9Å; V661-A665 VanDerWaalsContact O-CB 3.26Å; V661-A665 WeakPolarHBondContact O-CB 3.1Å; V661-A665 PolarHBondContact O-N 3.36Å; A665-L668 WeakPolarHBondContact O-CB 3.47Å; A665-L668 PolarHBondContact O-N 3.31Å; A665-L669 WeakPolarHBondContact O-CG 3.32Å; A665-L669 PolarHBondContact O-N 3.13Å
666	K	96.2	Very high	93.9	Very high	101 Å²	101	61.9 Å²	61.9	44%	0.439	28%	0.282	S	S	.	.	H	α-helix	trans	-62.8	-45.1	176.2	-74.7	176.8	-175.7	172.2	0	111.9	E662 V664 L668 L669 E670	E662-K666 HydrophobicContact CG-CD 4.23Å; E662-K666 WeakPolarHBondContact O-CB 3.32Å; E662-K666 VanDerWaalsContact O-CG 3.31Å; E662-K666 WeakPolarHBondContact O-CG 3.26Å; E662-K666 PolarHBondContact O-N 2.88Å; E662-K666 WeakPolarHBondContact OE1-CE 3.32Å; E662-K666 IonicContact OE1-NZ 2.63Å; E662-K666 PolarHBondContact OE1-NZ 3.2Å; V664-K666 PolarHBondContact O-N 3.43Å; K666-L668 VanDerWaalsContact C-N 3.31Å; K666-L668 PolarHBondContact O-N 3.48Å; K666-L669 WeakPolarHBondContact O-CB 3.39Å; K666-L669 PolarHBondContact O-N 2.75Å; K666-L669 VanDerWaalsContact O-N 3.14Å; K666-E670 PolarHBondContact O-N 3.39Å
667	R	95.5	Very high	93.6	Very high	46 Å²	46	62.1 Å²	62.1	17%	0.174	28%	0.283	C	S	.	.	H	α-helix	trans	-66.1	-34.5	177.6	-166.9	72.8	75.6	90.4	-5	111.8	K663 V664 L669 E670 R671 L674 E681 L682	K663-R667 PolarHBondContact O-N 2.96Å; K663-R667 VanDerWaalsContact O-N 3.07Å; V664-R667 PolarHBondContact O-N 3.38Å; R667-L669 VanDerWaalsContact C-N 3.32Å; R667-L669 PolarHBondContact O-N 3.49Å; R667-E670 PolarHBondContact O-N 2.86Å; R667-R671 PolarHBondContact O-N 3.04Å; R667-L674 HydrophobicContact CB-CD1 4.15Å; R667-L674 HydrophobicContact CB-CD2 4.17Å; R667-L674 HydrophobicContact CG-CD1 4.29Å; R667-L674 HydrophobicContact CG-CD2 3.45Å; R667-L674 VanDerWaalsContact CG-CD2 3.45Å; R667-E681 IonicContact CZ-OE1 3.34Å; R667-E681 IonicContact NH1-OE1 3.41Å; R667-E681 PolarHBondContact NH1-OE1 3.47Å; R667-E681 IonicContact NH1-OE2 3.51Å; R667-E681 IonicContact NH2-OE1 2.68Å; R667-E681 PolarHBondContact NH2-OE1 3.07Å; R667-L682 HydrophobicContact CB-CD1 3.9Å; R667-L682 HydrophobicContact CG-CD1 4.16Å
668	L	94.8	Very high	93.5	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-38.6	171.6	-79.4	169	0	0	0	112	A526 E529 A530 V548 I550 V664 A665 K666 E670 E672 L674	A526-L668 HydrophobicContact CB-CB 4.29Å; E529-L668 HydrophobicContact CB-CD1 4.38Å; A530-L668 HydrophobicContact CB-CD1 4.31Å; V548-L668 HydrophobicContact CB-CD2 4.27Å; V548-L668 HydrophobicContact CG1-CD1 3.92Å; V548-L668 HydrophobicContact CG1-CD2 3.97Å; I550-L668 WeakPolarHBondContact CD1-O 3.48Å; I550-L668 HydrophobicContact CG2-CB 4.27Å; I550-L668 HydrophobicContact CG2-CD1 4.36Å; I550-L668 HydrophobicContact CG2-CD2 4.39Å; V664-L668 HydrophobicContact CG1-CD1 4.04Å; V664-L668 HydrophobicContact CG1-CG 4.45Å; V664-L668 WeakPolarHBondContact O-CB 3.16Å; V664-L668 WeakPolarHBondContact O-CG 3.3Å; V664-L668 PolarHBondContact O-N 3.06Å; A665-L668 WeakPolarHBondContact O-CB 3.47Å; A665-L668 PolarHBondContact O-N 3.31Å; K666-L668 VanDerWaalsContact C-N 3.31Å; K666-L668 PolarHBondContact O-N 3.48Å; L668-E670 VanDerWaalsContact C-N 3.28Å; L668-E670 PolarHBondContact O-N 3.04Å; L668-E672 WeakPolarHBondContact O-CA 3.43Å; L668-E672 PolarHBondContact O-N 3.39Å; L668-L674 HydrophobicContact CD2-CB 4.33Å; L668-L674 HydrophobicContact CD2-CD1 3.88Å; L668-L674 HydrophobicContact CD2-CG 3.72Å; L668-L674 HydrophobicContact CG-CD1 3.68Å; L668-L674 HydrophobicContact CG-CG 4.07Å
669	L	94	Very high	93.4	Very high	48 Å²	48	55.2 Å²	55.2	25%	0.251	26%	0.256	S	S	.	.	H	α-helix	trans	-67	-29.6	176.7	-69.6	170.1	0	0	0	113	K522 T523 A526 I550 A665 K666 R667	K522-L669 HydrophobicContact CD-CD2 4.35Å; K522-L669 HydrophobicContact CG-CD2 3.95Å; T523-L669 HydrophobicContact CG2-CD1 4.3Å; A526-L669 HydrophobicContact CB-CD1 4.47Å; A526-L669 HydrophobicContact CB-CD2 3.75Å; A526-L669 HydrophobicContact CB-CG 3.8Å; I550-L669 HydrophobicContact CD1-CD2 4.26Å; A665-L669 WeakPolarHBondContact O-CG 3.32Å; A665-L669 PolarHBondContact O-N 3.13Å; K666-L669 WeakPolarHBondContact O-CB 3.39Å; K666-L669 PolarHBondContact O-N 2.75Å; K666-L669 VanDerWaalsContact O-N 3.14Å; R667-L669 VanDerWaalsContact C-N 3.32Å; R667-L669 PolarHBondContact O-N 3.49Å
670	E	94.1	Very high	93.2	Very high	144 Å²	144	51.1 Å²	51.1	67%	0.673	24%	0.239	S	C	*	.	H	α-helix	trans	-79.9	-47.2	177.9	-68.3	172.9	-177.2	0	0	113.4	K666 R667 L668	K666-E670 PolarHBondContact O-N 3.39Å; R667-E670 PolarHBondContact O-N 2.86Å; L668-E670 VanDerWaalsContact C-N 3.28Å; L668-E670 PolarHBondContact O-N 3.04Å
671	R	91.5	Very high	93.2	Very high	137 Å²	137	56.5 Å²	56.5	52%	0.517	26%	0.26	S	S	.	.	H	α-helix	trans	-104.1	-11.2	-173	-68.4	-168.8	177.6	-179.1	1.7	114.9	R667 V673 L674 D678	R667-R671 PolarHBondContact O-N 3.04Å; R671-V673 PolarHBondContact O-N 3.14Å; R671-L674 HydrophobicContact CB-CD2 4.4Å; R671-D678 IonicContact NH1-OD1 2.87Å; R671-D678 PolarHBondContact NH1-OD1 3.07Å; R671-D678 IonicContact NH1-OD2 3.52Å
672	E	91.1	Very high	93.1	Very high	80 Å²	80	57.9 Å²	57.9	37%	0.374	27%	0.268	S	S	.	.	S	Bend	trans	63.1	-17.2	-175.3	-51.2	-173.7	141	0	0	116	K522 S549 I550 I551 L668	K522-E672 IonicContact NZ-OE1 2.69Å; K522-E672 PolarHBondContact NZ-OE1 2.95Å; S549-E672 VanDerWaalsContact CA-O 3.32Å; S549-E672 WeakPolarHBondContact CA-O 3.08Å; S549-E672 PolarHBondContact OG-O 3.37Å; I550-E672 HydrophobicContact CG1-CB 4.09Å; I550-E672 WeakPolarHBondContact CG1-O 3.47Å; I550-E672 PolarHBondContact N-O 3.48Å; I551-E672 HydrophobicContact CD1-CB 4.22Å; I551-E672 HydrophobicContact CG1-CB 3.92Å; L668-E672 WeakPolarHBondContact O-CA 3.43Å; L668-E672 PolarHBondContact O-N 3.39Å
673	V	91.4	Very high	92.9	Very high	37 Å²	37	56.1 Å²	56.1	22%	0.224	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	133.8	-174.3	176.1	0	0	0	0	108.4	K547 V548 S549 I551 R671	K547-V673 HydrophobicContact CD-CG1 4.17Å; K547-V673 HydrophobicContact CG-CG1 4.12Å; V548-V673 CarbonylContact O-C 3.57Å; V548-V673 WeakPolarHBondContact O-CA 3.48Å; S549-V673 WeakPolarHBondContact OG-CG2 3.22Å; I551-V673 HydrophobicContact CD1-CG2 3.58Å; I551-V673 HydrophobicContact CG1-CG2 4.32Å; R671-V673 PolarHBondContact O-N 3.14Å
674	L	93	Very high	92.7	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133	171.3	-59.8	178.9	0	0	0	110.4	K547 V548 V664 R667 L668 R671 D678 L679 L682	K547-L674 WeakPolarHBondContact CA-O 3.41Å; K547-L674 WeakPolarHBondContact CG-O 3.48Å; V548-L674 PolarHBondContact N-O 3.06Å; V548-L674 PolarHBondContact O-N 3.01Å; V664-L674 HydrophobicContact CG1-CD1 4.03Å; R667-L674 HydrophobicContact CB-CD1 4.15Å; R667-L674 HydrophobicContact CB-CD2 4.17Å; R667-L674 HydrophobicContact CG-CD1 4.29Å; R667-L674 HydrophobicContact CG-CD2 3.45Å; R667-L674 VanDerWaalsContact CG-CD2 3.45Å; L668-L674 HydrophobicContact CD2-CB 4.33Å; L668-L674 HydrophobicContact CD2-CD1 3.88Å; L668-L674 HydrophobicContact CD2-CG 3.72Å; L668-L674 HydrophobicContact CG-CD1 3.68Å; L668-L674 HydrophobicContact CG-CG 4.07Å; R671-L674 HydrophobicContact CB-CD2 4.4Å; L674-D678 HydrophobicContact CB-CB 4.15Å; L674-D678 HydrophobicContact CD2-CB 4.04Å; L674-L679 HydrophobicContact CD1-CD2 4.39Å; L674-L682 HydrophobicContact CD1-CD1 4.24Å
675	S	90.6	Very high	92.4	Very high	37 Å²	37	57.2 Å²	57.2	26%	0.259	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	172.8	169.8	76.9	0	0	0	0	111.1	E677 D678 L679	S675-E677 VanDerWaalsContact CB-OE2 3.22Å; S675-E677 WeakPolarHBondContact CB-OE2 3.43Å; S675-E677 PolarHBondContact O-N 3.31Å; S675-E677 PolarHBondContact OG-N 3.46Å; S675-E677 PolarHBondContact OG-OE2 2.95Å; S675-D678 PolarHBondContact N-OD2 3.44Å; S675-D678 VanDerWaalsContact N-OD2 3.08Å; S675-D678 PolarHBondContact O-N 2.87Å; S675-L679 PolarHBondContact O-N 3.32Å
676	R	87.5	Confident	92.1	Very high	50 Å²	50	58.4 Å²	58.4	19%	0.189	29%	0.287	C	S	.	.	H	α-helix	trans	-57.2	-38.1	173.6	-177.4	174.1	178.1	-91.6	2.7	112.3	W537 L546 L679 I680 E690	W537-R676 HydrophobicContact CH2-CG 4.15Å; W537-R676 HydrophobicContact CZ3-CG 4.25Å; L546-R676 PolarHBondContact O-N 3.27Å; L546-R676 VanDerWaalsContact O-N 3.11Å; R676-L679 WeakPolarHBondContact O-CB 3.12Å; R676-L679 PolarHBondContact O-N 2.97Å; R676-I680 HydrophobicContact CG-CD1 4.13Å; R676-I680 WeakPolarHBondContact O-CG1 3.31Å; R676-I680 PolarHBondContact O-N 3.22Å; R676-E690 IonicContact CZ-OE2 3.7Å; R676-E690 IonicContact NE-OE2 3.09Å; R676-E690 PolarHBondContact NE-OE2 3.25Å; R676-E690 IonicContact NH2-OE2 3.07Å; R676-E690 PolarHBondContact NH2-OE2 3.48Å
677	E	89.8	Confident	91.8	Very high	126 Å²	126	57.3 Å²	57.3	59%	0.589	29%	0.291	S	S	*	.	H	α-helix	trans	-63.3	-42.4	179	-61.2	70.9	-149	0	0	111.5	S675 L679 I680 E681	S675-E677 VanDerWaalsContact CB-OE2 3.22Å; S675-E677 WeakPolarHBondContact CB-OE2 3.43Å; S675-E677 PolarHBondContact O-N 3.31Å; S675-E677 PolarHBondContact OG-N 3.46Å; S675-E677 PolarHBondContact OG-OE2 2.95Å; E677-L679 VanDerWaalsContact C-N 3.27Å; E677-L679 PolarHBondContact O-N 2.83Å; E677-I680 PolarHBondContact O-N 3.44Å; E677-E681 PolarHBondContact O-N 2.87Å
678	D	92.1	Very high	91.4	Very high	22 Å²	22	58.1 Å²	58.1	12%	0.118	30%	0.296	C	S	.	.	H	α-helix	trans	-62.1	-36.8	175	-65.3	-50.9	0	0	0	111.2	R671 L674 S675 E681 L682	R671-D678 IonicContact NH1-OD1 2.87Å; R671-D678 PolarHBondContact NH1-OD1 3.07Å; R671-D678 IonicContact NH1-OD2 3.52Å; L674-D678 HydrophobicContact CB-CB 4.15Å; L674-D678 HydrophobicContact CD2-CB 4.04Å; S675-D678 PolarHBondContact N-OD2 3.44Å; S675-D678 VanDerWaalsContact N-OD2 3.08Å; S675-D678 PolarHBondContact O-N 2.87Å; D678-E681 WeakPolarHBondContact O-CB 3.46Å; D678-E681 PolarHBondContact O-N 3.31Å; D678-L682 VanDerWaalsContact O-CG 3.28Å; D678-L682 WeakPolarHBondContact O-CG 3.45Å; D678-L682 PolarHBondContact O-N 2.73Å; D678-L682 VanDerWaalsContact O-N 3.13Å
679	L	90.9	Very high	90.9	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-70.5	-37	177.3	-68.6	171.5	0	0	0	112.5	W537 L545 V548 V664 L674 S675 R676 E677 E681 L682 L683	W537-L679 HydrophobicContact CH2-CB 4.39Å; W537-L679 HydrophobicContact CZ3-CB 4.27Å; L545-L679 HydrophobicContact CD2-CD1 3.34Å; L545-L679 HydrophobicContact CG-CD1 4.04Å; V548-L679 HydrophobicContact CG2-CD1 4.4Å; V664-L679 HydrophobicContact CG1-CD2 3.95Å; V664-L679 HydrophobicContact CG2-CD2 3.88Å; L674-L679 HydrophobicContact CD1-CD2 4.39Å; S675-L679 PolarHBondContact O-N 3.32Å; R676-L679 WeakPolarHBondContact O-CB 3.12Å; R676-L679 PolarHBondContact O-N 2.97Å; E677-L679 VanDerWaalsContact C-N 3.27Å; E677-L679 PolarHBondContact O-N 2.83Å; L679-E681 VanDerWaalsContact C-N 3.3Å; L679-E681 PolarHBondContact O-N 3.39Å; L679-L682 PolarHBondContact O-N 3.19Å; L679-L683 WeakPolarHBondContact O-CB 3.33Å; L679-L683 PolarHBondContact O-N 2.95Å
680	I	92.1	Very high	90.1	Very high	56 Å²	56	63.6 Å²	63.6	29%	0.287	33%	0.331	S	S	.	.	H	α-helix	trans	-63.5	-39.1	173.3	-65.8	166	0	0	0	110.3	W537 R676 E677 L682 G684	W537-I680 HydrophobicContact CH2-CD1 4.44Å; W537-I680 HydrophobicContact CH2-CG1 3.62Å; W537-I680 HydrophobicContact CZ2-CG1 3.75Å; R676-I680 HydrophobicContact CG-CD1 4.13Å; R676-I680 WeakPolarHBondContact O-CG1 3.31Å; R676-I680 PolarHBondContact O-N 3.22Å; E677-I680 PolarHBondContact O-N 3.44Å; I680-L682 VanDerWaalsContact C-N 3.32Å; I680-L682 PolarHBondContact O-N 3.42Å; I680-G684 CarbonylContact O-C 3.58Å; I680-G684 WeakPolarHBondContact O-CA 3.14Å; I680-G684 PolarHBondContact O-N 3.39Å
681	E	93.5	Very high	89.2	Confident	125 Å²	125	61.9 Å²	61.9	58%	0.584	32%	0.321	S	S	*	.	H	α-helix	trans	-60.4	-41.3	174.2	-173.1	-164.4	131.2	0	0	111.6	R667 E677 D678 L679	R667-E681 IonicContact CZ-OE1 3.34Å; R667-E681 IonicContact NH1-OE1 3.41Å; R667-E681 PolarHBondContact NH1-OE1 3.47Å; R667-E681 IonicContact NH1-OE2 3.51Å; R667-E681 IonicContact NH2-OE1 2.68Å; R667-E681 PolarHBondContact NH2-OE1 3.07Å; E677-E681 PolarHBondContact O-N 2.87Å; D678-E681 WeakPolarHBondContact O-CB 3.46Å; D678-E681 PolarHBondContact O-N 3.31Å; L679-E681 VanDerWaalsContact C-N 3.3Å; L679-E681 PolarHBondContact O-N 3.39Å
682	L	92.6	Very high	88.3	Confident	30 Å²	30	58.9 Å²	58.9	16%	0.157	31%	0.313	C	S	.	.	H	α-helix	trans	-83.7	-40.4	-174.1	-67.6	173.2	0	0	0	114.4	V664 R667 L674 D678 L679 I680	V664-L682 HydrophobicContact CG2-CB 4.5Å; V664-L682 HydrophobicContact CG2-CD1 4.16Å; R667-L682 HydrophobicContact CB-CD1 3.9Å; R667-L682 HydrophobicContact CG-CD1 4.16Å; L674-L682 HydrophobicContact CD1-CD1 4.24Å; D678-L682 VanDerWaalsContact O-CG 3.28Å; D678-L682 WeakPolarHBondContact O-CG 3.45Å; D678-L682 PolarHBondContact O-N 2.73Å; D678-L682 VanDerWaalsContact O-N 3.13Å; L679-L682 PolarHBondContact O-N 3.19Å; I680-L682 VanDerWaalsContact C-N 3.32Å; I680-L682 PolarHBondContact O-N 3.42Å
683	L	92.6	Very high	87.6	Confident	30 Å²	30	57.3 Å²	57.3	16%	0.157	31%	0.309	C	S	.	.	H	α-helix	trans	-107.8	-11.9	-172.1	-59	177.2	0	0	0	113.2	V534 W537 V664 L679	V534-L683 HydrophobicContact CG2-CD1 4.13Å; V534-L683 HydrophobicContact CG2-CD2 4.36Å; W537-L683 HydrophobicContact CB-CD1 4.25Å; W537-L683 HydrophobicContact CD2-CD1 4.36Å; W537-L683 HydrophobicContact CG-CD1 3.94Å; V664-L683 HydrophobicContact CG2-CD1 4.17Å; V664-L683 HydrophobicContact CG2-CD2 4.05Å; V664-L683 HydrophobicContact CG2-CG 4.12Å; L679-L683 WeakPolarHBondContact O-CB 3.33Å; L679-L683 PolarHBondContact O-N 2.95Å
684	G	91.9	Very high	86.9	Confident	23 Å²	23	55.8 Å²	55.8	24%	0.237	30%	0.299	C	S	.	.			trans	82.4	176.1	-168.2	0	0	0	0	0	112.9	W537 I680	W537-G684 WeakPolarHBondContact CZ2-O 3.46Å; W537-G684 PolarHBondContact NE1-O 3.41Å; I680-G684 CarbonylContact O-C 3.58Å; I680-G684 WeakPolarHBondContact O-CA 3.14Å; I680-G684 PolarHBondContact O-N 3.39Å
685	P	89.5	Confident	86.4	Confident	108 Å²	108	59.2 Å²	59.2	70%	0.701	32%	0.315	S	S	*	.	S	Bend	trans	-61.8	144.2	176.7	28	-34.5	0	0	0	110.7
686	R	89.2	Confident	85.9	Confident	25 Å²	25	60 Å²	60	9%	0.094	32%	0.315	C	S	.	.			trans	-58.7	134.1	177	-167.2	177.5	-179.8	-174.6	-4.2	109.8	G536 W537 L539 A542 F688 E690	G536-R686 PolarHBondContact O-NH2 2.88Å; W537-R686 HydrophobicContact CD2-CB 4.4Å; W537-R686 HydrophobicContact CD2-CG 4.46Å; W537-R686 HydrophobicContact CZ2-CB 3.96Å; W537-R686 VanDerWaalsContact O-CG 3.27Å; W537-R686 WeakPolarHBondContact O-CG 3.41Å; W537-R686 PolarHBondContact O-NE 2.83Å; W537-R686 VanDerWaalsContact O-NE 3.09Å; L539-R686 PolarHBondContact O-NH2 2.99Å; A542-R686 PolarHBondContact O-NH1 2.98Å; A542-R686 PolarHBondContact O-NH2 3.27Å; R686-F688 PolarHBondContact O-N 2.65Å; R686-F688 VanDerWaalsContact O-N 3.08Å; R686-E690 WeakPolarHBondContact CD-OE1 3.48Å; R686-E690 IonicContact CZ-OE1 3.34Å; R686-E690 IonicContact NE-OE1 2.73Å; R686-E690 IonicContact NH1-OE1 2.63Å; R686-E690 PolarHBondContact NH1-OE1 3.16Å
687	P	89.2	Confident	85.5	Confident	79 Å²	79	60 Å²	60	51%	0.513	32%	0.316	S	S	.	.	S	Bend	trans	-72.6	1.5	-177.4	27.6	-34.2	0	0	0	114.5	F538	F538-P687 HydrophobicContact CD1-CG 4.17Å
688	F	89	Confident	85.1	Confident	63 Å²	63	54.1 Å²	54.1	28%	0.276	29%	0.289	S	S	.	.	S	Bend	trans	-125.7	147.5	-177.5	-58.2	-72.2	0	0	0	111.1	F538 E540 R686 E690	F538-F688 WeakPolarHBondContact O-CE2 3.44Å; E540-F688 HydrophobicContact CB-CD1 3.82Å; E540-F688 HydrophobicContact CB-CD2 4.18Å; E540-F688 HydrophobicContact CB-CE1 3.69Å; E540-F688 HydrophobicContact CB-CE2 4.07Å; E540-F688 HydrophobicContact CB-CG 4.05Å; E540-F688 HydrophobicContact CB-CZ 3.83Å; E540-F688 HydrophobicContact CG-CD1 3.6Å; E540-F688 HydrophobicContact CG-CE1 3.85Å; E540-F688 HydrophobicContact CG-CG 4.04Å; E540-F688 HydrophobicContact CG-CZ 4.48Å; R686-F688 PolarHBondContact O-N 2.65Å; R686-F688 VanDerWaalsContact O-N 3.08Å; F688-E690 PolarHBondContact O-N 3.29Å
689	P	82.4	Confident	84.5	Confident	132 Å²	132	60.1 Å²	60.1	86%	0.857	32%	0.316	S	S	*	.			trans	-67.4	129.5	178.2	27.6	-33.6	0	0	0	111.1
690	E	77.6	Confident	83.7	Confident	30 Å²	30	63.4 Å²	63.4	14%	0.14	35%	0.351	C	S	.	.			trans	-120.4	141.8	177.4	-64	-179.3	137.6	0	0	111.3	P544 R676 R686 F688	P544-E690 WeakPolarHBondContact CB-OE1 3.36Å; P544-E690 HydrophobicContact CG-CG 4.37Å; R676-E690 IonicContact CZ-OE2 3.7Å; R676-E690 IonicContact NE-OE2 3.09Å; R676-E690 PolarHBondContact NE-OE2 3.25Å; R676-E690 IonicContact NH2-OE2 3.07Å; R676-E690 PolarHBondContact NH2-OE2 3.48Å; R686-E690 WeakPolarHBondContact CD-OE1 3.48Å; R686-E690 IonicContact CZ-OE1 3.34Å; R686-E690 IonicContact NE-OE1 2.73Å; R686-E690 IonicContact NH1-OE1 2.63Å; R686-E690 PolarHBondContact NH1-OE1 3.16Å; F688-E690 PolarHBondContact O-N 3.29Å
691	K	76.1	Confident	82.8	Confident	108 Å²	108	64.8 Å²	64.8	47%	0.47	36%	0.362	S	S	.	.			trans	-94.8	128.3	163.3	-62.1	-178.5	169.3	-148.1	0	108.2	Q696 F697	K691-Q696 HydrophobicContact CB-CB 4.1Å; K691-Q696 WeakPolarHBondContact CD-O 3.37Å; K691-Q696 WeakPolarHBondContact CE-O 3.21Å; K691-Q696 HydrophobicContact CG-CB 4.23Å; K691-Q696 PolarHBondContact NZ-O 3.32Å; K691-F697 HydrophobicContact CB-CD1 4Å; K691-F697 HydrophobicContact CB-CE1 3.73Å; K691-F697 HydrophobicContact CB-CZ 4.02Å; K691-F697 HydrophobicContact CD-CD1 4.44Å; K691-F697 WeakPolarHBondContact O-CZ 3.32Å
692	H	72.1	Confident	81.4	Confident	75 Å²	75	62.9 Å²	62.9	35%	0.347	38%	0.376	S	S	.	.			trans	-137.2	-25.6	-178.8	60.7	-78.3	0	0	0	113.3	Q696	H692-Q696 PolarHBondContact ND1-OE1 2.87Å; H692-Q696 VanDerWaalsContact ND1-OE1 3.14Å
693	T	75.9	Confident	80.5	Confident	46 Å²	46	63 Å²	63	28%	0.282	39%	0.385	S	S	.	.	S	Bend	trans	-89.5	153.7	175.2	66.6	0	0	0	0	111.6	E695 Q696 F697	T693-E695 PolarHBondContact O-N 3.32Å; T693-Q696 PolarHBondContact O-N 3.42Å; T693-Q696 VanDerWaalsContact O-N 3.15Å; T693-Q696 VanDerWaalsContact OG1-CD 3.31Å; T693-Q696 WeakPolarHBondContact OG1-CG 3.37Å; T693-Q696 PolarHBondContact OG1-N 3.13Å; T693-F697 WeakPolarHBondContact O-CD2 3.48Å; T693-F697 PolarHBondContact O-N 2.88Å; T693-F697 VanDerWaalsContact O-N 3.16Å
694	Y	78.1	Confident	79.7	Confident	5 Å²	5	66 Å²	66	2%	0.02	40%	0.4	C	S	.	.	H	α-helix	trans	-53.4	-44.3	175.6	176.2	-91.9	0	0	0	111.3	I436 A440 R461 A464 Q696 F697 V698 L704	I436-Y694 HydrophobicContact CD1-CD2 3.79Å; I436-Y694 HydrophobicContact CD1-CE2 4.3Å; I436-Y694 HydrophobicContact CG1-CD2 3.74Å; I436-Y694 HydrophobicContact CG1-CE2 3.86Å; A440-Y694 HydrophobicContact CB-CE2 3.86Å; R461-Y694 HydrophobicContact CB-CD1 3.87Å; R461-Y694 HydrophobicContact CB-CD2 4.12Å; R461-Y694 HydrophobicContact CB-CE1 4.4Å; R461-Y694 HydrophobicContact CB-CG 3.72Å; R461-Y694 HydrophobicContact CG-CD1 3.74Å; R461-Y694 HydrophobicContact CG-CD2 4.34Å; R461-Y694 HydrophobicContact CG-CE1 3.8Å; R461-Y694 HydrophobicContact CG-CE2 4.38Å; R461-Y694 HydrophobicContact CG-CG 4.04Å; A464-Y694 HydrophobicContact CB-CD2 4.45Å; Y694-Q696 VanDerWaalsContact C-N 3.35Å; Y694-Q696 PolarHBondContact O-N 2.99Å; Y694-F697 PolarHBondContact O-N 3.41Å; Y694-V698 HydrophobicContact CD1-CG2 4.25Å; Y694-V698 HydrophobicContact CD2-CG2 4.38Å; Y694-V698 HydrophobicContact CE1-CB 4.39Å; Y694-V698 HydrophobicContact CE1-CG2 3.86Å; Y694-V698 HydrophobicContact CE2-CG2 4.01Å; Y694-V698 HydrophobicContact CG-CG2 4.49Å; Y694-V698 WeakPolarHBondContact O-CB 3.49Å; Y694-V698 WeakPolarHBondContact O-CG2 3.2Å; Y694-V698 PolarHBondContact O-N 2.81Å; Y694-L704 WeakPolarHBondContact CE1-O 3.38Å; Y694-L704 PolarHBondContact OH-O 2.91Å
695	E	81.9	Confident	78.9	Confident	73 Å²	73	67.8 Å²	67.8	34%	0.341	41%	0.405	S	S	.	.	H	α-helix	trans	-58.7	-46.1	179.4	-63.5	71.8	-154.2	0	0	110.8	T693 F697 V698 E699 L704	T693-E695 PolarHBondContact O-N 3.32Å; E695-F697 VanDerWaalsContact C-N 3.32Å; E695-F697 PolarHBondContact O-N 2.88Å; E695-V698 PolarHBondContact O-N 3.49Å; E695-V698 VanDerWaalsContact O-N 3.08Å; E695-E699 WeakPolarHBondContact O-CB 3.31Å; E695-E699 WeakPolarHBondContact O-CG 3.43Å; E695-E699 PolarHBondContact O-N 2.94Å; E695-L704 HydrophobicContact CG-CD2 4.4Å
696	Q	81.1	Confident	78.1	Confident	52 Å²	52	64.9 Å²	64.9	24%	0.243	38%	0.383	C	S	.	.	H	α-helix	trans	-64.2	-34.1	179.1	-73	169.5	-3.6	0	0	113.4	K691 H692 T693 Y694 V698	K691-Q696 HydrophobicContact CB-CB 4.1Å; K691-Q696 WeakPolarHBondContact CD-O 3.37Å; K691-Q696 WeakPolarHBondContact CE-O 3.21Å; K691-Q696 HydrophobicContact CG-CB 4.23Å; K691-Q696 PolarHBondContact NZ-O 3.32Å; H692-Q696 PolarHBondContact ND1-OE1 2.87Å; H692-Q696 VanDerWaalsContact ND1-OE1 3.14Å; T693-Q696 PolarHBondContact O-N 3.42Å; T693-Q696 VanDerWaalsContact O-N 3.15Å; T693-Q696 VanDerWaalsContact OG1-CD 3.31Å; T693-Q696 WeakPolarHBondContact OG1-CG 3.37Å; T693-Q696 PolarHBondContact OG1-N 3.13Å; Y694-Q696 VanDerWaalsContact C-N 3.35Å; Y694-Q696 PolarHBondContact O-N 2.99Å; Q696-V698 VanDerWaalsContact C-N 3.35Å
697	F	77.8	Confident	76.9	Confident	51 Å²	51	70.5 Å²	70.5	22%	0.224	42%	0.415	C	S	.	.	H	α-helix	trans	-69	-37	174.2	-73.8	-64.8	0	0	0	111.6	I436 L563 K691 T693 Y694 E695	I436-F697 HydrophobicContact CD1-CB 3.61Å; I436-F697 HydrophobicContact CD1-CD2 3.87Å; I436-F697 HydrophobicContact CD1-CG 3.93Å; L563-F697 HydrophobicContact CD2-CE2 3.8Å; L563-F697 HydrophobicContact CD2-CZ 3.58Å; L563-F697 HydrophobicContact CG-CZ 4.43Å; K691-F697 HydrophobicContact CB-CD1 4Å; K691-F697 HydrophobicContact CB-CE1 3.73Å; K691-F697 HydrophobicContact CB-CZ 4.02Å; K691-F697 HydrophobicContact CD-CD1 4.44Å; K691-F697 WeakPolarHBondContact O-CZ 3.32Å; T693-F697 WeakPolarHBondContact O-CD2 3.48Å; T693-F697 PolarHBondContact O-N 2.88Å; T693-F697 VanDerWaalsContact O-N 3.16Å; Y694-F697 PolarHBondContact O-N 3.41Å; E695-F697 VanDerWaalsContact C-N 3.32Å; E695-F697 PolarHBondContact O-N 2.88Å
698	V	81.5	Confident	75.6	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.018	41%	0.409	C	S	.	.	H	α-helix	trans	-91.5	-22.5	-171.4	172.4	0	0	0	0	113.9	I436 K437 Y694 E695 Q696 G700 T701 G703	I436-V698 HydrophobicContact CG2-CG2 4Å; K437-V698 VanDerWaalsContact CE-CG1 3.5Å; K437-V698 HydrophobicContact CG-CG2 4.17Å; Y694-V698 HydrophobicContact CD1-CG2 4.25Å; Y694-V698 HydrophobicContact CD2-CG2 4.38Å; Y694-V698 HydrophobicContact CE1-CB 4.39Å; Y694-V698 HydrophobicContact CE1-CG2 3.86Å; Y694-V698 HydrophobicContact CE2-CG2 4.01Å; Y694-V698 HydrophobicContact CG-CG2 4.49Å; Y694-V698 WeakPolarHBondContact O-CB 3.49Å; Y694-V698 WeakPolarHBondContact O-CG2 3.2Å; Y694-V698 PolarHBondContact O-N 2.81Å; E695-V698 PolarHBondContact O-N 3.49Å; E695-V698 VanDerWaalsContact O-N 3.08Å; Q696-V698 VanDerWaalsContact C-N 3.35Å; V698-G700 PolarHBondContact O-N 3.08Å; V698-T701 PolarHBondContact O-N 3.2Å; V698-T701 PolarHBondContact O-OG1 2.98Å; V698-G703 WeakPolarHBondContact CG1-O 3.34Å
699	E	80	Confident	74.6	Confident	147 Å²	147	71.9 Å²	71.9	69%	0.687	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.1	-26.4	-176.7	-91.3	163.4	-159	0	0	115	E695	E695-E699 WeakPolarHBondContact O-CB 3.31Å; E695-E699 WeakPolarHBondContact O-CG 3.43Å; E695-E699 PolarHBondContact O-N 2.94Å
700	G	75	Confident	74.3	Confident	71 Å²	71	69.1 Å²	69.1	73%	0.732	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-3.6	178.6	0	0	0	0	0	116.4	V698	V698-G700 PolarHBondContact O-N 3.08Å
701	T	72.3	Confident	74.4	Confident	84 Å²	84	70.5 Å²	70.5	52%	0.515	42%	0.42	S	S	.	.	S	Bend	trans	-109.2	11.5	-166.4	60.8	0	0	0	0	114.9	K437 V698 G703	K437-T701 WeakPolarHBondContact CE-OG1 3.42Å; K437-T701 PolarHBondContact NZ-OG1 2.63Å; V698-T701 PolarHBondContact O-N 3.2Å; V698-T701 PolarHBondContact O-OG1 2.98Å; T701-G703 PolarHBondContact O-N 3.33Å
702	G	64.9	Low	74.3	Confident	86 Å²	86	72.6 Å²	72.6	89%	0.887	43%	0.432	S	S	*	.	S	Bend	trans	76.7	15.7	168.8	0	0	0	0	0	116.9
703	G	72.4	Confident	74.4	Confident	33 Å²	33	71.2 Å²	71.2	34%	0.34	44%	0.438	S	S	.	.			trans	176.9	145.4	174.2	0	0	0	0	0	111.5	K437 V698 T701	K437-G703 WeakPolarHBondContact CE-O 3.46Å; K437-G703 PolarHBondContact NZ-O 3.46Å; V698-G703 WeakPolarHBondContact CG1-O 3.34Å; T701-G703 PolarHBondContact O-N 3.33Å
704	L	76	Confident	74.4	Confident	92 Å²	92	69.6 Å²	69.6	48%	0.482	43%	0.427	S	S	.	.	S	Bend	trans	-73.9	-32.2	-178.8	-86.5	158.1	0	0	0	113.1	Y694 E695	Y694-L704 WeakPolarHBondContact CE1-O 3.38Å; Y694-L704 PolarHBondContact OH-O 2.91Å; E695-L704 HydrophobicContact CG-CD2 4.4Å
705	D	76.2	Confident	74.1	Confident	61 Å²	61	74.9 Å²	74.9	33%	0.326	45%	0.45	S	S	.	.	S	Bend	trans	-117.6	169.6	-176.2	-61.5	-41.3	0	0	0	110.5	R461 D707	R461-D705 IonicContact CZ-OD1 2.75Å; R461-D705 IonicContact NE-OD1 2.74Å; R461-D705 IonicContact NH2-OD1 2.85Å; R461-D705 PolarHBondContact NH2-OD1 2.88Å; R461-D705 IonicContact NH2-OD2 3.61Å; R461-D705 PolarHBondContact NH2-OD2 2.72Å; D705-D707 PolarHBondContact O-N 3.49Å; D705-D707 VanDerWaalsContact O-N 3.13Å
706	D	71.7	Confident	73.1	Confident	46 Å²	46	76.7 Å²	76.7	25%	0.246	46%	0.459	C	S	.	.			trans	-83.1	80.2	-176.2	-156.6	8.3	0	0	0	110.2	K437	K437-D706 HydrophobicContact CB-CB 3.98Å
707	D	64.5	Low	72.3	Confident	144 Å²	144	75.8 Å²	75.8	77%	0.77	45%	0.453	S	S	*	.			trans	-105.7	93.9	-176.7	-69.2	-24.7	0	0	0	110.9	D705	D705-D707 PolarHBondContact O-N 3.49Å; D705-D707 VanDerWaalsContact O-N 3.13Å
708	V	61.7	Low	71.5	Confident	65 Å²	65	77.6 Å²	77.6	39%	0.394	47%	0.465	S	S	.	.			trans	-91.4	107.9	164	-177.7	0	0	0	0	108.4	E269 I710	E269-V708 HydrophobicContact CB-CB 3.85Å; E269-V708 HydrophobicContact CB-CG2 3.44Å; E269-V708 VanDerWaalsContact CB-CG2 3.44Å; E269-V708 HydrophobicContact CG-CG2 4.13Å; V708-I710 PolarHBondContact O-N 3.28Å
709	S	68.6	Low	70.4	Confident	106 Å²	106	83 Å²	83	74%	0.741	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-60	121.3	176.3	60.8	0	0	0	0	110.4
710	I	76.1	Confident	69	Low	73 Å²	73	81.8 Å²	81.8	37%	0.374	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-65.3	128.7	177.3	-57.9	168.8	0	0	0	109.1	M276 V708 L714 K715	M276-I710 HydrophobicContact CE-CD1 4.27Å; M276-I710 HydrophobicContact CE-CG2 3.99Å; V708-I710 PolarHBondContact O-N 3.28Å; I710-L714 HydrophobicContact CG2-CB 3.52Å; I710-K715 WeakPolarHBondContact O-CE 3.19Å
711	P	78.3	Confident	67.7	Low	59 Å²	59	85.7 Å²	85.7	38%	0.383	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-57	149.9	176	-25.4	34.4	0	0	0	112.6	L273 G713 L714 K715	L273-P711 HydrophobicContact CD1-CG 3.78Å; L273-P711 HydrophobicContact CD2-CG 4.29Å; P711-G713 VanDerWaalsContact C-N 3.28Å; P711-G713 PolarHBondContact O-N 3.23Å; P711-L714 CarbonylContact O-C 3.49Å; P711-L714 WeakPolarHBondContact O-CA 3.5Å; P711-L714 PolarHBondContact O-N 3.14Å; P711-K715 PolarHBondContact O-N 3.22Å
712	E	75	Confident	65.9	Low	153 Å²	153	90.5 Å²	90.5	72%	0.715	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-54.8	-40.9	-174.7	-62.8	-169.9	154.1	0	0	113.9	L714 K715	E712-L714 PolarHBondContact O-N 3.04Å; E712-L714 VanDerWaalsContact O-N 3.12Å; E712-K715 HydrophobicContact CG-CD 4.43Å; E712-K715 PolarHBondContact O-N 3.41Å; E712-K715 VanDerWaalsContact O-N 3.08Å; E712-K715 IonicContact OE1-NZ 3.53Å
713	G	73.7	Confident	64.6	Low	46 Å²	46	95.2 Å²	95.2	47%	0.474	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-64.4	-15.3	177.6	0	0	0	0	0	114.5	P711	P711-G713 VanDerWaalsContact C-N 3.28Å; P711-G713 PolarHBondContact O-N 3.23Å
714	L	75.6	Confident	62.9	Low	12 Å²	12	102.7 Å²	102.7	6%	0.063	53%	0.533	C	S	.	.	G	3₁₀ helix	trans	-110.5	2.5	176.9	-69.4	176.1	0	0	0	112.5	L273 M276 N280 I710 P711 E712	L273-L714 HydrophobicContact CD1-CD1 3.68Å; M276-L714 HydrophobicContact CB-CD1 4.01Å; M276-L714 HydrophobicContact CB-CD2 4.4Å; M276-L714 HydrophobicContact CE-CB 4.36Å; N280-L714 HydrophobicContact CB-CD2 3.62Å; I710-L714 HydrophobicContact CG2-CB 3.52Å; P711-L714 CarbonylContact O-C 3.49Å; P711-L714 WeakPolarHBondContact O-CA 3.5Å; P711-L714 PolarHBondContact O-N 3.14Å; E712-L714 PolarHBondContact O-N 3.04Å; E712-L714 VanDerWaalsContact O-N 3.12Å
715	K	71.1	Confident	60.8	Low	115 Å²	115	106.5 Å²	106.5	50%	0.5	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-38.4	178.7	-72.7	178.2	-175.7	173.3	0	112.5	I710 P711 E712	I710-K715 WeakPolarHBondContact O-CE 3.19Å; P711-K715 PolarHBondContact O-N 3.22Å; E712-K715 HydrophobicContact CG-CD 4.43Å; E712-K715 PolarHBondContact O-N 3.41Å; E712-K715 VanDerWaalsContact O-N 3.08Å; E712-K715 IonicContact OE1-NZ 3.53Å
716	H	61.7	Low	59.1	Low	112 Å²	112	108.3 Å²	108.3	52%	0.519	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.3	16.2	-176.7	-59.3	-75.3	0	0	0	114.1	N718 E719	H716-N718 PolarHBondContact O-N 3.24Å; H716-N718 VanDerWaalsContact O-N 3.1Å; H716-E719 IonicContact CG-OE2 2.77Å; H716-E719 IonicContact ND1-OE2 3.68Å; H716-E719 PolarHBondContact ND1-OE2 2.82Å; H716-E719 PolarHBondContact O-N 3.49Å; H716-E719 IonicContact CE1-OE2 2.87Å
717	W	64.6	Low	57.8	Low	32 Å²	32	110.4 Å²	110.4	12%	0.121	59%	0.587	C	S	.	*	T	Hydrogen-bonded Turn	trans	-60.3	-21.8	-178.9	72	-70.5	0	0	0	114.2	F262 M276 V279 N280 K283 E319	F262-W717 HydrophobicContact CD2-CH2 4.26Å; M276-W717 HydrophobicContact CE-CD2 4.22Å; M276-W717 HydrophobicContact CE-CG 4.17Å; M276-W717 HydrophobicContact CE-CZ2 4.45Å; V279-W717 HydrophobicContact CG1-CE3 3.93Å; V279-W717 HydrophobicContact CG1-CZ3 4.05Å; N280-W717 HydrophobicContact CB-CB 4.5Å; K283-W717 WeakPolarHBondContact CD-O 3.34Å; E319-W717 HydrophobicContact CB-CH2 4.33Å; E319-W717 HydrophobicContact CB-CZ3 3.98Å; E319-W717 HydrophobicContact CG-CH2 4.24Å; E319-W717 HydrophobicContact CG-CZ3 4.4Å; E319-W717 WeakPolarHBondContact OE2-CH2 3.48Å; E319-W717 WeakPolarHBondContact OE2-CZ3 3.46Å
718	N	61.6	Low	56.8	Low	90 Å²	90	107 Å²	107	48%	0.481	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.4	-2.3	-178.1	-113.1	-3	0	0	0	114.3	K283 H716	K283-N718 PolarHBondContact NZ-OD1 2.96Å; H716-N718 PolarHBondContact O-N 3.24Å; H716-N718 VanDerWaalsContact O-N 3.1Å
719	E	57.8	Low	55.9	Low	117 Å²	117	107 Å²	107	55%	0.547	59%	0.586	S	S	.	*	S	Bend	trans	-96.9	126.7	177.2	-69	176.7	173.2	0	0	109.6	H716 K721	H716-E719 IonicContact CG-OE2 2.77Å; H716-E719 IonicContact ND1-OE2 3.68Å; H716-E719 PolarHBondContact ND1-OE2 2.82Å; H716-E719 PolarHBondContact O-N 3.49Å; H716-E719 IonicContact CE1-OE2 2.87Å; E719-K721 PolarHBondContact O-N 2.69Å; E719-K721 VanDerWaalsContact O-N 3.16Å
720	P	49.8	Very low	54.7	Low	121 Å²	121	105.5 Å²	105.5	79%	0.786	58%	0.58	S	S	*	*			trans	-63.2	118.6	166.3	26.2	-30	0	0	0	107.6	Q722	P720-Q722 PolarHBondContact O-N 2.94Å
721	K	47.7	Very low	53.3	Low	153 Å²	153	105 Å²	105	67%	0.665	59%	0.587	S	S	*	*			trans	-55.6	114.1	172.7	-81.1	-175.1	175	-178.4	0	108.2	E719 E723	E719-K721 PolarHBondContact O-N 2.69Å; E719-K721 VanDerWaalsContact O-N 3.16Å; K721-E723 PolarHBondContact O-N 3.28Å
722	Q	34.5	Very low	51.8	Low	184 Å²	184	105.4 Å²	105.4	86%	0.86	59%	0.591	S	S	*	*			trans	-54.6	122.1	161.9	-71.9	179.3	-11	0	0	106.2	P720 E724	P720-Q722 PolarHBondContact O-N 2.94Å; Q722-E724 PolarHBondContact O-N 3.48Å
723	E	37.6	Very low	50.5	Low	186 Å²	186	106.2 Å²	106.2	87%	0.869	59%	0.592	S	S	*	*			trans	-51.6	110.6	176.2	-70.7	177.5	156.1	0	0	108.6	K721 Q725	K721-E723 PolarHBondContact O-N 3.28Å; E723-Q725 VanDerWaalsContact C-N 3.31Å; E723-Q725 PolarHBondContact O-N 3.25Å
724	E	36.9	Very low	49.4	Very low	189 Å²	189	112.1 Å²	112.1	88%	0.883	61%	0.605	S	S	*	*			trans	-57.8	102.2	161.4	-79.1	178.5	150.5	0	0	106.2	Q722	Q722-E724 PolarHBondContact O-N 3.48Å
725	Q	32.9	Very low	48.1	Very low	173 Å²	173	119.3 Å²	119.3	81%	0.808	64%	0.638	S	S	*	*			trans	-48.8	128.1	168	-75.3	179.2	-1.1	0	0	107.5	E723 A727	E723-Q725 VanDerWaalsContact C-N 3.31Å; E723-Q725 PolarHBondContact O-N 3.25Å; Q725-A727 PolarHBondContact O-N 2.83Å
726	P	40.8	Very low	47.2	Very low	98 Å²	98	121 Å²	121	64%	0.636	65%	0.653	S	S	*	*			trans	-61.3	116.3	179.9	5.5	-3.2	0	0	0	108.2	A728 A729	P726-A728 HydrophobicContact CB-CB 4.48Å; P726-A728 PolarHBondContact O-N 3.07Å; P726-A729 PolarHBondContact O-N 2.99Å
727	A	42.9	Very low	46.6	Very low	90 Å²	90	119.7 Å²	119.7	74%	0.744	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-8.3	173.8	0	0	0	0	0	113.3	Q725 A729	Q725-A727 PolarHBondContact O-N 2.83Å; A727-A729 VanDerWaalsContact C-N 3.34Å; A727-A729 PolarHBondContact O-N 3.48Å
728	A	43.3	Very low	45.6	Very low	74 Å²	74	128.5 Å²	128.5	61%	0.612	71%	0.71	S	S	*	*	H	α-helix	trans	-68.4	-21.4	171.4	0	0	0	0	0	114.7	P726	P726-A728 HydrophobicContact CB-CB 4.48Å; P726-A728 PolarHBondContact O-N 3.07Å
729	A	43.1	Very low	44.8	Very low	64 Å²	64	130.5 Å²	130.5	53%	0.529	72%	0.721	S	S	.	*	H	α-helix	trans	-84.5	-13	179.3	0	0	0	0	0	114.2	P726 A727	P726-A729 PolarHBondContact O-N 2.99Å; A727-A729 VanDerWaalsContact C-N 3.34Å; A727-A729 PolarHBondContact O-N 3.48Å
730	A	44.9	Very low	44.1	Very low	74 Å²	74	131.2 Å²	131.2	61%	0.612	73%	0.73	S	S	*	*	H	α-helix	trans	-91.9	-18.6	175.8	0	0	0	0	0	113
731	A	45.2	Very low	43.8	Very low	62 Å²	62	131.7 Å²	131.7	51%	0.512	73%	0.727	S	S	.	*	H	α-helix	trans	-80.5	-37.6	175.7	0	0	0	0	0	112.3	K733 K734	A731-K733 VanDerWaalsContact C-N 3.29Å; A731-K733 PolarHBondContact O-N 2.7Å; A731-K734 PolarHBondContact O-N 3.14Å
732	S	48	Very low	43.6	Very low	68 Å²	68	130.5 Å²	130.5	48%	0.476	73%	0.731	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.4	-11.8	-178.4	63.2	0	0	0	0	115.1
733	K	48	Very low	44.1	Very low	171 Å²	171	127.1 Å²	127.1	74%	0.743	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-9.8	173	-80.6	-175.2	177	179.6	0	114.2	A731	A731-K733 VanDerWaalsContact C-N 3.29Å; A731-K733 PolarHBondContact O-N 2.7Å
734	K	49.7	Very low	44.6	Very low	170 Å²	170	123.2 Å²	123.2	74%	0.739	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-17.1	172.6	-85.1	-175.7	173.4	-178.7	0	113.5	A731	A731-K734 PolarHBondContact O-N 3.14Å
735	E	48.9	Very low	45.1	Very low	162 Å²	162	118.5 Å²	118.5	76%	0.757	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-8.8	177.2	-118	173.8	168.8	0	0	114.3
736	N	52.3	Low	46.1	Very low	151 Å²	151	114.3 Å²	114.3	81%	0.807	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	17.2	173.5	-80.7	-31.6	0	0	0	112.8
737	A	47.9	Very low	46.5	Very low	84 Å²	84	115.7 Å²	115.7	69%	0.694	70%	0.697	S	S	*	*			trans	-133.9	17	-178.5	0	0	0	0	0	113.5
738	L	44.1	Very low	46.8	Very low	218 Å²	218	118 Å²	118	100%	1.141	69%	0.693	S	S	*	*			trans	-125.9	0	165.6	-107.9	154.7	0	0	0	106.4

Retrieved 738 of 738 residues in 664.6 ms (Link to these results)

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