A0A2K6QPZ6_RHIRO Loading...

Phosphatidylinositol 3-kinase regulatory subunit gamma

Binds to activated (phosphorylated) protein-tyrosine kinases through its SH2 domain and regulates their kinase activity. During insulin stimulation, it also binds to IRS-1.

AlphaFold DB , UniProt , Accession A0A2K6QPZ6, Species RHIRO (Rhinopithecus roxellana, Golden snub-nosed monkey), Gene PIK3R3, Length 461 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.9	Very low	29.2	Very low	226 Å²	226	167.9 Å²	167.9	100%	1.113	82%	0.822	S	S	*	*				0	98.4	0	-69.1	177.3	-163.4	0	0	106.1
2	Y	27.3	Very low	29.4	Very low	212 Å²	212	166.1 Å²	166.1	83%	0.831	82%	0.818	S	S	*	*				65.5	132.3	110.2	-66	-67.6	0	0	0	111.8
3	N	27.1	Very low	29.5	Very low	126 Å²	126	159.5 Å²	159.5	67%	0.674	81%	0.806	S	S	*	*			cis	-169.6	135.7	7.7	-129.5	-4.5	0	0	0	105.2	V5	N3-V5 HydrophobicContact CB-CG2 4.46Å
4	T	28.8	Very low	29.7	Very low	123 Å²	123	158.2 Å²	158.2	76%	0.755	80%	0.803	S	S	*	*			trans	-101.6	102.7	166.4	-46.5	0	0	0	0	106.9
5	V	28.2	Very low	29.7	Very low	108 Å²	108	164.6 Å²	164.6	66%	0.655	81%	0.813	S	S	*	*			trans	-100.5	112.3	172.4	178.5	0	0	0	0	107.1	N3	N3-V5 HydrophobicContact CB-CG2 4.46Å
6	W	30.1	Very low	29.8	Very low	231 Å²	231	168.1 Å²	168.1	88%	0.875	82%	0.815	S	S	*	*			trans	-99.5	111	160.5	-76.6	95.7	0	0	0	107.2	M8	W6-M8 PolarHBondContact O-N 2.87Å
7	S	27.6	Very low	29.9	Very low	95 Å²	95	169.1 Å²	169.1	66%	0.664	82%	0.818	S	S	*	*			trans	-65.9	119.2	168.6	-60.6	0	0	0	0	109.1
8	M	29.4	Very low	29.8	Very low	191 Å²	191	166.9 Å²	166.9	94%	0.941	82%	0.816	S	S	*	*			trans	-89.3	101.8	159.1	-78.3	171.4	96	0	0	106.8	W6	W6-M8 PolarHBondContact O-N 2.87Å
9	D	30.1	Very low	29.8	Very low	154 Å²	154	168.1 Å²	168.1	82%	0.824	82%	0.822	S	S	*	*			trans	-72	139.5	164	-85	-43.1	0	0	0	110
10	R	30.9	Very low	29.7	Very low	211 Å²	211	167.8 Å²	167.8	80%	0.796	82%	0.821	S	S	*	*			trans	-61.3	147.1	170.8	-65.3	167.3	-171.9	-169	-0.6	109.4
11	D	30.6	Very low	30	Very low	170 Å²	170	164.2 Å²	164.2	91%	0.909	81%	0.81	S	S	*	*			trans	-142.2	98.8	134.2	-91.2	-35.3	0	0	0	108.3
12	D	32.2	Very low	29.8	Very low	146 Å²	146	163.8 Å²	163.8	78%	0.781	80%	0.798	S	S	*	*			trans	-61.5	128.8	156.6	-89.2	-49.7	0	0	0	109.1
13	A	30.3	Very low	29.8	Very low	80 Å²	80	158.1 Å²	158.1	66%	0.661	79%	0.789	S	S	*	*			trans	-144.7	87.2	158.4	0	0	0	0	0	109.6
14	D	32.9	Very low	29.9	Very low	142 Å²	142	159.1 Å²	159.1	76%	0.759	80%	0.8	S	S	*	*			trans	32.4	102.4	134.6	-125.8	-5.1	0	0	0	118.6
15	W	29.9	Very low	30.1	Very low	254 Å²	254	160.9 Å²	160.9	96%	0.962	80%	0.8	S	S	*	*			trans	-119	27.2	167	-72.3	108.1	0	0	0	112.9
16	R	30.1	Very low	30.4	Very low	221 Å²	221	162.2 Å²	162.2	83%	0.834	80%	0.803	S	S	*	*			trans	-87.4	137.3	172.3	-64.7	-165.5	-160.1	-148.4	5.1	110.6
17	E	31.5	Very low	30.3	Very low	185 Å²	185	159.3 Å²	159.3	86%	0.864	80%	0.803	S	S	*	*			trans	75.7	86.7	169.6	-69.5	-174.3	153.9	0	0	118.5
18	V	28.7	Very low	30.6	Very low	130 Å²	130	162 Å²	162	79%	0.788	80%	0.802	S	S	*	*			trans	-137.6	91.7	130.8	-174.4	0	0	0	0	108.6	M20	V18-M20 HydrophobicContact CG1-CB 4.43Å; V18-M20 HydrophobicContact CG1-CG 3.72Å
19	M	29.8	Very low	30.8	Very low	188 Å²	188	160.9 Å²	160.9	93%	0.926	79%	0.789	S	S	*	*			trans	-81.9	119.8	154.8	-92.7	-78.5	-145.9	0	0	106.9
20	M	28	Very low	30.7	Very low	162 Å²	162	159.8 Å²	159.8	80%	0.798	78%	0.782	S	S	*	*			trans	-127.6	122.2	167.7	-84.1	-83.3	-173.3	0	0	108.8	V18	V18-M20 HydrophobicContact CG1-CB 4.43Å; V18-M20 HydrophobicContact CG1-CG 3.72Å
21	P	35.1	Very low	30.8	Very low	93 Å²	93	158.1 Å²	158.1	60%	0.604	78%	0.783	S	S	*	*			trans	-84.8	156.3	169.1	32	-25.4	0	0	0	110.5
22	Y	26.9	Very low	30.7	Very low	217 Å²	217	157.6 Å²	157.6	85%	0.851	78%	0.777	S	S	*	*			trans	104	128.8	158.3	-59.5	-73.2	0	0	0	120.7
23	S	27.1	Very low	30.5	Very low	93 Å²	93	158.4 Å²	158.4	65%	0.65	78%	0.781	S	S	*	*			trans	74.2	125.7	130.7	-152.4	0	0	0	0	119.7	E25	S23-E25 PolarHBondContact O-N 3.43Å
24	T	31	Very low	30.8	Very low	148 Å²	148	159.8 Å²	159.8	91%	0.908	78%	0.784	S	S	*	*	S	Bend	trans	-66.1	27.5	-178.4	33.5	0	0	0	0	115.6
25	E	33	Very low	30.8	Very low	159 Å²	159	158.7 Å²	158.7	74%	0.743	78%	0.784	S	S	*	*			trans	-121.8	52.3	-174.7	-76.4	-85.7	160.2	0	0	110.6	S23	S23-E25 PolarHBondContact O-N 3.43Å
26	L	32.4	Very low	30.8	Very low	137 Å²	137	151.6 Å²	151.6	72%	0.717	78%	0.779	S	S	*	*			trans	-163.7	82.7	174.6	-105.5	129.6	0	0	0	111.6	F28	L26-F28 HydrophobicContact CD2-CB 4.27Å; L26-F28 HydrophobicContact CD2-CD2 3.71Å; L26-F28 HydrophobicContact CD2-CG 4.48Å; L26-F28 HydrophobicContact CG-CD2 4.21Å
27	I	29.7	Very low	31.1	Very low	170 Å²	170	148.8 Å²	148.8	87%	0.872	78%	0.78	S	S	*	*			trans	-106.1	80.9	153.2	-57.8	178.3	0	0	0	106.1
28	F	32.7	Very low	31.4	Very low	150 Å²	150	145 Å²	145	66%	0.658	77%	0.772	S	S	*	*			trans	-99.4	157.4	172.3	-103.7	-64.2	0	0	0	110.9	L26	L26-F28 HydrophobicContact CD2-CB 4.27Å; L26-F28 HydrophobicContact CD2-CD2 3.71Å; L26-F28 HydrophobicContact CD2-CG 4.48Å; L26-F28 HydrophobicContact CG-CD2 4.21Å
29	Y	33.7	Very low	31.7	Very low	168 Å²	168	144.9 Å²	144.9	66%	0.659	77%	0.774	S	S	*	*			trans	44.6	106.6	148.9	-86.2	-87.9	0	0	0	117.9
30	I	29.4	Very low	32.1	Very low	131 Å²	131	145.6 Å²	145.6	67%	0.672	77%	0.772	S	S	*	*			trans	-117.1	105.1	141.4	-66.5	175.9	0	0	0	106.2	M32	I30-M32 HydrophobicContact CG2-CG 3.8Å; I30-M32 PolarHBondContact O-N 3.17Å
31	E	32.4	Very low	32.4	Very low	176 Å²	176	143.1 Å²	143.1	82%	0.822	77%	0.768	S	S	*	*			trans	-62.7	119.4	159	-122.2	171.1	-177.5	0	0	107.6
32	M	28.1	Very low	32.2	Very low	160 Å²	160	144.9 Å²	144.9	79%	0.788	78%	0.779	S	S	*	*			trans	-134.4	115.1	161.4	-75.7	-163.1	78	0	0	107.6	I30 P34	I30-M32 HydrophobicContact CG2-CG 3.8Å; I30-M32 PolarHBondContact O-N 3.17Å; M32-P34 WeakPolarHBondContact O-CD 3.42Å
33	D	28.9	Very low	32.6	Very low	162 Å²	162	143.9 Å²	143.9	87%	0.866	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-60.9	124.6	164.1	-84.6	-35.1	0	0	0	109.3
34	P	34.8	Very low	32.8	Very low	110 Å²	110	145.1 Å²	145.1	71%	0.714	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-82.4	146.1	173	30.6	-30	0	0	0	111.2	M32	M32-P34 WeakPolarHBondContact O-CD 3.42Å
35	P	32.9	Very low	33	Very low	118 Å²	118	147.2 Å²	147.2	77%	0.766	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-67.4	141.6	173.7	26.9	-31.2	0	0	0	111.3	L37	P35-L37 PolarHBondContact O-N 3.38Å
36	A	31.1	Very low	32.8	Very low	105 Å²	105	146.3 Å²	146.3	87%	0.868	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-58	124	179.8	0	0	0	0	0	112.2
37	L	35.7	Very low	32.7	Very low	162 Å²	162	145.2 Å²	145.2	85%	0.848	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-84.3	143.5	171.4	-72.4	169.5	0	0	0	110.9	P35	P35-L37 PolarHBondContact O-N 3.38Å
38	P	38.9	Very low	32.8	Very low	107 Å²	107	141.6 Å²	141.6	70%	0.695	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-72.6	153.7	179.4	29.5	-33.3	0	0	0	112.3
39	P	33.4	Very low	32.6	Very low	127 Å²	127	141 Å²	141	83%	0.825	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-69.8	135.4	-177.1	27.4	-31.9	0	0	0	111.8
40	K	38.3	Very low	32.7	Very low	202 Å²	202	138.8 Å²	138.8	88%	0.878	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-74.3	147.5	172.7	-80.7	-179.2	178.1	172.6	0	111.2
41	P	34	Very low	32.8	Very low	111 Å²	111	140.3 Å²	140.3	72%	0.721	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-72	153.6	-176.9	29.3	-33.4	0	0	0	112.5
42	P	32	Very low	32.6	Very low	129 Å²	129	135.4 Å²	135.4	84%	0.838	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-71.9	134.9	-178	29.2	-32.3	0	0	0	111
43	K	36	Very low	33	Very low	196 Å²	196	137.3 Å²	137.3	85%	0.852	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-83	151	170.3	-81.8	-176.5	178.2	-179.6	0	111
44	P	29.7	Very low	33.3	Very low	119 Å²	119	138.4 Å²	138.4	77%	0.773	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-71.9	144.1	-166.3	-11.2	27.1	0	0	0	112.8	T46	P44-T46 PolarHBondContact O-N 3.32Å
45	M	35.4	Very low	33.4	Very low	193 Å²	193	141 Å²	141	95%	0.951	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-66.2	123.7	169.1	-60.6	171.9	78.4	0	0	109.6
46	T	29.7	Very low	33.6	Very low	139 Å²	139	139.4 Å²	139.4	85%	0.853	82%	0.816	S	S	*	*			trans	-110.6	129.1	157.4	35.5	0	0	0	0	109.4	P44	P44-T46 PolarHBondContact O-N 3.32Å
47	S	30	Very low	34.3	Very low	114 Å²	114	139.9 Å²	139.9	80%	0.797	81%	0.813	S	S	*	*			trans	-66.6	150.8	-170.3	36.1	0	0	0	0	114.4
48	A	32.4	Very low	35.7	Very low	94 Å²	94	135.9 Å²	135.9	78%	0.777	80%	0.795	S	S	*	*			trans	-36.2	135.2	174.4	0	0	0	0	0	115.8
49	V	28.3	Very low	37.6	Very low	137 Å²	137	133.5 Å²	133.5	83%	0.83	78%	0.781	S	S	*	*			trans	-123.7	106.5	149.8	-178.4	0	0	0	0	107
50	T	36.4	Very low	40.1	Very low	123 Å²	123	128.9 Å²	128.9	76%	0.755	75%	0.749	S	S	*	*			trans	-66.9	121.3	165.7	42.2	0	0	0	0	109.3
51	N	30.3	Very low	42.3	Very low	162 Å²	162	126 Å²	126	87%	0.866	74%	0.739	S	S	*	*			trans	-164	122.4	152.3	-105.5	-12.7	0	0	0	112.4
52	G	27.9	Very low	44.7	Very low	73 Å²	73	125.3 Å²	125.3	75%	0.753	73%	0.729	S	S	*	*			trans	80.9	88.7	148	0	0	0	0	0	117.5	K54	G52-K54 PolarHBondContact O-N 2.89Å
53	M	37.5	Very low	47.3	Very low	200 Å²	200	119.4 Å²	119.4	99%	0.985	69%	0.692	S	S	*	*			trans	-51	105.9	154.4	-80.5	147.8	126.9	0	0	110.1
54	K	33.7	Very low	49.8	Very low	185 Å²	185	113.9 Å²	113.9	80%	0.804	67%	0.669	S	S	*	*			trans	-105.1	99	149.9	-97.4	-174.3	175.5	-179	0	106.4	G52 S56	G52-K54 PolarHBondContact O-N 2.89Å; K54-S56 PolarHBondContact O-N 3.13Å; K54-S56 PolarHBondContact O-OG 3.2Å
55	D	37.1	Very low	52.8	Low	166 Å²	166	109 Å²	109	89%	0.888	64%	0.635	S	S	*	*			trans	-62.9	86.7	168.9	-147.8	-0.4	0	0	0	107.6
56	S	37.3	Very low	55.5	Low	84 Å²	84	101 Å²	101	59%	0.587	59%	0.594	S	S	*	*			trans	-91.1	100.4	171.3	-41.8	0	0	0	0	102.9	K54 V58	K54-S56 PolarHBondContact O-N 3.13Å; K54-S56 PolarHBondContact O-OG 3.2Å; S56-V58 PolarHBondContact O-N 3Å
57	S	46.3	Very low	58.3	Low	115 Å²	115	95.9 Å²	95.9	80%	0.804	56%	0.559	S	S	*	*			trans	-62.1	89.9	173.9	60.1	0	0	0	0	107.9	S59	S57-S59 PolarHBondContact O-N 3.23Å
58	V	64.3	Low	61.1	Low	78 Å²	78	91.1 Å²	91.1	47%	0.473	53%	0.528	S	S	.	.			trans	-61.3	114.5	177.4	-178.4	0	0	0	0	106	S56 D62	S56-V58 PolarHBondContact O-N 3Å; V58-D62 HydrophobicContact CG1-CB 4.14Å
59	S	80.3	Confident	63.6	Low	57 Å²	57	93.6 Å²	93.6	40%	0.399	53%	0.528	S	S	.	.			trans	-59.8	144.3	175.8	179.6	0	0	0	0	108.6	S57 Q61 D62 A63	S57-S59 PolarHBondContact O-N 3.23Å; S59-Q61 PolarHBondContact O-N 2.74Å; S59-Q61 VanDerWaalsContact O-N 3.13Å; S59-Q61 PolarHBondContact OG-N 3.33Å; S59-D62 WeakPolarHBondContact CB-OD2 3.48Å; S59-D62 WeakPolarHBondContact O-CA 3.36Å; S59-D62 PolarHBondContact O-N 3.13Å; S59-A63 PolarHBondContact O-N 2.93Å
60	L	85.4	Confident	66.4	Low	29 Å²	29	87.6 Å²	87.6	15%	0.152	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-52.6	-35.9	172.5	176.8	62.1	0	0	0	111	D62 A63 W65 Y66 Y100 V133 V134	L60-D62 PolarHBondContact O-N 3.47Å; L60-A63 WeakPolarHBondContact O-CB 3.49Å; L60-A63 PolarHBondContact O-N 3.47Å; L60-W65 HydrophobicContact CD1-CH2 3.75Å; L60-W65 HydrophobicContact CD1-CZ3 3.83Å; L60-Y66 HydrophobicContact CD1-CD2 4.03Å; L60-Y66 HydrophobicContact CD1-CG 3.99Å; L60-Y66 HydrophobicContact CD2-CE2 4.35Å; L60-Y66 HydrophobicContact CG-CD1 4.17Å; L60-Y66 HydrophobicContact CG-CD2 4.21Å; L60-Y66 HydrophobicContact CG-CE1 4.32Å; L60-Y66 HydrophobicContact CG-CE2 4.38Å; L60-Y66 HydrophobicContact CG-CG 4.1Å; L60-Y66 VanDerWaalsContact O-CD1 3.23Å; L60-Y66 WeakPolarHBondContact O-CD1 3.24Å; L60-Y100 HydrophobicContact CD2-CD1 4.42Å; L60-Y100 HydrophobicContact CD2-CE1 3.66Å; L60-Y100 HydrophobicContact CD2-CE2 4Å; L60-Y100 VanDerWaalsContact CD2-CZ 3.41Å; L60-Y100 WeakPolarHBondContact CD2-OH 3.26Å; L60-V133 HydrophobicContact CD1-CB 3.98Å; L60-V133 HydrophobicContact CD1-CG1 3.94Å; L60-V133 HydrophobicContact CD2-CB 4.31Å; L60-V133 HydrophobicContact CD2-CG2 4.3Å; L60-V134 HydrophobicContact CB-CG2 4.31Å; L60-V134 HydrophobicContact CD1-CG2 4.29Å
61	Q	83.9	Confident	68.8	Low	142 Å²	142	83.7 Å²	83.7	66%	0.664	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-66.4	-19.8	177.2	-71	-157	11.1	0	0	113.8	S59 R162	S59-Q61 PolarHBondContact O-N 2.74Å; S59-Q61 VanDerWaalsContact O-N 3.13Å; S59-Q61 PolarHBondContact OG-N 3.33Å; Q61-R162 PolarHBondContact O-NH1 3.1Å; Q61-R162 PolarHBondContact O-NH2 3.35Å
62	D	84	Confident	71.3	Confident	97 Å²	97	82.2 Å²	82.2	52%	0.519	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-96.7	-8.6	178.7	-62.7	-37.5	0	0	0	112.5	V58 S59 L60 E64 Y163	V58-D62 HydrophobicContact CG1-CB 4.14Å; S59-D62 WeakPolarHBondContact CB-OD2 3.48Å; S59-D62 WeakPolarHBondContact O-CA 3.36Å; S59-D62 PolarHBondContact O-N 3.13Å; L60-D62 PolarHBondContact O-N 3.47Å; D62-E64 PolarHBondContact O-N 3.32Å; D62-Y163 PolarHBondContact O-OH 2.7Å
63	A	87.6	Confident	74.1	Confident	5 Å²	5	84.5 Å²	84.5	4%	0.041	44%	0.443	C	S	.	.			trans	-67	129.7	-179.5	0	0	0	0	0	111.3	S59 L60 W65 Y66 R162	S59-A63 PolarHBondContact O-N 2.93Å; L60-A63 WeakPolarHBondContact O-CB 3.49Å; L60-A63 PolarHBondContact O-N 3.47Å; A63-W65 VanDerWaalsContact C-N 3.26Å; A63-W65 HydrophobicContact CB-CD2 4.12Å; A63-W65 HydrophobicContact CB-CE3 4.46Å; A63-W65 HydrophobicContact CB-CH2 4.1Å; A63-W65 HydrophobicContact CB-CZ2 3.74Å; A63-W65 HydrophobicContact CB-CZ3 4.44Å; A63-W65 PolarHBondContact O-N 3.2Å; A63-Y66 PolarHBondContact O-N 3.44Å; A63-Y66 VanDerWaalsContact O-N 3.14Å; A63-R162 PolarHBondContact O-NH1 3.21Å
64	E	88	Confident	76.4	Confident	80 Å²	80	79.3 Å²	79.3	37%	0.374	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-29.6	-174.8	65.3	173.2	166.7	0	0	114	D62 Y66 P159 S161 R162 Y163	D62-E64 PolarHBondContact O-N 3.32Å; E64-Y66 VanDerWaalsContact C-N 3.33Å; E64-P159 HydrophobicContact CG-CB 4.4Å; E64-P159 WeakPolarHBondContact OE1-CG 3.46Å; E64-S161 CarbonylContact O-C 3.59Å; E64-S161 WeakPolarHBondContact O-CA 3.37Å; E64-S161 WeakPolarHBondContact OE2-CB 3.36Å; E64-S161 PolarHBondContact OE2-OG 3.35Å; E64-R162 PolarHBondContact O-N 2.92Å; E64-Y163 HydrophobicContact CB-CD2 3.75Å; E64-Y163 HydrophobicContact CB-CE2 3.87Å
65	W	92.1	Very high	79	Confident	16 Å²	16	70.6 Å²	70.6	6%	0.061	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-1.5	-179	45.1	-100.6	0	0	0	113	L60 A63 F87 V89 V133 V134 I137 P159	L60-W65 HydrophobicContact CD1-CH2 3.75Å; L60-W65 HydrophobicContact CD1-CZ3 3.83Å; A63-W65 VanDerWaalsContact C-N 3.26Å; A63-W65 HydrophobicContact CB-CD2 4.12Å; A63-W65 HydrophobicContact CB-CE3 4.46Å; A63-W65 HydrophobicContact CB-CH2 4.1Å; A63-W65 HydrophobicContact CB-CZ2 3.74Å; A63-W65 HydrophobicContact CB-CZ3 4.44Å; A63-W65 PolarHBondContact O-N 3.2Å; W65-F87 HydrophobicContact CB-CE2 3.91Å; W65-F87 HydrophobicContact CB-CZ 4.38Å; W65-F87 HydrophobicContact CD2-CE2 4.23Å; W65-F87 AromaticContact CG-CE2 3.85Å; W65-F87 HydrophobicContact CG-CE2 3.85Å; W65-F87 HydrophobicContact CG-CZ 4.26Å; W65-V89 HydrophobicContact CE3-CB 3.67Å; W65-V89 HydrophobicContact CE3-CG2 3.46Å; W65-V89 VanDerWaalsContact CE3-CG2 3.46Å; W65-V89 HydrophobicContact CZ3-CB 3.7Å; W65-V89 HydrophobicContact CZ3-CG1 4.3Å; W65-V89 HydrophobicContact CZ3-CG2 3.49Å; W65-V89 VanDerWaalsContact CZ3-CG2 3.49Å; W65-V89 PolarHBondContact O-N 2.67Å; W65-V133 HydrophobicContact CH2-CG1 4.04Å; W65-V133 HydrophobicContact CZ3-CG1 4.16Å; W65-V134 HydrophobicContact CH2-CG2 4.24Å; W65-V134 HydrophobicContact CZ2-CG2 4.24Å; W65-I137 HydrophobicContact CD2-CG2 4.13Å; W65-I137 HydrophobicContact CE3-CG1 4.4Å; W65-I137 HydrophobicContact CH2-CB 3.91Å; W65-I137 HydrophobicContact CH2-CG1 3.62Å; W65-I137 HydrophobicContact CH2-CG2 4.25Å; W65-I137 HydrophobicContact CZ2-CB 3.75Å; W65-I137 HydrophobicContact CZ2-CG1 3.99Å; W65-I137 HydrophobicContact CZ2-CG2 3.75Å; W65-I137 HydrophobicContact CZ3-CB 4.49Å; W65-I137 HydrophobicContact CZ3-CG1 3.84Å; W65-P159 HydrophobicContact CB-CB 3.85Å; W65-P159 HydrophobicContact CG-CB 4.36Å
66	Y	92.5	Very high	81.5	Confident	26 Å²	26	65.6 Å²	65.6	10%	0.102	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-94.4	112.3	178.2	178.9	-114.9	0	0	0	110.8	L60 A63 E64 V89 D91 Y100 R162	L60-Y66 HydrophobicContact CD1-CD2 4.03Å; L60-Y66 HydrophobicContact CD1-CG 3.99Å; L60-Y66 HydrophobicContact CD2-CE2 4.35Å; L60-Y66 HydrophobicContact CG-CD1 4.17Å; L60-Y66 HydrophobicContact CG-CD2 4.21Å; L60-Y66 HydrophobicContact CG-CE1 4.32Å; L60-Y66 HydrophobicContact CG-CE2 4.38Å; L60-Y66 HydrophobicContact CG-CG 4.1Å; L60-Y66 VanDerWaalsContact O-CD1 3.23Å; L60-Y66 WeakPolarHBondContact O-CD1 3.24Å; A63-Y66 PolarHBondContact O-N 3.44Å; A63-Y66 VanDerWaalsContact O-N 3.14Å; E64-Y66 VanDerWaalsContact C-N 3.33Å; Y66-V89 WeakPolarHBondContact CA-O 3.3Å; Y66-V89 HydrophobicContact CD2-CB 4.42Å; Y66-V89 HydrophobicContact CD2-CG1 4.22Å; Y66-D91 WeakPolarHBondContact CE2-OD1 3.49Å; Y66-D91 PolarHBondContact OH-OD1 3.01Å; Y66-D91 PolarHBondContact OH-OD2 2.96Å; Y66-Y100 AromaticContact CE2-CD1 3.95Å; Y66-Y100 HydrophobicContact CE2-CD1 3.95Å; Y66-Y100 AromaticContact CE2-CE1 3.89Å; Y66-Y100 HydrophobicContact CE2-CE1 3.89Å; Y66-R162 VanDerWaalsContact O-CD 3.31Å; Y66-R162 WeakPolarHBondContact O-CD 3.22Å; Y66-R162 PolarHBondContact O-NH1 3.3Å; Y66-R162 VanDerWaalsContact O-NH1 3.13Å
67	W	89.2	Confident	83.8	Confident	31 Å²	31	66.2 Å²	66.2	12%	0.117	35%	0.348	C	S	.	.			trans	-101.5	1.8	-174.5	-76.4	76.9	0	0	0	114.2	I70 K78 V89 V160 R162	W67-I70 HydrophobicContact CB-CB 4.18Å; W67-I70 HydrophobicContact CB-CD1 4.42Å; W67-I70 HydrophobicContact CB-CG2 3.56Å; W67-I70 HydrophobicContact CD2-CD1 4.2Å; W67-I70 HydrophobicContact CE3-CD1 3.77Å; W67-I70 HydrophobicContact CZ3-CD1 4.48Å; W67-K78 HydrophobicContact CD2-CD 4.43Å; W67-K78 HydrophobicContact CE3-CD 4.36Å; W67-K78 HydrophobicContact CH2-CD 4.01Å; W67-K78 HydrophobicContact CZ2-CD 4.02Å; W67-K78 HydrophobicContact CZ3-CD 4.18Å; W67-V89 PolarHBondContact N-O 3.1Å; W67-V160 HydrophobicContact CZ2-CG1 3.88Å; W67-V160 PolarHBondContact NE1-O 3.26Å; W67-R162 HydrophobicContact CD2-CB 4.16Å; W67-R162 HydrophobicContact CE3-CB 4.39Å; W67-R162 HydrophobicContact CH2-CB 4.2Å; W67-R162 VanDerWaalsContact CZ2-CA 3.41Å; W67-R162 HydrophobicContact CZ2-CB 3.99Å; W67-R162 HydrophobicContact CZ3-CB 4.4Å
68	G	88.1	Confident	85.7	Confident	14 Å²	14	63.4 Å²	63.4	14%	0.144	32%	0.321	C	S	.	.	S	Bend	trans	60.8	-137.4	-179.7	0	0	0	0	0	113	I70 R90 D91	G68-I70 PolarHBondContact O-N 3.24Å; G68-R90 CarbonylContact O-C 3.53Å; G68-R90 WeakPolarHBondContact O-CA 3.38Å; G68-R90 WeakPolarHBondContact O-CB 3.45Å; G68-D91 PolarHBondContact O-N 3.38Å
69	D	86.1	Confident	86.9	Confident	145 Å²	145	59.7 Å²	59.7	78%	0.775	30%	0.299	S	S	*	.	S	Bend	trans	-80.4	56.8	-176.6	-162.8	15.8	0	0	0	113	D91	D69-D91 PolarHBondContact N-OD2 3.48Å
70	I	86.3	Confident	87.2	Confident	12 Å²	12	63.1 Å²	63.1	6%	0.062	30%	0.303	C	S	.	.			trans	-86.7	140.4	173.6	-172.7	170.7	0	0	0	111	W67 G68 E74 V75 K78 R90	W67-I70 HydrophobicContact CB-CB 4.18Å; W67-I70 HydrophobicContact CB-CD1 4.42Å; W67-I70 HydrophobicContact CB-CG2 3.56Å; W67-I70 HydrophobicContact CD2-CD1 4.2Å; W67-I70 HydrophobicContact CE3-CD1 3.77Å; W67-I70 HydrophobicContact CZ3-CD1 4.48Å; G68-I70 PolarHBondContact O-N 3.24Å; I70-E74 HydrophobicContact CD1-CB 3.77Å; I70-E74 HydrophobicContact CG1-CB 3.62Å; I70-E74 HydrophobicContact CG1-CG 4.42Å; I70-E74 WeakPolarHBondContact CG1-OE2 3.49Å; I70-V75 HydrophobicContact CD1-CG2 4.21Å; I70-V75 HydrophobicContact CG1-CG2 4.22Å; I70-V75 HydrophobicContact CG2-CG2 3.69Å; I70-K78 HydrophobicContact CD1-CD 3.9Å; I70-R90 HydrophobicContact CG2-CB 3.43Å; I70-R90 VanDerWaalsContact CG2-CB 3.43Å; I70-R90 HydrophobicContact CG2-CG 4.33Å; I70-R90 VanDerWaalsContact O-CD 3.26Å; I70-R90 WeakPolarHBondContact O-CD 3.41Å
71	S	86.1	Confident	87.3	Confident	41 Å²	41	68.1 Å²	68.1	29%	0.287	33%	0.33	S	S	.	.			trans	-68.9	160.5	-179.8	69.2	0	0	0	0	112.8	E73 E74 V75	S71-E73 VanDerWaalsContact C-N 3.26Å; S71-E73 PolarHBondContact O-N 3.4Å; S71-E74 WeakPolarHBondContact CB-OE2 3.04Å; S71-E74 PolarHBondContact N-OE2 3.25Å; S71-E74 WeakPolarHBondContact OG-CB 3.44Å; S71-E74 VanDerWaalsContact OG-CD 3.32Å; S71-E74 WeakPolarHBondContact OG-CG 3.11Å; S71-E74 PolarHBondContact OG-N 2.86Å; S71-E74 PolarHBondContact OG-OE2 2.77Å; S71-V75 WeakPolarHBondContact O-CG2 3.38Å; S71-V75 PolarHBondContact O-N 3.3Å
72	R	84.6	Confident	87.6	Confident	131 Å²	131	65.3 Å²	65.3	49%	0.494	32%	0.318	S	S	.	.	H	α-helix	trans	-64.2	-37.5	177.6	178.2	-176	-68.8	-176.3	-0.8	110.9	V75 N76	R72-V75 PolarHBondContact O-N 3.29Å; R72-N76 PolarHBondContact O-N 3.43Å; R72-N76 PolarHBondContact O-ND2 3.45Å
73	E	86.1	Confident	87.9	Confident	120 Å²	120	63.5 Å²	63.5	56%	0.561	31%	0.312	S	S	*	.	H	α-helix	trans	-63.3	-49	-178.8	-65.1	64.8	-140.4	0	0	110	S71 V75 N76 D77	S71-E73 VanDerWaalsContact C-N 3.26Å; S71-E73 PolarHBondContact O-N 3.4Å; E73-V75 VanDerWaalsContact C-N 3.33Å; E73-V75 PolarHBondContact O-N 3.32Å; E73-N76 WeakPolarHBondContact O-CB 3.39Å; E73-N76 PolarHBondContact O-N 3.29Å; E73-N76 VanDerWaalsContact O-N 3.15Å; E73-D77 PolarHBondContact O-N 2.97Å
74	E	84.9	Confident	88.1	Confident	92 Å²	92	66.3 Å²	66.3	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-63.6	-36.7	177.2	-70.4	169.5	106.4	0	0	112.9	I70 S71 D77 K78	I70-E74 HydrophobicContact CD1-CB 3.77Å; I70-E74 HydrophobicContact CG1-CB 3.62Å; I70-E74 HydrophobicContact CG1-CG 4.42Å; I70-E74 WeakPolarHBondContact CG1-OE2 3.49Å; S71-E74 WeakPolarHBondContact CB-OE2 3.04Å; S71-E74 PolarHBondContact N-OE2 3.25Å; S71-E74 WeakPolarHBondContact OG-CB 3.44Å; S71-E74 VanDerWaalsContact OG-CD 3.32Å; S71-E74 WeakPolarHBondContact OG-CG 3.11Å; S71-E74 PolarHBondContact OG-N 2.86Å; S71-E74 PolarHBondContact OG-OE2 2.77Å; E74-D77 PolarHBondContact O-N 2.88Å; E74-K78 VanDerWaalsContact O-CG 3.32Å; E74-K78 WeakPolarHBondContact O-CG 3.2Å; E74-K78 PolarHBondContact O-N 3.24Å
75	V	89.2	Confident	88.2	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.012	31%	0.308	C	S	.	.	H	α-helix	trans	-64	-42.7	173.9	168.9	0	0	0	0	111.4	I70 S71 R72 E73 D77 K78 L79 L88 T103	I70-V75 HydrophobicContact CD1-CG2 4.21Å; I70-V75 HydrophobicContact CG1-CG2 4.22Å; I70-V75 HydrophobicContact CG2-CG2 3.69Å; S71-V75 WeakPolarHBondContact O-CG2 3.38Å; S71-V75 PolarHBondContact O-N 3.3Å; R72-V75 PolarHBondContact O-N 3.29Å; E73-V75 VanDerWaalsContact C-N 3.33Å; E73-V75 PolarHBondContact O-N 3.32Å; V75-D77 VanDerWaalsContact C-N 3.3Å; V75-D77 PolarHBondContact O-N 3.35Å; V75-K78 PolarHBondContact O-N 3.29Å; V75-L79 HydrophobicContact CG1-CD1 3.83Å; V75-L79 HydrophobicContact CG1-CG 4.47Å; V75-L79 WeakPolarHBondContact O-CB 3.5Å; V75-L79 WeakPolarHBondContact O-CG 3.07Å; V75-L79 PolarHBondContact O-N 3.01Å; V75-L88 HydrophobicContact CB-CD1 4.36Å; V75-L88 HydrophobicContact CG1-CD1 3.86Å; V75-L88 HydrophobicContact CG1-CD2 4.15Å; V75-L88 HydrophobicContact CG1-CG 4.22Å; V75-L88 HydrophobicContact CG2-CD1 3.57Å; V75-L88 HydrophobicContact CG2-CD2 4.28Å; V75-T103 HydrophobicContact CG1-CG2 3.76Å
76	N	89.2	Confident	88.3	Confident	60 Å²	60	61.9 Å²	61.9	32%	0.321	31%	0.306	S	S	.	.	H	α-helix	trans	-61.7	-40.7	178	-77.6	-28.3	0	0	0	111.7	R72 E73 L79 R80 N110	R72-N76 PolarHBondContact O-N 3.43Å; R72-N76 PolarHBondContact O-ND2 3.45Å; E73-N76 WeakPolarHBondContact O-CB 3.39Å; E73-N76 PolarHBondContact O-N 3.29Å; E73-N76 VanDerWaalsContact O-N 3.15Å; N76-L79 PolarHBondContact O-N 2.77Å; N76-R80 PolarHBondContact O-N 3.44Å; N76-R80 VanDerWaalsContact O-N 3.07Å; N76-N110 PolarHBondContact OD1-ND2 2.82Å
77	D	85.9	Confident	88.5	Confident	97 Å²	97	60.8 Å²	60.8	52%	0.519	30%	0.302	S	S	.	.	H	α-helix	trans	-68.8	-39.7	177.5	-74.8	-21.6	0	0	0	112.5	E73 E74 V75 L79 R80	E73-D77 PolarHBondContact O-N 2.97Å; E74-D77 PolarHBondContact O-N 2.88Å; V75-D77 VanDerWaalsContact C-N 3.3Å; V75-D77 PolarHBondContact O-N 3.35Å; D77-L79 VanDerWaalsContact C-N 3.31Å; D77-L79 PolarHBondContact O-N 3.47Å; D77-R80 WeakPolarHBondContact O-CB 3.36Å; D77-R80 PolarHBondContact O-N 2.88Å; D77-R80 IonicContact OD1-CZ 3.09Å; D77-R80 IonicContact OD1-NE 3.85Å; D77-R80 IonicContact OD1-NH2 3.64Å; D77-R80 PolarHBondContact OD1-NH2 2.92Å
78	K	86.3	Confident	88.7	Confident	56 Å²	56	59.3 Å²	59.3	24%	0.243	30%	0.296	C	S	.	.	H	α-helix	trans	-65.1	-34.1	175.7	-73.9	175.9	-169.3	-66.3	0	113.2	W67 I70 E74 V75 L88	W67-K78 HydrophobicContact CD2-CD 4.43Å; W67-K78 HydrophobicContact CE3-CD 4.36Å; W67-K78 HydrophobicContact CH2-CD 4.01Å; W67-K78 HydrophobicContact CZ2-CD 4.02Å; W67-K78 HydrophobicContact CZ3-CD 4.18Å; I70-K78 HydrophobicContact CD1-CD 3.9Å; E74-K78 VanDerWaalsContact O-CG 3.32Å; E74-K78 WeakPolarHBondContact O-CG 3.2Å; E74-K78 PolarHBondContact O-N 3.24Å; V75-K78 PolarHBondContact O-N 3.29Å; K78-L88 HydrophobicContact CB-CD2 4.47Å; K78-L88 HydrophobicContact CD-CD2 4.44Å
79	L	88.6	Confident	89	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-3.4	179.2	-66.8	175.9	0	0	0	113	V75 N76 D77 M82 T86 L88 T103 R105 V160	V75-L79 HydrophobicContact CG1-CD1 3.83Å; V75-L79 HydrophobicContact CG1-CG 4.47Å; V75-L79 WeakPolarHBondContact O-CB 3.5Å; V75-L79 WeakPolarHBondContact O-CG 3.07Å; V75-L79 PolarHBondContact O-N 3.01Å; N76-L79 PolarHBondContact O-N 2.77Å; D77-L79 VanDerWaalsContact C-N 3.31Å; D77-L79 PolarHBondContact O-N 3.47Å; L79-M82 PolarHBondContact O-N 2.89Å; L79-T86 HydrophobicContact CD2-CG2 3.55Å; L79-L88 HydrophobicContact CG-CD2 4.4Å; L79-T103 HydrophobicContact CD1-CG2 3.47Å; L79-T103 VanDerWaalsContact CD1-CG2 3.47Å; L79-R105 WeakPolarHBondContact O-CD 3.38Å; L79-R105 PolarHBondContact O-NE 3.39Å; L79-R105 PolarHBondContact O-NH1 3.44Å; L79-V160 HydrophobicContact CD2-CG2 3.7Å
80	R	87.6	Confident	89.3	Confident	130 Å²	130	52 Å²	52	49%	0.491	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	136.4	179.1	-164.1	-176.2	-64.4	-105.1	2.2	110.5	N76 D77 M82	N76-R80 PolarHBondContact O-N 3.44Å; N76-R80 VanDerWaalsContact O-N 3.07Å; D77-R80 WeakPolarHBondContact O-CB 3.36Å; D77-R80 PolarHBondContact O-N 2.88Å; D77-R80 IonicContact OD1-CZ 3.09Å; D77-R80 IonicContact OD1-NE 3.85Å; D77-R80 IonicContact OD1-NH2 3.64Å; D77-R80 PolarHBondContact OD1-NH2 2.92Å; R80-M82 PolarHBondContact O-N 3.21Å
81	D	87.1	Confident	89.5	Confident	133 Å²	133	53.5 Å²	53.5	71%	0.711	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	22.5	-179.2	-49.8	-36	0	0	0	116.4
82	M	90	Very high	89.3	Confident	83 Å²	83	52.2 Å²	52.2	41%	0.409	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-87.2	154.6	176.1	-69.1	-81.7	67.6	0	0	113	L79 R80 T86 R105	L79-M82 PolarHBondContact O-N 2.89Å; R80-M82 PolarHBondContact O-N 3.21Å; M82-T86 HydrophobicContact CB-CG2 3.92Å; M82-T86 HydrophobicContact CG-CG2 4.19Å; M82-T86 HydrophobicContact SD-CG2 4.47Å; M82-R105 VanDerWaalsContact O-CD 3.26Å; M82-R105 WeakPolarHBondContact O-CD 3.5Å; M82-R105 PolarHBondContact O-NE 3.25Å
83	P	90.8	Very high	88.9	Confident	60 Å²	60	50.4 Å²	50.4	39%	0.39	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-67	161.7	177.6	28.3	-35.3	0	0	0	111.9	T86 Y158	P83-T86 WeakPolarHBondContact O-CB 3.33Å; P83-T86 PolarHBondContact O-N 2.91Å; P83-T86 PolarHBondContact O-OG1 3.48Å; P83-Y158 HydrophobicContact CB-CD2 4.41Å; P83-Y158 HydrophobicContact CB-CE2 4.14Å; P83-Y158 HydrophobicContact CG-CD2 3.75Å; P83-Y158 HydrophobicContact CG-CE2 3.83Å; P83-Y158 HydrophobicContact CG-CG 4.49Å
84	D	91.7	Very high	88.1	Confident	63 Å²	63	48.1 Å²	48.1	34%	0.337	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	138.6	171.7	-81.6	14.8	0	0	0	110.7	R105 K106 G107 M157	D84-R105 WeakPolarHBondContact CA-O 3.46Å; D84-K106 WeakPolarHBondContact OD1-CA 3.37Å; D84-G107 PolarHBondContact OD1-N 3.34Å; D84-G107 PolarHBondContact OD2-N 3.49Å; D84-M157 WeakPolarHBondContact O-CE 3.46Å
85	G	90.3	Very high	86.8	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.2	-1.5	-174.5	0	0	0	0	0	114.4	R105 K155 M157 Y158	G85-R105 PolarHBondContact N-O 3.28Å; G85-K155 WeakPolarHBondContact CA-O 3.33Å; G85-M157 PolarHBondContact O-N 3.33Å; G85-Y158 PolarHBondContact O-N 3Å
86	T	94.4	Very high	85.5	Confident	4 Å²	4	60.5 Å²	60.5	3%	0.025	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	132.7	170.4	-56.1	0	0	0	0	111.3	L79 M82 P83 L104 R105 Y158 V160	L79-T86 HydrophobicContact CD2-CG2 3.55Å; M82-T86 HydrophobicContact CB-CG2 3.92Å; M82-T86 HydrophobicContact CG-CG2 4.19Å; M82-T86 HydrophobicContact SD-CG2 4.47Å; P83-T86 WeakPolarHBondContact O-CB 3.33Å; P83-T86 PolarHBondContact O-N 2.91Å; P83-T86 PolarHBondContact O-OG1 3.48Å; T86-L104 WeakPolarHBondContact O-CA 3.49Å; T86-R105 PolarHBondContact O-N 3.05Å; T86-Y158 VanDerWaalsContact CA-O 3.29Å; T86-Y158 WeakPolarHBondContact CA-O 3.41Å; T86-V160 HydrophobicContact CG2-CG2 3.45Å; T86-V160 VanDerWaalsContact CG2-CG2 3.45Å
87	F	95.3	Very high	84	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.009	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	160.5	-173	76.8	-80.3	0	0	0	114.2	W65 L102 T103 L104 I137 L156 Y158 P159 V160	W65-F87 HydrophobicContact CB-CE2 3.91Å; W65-F87 HydrophobicContact CB-CZ 4.38Å; W65-F87 HydrophobicContact CD2-CE2 4.23Å; W65-F87 AromaticContact CG-CE2 3.85Å; W65-F87 HydrophobicContact CG-CE2 3.85Å; W65-F87 HydrophobicContact CG-CZ 4.26Å; F87-L102 HydrophobicContact CB-CD1 4.03Å; F87-L102 HydrophobicContact CD2-CD1 3.76Å; F87-L102 HydrophobicContact CG-CD1 4.31Å; F87-T103 WeakPolarHBondContact CA-O 3.46Å; F87-L104 HydrophobicContact CB-CD1 4.21Å; F87-I137 HydrophobicContact CE2-CG2 3.59Å; F87-I137 HydrophobicContact CZ-CG2 3.94Å; F87-L156 HydrophobicContact CB-CD2 3.94Å; F87-L156 HydrophobicContact CD1-CB 3.69Å; F87-L156 HydrophobicContact CD1-CD2 4.16Å; F87-L156 HydrophobicContact CD1-CG 4.45Å; F87-L156 HydrophobicContact CD2-CB 4.46Å; F87-L156 HydrophobicContact CD2-CD1 4.32Å; F87-L156 HydrophobicContact CD2-CD2 4.29Å; F87-L156 HydrophobicContact CE1-CB 3.6Å; F87-L156 HydrophobicContact CE2-CB 4.39Å; F87-L156 HydrophobicContact CE2-CD1 4.34Å; F87-L156 HydrophobicContact CG-CB 4.13Å; F87-L156 HydrophobicContact CG-CD2 3.86Å; F87-L156 HydrophobicContact CG-CG 4.42Å; F87-L156 HydrophobicContact CZ-CB 3.97Å; F87-Y158 PolarHBondContact N-O 2.96Å; F87-P159 HydrophobicContact CE1-CB 3.91Å; F87-P159 HydrophobicContact CZ-CB 3.8Å; F87-V160 PolarHBondContact O-N 2.64Å
88	L	94.6	Very high	82.9	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	161.3	166.7	62.1	85.7	0	0	0	111	V75 K78 L79 T103 V160	V75-L88 HydrophobicContact CB-CD1 4.36Å; V75-L88 HydrophobicContact CG1-CD1 3.86Å; V75-L88 HydrophobicContact CG1-CD2 4.15Å; V75-L88 HydrophobicContact CG1-CG 4.22Å; V75-L88 HydrophobicContact CG2-CD1 3.57Å; V75-L88 HydrophobicContact CG2-CD2 4.28Å; K78-L88 HydrophobicContact CB-CD2 4.47Å; K78-L88 HydrophobicContact CD-CD2 4.44Å; L79-L88 HydrophobicContact CG-CD2 4.4Å; L88-T103 PolarHBondContact N-O 3.02Å; L88-T103 PolarHBondContact O-N 3.29Å; L88-V160 HydrophobicContact CB-CB 4.18Å; L88-V160 HydrophobicContact CD2-CB 4.1Å; L88-V160 HydrophobicContact CD2-CG1 4.28Å; L88-V160 HydrophobicContact CD2-CG2 4.28Å
89	V	94.5	Very high	82.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136	174.9	-178.1	0	0	0	0	109.8	W65 Y66 W67 T101 L102 I115 I137	W65-V89 HydrophobicContact CE3-CB 3.67Å; W65-V89 HydrophobicContact CE3-CG2 3.46Å; W65-V89 VanDerWaalsContact CE3-CG2 3.46Å; W65-V89 HydrophobicContact CZ3-CB 3.7Å; W65-V89 HydrophobicContact CZ3-CG1 4.3Å; W65-V89 HydrophobicContact CZ3-CG2 3.49Å; W65-V89 VanDerWaalsContact CZ3-CG2 3.49Å; W65-V89 PolarHBondContact O-N 2.67Å; Y66-V89 WeakPolarHBondContact CA-O 3.3Å; Y66-V89 HydrophobicContact CD2-CB 4.42Å; Y66-V89 HydrophobicContact CD2-CG1 4.22Å; W67-V89 PolarHBondContact N-O 3.1Å; V89-T101 WeakPolarHBondContact CA-O 3.49Å; V89-L102 HydrophobicContact CG2-CB 4.38Å; V89-L102 HydrophobicContact CG2-CD1 3.87Å; V89-I115 HydrophobicContact CG1-CD1 4.14Å; V89-I115 HydrophobicContact CG2-CD1 4.5Å; V89-I137 HydrophobicContact CG2-CD1 3.83Å; V89-I137 HydrophobicContact CG2-CG1 4.16Å
90	R	92.1	Very high	82.6	Confident	7 Å²	7	63.9 Å²	63.9	3%	0.026	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	167.2	175.6	64.5	165.8	178.9	93.7	0.1	111.3	G68 I70 S93 T101	G68-R90 CarbonylContact O-C 3.53Å; G68-R90 WeakPolarHBondContact O-CA 3.38Å; G68-R90 WeakPolarHBondContact O-CB 3.45Å; I70-R90 HydrophobicContact CG2-CB 3.43Å; I70-R90 VanDerWaalsContact CG2-CB 3.43Å; I70-R90 HydrophobicContact CG2-CG 4.33Å; I70-R90 VanDerWaalsContact O-CD 3.26Å; I70-R90 WeakPolarHBondContact O-CD 3.41Å; R90-S93 PolarHBondContact NH1-OG 3.29Å; R90-T101 PolarHBondContact N-O 3.25Å; R90-T101 PolarHBondContact O-N 3.23Å
91	D	89.1	Confident	82.9	Confident	43 Å²	43	58.4 Å²	58.4	23%	0.23	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	142.6	171.5	-63.7	-18.5	0	0	0	110	Y66 G68 D69 Y100	Y66-D91 WeakPolarHBondContact CE2-OD1 3.49Å; Y66-D91 PolarHBondContact OH-OD1 3.01Å; Y66-D91 PolarHBondContact OH-OD2 2.96Å; G68-D91 PolarHBondContact O-N 3.38Å; D69-D91 PolarHBondContact N-OD2 3.48Å; D91-Y100 WeakPolarHBondContact OD1-CE1 3.35Å
92	A	83.9	Confident	83.2	Confident	14 Å²	14	52.1 Å²	52.1	12%	0.116	27%	0.274	C	S	.	.			trans	-68.8	145.7	174.3	0	0	0	0	0	110.1	T94 D99	A92-T94 PolarHBondContact O-N 3.05Å; A92-T94 VanDerWaalsContact O-N 3.08Å; A92-D99 HydrophobicContact CB-CB 3.58Å; A92-D99 WeakPolarHBondContact CB-O 3.47Å; A92-D99 PolarHBondContact N-O 3.14Å
93	S	75.7	Confident	83.4	Confident	93 Å²	93	48.2 Å²	48.2	65%	0.65	26%	0.255	S	S	*	.	S	Bend	trans	-66.8	-12.2	179.4	-52.4	0	0	0	0	113.1	R90	R90-S93 PolarHBondContact NH1-OG 3.29Å
94	T	68.2	Low	83.6	Confident	72 Å²	72	45.4 Å²	45.4	44%	0.442	24%	0.237	S	C	.	.	S	Bend	trans	-83	125.7	171.8	44.8	0	0	0	0	109.7	A92 M96	A92-T94 PolarHBondContact O-N 3.05Å; A92-T94 VanDerWaalsContact O-N 3.08Å; T94-M96 PolarHBondContact O-N 3.49Å
95	K	58.5	Low	83.7	Confident	214 Å²	214	43.8 Å²	43.8	93%	0.93	23%	0.226	S	C	*	.			trans	-64.2	16.8	178.2	-70.9	-172.2	176.2	-175.1	0	115.4
96	M	60.9	Low	83.7	Confident	139 Å²	139	45.7 Å²	45.7	69%	0.685	23%	0.234	S	C	*	.			trans	-80.3	121.1	175.1	-64.9	-64.6	149.9	0	0	108.7	T94 G98 D99	T94-M96 PolarHBondContact O-N 3.49Å; M96-G98 PolarHBondContact O-N 3Å; M96-D99 PolarHBondContact O-N 3.42Å
97	Q	58.7	Low	83.4	Confident	202 Å²	202	48 Å²	48	94%	0.944	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	116	-174.2	-148.7	163.5	7.1	0	0	110.1
98	G	63.5	Low	83	Confident	17 Å²	17	50 Å²	50	18%	0.175	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	108.5	-0.1	176.4	0	0	0	0	0	116.4	M96 Y100 H117	M96-G98 PolarHBondContact O-N 3Å; G98-Y100 WeakPolarHBondContact O-CD2 3.45Å; G98-Y100 WeakPolarHBondContact O-CE2 3.04Å; G98-H117 WeakPolarHBondContact O-CB 3.42Å
99	D	78.2	Confident	82.8	Confident	29 Å²	29	54.7 Å²	54.7	16%	0.155	31%	0.305	C	S	.	.			trans	-85.3	123.8	171.6	-82.6	-5.8	0	0	0	110.5	A92 M96 K114	A92-D99 HydrophobicContact CB-CB 3.58Å; A92-D99 WeakPolarHBondContact CB-O 3.47Å; A92-D99 PolarHBondContact N-O 3.14Å; M96-D99 PolarHBondContact O-N 3.42Å; D99-K114 IonicContact OD1-NZ 3.1Å; D99-K114 WeakPolarHBondContact OD2-CE 3.43Å; D99-K114 IonicContact OD2-NZ 2.67Å; D99-K114 PolarHBondContact OD2-NZ 3.07Å
100	Y	90.3	Very high	82.7	Confident	37 Å²	37	56.5 Å²	56.5	15%	0.145	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	156.1	177	-55.8	-79.9	0	0	0	111.2	L60 Y66 D91 G98 I115 Y122 V133	L60-Y100 HydrophobicContact CD2-CD1 4.42Å; L60-Y100 HydrophobicContact CD2-CE1 3.66Å; L60-Y100 HydrophobicContact CD2-CE2 4Å; L60-Y100 VanDerWaalsContact CD2-CZ 3.41Å; L60-Y100 WeakPolarHBondContact CD2-OH 3.26Å; Y66-Y100 AromaticContact CE2-CD1 3.95Å; Y66-Y100 HydrophobicContact CE2-CD1 3.95Å; Y66-Y100 AromaticContact CE2-CE1 3.89Å; Y66-Y100 HydrophobicContact CE2-CE1 3.89Å; D91-Y100 WeakPolarHBondContact OD1-CE1 3.35Å; G98-Y100 WeakPolarHBondContact O-CD2 3.45Å; G98-Y100 WeakPolarHBondContact O-CE2 3.04Å; Y100-I115 PolarHBondContact N-O 2.99Å; Y100-I115 PolarHBondContact O-N 3.07Å; Y100-Y122 HydrophobicContact CD2-CE1 4.48Å; Y100-Y122 HydrophobicContact CE2-CE1 4.07Å; Y100-V133 HydrophobicContact CD2-CG2 3.6Å; Y100-V133 HydrophobicContact CE2-CG2 3.71Å; Y100-V133 HydrophobicContact CG-CG2 4.45Å
101	T	92.5	Very high	82.7	Confident	15 Å²	15	60.1 Å²	60.1	9%	0.092	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	118.3	173.7	-50.6	0	0	0	0	109.8	V89 R90 L112	V89-T101 WeakPolarHBondContact CA-O 3.49Å; R90-T101 PolarHBondContact N-O 3.25Å; R90-T101 PolarHBondContact O-N 3.23Å; T101-L112 HydrophobicContact CG2-CB 4.31Å; T101-L112 HydrophobicContact CG2-CD2 4.49Å
102	L	93.7	Very high	82.8	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	125.7	166.4	170	65.3	0	0	0	108.6	F87 V89 I113 I115 F124 I137 L156	F87-L102 HydrophobicContact CB-CD1 4.03Å; F87-L102 HydrophobicContact CD2-CD1 3.76Å; F87-L102 HydrophobicContact CG-CD1 4.31Å; V89-L102 HydrophobicContact CG2-CB 4.38Å; V89-L102 HydrophobicContact CG2-CD1 3.87Å; L102-I113 HydrophobicContact CB-CB 4.33Å; L102-I113 HydrophobicContact CD2-CD1 4.23Å; L102-I113 PolarHBondContact N-O 3.47Å; L102-I113 PolarHBondContact O-N 3.22Å; L102-I115 HydrophobicContact CB-CD1 4.1Å; L102-I115 HydrophobicContact CB-CG1 4.42Å; L102-F124 HydrophobicContact CD2-CE1 3.79Å; L102-F124 HydrophobicContact CD2-CZ 3.59Å; L102-I137 HydrophobicContact CD1-CD1 3.98Å; L102-I137 HydrophobicContact CD2-CD1 4.14Å; L102-L156 HydrophobicContact CD1-CD2 4.35Å; L102-L156 HydrophobicContact CD2-CD1 4.23Å; L102-L156 HydrophobicContact CD2-CD2 4.22Å
103	T	94.3	Very high	83.1	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.012	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124.9	170.8	-48.4	0	0	0	0	109.1	V75 L79 F87 L88 N110 K111 L112	V75-T103 HydrophobicContact CG1-CG2 3.76Å; L79-T103 HydrophobicContact CD1-CG2 3.47Å; L79-T103 VanDerWaalsContact CD1-CG2 3.47Å; F87-T103 WeakPolarHBondContact CA-O 3.46Å; L88-T103 PolarHBondContact N-O 3.02Å; L88-T103 PolarHBondContact O-N 3.29Å; T103-N110 HydrophobicContact CG2-CB 4.06Å; T103-K111 WeakPolarHBondContact CA-O 3.25Å; T103-L112 HydrophobicContact CG2-CD1 4.41Å; T103-L112 HydrophobicContact CG2-CG 4.43Å
104	L	94.3	Very high	83.8	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	135.7	-174.6	165.5	68.4	0	0	0	110.5	T86 F87 K111 L145 V154 L156	T86-L104 WeakPolarHBondContact O-CA 3.49Å; F87-L104 HydrophobicContact CB-CD1 4.21Å; L104-K111 PolarHBondContact N-O 2.9Å; L104-K111 PolarHBondContact O-N 3.44Å; L104-L145 HydrophobicContact CD2-CD1 3.26Å; L104-V154 HydrophobicContact CD1-CG1 4.35Å; L104-V154 HydrophobicContact CD2-CG1 3.68Å; L104-V154 HydrophobicContact CG-CG1 4.38Å; L104-L156 HydrophobicContact CD1-CD2 3.93Å; L104-L156 HydrophobicContact CD2-CD2 4.3Å
105	R	94.6	Very high	84.9	Confident	29 Å²	29	57.4 Å²	57.4	11%	0.109	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	126	173.3	-171.7	145.8	169.1	139	0.9	111.4	L79 M82 D84 G85 T86	L79-R105 WeakPolarHBondContact O-CD 3.38Å; L79-R105 PolarHBondContact O-NE 3.39Å; L79-R105 PolarHBondContact O-NH1 3.44Å; M82-R105 VanDerWaalsContact O-CD 3.26Å; M82-R105 WeakPolarHBondContact O-CD 3.5Å; M82-R105 PolarHBondContact O-NE 3.25Å; D84-R105 WeakPolarHBondContact CA-O 3.46Å; G85-R105 PolarHBondContact N-O 3.28Å; T86-R105 PolarHBondContact O-N 3.05Å
106	K	91.3	Very high	86.2	Confident	41 Å²	41	52.5 Å²	52.5	18%	0.178	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	129.7	173.6	-177.2	174	-178	166.6	0	111.5	D84 G108 N109 K111 K151 L152 D153 V154	D84-K106 WeakPolarHBondContact OD1-CA 3.37Å; K106-G108 VanDerWaalsContact C-N 3.27Å; K106-G108 PolarHBondContact O-N 3.34Å; K106-N109 PolarHBondContact N-O 3.09Å; K106-N109 PolarHBondContact O-N 2.98Å; K106-N109 VanDerWaalsContact O-N 3.14Å; K106-K111 HydrophobicContact CB-CG 4.42Å; K106-K151 WeakPolarHBondContact CE-O 3.39Å; K106-K151 PolarHBondContact NZ-O 2.8Å; K106-L152 HydrophobicContact CD-CD2 3.96Å; K106-D153 PolarHBondContact NZ-O 3.43Å; K106-V154 HydrophobicContact CB-CG1 4.47Å; K106-V154 HydrophobicContact CD-CB 4.28Å; K106-V154 HydrophobicContact CD-CG1 3.92Å; K106-V154 HydrophobicContact CG-CG1 4.45Å
107	G	87.7	Confident	87.4	Confident	53 Å²	53	49.4 Å²	49.4	55%	0.546	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	42.5	179.6	0	0	0	0	0	111.7	D84 N109	D84-G107 PolarHBondContact OD1-N 3.34Å; D84-G107 PolarHBondContact OD2-N 3.49Å; G107-N109 PolarHBondContact O-N 3.28Å; G107-N109 VanDerWaalsContact O-N 3.13Å; G107-N109 PolarHBondContact O-ND2 3.1Å
108	G	87	Confident	88.7	Confident	44 Å²	44	47.1 Å²	47.1	45%	0.454	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	0.9	-178.2	0	0	0	0	0	115.8	K106	K106-G108 VanDerWaalsContact C-N 3.27Å; K106-G108 PolarHBondContact O-N 3.34Å
109	N	89.9	Confident	89.6	Confident	98 Å²	98	53.7 Å²	53.7	52%	0.524	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	146.8	-177.1	-72	-81.1	0	0	0	112.1	K106 G107	K106-N109 PolarHBondContact N-O 3.09Å; K106-N109 PolarHBondContact O-N 2.98Å; K106-N109 VanDerWaalsContact O-N 3.14Å; G107-N109 PolarHBondContact O-N 3.28Å; G107-N109 VanDerWaalsContact O-N 3.13Å; G107-N109 PolarHBondContact O-ND2 3.1Å
110	N	92.5	Very high	89.8	Confident	38 Å²	38	54.3 Å²	54.3	20%	0.203	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	124	172.8	-64.3	-14.8	0	0	0	110	N76 T103	N76-N110 PolarHBondContact OD1-ND2 2.82Å; T103-N110 HydrophobicContact CG2-CB 4.06Å
111	K	91.8	Very high	89.7	Confident	83 Å²	83	56 Å²	56	36%	0.361	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	118.3	177	-56.3	-58.3	-179.8	-170.2	0	108.5	T103 L104 K106 L152	T103-K111 WeakPolarHBondContact CA-O 3.25Å; L104-K111 PolarHBondContact N-O 2.9Å; L104-K111 PolarHBondContact O-N 3.44Å; K106-K111 HydrophobicContact CB-CG 4.42Å; K111-L152 HydrophobicContact CB-CD2 4.46Å; K111-L152 HydrophobicContact CG-CD2 3.97Å
112	L	91.1	Very high	89.5	Confident	81 Å²	81	57.3 Å²	57.3	42%	0.424	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	123.8	177.2	-71.4	76.1	0	0	0	108.6	T101 T103	T101-L112 HydrophobicContact CG2-CB 4.31Å; T101-L112 HydrophobicContact CG2-CD2 4.49Å; T103-L112 HydrophobicContact CG2-CD1 4.41Å; T103-L112 HydrophobicContact CG2-CG 4.43Å
113	I	91.1	Very high	89.3	Confident	8 Å²	8	57.4 Å²	57.4	4%	0.041	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	121.6	-179.3	-51.8	175.3	0	0	0	107.5	L102 F124 Y148 L152	L102-I113 HydrophobicContact CB-CB 4.33Å; L102-I113 HydrophobicContact CD2-CD1 4.23Å; L102-I113 PolarHBondContact N-O 3.47Å; L102-I113 PolarHBondContact O-N 3.22Å; I113-F124 HydrophobicContact CG2-CB 4.24Å; I113-F124 HydrophobicContact CG2-CD1 3.42Å; I113-F124 VanDerWaalsContact CG2-CD1 3.42Å; I113-F124 HydrophobicContact CG2-CE1 3.83Å; I113-F124 HydrophobicContact CG2-CG 3.86Å; I113-Y148 HydrophobicContact CG2-CE1 4.15Å; I113-L152 HydrophobicContact CD1-CD1 3.91Å
114	K	89.8	Confident	89	Confident	76 Å²	76	57.7 Å²	57.7	33%	0.33	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	132.5	176.4	-174.8	168.9	178.8	174.3	0	109.6	D99 Y116	D99-K114 IonicContact OD1-NZ 3.1Å; D99-K114 WeakPolarHBondContact OD2-CE 3.43Å; D99-K114 IonicContact OD2-NZ 2.67Å; D99-K114 PolarHBondContact OD2-NZ 3.07Å; K114-Y116 HydrophobicContact CB-CE2 4.22Å; K114-Y116 HydrophobicContact CD-CD1 4.26Å; K114-Y116 HydrophobicContact CD-CE1 3.67Å; K114-Y116 HydrophobicContact CD-CE2 4.47Å; K114-Y116 HydrophobicContact CG-CD1 4.49Å; K114-Y116 HydrophobicContact CG-CE1 4.21Å; K114-Y116 HydrophobicContact CG-CE2 4.26Å
115	I	90.8	Very high	88.4	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	116.8	169.8	-60.2	165.8	0	0	0	106.6	V89 Y100 L102 Y122 F124 V133 L136	V89-I115 HydrophobicContact CG1-CD1 4.14Å; V89-I115 HydrophobicContact CG2-CD1 4.5Å; Y100-I115 PolarHBondContact N-O 2.99Å; Y100-I115 PolarHBondContact O-N 3.07Å; L102-I115 HydrophobicContact CB-CD1 4.1Å; L102-I115 HydrophobicContact CB-CG1 4.42Å; I115-Y122 HydrophobicContact CG2-CD1 4.27Å; I115-F124 HydrophobicContact CG1-CD1 4.1Å; I115-F124 HydrophobicContact CG1-CE1 3.79Å; I115-V133 HydrophobicContact CD1-CG1 4.06Å; I115-V133 HydrophobicContact CG2-CG2 4.41Å; I115-L136 HydrophobicContact CD1-CD2 3.98Å; I115-L136 HydrophobicContact CG1-CD2 3.9Å; I115-L136 HydrophobicContact CG2-CD2 3.85Å
116	Y	86.7	Confident	87.6	Confident	111 Å²	111	64.9 Å²	64.9	44%	0.435	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	148.1	177.8	-66	-83.4	0	0	0	110.7	K114 Y122 G123 F124	K114-Y116 HydrophobicContact CB-CE2 4.22Å; K114-Y116 HydrophobicContact CD-CD1 4.26Å; K114-Y116 HydrophobicContact CD-CE1 3.67Å; K114-Y116 HydrophobicContact CD-CE2 4.47Å; K114-Y116 HydrophobicContact CG-CD1 4.49Å; K114-Y116 HydrophobicContact CG-CE1 4.21Å; K114-Y116 HydrophobicContact CG-CE2 4.26Å; Y116-Y122 WeakPolarHBondContact O-CA 3.35Å; Y116-G123 PolarHBondContact N-O 2.87Å; Y116-G123 PolarHBondContact O-N 2.86Å; Y116-F124 WeakPolarHBondContact CD2-O 3.32Å; Y116-F124 WeakPolarHBondContact CE2-O 3.49Å
117	H	86.8	Confident	87.2	Confident	73 Å²	73	68 Å²	68	34%	0.338	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	124.6	174.8	172.3	-115.5	0	0	0	110.2	G98 K121 Y122	G98-H117 WeakPolarHBondContact O-CB 3.42Å; H117-K121 WeakPolarHBondContact CA-O 3.32Å; H117-Y122 HydrophobicContact CB-CD1 3.99Å; H117-Y122 HydrophobicContact CB-CE1 3.78Å; H117-Y122 AromaticContact CD2-CE1 3.43Å; H117-Y122 VanDerWaalsContact CD2-CE1 3.43Å; H117-Y122 WeakPolarHBondContact CD2-CE1 3.09Å; H117-Y122 AromaticContact CD2-CE2 3.97Å; H117-Y122 AromaticContact CD2-CZ 3.42Å; H117-Y122 VanDerWaalsContact CD2-CZ 3.42Å; H117-Y122 AromaticContact CG-CE1 3.75Å
118	R	84.4	Confident	87.2	Confident	155 Å²	155	66.7 Å²	66.7	59%	0.585	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.3	135.8	173.3	178.7	-177.1	-93	165.7	-8.4	109.2	G120 K121 L128	R118-G120 PolarHBondContact O-N 3.48Å; R118-G120 VanDerWaalsContact O-N 3.14Å; R118-K121 PolarHBondContact N-O 3.25Å; R118-K121 VanDerWaalsContact N-O 3.1Å; R118-K121 WeakPolarHBondContact O-CB 3.47Å; R118-K121 PolarHBondContact O-N 3.36Å; R118-L128 HydrophobicContact CB-CD1 3.69Å
119	D	83.5	Confident	87.2	Confident	154 Å²	154	68.4 Å²	68.4	82%	0.824	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	35.7	176.6	-55	-36.1	0	0	0	114.6	K121	D119-K121 PolarHBondContact O-N 3.11Å
120	G	82.6	Confident	87.1	Confident	43 Å²	43	64.7 Å²	64.7	44%	0.443	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	10.5	-178.5	0	0	0	0	0	114.5	R118	R118-G120 PolarHBondContact O-N 3.48Å; R118-G120 VanDerWaalsContact O-N 3.14Å
121	K	87.4	Confident	87	Confident	73 Å²	73	67.4 Å²	67.4	32%	0.317	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	150.1	175.9	-66.4	-69.4	-165.3	168.2	0	111.5	H117 R118 D119 L128 T129 F130 N131	H117-K121 WeakPolarHBondContact CA-O 3.32Å; R118-K121 PolarHBondContact N-O 3.25Å; R118-K121 VanDerWaalsContact N-O 3.1Å; R118-K121 WeakPolarHBondContact O-CB 3.47Å; R118-K121 PolarHBondContact O-N 3.36Å; D119-K121 PolarHBondContact O-N 3.11Å; K121-L128 HydrophobicContact CB-CB 3.73Å; K121-L128 WeakPolarHBondContact O-CD1 3.37Å; K121-T129 PolarHBondContact NZ-O 3.33Å; K121-F130 CarbonylContact C-O 3.6Å; K121-F130 VanDerWaalsContact CA-O 3.23Å; K121-F130 WeakPolarHBondContact CA-O 3.45Å; K121-F130 VanDerWaalsContact CD-O 3.3Å; K121-F130 WeakPolarHBondContact CD-O 3.27Å; K121-N131 WeakPolarHBondContact CE-OD1 3.44Å; K121-N131 PolarHBondContact NZ-OD1 3.46Å
122	Y	89.3	Confident	86.8	Confident	41 Å²	41	65.6 Å²	65.6	16%	0.161	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	151.3	-178.3	-60.4	-89.4	0	0	0	111.9	Y100 I115 Y116 H117 F130 V133	Y100-Y122 HydrophobicContact CD2-CE1 4.48Å; Y100-Y122 HydrophobicContact CE2-CE1 4.07Å; I115-Y122 HydrophobicContact CG2-CD1 4.27Å; Y116-Y122 WeakPolarHBondContact O-CA 3.35Å; H117-Y122 HydrophobicContact CB-CD1 3.99Å; H117-Y122 HydrophobicContact CB-CE1 3.78Å; H117-Y122 AromaticContact CD2-CE1 3.43Å; H117-Y122 VanDerWaalsContact CD2-CE1 3.43Å; H117-Y122 WeakPolarHBondContact CD2-CE1 3.09Å; H117-Y122 AromaticContact CD2-CE2 3.97Å; H117-Y122 AromaticContact CD2-CZ 3.42Å; H117-Y122 VanDerWaalsContact CD2-CZ 3.42Å; H117-Y122 AromaticContact CG-CE1 3.75Å; Y122-F130 PolarHBondContact N-O 3.3Å; Y122-F130 WeakPolarHBondContact O-CB 3.46Å; Y122-F130 WeakPolarHBondContact O-CD2 2.83Å; Y122-F130 PolarHBondContact O-N 3.27Å; Y122-V133 HydrophobicContact CD1-CG2 3.56Å; Y122-V133 HydrophobicContact CE1-CG2 3.75Å; Y122-V133 HydrophobicContact CG-CG2 4.03Å
123	G	88.5	Confident	86.8	Confident	3 Å²	3	61.9 Å²	61.9	3%	0.031	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.5	169.3	179.8	0	0	0	0	0	113.7	Y116	Y116-G123 PolarHBondContact N-O 2.87Å; Y116-G123 PolarHBondContact O-N 2.86Å
124	F	87.6	Confident	86.8	Confident	7 Å²	7	62.3 Å²	62.3	3%	0.031	33%	0.329	C	S	.	.	S	Bend	trans	-87.4	-24.9	175.8	-57.2	-46.7	0	0	0	113.3	L102 I113 I115 Y116 L136 Y140 L145 Y148	L102-F124 HydrophobicContact CD2-CE1 3.79Å; L102-F124 HydrophobicContact CD2-CZ 3.59Å; I113-F124 HydrophobicContact CG2-CB 4.24Å; I113-F124 HydrophobicContact CG2-CD1 3.42Å; I113-F124 VanDerWaalsContact CG2-CD1 3.42Å; I113-F124 HydrophobicContact CG2-CE1 3.83Å; I113-F124 HydrophobicContact CG2-CG 3.86Å; I115-F124 HydrophobicContact CG1-CD1 4.1Å; I115-F124 HydrophobicContact CG1-CE1 3.79Å; Y116-F124 WeakPolarHBondContact CD2-O 3.32Å; Y116-F124 WeakPolarHBondContact CE2-O 3.49Å; F124-L136 HydrophobicContact CD1-CD2 4.37Å; F124-L136 HydrophobicContact CE1-CD2 3.76Å; F124-L136 HydrophobicContact CE1-CG 4.42Å; F124-L136 HydrophobicContact CE2-CD1 4.35Å; F124-L136 HydrophobicContact CZ-CD1 4.32Å; F124-L136 HydrophobicContact CZ-CD2 3.99Å; F124-L136 HydrophobicContact CZ-CG 4.17Å; F124-Y140 HydrophobicContact CD2-CD2 4.34Å; F124-Y140 AromaticContact CD2-CE2 3.73Å; F124-Y140 HydrophobicContact CD2-CE2 3.73Å; F124-Y140 AromaticContact CD2-CZ 3.96Å; F124-Y140 AromaticContact CE2-CD2 3.4Å; F124-Y140 HydrophobicContact CE2-CD2 3.4Å; F124-Y140 VanDerWaalsContact CE2-CD2 3.4Å; F124-Y140 HydrophobicContact CE2-CE1 4.4Å; F124-Y140 AromaticContact CE2-CE2 3.24Å; F124-Y140 HydrophobicContact CE2-CE2 3.24Å; F124-Y140 HydrophobicContact CE2-CG 4.08Å; F124-Y140 AromaticContact CE2-CZ 3.77Å; F124-Y140 AromaticContact CZ-CD2 3.99Å; F124-Y140 HydrophobicContact CZ-CD2 3.99Å; F124-Y140 HydrophobicContact CZ-CE2 4.15Å; F124-L145 HydrophobicContact CD2-CD2 4.14Å; F124-L145 HydrophobicContact CE2-CD2 3.41Å; F124-L145 VanDerWaalsContact CE2-CD2 3.41Å; F124-L145 HydrophobicContact CZ-CD2 4.1Å; F124-Y148 HydrophobicContact CB-CD1 4.42Å; F124-Y148 HydrophobicContact CB-CD2 3.62Å; F124-Y148 HydrophobicContact CB-CE1 4.3Å; F124-Y148 HydrophobicContact CB-CE2 3.48Å; F124-Y148 VanDerWaalsContact CB-CE2 3.48Å; F124-Y148 HydrophobicContact CB-CG 4.1Å; F124-Y148 HydrophobicContact CD2-CD1 4.23Å; F124-Y148 HydrophobicContact CD2-CD2 4.32Å; F124-Y148 AromaticContact CD2-CG 3.99Å; F124-Y148 HydrophobicContact CD2-CG 3.99Å; F124-Y148 HydrophobicContact CG-CD2 4.44Å; F124-Y148 HydrophobicContact CG-CG 4.46Å
125	S	83.1	Confident	86.8	Confident	63 Å²	63	62.6 Å²	62.6	44%	0.441	33%	0.331	S	S	.	.	S	Bend	trans	-154	160.2	177.3	54.8	0	0	0	0	110.1	P127	S125-P127 CarbonylContact O-C 3.29Å
126	D	77.6	Confident	86.9	Confident	117 Å²	117	62.6 Å²	62.6	63%	0.626	33%	0.331	S	S	*	.	S	Bend	trans	-65.4	139.4	172.7	-79.6	-48.1	0	0	0	111.3
127	P	81.9	Confident	87.2	Confident	107 Å²	107	57.3 Å²	57.3	70%	0.695	31%	0.311	S	S	*	.	S	Bend	cis	-80.2	140.3	-1	31.8	-33.9	0	0	0	113.8	S125 T129	S125-P127 CarbonylContact O-C 3.29Å; P127-T129 PolarHBondContact O-N 3.5Å
128	L	86.9	Confident	87.4	Confident	25 Å²	25	57.6 Å²	57.6	13%	0.131	32%	0.315	C	S	.	.			trans	-76.3	111.6	175.4	-51.1	-177.6	0	0	0	110.9	R118 K121	R118-L128 HydrophobicContact CB-CD1 3.69Å; K121-L128 HydrophobicContact CB-CB 3.73Å; K121-L128 WeakPolarHBondContact O-CD1 3.37Å
129	T	87.7	Confident	87.7	Confident	80 Å²	80	52.8 Å²	52.8	49%	0.491	30%	0.299	S	S	.	.			trans	-100.4	-26.6	-171.3	49.8	0	0	0	0	114.4	K121 P127	K121-T129 PolarHBondContact NZ-O 3.33Å; P127-T129 PolarHBondContact O-N 3.5Å
130	F	89.1	Confident	88	Confident	21 Å²	21	46.4 Å²	46.4	9%	0.092	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-88.8	147.1	-169.1	-56.7	-84.4	0	0	0	112.4	K121 Y122 E135 L136 H139 Y140	K121-F130 CarbonylContact C-O 3.6Å; K121-F130 VanDerWaalsContact CA-O 3.23Å; K121-F130 WeakPolarHBondContact CA-O 3.45Å; K121-F130 VanDerWaalsContact CD-O 3.3Å; K121-F130 WeakPolarHBondContact CD-O 3.27Å; Y122-F130 PolarHBondContact N-O 3.3Å; Y122-F130 WeakPolarHBondContact O-CB 3.46Å; Y122-F130 WeakPolarHBondContact O-CD2 2.83Å; Y122-F130 PolarHBondContact O-N 3.27Å; F130-E135 HydrophobicContact CD1-CG 4.14Å; F130-L136 HydrophobicContact CB-CB 4.18Å; F130-L136 HydrophobicContact CD1-CB 4.46Å; F130-L136 HydrophobicContact CD2-CB 4.26Å; F130-L136 HydrophobicContact CD2-CD1 3.24Å; F130-L136 HydrophobicContact CD2-CG 4.36Å; F130-L136 HydrophobicContact CE2-CD1 3.46Å; F130-L136 VanDerWaalsContact CE2-CD1 3.46Å; F130-L136 HydrophobicContact CG-CB 4.03Å; F130-L136 HydrophobicContact CG-CD1 3.9Å; F130-L136 HydrophobicContact CZ-CD1 4.25Å; F130-H139 HydrophobicContact CD1-CB 4.5Å; F130-H139 HydrophobicContact CE1-CB 3.62Å; F130-H139 AromaticContact CE1-CD2 3.75Å; F130-H139 AromaticContact CE1-CG 3.62Å; F130-H139 HydrophobicContact CZ-CB 4.18Å; F130-H139 AromaticContact CZ-CD2 3.47Å; F130-H139 VanDerWaalsContact CZ-CD2 3.47Å; F130-H139 WeakPolarHBondContact CZ-CD2 3.42Å; F130-H139 AromaticContact CZ-CG 3.85Å; F130-H139 AromaticContact CZ-NE2 4Å; F130-Y140 HydrophobicContact CE2-CE2 4.18Å; F130-Y140 HydrophobicContact CZ-CE2 4.16Å
131	N	88.4	Confident	88.4	Confident	95 Å²	95	48 Å²	48	51%	0.508	26%	0.259	S	S	.	.	S	Bend	trans	-89.9	-16.4	-179.5	-52.4	-72.4	0	0	0	113	K121 E135	K121-N131 WeakPolarHBondContact CE-OD1 3.44Å; K121-N131 PolarHBondContact NZ-OD1 3.46Å; N131-E135 WeakPolarHBondContact CB-OE2 3.46Å; N131-E135 PolarHBondContact N-OE2 3.04Å; N131-E135 PolarHBondContact ND2-OE2 3.5Å; N131-E135 VanDerWaalsContact ND2-OE2 3.08Å
132	S	89.4	Confident	88.3	Confident	44 Å²	44	50.6 Å²	50.6	31%	0.308	27%	0.272	S	S	.	.	S	Bend	trans	-148.7	159.3	175.4	70.6	0	0	0	0	111.7	V134 E135 L136	S132-V134 PolarHBondContact O-N 3.17Å; S132-E135 PolarHBondContact O-N 2.84Å; S132-E135 WeakPolarHBondContact OG-CB 3.49Å; S132-E135 PolarHBondContact OG-N 3.3Å; S132-L136 PolarHBondContact O-N 2.78Å
133	V	89.5	Confident	88.2	Confident	4 Å²	4	52.2 Å²	52.2	2%	0.024	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-33.8	171.4	-179.1	0	0	0	0	111.2	L60 W65 Y100 I115 Y122 L136 I137	L60-V133 HydrophobicContact CD1-CB 3.98Å; L60-V133 HydrophobicContact CD1-CG1 3.94Å; L60-V133 HydrophobicContact CD2-CB 4.31Å; L60-V133 HydrophobicContact CD2-CG2 4.3Å; W65-V133 HydrophobicContact CH2-CG1 4.04Å; W65-V133 HydrophobicContact CZ3-CG1 4.16Å; Y100-V133 HydrophobicContact CD2-CG2 3.6Å; Y100-V133 HydrophobicContact CE2-CG2 3.71Å; Y100-V133 HydrophobicContact CG-CG2 4.45Å; I115-V133 HydrophobicContact CD1-CG1 4.06Å; I115-V133 HydrophobicContact CG2-CG2 4.41Å; Y122-V133 HydrophobicContact CD1-CG2 3.56Å; Y122-V133 HydrophobicContact CE1-CG2 3.75Å; Y122-V133 HydrophobicContact CG-CG2 4.03Å; V133-L136 WeakPolarHBondContact O-CB 3.39Å; V133-L136 PolarHBondContact O-N 2.86Å; V133-I137 HydrophobicContact CG1-CG1 4.24Å; V133-I137 VanDerWaalsContact O-CG1 3.3Å; V133-I137 WeakPolarHBondContact O-CG1 3.19Å; V133-I137 PolarHBondContact O-N 3.16Å
134	V	91.4	Very high	88.3	Confident	17 Å²	17	53 Å²	53	10%	0.103	29%	0.287	C	S	.	.	H	α-helix	trans	-64.6	-42.7	177.5	179.3	0	0	0	0	110.8	L60 W65 S132 I137 N138	L60-V134 HydrophobicContact CB-CG2 4.31Å; L60-V134 HydrophobicContact CD1-CG2 4.29Å; W65-V134 HydrophobicContact CH2-CG2 4.24Å; W65-V134 HydrophobicContact CZ2-CG2 4.24Å; S132-V134 PolarHBondContact O-N 3.17Å; V134-I137 PolarHBondContact O-N 3.31Å; V134-N138 VanDerWaalsContact O-CB 3.27Å; V134-N138 WeakPolarHBondContact O-CB 3.36Å; V134-N138 VanDerWaalsContact O-CG 3.24Å; V134-N138 PolarHBondContact O-N 3.48Å; V134-N138 PolarHBondContact O-ND2 2.98Å
135	E	91	Very high	88.4	Confident	81 Å²	81	52.7 Å²	52.7	38%	0.379	29%	0.285	S	S	.	.	H	α-helix	trans	-63.5	-45.1	175.3	-168.8	-174.3	-178.7	0	0	111.7	F130 N131 S132 I137 N138 H139	F130-E135 HydrophobicContact CD1-CG 4.14Å; N131-E135 WeakPolarHBondContact CB-OE2 3.46Å; N131-E135 PolarHBondContact N-OE2 3.04Å; N131-E135 PolarHBondContact ND2-OE2 3.5Å; N131-E135 VanDerWaalsContact ND2-OE2 3.08Å; S132-E135 PolarHBondContact O-N 2.84Å; S132-E135 WeakPolarHBondContact OG-CB 3.49Å; S132-E135 PolarHBondContact OG-N 3.3Å; E135-I137 PolarHBondContact O-N 2.7Å; E135-N138 PolarHBondContact O-N 3.36Å; E135-H139 WeakPolarHBondContact O-CB 3.15Å; E135-H139 PolarHBondContact O-N 2.96Å
136	L	91.8	Very high	88.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-54.8	-52.8	174.9	176.7	83.9	0	0	0	111.4	I115 F124 F130 S132 V133 H139 Y140	I115-L136 HydrophobicContact CD1-CD2 3.98Å; I115-L136 HydrophobicContact CG1-CD2 3.9Å; I115-L136 HydrophobicContact CG2-CD2 3.85Å; F124-L136 HydrophobicContact CD1-CD2 4.37Å; F124-L136 HydrophobicContact CE1-CD2 3.76Å; F124-L136 HydrophobicContact CE1-CG 4.42Å; F124-L136 HydrophobicContact CE2-CD1 4.35Å; F124-L136 HydrophobicContact CZ-CD1 4.32Å; F124-L136 HydrophobicContact CZ-CD2 3.99Å; F124-L136 HydrophobicContact CZ-CG 4.17Å; F130-L136 HydrophobicContact CB-CB 4.18Å; F130-L136 HydrophobicContact CD1-CB 4.46Å; F130-L136 HydrophobicContact CD2-CB 4.26Å; F130-L136 HydrophobicContact CD2-CD1 3.24Å; F130-L136 HydrophobicContact CD2-CG 4.36Å; F130-L136 HydrophobicContact CE2-CD1 3.46Å; F130-L136 VanDerWaalsContact CE2-CD1 3.46Å; F130-L136 HydrophobicContact CG-CB 4.03Å; F130-L136 HydrophobicContact CG-CD1 3.9Å; F130-L136 HydrophobicContact CZ-CD1 4.25Å; S132-L136 PolarHBondContact O-N 2.78Å; V133-L136 WeakPolarHBondContact O-CB 3.39Å; V133-L136 PolarHBondContact O-N 2.86Å; L136-H139 PolarHBondContact O-N 3.3Å; L136-Y140 HydrophobicContact CD1-CD2 4.19Å; L136-Y140 HydrophobicContact CD1-CE2 3.8Å; L136-Y140 HydrophobicContact CG-CD2 4.36Å; L136-Y140 HydrophobicContact CG-CE2 4.46Å; L136-Y140 VanDerWaalsContact O-CD2 3.26Å; L136-Y140 WeakPolarHBondContact O-CD2 3.38Å; L136-Y140 PolarHBondContact O-N 3.32Å
137	I	93.1	Very high	88.9	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-66.6	-42.4	-177.8	-65.4	-62.1	0	0	0	110.9	W65 F87 V89 L102 V133 V134 E135 H139 Y140 H141 L156	W65-I137 HydrophobicContact CD2-CG2 4.13Å; W65-I137 HydrophobicContact CE3-CG1 4.4Å; W65-I137 HydrophobicContact CH2-CB 3.91Å; W65-I137 HydrophobicContact CH2-CG1 3.62Å; W65-I137 HydrophobicContact CH2-CG2 4.25Å; W65-I137 HydrophobicContact CZ2-CB 3.75Å; W65-I137 HydrophobicContact CZ2-CG1 3.99Å; W65-I137 HydrophobicContact CZ2-CG2 3.75Å; W65-I137 HydrophobicContact CZ3-CB 4.49Å; W65-I137 HydrophobicContact CZ3-CG1 3.84Å; F87-I137 HydrophobicContact CE2-CG2 3.59Å; F87-I137 HydrophobicContact CZ-CG2 3.94Å; V89-I137 HydrophobicContact CG2-CD1 3.83Å; V89-I137 HydrophobicContact CG2-CG1 4.16Å; L102-I137 HydrophobicContact CD1-CD1 3.98Å; L102-I137 HydrophobicContact CD2-CD1 4.14Å; V133-I137 HydrophobicContact CG1-CG1 4.24Å; V133-I137 VanDerWaalsContact O-CG1 3.3Å; V133-I137 WeakPolarHBondContact O-CG1 3.19Å; V133-I137 PolarHBondContact O-N 3.16Å; V134-I137 PolarHBondContact O-N 3.31Å; E135-I137 PolarHBondContact O-N 2.7Å; I137-H139 VanDerWaalsContact C-N 3.29Å; I137-H139 PolarHBondContact O-N 3.3Å; I137-Y140 CarbonylContact O-C 3.56Å; I137-Y140 PolarHBondContact O-N 3.43Å; I137-H141 WeakPolarHBondContact O-CB 3.43Å; I137-H141 PolarHBondContact O-N 2.9Å; I137-L156 HydrophobicContact CB-CD1 4.47Å; I137-L156 HydrophobicContact CD1-CD1 3.69Å; I137-L156 HydrophobicContact CG2-CD1 4.01Å
138	N	90.3	Very high	89	Confident	79 Å²	79	50.1 Å²	50.1	42%	0.422	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-33	177.3	-77.6	-16.1	0	0	0	112.8	V134 E135 H141 H142	V134-N138 VanDerWaalsContact O-CB 3.27Å; V134-N138 WeakPolarHBondContact O-CB 3.36Å; V134-N138 VanDerWaalsContact O-CG 3.24Å; V134-N138 PolarHBondContact O-N 3.48Å; V134-N138 PolarHBondContact O-ND2 2.98Å; E135-N138 PolarHBondContact O-N 3.36Å; N138-H141 WeakPolarHBondContact O-CB 3.36Å; N138-H142 PolarHBondContact O-ND1 3.22Å
139	H	90.7	Very high	88.9	Confident	53 Å²	53	51.7 Å²	51.7	25%	0.245	26%	0.264	C	S	.	.	H	α-helix	trans	-64.9	-52.4	173.7	177	78.2	0	0	0	111.2	F130 E135 L136 I137 H141 H142 E143	F130-H139 HydrophobicContact CD1-CB 4.5Å; F130-H139 HydrophobicContact CE1-CB 3.62Å; F130-H139 AromaticContact CE1-CD2 3.75Å; F130-H139 AromaticContact CE1-CG 3.62Å; F130-H139 HydrophobicContact CZ-CB 4.18Å; F130-H139 AromaticContact CZ-CD2 3.47Å; F130-H139 VanDerWaalsContact CZ-CD2 3.47Å; F130-H139 WeakPolarHBondContact CZ-CD2 3.42Å; F130-H139 AromaticContact CZ-CG 3.85Å; F130-H139 AromaticContact CZ-NE2 4Å; E135-H139 WeakPolarHBondContact O-CB 3.15Å; E135-H139 PolarHBondContact O-N 2.96Å; L136-H139 PolarHBondContact O-N 3.3Å; I137-H139 VanDerWaalsContact C-N 3.29Å; I137-H139 PolarHBondContact O-N 3.3Å; H139-H141 PolarHBondContact O-N 2.97Å; H139-H142 PolarHBondContact O-N 3.42Å; H139-E143 IonicContact CE1-OE1 3.93Å; H139-E143 PolarHBondContact CE1-OE1 3.49Å; H139-E143 IonicContact CE1-OE2 3.7Å; H139-E143 PolarHBondContact CE1-OE2 3.09Å; H139-E143 IonicContact ND1-OE1 3.1Å; H139-E143 IonicContact NE2-OE2 2.77Å; H139-E143 PolarHBondContact NE2-OE2 3.37Å; H139-E143 PolarHBondContact O-N 2.97Å
140	Y	91.1	Very high	88.9	Confident	21 Å²	21	53 Å²	53	8%	0.082	27%	0.274	C	S	.	.	H	α-helix	trans	-75.4	-4	178.5	-69.2	-70.8	0	0	0	114.8	F124 F130 L136 I137 E143 L145 L156	F124-Y140 HydrophobicContact CD2-CD2 4.34Å; F124-Y140 AromaticContact CD2-CE2 3.73Å; F124-Y140 HydrophobicContact CD2-CE2 3.73Å; F124-Y140 AromaticContact CD2-CZ 3.96Å; F124-Y140 AromaticContact CE2-CD2 3.4Å; F124-Y140 HydrophobicContact CE2-CD2 3.4Å; F124-Y140 VanDerWaalsContact CE2-CD2 3.4Å; F124-Y140 HydrophobicContact CE2-CE1 4.4Å; F124-Y140 AromaticContact CE2-CE2 3.24Å; F124-Y140 HydrophobicContact CE2-CE2 3.24Å; F124-Y140 HydrophobicContact CE2-CG 4.08Å; F124-Y140 AromaticContact CE2-CZ 3.77Å; F124-Y140 AromaticContact CZ-CD2 3.99Å; F124-Y140 HydrophobicContact CZ-CD2 3.99Å; F124-Y140 HydrophobicContact CZ-CE2 4.15Å; F130-Y140 HydrophobicContact CE2-CE2 4.18Å; F130-Y140 HydrophobicContact CZ-CE2 4.16Å; L136-Y140 HydrophobicContact CD1-CD2 4.19Å; L136-Y140 HydrophobicContact CD1-CE2 3.8Å; L136-Y140 HydrophobicContact CG-CD2 4.36Å; L136-Y140 HydrophobicContact CG-CE2 4.46Å; L136-Y140 VanDerWaalsContact O-CD2 3.26Å; L136-Y140 WeakPolarHBondContact O-CD2 3.38Å; L136-Y140 PolarHBondContact O-N 3.32Å; I137-Y140 CarbonylContact O-C 3.56Å; I137-Y140 PolarHBondContact O-N 3.43Å; Y140-E143 CarbonylContact C-O 3.31Å; Y140-E143 WeakPolarHBondContact CA-O 3.5Å; Y140-L145 HydrophobicContact CD1-CD2 3.59Å; Y140-L145 HydrophobicContact CD1-CG 3.98Å; Y140-L145 HydrophobicContact CD2-CD2 4.34Å; Y140-L145 HydrophobicContact CE1-CD2 3.96Å; Y140-L145 HydrophobicContact CG-CD2 3.79Å; Y140-L145 HydrophobicContact CG-CG 4.33Å; Y140-L156 PolarHBondContact O-N 3.01Å
141	H	89.8	Confident	88.6	Confident	75 Å²	75	60.5 Å²	60.5	35%	0.347	31%	0.306	S	S	.	.	H	α-helix	trans	-71	-37.5	163	180	-83.6	0	0	0	110.8	I137 N138 H139 L156	I137-H141 WeakPolarHBondContact O-CB 3.43Å; I137-H141 PolarHBondContact O-N 2.9Å; N138-H141 WeakPolarHBondContact O-CB 3.36Å; H139-H141 PolarHBondContact O-N 2.97Å; H141-L156 PolarHBondContact CD2-O 3.13Å
142	H	85.6	Confident	88.5	Confident	128 Å²	128	56.7 Å²	56.7	59%	0.593	29%	0.286	S	S	*	.	H	α-helix	trans	-94	-32.8	-179.3	-62.5	90.5	0	0	0	112.6	N138 H139 K155	N138-H142 PolarHBondContact O-ND1 3.22Å; H139-H142 PolarHBondContact O-N 3.42Å; H142-K155 VanDerWaalsContact O-CE 3.31Å; H142-K155 WeakPolarHBondContact O-CE 3.48Å; H142-K155 PolarHBondContact O-NZ 3.41Å
143	E	88	Confident	88.5	Confident	76 Å²	76	59.7 Å²	59.7	36%	0.355	30%	0.298	S	S	.	.	S	Bend	trans	-107.8	147.6	-177.6	-61	-167.6	-156.5	0	0	111.7	H139 Y140 Q147	H139-E143 IonicContact CE1-OE1 3.93Å; H139-E143 PolarHBondContact CE1-OE1 3.49Å; H139-E143 IonicContact CE1-OE2 3.7Å; H139-E143 PolarHBondContact CE1-OE2 3.09Å; H139-E143 IonicContact ND1-OE1 3.1Å; H139-E143 IonicContact NE2-OE2 2.77Å; H139-E143 PolarHBondContact NE2-OE2 3.37Å; H139-E143 PolarHBondContact O-N 2.97Å; Y140-E143 CarbonylContact C-O 3.31Å; Y140-E143 WeakPolarHBondContact CA-O 3.5Å; E143-Q147 PolarHBondContact OE2-NE2 3.43Å; E143-Q147 PolarHBondContact OE2-OE1 2.86Å
144	S	89.7	Confident	88.5	Confident	20 Å²	20	60.3 Å²	60.3	14%	0.14	30%	0.302	C	S	.	.			trans	-74.6	139.7	-178.2	-178.4	0	0	0	0	110.9	A146 Q147 D153 V154	S144-A146 PolarHBondContact O-N 2.91Å; S144-A146 WeakPolarHBondContact OG-CB 3.48Å; S144-A146 PolarHBondContact OG-N 3.25Å; S144-Q147 PolarHBondContact O-N 2.97Å; S144-D153 WeakPolarHBondContact OG-CA 3.42Å; S144-D153 PolarHBondContact OG-OD1 2.99Å; S144-V154 PolarHBondContact OG-N 2.77Å
145	L	90.3	Very high	88.6	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-62.5	-6.2	170.3	-77.6	163.3	0	0	0	113.2	L104 F124 Y140 Q147 Y148 N149 L152 V154 L156	L104-L145 HydrophobicContact CD2-CD1 3.26Å; F124-L145 HydrophobicContact CD2-CD2 4.14Å; F124-L145 HydrophobicContact CE2-CD2 3.41Å; F124-L145 VanDerWaalsContact CE2-CD2 3.41Å; F124-L145 HydrophobicContact CZ-CD2 4.1Å; Y140-L145 HydrophobicContact CD1-CD2 3.59Å; Y140-L145 HydrophobicContact CD1-CG 3.98Å; Y140-L145 HydrophobicContact CD2-CD2 4.34Å; Y140-L145 HydrophobicContact CE1-CD2 3.96Å; Y140-L145 HydrophobicContact CG-CD2 3.79Å; Y140-L145 HydrophobicContact CG-CG 4.33Å; L145-Q147 PolarHBondContact O-N 3.29Å; L145-Y148 PolarHBondContact O-N 3.01Å; L145-N149 PolarHBondContact O-N 2.88Å; L145-L152 CarbonylContact C-O 3.58Å; L145-L152 VanDerWaalsContact C-O 3.29Å; L145-L152 HydrophobicContact CB-CB 4.1Å; L145-L152 WeakPolarHBondContact CB-O 3.46Å; L145-V154 WeakPolarHBondContact CB-O 3.33Å; L145-V154 PolarHBondContact N-O 2.93Å; L145-L156 HydrophobicContact CD1-CD2 3.85Å; L145-L156 HydrophobicContact CD1-CG 4.38Å
146	A	86.6	Confident	88.6	Confident	30 Å²	30	59.9 Å²	59.9	25%	0.248	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-51	-33.1	167.5	0	0	0	0	0	113.3	S144 Y148 N149 L152 D153	S144-A146 PolarHBondContact O-N 2.91Å; S144-A146 WeakPolarHBondContact OG-CB 3.48Å; S144-A146 PolarHBondContact OG-N 3.25Å; A146-Y148 VanDerWaalsContact C-N 3.29Å; A146-Y148 PolarHBondContact O-N 3.03Å; A146-N149 WeakPolarHBondContact CA-O 3.31Å; A146-N149 CarbonylContact O-C 3.4Å; A146-N149 VanDerWaalsContact O-C 3.31Å; A146-N149 PolarHBondContact O-N 3.47Å; A146-L152 PolarHBondContact N-O 2.79Å; A146-D153 HydrophobicContact CB-CB 4Å
147	Q	83.8	Confident	88.5	Confident	120 Å²	120	63.8 Å²	63.8	56%	0.561	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-63.7	-34.6	177.6	-68.2	176.5	-17.3	0	0	112.7	E143 S144 L145	E143-Q147 PolarHBondContact OE2-NE2 3.43Å; E143-Q147 PolarHBondContact OE2-OE1 2.86Å; S144-Q147 PolarHBondContact O-N 2.97Å; L145-Q147 PolarHBondContact O-N 3.29Å
148	Y	84.6	Confident	88.4	Confident	83 Å²	83	69.2 Å²	69.2	33%	0.325	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-47.6	173.8	162.9	-112.6	0	0	0	111.1	I113 F124 L145 A146 L152	I113-Y148 HydrophobicContact CG2-CE1 4.15Å; F124-Y148 HydrophobicContact CB-CD1 4.42Å; F124-Y148 HydrophobicContact CB-CD2 3.62Å; F124-Y148 HydrophobicContact CB-CE1 4.3Å; F124-Y148 HydrophobicContact CB-CE2 3.48Å; F124-Y148 VanDerWaalsContact CB-CE2 3.48Å; F124-Y148 HydrophobicContact CB-CG 4.1Å; F124-Y148 HydrophobicContact CD2-CD1 4.23Å; F124-Y148 HydrophobicContact CD2-CD2 4.32Å; F124-Y148 AromaticContact CD2-CG 3.99Å; F124-Y148 HydrophobicContact CD2-CG 3.99Å; F124-Y148 HydrophobicContact CG-CD2 4.44Å; F124-Y148 HydrophobicContact CG-CG 4.46Å; L145-Y148 PolarHBondContact O-N 3.01Å; A146-Y148 VanDerWaalsContact C-N 3.29Å; A146-Y148 PolarHBondContact O-N 3.03Å; Y148-L152 HydrophobicContact CD1-CD1 4.49Å; Y148-L152 HydrophobicContact CE1-CD1 4.41Å
149	N	85.5	Confident	88.4	Confident	57 Å²	57	67.4 Å²	67.4	31%	0.305	33%	0.331	S	S	.	.			trans	-145.3	116	179.3	-175.8	-21.3	0	0	0	110	L145 A146 K151 L152	L145-N149 PolarHBondContact O-N 2.88Å; A146-N149 WeakPolarHBondContact CA-O 3.31Å; A146-N149 CarbonylContact O-C 3.4Å; A146-N149 VanDerWaalsContact O-C 3.31Å; A146-N149 PolarHBondContact O-N 3.47Å; N149-K151 PolarHBondContact O-N 3.19Å; N149-K151 WeakPolarHBondContact OD1-CB 3.48Å; N149-K151 PolarHBondContact OD1-N 3.23Å; N149-L152 HydrophobicContact CB-CB 4.31Å; N149-L152 HydrophobicContact CB-CD1 4.17Å; N149-L152 HydrophobicContact CB-CG 4.23Å; N149-L152 CarbonylContact O-C 3.58Å; N149-L152 WeakPolarHBondContact O-CA 3.4Å; N149-L152 WeakPolarHBondContact O-CB 3.37Å; N149-L152 PolarHBondContact O-N 3.44Å
150	P	86.6	Confident	88.3	Confident	109 Å²	109	65.5 Å²	65.5	71%	0.708	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-55.5	-27.9	-179.2	-28.2	35.1	0	0	0	114.4	L152 D153	P150-L152 PolarHBondContact O-N 3.03Å; P150-D153 PolarHBondContact O-N 3.21Å
151	K	84.3	Confident	88.1	Confident	177 Å²	177	65.4 Å²	65.4	77%	0.77	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-71.2	-16.3	175.8	-64	-175.1	178.2	-179.6	0	112.8	K106 N149	K106-K151 WeakPolarHBondContact CE-O 3.39Å; K106-K151 PolarHBondContact NZ-O 2.8Å; N149-K151 PolarHBondContact O-N 3.19Å; N149-K151 WeakPolarHBondContact OD1-CB 3.48Å; N149-K151 PolarHBondContact OD1-N 3.23Å
152	L	86.2	Confident	87.6	Confident	15 Å²	15	64.4 Å²	64.4	8%	0.079	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-105.2	40.6	177.5	-61.7	179.4	0	0	0	111.4	K106 K111 I113 L145 A146 Y148 N149 P150 V154	K106-L152 HydrophobicContact CD-CD2 3.96Å; K111-L152 HydrophobicContact CB-CD2 4.46Å; K111-L152 HydrophobicContact CG-CD2 3.97Å; I113-L152 HydrophobicContact CD1-CD1 3.91Å; L145-L152 CarbonylContact C-O 3.58Å; L145-L152 VanDerWaalsContact C-O 3.29Å; L145-L152 HydrophobicContact CB-CB 4.1Å; L145-L152 WeakPolarHBondContact CB-O 3.46Å; A146-L152 PolarHBondContact N-O 2.79Å; Y148-L152 HydrophobicContact CD1-CD1 4.49Å; Y148-L152 HydrophobicContact CE1-CD1 4.41Å; N149-L152 HydrophobicContact CB-CB 4.31Å; N149-L152 HydrophobicContact CB-CD1 4.17Å; N149-L152 HydrophobicContact CB-CG 4.23Å; N149-L152 CarbonylContact O-C 3.58Å; N149-L152 WeakPolarHBondContact O-CA 3.4Å; N149-L152 WeakPolarHBondContact O-CB 3.37Å; N149-L152 PolarHBondContact O-N 3.44Å; P150-L152 PolarHBondContact O-N 3.03Å; L152-V154 VanDerWaalsContact C-N 3.27Å; L152-V154 PolarHBondContact O-N 3.21Å
153	D	88.9	Confident	86.9	Confident	107 Å²	107	62.5 Å²	62.5	57%	0.572	31%	0.306	S	S	*	.			trans	-63.1	87.9	165.7	-170.3	25.9	0	0	0	112	K106 S144 A146 P150	K106-D153 PolarHBondContact NZ-O 3.43Å; S144-D153 WeakPolarHBondContact OG-CA 3.42Å; S144-D153 PolarHBondContact OG-OD1 2.99Å; A146-D153 HydrophobicContact CB-CB 4Å; P150-D153 PolarHBondContact O-N 3.21Å
154	V	90.2	Very high	85.8	Confident	17 Å²	17	64.2 Å²	64.2	10%	0.103	31%	0.314	C	S	.	.			trans	-166.2	148.9	177.2	68.4	0	0	0	0	107.1	L104 K106 S144 L145 L152	L104-V154 HydrophobicContact CD1-CG1 4.35Å; L104-V154 HydrophobicContact CD2-CG1 3.68Å; L104-V154 HydrophobicContact CG-CG1 4.38Å; K106-V154 HydrophobicContact CB-CG1 4.47Å; K106-V154 HydrophobicContact CD-CB 4.28Å; K106-V154 HydrophobicContact CD-CG1 3.92Å; K106-V154 HydrophobicContact CG-CG1 4.45Å; S144-V154 PolarHBondContact OG-N 2.77Å; L145-V154 WeakPolarHBondContact CB-O 3.33Å; L145-V154 PolarHBondContact N-O 2.93Å; L152-V154 VanDerWaalsContact C-N 3.27Å; L152-V154 PolarHBondContact O-N 3.21Å
155	K	91.7	Very high	84.2	Confident	89 Å²	89	64.4 Å²	64.4	39%	0.387	31%	0.313	S	S	.	.			trans	-98.8	159.2	175.4	-60.6	-175.4	-177.8	-167.8	0	110.6	G85 H142 M157	G85-K155 WeakPolarHBondContact CA-O 3.33Å; H142-K155 VanDerWaalsContact O-CE 3.31Å; H142-K155 WeakPolarHBondContact O-CE 3.48Å; H142-K155 PolarHBondContact O-NZ 3.41Å; K155-M157 VanDerWaalsContact C-N 3.31Å; K155-M157 HydrophobicContact CB-CG 3.87Å; K155-M157 PolarHBondContact O-N 3.14Å
156	L	92.6	Very high	82.4	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.331	C	S	.	.			trans	-76.3	82.1	170.9	-59.9	-175.1	0	0	0	109.4	F87 L102 L104 I137 Y140 H141 L145	F87-L156 HydrophobicContact CB-CD2 3.94Å; F87-L156 HydrophobicContact CD1-CB 3.69Å; F87-L156 HydrophobicContact CD1-CD2 4.16Å; F87-L156 HydrophobicContact CD1-CG 4.45Å; F87-L156 HydrophobicContact CD2-CB 4.46Å; F87-L156 HydrophobicContact CD2-CD1 4.32Å; F87-L156 HydrophobicContact CD2-CD2 4.29Å; F87-L156 HydrophobicContact CE1-CB 3.6Å; F87-L156 HydrophobicContact CE2-CB 4.39Å; F87-L156 HydrophobicContact CE2-CD1 4.34Å; F87-L156 HydrophobicContact CG-CB 4.13Å; F87-L156 HydrophobicContact CG-CD2 3.86Å; F87-L156 HydrophobicContact CG-CG 4.42Å; F87-L156 HydrophobicContact CZ-CB 3.97Å; L102-L156 HydrophobicContact CD1-CD2 4.35Å; L102-L156 HydrophobicContact CD2-CD1 4.23Å; L102-L156 HydrophobicContact CD2-CD2 4.22Å; L104-L156 HydrophobicContact CD1-CD2 3.93Å; L104-L156 HydrophobicContact CD2-CD2 4.3Å; I137-L156 HydrophobicContact CB-CD1 4.47Å; I137-L156 HydrophobicContact CD1-CD1 3.69Å; I137-L156 HydrophobicContact CG2-CD1 4.01Å; Y140-L156 PolarHBondContact O-N 3.01Å; H141-L156 PolarHBondContact CD2-O 3.13Å; L145-L156 HydrophobicContact CD1-CD2 3.85Å; L145-L156 HydrophobicContact CD1-CG 4.38Å
157	M	88.4	Confident	80.8	Confident	82 Å²	82	74 Å²	74	40%	0.404	36%	0.355	S	S	.	.			trans	-93.2	-36.7	-168.5	-64.7	-167.8	-65	0	0	114.3	D84 G85 K155 P159	D84-M157 WeakPolarHBondContact O-CE 3.46Å; G85-M157 PolarHBondContact O-N 3.33Å; K155-M157 VanDerWaalsContact C-N 3.31Å; K155-M157 HydrophobicContact CB-CG 3.87Å; K155-M157 PolarHBondContact O-N 3.14Å; M157-P159 WeakPolarHBondContact O-CD 3.48Å
158	Y	91.1	Very high	79.5	Confident	115 Å²	115	72.8 Å²	72.8	45%	0.451	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	91.1	-170.7	-50.8	-65.5	0	0	0	110	P83 G85 T86 F87 V160	P83-Y158 HydrophobicContact CB-CD2 4.41Å; P83-Y158 HydrophobicContact CB-CE2 4.14Å; P83-Y158 HydrophobicContact CG-CD2 3.75Å; P83-Y158 HydrophobicContact CG-CE2 3.83Å; P83-Y158 HydrophobicContact CG-CG 4.49Å; G85-Y158 PolarHBondContact O-N 3Å; T86-Y158 VanDerWaalsContact CA-O 3.29Å; T86-Y158 WeakPolarHBondContact CA-O 3.41Å; F87-Y158 PolarHBondContact N-O 2.96Å; Y158-V160 PolarHBondContact O-N 2.94Å
159	P	91.4	Very high	78.3	Confident	41 Å²	41	69.2 Å²	69.2	27%	0.266	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	129.2	175.7	25.7	-31.8	0	0	0	109.8	E64 W65 F87 M157 S161	E64-P159 HydrophobicContact CG-CB 4.4Å; E64-P159 WeakPolarHBondContact OE1-CG 3.46Å; W65-P159 HydrophobicContact CB-CB 3.85Å; W65-P159 HydrophobicContact CG-CB 4.36Å; F87-P159 HydrophobicContact CE1-CB 3.91Å; F87-P159 HydrophobicContact CZ-CB 3.8Å; M157-P159 WeakPolarHBondContact O-CD 3.48Å; P159-S161 PolarHBondContact O-N 3.36Å; P159-S161 VanDerWaalsContact O-N 3.08Å
160	V	88.9	Confident	77.3	Confident	14 Å²	14	75.7 Å²	75.7	9%	0.085	36%	0.364	C	S	.	.			trans	-76.2	98.1	167.9	-177.1	0	0	0	0	107.3	W67 L79 T86 F87 L88 Y158 R162	W67-V160 HydrophobicContact CZ2-CG1 3.88Å; W67-V160 PolarHBondContact NE1-O 3.26Å; L79-V160 HydrophobicContact CD2-CG2 3.7Å; T86-V160 HydrophobicContact CG2-CG2 3.45Å; T86-V160 VanDerWaalsContact CG2-CG2 3.45Å; F87-V160 PolarHBondContact O-N 2.64Å; L88-V160 HydrophobicContact CB-CB 4.18Å; L88-V160 HydrophobicContact CD2-CB 4.1Å; L88-V160 HydrophobicContact CD2-CG1 4.28Å; L88-V160 HydrophobicContact CD2-CG2 4.28Å; Y158-V160 PolarHBondContact O-N 2.94Å; V160-R162 PolarHBondContact O-N 3.32Å
161	S	85.4	Confident	76.5	Confident	18 Å²	18	73.4 Å²	73.4	13%	0.126	34%	0.344	C	S	.	.			trans	-72.4	125.2	-176.8	-172	0	0	0	0	111.1	E64 P159 Y163 Q164	E64-S161 CarbonylContact O-C 3.59Å; E64-S161 WeakPolarHBondContact O-CA 3.37Å; E64-S161 WeakPolarHBondContact OE2-CB 3.36Å; E64-S161 PolarHBondContact OE2-OG 3.35Å; P159-S161 PolarHBondContact O-N 3.36Å; P159-S161 VanDerWaalsContact O-N 3.08Å; S161-Y163 PolarHBondContact O-N 2.92Å; S161-Y163 PolarHBondContact OG-N 3.49Å; S161-Q164 WeakPolarHBondContact O-CB 3.48Å; S161-Q164 PolarHBondContact O-N 3.02Å; S161-Q164 VanDerWaalsContact O-N 3.1Å
162	R	80	Confident	75.9	Confident	54 Å²	54	71.9 Å²	71.9	20%	0.204	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-62.2	-28.2	170.7	72.4	-166.6	-177	-175.8	4.8	112.5	Q61 A63 E64 Y66 W67 V160 Q164 Q165	Q61-R162 PolarHBondContact O-NH1 3.1Å; Q61-R162 PolarHBondContact O-NH2 3.35Å; A63-R162 PolarHBondContact O-NH1 3.21Å; E64-R162 PolarHBondContact O-N 2.92Å; Y66-R162 VanDerWaalsContact O-CD 3.31Å; Y66-R162 WeakPolarHBondContact O-CD 3.22Å; Y66-R162 PolarHBondContact O-NH1 3.3Å; Y66-R162 VanDerWaalsContact O-NH1 3.13Å; W67-R162 HydrophobicContact CD2-CB 4.16Å; W67-R162 HydrophobicContact CE3-CB 4.39Å; W67-R162 HydrophobicContact CH2-CB 4.2Å; W67-R162 VanDerWaalsContact CZ2-CA 3.41Å; W67-R162 HydrophobicContact CZ2-CB 3.99Å; W67-R162 HydrophobicContact CZ3-CB 4.4Å; V160-R162 PolarHBondContact O-N 3.32Å; R162-Q164 PolarHBondContact O-N 3.07Å; R162-Q165 PolarHBondContact O-N 2.9Å
163	Y	70.7	Confident	75.8	Confident	88 Å²	88	75.7 Å²	75.7	35%	0.345	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-76.7	-8.9	176.4	-51.9	-61.8	0	0	0	113.3	D62 E64 S161 Q165 D166 Q167	D62-Y163 PolarHBondContact O-OH 2.7Å; E64-Y163 HydrophobicContact CB-CD2 3.75Å; E64-Y163 HydrophobicContact CB-CE2 3.87Å; S161-Y163 PolarHBondContact O-N 2.92Å; S161-Y163 PolarHBondContact OG-N 3.49Å; Y163-Q165 PolarHBondContact O-N 3.26Å; Y163-Q165 VanDerWaalsContact O-N 3.14Å; Y163-D166 PolarHBondContact O-N 2.92Å; Y163-Q167 PolarHBondContact O-N 2.93Å; Y163-Q167 VanDerWaalsContact O-N 3.1Å
164	Q	64.5	Low	75.5	Confident	112 Å²	112	73 Å²	73	52%	0.523	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-59.5	-23.8	172.3	-164.6	171.2	16.7	0	0	111.5	S161 R162 L168	S161-Q164 WeakPolarHBondContact O-CB 3.48Å; S161-Q164 PolarHBondContact O-N 3.02Å; S161-Q164 VanDerWaalsContact O-N 3.1Å; R162-Q164 PolarHBondContact O-N 3.07Å; Q164-L168 WeakPolarHBondContact O-CD1 3.07Å; Q164-L168 WeakPolarHBondContact O-CG 3.26Å
165	Q	55.8	Low	75.3	Confident	25 Å²	25	76.5 Å²	76.5	12%	0.117	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-39.7	172.6	-70.6	176.6	-29.6	0	0	112.6	R162 Y163 Q167 L168 V169	R162-Q165 PolarHBondContact O-N 2.9Å; Y163-Q165 PolarHBondContact O-N 3.26Å; Y163-Q165 VanDerWaalsContact O-N 3.14Å; Q165-Q167 VanDerWaalsContact C-N 3.31Å; Q165-Q167 PolarHBondContact O-N 2.75Å; Q165-L168 PolarHBondContact O-N 2.63Å; Q165-V169 PolarHBondContact O-N 2.83Å
166	D	53.3	Low	75.1	Confident	71 Å²	71	73.8 Å²	73.8	38%	0.38	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-29.8	176	-76.8	-28.3	0	0	0	112.7	Y163 L168 W315	Y163-D166 PolarHBondContact O-N 2.92Å; D166-L168 VanDerWaalsContact C-N 3.32Å; D166-L168 PolarHBondContact O-N 3.1Å; D166-W315 VanDerWaalsContact OD1-CD1 3.22Å; D166-W315 PolarHBondContact OD1-NE1 2.94Å
167	Q	52.7	Low	74.8	Confident	159 Å²	159	73.8 Å²	73.8	74%	0.743	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-21.4	175.9	-71.9	-171.1	-1.8	0	0	114	Y163 Q165	Y163-Q167 PolarHBondContact O-N 2.93Å; Y163-Q167 VanDerWaalsContact O-N 3.1Å; Q165-Q167 VanDerWaalsContact C-N 3.31Å; Q165-Q167 PolarHBondContact O-N 2.75Å
168	L	55.7	Low	74.7	Confident	95 Å²	95	69.9 Å²	69.9	50%	0.497	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-34.5	-177.7	-71.3	168.6	0	0	0	111.9	Q164 Q165 D166 K170	Q164-L168 WeakPolarHBondContact O-CD1 3.07Å; Q164-L168 WeakPolarHBondContact O-CG 3.26Å; Q165-L168 PolarHBondContact O-N 2.63Å; D166-L168 VanDerWaalsContact C-N 3.32Å; D166-L168 PolarHBondContact O-N 3.1Å; L168-K170 PolarHBondContact O-N 2.78Å
169	V	60.7	Low	74.6	Confident	8 Å²	8	70.5 Å²	70.5	5%	0.048	35%	0.348	C	S	.	.			trans	-90.3	90.2	173.3	-174.9	0	0	0	0	108.2	Q165 E171 V177 W315	Q165-V169 PolarHBondContact O-N 2.83Å; V169-E171 PolarHBondContact O-N 2.88Å; V169-V177 HydrophobicContact CG1-CB 4.21Å; V169-V177 HydrophobicContact CG1-CG1 3.72Å; V169-V177 HydrophobicContact CG1-CG2 3.35Å; V169-W315 HydrophobicContact CB-CD2 4.44Å; V169-W315 HydrophobicContact CB-CG 4.25Å; V169-W315 HydrophobicContact CG1-CD2 4.17Å; V169-W315 HydrophobicContact CG1-CG 4.45Å; V169-W315 HydrophobicContact CG2-CB 4.16Å; V169-W315 HydrophobicContact CG2-CG 4.02Å
170	K	64.9	Low	74.5	Confident	193 Å²	193	71.5 Å²	71.5	84%	0.839	35%	0.348	S	S	*	.			trans	-67.9	8.1	-176.5	-61.2	-174.7	179.3	-179.1	0	115	L168	L168-K170 PolarHBondContact O-N 2.78Å
171	E	69.6	Low	74.5	Confident	62 Å²	62	70.8 Å²	70.8	29%	0.29	34%	0.344	S	S	.	.			trans	-123	124.8	-174.8	-76	176.4	-176.4	0	0	110.3	V169 N173 A176 V177 K180	V169-E171 PolarHBondContact O-N 2.88Å; E171-N173 VanDerWaalsContact C-N 3.34Å; E171-A176 WeakPolarHBondContact OE2-CB 3.48Å; E171-V177 HydrophobicContact CB-CG2 3.85Å; E171-V177 VanDerWaalsContact O-CG2 3.29Å; E171-V177 WeakPolarHBondContact O-CG2 3.39Å; E171-K180 VanDerWaalsContact CD-CE 3.41Å; E171-K180 WeakPolarHBondContact OE1-CE 3.25Å; E171-K180 IonicContact OE1-NZ 3.48Å; E171-K180 PolarHBondContact OE1-NZ 3.07Å; E171-K180 WeakPolarHBondContact OE2-CE 3.38Å; E171-K180 IonicContact OE2-NZ 2.75Å; E171-K180 PolarHBondContact OE2-NZ 2.96Å
172	D	71.3	Confident	74.8	Confident	145 Å²	145	74.7 Å²	74.7	78%	0.775	36%	0.36	S	S	*	.			trans	-82.9	-13	178.3	-63.3	-48.7	0	0	0	112.9	I174	D172-I174 PolarHBondContact O-N 3.42Å
173	N	83.9	Confident	75.3	Confident	94 Å²	94	76.6 Å²	76.6	50%	0.503	37%	0.371	S	S	.	.			trans	-83.6	114.6	-178.2	-174.6	-11.2	0	0	0	111.3	E171 D175 A176 V177	E171-N173 VanDerWaalsContact C-N 3.34Å; N173-D175 PolarHBondContact O-N 3.06Å; N173-D175 PolarHBondContact OD1-N 3.33Å; N173-A176 HydrophobicContact CB-CB 3.99Å; N173-A176 PolarHBondContact O-N 3.43Å; N173-A176 VanDerWaalsContact O-N 3.08Å; N173-V177 WeakPolarHBondContact O-CG2 3.42Å; N173-V177 PolarHBondContact O-N 3.45Å
174	I	83.6	Confident	76.3	Confident	51 Å²	51	75.6 Å²	75.6	26%	0.262	37%	0.367	S	S	.	.	H	α-helix	trans	-51.9	-40.1	178.4	-63.8	174.3	0	0	0	112.4	D172 G178 W315 L316 K319 V321 W329	D172-I174 PolarHBondContact O-N 3.42Å; I174-G178 PolarHBondContact O-N 3.47Å; I174-W315 HydrophobicContact CG1-CH2 4.47Å; I174-W315 HydrophobicContact CG1-CZ3 4.39Å; I174-L316 HydrophobicContact CG2-CD2 3.99Å; I174-K319 HydrophobicContact CD1-CB 4.22Å; I174-K319 HydrophobicContact CG1-CB 4.39Å; I174-V321 HydrophobicContact CG2-CG2 3.49Å; I174-V321 VanDerWaalsContact CG2-CG2 3.49Å; I174-W329 HydrophobicContact CG2-CH2 4.11Å
175	D	84.9	Confident	77.6	Confident	91 Å²	91	71.3 Å²	71.3	49%	0.487	35%	0.347	S	S	.	.	H	α-helix	trans	-71.4	-37.9	179.9	-80.2	-66	0	0	0	113	N173 G178 K179 R325	N173-D175 PolarHBondContact O-N 3.06Å; N173-D175 PolarHBondContact OD1-N 3.33Å; D175-G178 PolarHBondContact O-N 3.22Å; D175-K179 PolarHBondContact O-N 3.04Å; D175-R325 IonicContact OD1-CZ 3.2Å; D175-R325 IonicContact OD1-NH2 3.59Å; D175-R325 PolarHBondContact OD1-NH2 3.36Å; D175-R325 IonicContact OD2-NH2 3.15Å; D175-R325 PolarHBondContact OD2-NH2 3.19Å
176	A	86.9	Confident	79.4	Confident	31 Å²	31	73.3 Å²	73.3	26%	0.256	36%	0.364	S	S	.	.	H	α-helix	trans	-67.4	-43.2	177.1	0	0	0	0	0	111	E171 N173 G178 K179 K180	E171-A176 WeakPolarHBondContact OE2-CB 3.48Å; N173-A176 HydrophobicContact CB-CB 3.99Å; N173-A176 PolarHBondContact O-N 3.43Å; N173-A176 VanDerWaalsContact O-N 3.08Å; A176-G178 VanDerWaalsContact C-N 3.34Å; A176-G178 PolarHBondContact O-N 3Å; A176-K179 PolarHBondContact O-N 3.47Å; A176-K180 PolarHBondContact O-N 2.91Å
177	V	86.6	Confident	81.3	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-38.8	174.7	-179.5	0	0	0	0	111.3	V169 E171 N173 K180 L181 W315 L316	V169-V177 HydrophobicContact CG1-CB 4.21Å; V169-V177 HydrophobicContact CG1-CG1 3.72Å; V169-V177 HydrophobicContact CG1-CG2 3.35Å; E171-V177 HydrophobicContact CB-CG2 3.85Å; E171-V177 VanDerWaalsContact O-CG2 3.29Å; E171-V177 WeakPolarHBondContact O-CG2 3.39Å; N173-V177 WeakPolarHBondContact O-CG2 3.42Å; N173-V177 PolarHBondContact O-N 3.45Å; V177-K180 PolarHBondContact O-N 3.14Å; V177-L181 WeakPolarHBondContact O-CB 3.33Å; V177-L181 PolarHBondContact O-N 3.16Å; V177-W315 HydrophobicContact CB-CE3 4.11Å; V177-W315 HydrophobicContact CB-CH2 4.42Å; V177-W315 HydrophobicContact CB-CZ3 3.75Å; V177-W315 HydrophobicContact CG1-CD2 4.39Å; V177-W315 HydrophobicContact CG1-CE3 3.62Å; V177-W315 HydrophobicContact CG1-CZ3 3.81Å; V177-W315 HydrophobicContact CG2-CE3 4.19Å; V177-W315 HydrophobicContact CG2-CH2 3.85Å; V177-W315 HydrophobicContact CG2-CZ3 3.67Å; V177-L316 HydrophobicContact CB-CD2 4.15Å; V177-L316 HydrophobicContact CG1-CD1 4.35Å; V177-L316 HydrophobicContact CG1-CD2 3.97Å; V177-L316 HydrophobicContact CG1-CG 4.02Å
178	G	87.2	Confident	83.2	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61.1	-43.2	173.6	0	0	0	0	0	113.1	I174 D175 A176 L181 Q182	I174-G178 PolarHBondContact O-N 3.47Å; D175-G178 PolarHBondContact O-N 3.22Å; A176-G178 VanDerWaalsContact C-N 3.34Å; A176-G178 PolarHBondContact O-N 3Å; G178-L181 WeakPolarHBondContact O-CB 3.37Å; G178-L181 PolarHBondContact O-N 2.94Å; G178-Q182 PolarHBondContact O-N 3.2Å
179	K	88.7	Confident	85	Confident	129 Å²	129	68 Å²	68	56%	0.561	33%	0.333	S	S	*	.	H	α-helix	trans	-64.2	-43.1	174.6	-172.7	177.5	177.4	179.6	0	112.2	D175 A176 L181 Q182 E183	D175-K179 PolarHBondContact O-N 3.04Å; A176-K179 PolarHBondContact O-N 3.47Å; K179-L181 VanDerWaalsContact C-N 3.33Å; K179-L181 PolarHBondContact O-N 2.95Å; K179-Q182 WeakPolarHBondContact O-CB 3.45Å; K179-Q182 PolarHBondContact O-N 3.15Å; K179-E183 WeakPolarHBondContact O-CG 3.46Å; K179-E183 PolarHBondContact O-N 2.76Å
180	K	88.5	Confident	86.6	Confident	61 Å²	61	74.1 Å²	74.1	27%	0.265	36%	0.361	S	S	.	.	H	α-helix	trans	-62.3	-40	173.8	-75.4	-172.7	-179.1	175.7	0	112.6	E171 A176 V177 Q182 E183 Y184	E171-K180 VanDerWaalsContact CD-CE 3.41Å; E171-K180 WeakPolarHBondContact OE1-CE 3.25Å; E171-K180 IonicContact OE1-NZ 3.48Å; E171-K180 PolarHBondContact OE1-NZ 3.07Å; E171-K180 WeakPolarHBondContact OE2-CE 3.38Å; E171-K180 IonicContact OE2-NZ 2.75Å; E171-K180 PolarHBondContact OE2-NZ 2.96Å; A176-K180 PolarHBondContact O-N 2.91Å; V177-K180 PolarHBondContact O-N 3.14Å; K180-Q182 VanDerWaalsContact C-N 3.29Å; K180-Q182 PolarHBondContact O-N 2.97Å; K180-E183 PolarHBondContact O-N 3.33Å; K180-Y184 HydrophobicContact CB-CD2 4.34Å; K180-Y184 HydrophobicContact CB-CE2 4.11Å; K180-Y184 WeakPolarHBondContact O-CD2 3.36Å; K180-Y184 PolarHBondContact O-N 3.24Å
181	L	90.6	Very high	88	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-57.6	-45.4	173.7	170.9	65.1	0	0	0	110.7	V177 G178 K179 E183 Y184 H185 R309 H312 L313 L316 W329 L330	V177-L181 WeakPolarHBondContact O-CB 3.33Å; V177-L181 PolarHBondContact O-N 3.16Å; G178-L181 WeakPolarHBondContact O-CB 3.37Å; G178-L181 PolarHBondContact O-N 2.94Å; K179-L181 VanDerWaalsContact C-N 3.33Å; K179-L181 PolarHBondContact O-N 2.95Å; L181-E183 VanDerWaalsContact C-N 3.35Å; L181-E183 PolarHBondContact O-N 3.3Å; L181-Y184 PolarHBondContact O-N 3.38Å; L181-H185 WeakPolarHBondContact O-CB 3.4Å; L181-H185 PolarHBondContact O-N 3.48Å; L181-R309 HydrophobicContact CD1-CG 3.7Å; L181-H312 HydrophobicContact CB-CB 4.19Å; L181-H312 HydrophobicContact CD1-CB 4.02Å; L181-L313 HydrophobicContact CD1-CD2 4.15Å; L181-L313 HydrophobicContact CD1-CG 3.86Å; L181-L313 HydrophobicContact CD2-CD2 3.55Å; L181-L313 HydrophobicContact CD2-CG 4.14Å; L181-L313 HydrophobicContact CG-CD2 4.48Å; L181-L316 HydrophobicContact CB-CD1 4.29Å; L181-L316 HydrophobicContact CD2-CD1 3.55Å; L181-W329 HydrophobicContact CD2-CB 4.4Å; L181-L330 HydrophobicContact CD1-CD2 4.42Å
182	Q	90.1	Very high	89.2	Confident	100 Å²	100	66 Å²	66	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-60.2	-44	176.8	-175	-178.7	11.2	0	0	111.7	G178 K179 K180 H185 S186	G178-Q182 PolarHBondContact O-N 3.2Å; K179-Q182 WeakPolarHBondContact O-CB 3.45Å; K179-Q182 PolarHBondContact O-N 3.15Å; K180-Q182 VanDerWaalsContact C-N 3.29Å; K180-Q182 PolarHBondContact O-N 2.97Å; Q182-H185 PolarHBondContact O-N 3.25Å; Q182-S186 WeakPolarHBondContact O-CB 3.38Å; Q182-S186 PolarHBondContact O-N 3Å
183	E	91.4	Very high	90.3	Very high	94 Å²	94	64.7 Å²	64.7	44%	0.439	32%	0.315	S	S	.	.	H	α-helix	trans	-62.7	-48.8	177	-70.1	171.3	-168.9	0	0	112.1	K179 K180 L181 H185 S186 Q187	K179-E183 WeakPolarHBondContact O-CG 3.46Å; K179-E183 PolarHBondContact O-N 2.76Å; K180-E183 PolarHBondContact O-N 3.33Å; L181-E183 VanDerWaalsContact C-N 3.35Å; L181-E183 PolarHBondContact O-N 3.3Å; E183-H185 VanDerWaalsContact C-N 3.33Å; E183-H185 PolarHBondContact O-N 2.99Å; E183-S186 PolarHBondContact O-N 2.95Å; E183-Q187 WeakPolarHBondContact O-CG 3.42Å; E183-Q187 PolarHBondContact O-N 2.85Å
184	Y	90.9	Very high	90.9	Very high	66 Å²	66	64.7 Å²	64.7	26%	0.259	31%	0.312	S	S	.	.	H	α-helix	trans	-64.7	-37.8	177.1	-69.7	-51.1	0	0	0	112.4	K180 L181 Y188 L305 I308 H312	K180-Y184 HydrophobicContact CB-CD2 4.34Å; K180-Y184 HydrophobicContact CB-CE2 4.11Å; K180-Y184 WeakPolarHBondContact O-CD2 3.36Å; K180-Y184 PolarHBondContact O-N 3.24Å; L181-Y184 PolarHBondContact O-N 3.38Å; Y184-Y188 VanDerWaalsContact O-CB 3.31Å; Y184-Y188 WeakPolarHBondContact O-CB 3.38Å; Y184-Y188 PolarHBondContact O-N 2.7Å; Y184-L305 HydrophobicContact CD1-CD2 4.15Å; Y184-I308 HydrophobicContact CD1-CG2 4.18Å; Y184-I308 HydrophobicContact CD2-CG2 3.67Å; Y184-I308 HydrophobicContact CE1-CG2 4.16Å; Y184-I308 HydrophobicContact CE2-CG2 3.65Å; Y184-I308 HydrophobicContact CG-CG2 3.96Å; Y184-H312 AromaticContact CE2-CE1 3.66Å; Y184-H312 AromaticContact CE2-NE2 3.64Å
185	H	92.5	Very high	91.5	Very high	23 Å²	23	64.1 Å²	64.1	11%	0.106	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-44.8	176.1	-175.3	68.7	0	0	0	111.3	L181 Q182 E183 Y188 Q189 L330	L181-H185 WeakPolarHBondContact O-CB 3.4Å; L181-H185 PolarHBondContact O-N 3.48Å; Q182-H185 PolarHBondContact O-N 3.25Å; E183-H185 VanDerWaalsContact C-N 3.33Å; E183-H185 PolarHBondContact O-N 2.99Å; H185-Y188 WeakPolarHBondContact O-CB 3.47Å; H185-Y188 PolarHBondContact O-N 2.96Å; H185-Q189 PolarHBondContact NE2-NE2 3.02Å; H185-Q189 WeakPolarHBondContact O-CG 3.41Å; H185-Q189 PolarHBondContact O-N 3.42Å; H185-L330 HydrophobicContact CB-CD2 4.25Å; H185-L330 PolarHBondContact CD2-O 3.19Å; H185-L330 PolarHBondContact NE2-O 3.06Å
186	S	92.4	Very high	92	Very high	66 Å²	66	63.3 Å²	63.3	46%	0.462	30%	0.302	S	S	.	.	H	α-helix	trans	-60.7	-48.2	176.4	-172.3	0	0	0	0	111.9	Q182 E183 Y188 Q189 E190	Q182-S186 WeakPolarHBondContact O-CB 3.38Å; Q182-S186 PolarHBondContact O-N 3Å; E183-S186 PolarHBondContact O-N 2.95Å; S186-Y188 VanDerWaalsContact C-N 3.32Å; S186-Y188 PolarHBondContact O-N 3.47Å; S186-Q189 PolarHBondContact O-N 3.32Å; S186-Q189 VanDerWaalsContact O-N 3.17Å; S186-E190 PolarHBondContact O-N 2.92Å
187	Q	93.6	Very high	92.4	Very high	90 Å²	90	70 Å²	70	42%	0.421	32%	0.321	S	S	.	.	H	α-helix	trans	-60.7	-40.5	176.3	-71	174.7	31.6	0	0	112.4	E183 E190 K191 L305	E183-Q187 WeakPolarHBondContact O-CG 3.42Å; E183-Q187 PolarHBondContact O-N 2.85Å; Q187-E190 PolarHBondContact O-N 2.98Å; Q187-K191 PolarHBondContact O-N 3.42Å; Q187-L305 HydrophobicContact CB-CD1 4.23Å; Q187-L305 HydrophobicContact CB-CD2 4.22Å
188	Y	93.7	Very high	92.9	Very high	46 Å²	46	70.9 Å²	70.9	18%	0.18	33%	0.325	C	S	.	.	H	α-helix	trans	-61.4	-46.9	174.5	171	-91.2	0	0	0	111.3	Y184 H185 S186 E190 K191 S192 L302 L305 R306	Y184-Y188 VanDerWaalsContact O-CB 3.31Å; Y184-Y188 WeakPolarHBondContact O-CB 3.38Å; Y184-Y188 PolarHBondContact O-N 2.7Å; H185-Y188 WeakPolarHBondContact O-CB 3.47Å; H185-Y188 PolarHBondContact O-N 2.96Å; S186-Y188 VanDerWaalsContact C-N 3.32Å; S186-Y188 PolarHBondContact O-N 3.47Å; Y188-E190 PolarHBondContact O-N 3.48Å; Y188-K191 PolarHBondContact O-N 3.15Å; Y188-S192 VanDerWaalsContact O-CB 3.24Å; Y188-S192 WeakPolarHBondContact O-CB 3.49Å; Y188-S192 PolarHBondContact O-N 3.3Å; Y188-L302 HydrophobicContact CD2-CD1 3.65Å; Y188-L302 HydrophobicContact CD2-CG 4.34Å; Y188-L302 HydrophobicContact CE2-CD1 3.54Å; Y188-L302 HydrophobicContact CE2-CG 3.9Å; Y188-L302 HydrophobicContact CG-CD1 4.48Å; Y188-L305 HydrophobicContact CD2-CB 4.25Å; Y188-R306 HydrophobicContact CD2-CB 4.1Å; Y188-R306 HydrophobicContact CE2-CB 3.79Å; Y188-R306 HydrophobicContact CE2-CG 4.41Å
189	Q	93.3	Very high	93.3	Very high	78 Å²	78	76.8 Å²	76.8	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-42.9	178.9	-74.2	-171.8	-7.6	0	0	111.9	H185 S186 S192 K193	H185-Q189 PolarHBondContact NE2-NE2 3.02Å; H185-Q189 WeakPolarHBondContact O-CG 3.41Å; H185-Q189 PolarHBondContact O-N 3.42Å; S186-Q189 PolarHBondContact O-N 3.32Å; S186-Q189 VanDerWaalsContact O-N 3.17Å; Q189-S192 PolarHBondContact O-N 3.48Å; Q189-K193 WeakPolarHBondContact O-CB 3.26Å; Q189-K193 VanDerWaalsContact O-CG 3.3Å; Q189-K193 WeakPolarHBondContact O-CG 3.43Å; Q189-K193 PolarHBondContact O-N 2.92Å
190	E	94.1	Very high	93.7	Very high	137 Å²	137	76.7 Å²	76.7	64%	0.64	35%	0.35	S	S	*	.	H	α-helix	trans	-63.4	-49.8	178.5	-173.3	173.2	-162.8	0	0	111.5	S186 Q187 Y188 S192 K193 E194	S186-E190 PolarHBondContact O-N 2.92Å; Q187-E190 PolarHBondContact O-N 2.98Å; Y188-E190 PolarHBondContact O-N 3.48Å; E190-S192 VanDerWaalsContact C-N 3.32Å; E190-S192 PolarHBondContact O-N 2.92Å; E190-K193 PolarHBondContact O-N 3.48Å; E190-E194 PolarHBondContact O-N 3.44Å
191	K	94.1	Very high	94	Very high	59 Å²	59	77.7 Å²	77.7	26%	0.257	36%	0.356	S	S	.	.	H	α-helix	trans	-64.5	-34.9	176.3	-74.9	-160.6	178.6	-178.5	0	113	Q187 Y188 E194 Y195 I298 D301 L302 L305	Q187-K191 PolarHBondContact O-N 3.42Å; Y188-K191 PolarHBondContact O-N 3.15Å; K191-E194 PolarHBondContact O-N 2.88Å; K191-Y195 WeakPolarHBondContact O-CB 3.4Å; K191-Y195 PolarHBondContact O-N 2.87Å; K191-I298 HydrophobicContact CB-CG2 4.43Å; K191-D301 HydrophobicContact CD-CB 4.07Å; K191-D301 VanDerWaalsContact NZ-CB 3.34Å; K191-D301 VanDerWaalsContact NZ-CG 3.34Å; K191-D301 IonicContact NZ-OD2 2.8Å; K191-D301 PolarHBondContact NZ-OD2 3.44Å; K191-L302 HydrophobicContact CB-CD1 4.19Å; K191-L305 HydrophobicContact CD-CD1 3.8Å; K191-L305 HydrophobicContact CG-CD1 4.38Å
192	S	94.4	Very high	94.3	Very high	25 Å²	25	81.2 Å²	81.2	18%	0.175	37%	0.37	C	S	.	.	H	α-helix	trans	-62.9	-48.4	174.5	-167.2	0	0	0	0	110.5	Y188 Q189 E190 E194 Y195 D196	Y188-S192 VanDerWaalsContact O-CB 3.24Å; Y188-S192 WeakPolarHBondContact O-CB 3.49Å; Y188-S192 PolarHBondContact O-N 3.3Å; Q189-S192 PolarHBondContact O-N 3.48Å; E190-S192 VanDerWaalsContact C-N 3.32Å; E190-S192 PolarHBondContact O-N 2.92Å; S192-E194 VanDerWaalsContact C-N 3.31Å; S192-E194 PolarHBondContact O-N 3.42Å; S192-Y195 WeakPolarHBondContact O-CB 3.38Å; S192-Y195 PolarHBondContact O-N 3.45Å; S192-Y195 VanDerWaalsContact O-N 3.16Å; S192-D196 PolarHBondContact O-N 3.41Å
193	K	95.8	Very high	94.6	Very high	118 Å²	118	78.8 Å²	78.8	51%	0.513	36%	0.362	S	S	.	.	H	α-helix	trans	-61.7	-38.1	176.8	-73	173.2	-176.6	176.1	0	112.3	Q189 E190 R197	Q189-K193 WeakPolarHBondContact O-CB 3.26Å; Q189-K193 VanDerWaalsContact O-CG 3.3Å; Q189-K193 WeakPolarHBondContact O-CG 3.43Å; Q189-K193 PolarHBondContact O-N 2.92Å; E190-K193 PolarHBondContact O-N 3.48Å; K193-R197 VanDerWaalsContact O-CG 3.29Å; K193-R197 WeakPolarHBondContact O-CG 3.21Å; K193-R197 PolarHBondContact O-N 3.29Å; K193-R197 VanDerWaalsContact O-N 3.11Å
194	E	95.4	Very high	94.8	Very high	93 Å²	93	80.3 Å²	80.3	44%	0.435	36%	0.363	S	S	.	.	H	α-helix	trans	-63.3	-45.6	174	-174	-178.8	-177.3	0	0	111.5	E190 K191 S192 D196 R197 L198 I298	E190-E194 PolarHBondContact O-N 3.44Å; K191-E194 PolarHBondContact O-N 2.88Å; S192-E194 VanDerWaalsContact C-N 3.31Å; S192-E194 PolarHBondContact O-N 3.42Å; E194-D196 PolarHBondContact O-N 3.4Å; E194-R197 PolarHBondContact O-N 3.36Å; E194-L198 HydrophobicContact CG-CD1 4.38Å; E194-L198 WeakPolarHBondContact O-CG 3.42Å; E194-L198 PolarHBondContact O-N 3.33Å; E194-I298 HydrophobicContact CG-CD1 4.09Å
195	Y	96.4	Very high	95	Very high	40 Å²	40	77.7 Å²	77.7	16%	0.157	35%	0.354	C	S	.	.	H	α-helix	trans	-60	-45	176	-177.2	-90.3	0	0	0	112	K191 S192 R197 L198 Y199 M295 K299	K191-Y195 WeakPolarHBondContact O-CB 3.4Å; K191-Y195 PolarHBondContact O-N 2.87Å; S192-Y195 WeakPolarHBondContact O-CB 3.38Å; S192-Y195 PolarHBondContact O-N 3.45Å; S192-Y195 VanDerWaalsContact O-N 3.16Å; Y195-R197 PolarHBondContact O-N 3.49Å; Y195-L198 PolarHBondContact O-N 2.92Å; Y195-Y199 WeakPolarHBondContact O-CB 3.29Å; Y195-Y199 PolarHBondContact O-N 3.02Å; Y195-M295 HydrophobicContact CD2-CB 4.43Å; Y195-M295 HydrophobicContact CD2-CG 4.48Å; Y195-M295 HydrophobicContact CE2-CB 3.98Å; Y195-M295 HydrophobicContact CE2-CE 4.01Å; Y195-M295 HydrophobicContact CE2-CG 4.26Å; Y195-K299 HydrophobicContact CD2-CG 4.43Å; Y195-K299 HydrophobicContact CE2-CD 4.35Å; Y195-K299 HydrophobicContact CE2-CG 3.68Å; Y195-K299 WeakPolarHBondContact OH-CE 3.42Å
196	D	94.9	Very high	95.2	Very high	73 Å²	73	79.1 Å²	79.1	39%	0.39	37%	0.367	S	S	.	.	H	α-helix	trans	-60.8	-44.4	179.2	-63.8	-25.6	0	0	0	111.2	S192 E194 L198 Y199 E200	S192-D196 PolarHBondContact O-N 3.41Å; E194-D196 PolarHBondContact O-N 3.4Å; D196-L198 PolarHBondContact O-N 3.11Å; D196-Y199 PolarHBondContact O-N 3.05Å; D196-E200 WeakPolarHBondContact O-CG 3.25Å; D196-E200 PolarHBondContact O-N 3.26Å
197	R	96.3	Very high	95.4	Very high	172 Å²	172	81.9 Å²	81.9	65%	0.649	37%	0.373	S	S	*	.	H	α-helix	trans	-60.1	-45.2	174.9	-71.4	172.3	-170.9	173.1	3.8	112.5	K193 E194 Y195 Y199 E200 E201	K193-R197 VanDerWaalsContact O-CG 3.29Å; K193-R197 WeakPolarHBondContact O-CG 3.21Å; K193-R197 PolarHBondContact O-N 3.29Å; K193-R197 VanDerWaalsContact O-N 3.11Å; E194-R197 PolarHBondContact O-N 3.36Å; Y195-R197 PolarHBondContact O-N 3.49Å; R197-Y199 VanDerWaalsContact C-N 3.3Å; R197-Y199 PolarHBondContact O-N 3.15Å; R197-E200 PolarHBondContact O-N 2.99Å; R197-E201 WeakPolarHBondContact O-CB 3.26Å; R197-E201 PolarHBondContact O-N 3.49Å
198	L	96	Very high	95.5	Very high	18 Å²	18	81.2 Å²	81.2	9%	0.094	37%	0.369	C	S	.	.	H	α-helix	trans	-64.1	-38	177.5	-70.8	171.5	0	0	0	111.3	E194 Y195 D196 E201 Y202 I291 K294 M295 I298	E194-L198 HydrophobicContact CG-CD1 4.38Å; E194-L198 WeakPolarHBondContact O-CG 3.42Å; E194-L198 PolarHBondContact O-N 3.33Å; Y195-L198 PolarHBondContact O-N 2.92Å; D196-L198 PolarHBondContact O-N 3.11Å; L198-E201 PolarHBondContact O-N 3.36Å; L198-Y202 VanDerWaalsContact O-CB 3.27Å; L198-Y202 WeakPolarHBondContact O-CB 3.43Å; L198-Y202 PolarHBondContact O-N 3.05Å; L198-I291 HydrophobicContact CB-CG2 4.27Å; L198-I291 HydrophobicContact CD2-CG2 4.26Å; L198-I291 WeakPolarHBondContact O-CG2 3.25Å; L198-K294 HydrophobicContact CD1-CB 4.08Å; L198-K294 HydrophobicContact CD2-CD 4.45Å; L198-M295 HydrophobicContact CB-CG 3.67Å; L198-M295 HydrophobicContact CB-SD 4.29Å; L198-M295 HydrophobicContact CD1-CG 4.21Å; L198-I298 HydrophobicContact CD1-CD1 3.58Å
199	Y	96.4	Very high	95.6	Very high	124 Å²	124	79.5 Å²	79.5	49%	0.486	36%	0.363	S	S	.	.	H	α-helix	trans	-67.1	-42.1	178.1	-173.7	-93.9	0	0	0	112.4	Y195 D196 R197 Y202 T203 M295	Y195-Y199 WeakPolarHBondContact O-CB 3.29Å; Y195-Y199 PolarHBondContact O-N 3.02Å; D196-Y199 PolarHBondContact O-N 3.05Å; R197-Y199 VanDerWaalsContact C-N 3.3Å; R197-Y199 PolarHBondContact O-N 3.15Å; Y199-Y202 PolarHBondContact O-N 3Å; Y199-T203 WeakPolarHBondContact O-CB 3.33Å; Y199-T203 PolarHBondContact O-N 2.95Å; Y199-T203 PolarHBondContact O-OG1 3.07Å; Y199-M295 HydrophobicContact CD2-CE 3.68Å
200	E	96.6	Very high	95.8	Very high	128 Å²	128	80.7 Å²	80.7	60%	0.598	37%	0.369	S	S	*	.	H	α-helix	trans	-60.6	-46.1	173	-73.5	175.8	-175.2	0	0	111.5	D196 R197 T203 R204	D196-E200 WeakPolarHBondContact O-CG 3.25Å; D196-E200 PolarHBondContact O-N 3.26Å; R197-E200 PolarHBondContact O-N 2.99Å; E200-T203 PolarHBondContact O-N 2.93Å; E200-R204 WeakPolarHBondContact O-CB 3.49Å; E200-R204 PolarHBondContact O-N 2.75Å
201	E	95.7	Very high	96	Very high	81 Å²	81	80.6 Å²	80.6	38%	0.379	37%	0.37	S	S	.	.	H	α-helix	trans	-64.1	-43.1	177.4	-175.1	174.7	-168.2	0	0	112.2	R197 L198 R204 T205 I291	R197-E201 WeakPolarHBondContact O-CB 3.26Å; R197-E201 PolarHBondContact O-N 3.49Å; L198-E201 PolarHBondContact O-N 3.36Å; E201-R204 PolarHBondContact O-N 2.87Å; E201-T205 VanDerWaalsContact O-CB 3.24Å; E201-T205 WeakPolarHBondContact O-CB 3.23Å; E201-T205 PolarHBondContact O-N 3.1Å; E201-T205 PolarHBondContact O-OG1 2.87Å; E201-I291 HydrophobicContact CB-CD1 4.49Å; E201-I291 HydrophobicContact CG-CD1 3.69Å
202	Y	96.4	Very high	96.1	Very high	75 Å²	75	80.1 Å²	80.1	29%	0.294	37%	0.368	S	S	.	.	H	α-helix	trans	-58.3	-48.5	175	175.4	-95.9	0	0	0	111.4	L198 Y199 T205 S206 N288 I291 D292 M295	L198-Y202 VanDerWaalsContact O-CB 3.27Å; L198-Y202 WeakPolarHBondContact O-CB 3.43Å; L198-Y202 PolarHBondContact O-N 3.05Å; Y199-Y202 PolarHBondContact O-N 3Å; Y202-T205 PolarHBondContact O-N 3.42Å; Y202-S206 VanDerWaalsContact O-CB 3.25Å; Y202-S206 WeakPolarHBondContact O-CB 3.24Å; Y202-S206 PolarHBondContact O-N 3.31Å; Y202-N288 VanDerWaalsContact CD2-OD1 3.23Å; Y202-N288 WeakPolarHBondContact CD2-OD1 3.47Å; Y202-N288 WeakPolarHBondContact CE2-ND2 3.39Å; Y202-N288 PolarHBondContact O-OD1 2.8Å; Y202-I291 HydrophobicContact CD2-CG2 4.44Å; Y202-D292 HydrophobicContact CD2-CB 4.46Å; Y202-D292 HydrophobicContact CE2-CB 4.13Å; Y202-M295 HydrophobicContact CG-SD 4.31Å
203	T	95.6	Very high	96.2	Very high	48 Å²	48	85 Å²	85	29%	0.294	38%	0.382	S	S	.	.	H	α-helix	trans	-64.3	-45.7	-177.8	-56.9	0	0	0	0	111	Y199 E200 S206 Q207	Y199-T203 WeakPolarHBondContact O-CB 3.33Å; Y199-T203 PolarHBondContact O-N 2.95Å; Y199-T203 PolarHBondContact O-OG1 3.07Å; E200-T203 PolarHBondContact O-N 2.93Å; T203-S206 PolarHBondContact O-N 3.2Å; T203-Q207 WeakPolarHBondContact O-CG 3.41Å; T203-Q207 PolarHBondContact O-N 2.91Å; T203-Q207 VanDerWaalsContact O-N 3.09Å
204	R	96.1	Very high	96.3	Very high	126 Å²	126	83 Å²	83	48%	0.475	38%	0.38	S	S	.	.	H	α-helix	trans	-59.5	-50.1	175.3	-179	178.7	63.9	-118.3	1.4	111.4	E200 E201 S206 Q207 E208	E200-R204 WeakPolarHBondContact O-CB 3.49Å; E200-R204 PolarHBondContact O-N 2.75Å; E201-R204 PolarHBondContact O-N 2.87Å; R204-S206 VanDerWaalsContact C-N 3.3Å; R204-S206 PolarHBondContact O-N 3.38Å; R204-Q207 PolarHBondContact O-N 3.03Å; R204-E208 PolarHBondContact O-N 3.03Å
205	T	94.9	Very high	96.4	Very high	12 Å²	12	80.3 Å²	80.3	7%	0.074	37%	0.374	C	S	.	.	H	α-helix	trans	-62.5	-38.5	-179.8	-57.5	0	0	0	0	111.6	E201 Y202 Q207 E208 I209 Q284 N288	E201-T205 VanDerWaalsContact O-CB 3.24Å; E201-T205 WeakPolarHBondContact O-CB 3.23Å; E201-T205 PolarHBondContact O-N 3.1Å; E201-T205 PolarHBondContact O-OG1 2.87Å; Y202-T205 PolarHBondContact O-N 3.42Å; T205-Q207 PolarHBondContact O-N 2.85Å; T205-E208 PolarHBondContact O-N 3.29Å; T205-I209 HydrophobicContact CG2-CD1 4.13Å; T205-I209 WeakPolarHBondContact O-CB 3.47Å; T205-I209 VanDerWaalsContact O-CG1 3.26Å; T205-I209 WeakPolarHBondContact O-CG1 3.27Å; T205-I209 PolarHBondContact O-N 3.09Å; T205-Q284 HydrophobicContact CG2-CG 3.53Å; T205-N288 HydrophobicContact CG2-CB 3.73Å
206	S	96.3	Very high	96.5	Very high	52 Å²	52	79.1 Å²	79.1	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-62.9	-40.6	175.8	-171.4	0	0	0	0	112.3	Y202 T203 R204 Q210	Y202-S206 VanDerWaalsContact O-CB 3.25Å; Y202-S206 WeakPolarHBondContact O-CB 3.24Å; Y202-S206 PolarHBondContact O-N 3.31Å; T203-S206 PolarHBondContact O-N 3.2Å; R204-S206 VanDerWaalsContact C-N 3.3Å; R204-S206 PolarHBondContact O-N 3.38Å; S206-Q210 PolarHBondContact O-N 3.35Å; S206-Q210 VanDerWaalsContact O-N 3.15Å
207	Q	96.8	Very high	96.6	Very high	125 Å²	125	81.8 Å²	81.8	58%	0.584	38%	0.38	S	S	*	.	H	α-helix	trans	-65.3	-44.8	174.5	-70	174.1	-0.5	0	0	111.5	T203 R204 T205 I209 Q210 M211	T203-Q207 WeakPolarHBondContact O-CG 3.41Å; T203-Q207 PolarHBondContact O-N 2.91Å; T203-Q207 VanDerWaalsContact O-N 3.09Å; R204-Q207 PolarHBondContact O-N 3.03Å; T205-Q207 PolarHBondContact O-N 2.85Å; Q207-I209 VanDerWaalsContact C-N 3.34Å; Q207-I209 PolarHBondContact O-N 3.28Å; Q207-Q210 WeakPolarHBondContact O-CB 3.43Å; Q207-Q210 PolarHBondContact O-N 2.69Å; Q207-Q210 VanDerWaalsContact O-N 3.1Å; Q207-M211 WeakPolarHBondContact O-CG 3.21Å; Q207-M211 PolarHBondContact O-N 2.83Å
208	E	95.9	Very high	96.7	Very high	75 Å²	75	76.2 Å²	76.2	35%	0.35	37%	0.371	S	S	.	.	H	α-helix	trans	-61.1	-40.7	177	-71.5	178.9	-154.9	0	0	112.4	R204 T205 Q210 M211 K212 Q284	R204-E208 PolarHBondContact O-N 3.03Å; T205-E208 PolarHBondContact O-N 3.29Å; E208-Q210 VanDerWaalsContact C-N 3.3Å; E208-Q210 PolarHBondContact O-N 3.18Å; E208-M211 PolarHBondContact O-N 3.38Å; E208-K212 WeakPolarHBondContact O-CG 3.48Å; E208-K212 PolarHBondContact O-N 3.37Å; E208-Q284 PolarHBondContact OE2-NE2 3.42Å
209	I	96.8	Very high	96.8	Very high	11 Å²	11	78.3 Å²	78.3	6%	0.056	38%	0.38	C	S	.	.	H	α-helix	trans	-57	-45.3	172.7	-75.8	167.8	0	0	0	110.5	T205 Q207 K212 R213 L281 Q284 A285 N288	T205-I209 HydrophobicContact CG2-CD1 4.13Å; T205-I209 WeakPolarHBondContact O-CB 3.47Å; T205-I209 VanDerWaalsContact O-CG1 3.26Å; T205-I209 WeakPolarHBondContact O-CG1 3.27Å; T205-I209 PolarHBondContact O-N 3.09Å; Q207-I209 VanDerWaalsContact C-N 3.34Å; Q207-I209 PolarHBondContact O-N 3.28Å; I209-K212 PolarHBondContact O-N 3.5Å; I209-R213 WeakPolarHBondContact O-CG 3.45Å; I209-R213 PolarHBondContact O-N 3.44Å; I209-L281 HydrophobicContact CB-CD1 4.24Å; I209-L281 HydrophobicContact CG1-CD1 4.33Å; I209-L281 HydrophobicContact CG2-CD1 3.81Å; I209-Q284 HydrophobicContact CD1-CG 4.29Å; I209-Q284 HydrophobicContact CG1-CB 4.35Å; I209-Q284 HydrophobicContact CG1-CG 3.91Å; I209-A285 HydrophobicContact CD1-CB 4.34Å; I209-N288 HydrophobicContact CD1-CB 3.79Å
210	Q	97.6	Very high	96.8	Very high	103 Å²	103	75.5 Å²	75.5	48%	0.481	37%	0.373	S	S	.	.	H	α-helix	trans	-66.5	-39.9	-179.9	-171.1	61.5	13.6	0	0	112.3	S206 Q207 E208 R213 T214	S206-Q210 PolarHBondContact O-N 3.35Å; S206-Q210 VanDerWaalsContact O-N 3.15Å; Q207-Q210 WeakPolarHBondContact O-CB 3.43Å; Q207-Q210 PolarHBondContact O-N 2.69Å; Q207-Q210 VanDerWaalsContact O-N 3.1Å; E208-Q210 VanDerWaalsContact C-N 3.3Å; E208-Q210 PolarHBondContact O-N 3.18Å; Q210-R213 PolarHBondContact O-N 3.38Å; Q210-T214 PolarHBondContact O-N 3.34Å; Q210-T214 VanDerWaalsContact O-N 3.07Å; Q210-T214 PolarHBondContact O-OG1 2.95Å
211	M	96.9	Very high	96.8	Very high	135 Å²	135	74.1 Å²	74.1	67%	0.665	37%	0.367	S	S	*	.	H	α-helix	trans	-61.4	-44.4	173.5	-67.5	171.9	65.9	0	0	111.3	Q207 E208 T214 A215	Q207-M211 WeakPolarHBondContact O-CG 3.21Å; Q207-M211 PolarHBondContact O-N 2.83Å; E208-M211 PolarHBondContact O-N 3.38Å; M211-T214 PolarHBondContact O-N 3.02Å; M211-A215 WeakPolarHBondContact O-CB 3.43Å; M211-A215 PolarHBondContact O-N 3.38Å
212	K	96.9	Very high	96.9	Very high	49 Å²	49	72.9 Å²	72.9	21%	0.213	37%	0.365	C	S	.	.	H	α-helix	trans	-64	-39.5	177.1	-73.5	-178.4	178.5	170.9	0	112.6	E208 I209 A215 I216 L277 L281 Q284	E208-K212 WeakPolarHBondContact O-CG 3.48Å; E208-K212 PolarHBondContact O-N 3.37Å; I209-K212 PolarHBondContact O-N 3.5Å; K212-A215 PolarHBondContact O-N 3.07Å; K212-I216 WeakPolarHBondContact O-CD1 3.48Å; K212-I216 WeakPolarHBondContact O-CG1 3.3Å; K212-I216 PolarHBondContact O-N 2.89Å; K212-L277 HydrophobicContact CB-CD1 4.4Å; K212-L277 HydrophobicContact CD-CD1 4.21Å; K212-L277 HydrophobicContact CG-CD1 3.96Å; K212-L281 HydrophobicContact CB-CB 4.47Å; K212-L281 HydrophobicContact CB-CD1 4.02Å; K212-Q284 VanDerWaalsContact CE-OE1 3.29Å
213	R	97.3	Very high	96.9	Very high	127 Å²	127	69.8 Å²	69.8	48%	0.479	35%	0.353	S	S	.	.	H	α-helix	trans	-59	-49.8	173.6	-75.6	173.9	177.1	175.4	-2.5	111.7	I209 Q210 A215 I216 E217 L281	I209-R213 WeakPolarHBondContact O-CG 3.45Å; I209-R213 PolarHBondContact O-N 3.44Å; Q210-R213 PolarHBondContact O-N 3.38Å; R213-A215 VanDerWaalsContact C-N 3.28Å; R213-A215 PolarHBondContact O-N 3.01Å; R213-I216 PolarHBondContact O-N 2.69Å; R213-I216 VanDerWaalsContact O-N 3.1Å; R213-E217 PolarHBondContact O-N 2.83Å; R213-L281 HydrophobicContact CG-CD1 4.16Å; R213-L281 HydrophobicContact CG-CD2 3.87Å
214	T	97.9	Very high	97	Very high	75 Å²	75	71.9 Å²	71.9	46%	0.46	36%	0.358	S	S	.	.	H	α-helix	trans	-60.3	-40.4	177.8	-50	0	0	0	0	111.2	Q210 M211 E217 A218	Q210-T214 PolarHBondContact O-N 3.34Å; Q210-T214 VanDerWaalsContact O-N 3.07Å; Q210-T214 PolarHBondContact O-OG1 2.95Å; M211-T214 PolarHBondContact O-N 3.02Å; T214-E217 PolarHBondContact O-N 2.9Å; T214-A218 PolarHBondContact O-N 2.8Å
215	A	97.6	Very high	97	Very high	38 Å²	38	70.3 Å²	70.3	31%	0.314	36%	0.359	S	S	.	.	H	α-helix	trans	-64.9	-38	175.6	0	0	0	0	0	112.7	M211 K212 R213 A218 F219 L277	M211-A215 WeakPolarHBondContact O-CB 3.43Å; M211-A215 PolarHBondContact O-N 3.38Å; K212-A215 PolarHBondContact O-N 3.07Å; R213-A215 VanDerWaalsContact C-N 3.28Å; R213-A215 PolarHBondContact O-N 3.01Å; A215-A218 PolarHBondContact O-N 3.47Å; A215-F219 WeakPolarHBondContact O-CD2 3.18Å; A215-F219 PolarHBondContact O-N 3.3Å; A215-L277 HydrophobicContact CB-CD2 3.77Å
216	I	97.4	Very high	97	Very high	15 Å²	15	72.3 Å²	72.3	8%	0.077	37%	0.366	C	S	.	.	H	α-helix	trans	-65.2	-40.1	174.7	-70.5	159.3	0	0	0	111.2	K212 R213 A218 F219 N220 L277 E278 L281	K212-I216 WeakPolarHBondContact O-CD1 3.48Å; K212-I216 WeakPolarHBondContact O-CG1 3.3Å; K212-I216 PolarHBondContact O-N 2.89Å; R213-I216 PolarHBondContact O-N 2.69Å; R213-I216 VanDerWaalsContact O-N 3.1Å; I216-A218 VanDerWaalsContact C-N 3.33Å; I216-A218 PolarHBondContact O-N 2.73Å; I216-F219 WeakPolarHBondContact O-CB 3.49Å; I216-F219 PolarHBondContact O-N 3.1Å; I216-N220 VanDerWaalsContact O-CG 3.3Å; I216-N220 PolarHBondContact O-N 3Å; I216-N220 PolarHBondContact O-ND2 3.4Å; I216-L277 HydrophobicContact CD1-CG 4.29Å; I216-L277 HydrophobicContact CG1-CB 4.42Å; I216-L277 HydrophobicContact CG1-CD2 3.78Å; I216-L277 HydrophobicContact CG1-CG 3.94Å; I216-E278 HydrophobicContact CD1-CG 3.81Å; I216-E278 HydrophobicContact CG1-CG 4.13Å; I216-E278 HydrophobicContact CG2-CG 4.24Å; I216-L281 HydrophobicContact CD1-CB 4.15Å; I216-L281 HydrophobicContact CD1-CD2 3.47Å; I216-L281 VanDerWaalsContact CD1-CD2 3.47Å; I216-L281 HydrophobicContact CD1-CG 4.41Å
217	E	97.5	Very high	96.9	Very high	128 Å²	128	75 Å²	75	60%	0.598	37%	0.373	S	S	*	.	H	α-helix	trans	-60.9	-42.7	173.4	-70.4	170.4	-169.2	0	0	111.5	R213 T214 F219 N220 E221	R213-E217 PolarHBondContact O-N 2.83Å; T214-E217 PolarHBondContact O-N 2.9Å; E217-F219 VanDerWaalsContact C-N 3.35Å; E217-F219 PolarHBondContact O-N 3.03Å; E217-N220 WeakPolarHBondContact O-CB 3.45Å; E217-N220 PolarHBondContact O-N 3.13Å; E217-N220 VanDerWaalsContact O-N 3.17Å; E217-E221 PolarHBondContact O-N 3.12Å
218	A	97.7	Very high	96.8	Very high	56 Å²	56	74 Å²	74	46%	0.463	37%	0.369	S	S	.	.	H	α-helix	trans	-63.5	-38.1	173.8	0	0	0	0	0	112.7	T214 A215 I216 E221 T222	T214-A218 PolarHBondContact O-N 2.8Å; A215-A218 PolarHBondContact O-N 3.47Å; I216-A218 VanDerWaalsContact C-N 3.33Å; I216-A218 PolarHBondContact O-N 2.73Å; A218-E221 PolarHBondContact O-N 3Å; A218-T222 WeakPolarHBondContact O-CB 3.44Å; A218-T222 PolarHBondContact O-N 3.35Å; A218-T222 PolarHBondContact O-OG1 3.3Å
219	F	97.8	Very high	96.7	Very high	61 Å²	61	75.5 Å²	75.5	27%	0.268	38%	0.375	S	S	.	.	H	α-helix	trans	-62.9	-41.3	171.7	-84.7	-65	0	0	0	111.8	A215 I216 E217 T222 I223 I270 K274 L277	A215-F219 WeakPolarHBondContact O-CD2 3.18Å; A215-F219 PolarHBondContact O-N 3.3Å; I216-F219 WeakPolarHBondContact O-CB 3.49Å; I216-F219 PolarHBondContact O-N 3.1Å; E217-F219 VanDerWaalsContact C-N 3.35Å; E217-F219 PolarHBondContact O-N 3.03Å; F219-T222 PolarHBondContact O-N 3.38Å; F219-I223 WeakPolarHBondContact O-CB 3.46Å; F219-I223 VanDerWaalsContact O-CG1 3.27Å; F219-I223 WeakPolarHBondContact O-CG1 3.45Å; F219-I223 PolarHBondContact O-N 2.9Å; F219-I270 HydrophobicContact CD1-CG2 3.99Å; F219-I270 HydrophobicContact CE1-CG2 4.48Å; F219-K274 HydrophobicContact CB-CB 4.08Å; F219-K274 HydrophobicContact CB-CD 4.44Å; F219-K274 HydrophobicContact CB-CG 4.13Å; F219-K274 HydrophobicContact CG-CB 4.19Å; F219-L277 HydrophobicContact CD2-CD2 3.87Å; F219-L277 HydrophobicContact CE2-CD2 3.68Å
220	N	96.9	Very high	96.5	Very high	66 Å²	66	75.6 Å²	75.6	35%	0.353	38%	0.377	S	S	.	.	H	α-helix	trans	-61.3	-45.8	177.7	-71.9	-29.8	0	0	0	111.6	I216 E217 T222 I223 K224 K274	I216-N220 VanDerWaalsContact O-CG 3.3Å; I216-N220 PolarHBondContact O-N 3Å; I216-N220 PolarHBondContact O-ND2 3.4Å; E217-N220 WeakPolarHBondContact O-CB 3.45Å; E217-N220 PolarHBondContact O-N 3.13Å; E217-N220 VanDerWaalsContact O-N 3.17Å; N220-T222 VanDerWaalsContact C-N 3.33Å; N220-T222 PolarHBondContact O-N 3.38Å; N220-I223 PolarHBondContact O-N 2.89Å; N220-K224 WeakPolarHBondContact O-CB 3.34Å; N220-K224 PolarHBondContact O-N 3.06Å; N220-K274 WeakPolarHBondContact OD1-CD 3.35Å; N220-K274 WeakPolarHBondContact OD1-CE 3.23Å; N220-K274 PolarHBondContact OD1-NZ 3.45Å
221	E	97.8	Very high	96.2	Very high	98 Å²	98	76.3 Å²	76.3	46%	0.458	38%	0.38	S	S	.	.	H	α-helix	trans	-67.5	-36.7	177.7	-162.8	61.2	-154.5	0	0	111.5	E217 A218 K224 I225	E217-E221 PolarHBondContact O-N 3.12Å; A218-E221 PolarHBondContact O-N 3Å; E221-K224 WeakPolarHBondContact O-CB 3.27Å; E221-K224 PolarHBondContact O-N 2.71Å; E221-K224 IonicContact OE1-NZ 2.87Å; E221-K224 PolarHBondContact OE1-NZ 3.27Å; E221-K224 IonicContact OE2-NZ 2.74Å; E221-I225 WeakPolarHBondContact O-CG1 3.12Å; E221-I225 PolarHBondContact O-N 3.44Å
222	T	96.4	Very high	96	Very high	55 Å²	55	72.6 Å²	72.6	34%	0.337	37%	0.365	S	S	.	.	H	α-helix	trans	-62.2	-46.6	174.1	-56.5	0	0	0	0	111.2	A218 F219 N220 K224 I225 F226 I270	A218-T222 WeakPolarHBondContact O-CB 3.44Å; A218-T222 PolarHBondContact O-N 3.35Å; A218-T222 PolarHBondContact O-OG1 3.3Å; F219-T222 PolarHBondContact O-N 3.38Å; N220-T222 VanDerWaalsContact C-N 3.33Å; N220-T222 PolarHBondContact O-N 3.38Å; T222-K224 VanDerWaalsContact C-N 3.3Å; T222-K224 PolarHBondContact O-N 3.2Å; T222-I225 PolarHBondContact O-N 2.85Å; T222-F226 HydrophobicContact CG2-CD2 4.01Å; T222-F226 HydrophobicContact CG2-CE2 3.98Å; T222-F226 VanDerWaalsContact O-CD2 3.32Å; T222-F226 WeakPolarHBondContact O-CD2 3.46Å; T222-F226 PolarHBondContact O-N 2.83Å; T222-F226 VanDerWaalsContact O-N 3.09Å; T222-I270 HydrophobicContact CG2-CD1 4.28Å; T222-I270 HydrophobicContact CG2-CG2 4.49Å
223	I	96.6	Very high	95.6	Very high	11 Å²	11	72.4 Å²	72.4	6%	0.056	37%	0.365	C	S	.	.	H	α-helix	trans	-58.2	-46.3	177.2	-74.6	167.6	0	0	0	110	F219 N220 I225 F226 E227 L267 I270 K274	F219-I223 WeakPolarHBondContact O-CB 3.46Å; F219-I223 VanDerWaalsContact O-CG1 3.27Å; F219-I223 WeakPolarHBondContact O-CG1 3.45Å; F219-I223 PolarHBondContact O-N 2.9Å; N220-I223 PolarHBondContact O-N 2.89Å; I223-I225 PolarHBondContact O-N 2.86Å; I223-F226 CarbonylContact O-C 3.42Å; I223-F226 PolarHBondContact O-N 3.41Å; I223-F226 VanDerWaalsContact O-N 3.1Å; I223-E227 HydrophobicContact CG2-CG 4.17Å; I223-E227 WeakPolarHBondContact O-CG 3.48Å; I223-E227 PolarHBondContact O-N 3.03Å; I223-L267 HydrophobicContact CG1-CD1 4.47Å; I223-L267 HydrophobicContact CG2-CD1 4.14Å; I223-I270 HydrophobicContact CD1-CG2 4.26Å; I223-I270 HydrophobicContact CG1-CG2 3.64Å; I223-K274 HydrophobicContact CD1-CB 4.3Å; I223-K274 HydrophobicContact CD1-CD 3.55Å
224	K	97.3	Very high	95.2	Very high	91 Å²	91	69.8 Å²	69.8	40%	0.396	36%	0.358	S	S	.	.	H	α-helix	trans	-57.6	-44.7	178.2	-176.1	-176	165.6	-154.6	0	112.5	N220 E221 T222 F226 E227 E228	N220-K224 WeakPolarHBondContact O-CB 3.34Å; N220-K224 PolarHBondContact O-N 3.06Å; E221-K224 WeakPolarHBondContact O-CB 3.27Å; E221-K224 PolarHBondContact O-N 2.71Å; E221-K224 IonicContact OE1-NZ 2.87Å; E221-K224 PolarHBondContact OE1-NZ 3.27Å; E221-K224 IonicContact OE2-NZ 2.74Å; T222-K224 VanDerWaalsContact C-N 3.3Å; T222-K224 PolarHBondContact O-N 3.2Å; K224-F226 VanDerWaalsContact C-N 3.34Å; K224-F226 PolarHBondContact O-N 2.82Å; K224-E227 PolarHBondContact O-N 2.86Å; K224-E228 WeakPolarHBondContact CE-OE1 3.37Å; K224-E228 WeakPolarHBondContact O-CG 3.38Å; K224-E228 PolarHBondContact O-N 3.08Å
225	I	96.3	Very high	94.7	Very high	94 Å²	94	71.8 Å²	71.8	48%	0.482	36%	0.362	S	S	.	.	H	α-helix	trans	-61.4	-42.3	175.7	-66	165.1	0	0	0	111.2	E221 T222 I223 E228 Q229	E221-I225 WeakPolarHBondContact O-CG1 3.12Å; E221-I225 PolarHBondContact O-N 3.44Å; T222-I225 PolarHBondContact O-N 2.85Å; I223-I225 PolarHBondContact O-N 2.86Å; I225-E228 PolarHBondContact O-N 3.23Å; I225-Q229 WeakPolarHBondContact O-CB 3.3Å; I225-Q229 PolarHBondContact O-N 3.32Å
226	F	95.1	Very high	94.2	Very high	54 Å²	54	74.8 Å²	74.8	24%	0.237	37%	0.37	C	S	.	.	H	α-helix	trans	-69.6	-33.5	177.5	-87.5	-102.7	0	0	0	112.8	T222 I223 K224 Q229 C230 L263 R266 L267 I270	T222-F226 HydrophobicContact CG2-CD2 4.01Å; T222-F226 HydrophobicContact CG2-CE2 3.98Å; T222-F226 VanDerWaalsContact O-CD2 3.32Å; T222-F226 WeakPolarHBondContact O-CD2 3.46Å; T222-F226 PolarHBondContact O-N 2.83Å; T222-F226 VanDerWaalsContact O-N 3.09Å; I223-F226 CarbonylContact O-C 3.42Å; I223-F226 PolarHBondContact O-N 3.41Å; I223-F226 VanDerWaalsContact O-N 3.1Å; K224-F226 VanDerWaalsContact C-N 3.34Å; K224-F226 PolarHBondContact O-N 2.82Å; F226-Q229 PolarHBondContact O-N 2.85Å; F226-C230 WeakPolarHBondContact O-CB 3.42Å; F226-C230 PolarHBondContact O-N 2.99Å; F226-C230 PolarHBondContact O-SG 3.41Å; F226-L263 HydrophobicContact CD1-CD1 3.72Å; F226-L263 HydrophobicContact CE1-CD1 4.03Å; F226-R266 HydrophobicContact CE1-CB 4.34Å; F226-R266 HydrophobicContact CE1-CG 3.71Å; F226-R266 HydrophobicContact CZ-CG 4.22Å; F226-L267 HydrophobicContact CB-CD1 3.81Å; F226-I270 HydrophobicContact CD1-CD1 4.3Å; F226-I270 HydrophobicContact CD2-CD1 3.98Å; F226-I270 HydrophobicContact CE1-CD1 4.12Å; F226-I270 HydrophobicContact CE2-CD1 3.77Å; F226-I270 HydrophobicContact CG-CD1 4.24Å; F226-I270 HydrophobicContact CZ-CD1 3.85Å
227	E	93.9	Very high	93.7	Very high	107 Å²	107	74.8 Å²	74.8	50%	0.5	37%	0.371	S	S	.	.	H	α-helix	trans	-67	-44	173.4	-74.8	178.9	166.1	0	0	111.3	I223 K224 Q229 C230 H231 L267	I223-E227 HydrophobicContact CG2-CG 4.17Å; I223-E227 WeakPolarHBondContact O-CG 3.48Å; I223-E227 PolarHBondContact O-N 3.03Å; K224-E227 PolarHBondContact O-N 2.86Å; E227-Q229 VanDerWaalsContact C-N 3.3Å; E227-Q229 PolarHBondContact O-N 2.91Å; E227-C230 WeakPolarHBondContact O-CB 3.4Å; E227-C230 PolarHBondContact O-N 3Å; E227-H231 WeakPolarHBondContact O-CB 3.43Å; E227-H231 PolarHBondContact O-N 2.71Å; E227-L267 HydrophobicContact CG-CD1 4.42Å; E227-L267 HydrophobicContact CG-CD2 4.08Å
228	E	95.4	Very high	93.2	Very high	106 Å²	106	74.5 Å²	74.5	50%	0.495	37%	0.368	S	S	.	.	H	α-helix	trans	-60.4	-40.3	173	-73.5	174.2	-169.1	0	0	111.4	K224 I225 H231 T232	K224-E228 WeakPolarHBondContact CE-OE1 3.37Å; K224-E228 WeakPolarHBondContact O-CG 3.38Å; K224-E228 PolarHBondContact O-N 3.08Å; I225-E228 PolarHBondContact O-N 3.23Å; E228-H231 PolarHBondContact O-N 3.42Å; E228-T232 WeakPolarHBondContact O-CB 3.4Å; E228-T232 PolarHBondContact O-N 3.06Å; E228-T232 PolarHBondContact O-OG1 3.07Å
229	Q	93.8	Very high	92.6	Very high	106 Å²	106	78.2 Å²	78.2	50%	0.495	38%	0.375	S	S	.	.	H	α-helix	trans	-66.1	-41.1	175.1	-166.9	67.1	8	0	0	112	I225 F226 E227 H231 T232 Q233 L263	I225-Q229 WeakPolarHBondContact O-CB 3.3Å; I225-Q229 PolarHBondContact O-N 3.32Å; F226-Q229 PolarHBondContact O-N 2.85Å; E227-Q229 VanDerWaalsContact C-N 3.3Å; E227-Q229 PolarHBondContact O-N 2.91Å; Q229-H231 VanDerWaalsContact C-N 3.34Å; Q229-T232 PolarHBondContact O-N 3.06Å; Q229-Q233 VanDerWaalsContact O-CB 3.3Å; Q229-Q233 WeakPolarHBondContact O-CB 3.38Å; Q229-Q233 PolarHBondContact O-N 3.15Å; Q229-L263 HydrophobicContact CB-CD2 4.4Å; Q229-L263 HydrophobicContact CG-CD1 4.44Å; Q229-L263 HydrophobicContact CG-CD2 4.03Å
230	C	91.9	Very high	91.9	Very high	13 Å²	13	81 Å²	81	9%	0.088	39%	0.385	C	S	.	.	H	α-helix	trans	-60.1	-45.1	173.4	-77.2	0	0	0	0	111.3	F226 E227 E234 L263	F226-C230 WeakPolarHBondContact O-CB 3.42Å; F226-C230 PolarHBondContact O-N 2.99Å; F226-C230 PolarHBondContact O-SG 3.41Å; E227-C230 WeakPolarHBondContact O-CB 3.4Å; E227-C230 PolarHBondContact O-N 3Å; C230-E234 WeakPolarHBondContact O-CB 3.43Å; C230-E234 PolarHBondContact O-N 3.33Å; C230-L263 HydrophobicContact CB-CD2 4.42Å
231	H	92.3	Very high	91.4	Very high	117 Å²	117	79.3 Å²	79.3	54%	0.542	38%	0.375	S	S	.	.	H	α-helix	trans	-64.3	-45.9	179.4	-171.3	65.5	0	0	0	111.7	E227 E228 Q229 E234 Q235	E227-H231 WeakPolarHBondContact O-CB 3.43Å; E227-H231 PolarHBondContact O-N 2.71Å; E228-H231 PolarHBondContact O-N 3.42Å; Q229-H231 VanDerWaalsContact C-N 3.34Å; H231-E234 PolarHBondContact O-N 3.44Å; H231-Q235 WeakPolarHBondContact O-CB 3.48Å; H231-Q235 PolarHBondContact O-N 3.38Å
232	T	91.7	Very high	90.8	Very high	58 Å²	58	79.4 Å²	79.4	36%	0.356	38%	0.376	S	S	.	.	H	α-helix	trans	-61.2	-47.6	177.7	-58.3	0	0	0	0	111.1	E228 Q229 E234 Q235 H236	E228-T232 WeakPolarHBondContact O-CB 3.4Å; E228-T232 PolarHBondContact O-N 3.06Å; E228-T232 PolarHBondContact O-OG1 3.07Å; Q229-T232 PolarHBondContact O-N 3.06Å; T232-E234 VanDerWaalsContact C-N 3.33Å; T232-E234 PolarHBondContact O-N 3.43Å; T232-Q235 PolarHBondContact O-N 2.81Å; T232-H236 PolarHBondContact O-CD2 3.4Å; T232-H236 PolarHBondContact O-N 3.47Å
233	Q	89.1	Confident	90.3	Very high	45 Å²	45	84.4 Å²	84.4	21%	0.21	39%	0.389	C	S	.	.	H	α-helix	trans	-60.6	-42.2	176.1	177.6	65.6	0.9	0	0	111.4	Q229 S237 Y260	Q229-Q233 VanDerWaalsContact O-CB 3.3Å; Q229-Q233 WeakPolarHBondContact O-CB 3.38Å; Q229-Q233 PolarHBondContact O-N 3.15Å; Q233-S237 WeakPolarHBondContact O-CA 3.41Å; Q233-S237 WeakPolarHBondContact O-CB 3.45Å; Q233-S237 PolarHBondContact O-N 3.48Å; Q233-S237 PolarHBondContact O-OG 3.01Å; Q233-Y260 HydrophobicContact CG-CD2 3.92Å
234	E	87.9	Confident	89.9	Confident	71 Å²	71	85.9 Å²	85.9	33%	0.332	40%	0.395	S	S	.	.	H	α-helix	trans	-65.1	-42.2	178.3	-168.7	-175.9	158.7	0	0	112	C230 H231 T232 S237 K238	C230-E234 WeakPolarHBondContact O-CB 3.43Å; C230-E234 PolarHBondContact O-N 3.33Å; H231-E234 PolarHBondContact O-N 3.44Å; T232-E234 VanDerWaalsContact C-N 3.33Å; T232-E234 PolarHBondContact O-N 3.43Å; E234-S237 PolarHBondContact O-OG 2.92Å; E234-K238 VanDerWaalsContact O-CG 3.26Å; E234-K238 WeakPolarHBondContact O-CG 3.46Å; E234-K238 PolarHBondContact O-N 3.47Å; E234-K238 WeakPolarHBondContact OE1-CE 3.41Å; E234-K238 IonicContact OE1-NZ 3.86Å; E234-K238 PolarHBondContact OE1-NZ 3.37Å
235	Q	88.8	Confident	89.4	Confident	117 Å²	117	90 Å²	90	55%	0.547	41%	0.408	S	S	.	.	H	α-helix	trans	-65.9	-48.1	179.6	-173.1	174	-7.4	0	0	111.9	H231 T232	H231-Q235 WeakPolarHBondContact O-CB 3.48Å; H231-Q235 PolarHBondContact O-N 3.38Å; T232-Q235 PolarHBondContact O-N 2.81Å
236	H	87.1	Confident	89	Confident	102 Å²	102	94.9 Å²	94.9	47%	0.472	42%	0.42	S	S	.	.	H	α-helix	trans	-70.7	-44.8	178.9	-72.2	-66.6	0	0	0	112	T232 K238 E239 Y240	T232-H236 PolarHBondContact O-CD2 3.4Å; T232-H236 PolarHBondContact O-N 3.47Å; H236-K238 VanDerWaalsContact C-N 3.26Å; H236-K238 PolarHBondContact O-N 2.96Å; H236-E239 PolarHBondContact O-N 3.03Å; H236-Y240 VanDerWaalsContact O-CD2 3.24Å; H236-Y240 WeakPolarHBondContact O-CD2 3.11Å; H236-Y240 PolarHBondContact O-N 2.9Å
237	S	87.4	Confident	88.6	Confident	15 Å²	15	98.8 Å²	98.8	11%	0.105	44%	0.439	C	S	.	.	H	α-helix	trans	-62.2	-31.2	-177.4	63	0	0	0	0	113	Q233 E234 E239 Y240 I241	Q233-S237 WeakPolarHBondContact O-CA 3.41Å; Q233-S237 WeakPolarHBondContact O-CB 3.45Å; Q233-S237 PolarHBondContact O-N 3.48Å; Q233-S237 PolarHBondContact O-OG 3.01Å; E234-S237 PolarHBondContact O-OG 2.92Å; S237-E239 PolarHBondContact O-N 3.42Å; S237-Y240 PolarHBondContact O-N 3.44Å; S237-I241 WeakPolarHBondContact O-CB 3.42Å; S237-I241 WeakPolarHBondContact O-CD1 3.45Å; S237-I241 WeakPolarHBondContact O-CG1 3.43Å; S237-I241 PolarHBondContact O-N 2.94Å
238	K	86.7	Confident	88.2	Confident	122 Å²	122	96.5 Å²	96.5	53%	0.53	45%	0.445	S	S	.	.	H	α-helix	trans	-54.3	-48.8	177	-84.1	170	-177.2	165	0	112.5	E234 H236 E242	E234-K238 VanDerWaalsContact O-CG 3.26Å; E234-K238 WeakPolarHBondContact O-CG 3.46Å; E234-K238 PolarHBondContact O-N 3.47Å; E234-K238 WeakPolarHBondContact OE1-CE 3.41Å; E234-K238 IonicContact OE1-NZ 3.86Å; E234-K238 PolarHBondContact OE1-NZ 3.37Å; H236-K238 VanDerWaalsContact C-N 3.26Å; H236-K238 PolarHBondContact O-N 2.96Å; K238-E242 WeakPolarHBondContact O-CB 3.43Å; K238-E242 PolarHBondContact O-N 3.45Å; K238-E242 VanDerWaalsContact O-N 3.13Å
239	E	84.3	Confident	87.9	Confident	133 Å²	133	94.5 Å²	94.5	62%	0.621	44%	0.437	S	S	*	.	H	α-helix	trans	-68.8	-40.5	-179.7	-65.1	-176.7	177.3	0	0	112.3	H236 S237 R243	H236-E239 PolarHBondContact O-N 3.03Å; S237-E239 PolarHBondContact O-N 3.42Å; E239-R243 PolarHBondContact O-N 2.88Å; E239-R243 VanDerWaalsContact O-N 3.17Å
240	Y	84.1	Confident	87.6	Confident	121 Å²	121	96.5 Å²	96.5	48%	0.475	45%	0.446	S	S	.	.	H	α-helix	trans	-68.7	-44.1	178	-77.1	-77.6	0	0	0	112.5	H236 S237 E242 R243 F244	H236-Y240 VanDerWaalsContact O-CD2 3.24Å; H236-Y240 WeakPolarHBondContact O-CD2 3.11Å; H236-Y240 PolarHBondContact O-N 2.9Å; S237-Y240 PolarHBondContact O-N 3.44Å; Y240-E242 VanDerWaalsContact C-N 3.28Å; Y240-E242 PolarHBondContact O-N 2.83Å; Y240-R243 PolarHBondContact O-N 3Å; Y240-F244 HydrophobicContact CD1-CE2 4.19Å; Y240-F244 WeakPolarHBondContact O-CD2 3.43Å; Y240-F244 PolarHBondContact O-N 3.43Å
241	I	85.4	Confident	87.5	Confident	29 Å²	29	103.1 Å²	103.1	15%	0.149	47%	0.474	C	S	.	.	H	α-helix	trans	-60.8	-40.7	177.5	-70.7	167.4	0	0	0	110	S237 R245 I253 I256	S237-I241 WeakPolarHBondContact O-CB 3.42Å; S237-I241 WeakPolarHBondContact O-CD1 3.45Å; S237-I241 WeakPolarHBondContact O-CG1 3.43Å; S237-I241 PolarHBondContact O-N 2.94Å; I241-R245 VanDerWaalsContact O-CB 3.22Å; I241-R245 WeakPolarHBondContact O-CB 3.39Å; I241-R245 PolarHBondContact O-N 3.08Å; I241-I253 HydrophobicContact CG1-CG2 4.41Å; I241-I253 HydrophobicContact CG2-CD1 4.34Å; I241-I253 HydrophobicContact CG2-CG1 4.38Å; I241-I253 HydrophobicContact CG2-CG2 4.09Å; I241-I256 HydrophobicContact CD1-CG2 4.14Å; I241-I256 HydrophobicContact CG1-CD1 4.5Å; I241-I256 HydrophobicContact CG1-CG2 4.39Å
242	E	85.7	Confident	87.3	Confident	101 Å²	101	100.2 Å²	100.2	47%	0.472	46%	0.46	S	S	.	.	H	α-helix	trans	-67.6	-36.5	178	-163.1	172.9	158.9	0	0	112.5	K238 Y240 R246	K238-E242 WeakPolarHBondContact O-CB 3.43Å; K238-E242 PolarHBondContact O-N 3.45Å; K238-E242 VanDerWaalsContact O-N 3.13Å; Y240-E242 VanDerWaalsContact C-N 3.28Å; Y240-E242 PolarHBondContact O-N 2.83Å; E242-R246 WeakPolarHBondContact O-CG 3.26Å; E242-R246 PolarHBondContact O-N 3.44Å; E242-R246 IonicContact OE1-CZ 2.66Å; E242-R246 IonicContact OE1-NH2 3.17Å; E242-R246 PolarHBondContact OE1-NH2 2.95Å
243	R	85.9	Confident	87.1	Confident	159 Å²	159	98.6 Å²	98.6	60%	0.6	45%	0.449	S	S	*	.	H	α-helix	trans	-65.2	-52.2	172	-74.4	-176.1	-177.3	-179.7	3.9	112.3	E239 Y240 R245 R246 E247	E239-R243 PolarHBondContact O-N 2.88Å; E239-R243 VanDerWaalsContact O-N 3.17Å; Y240-R243 PolarHBondContact O-N 3Å; R243-R245 PolarHBondContact O-N 3.49Å; R243-R246 WeakPolarHBondContact O-CB 3.39Å; R243-R246 PolarHBondContact O-N 3.41Å; R243-E247 PolarHBondContact O-N 3.04Å; R243-E247 VanDerWaalsContact O-N 3.13Å
244	F	87.6	Confident	87.1	Confident	42 Å²	42	102.8 Å²	102.8	18%	0.184	47%	0.469	C	S	.	.	H	α-helix	trans	-62.9	-28.8	180	-70.5	-54.7	0	0	0	112.9	Y240 E247 G248 N249 E252 I253 I256	Y240-F244 HydrophobicContact CD1-CE2 4.19Å; Y240-F244 WeakPolarHBondContact O-CD2 3.43Å; Y240-F244 PolarHBondContact O-N 3.43Å; F244-E247 PolarHBondContact O-N 3.11Å; F244-G248 PolarHBondContact O-N 3.42Å; F244-G248 VanDerWaalsContact O-N 3.1Å; F244-N249 HydrophobicContact CB-CB 4.48Å; F244-N249 HydrophobicContact CD1-CB 4.19Å; F244-N249 PolarHBondContact O-N 2.87Å; F244-E252 HydrophobicContact CD1-CB 4.38Å; F244-E252 HydrophobicContact CD1-CG 4.5Å; F244-E252 HydrophobicContact CD2-CB 4.29Å; F244-E252 HydrophobicContact CD2-CG 4.05Å; F244-E252 HydrophobicContact CE1-CG 4.21Å; F244-E252 HydrophobicContact CE2-CB 4.43Å; F244-E252 HydrophobicContact CE2-CG 3.73Å; F244-E252 HydrophobicContact CG-CB 4.27Å; F244-E252 HydrophobicContact CG-CG 4.43Å; F244-E252 HydrophobicContact CZ-CG 3.81Å; F244-I253 HydrophobicContact CB-CD1 4.17Å; F244-I253 HydrophobicContact CB-CG1 3.87Å; F244-I256 HydrophobicContact CD2-CD1 4.4Å; F244-I256 HydrophobicContact CE2-CD1 4.33Å
245	R	87.6	Confident	87.2	Confident	178 Å²	178	106.9 Å²	106.9	67%	0.672	48%	0.481	S	S	*	.	H	α-helix	trans	-66.1	-38.3	173	-172.1	-178.3	-67	172.2	-1.2	112	I241 R243 E247 G248 I253	I241-R245 VanDerWaalsContact O-CB 3.22Å; I241-R245 WeakPolarHBondContact O-CB 3.39Å; I241-R245 PolarHBondContact O-N 3.08Å; R243-R245 PolarHBondContact O-N 3.49Å; R245-E247 VanDerWaalsContact C-N 3.32Å; R245-G248 PolarHBondContact O-N 3.49Å; R245-I253 HydrophobicContact CB-CD1 4.15Å
246	R	87.3	Confident	87.3	Confident	197 Å²	197	102.7 Å²	102.7	74%	0.743	46%	0.462	S	S	*	.	H	α-helix	trans	-70.6	-30	175.6	-66.2	175.7	-168.7	-167.8	4.8	112.2	E242 R243	E242-R246 WeakPolarHBondContact O-CG 3.26Å; E242-R246 PolarHBondContact O-N 3.44Å; E242-R246 IonicContact OE1-CZ 2.66Å; E242-R246 IonicContact OE1-NH2 3.17Å; E242-R246 PolarHBondContact OE1-NH2 2.95Å; R243-R246 WeakPolarHBondContact O-CB 3.39Å; R243-R246 PolarHBondContact O-N 3.41Å
247	E	86.9	Confident	87.4	Confident	135 Å²	135	102.7 Å²	102.7	63%	0.631	46%	0.464	S	S	*	.	H	α-helix	trans	-84.3	-7.3	178.5	-65.7	172.4	-166.8	0	0	113.7	R243 F244 R245 N249	R243-E247 PolarHBondContact O-N 3.04Å; R243-E247 VanDerWaalsContact O-N 3.13Å; F244-E247 PolarHBondContact O-N 3.11Å; R245-E247 VanDerWaalsContact C-N 3.32Å; E247-N249 VanDerWaalsContact C-N 3.3Å; E247-N249 PolarHBondContact O-N 3.28Å
248	G	85.3	Confident	87.7	Confident	60 Å²	60	107.8 Å²	107.8	62%	0.619	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	17.8	-177.8	0	0	0	0	0	114.6	F244 R245 E250	F244-G248 PolarHBondContact O-N 3.42Å; F244-G248 VanDerWaalsContact O-N 3.1Å; R245-G248 PolarHBondContact O-N 3.49Å; G248-E250 PolarHBondContact O-N 2.93Å
249	N	88.7	Confident	87.9	Confident	63 Å²	63	106.1 Å²	106.1	34%	0.337	49%	0.485	S	S	.	.			trans	-92.2	68.9	-176.3	-167.6	0.7	0	0	0	112.2	F244 E247 K251 E252	F244-N249 HydrophobicContact CB-CB 4.48Å; F244-N249 HydrophobicContact CD1-CB 4.19Å; F244-N249 PolarHBondContact O-N 2.87Å; E247-N249 VanDerWaalsContact C-N 3.3Å; E247-N249 PolarHBondContact O-N 3.28Å; N249-K251 VanDerWaalsContact C-N 3.27Å; N249-K251 PolarHBondContact O-N 2.84Å; N249-E252 PolarHBondContact O-N 3.13Å
250	E	87.8	Confident	88.3	Confident	148 Å²	148	102 Å²	102	69%	0.692	46%	0.463	S	S	*	.	H	α-helix	trans	-61.4	-31.6	-176.6	-70.2	-172.3	155.6	0	0	113.9	G248 E252 I253 E254	G248-E250 PolarHBondContact O-N 2.93Å; E250-E252 PolarHBondContact O-N 2.99Å; E250-I253 WeakPolarHBondContact O-CB 3.44Å; E250-I253 PolarHBondContact O-N 2.66Å; E250-I253 VanDerWaalsContact O-N 3.14Å; E250-E254 PolarHBondContact O-N 3.14Å
251	K	90.2	Very high	88.7	Confident	153 Å²	153	100.7 Å²	100.7	67%	0.665	47%	0.465	S	S	*	.	H	α-helix	trans	-62.2	-30.5	-179.5	-68.1	-175.8	178.7	178.8	0	113.2	N249 R255	N249-K251 VanDerWaalsContact C-N 3.27Å; N249-K251 PolarHBondContact O-N 2.84Å; K251-R255 WeakPolarHBondContact O-CG 3.17Å; K251-R255 PolarHBondContact O-N 3.48Å
252	E	87.3	Confident	89.1	Confident	55 Å²	55	106 Å²	106	26%	0.257	49%	0.487	S	S	.	.	H	α-helix	trans	-76.8	-37.6	177.3	-159.7	60.6	-160.7	0	0	111.6	F244 N249 E250 E254 R255 I256	F244-E252 HydrophobicContact CD1-CB 4.38Å; F244-E252 HydrophobicContact CD1-CG 4.5Å; F244-E252 HydrophobicContact CD2-CB 4.29Å; F244-E252 HydrophobicContact CD2-CG 4.05Å; F244-E252 HydrophobicContact CE1-CG 4.21Å; F244-E252 HydrophobicContact CE2-CB 4.43Å; F244-E252 HydrophobicContact CE2-CG 3.73Å; F244-E252 HydrophobicContact CG-CB 4.27Å; F244-E252 HydrophobicContact CG-CG 4.43Å; F244-E252 HydrophobicContact CZ-CG 3.81Å; N249-E252 PolarHBondContact O-N 3.13Å; E250-E252 PolarHBondContact O-N 2.99Å; E252-E254 VanDerWaalsContact C-N 3.34Å; E252-E254 PolarHBondContact O-N 3.1Å; E252-R255 PolarHBondContact O-N 2.94Å; E252-R255 IonicContact OE2-CZ 2.62Å; E252-R255 IonicContact OE2-NE 2.94Å; E252-R255 PolarHBondContact OE2-NE 3.12Å; E252-R255 VanDerWaalsContact OE2-NE 3.1Å; E252-R255 IonicContact OE2-NH2 3.7Å; E252-R255 PolarHBondContact OE2-NH2 3.08Å; E252-I256 WeakPolarHBondContact O-CG1 3.35Å; E252-I256 PolarHBondContact O-N 3.47Å
253	I	87.6	Confident	89.5	Confident	24 Å²	24	102.5 Å²	102.5	12%	0.123	47%	0.471	C	S	.	.	H	α-helix	trans	-61.1	-45.5	174.6	-60	174.2	0	0	0	110	I241 F244 R245 E250 R255 I256 M257	I241-I253 HydrophobicContact CG1-CG2 4.41Å; I241-I253 HydrophobicContact CG2-CD1 4.34Å; I241-I253 HydrophobicContact CG2-CG1 4.38Å; I241-I253 HydrophobicContact CG2-CG2 4.09Å; F244-I253 HydrophobicContact CB-CD1 4.17Å; F244-I253 HydrophobicContact CB-CG1 3.87Å; R245-I253 HydrophobicContact CB-CD1 4.15Å; E250-I253 WeakPolarHBondContact O-CB 3.44Å; E250-I253 PolarHBondContact O-N 2.66Å; E250-I253 VanDerWaalsContact O-N 3.14Å; I253-R255 VanDerWaalsContact C-N 3.34Å; I253-R255 PolarHBondContact O-N 2.9Å; I253-I256 PolarHBondContact O-N 3.08Å; I253-M257 HydrophobicContact CG2-CG 4.47Å; I253-M257 HydrophobicContact CG2-SD 4.19Å; I253-M257 WeakPolarHBondContact O-CG 3.34Å; I253-M257 PolarHBondContact O-N 3.36Å
254	E	90.4	Very high	89.9	Confident	133 Å²	133	99.9 Å²	99.9	62%	0.621	46%	0.464	S	S	*	.	H	α-helix	trans	-58.5	-43.1	175.3	-75.6	-176.4	165.2	0	0	112.3	E250 E252 I256 M257 M258	E250-E254 PolarHBondContact O-N 3.14Å; E252-E254 VanDerWaalsContact C-N 3.34Å; E252-E254 PolarHBondContact O-N 3.1Å; E254-I256 PolarHBondContact O-N 3.3Å; E254-M257 PolarHBondContact O-N 2.97Å; E254-M258 VanDerWaalsContact O-CB 3.25Å; E254-M258 WeakPolarHBondContact O-CB 3.49Å; E254-M258 PolarHBondContact O-N 2.87Å
255	R	90.2	Very high	90.3	Very high	158 Å²	158	101.2 Å²	101.2	60%	0.596	48%	0.479	S	S	*	.	H	α-helix	trans	-62.9	-41.8	178.2	-78	-170.7	-85.4	-167.5	-0.2	112.5	K251 E252 I253 N259	K251-R255 WeakPolarHBondContact O-CG 3.17Å; K251-R255 PolarHBondContact O-N 3.48Å; E252-R255 PolarHBondContact O-N 2.94Å; E252-R255 IonicContact OE2-CZ 2.62Å; E252-R255 IonicContact OE2-NE 2.94Å; E252-R255 PolarHBondContact OE2-NE 3.12Å; E252-R255 VanDerWaalsContact OE2-NE 3.1Å; E252-R255 IonicContact OE2-NH2 3.7Å; E252-R255 PolarHBondContact OE2-NH2 3.08Å; I253-R255 VanDerWaalsContact C-N 3.34Å; I253-R255 PolarHBondContact O-N 2.9Å; R255-N259 PolarHBondContact O-N 2.64Å; R255-N259 VanDerWaalsContact O-N 3.11Å
256	I	89.8	Confident	90.6	Very high	28 Å²	28	98.9 Å²	98.9	14%	0.144	47%	0.47	C	S	.	.	H	α-helix	trans	-65.2	-45.6	177.2	-67.7	169.7	0	0	0	110.7	I241 F244 E252 I253 E254 N259 Y260	I241-I256 HydrophobicContact CD1-CG2 4.14Å; I241-I256 HydrophobicContact CG1-CD1 4.5Å; I241-I256 HydrophobicContact CG1-CG2 4.39Å; F244-I256 HydrophobicContact CD2-CD1 4.4Å; F244-I256 HydrophobicContact CE2-CD1 4.33Å; E252-I256 WeakPolarHBondContact O-CG1 3.35Å; E252-I256 PolarHBondContact O-N 3.47Å; I253-I256 PolarHBondContact O-N 3.08Å; E254-I256 PolarHBondContact O-N 3.3Å; I256-N259 PolarHBondContact O-N 3.24Å; I256-Y260 PolarHBondContact O-N 3.04Å
257	M	89.5	Confident	91	Very high	103 Å²	103	91 Å²	91	51%	0.507	44%	0.442	S	S	.	.	H	α-helix	trans	-63.8	-44.5	177.9	-72.8	-173.6	63.6	0	0	111.9	I253 E254 N259 Y260 D261	I253-M257 HydrophobicContact CG2-CG 4.47Å; I253-M257 HydrophobicContact CG2-SD 4.19Å; I253-M257 WeakPolarHBondContact O-CG 3.34Å; I253-M257 PolarHBondContact O-N 3.36Å; E254-M257 PolarHBondContact O-N 2.97Å; M257-N259 VanDerWaalsContact C-N 3.26Å; M257-N259 PolarHBondContact O-N 2.87Å; M257-Y260 WeakPolarHBondContact O-CB 3.37Å; M257-Y260 PolarHBondContact O-N 3.14Å; M257-Y260 VanDerWaalsContact O-N 3.07Å; M257-D261 PolarHBondContact O-N 3.22Å
258	M	92.8	Very high	91.4	Very high	121 Å²	121	86.1 Å²	86.1	60%	0.596	43%	0.428	S	S	*	.	H	α-helix	trans	-63.9	-32.1	179.4	-161.3	-178.4	-169.6	0	0	112.2	E254 K262	E254-M258 VanDerWaalsContact O-CB 3.25Å; E254-M258 WeakPolarHBondContact O-CB 3.49Å; E254-M258 PolarHBondContact O-N 2.87Å; M258-K262 WeakPolarHBondContact O-CG 3.39Å; M258-K262 PolarHBondContact O-N 3.42Å
259	N	92.4	Very high	92	Very high	88 Å²	88	87.4 Å²	87.4	47%	0.471	42%	0.418	S	S	.	.	H	α-helix	trans	-69	-43.8	171.8	-178.1	-94.6	0	0	0	111.9	R255 I256 M257 D261 K262 L263	R255-N259 PolarHBondContact O-N 2.64Å; R255-N259 VanDerWaalsContact O-N 3.11Å; I256-N259 PolarHBondContact O-N 3.24Å; M257-N259 VanDerWaalsContact C-N 3.26Å; M257-N259 PolarHBondContact O-N 2.87Å; N259-D261 VanDerWaalsContact C-N 3.34Å; N259-D261 PolarHBondContact O-N 2.91Å; N259-K262 WeakPolarHBondContact O-CB 3.35Å; N259-K262 PolarHBondContact O-N 3.19Å; N259-L263 PolarHBondContact O-N 3.01Å
260	Y	91.2	Very high	92.3	Very high	45 Å²	45	85 Å²	85	18%	0.176	41%	0.405	C	S	.	.	H	α-helix	trans	-62.7	-39.8	177.3	-178.3	-107.9	0	0	0	112.4	Q233 I256 M257 K262 L263 K264	Q233-Y260 HydrophobicContact CG-CD2 3.92Å; I256-Y260 PolarHBondContact O-N 3.04Å; M257-Y260 WeakPolarHBondContact O-CB 3.37Å; M257-Y260 PolarHBondContact O-N 3.14Å; M257-Y260 VanDerWaalsContact O-N 3.07Å; Y260-K262 VanDerWaalsContact C-N 3.34Å; Y260-K262 PolarHBondContact O-N 2.82Å; Y260-L263 PolarHBondContact O-N 3.46Å; Y260-K264 HydrophobicContact CD1-CD 4.26Å; Y260-K264 HydrophobicContact CE1-CD 3.69Å; Y260-K264 HydrophobicContact CE1-CG 4.31Å; Y260-K264 VanDerWaalsContact CE1-NZ 3.34Å; Y260-K264 PolarHBondContact O-N 3.48Å; Y260-K264 WeakPolarHBondContact OH-CE 3.47Å; Y260-K264 PolarHBondContact OH-NZ 3.33Å
261	D	92.8	Very high	92.8	Very high	94 Å²	94	82 Å²	82	50%	0.503	39%	0.391	S	S	.	.	H	α-helix	trans	-64.1	-39	175.6	-70.6	-22.7	0	0	0	111.8	M257 N259 K264 S265	M257-D261 PolarHBondContact O-N 3.22Å; N259-D261 VanDerWaalsContact C-N 3.34Å; N259-D261 PolarHBondContact O-N 2.91Å; D261-K264 PolarHBondContact O-N 2.81Å; D261-S265 WeakPolarHBondContact O-CB 3.38Å; D261-S265 PolarHBondContact O-N 3.1Å
262	K	94.6	Very high	93.1	Very high	140 Å²	140	79 Å²	79	61%	0.609	38%	0.382	S	S	*	.	H	α-helix	trans	-64.1	-41.7	173.2	-73.1	179	-174.1	-176.2	0	112	M258 N259 Y260 S265 R266	M258-K262 WeakPolarHBondContact O-CG 3.39Å; M258-K262 PolarHBondContact O-N 3.42Å; N259-K262 WeakPolarHBondContact O-CB 3.35Å; N259-K262 PolarHBondContact O-N 3.19Å; Y260-K262 VanDerWaalsContact C-N 3.34Å; Y260-K262 PolarHBondContact O-N 2.82Å; K262-S265 PolarHBondContact O-N 2.73Å; K262-R266 WeakPolarHBondContact O-CB 3.49Å; K262-R266 PolarHBondContact O-N 3.42Å
263	L	93.9	Very high	93.6	Very high	28 Å²	28	78.2 Å²	78.2	15%	0.147	38%	0.383	C	S	.	.	H	α-helix	trans	-62.9	-45.7	177.1	-177.6	64.1	0	0	0	111	F226 Q229 C230 N259 Y260 R266 L267	F226-L263 HydrophobicContact CD1-CD1 3.72Å; F226-L263 HydrophobicContact CE1-CD1 4.03Å; Q229-L263 HydrophobicContact CB-CD2 4.4Å; Q229-L263 HydrophobicContact CG-CD1 4.44Å; Q229-L263 HydrophobicContact CG-CD2 4.03Å; C230-L263 HydrophobicContact CB-CD2 4.42Å; N259-L263 PolarHBondContact O-N 3.01Å; Y260-L263 PolarHBondContact O-N 3.46Å; L263-R266 PolarHBondContact O-N 3.25Å; L263-L267 PolarHBondContact O-N 2.95Å
264	K	93.6	Very high	94.1	Very high	104 Å²	104	78.7 Å²	78.7	45%	0.452	38%	0.384	S	S	.	.	H	α-helix	trans	-62.2	-43.9	174.8	-85.8	-169.4	167	171.4	0	113.1	Y260 D261 R266 L267 G268	Y260-K264 HydrophobicContact CD1-CD 4.26Å; Y260-K264 HydrophobicContact CE1-CD 3.69Å; Y260-K264 HydrophobicContact CE1-CG 4.31Å; Y260-K264 VanDerWaalsContact CE1-NZ 3.34Å; Y260-K264 PolarHBondContact O-N 3.48Å; Y260-K264 WeakPolarHBondContact OH-CE 3.47Å; Y260-K264 PolarHBondContact OH-NZ 3.33Å; D261-K264 PolarHBondContact O-N 2.81Å; K264-R266 VanDerWaalsContact C-N 3.29Å; K264-R266 PolarHBondContact O-N 2.99Å; K264-L267 PolarHBondContact O-N 3.49Å; K264-G268 PolarHBondContact O-N 3.49Å
265	S	96.1	Very high	94.4	Very high	71 Å²	71	75.8 Å²	75.8	50%	0.497	37%	0.371	S	S	.	.	H	α-helix	trans	-58.7	-44.5	175.8	-170.6	0	0	0	0	110.7	D261 K262 G268 E269	D261-S265 WeakPolarHBondContact O-CB 3.38Å; D261-S265 PolarHBondContact O-N 3.1Å; K262-S265 PolarHBondContact O-N 2.73Å; S265-G268 PolarHBondContact O-N 2.9Å; S265-E269 PolarHBondContact O-N 3.46Å; S265-E269 VanDerWaalsContact O-N 3.09Å
266	R	95.2	Very high	94.8	Very high	129 Å²	129	74.5 Å²	74.5	49%	0.487	37%	0.367	S	S	.	.	H	α-helix	trans	-65.3	-41.1	179	-175.4	55.6	178.3	171.9	2	112.5	F226 K262 L263 K264 G268 E269 I270	F226-R266 HydrophobicContact CE1-CB 4.34Å; F226-R266 HydrophobicContact CE1-CG 3.71Å; F226-R266 HydrophobicContact CZ-CG 4.22Å; K262-R266 WeakPolarHBondContact O-CB 3.49Å; K262-R266 PolarHBondContact O-N 3.42Å; L263-R266 PolarHBondContact O-N 3.25Å; K264-R266 VanDerWaalsContact C-N 3.29Å; K264-R266 PolarHBondContact O-N 2.99Å; R266-G268 VanDerWaalsContact C-N 3.31Å; R266-G268 PolarHBondContact O-N 2.94Å; R266-E269 WeakPolarHBondContact CD-OE2 3.4Å; R266-E269 IonicContact CZ-OE2 3.29Å; R266-E269 IonicContact NH1-OE2 3.91Å; R266-E269 PolarHBondContact NH1-OE2 3.46Å; R266-E269 PolarHBondContact O-N 3.47Å; R266-I270 HydrophobicContact CG-CD1 4.27Å; R266-I270 WeakPolarHBondContact O-CG1 3.32Å; R266-I270 PolarHBondContact O-N 3.23Å; R266-I270 VanDerWaalsContact O-N 3.16Å
267	L	95.1	Very high	95.1	Very high	31 Å²	31	74.7 Å²	74.7	16%	0.162	37%	0.368	C	S	.	.	H	α-helix	trans	-60.3	-41.8	174.5	177.6	58.1	0	0	0	111.4	I223 F226 E227 L263 K264 E269 I270 H271	I223-L267 HydrophobicContact CG1-CD1 4.47Å; I223-L267 HydrophobicContact CG2-CD1 4.14Å; F226-L267 HydrophobicContact CB-CD1 3.81Å; E227-L267 HydrophobicContact CG-CD1 4.42Å; E227-L267 HydrophobicContact CG-CD2 4.08Å; L263-L267 PolarHBondContact O-N 2.95Å; K264-L267 PolarHBondContact O-N 3.49Å; L267-E269 PolarHBondContact O-N 3.16Å; L267-I270 PolarHBondContact O-N 3.35Å; L267-H271 PolarHBondContact O-N 2.92Å
268	G	95.3	Very high	95.5	Very high	32 Å²	32	72.8 Å²	72.8	33%	0.33	36%	0.358	S	S	.	.	H	α-helix	trans	-58.2	-46	174.3	0	0	0	0	0	113.1	K264 S265 R266 I270 H271 D272	K264-G268 PolarHBondContact O-N 3.49Å; S265-G268 PolarHBondContact O-N 2.9Å; R266-G268 VanDerWaalsContact C-N 3.31Å; R266-G268 PolarHBondContact O-N 2.94Å; G268-I270 VanDerWaalsContact C-N 3.32Å; G268-I270 PolarHBondContact O-N 3.49Å; G268-H271 WeakPolarHBondContact O-CB 3.42Å; G268-H271 PolarHBondContact O-N 3.39Å; G268-D272 PolarHBondContact O-N 3.24Å
269	E	96.9	Very high	95.8	Very high	88 Å²	88	72.9 Å²	72.9	41%	0.411	36%	0.357	S	S	.	.	H	α-helix	trans	-61.6	-37.6	177.4	-69.5	169.5	-166.5	0	0	113.3	S265 R266 L267 S273	S265-E269 PolarHBondContact O-N 3.46Å; S265-E269 VanDerWaalsContact O-N 3.09Å; R266-E269 WeakPolarHBondContact CD-OE2 3.4Å; R266-E269 IonicContact CZ-OE2 3.29Å; R266-E269 IonicContact NH1-OE2 3.91Å; R266-E269 PolarHBondContact NH1-OE2 3.46Å; R266-E269 PolarHBondContact O-N 3.47Å; L267-E269 PolarHBondContact O-N 3.16Å; E269-S273 WeakPolarHBondContact O-CB 3.13Å; E269-S273 PolarHBondContact O-N 3.2Å; E269-S273 PolarHBondContact O-OG 2.86Å
270	I	96.1	Very high	96	Very high	12 Å²	12	72.8 Å²	72.8	6%	0.062	36%	0.356	C	S	.	.	H	α-helix	trans	-68.4	-44.2	177.1	-64.6	168.2	0	0	0	109.6	F219 T222 I223 F226 R266 L267 G268 D272 S273 K274	F219-I270 HydrophobicContact CD1-CG2 3.99Å; F219-I270 HydrophobicContact CE1-CG2 4.48Å; T222-I270 HydrophobicContact CG2-CD1 4.28Å; T222-I270 HydrophobicContact CG2-CG2 4.49Å; I223-I270 HydrophobicContact CD1-CG2 4.26Å; I223-I270 HydrophobicContact CG1-CG2 3.64Å; F226-I270 HydrophobicContact CD1-CD1 4.3Å; F226-I270 HydrophobicContact CD2-CD1 3.98Å; F226-I270 HydrophobicContact CE1-CD1 4.12Å; F226-I270 HydrophobicContact CE2-CD1 3.77Å; F226-I270 HydrophobicContact CG-CD1 4.24Å; F226-I270 HydrophobicContact CZ-CD1 3.85Å; R266-I270 HydrophobicContact CG-CD1 4.27Å; R266-I270 WeakPolarHBondContact O-CG1 3.32Å; R266-I270 PolarHBondContact O-N 3.23Å; R266-I270 VanDerWaalsContact O-N 3.16Å; L267-I270 PolarHBondContact O-N 3.35Å; G268-I270 VanDerWaalsContact C-N 3.32Å; G268-I270 PolarHBondContact O-N 3.49Å; I270-D272 VanDerWaalsContact C-N 3.35Å; I270-D272 PolarHBondContact O-N 3.11Å; I270-S273 PolarHBondContact O-N 2.98Å; I270-K274 PolarHBondContact O-N 3Å
271	H	97.5	Very high	96.3	Very high	85 Å²	85	72 Å²	72	39%	0.394	36%	0.355	S	S	.	.	H	α-helix	trans	-59.9	-44.7	176.2	-167.9	-77.1	0	0	0	111.5	L267 G268 S273 K274 M275	L267-H271 PolarHBondContact O-N 2.92Å; G268-H271 WeakPolarHBondContact O-CB 3.42Å; G268-H271 PolarHBondContact O-N 3.39Å; H271-S273 VanDerWaalsContact C-N 3.32Å; H271-S273 PolarHBondContact O-N 3.43Å; H271-K274 PolarHBondContact O-N 3.04Å; H271-M275 VanDerWaalsContact O-CG 3.32Å; H271-M275 WeakPolarHBondContact O-CG 3.39Å; H271-M275 PolarHBondContact O-N 3.37Å
272	D	97.1	Very high	96.5	Very high	89 Å²	89	74.7 Å²	74.7	48%	0.476	36%	0.362	S	S	.	.	H	α-helix	trans	-64.6	-37.2	176.8	-73	-15.5	0	0	0	112.3	G268 I270 M275 R276	G268-D272 PolarHBondContact O-N 3.24Å; I270-D272 VanDerWaalsContact C-N 3.35Å; I270-D272 PolarHBondContact O-N 3.11Å; D272-M275 PolarHBondContact O-N 2.78Å; D272-R276 WeakPolarHBondContact O-CG 3.36Å; D272-R276 PolarHBondContact O-N 2.81Å
273	S	97.3	Very high	96.6	Very high	40 Å²	40	74.5 Å²	74.5	28%	0.28	36%	0.361	S	S	.	.	H	α-helix	trans	-66.3	-42.1	176.1	-59.9	0	0	0	0	112	E269 I270 H271 R276 L277	E269-S273 WeakPolarHBondContact O-CB 3.13Å; E269-S273 PolarHBondContact O-N 3.2Å; E269-S273 PolarHBondContact O-OG 2.86Å; I270-S273 PolarHBondContact O-N 2.98Å; H271-S273 VanDerWaalsContact C-N 3.32Å; H271-S273 PolarHBondContact O-N 3.43Å; S273-R276 PolarHBondContact O-N 2.92Å; S273-R276 PolarHBondContact OG-NH2 3.33Å; S273-L277 PolarHBondContact O-N 3.38Å; S273-L277 VanDerWaalsContact O-N 3.14Å
274	K	97.5	Very high	96.7	Very high	33 Å²	33	74.1 Å²	74.1	14%	0.143	36%	0.358	C	S	.	.	H	α-helix	trans	-60.3	-48.9	172	176	-169.1	157	-175.7	0	110.9	F219 N220 I223 I270 H271 R276 L277 E278	F219-K274 HydrophobicContact CB-CB 4.08Å; F219-K274 HydrophobicContact CB-CD 4.44Å; F219-K274 HydrophobicContact CB-CG 4.13Å; F219-K274 HydrophobicContact CG-CB 4.19Å; N220-K274 WeakPolarHBondContact OD1-CD 3.35Å; N220-K274 WeakPolarHBondContact OD1-CE 3.23Å; N220-K274 PolarHBondContact OD1-NZ 3.45Å; I223-K274 HydrophobicContact CD1-CB 4.3Å; I223-K274 HydrophobicContact CD1-CD 3.55Å; I270-K274 PolarHBondContact O-N 3Å; H271-K274 PolarHBondContact O-N 3.04Å; K274-R276 VanDerWaalsContact C-N 3.3Å; K274-R276 PolarHBondContact O-N 2.66Å; K274-L277 PolarHBondContact O-N 3.21Å; K274-E278 WeakPolarHBondContact CE-OE1 3.42Å; K274-E278 HydrophobicContact CG-CG 4.38Å; K274-E278 IonicContact NZ-OE1 2.58Å; K274-E278 WeakPolarHBondContact O-CG 3.16Å; K274-E278 PolarHBondContact O-N 3.49Å
275	M	97.8	Very high	96.9	Very high	73 Å²	73	70.6 Å²	70.6	36%	0.36	35%	0.349	S	S	.	.	H	α-helix	trans	-58.6	-40.3	-179.5	-76.5	-65.5	-59.9	0	0	112.3	H271 D272 E278 Q279	H271-M275 VanDerWaalsContact O-CG 3.32Å; H271-M275 WeakPolarHBondContact O-CG 3.39Å; H271-M275 PolarHBondContact O-N 3.37Å; D272-M275 PolarHBondContact O-N 2.78Å; M275-E278 PolarHBondContact O-N 2.6Å; M275-Q279 WeakPolarHBondContact O-CG 3.37Å; M275-Q279 PolarHBondContact O-N 3.29Å
276	R	97.8	Very high	96.9	Very high	131 Å²	131	71.4 Å²	71.4	49%	0.494	35%	0.347	S	S	.	.	H	α-helix	trans	-62.1	-45.9	173.3	-75.1	-173.9	-68.2	-89.7	1.8	111.8	D272 S273 K274 E278 Q279 D280	D272-R276 WeakPolarHBondContact O-CG 3.36Å; D272-R276 PolarHBondContact O-N 2.81Å; S273-R276 PolarHBondContact O-N 2.92Å; S273-R276 PolarHBondContact OG-NH2 3.33Å; K274-R276 VanDerWaalsContact C-N 3.3Å; K274-R276 PolarHBondContact O-N 2.66Å; R276-E278 VanDerWaalsContact C-N 3.32Å; R276-E278 PolarHBondContact O-N 2.95Å; R276-Q279 PolarHBondContact O-N 2.84Å; R276-D280 PolarHBondContact O-N 3.13Å
277	L	97.6	Very high	96.8	Very high	32 Å²	32	68.6 Å²	68.6	17%	0.168	34%	0.342	C	S	.	.	H	α-helix	trans	-64.7	-36.5	179.2	-172.1	61.8	0	0	0	112.5	K212 A215 I216 F219 S273 K274 D280 L281	K212-L277 HydrophobicContact CB-CD1 4.4Å; K212-L277 HydrophobicContact CD-CD1 4.21Å; K212-L277 HydrophobicContact CG-CD1 3.96Å; A215-L277 HydrophobicContact CB-CD2 3.77Å; I216-L277 HydrophobicContact CD1-CG 4.29Å; I216-L277 HydrophobicContact CG1-CB 4.42Å; I216-L277 HydrophobicContact CG1-CD2 3.78Å; I216-L277 HydrophobicContact CG1-CG 3.94Å; F219-L277 HydrophobicContact CD2-CD2 3.87Å; F219-L277 HydrophobicContact CE2-CD2 3.68Å; S273-L277 PolarHBondContact O-N 3.38Å; S273-L277 VanDerWaalsContact O-N 3.14Å; K274-L277 PolarHBondContact O-N 3.21Å; L277-D280 PolarHBondContact O-N 3.39Å; L277-L281 WeakPolarHBondContact O-CB 3.44Å; L277-L281 PolarHBondContact O-N 3.23Å
278	E	97.6	Very high	96.9	Very high	63 Å²	63	67.8 Å²	67.8	29%	0.294	34%	0.338	S	S	.	.	H	α-helix	trans	-65.1	-40	174.1	-75.2	-179.9	160.2	0	0	112.3	I216 K274 M275 R276 L281 K282	I216-E278 HydrophobicContact CD1-CG 3.81Å; I216-E278 HydrophobicContact CG1-CG 4.13Å; I216-E278 HydrophobicContact CG2-CG 4.24Å; K274-E278 WeakPolarHBondContact CE-OE1 3.42Å; K274-E278 HydrophobicContact CG-CG 4.38Å; K274-E278 IonicContact NZ-OE1 2.58Å; K274-E278 WeakPolarHBondContact O-CG 3.16Å; K274-E278 PolarHBondContact O-N 3.49Å; M275-E278 PolarHBondContact O-N 2.6Å; R276-E278 VanDerWaalsContact C-N 3.32Å; R276-E278 PolarHBondContact O-N 2.95Å; E278-L281 PolarHBondContact O-N 3.13Å; E278-K282 WeakPolarHBondContact O-CB 3.43Å; E278-K282 PolarHBondContact O-N 3.4Å
279	Q	97.7	Very high	96.9	Very high	123 Å²	123	74.5 Å²	74.5	58%	0.575	35%	0.353	S	S	*	.	H	α-helix	trans	-63.6	-44.3	174.1	-72.1	174.3	2.8	0	0	111.4	M275 R276 K282 K283	M275-Q279 WeakPolarHBondContact O-CG 3.37Å; M275-Q279 PolarHBondContact O-N 3.29Å; R276-Q279 PolarHBondContact O-N 2.84Å; Q279-K282 PolarHBondContact O-N 3.05Å; Q279-K283 PolarHBondContact O-N 3.34Å
280	D	97.1	Very high	96.9	Very high	85 Å²	85	75.5 Å²	75.5	46%	0.455	36%	0.358	S	S	.	.	H	α-helix	trans	-63.8	-41.7	176.6	-75.3	-11.8	0	0	0	112.1	R276 L277 K282 K283 Q284	R276-D280 PolarHBondContact O-N 3.13Å; L277-D280 PolarHBondContact O-N 3.39Å; D280-K282 VanDerWaalsContact C-N 3.33Å; D280-K282 PolarHBondContact O-N 3.27Å; D280-K283 PolarHBondContact O-N 2.63Å; D280-Q284 WeakPolarHBondContact O-CB 3.35Å; D280-Q284 PolarHBondContact O-N 2.76Å
281	L	97.7	Very high	96.8	Very high	30 Å²	30	75.5 Å²	75.5	16%	0.157	36%	0.358	C	S	.	.	H	α-helix	trans	-59.7	-45.2	174.3	174.3	64.6	0	0	0	110.7	I209 K212 R213 I216 L277 E278 Q284 A285	I209-L281 HydrophobicContact CB-CD1 4.24Å; I209-L281 HydrophobicContact CG1-CD1 4.33Å; I209-L281 HydrophobicContact CG2-CD1 3.81Å; K212-L281 HydrophobicContact CB-CB 4.47Å; K212-L281 HydrophobicContact CB-CD1 4.02Å; R213-L281 HydrophobicContact CG-CD1 4.16Å; R213-L281 HydrophobicContact CG-CD2 3.87Å; I216-L281 HydrophobicContact CD1-CB 4.15Å; I216-L281 HydrophobicContact CD1-CD2 3.47Å; I216-L281 VanDerWaalsContact CD1-CD2 3.47Å; I216-L281 HydrophobicContact CD1-CG 4.41Å; L277-L281 WeakPolarHBondContact O-CB 3.44Å; L277-L281 PolarHBondContact O-N 3.23Å; E278-L281 PolarHBondContact O-N 3.13Å; L281-Q284 PolarHBondContact O-N 3.45Å; L281-A285 VanDerWaalsContact O-CB 3.25Å; L281-A285 WeakPolarHBondContact O-CB 3.41Å; L281-A285 PolarHBondContact O-N 3.16Å
282	K	97	Very high	96.8	Very high	150 Å²	150	74.2 Å²	74.2	65%	0.652	35%	0.354	S	S	*	.	H	α-helix	trans	-63.8	-43.8	179.8	-173	177.4	-178.9	179.8	0	111.5	E278 Q279 D280 A285 L286	E278-K282 WeakPolarHBondContact O-CB 3.43Å; E278-K282 PolarHBondContact O-N 3.4Å; Q279-K282 PolarHBondContact O-N 3.05Å; D280-K282 VanDerWaalsContact C-N 3.33Å; D280-K282 PolarHBondContact O-N 3.27Å; K282-A285 PolarHBondContact O-N 3.44Å; K282-L286 WeakPolarHBondContact O-CG 3.32Å; K282-L286 PolarHBondContact O-N 3.32Å; K282-L286 VanDerWaalsContact O-N 3.15Å
283	K	96.9	Very high	96.7	Very high	136 Å²	136	77 Å²	77	59%	0.591	36%	0.362	S	S	*	.	H	α-helix	trans	-60.8	-52.1	175.8	-177.3	-178.1	174.1	-173.1	0	110.7	Q279 D280 A285 L286 D287	Q279-K283 PolarHBondContact O-N 3.34Å; D280-K283 PolarHBondContact O-N 2.63Å; K283-A285 VanDerWaalsContact C-N 3.28Å; K283-A285 PolarHBondContact O-N 2.95Å; K283-L286 WeakPolarHBondContact O-CB 3.38Å; K283-L286 PolarHBondContact O-N 3.42Å; K283-D287 PolarHBondContact O-N 3.47Å
284	Q	96.5	Very high	96.6	Very high	19 Å²	19	80.5 Å²	80.5	9%	0.089	37%	0.372	C	S	.	.	H	α-helix	trans	-62.8	-35.3	-178.7	-168.9	169.4	18.9	0	0	112.8	T205 E208 I209 K212 D280 L281 L286 D287 N288	T205-Q284 HydrophobicContact CG2-CG 3.53Å; E208-Q284 PolarHBondContact OE2-NE2 3.42Å; I209-Q284 HydrophobicContact CD1-CG 4.29Å; I209-Q284 HydrophobicContact CG1-CB 4.35Å; I209-Q284 HydrophobicContact CG1-CG 3.91Å; K212-Q284 VanDerWaalsContact CE-OE1 3.29Å; D280-Q284 WeakPolarHBondContact O-CB 3.35Å; D280-Q284 PolarHBondContact O-N 2.76Å; L281-Q284 PolarHBondContact O-N 3.45Å; Q284-L286 VanDerWaalsContact C-N 3.32Å; Q284-L286 PolarHBondContact O-N 3.48Å; Q284-D287 PolarHBondContact O-N 3.38Å; Q284-N288 WeakPolarHBondContact O-CB 3.39Å; Q284-N288 PolarHBondContact O-N 3.02Å
285	A	96.6	Very high	96.6	Very high	30 Å²	30	79.2 Å²	79.2	25%	0.248	37%	0.367	C	S	.	.	H	α-helix	trans	-66.9	-31.4	174.4	0	0	0	0	0	113.1	I209 L281 K282 K283 R289	I209-A285 HydrophobicContact CD1-CB 4.34Å; L281-A285 VanDerWaalsContact O-CB 3.25Å; L281-A285 WeakPolarHBondContact O-CB 3.41Å; L281-A285 PolarHBondContact O-N 3.16Å; K282-A285 PolarHBondContact O-N 3.44Å; K283-A285 VanDerWaalsContact C-N 3.28Å; K283-A285 PolarHBondContact O-N 2.95Å; A285-R289 WeakPolarHBondContact O-CG 3.5Å; A285-R289 PolarHBondContact O-N 2.94Å
286	L	96.2	Very high	96.4	Very high	88 Å²	88	79.1 Å²	79.1	46%	0.461	37%	0.367	S	S	.	.	H	α-helix	trans	-70.5	-48.3	172.7	-69.9	169.3	0	0	0	110.6	K282 K283 Q284 N288 R289 E290	K282-L286 WeakPolarHBondContact O-CG 3.32Å; K282-L286 PolarHBondContact O-N 3.32Å; K282-L286 VanDerWaalsContact O-N 3.15Å; K283-L286 WeakPolarHBondContact O-CB 3.38Å; K283-L286 PolarHBondContact O-N 3.42Å; Q284-L286 VanDerWaalsContact C-N 3.32Å; Q284-L286 PolarHBondContact O-N 3.48Å; L286-N288 VanDerWaalsContact C-N 3.27Å; L286-N288 PolarHBondContact O-N 2.98Å; L286-R289 WeakPolarHBondContact O-CB 3.41Å; L286-R289 PolarHBondContact O-N 3.33Å; L286-E290 PolarHBondContact O-N 3.43Å
287	D	94.1	Very high	96.3	Very high	70 Å²	70	76.1 Å²	76.1	37%	0.374	37%	0.367	S	S	.	.	H	α-helix	trans	-57.7	-42.3	177.9	-60.8	-17.9	0	0	0	110.7	K283 Q284 R289 E290 I291	K283-D287 PolarHBondContact O-N 3.47Å; Q284-D287 PolarHBondContact O-N 3.38Å; D287-R289 VanDerWaalsContact C-N 3.32Å; D287-R289 PolarHBondContact O-N 2.88Å; D287-E290 WeakPolarHBondContact O-CB 3.39Å; D287-E290 PolarHBondContact O-N 3.43Å; D287-I291 WeakPolarHBondContact O-CG1 3.36Å; D287-I291 PolarHBondContact O-N 2.84Å
288	N	96.4	Very high	96	Very high	15 Å²	15	75.2 Å²	75.2	8%	0.08	36%	0.362	C	S	.	.	H	α-helix	trans	-64.1	-34.5	177.2	-158.6	45.8	0	0	0	113.3	Y202 T205 I209 Q284 L286 E290 I291 D292	Y202-N288 VanDerWaalsContact CD2-OD1 3.23Å; Y202-N288 WeakPolarHBondContact CD2-OD1 3.47Å; Y202-N288 WeakPolarHBondContact CE2-ND2 3.39Å; Y202-N288 PolarHBondContact O-OD1 2.8Å; T205-N288 HydrophobicContact CG2-CB 3.73Å; I209-N288 HydrophobicContact CD1-CB 3.79Å; Q284-N288 WeakPolarHBondContact O-CB 3.39Å; Q284-N288 PolarHBondContact O-N 3.02Å; L286-N288 VanDerWaalsContact C-N 3.27Å; L286-N288 PolarHBondContact O-N 2.98Å; N288-E290 VanDerWaalsContact C-N 3.33Å; N288-I291 PolarHBondContact O-N 2.86Å; N288-D292 PolarHBondContact O-N 3.5Å; N288-D292 VanDerWaalsContact O-N 3.13Å
289	R	95.9	Very high	95.7	Very high	172 Å²	172	74.8 Å²	74.8	65%	0.649	36%	0.359	S	S	*	.	H	α-helix	trans	-69.9	-30.9	173.3	-75.9	174.9	176.2	175.3	-0.2	112	A285 L286 D287 K293	A285-R289 WeakPolarHBondContact O-CG 3.5Å; A285-R289 PolarHBondContact O-N 2.94Å; L286-R289 WeakPolarHBondContact O-CB 3.41Å; L286-R289 PolarHBondContact O-N 3.33Å; D287-R289 VanDerWaalsContact C-N 3.32Å; D287-R289 PolarHBondContact O-N 2.88Å; R289-K293 WeakPolarHBondContact O-CG 3.36Å; R289-K293 PolarHBondContact O-N 3.45Å; R289-K293 VanDerWaalsContact O-N 3.11Å
290	E	96.1	Very high	95.4	Very high	109 Å²	109	72.2 Å²	72.2	51%	0.509	35%	0.353	S	S	.	.	H	α-helix	trans	-69.9	-39.3	174.1	-66.9	-170.6	172.1	0	0	111.8	L286 D287 N288 K293 K294	L286-E290 PolarHBondContact O-N 3.43Å; D287-E290 WeakPolarHBondContact O-CB 3.39Å; D287-E290 PolarHBondContact O-N 3.43Å; N288-E290 VanDerWaalsContact C-N 3.33Å; E290-K293 PolarHBondContact O-N 2.92Å; E290-K294 WeakPolarHBondContact O-CG 3.23Å; E290-K294 PolarHBondContact O-N 3.48Å
291	I	95.5	Very high	95.2	Very high	12 Å²	12	71.2 Å²	71.2	6%	0.062	35%	0.347	C	S	.	.	H	α-helix	trans	-59.5	-47.4	173.3	-64.2	164.7	0	0	0	110.4	L198 E201 Y202 D287 N288 K293 K294 M295	L198-I291 HydrophobicContact CB-CG2 4.27Å; L198-I291 HydrophobicContact CD2-CG2 4.26Å; L198-I291 WeakPolarHBondContact O-CG2 3.25Å; E201-I291 HydrophobicContact CB-CD1 4.49Å; E201-I291 HydrophobicContact CG-CD1 3.69Å; Y202-I291 HydrophobicContact CD2-CG2 4.44Å; D287-I291 WeakPolarHBondContact O-CG1 3.36Å; D287-I291 PolarHBondContact O-N 2.84Å; N288-I291 PolarHBondContact O-N 2.86Å; I291-K293 VanDerWaalsContact C-N 3.34Å; I291-K293 PolarHBondContact O-N 3.48Å; I291-K294 WeakPolarHBondContact O-CB 3.31Å; I291-K294 PolarHBondContact O-N 2.93Å; I291-K294 VanDerWaalsContact O-N 3.12Å; I291-M295 HydrophobicContact CG2-CG 4.43Å; I291-M295 HydrophobicContact CG2-SD 4.04Å; I291-M295 WeakPolarHBondContact O-CG 3.49Å; I291-M295 PolarHBondContact O-N 3.42Å
292	D	95.6	Very high	94.9	Very high	58 Å²	58	71.1 Å²	71.1	31%	0.31	35%	0.347	S	S	.	.	H	α-helix	trans	-59.4	-42	177	179	46.7	0	0	0	112.2	Y202 N288 K294 M295 N296	Y202-D292 HydrophobicContact CD2-CB 4.46Å; Y202-D292 HydrophobicContact CE2-CB 4.13Å; N288-D292 PolarHBondContact O-N 3.5Å; N288-D292 VanDerWaalsContact O-N 3.13Å; D292-K294 PolarHBondContact O-N 3.26Å; D292-M295 PolarHBondContact O-N 2.95Å; D292-N296 VanDerWaalsContact CG-ND2 3.34Å; D292-N296 WeakPolarHBondContact O-CB 3.26Å; D292-N296 VanDerWaalsContact O-CG 3.26Å; D292-N296 PolarHBondContact O-N 3.43Å; D292-N296 PolarHBondContact O-ND2 3.38Å; D292-N296 PolarHBondContact OD1-ND2 3.24Å; D292-N296 PolarHBondContact OD2-ND2 3.17Å
293	K	96	Very high	94.4	Very high	148 Å²	148	69.6 Å²	69.6	64%	0.643	35%	0.345	S	S	*	.	H	α-helix	trans	-60.1	-44	173.6	-74.3	175	-177.1	177.8	0	112.5	R289 E290 I291 N296 S297	R289-K293 WeakPolarHBondContact O-CG 3.36Å; R289-K293 PolarHBondContact O-N 3.45Å; R289-K293 VanDerWaalsContact O-N 3.11Å; E290-K293 PolarHBondContact O-N 2.92Å; I291-K293 VanDerWaalsContact C-N 3.34Å; I291-K293 PolarHBondContact O-N 3.48Å; K293-N296 PolarHBondContact O-N 3.03Å; K293-S297 PolarHBondContact O-N 2.79Å
294	K	95.4	Very high	93.9	Very high	113 Å²	113	68.8 Å²	68.8	49%	0.491	34%	0.343	S	S	.	.	H	α-helix	trans	-62.1	-47.6	177.2	-71.4	175.8	-175.2	173.9	0	110.7	L198 E290 I291 D292 N296 S297 I298	L198-K294 HydrophobicContact CD1-CB 4.08Å; L198-K294 HydrophobicContact CD2-CD 4.45Å; E290-K294 WeakPolarHBondContact O-CG 3.23Å; E290-K294 PolarHBondContact O-N 3.48Å; I291-K294 WeakPolarHBondContact O-CB 3.31Å; I291-K294 PolarHBondContact O-N 2.93Å; I291-K294 VanDerWaalsContact O-N 3.12Å; D292-K294 PolarHBondContact O-N 3.26Å; K294-N296 VanDerWaalsContact C-N 3.34Å; K294-N296 PolarHBondContact O-N 3.14Å; K294-S297 PolarHBondContact O-N 2.94Å; K294-S297 VanDerWaalsContact O-N 3.1Å; K294-S297 PolarHBondContact O-OG 3.1Å; K294-I298 WeakPolarHBondContact O-CG1 3.45Å; K294-I298 PolarHBondContact O-N 3.01Å; K294-I298 VanDerWaalsContact O-N 3.08Å
295	M	96.3	Very high	93.6	Very high	7 Å²	7	68.5 Å²	68.5	3%	0.034	34%	0.342	C	S	.	.	H	α-helix	trans	-56.7	-47.8	175.7	-72.7	172.9	53.6	0	0	111.8	Y195 L198 Y199 Y202 I291 D292 S297 I298 K299	Y195-M295 HydrophobicContact CD2-CB 4.43Å; Y195-M295 HydrophobicContact CD2-CG 4.48Å; Y195-M295 HydrophobicContact CE2-CB 3.98Å; Y195-M295 HydrophobicContact CE2-CE 4.01Å; Y195-M295 HydrophobicContact CE2-CG 4.26Å; L198-M295 HydrophobicContact CB-CG 3.67Å; L198-M295 HydrophobicContact CB-SD 4.29Å; L198-M295 HydrophobicContact CD1-CG 4.21Å; Y199-M295 HydrophobicContact CD2-CE 3.68Å; Y202-M295 HydrophobicContact CG-SD 4.31Å; I291-M295 HydrophobicContact CG2-CG 4.43Å; I291-M295 HydrophobicContact CG2-SD 4.04Å; I291-M295 WeakPolarHBondContact O-CG 3.49Å; I291-M295 PolarHBondContact O-N 3.42Å; D292-M295 PolarHBondContact O-N 2.95Å; M295-S297 PolarHBondContact O-N 3.38Å; M295-I298 PolarHBondContact O-N 3.49Å; M295-I298 VanDerWaalsContact O-N 3.12Å; M295-K299 WeakPolarHBondContact O-CG 3.36Å; M295-K299 PolarHBondContact O-N 3.48Å
296	N	94.1	Very high	93.2	Very high	70 Å²	70	73.6 Å²	73.6	37%	0.374	36%	0.355	S	S	.	.	H	α-helix	trans	-67.1	-23.6	180	-67.8	-35.9	0	0	0	113.1	D292 K293 K294 K299 P300	D292-N296 VanDerWaalsContact CG-ND2 3.34Å; D292-N296 WeakPolarHBondContact O-CB 3.26Å; D292-N296 VanDerWaalsContact O-CG 3.26Å; D292-N296 PolarHBondContact O-N 3.43Å; D292-N296 PolarHBondContact O-ND2 3.38Å; D292-N296 PolarHBondContact OD1-ND2 3.24Å; D292-N296 PolarHBondContact OD2-ND2 3.17Å; K293-N296 PolarHBondContact O-N 3.03Å; K294-N296 VanDerWaalsContact C-N 3.34Å; K294-N296 PolarHBondContact O-N 3.14Å; N296-K299 WeakPolarHBondContact OD1-CE 3.25Å; N296-K299 PolarHBondContact OD1-NZ 3.01Å; N296-P300 WeakPolarHBondContact O-CD 3.42Å
297	S	95.1	Very high	92.6	Very high	69 Å²	69	75.8 Å²	75.8	48%	0.483	36%	0.361	S	S	.	.	H	α-helix	trans	-76.5	-32.1	171.4	75.2	0	0	0	0	113.5	K293 K294 M295 P300	K293-S297 PolarHBondContact O-N 2.79Å; K294-S297 PolarHBondContact O-N 2.94Å; K294-S297 VanDerWaalsContact O-N 3.1Å; K294-S297 PolarHBondContact O-OG 3.1Å; M295-S297 PolarHBondContact O-N 3.38Å; S297-P300 WeakPolarHBondContact O-CD 3.24Å; S297-P300 WeakPolarHBondContact O-CG 3.31Å
298	I	93.1	Very high	92.2	Very high	13 Å²	13	74.1 Å²	74.1	7%	0.067	35%	0.352	C	S	.	.	H	α-helix	trans	-81.9	-33	-179.4	-65.7	166	0	0	0	111.7	K191 E194 L198 K294 M295 D301 L302	K191-I298 HydrophobicContact CB-CG2 4.43Å; E194-I298 HydrophobicContact CG-CD1 4.09Å; L198-I298 HydrophobicContact CD1-CD1 3.58Å; K294-I298 WeakPolarHBondContact O-CG1 3.45Å; K294-I298 PolarHBondContact O-N 3.01Å; K294-I298 VanDerWaalsContact O-N 3.08Å; M295-I298 PolarHBondContact O-N 3.49Å; M295-I298 VanDerWaalsContact O-N 3.12Å; I298-D301 WeakPolarHBondContact O-CB 3.43Å; I298-D301 PolarHBondContact O-N 3.09Å; I298-D301 VanDerWaalsContact O-N 3.13Å; I298-L302 PolarHBondContact O-N 2.94Å
299	K	91.2	Very high	91.8	Very high	54 Å²	54	75.1 Å²	75.1	24%	0.235	35%	0.354	C	S	.	.	H	α-helix	trans	-46.3	-54.3	178.7	-80.3	176.5	-172.3	169.3	0	114.5	Y195 M295 N296 D301 L302 I303	Y195-K299 HydrophobicContact CD2-CG 4.43Å; Y195-K299 HydrophobicContact CE2-CD 4.35Å; Y195-K299 HydrophobicContact CE2-CG 3.68Å; Y195-K299 WeakPolarHBondContact OH-CE 3.42Å; M295-K299 WeakPolarHBondContact O-CG 3.36Å; M295-K299 PolarHBondContact O-N 3.48Å; N296-K299 WeakPolarHBondContact OD1-CE 3.25Å; N296-K299 PolarHBondContact OD1-NZ 3.01Å; K299-D301 VanDerWaalsContact C-N 3.32Å; K299-D301 PolarHBondContact O-N 3.34Å; K299-L302 PolarHBondContact O-N 2.77Å; K299-I303 WeakPolarHBondContact O-CG1 3.29Å; K299-I303 PolarHBondContact O-N 3.23Å; K299-I303 VanDerWaalsContact O-N 3.11Å
300	P	91.8	Very high	91.2	Very high	69 Å²	69	69.4 Å²	69.4	45%	0.448	34%	0.337	S	S	.	.	H	α-helix	trans	-63	-38.8	-179.2	24.3	-34.6	0	0	0	112.4	N296 S297 L302 I303 Q304	N296-P300 WeakPolarHBondContact O-CD 3.42Å; S297-P300 WeakPolarHBondContact O-CD 3.24Å; S297-P300 WeakPolarHBondContact O-CG 3.31Å; P300-L302 VanDerWaalsContact C-N 3.34Å; P300-L302 PolarHBondContact O-N 3.35Å; P300-I303 PolarHBondContact O-N 2.82Å; P300-Q304 WeakPolarHBondContact O-CB 3.48Å; P300-Q304 PolarHBondContact O-N 2.96Å
301	D	90.9	Very high	90.6	Very high	63 Å²	63	66.2 Å²	66.2	34%	0.337	32%	0.322	S	S	.	.	H	α-helix	trans	-63.4	-41.3	177.5	-72	-7	0	0	0	111.7	K191 I298 K299 Q304 L305	K191-D301 HydrophobicContact CD-CB 4.07Å; K191-D301 VanDerWaalsContact NZ-CB 3.34Å; K191-D301 VanDerWaalsContact NZ-CG 3.34Å; K191-D301 IonicContact NZ-OD2 2.8Å; K191-D301 PolarHBondContact NZ-OD2 3.44Å; I298-D301 WeakPolarHBondContact O-CB 3.43Å; I298-D301 PolarHBondContact O-N 3.09Å; I298-D301 VanDerWaalsContact O-N 3.13Å; K299-D301 VanDerWaalsContact C-N 3.32Å; K299-D301 PolarHBondContact O-N 3.34Å; D301-Q304 PolarHBondContact O-N 2.87Å; D301-L305 WeakPolarHBondContact O-CB 3.3Å; D301-L305 WeakPolarHBondContact O-CG 3.48Å; D301-L305 PolarHBondContact O-N 3.48Å
302	L	91.6	Very high	90.1	Very high	28 Å²	28	66.2 Å²	66.2	15%	0.147	32%	0.321	C	S	.	.	H	α-helix	trans	-63.6	-43.2	178.2	-168.8	69.3	0	0	0	111.3	Y188 K191 I298 K299 P300 L305 R306	Y188-L302 HydrophobicContact CD2-CD1 3.65Å; Y188-L302 HydrophobicContact CD2-CG 4.34Å; Y188-L302 HydrophobicContact CE2-CD1 3.54Å; Y188-L302 HydrophobicContact CE2-CG 3.9Å; Y188-L302 HydrophobicContact CG-CD1 4.48Å; K191-L302 HydrophobicContact CB-CD1 4.19Å; I298-L302 PolarHBondContact O-N 2.94Å; K299-L302 PolarHBondContact O-N 2.77Å; P300-L302 VanDerWaalsContact C-N 3.34Å; P300-L302 PolarHBondContact O-N 3.35Å; L302-L305 PolarHBondContact O-N 3.35Å; L302-R306 WeakPolarHBondContact O-CB 3.41Å; L302-R306 PolarHBondContact O-N 2.81Å
303	I	86.4	Confident	89.6	Confident	119 Å²	119	65.3 Å²	65.3	61%	0.61	32%	0.316	S	S	*	.	H	α-helix	trans	-62.7	-44.8	175.6	-66	166.5	0	0	0	110.4	K299 P300 R306 K307	K299-I303 WeakPolarHBondContact O-CG1 3.29Å; K299-I303 PolarHBondContact O-N 3.23Å; K299-I303 VanDerWaalsContact O-N 3.11Å; P300-I303 PolarHBondContact O-N 2.82Å; I303-R306 PolarHBondContact O-N 3.31Å; I303-K307 WeakPolarHBondContact O-CB 3.31Å; I303-K307 PolarHBondContact O-N 3.31Å
304	Q	87.7	Confident	88.9	Confident	118 Å²	118	60.4 Å²	60.4	55%	0.551	30%	0.299	S	S	*	.	H	α-helix	trans	-64.3	-46.2	179.1	-178.6	176.2	-25.9	0	0	111.7	P300 D301 R306 K307 I308	P300-Q304 WeakPolarHBondContact O-CB 3.48Å; P300-Q304 PolarHBondContact O-N 2.96Å; D301-Q304 PolarHBondContact O-N 2.87Å; Q304-R306 PolarHBondContact O-N 3.42Å; Q304-K307 PolarHBondContact O-N 2.86Å; Q304-I308 HydrophobicContact CG-CD1 3.82Å; Q304-I308 HydrophobicContact CG-CG1 4.46Å; Q304-I308 VanDerWaalsContact O-CG1 3.32Å; Q304-I308 WeakPolarHBondContact O-CG1 3.07Å; Q304-I308 PolarHBondContact O-N 2.89Å
305	L	89.8	Confident	88.4	Confident	14 Å²	14	55.3 Å²	55.3	7%	0.073	28%	0.276	C	S	.	.	H	α-helix	trans	-61.7	-43.3	177.3	-77.2	170.2	0	0	0	111.6	Y184 Q187 Y188 K191 D301 L302 K307 I308 R309	Y184-L305 HydrophobicContact CD1-CD2 4.15Å; Q187-L305 HydrophobicContact CB-CD1 4.23Å; Q187-L305 HydrophobicContact CB-CD2 4.22Å; Y188-L305 HydrophobicContact CD2-CB 4.25Å; K191-L305 HydrophobicContact CD-CD1 3.8Å; K191-L305 HydrophobicContact CG-CD1 4.38Å; D301-L305 WeakPolarHBondContact O-CB 3.3Å; D301-L305 WeakPolarHBondContact O-CG 3.48Å; D301-L305 PolarHBondContact O-N 3.48Å; L302-L305 PolarHBondContact O-N 3.35Å; L305-K307 VanDerWaalsContact C-N 3.34Å; L305-K307 PolarHBondContact O-N 3.44Å; L305-I308 PolarHBondContact O-N 3.34Å; L305-R309 VanDerWaalsContact O-CB 3.25Å; L305-R309 WeakPolarHBondContact O-CB 3.41Å; L305-R309 PolarHBondContact O-N 2.91Å
306	R	87.4	Confident	87.8	Confident	137 Å²	137	55 Å²	55	52%	0.517	28%	0.275	S	S	.	.	H	α-helix	trans	-57.5	-48.6	173.4	-178.9	177.1	175.3	-179.1	2.1	111.1	Y188 L302 I303 Q304 I308 R309 D310	Y188-R306 HydrophobicContact CD2-CB 4.1Å; Y188-R306 HydrophobicContact CE2-CB 3.79Å; Y188-R306 HydrophobicContact CE2-CG 4.41Å; L302-R306 WeakPolarHBondContact O-CB 3.41Å; L302-R306 PolarHBondContact O-N 2.81Å; I303-R306 PolarHBondContact O-N 3.31Å; Q304-R306 PolarHBondContact O-N 3.42Å; R306-I308 PolarHBondContact O-N 3.47Å; R306-R309 PolarHBondContact O-N 3.47Å; R306-D310 WeakPolarHBondContact CG-OD2 3.37Å; R306-D310 IonicContact NE-OD2 3.79Å; R306-D310 WeakPolarHBondContact O-CB 3.44Å; R306-D310 PolarHBondContact O-N 3Å
307	K	84.8	Confident	87.1	Confident	133 Å²	133	56.3 Å²	56.3	58%	0.578	28%	0.282	S	S	*	.	H	α-helix	trans	-60.1	-45.5	179.9	-173.8	176.4	-176.5	175.1	0	112	I303 Q304 L305 Q311	I303-K307 WeakPolarHBondContact O-CB 3.31Å; I303-K307 PolarHBondContact O-N 3.31Å; Q304-K307 PolarHBondContact O-N 2.86Å; L305-K307 VanDerWaalsContact C-N 3.34Å; L305-K307 PolarHBondContact O-N 3.44Å; K307-Q311 WeakPolarHBondContact O-CB 3.4Å; K307-Q311 WeakPolarHBondContact O-CG 3.16Å; K307-Q311 PolarHBondContact O-N 3.24Å
308	I	85.8	Confident	86.4	Confident	36 Å²	36	59 Å²	59	19%	0.185	29%	0.286	C	S	.	.	H	α-helix	trans	-65.6	-45.3	178.8	-66.8	168.5	0	0	0	110.5	Y184 Q304 L305 R306 D310 Q311 H312	Y184-I308 HydrophobicContact CD1-CG2 4.18Å; Y184-I308 HydrophobicContact CD2-CG2 3.67Å; Y184-I308 HydrophobicContact CE1-CG2 4.16Å; Y184-I308 HydrophobicContact CE2-CG2 3.65Å; Y184-I308 HydrophobicContact CG-CG2 3.96Å; Q304-I308 HydrophobicContact CG-CD1 3.82Å; Q304-I308 HydrophobicContact CG-CG1 4.46Å; Q304-I308 VanDerWaalsContact O-CG1 3.32Å; Q304-I308 WeakPolarHBondContact O-CG1 3.07Å; Q304-I308 PolarHBondContact O-N 2.89Å; L305-I308 PolarHBondContact O-N 3.34Å; R306-I308 PolarHBondContact O-N 3.47Å; I308-D310 PolarHBondContact O-N 2.93Å; I308-Q311 WeakPolarHBondContact O-CB 3.36Å; I308-Q311 PolarHBondContact O-N 2.93Å; I308-H312 PolarHBondContact O-N 2.99Å; I308-H312 PolarHBondContact O-ND1 3.36Å
309	R	87.4	Confident	85.8	Confident	35 Å²	35	63.2 Å²	63.2	13%	0.132	30%	0.304	C	S	.	.	H	α-helix	trans	-57.7	-49.5	176.2	-179.6	-158.2	68.2	-173.5	7.4	111.4	L181 L305 R306 Q311 H312 L313	L181-R309 HydrophobicContact CD1-CG 3.7Å; L305-R309 VanDerWaalsContact O-CB 3.25Å; L305-R309 WeakPolarHBondContact O-CB 3.41Å; L305-R309 PolarHBondContact O-N 2.91Å; R306-R309 PolarHBondContact O-N 3.47Å; R309-Q311 VanDerWaalsContact C-N 3.3Å; R309-Q311 PolarHBondContact O-N 3.3Å; R309-H312 PolarHBondContact O-N 3.15Å; R309-H312 VanDerWaalsContact O-N 3.16Å; R309-L313 HydrophobicContact CG-CD1 4.33Å; R309-L313 PolarHBondContact O-N 3.43Å
310	D	84.1	Confident	85.2	Confident	53 Å²	53	63.5 Å²	63.5	28%	0.283	32%	0.323	S	S	.	.	H	α-helix	trans	-65.9	-35.3	-178.2	-65.5	-8.7	0	0	0	110.9	R306 I308 L313 V314	R306-D310 WeakPolarHBondContact CG-OD2 3.37Å; R306-D310 IonicContact NE-OD2 3.79Å; R306-D310 WeakPolarHBondContact O-CB 3.44Å; R306-D310 PolarHBondContact O-N 3Å; I308-D310 PolarHBondContact O-N 2.93Å; D310-L313 PolarHBondContact O-N 3.17Å; D310-V314 WeakPolarHBondContact O-CB 3.34Å; D310-V314 VanDerWaalsContact O-CG2 3.26Å; D310-V314 WeakPolarHBondContact O-CG2 3.35Å; D310-V314 PolarHBondContact O-N 2.62Å
311	Q	83.4	Confident	84.9	Confident	41 Å²	41	60.8 Å²	60.8	19%	0.192	31%	0.305	C	S	.	.	H	α-helix	trans	-61.8	-44.6	171.3	-75.2	169.1	-6.2	0	0	112.5	K307 I308 R309 V314 W315	K307-Q311 WeakPolarHBondContact O-CB 3.4Å; K307-Q311 WeakPolarHBondContact O-CG 3.16Å; K307-Q311 PolarHBondContact O-N 3.24Å; I308-Q311 WeakPolarHBondContact O-CB 3.36Å; I308-Q311 PolarHBondContact O-N 2.93Å; R309-Q311 VanDerWaalsContact C-N 3.3Å; R309-Q311 PolarHBondContact O-N 3.3Å; Q311-V314 PolarHBondContact O-N 3.3Å; Q311-W315 WeakPolarHBondContact O-CB 3.15Å; Q311-W315 PolarHBondContact O-N 3.43Å
312	H	84.3	Confident	84.4	Confident	12 Å²	12	67.8 Å²	67.8	6%	0.056	33%	0.327	C	S	.	.	H	α-helix	trans	-66.2	-39.2	177.8	-74.9	65.1	0	0	0	111.6	L181 Y184 I308 R309 W315 L316	L181-H312 HydrophobicContact CB-CB 4.19Å; L181-H312 HydrophobicContact CD1-CB 4.02Å; Y184-H312 AromaticContact CE2-CE1 3.66Å; Y184-H312 AromaticContact CE2-NE2 3.64Å; I308-H312 PolarHBondContact O-N 2.99Å; I308-H312 PolarHBondContact O-ND1 3.36Å; R309-H312 PolarHBondContact O-N 3.15Å; R309-H312 VanDerWaalsContact O-N 3.16Å; H312-W315 PolarHBondContact O-N 3.41Å; H312-L316 VanDerWaalsContact O-CG 3.31Å; H312-L316 WeakPolarHBondContact O-CG 3.09Å; H312-L316 PolarHBondContact O-N 2.88Å
313	L	84.6	Confident	83.8	Confident	39 Å²	39	71.9 Å²	71.9	20%	0.204	35%	0.345	C	S	.	.	H	α-helix	trans	-60	-49.4	174.6	-77.7	170.6	0	0	0	111.8	L181 R309 D310 W315 L316 N317 L326 L330	L181-L313 HydrophobicContact CD1-CD2 4.15Å; L181-L313 HydrophobicContact CD1-CG 3.86Å; L181-L313 HydrophobicContact CD2-CD2 3.55Å; L181-L313 HydrophobicContact CD2-CG 4.14Å; L181-L313 HydrophobicContact CG-CD2 4.48Å; R309-L313 HydrophobicContact CG-CD1 4.33Å; R309-L313 PolarHBondContact O-N 3.43Å; D310-L313 PolarHBondContact O-N 3.17Å; L313-W315 VanDerWaalsContact C-N 3.31Å; L313-W315 PolarHBondContact O-N 3.37Å; L313-L316 PolarHBondContact O-N 3.4Å; L313-N317 WeakPolarHBondContact O-CB 3.41Å; L313-N317 PolarHBondContact O-N 3.23Å; L313-L326 HydrophobicContact CD2-CD2 4.43Å; L313-L330 HydrophobicContact CD1-CD2 4.45Å; L313-L330 HydrophobicContact CD2-CD1 3.95Å; L313-L330 HydrophobicContact CD2-CD2 4.17Å; L313-L330 HydrophobicContact CD2-CG 4.28Å
314	V	81.5	Confident	83.5	Confident	46 Å²	46	73.2 Å²	73.2	28%	0.279	35%	0.347	S	S	.	.	H	α-helix	trans	-62.6	-41	178.5	173.3	0	0	0	0	110.7	D310 Q311 N317 H318	D310-V314 WeakPolarHBondContact O-CB 3.34Å; D310-V314 VanDerWaalsContact O-CG2 3.26Å; D310-V314 WeakPolarHBondContact O-CG2 3.35Å; D310-V314 PolarHBondContact O-N 2.62Å; Q311-V314 PolarHBondContact O-N 3.3Å; V314-N317 PolarHBondContact O-N 2.97Å; V314-H318 WeakPolarHBondContact CG1-CE1 3.29Å; V314-H318 WeakPolarHBondContact CG1-ND1 3.27Å; V314-H318 PolarHBondContact O-N 3.06Å; V314-H318 PolarHBondContact O-ND1 3.02Å
315	W	84.2	Confident	83.2	Confident	5 Å²	5	72.1 Å²	72.1	2%	0.019	34%	0.337	C	S	.	.	H	α-helix	trans	-61.1	-48	176.6	-173.3	91	0	0	0	112.3	D166 V169 I174 V177 Q311 H312 L313 N317 H318 K319	D166-W315 VanDerWaalsContact OD1-CD1 3.22Å; D166-W315 PolarHBondContact OD1-NE1 2.94Å; V169-W315 HydrophobicContact CB-CD2 4.44Å; V169-W315 HydrophobicContact CB-CG 4.25Å; V169-W315 HydrophobicContact CG1-CD2 4.17Å; V169-W315 HydrophobicContact CG1-CG 4.45Å; V169-W315 HydrophobicContact CG2-CB 4.16Å; V169-W315 HydrophobicContact CG2-CG 4.02Å; I174-W315 HydrophobicContact CG1-CH2 4.47Å; I174-W315 HydrophobicContact CG1-CZ3 4.39Å; V177-W315 HydrophobicContact CB-CE3 4.11Å; V177-W315 HydrophobicContact CB-CH2 4.42Å; V177-W315 HydrophobicContact CB-CZ3 3.75Å; V177-W315 HydrophobicContact CG1-CD2 4.39Å; V177-W315 HydrophobicContact CG1-CE3 3.62Å; V177-W315 HydrophobicContact CG1-CZ3 3.81Å; V177-W315 HydrophobicContact CG2-CE3 4.19Å; V177-W315 HydrophobicContact CG2-CH2 3.85Å; V177-W315 HydrophobicContact CG2-CZ3 3.67Å; Q311-W315 WeakPolarHBondContact O-CB 3.15Å; Q311-W315 PolarHBondContact O-N 3.43Å; H312-W315 PolarHBondContact O-N 3.41Å; L313-W315 VanDerWaalsContact C-N 3.31Å; L313-W315 PolarHBondContact O-N 3.37Å; W315-N317 VanDerWaalsContact C-N 3.31Å; W315-N317 PolarHBondContact O-N 3.23Å; W315-H318 PolarHBondContact O-N 3.34Å; W315-K319 HydrophobicContact CD2-CG 4.17Å; W315-K319 HydrophobicContact CE3-CG 4.02Å; W315-K319 HydrophobicContact CH2-CD 4.47Å; W315-K319 HydrophobicContact CH2-CG 3.9Å; W315-K319 HydrophobicContact CZ2-CD 4.3Å; W315-K319 HydrophobicContact CZ2-CG 4.02Å; W315-K319 HydrophobicContact CZ3-CG 3.88Å; W315-K319 PolarHBondContact O-N 2.95Å; W315-K319 VanDerWaalsContact O-N 3.09Å
316	L	84.7	Confident	82.9	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-64.1	-36.7	178.5	-69.8	164	0	0	0	111.9	I174 V177 L181 H312 L313 K319 G320 V321 L326 W329	I174-L316 HydrophobicContact CG2-CD2 3.99Å; V177-L316 HydrophobicContact CB-CD2 4.15Å; V177-L316 HydrophobicContact CG1-CD1 4.35Å; V177-L316 HydrophobicContact CG1-CD2 3.97Å; V177-L316 HydrophobicContact CG1-CG 4.02Å; L181-L316 HydrophobicContact CB-CD1 4.29Å; L181-L316 HydrophobicContact CD2-CD1 3.55Å; H312-L316 VanDerWaalsContact O-CG 3.31Å; H312-L316 WeakPolarHBondContact O-CG 3.09Å; H312-L316 PolarHBondContact O-N 2.88Å; L313-L316 PolarHBondContact O-N 3.4Å; L316-K319 PolarHBondContact O-N 3.29Å; L316-G320 PolarHBondContact O-N 2.97Å; L316-V321 HydrophobicContact CB-CB 4.35Å; L316-V321 HydrophobicContact CB-CG2 4.13Å; L316-V321 HydrophobicContact CD2-CG2 4.06Å; L316-V321 WeakPolarHBondContact O-CB 3.48Å; L316-V321 VanDerWaalsContact O-CG2 3.27Å; L316-V321 WeakPolarHBondContact O-CG2 3.38Å; L316-V321 PolarHBondContact O-N 3.08Å; L316-V321 VanDerWaalsContact O-N 3.15Å; L316-L326 HydrophobicContact CB-CD2 3.7Å; L316-L326 HydrophobicContact CD1-CD2 3.93Å; L316-L326 HydrophobicContact CG-CD2 4.44Å; L316-W329 HydrophobicContact CD1-CE3 3.98Å; L316-W329 HydrophobicContact CD1-CZ3 3.77Å; L316-W329 HydrophobicContact CD2-CH2 4.32Å; L316-W329 HydrophobicContact CD2-CZ3 3.89Å; L316-W329 HydrophobicContact CG-CZ3 4.38Å
317	N	80.3	Confident	82.8	Confident	99 Å²	99	67 Å²	67	53%	0.529	32%	0.321	S	S	.	.	H	α-helix	trans	-63.8	-43.5	174.9	-165.9	50.7	0	0	0	111.7	L313 V314 W315 K319 G320	L313-N317 WeakPolarHBondContact O-CB 3.41Å; L313-N317 PolarHBondContact O-N 3.23Å; V314-N317 PolarHBondContact O-N 2.97Å; W315-N317 VanDerWaalsContact C-N 3.31Å; W315-N317 PolarHBondContact O-N 3.23Å; N317-K319 VanDerWaalsContact C-N 3.28Å; N317-K319 PolarHBondContact O-N 2.98Å; N317-G320 PolarHBondContact O-N 3.3Å
318	H	79.7	Confident	82.8	Confident	124 Å²	124	64 Å²	64	57%	0.574	32%	0.32	S	S	*	.	H	α-helix	trans	-62.8	-32.1	175	-75.3	105.1	0	0	0	113.3	V314 W315 G320	V314-H318 WeakPolarHBondContact CG1-CE1 3.29Å; V314-H318 WeakPolarHBondContact CG1-ND1 3.27Å; V314-H318 PolarHBondContact O-N 3.06Å; V314-H318 PolarHBondContact O-ND1 3.02Å; W315-H318 PolarHBondContact O-N 3.34Å; H318-G320 PolarHBondContact O-N 3.48Å
319	K	80.4	Confident	82.8	Confident	102 Å²	102	63.8 Å²	63.8	44%	0.443	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	3	173.6	-64.2	-64.7	-175.6	-177.4	0	113.6	I174 W315 L316 N317	I174-K319 HydrophobicContact CD1-CB 4.22Å; I174-K319 HydrophobicContact CG1-CB 4.39Å; W315-K319 HydrophobicContact CD2-CG 4.17Å; W315-K319 HydrophobicContact CE3-CG 4.02Å; W315-K319 HydrophobicContact CH2-CD 4.47Å; W315-K319 HydrophobicContact CH2-CG 3.9Å; W315-K319 HydrophobicContact CZ2-CD 4.3Å; W315-K319 HydrophobicContact CZ2-CG 4.02Å; W315-K319 HydrophobicContact CZ3-CG 3.88Å; W315-K319 PolarHBondContact O-N 2.95Å; W315-K319 VanDerWaalsContact O-N 3.09Å; L316-K319 PolarHBondContact O-N 3.29Å; N317-K319 VanDerWaalsContact C-N 3.28Å; N317-K319 PolarHBondContact O-N 2.98Å
320	G	77.7	Confident	82.7	Confident	61 Å²	61	63.1 Å²	63.1	63%	0.629	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	23.3	175.7	0	0	0	0	0	114.3	L316 N317 H318 R322	L316-G320 PolarHBondContact O-N 2.97Å; N317-G320 PolarHBondContact O-N 3.3Å; H318-G320 PolarHBondContact O-N 3.48Å; G320-R322 PolarHBondContact O-N 3.45Å
321	V	85.5	Confident	82.4	Confident	12 Å²	12	63.2 Å²	63.2	7%	0.073	33%	0.329	C	S	.	.			trans	-66.4	129	176.5	179.9	0	0	0	0	110	I174 L316 R325 L326 W329	I174-V321 HydrophobicContact CG2-CG2 3.49Å; I174-V321 VanDerWaalsContact CG2-CG2 3.49Å; L316-V321 HydrophobicContact CB-CB 4.35Å; L316-V321 HydrophobicContact CB-CG2 4.13Å; L316-V321 HydrophobicContact CD2-CG2 4.06Å; L316-V321 WeakPolarHBondContact O-CB 3.48Å; L316-V321 VanDerWaalsContact O-CG2 3.27Å; L316-V321 WeakPolarHBondContact O-CG2 3.38Å; L316-V321 PolarHBondContact O-N 3.08Å; L316-V321 VanDerWaalsContact O-N 3.15Å; V321-R325 HydrophobicContact CG1-CB 3.99Å; V321-R325 HydrophobicContact CG1-CG 4.12Å; V321-L326 HydrophobicContact CB-CD2 4.38Å; V321-L326 HydrophobicContact CG1-CD2 4.02Å; V321-L326 HydrophobicContact CG1-CG 4.09Å; V321-W329 HydrophobicContact CG1-CH2 4.36Å; V321-W329 HydrophobicContact CG1-CZ3 3.91Å
322	R	80.3	Confident	81.8	Confident	210 Å²	210	65.6 Å²	65.6	79%	0.792	34%	0.342	S	S	*	.			trans	-63.1	143.9	179.4	-65	-176.6	-173.3	167.9	2.4	111.9	G320 K324 R325 L326	G320-R322 PolarHBondContact O-N 3.45Å; R322-K324 VanDerWaalsContact C-N 3.29Å; R322-K324 PolarHBondContact O-N 3.46Å; R322-R325 WeakPolarHBondContact O-CB 3.34Å; R322-R325 PolarHBondContact O-N 3.39Å; R322-L326 PolarHBondContact O-N 3.02Å
323	Q	79.8	Confident	80.6	Confident	113 Å²	113	73.6 Å²	73.6	53%	0.528	38%	0.377	S	S	.	.	H	α-helix	trans	-54.4	-38.7	179.9	-167.2	63	38	0	0	114	R325 L326 N327	Q323-R325 VanDerWaalsContact C-N 3.25Å; Q323-R325 PolarHBondContact O-N 3.5Å; Q323-L326 PolarHBondContact O-N 3.02Å; Q323-N327 PolarHBondContact NE2-OD1 3.41Å; Q323-N327 VanDerWaalsContact O-CG 3.25Å; Q323-N327 PolarHBondContact O-N 3.03Å; Q323-N327 PolarHBondContact O-OD1 2.93Å
324	K	80.5	Confident	78.8	Confident	147 Å²	147	77.7 Å²	77.7	64%	0.639	40%	0.399	S	S	*	.	H	α-helix	trans	-56.4	-39.9	177.1	-170.2	-173.6	179.1	-166.1	0	111.9	R322 A328 E348	R322-K324 VanDerWaalsContact C-N 3.29Å; R322-K324 PolarHBondContact O-N 3.46Å; K324-A328 PolarHBondContact O-N 3.26Å; K324-E348 IonicContact NZ-OE1 3.62Å; K324-E348 PolarHBondContact NZ-OE1 2.91Å
325	R	80.7	Confident	77	Confident	95 Å²	95	84.4 Å²	84.4	36%	0.358	43%	0.428	S	S	.	.	H	α-helix	trans	-74.7	-36.3	-179.7	-171.9	170.2	171.1	-170.8	-1.3	111.9	D175 V321 R322 Q323 A328 W329	D175-R325 IonicContact OD1-CZ 3.2Å; D175-R325 IonicContact OD1-NH2 3.59Å; D175-R325 PolarHBondContact OD1-NH2 3.36Å; D175-R325 IonicContact OD2-NH2 3.15Å; D175-R325 PolarHBondContact OD2-NH2 3.19Å; V321-R325 HydrophobicContact CG1-CB 3.99Å; V321-R325 HydrophobicContact CG1-CG 4.12Å; R322-R325 WeakPolarHBondContact O-CB 3.34Å; R322-R325 PolarHBondContact O-N 3.39Å; Q323-R325 VanDerWaalsContact C-N 3.25Å; Q323-R325 PolarHBondContact O-N 3.5Å; R325-A328 PolarHBondContact O-N 3.19Å; R325-W329 HydrophobicContact CG-CD2 4.47Å; R325-W329 HydrophobicContact CG-CE3 4.4Å; R325-W329 HydrophobicContact CG-CH2 3.93Å; R325-W329 HydrophobicContact CG-CZ2 3.98Å; R325-W329 HydrophobicContact CG-CZ3 4.13Å; R325-W329 VanDerWaalsContact NE-CH2 3.35Å; R325-W329 VanDerWaalsContact NE-CZ2 3.34Å; R325-W329 PolarHBondContact O-N 2.99Å
326	L	84.3	Confident	75	Confident	6 Å²	6	92.2 Å²	92.2	3%	0.031	47%	0.47	C	S	.	.	H	α-helix	trans	-62.6	-45.8	170.7	-65.1	176.1	0	0	0	111.5	L313 L316 V321 R322 Q323 A328 W329 L330	L313-L326 HydrophobicContact CD2-CD2 4.43Å; L316-L326 HydrophobicContact CB-CD2 3.7Å; L316-L326 HydrophobicContact CD1-CD2 3.93Å; L316-L326 HydrophobicContact CG-CD2 4.44Å; V321-L326 HydrophobicContact CB-CD2 4.38Å; V321-L326 HydrophobicContact CG1-CD2 4.02Å; V321-L326 HydrophobicContact CG1-CG 4.09Å; R322-L326 PolarHBondContact O-N 3.02Å; Q323-L326 PolarHBondContact O-N 3.02Å; L326-A328 VanDerWaalsContact C-N 3.3Å; L326-A328 PolarHBondContact O-N 2.95Å; L326-W329 HydrophobicContact CD2-CE3 4.17Å; L326-W329 HydrophobicContact CD2-CZ3 4.26Å; L326-W329 PolarHBondContact O-N 3.3Å; L326-L330 WeakPolarHBondContact O-CG 3.47Å; L326-L330 PolarHBondContact O-N 3.08Å
327	N	83.9	Confident	73	Confident	39 Å²	39	95.9 Å²	95.9	21%	0.209	50%	0.5	C	S	.	.	H	α-helix	trans	-61.5	-38.8	178.1	-68.3	0	0	0	0	111.8	Q323 L330 G331 I332	Q323-N327 PolarHBondContact NE2-OD1 3.41Å; Q323-N327 VanDerWaalsContact O-CG 3.25Å; Q323-N327 PolarHBondContact O-N 3.03Å; Q323-N327 PolarHBondContact O-OD1 2.93Å; N327-L330 CarbonylContact O-C 3.36Å; N327-L330 PolarHBondContact O-N 2.98Å; N327-G331 PolarHBondContact O-N 3.19Å; N327-I332 HydrophobicContact CB-CB 4.33Å; N327-I332 PolarHBondContact O-N 2.58Å
328	A	85.7	Confident	70.9	Confident	68 Å²	68	98.7 Å²	98.7	56%	0.562	52%	0.515	S	S	*	.	H	α-helix	trans	-61	-45.9	175	0	0	0	0	0	112.3	K324 R325 L326 L330 G331	K324-A328 PolarHBondContact O-N 3.26Å; R325-A328 PolarHBondContact O-N 3.19Å; L326-A328 VanDerWaalsContact C-N 3.3Å; L326-A328 PolarHBondContact O-N 2.95Å; A328-L330 VanDerWaalsContact C-N 3.32Å; A328-L330 PolarHBondContact O-N 3.28Å; A328-G331 PolarHBondContact O-N 3.43Å; A328-G331 VanDerWaalsContact O-N 3.08Å
329	W	85.3	Confident	69.1	Low	33 Å²	33	102.2 Å²	102.2	13%	0.125	53%	0.532	C	S	.	.	H	α-helix	trans	-67.8	-29.9	175.9	-69	-38.2	0	0	0	113.6	I174 L181 L316 V321 R325 L326 G331	I174-W329 HydrophobicContact CG2-CH2 4.11Å; L181-W329 HydrophobicContact CD2-CB 4.4Å; L316-W329 HydrophobicContact CD1-CE3 3.98Å; L316-W329 HydrophobicContact CD1-CZ3 3.77Å; L316-W329 HydrophobicContact CD2-CH2 4.32Å; L316-W329 HydrophobicContact CD2-CZ3 3.89Å; L316-W329 HydrophobicContact CG-CZ3 4.38Å; V321-W329 HydrophobicContact CG1-CH2 4.36Å; V321-W329 HydrophobicContact CG1-CZ3 3.91Å; R325-W329 HydrophobicContact CG-CD2 4.47Å; R325-W329 HydrophobicContact CG-CE3 4.4Å; R325-W329 HydrophobicContact CG-CH2 3.93Å; R325-W329 HydrophobicContact CG-CZ2 3.98Å; R325-W329 HydrophobicContact CG-CZ3 4.13Å; R325-W329 VanDerWaalsContact NE-CH2 3.35Å; R325-W329 VanDerWaalsContact NE-CZ2 3.34Å; R325-W329 PolarHBondContact O-N 2.99Å; L326-W329 HydrophobicContact CD2-CE3 4.17Å; L326-W329 HydrophobicContact CD2-CZ3 4.26Å; L326-W329 PolarHBondContact O-N 3.3Å; W329-G331 PolarHBondContact O-N 3.2Å
330	L	84.9	Confident	67.2	Low	20 Å²	20	104 Å²	104	11%	0.105	55%	0.546	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-4.9	172.7	-66.2	175	0	0	0	113	L181 H185 L313 L326 N327 A328 I332	L181-L330 HydrophobicContact CD1-CD2 4.42Å; H185-L330 HydrophobicContact CB-CD2 4.25Å; H185-L330 PolarHBondContact CD2-O 3.19Å; H185-L330 PolarHBondContact NE2-O 3.06Å; L313-L330 HydrophobicContact CD1-CD2 4.45Å; L313-L330 HydrophobicContact CD2-CD1 3.95Å; L313-L330 HydrophobicContact CD2-CD2 4.17Å; L313-L330 HydrophobicContact CD2-CG 4.28Å; L326-L330 WeakPolarHBondContact O-CG 3.47Å; L326-L330 PolarHBondContact O-N 3.08Å; N327-L330 CarbonylContact O-C 3.36Å; N327-L330 PolarHBondContact O-N 2.98Å; A328-L330 VanDerWaalsContact C-N 3.32Å; A328-L330 PolarHBondContact O-N 3.28Å; L330-I332 HydrophobicContact CB-CD1 4.01Å; L330-I332 HydrophobicContact CB-CG1 3.94Å; L330-I332 HydrophobicContact CD1-CD1 4.05Å; L330-I332 PolarHBondContact O-N 2.99Å
331	G	79	Confident	65.4	Low	55 Å²	55	110.1 Å²	110.1	57%	0.567	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.9	18.9	-177.5	0	0	0	0	0	113.9	N327 A328 W329 K333	N327-G331 PolarHBondContact O-N 3.19Å; A328-G331 PolarHBondContact O-N 3.43Å; A328-G331 VanDerWaalsContact O-N 3.08Å; W329-G331 PolarHBondContact O-N 3.2Å; G331-K333 VanDerWaalsContact C-N 3.29Å; G331-K333 PolarHBondContact O-N 2.94Å
332	I	71.3	Confident	63.1	Low	91 Å²	91	119.2 Å²	119.2	47%	0.467	59%	0.591	S	S	.	*			trans	-76.3	88.5	173.5	-55.9	171.4	0	0	0	106.5	N327 L330	N327-I332 HydrophobicContact CB-CB 4.33Å; N327-I332 PolarHBondContact O-N 2.58Å; L330-I332 HydrophobicContact CB-CD1 4.01Å; L330-I332 HydrophobicContact CB-CG1 3.94Å; L330-I332 HydrophobicContact CD1-CD1 4.05Å; L330-I332 PolarHBondContact O-N 2.99Å
333	K	57.9	Low	61.2	Low	180 Å²	180	114 Å²	114	78%	0.783	58%	0.577	S	S	*	*			trans	-74.5	126.3	166.5	-64.4	-175.6	178.9	-175.9	0	106.7	G331 E335	G331-K333 VanDerWaalsContact C-N 3.29Å; G331-K333 PolarHBondContact O-N 2.94Å; K333-E335 VanDerWaalsContact C-N 3.31Å; K333-E335 PolarHBondContact O-N 3.2Å
334	N	46.4	Very low	59.4	Low	125 Å²	125	114.3 Å²	114.3	67%	0.668	58%	0.583	S	S	*	*			trans	-64.9	99.4	165.3	-81.1	-5.8	0	0	0	106.5	D336 A337	N334-D336 PolarHBondContact O-N 3.44Å; N334-A337 PolarHBondContact O-N 2.77Å
335	E	44.8	Very low	57.6	Low	188 Å²	188	116.6 Å²	116.6	88%	0.879	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-11.9	178.3	-69.8	-177.7	161.8	0	0	112.2	K333	K333-E335 VanDerWaalsContact C-N 3.31Å; K333-E335 PolarHBondContact O-N 3.2Å
336	D	41.5	Very low	56	Low	169 Å²	169	120.3 Å²	120.3	90%	0.904	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	7.9	-179.8	-64.1	-43.5	0	0	0	115.2	N334	N334-D336 PolarHBondContact O-N 3.44Å
337	A	42.4	Very low	54.3	Low	77 Å²	77	122.1 Å²	122.1	64%	0.636	63%	0.627	S	S	*	*	S	Bend	trans	-102.9	92	170.8	0	0	0	0	0	109.2	N334	N334-A337 PolarHBondContact O-N 2.77Å
338	D	36.8	Very low	52.8	Low	157 Å²	157	126 Å²	126	84%	0.84	64%	0.644	S	S	*	*			trans	-11.1	128.1	171.9	-96.7	-30.5	0	0	0	116.2	N340	D338-N340 PolarHBondContact O-N 2.74Å
339	E	43.2	Very low	51.4	Low	198 Å²	198	130.3 Å²	130.3	93%	0.925	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	45.3	176.6	-63.2	-176.7	133.2	0	0	115.3
340	N	38.7	Very low	50.7	Low	141 Å²	141	130.6 Å²	130.6	75%	0.754	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.1	15.2	-177	-117.5	-4.4	0	0	0	118.7	D338	D338-N340 PolarHBondContact O-N 2.74Å
341	Y	39.7	Very low	50.3	Low	188 Å²	188	132.2 Å²	132.2	74%	0.737	67%	0.673	S	S	*	*			trans	-136	95.1	167.5	-92.9	-94.1	0	0	0	111.4	I343	Y341-I343 VanDerWaalsContact C-N 3.26Å; Y341-I343 HydrophobicContact CD1-CG1 4.45Å; Y341-I343 PolarHBondContact O-N 2.93Å
342	F	38.6	Very low	50.5	Low	204 Å²	204	129.9 Å²	129.9	90%	0.895	65%	0.647	S	S	*	*			trans	-63.1	89.7	156.5	-76.2	-91.5	0	0	0	108.4
343	I	39.5	Very low	51	Low	100 Å²	100	130.2 Å²	130.2	51%	0.513	64%	0.643	S	S	.	*			trans	-86.2	105.3	164	-60.3	-164.4	0	0	0	106.8	Y341 D347	Y341-I343 VanDerWaalsContact C-N 3.26Å; Y341-I343 HydrophobicContact CD1-CG1 4.45Å; Y341-I343 PolarHBondContact O-N 2.93Å; I343-D347 HydrophobicContact CG2-CB 3.72Å
344	N	42.1	Very low	52.2	Low	120 Å²	120	125.4 Å²	125.4	64%	0.642	63%	0.626	S	S	*	*			trans	-61.5	141.8	170.1	-70.4	-36.7	0	0	0	109.3	E346 D347	N344-E346 PolarHBondContact O-N 2.56Å; N344-D347 PolarHBondContact O-N 2.8Å; N344-D347 VanDerWaalsContact O-N 3.1Å
345	E	43.9	Very low	54	Low	194 Å²	194	124.1 Å²	124.1	91%	0.907	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	-6.2	-177.2	-64.8	179.2	161.1	0	0	115
346	E	46.4	Very low	55.9	Low	174 Å²	174	123.1 Å²	123.1	81%	0.813	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-19.1	174.4	-66	-175.1	165	0	0	113.6	N344	N344-E346 PolarHBondContact O-N 2.56Å
347	D	48.2	Very low	58	Low	44 Å²	44	115.9 Å²	115.9	24%	0.235	57%	0.57	C	S	.	*	G	3₁₀ helix	trans	-81.4	-14.8	-176.7	-114.9	15.5	0	0	0	113.6	I343 N344 N349 L350 Y353 Q434	I343-D347 HydrophobicContact CG2-CB 3.72Å; N344-D347 PolarHBondContact O-N 2.8Å; N344-D347 VanDerWaalsContact O-N 3.1Å; D347-N349 VanDerWaalsContact C-N 3.31Å; D347-N349 PolarHBondContact O-N 3.35Å; D347-L350 HydrophobicContact CB-CD1 4.11Å; D347-L350 VanDerWaalsContact CG-CD1 3.47Å; D347-L350 WeakPolarHBondContact O-CD1 3.5Å; D347-L350 WeakPolarHBondContact O-CG 3.32Å; D347-L350 WeakPolarHBondContact OD1-CD1 3.32Å; D347-Y353 VanDerWaalsContact O-CE2 3.27Å; D347-Y353 WeakPolarHBondContact O-CE2 3.27Å; D347-Q434 PolarHBondContact OD2-NE2 3.1Å; D347-Q434 VanDerWaalsContact OD2-NE2 3.11Å
348	E	53.6	Low	60.3	Low	120 Å²	120	112.3 Å²	112.3	56%	0.561	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-78.1	-9.1	-177.5	-75.9	-162.6	156	0	0	114.2	K324	K324-E348 IonicContact NZ-OE1 3.62Å; K324-E348 PolarHBondContact NZ-OE1 2.91Å
349	N	56.4	Low	62.9	Low	159 Å²	159	106.6 Å²	106.6	85%	0.85	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-112.6	20.9	175.5	-85.3	-20.2	0	0	0	113.6	D347	D347-N349 VanDerWaalsContact C-N 3.31Å; D347-N349 PolarHBondContact O-N 3.35Å
350	L	70.4	Confident	65.1	Low	38 Å²	38	98.4 Å²	98.4	20%	0.199	47%	0.472	C	S	.	.			trans	-62.2	134.4	176.8	-79.2	163.8	0	0	0	111.4	D347 H352 Y353 Q433	D347-L350 HydrophobicContact CB-CD1 4.11Å; D347-L350 VanDerWaalsContact CG-CD1 3.47Å; D347-L350 WeakPolarHBondContact O-CD1 3.5Å; D347-L350 WeakPolarHBondContact O-CG 3.32Å; D347-L350 WeakPolarHBondContact OD1-CD1 3.32Å; L350-H352 HydrophobicContact CB-CB 4.43Å; L350-H352 PolarHBondContact O-N 3.17Å; L350-Y353 HydrophobicContact CB-CD2 3.93Å; L350-Y353 HydrophobicContact CB-CE2 4.15Å; L350-Y353 HydrophobicContact CD1-CE2 4.43Å; L350-Y353 PolarHBondContact O-N 3.07Å; L350-Y353 VanDerWaalsContact O-N 3.08Å; L350-Q433 VanDerWaalsContact CD1-OE1 3.25Å
351	P	75.7	Confident	66.9	Low	54 Å²	54	97.3 Å²	97.3	35%	0.351	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-54.8	-27.6	175.8	-26.2	34.3	0	0	0	113.3	Y353 D354 T357 P451 A454	P351-Y353 PolarHBondContact O-N 3.38Å; P351-Y353 VanDerWaalsContact O-N 3.09Å; P351-D354 PolarHBondContact O-N 3.1Å; P351-D354 VanDerWaalsContact O-N 3.07Å; P351-T357 PolarHBondContact O-OG1 3.43Å; P351-P451 HydrophobicContact CB-CG 4.11Å; P351-A454 HydrophobicContact CB-CB 3.55Å; P351-A454 HydrophobicContact CG-CB 3.91Å
352	H	83.4	Confident	68.8	Low	6 Å²	6	95.4 Å²	95.4	3%	0.028	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-56	-22.8	176.7	-54.2	89.8	0	0	0	114.9	L350 D354 W358 F380 V429 L430 Q433 L448 A449 P451	L350-H352 HydrophobicContact CB-CB 4.43Å; L350-H352 PolarHBondContact O-N 3.17Å; H352-D354 VanDerWaalsContact C-N 3.33Å; H352-W358 PolarHBondContact O-NE1 2.77Å; H352-F380 AromaticContact CD2-CE1 3.74Å; H352-F380 AromaticContact CD2-CZ 3.83Å; H352-F380 AromaticContact NE2-CE1 3.76Å; H352-V429 HydrophobicContact CB-CG1 4.28Å; H352-L430 HydrophobicContact CB-CD2 3.91Å; H352-Q433 VanDerWaalsContact CG-OE1 3.23Å; H352-Q433 PolarHBondContact ND1-OE1 2.77Å; H352-L448 PolarHBondContact NE2-O 2.72Å; H352-A449 PolarHBondContact CE1-O 3.49Å; H352-A449 PolarHBondContact NE2-O 2.97Å; H352-P451 WeakPolarHBondContact NE2-CD 3.43Å
353	Y	81	Confident	71.1	Confident	98 Å²	98	87 Å²	87	38%	0.384	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-72.1	-24.9	176.8	-80.6	-84.8	0	0	0	113.7	D347 L350 P351 K426 L430	D347-Y353 VanDerWaalsContact O-CE2 3.27Å; D347-Y353 WeakPolarHBondContact O-CE2 3.27Å; L350-Y353 HydrophobicContact CB-CD2 3.93Å; L350-Y353 HydrophobicContact CB-CE2 4.15Å; L350-Y353 HydrophobicContact CD1-CE2 4.43Å; L350-Y353 PolarHBondContact O-N 3.07Å; L350-Y353 VanDerWaalsContact O-N 3.08Å; P351-Y353 PolarHBondContact O-N 3.38Å; P351-Y353 VanDerWaalsContact O-N 3.09Å; Y353-K426 VanDerWaalsContact O-CE 3.32Å; Y353-K426 WeakPolarHBondContact O-CE 3.37Å; Y353-K426 PolarHBondContact O-NZ 3.35Å; Y353-L430 HydrophobicContact CD1-CD1 4.25Å; Y353-L430 HydrophobicContact CD1-CD2 4.47Å; Y353-L430 HydrophobicContact CD2-CD2 4.18Å; Y353-L430 HydrophobicContact CE1-CD1 3.92Å; Y353-L430 HydrophobicContact CE1-CD2 4.31Å; Y353-L430 HydrophobicContact CE2-CD2 3.98Å; Y353-L430 HydrophobicContact CG-CD2 4.41Å
354	D	83.8	Confident	73.4	Confident	80 Å²	80	86.1 Å²	86.1	43%	0.428	43%	0.425	S	S	.	.	S	Bend	trans	-93.1	110.8	176.1	-177.8	5	0	0	0	109.5	P351 H352 K356 T357 W358	P351-D354 PolarHBondContact O-N 3.1Å; P351-D354 VanDerWaalsContact O-N 3.07Å; H352-D354 VanDerWaalsContact C-N 3.33Å; D354-K356 PolarHBondContact O-N 3.46Å; D354-K356 VanDerWaalsContact O-N 3.14Å; D354-K356 WeakPolarHBondContact OD1-CB 3.35Å; D354-K356 PolarHBondContact OD1-N 3.04Å; D354-T357 HydrophobicContact CB-CG2 3.79Å; D354-T357 WeakPolarHBondContact O-CB 3.37Å; D354-T357 PolarHBondContact O-N 2.84Å; D354-T357 PolarHBondContact O-OG1 2.94Å; D354-W358 PolarHBondContact O-NE1 2.97Å
355	E	84.9	Confident	75.6	Confident	98 Å²	98	87.4 Å²	87.4	46%	0.458	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-56.7	-30.1	-179.6	-65.6	177.4	-179.5	0	0	111.8	T357 W358 F359 K426	E355-T357 PolarHBondContact O-N 3.39Å; E355-T357 VanDerWaalsContact O-N 3.11Å; E355-W358 HydrophobicContact CB-CZ2 4.18Å; E355-W358 HydrophobicContact CG-CH2 4.21Å; E355-W358 HydrophobicContact CG-CZ2 3.76Å; E355-W358 PolarHBondContact O-N 3.11Å; E355-F359 WeakPolarHBondContact O-CA 3.47Å; E355-F359 WeakPolarHBondContact O-CB 3.42Å; E355-F359 PolarHBondContact O-N 2.82Å; E355-K426 HydrophobicContact CG-CD 4.35Å
356	K	84.3	Confident	77.7	Confident	167 Å²	167	82.2 Å²	82.2	73%	0.726	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-66.2	-15	178.4	-60.9	-180	-179.9	-179.7	0	113.4	D354 H453	D354-K356 PolarHBondContact O-N 3.46Å; D354-K356 VanDerWaalsContact O-N 3.14Å; D354-K356 WeakPolarHBondContact OD1-CB 3.35Å; D354-K356 PolarHBondContact OD1-N 3.04Å; K356-H453 PolarHBondContact O-CD2 3.17Å
357	T	85.6	Confident	79.7	Confident	16 Å²	16	78 Å²	78	10%	0.098	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-82.7	-23.1	-178	66.9	0	0	0	0	113.1	P351 D354 E355 P451 V452 H453	P351-T357 PolarHBondContact O-OG1 3.43Å; D354-T357 HydrophobicContact CB-CG2 3.79Å; D354-T357 WeakPolarHBondContact O-CB 3.37Å; D354-T357 PolarHBondContact O-N 2.84Å; D354-T357 PolarHBondContact O-OG1 2.94Å; E355-T357 PolarHBondContact O-N 3.39Å; E355-T357 VanDerWaalsContact O-N 3.11Å; T357-P451 CarbonylContact O-C 3.6Å; T357-P451 VanDerWaalsContact O-CB 3.22Å; T357-P451 WeakPolarHBondContact O-CB 3.43Å; T357-P451 WeakPolarHBondContact OG1-CB 3.3Å; T357-V452 PolarHBondContact O-N 3.3Å; T357-H453 PolarHBondContact O-N 3.38Å
358	W	91.1	Very high	81.7	Confident	3 Å²	3	75.9 Å²	75.9	1%	0.011	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.5	-20.8	-176.4	49	-95.1	0	0	0	114.3	H352 D354 E355 F380 L381 I382 L425 K426 V429 P451	H352-W358 PolarHBondContact O-NE1 2.77Å; D354-W358 PolarHBondContact O-NE1 2.97Å; E355-W358 HydrophobicContact CB-CZ2 4.18Å; E355-W358 HydrophobicContact CG-CH2 4.21Å; E355-W358 HydrophobicContact CG-CZ2 3.76Å; E355-W358 PolarHBondContact O-N 3.11Å; W358-F380 HydrophobicContact CB-CD2 4.28Å; W358-F380 HydrophobicContact CB-CE2 3.47Å; W358-F380 VanDerWaalsContact CB-CE2 3.47Å; W358-F380 HydrophobicContact CB-CZ 3.62Å; W358-F380 HydrophobicContact CD2-CE2 4.38Å; W358-F380 AromaticContact CG-CE2 3.92Å; W358-F380 HydrophobicContact CG-CE2 3.92Å; W358-F380 AromaticContact CG-CZ 3.94Å; W358-F380 HydrophobicContact CG-CZ 3.94Å; W358-L381 CarbonylContact O-C 3.58Å; W358-L381 WeakPolarHBondContact O-CA 3.33Å; W358-L381 WeakPolarHBondContact O-CB 3.09Å; W358-I382 HydrophobicContact CE3-CB 4.03Å; W358-I382 HydrophobicContact CE3-CD1 3.86Å; W358-I382 HydrophobicContact CE3-CG1 4.09Å; W358-I382 HydrophobicContact CZ3-CB 4.2Å; W358-I382 HydrophobicContact CZ3-CD1 3.77Å; W358-I382 HydrophobicContact CZ3-CG1 4.35Å; W358-I382 PolarHBondContact O-N 3.03Å; W358-L425 HydrophobicContact CH2-CB 3.98Å; W358-L425 HydrophobicContact CZ3-CB 4.19Å; W358-K426 HydrophobicContact CH2-CB 4.32Å; W358-K426 HydrophobicContact CZ2-CB 4Å; W358-K426 HydrophobicContact CZ2-CG 4.41Å; W358-V429 HydrophobicContact CD2-CG1 4.35Å; W358-V429 HydrophobicContact CD2-CG2 4.01Å; W358-V429 HydrophobicContact CE3-CG2 3.88Å; W358-V429 HydrophobicContact CG-CG1 4.46Å; W358-V429 HydrophobicContact CH2-CG2 4.04Å; W358-V429 HydrophobicContact CZ2-CB 4.34Å; W358-V429 HydrophobicContact CZ2-CG2 4.14Å; W358-V429 HydrophobicContact CZ3-CG2 3.9Å; W358-P451 HydrophobicContact CB-CB 3.91Å
359	F	91.2	Very high	83.5	Confident	37 Å²	37	73.1 Å²	73.1	16%	0.162	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	125.7	-179.4	-170.3	-119.4	0	0	0	111.3	E355 E361 I382 Y391 L425	E355-F359 WeakPolarHBondContact O-CA 3.47Å; E355-F359 WeakPolarHBondContact O-CB 3.42Å; E355-F359 PolarHBondContact O-N 2.82Å; F359-E361 HydrophobicContact CD1-CG 3.92Å; F359-E361 HydrophobicContact CE1-CG 3.25Å; F359-E361 WeakPolarHBondContact CE1-OE1 3.37Å; F359-E361 HydrophobicContact CZ-CG 3.79Å; F359-I382 CarbonylContact C-O 3.58Å; F359-I382 WeakPolarHBondContact CA-O 3.42Å; F359-I382 HydrophobicContact CD2-CB 4.14Å; F359-I382 HydrophobicContact CD2-CG2 3.97Å; F359-I382 WeakPolarHBondContact CD2-O 3.42Å; F359-I382 HydrophobicContact CE2-CG2 4.17Å; F359-Y391 AromaticContact CE2-CD1 3.84Å; F359-Y391 HydrophobicContact CE2-CD1 3.84Å; F359-Y391 AromaticContact CE2-CE1 3.77Å; F359-Y391 HydrophobicContact CE2-CE1 3.77Å; F359-Y391 HydrophobicContact CZ-CD1 4.31Å; F359-Y391 AromaticContact CZ-CE1 3.79Å; F359-Y391 HydrophobicContact CZ-CE1 3.79Å; F359-L425 HydrophobicContact CD2-CD1 4.41Å; F359-L425 HydrophobicContact CE2-CD1 4Å
360	V	88.3	Confident	85.2	Confident	25 Å²	25	70.9 Å²	70.9	15%	0.152	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	102.9	-177.4	-167.2	0	0	0	0	109.2	I363 L381 I382 R383 V452	V360-I363 HydrophobicContact CB-CD1 3.73Å; V360-I363 HydrophobicContact CB-CG1 3.94Å; V360-I363 HydrophobicContact CG1-CB 4.28Å; V360-I363 HydrophobicContact CG1-CD1 3.73Å; V360-I363 HydrophobicContact CG1-CG1 3.73Å; V360-I363 HydrophobicContact CG1-CG2 3.61Å; V360-I363 HydrophobicContact CG2-CD1 4.32Å; V360-L381 HydrophobicContact CG2-CB 4.41Å; V360-I382 PolarHBondContact N-O 3.1Å; V360-R383 VanDerWaalsContact O-CA 3.23Å; V360-R383 WeakPolarHBondContact O-CA 3.4Å; V360-R383 VanDerWaalsContact O-CB 3.31Å; V360-R383 WeakPolarHBondContact O-CB 3.35Å; V360-V452 HydrophobicContact CG2-CG1 4.28Å
361	E	77.9	Confident	86	Confident	118 Å²	118	72.4 Å²	72.4	55%	0.551	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-47.2	-170.8	-68.9	176.1	173.1	0	0	113	F359 I363	F359-E361 HydrophobicContact CD1-CG 3.92Å; F359-E361 HydrophobicContact CE1-CG 3.25Å; F359-E361 WeakPolarHBondContact CE1-OE1 3.37Å; F359-E361 HydrophobicContact CZ-CG 3.79Å; E361-I363 PolarHBondContact O-N 3.17Å
362	D	78.1	Confident	86.7	Confident	148 Å²	148	69.9 Å²	69.9	79%	0.791	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	52.5	-167.8	-73.5	-33	0	0	0	114.2
363	I	86.9	Confident	86.9	Confident	27 Å²	27	79 Å²	79	14%	0.138	37%	0.373	C	S	.	.			trans	-129.4	142.1	174.4	60.8	167.4	0	0	0	113.8	V360 E361 Q367 A368 L371 L381 R383	V360-I363 HydrophobicContact CB-CD1 3.73Å; V360-I363 HydrophobicContact CB-CG1 3.94Å; V360-I363 HydrophobicContact CG1-CB 4.28Å; V360-I363 HydrophobicContact CG1-CD1 3.73Å; V360-I363 HydrophobicContact CG1-CG1 3.73Å; V360-I363 HydrophobicContact CG1-CG2 3.61Å; V360-I363 HydrophobicContact CG2-CD1 4.32Å; E361-I363 PolarHBondContact O-N 3.17Å; I363-Q367 HydrophobicContact CB-CB 4.16Å; I363-Q367 HydrophobicContact CG2-CB 4.43Å; I363-A368 HydrophobicContact CD1-CB 4.08Å; I363-L371 HydrophobicContact CD1-CD1 4.12Å; I363-L381 HydrophobicContact CD1-CD1 3.62Å; I363-L381 HydrophobicContact CD1-CD2 3.8Å; I363-L381 HydrophobicContact CD1-CG 4.36Å; I363-R383 HydrophobicContact CD1-CB 4.12Å; I363-R383 HydrophobicContact CG1-CB 3.63Å; I363-R383 HydrophobicContact CG1-CG 4.39Å; I363-R383 WeakPolarHBondContact O-CD 3.39Å
364	N	87.4	Confident	87	Confident	82 Å²	82	78 Å²	78	44%	0.439	39%	0.393	S	S	.	.			trans	-89.6	173.4	174.6	72.1	44.3	0	0	0	111.9	V366 Q367 A368	N364-V366 VanDerWaalsContact C-N 3.3Å; N364-V366 PolarHBondContact O-N 3.28Å; N364-V366 WeakPolarHBondContact OD1-CB 3.48Å; N364-V366 PolarHBondContact OD1-N 3.42Å; N364-Q367 VanDerWaalsContact CG-OE1 3.25Å; N364-Q367 PolarHBondContact ND2-OE1 3.32Å; N364-Q367 PolarHBondContact O-N 3.48Å; N364-Q367 WeakPolarHBondContact OD1-CG 3.41Å; N364-Q367 PolarHBondContact OD1-N 3.33Å; N364-A368 PolarHBondContact O-N 3.35Å
365	R	88.7	Confident	87.2	Confident	147 Å²	147	78.3 Å²	78.3	56%	0.555	39%	0.391	S	S	*	.	H	α-helix	trans	-55.2	-42.5	-178.6	-175.9	-178	172	160.5	1.4	113.2	A368 E369 H403	R365-A368 PolarHBondContact O-N 2.83Å; R365-E369 IonicContact CZ-OE1 4Å; R365-E369 IonicContact NE-OE1 2.81Å; R365-E369 PolarHBondContact NE-OE1 3.25Å; R365-E369 VanDerWaalsContact NE-OE1 3.1Å; R365-E369 IonicContact NH2-OE1 3.54Å; R365-E369 WeakPolarHBondContact O-CG 3.4Å; R365-E369 PolarHBondContact O-N 3.04Å; R365-E369 VanDerWaalsContact O-N 3.13Å; R365-H403 VanDerWaalsContact CG-CE1 3.45Å; R365-H403 WeakPolarHBondContact CG-CE1 3.38Å
366	V	89.2	Confident	87.3	Confident	85 Å²	85	75.9 Å²	75.9	52%	0.515	38%	0.384	S	S	.	.	H	α-helix	trans	-70.9	-43	-176.6	-178.4	0	0	0	0	110.3	N364 A368 E369 D370	N364-V366 VanDerWaalsContact C-N 3.3Å; N364-V366 PolarHBondContact O-N 3.28Å; N364-V366 WeakPolarHBondContact OD1-CB 3.48Å; N364-V366 PolarHBondContact OD1-N 3.42Å; V366-A368 VanDerWaalsContact C-N 3.28Å; V366-A368 PolarHBondContact O-N 3.28Å; V366-E369 WeakPolarHBondContact O-CB 3.28Å; V366-E369 PolarHBondContact O-N 3.14Å; V366-E369 VanDerWaalsContact O-N 3.1Å; V366-D370 PolarHBondContact O-N 2.95Å
367	Q	88.2	Confident	87.4	Confident	86 Å²	86	71.4 Å²	71.4	40%	0.402	37%	0.368	S	S	.	.	H	α-helix	trans	-63	-34.8	175.7	-69.6	170	-43.9	0	0	112.4	I363 N364 D370 L371	I363-Q367 HydrophobicContact CB-CB 4.16Å; I363-Q367 HydrophobicContact CG2-CB 4.43Å; N364-Q367 VanDerWaalsContact CG-OE1 3.25Å; N364-Q367 PolarHBondContact ND2-OE1 3.32Å; N364-Q367 PolarHBondContact O-N 3.48Å; N364-Q367 WeakPolarHBondContact OD1-CG 3.41Å; N364-Q367 PolarHBondContact OD1-N 3.33Å; Q367-D370 PolarHBondContact O-N 2.93Å; Q367-L371 WeakPolarHBondContact O-CG 3.22Å; Q367-L371 PolarHBondContact O-N 3.03Å
368	A	89.5	Confident	87.4	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-66.9	-38.5	173.4	0	0	0	0	0	112.3	I363 N364 R365 V366 L371 L372 L381	I363-A368 HydrophobicContact CD1-CB 4.08Å; N364-A368 PolarHBondContact O-N 3.35Å; R365-A368 PolarHBondContact O-N 2.83Å; V366-A368 VanDerWaalsContact C-N 3.28Å; V366-A368 PolarHBondContact O-N 3.28Å; A368-L371 PolarHBondContact O-N 3.41Å; A368-L372 WeakPolarHBondContact O-CB 3.42Å; A368-L372 WeakPolarHBondContact O-CG 3.03Å; A368-L372 PolarHBondContact O-N 3.07Å; A368-L372 VanDerWaalsContact O-N 3.14Å; A368-L381 HydrophobicContact CB-CD1 4.04Å; A368-L381 HydrophobicContact CB-CD2 4.26Å
369	E	91.9	Very high	87.5	Confident	61 Å²	61	70.7 Å²	70.7	29%	0.285	36%	0.364	S	S	.	.	H	α-helix	trans	-64	-41.6	174.5	-71	166.4	-174.3	0	0	110.9	R365 V366 L372 Y373 V401 H403	R365-E369 IonicContact CZ-OE1 4Å; R365-E369 IonicContact NE-OE1 2.81Å; R365-E369 PolarHBondContact NE-OE1 3.25Å; R365-E369 VanDerWaalsContact NE-OE1 3.1Å; R365-E369 IonicContact NH2-OE1 3.54Å; R365-E369 WeakPolarHBondContact O-CG 3.4Å; R365-E369 PolarHBondContact O-N 3.04Å; R365-E369 VanDerWaalsContact O-N 3.13Å; V366-E369 WeakPolarHBondContact O-CB 3.28Å; V366-E369 PolarHBondContact O-N 3.14Å; V366-E369 VanDerWaalsContact O-N 3.1Å; E369-L372 PolarHBondContact O-N 2.81Å; E369-Y373 WeakPolarHBondContact O-CB 3.42Å; E369-Y373 PolarHBondContact O-N 3.31Å; E369-V401 HydrophobicContact CG-CB 4.06Å; E369-V401 HydrophobicContact CG-CG1 3.94Å; E369-H403 WeakPolarHBondContact CG-NE2 3.04Å; E369-H403 IonicContact OE1-CD2 3.05Å; E369-H403 IonicContact OE1-CE1 2.71Å; E369-H403 IonicContact OE1-NE2 3.66Å; E369-H403 PolarHBondContact OE1-NE2 3.11Å
370	D	90.9	Very high	87.6	Confident	113 Å²	113	68.9 Å²	68.9	60%	0.604	36%	0.356	S	S	*	.	H	α-helix	trans	-63.5	-41.6	176.1	-68.3	-27.6	0	0	0	112.8	V366 Q367 L372 Y373	V366-D370 PolarHBondContact O-N 2.95Å; Q367-D370 PolarHBondContact O-N 2.93Å; D370-L372 VanDerWaalsContact C-N 3.32Å; D370-L372 PolarHBondContact O-N 3.43Å; D370-Y373 WeakPolarHBondContact O-CB 3.22Å; D370-Y373 PolarHBondContact O-N 2.67Å
371	L	88.2	Confident	87.8	Confident	69 Å²	69	67.7 Å²	67.7	36%	0.361	35%	0.349	S	S	.	.	H	α-helix	trans	-68.7	-31.1	178.9	-75.4	172.4	0	0	0	113.2	I363 Q367 A368 L381 V452	I363-L371 HydrophobicContact CD1-CD1 4.12Å; Q367-L371 WeakPolarHBondContact O-CG 3.22Å; Q367-L371 PolarHBondContact O-N 3.03Å; A368-L371 PolarHBondContact O-N 3.41Å; L371-L381 HydrophobicContact CB-CD2 4.28Å; L371-L381 HydrophobicContact CD1-CD2 4.18Å; L371-V452 HydrophobicContact CB-CG2 4.28Å
372	L	89.7	Confident	88.6	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-92.7	-5.7	179.5	-67.5	175.1	0	0	0	112.9	A368 E369 D370 G374 K375 A379 L381 V396 V401 V452	A368-L372 WeakPolarHBondContact O-CB 3.42Å; A368-L372 WeakPolarHBondContact O-CG 3.03Å; A368-L372 PolarHBondContact O-N 3.07Å; A368-L372 VanDerWaalsContact O-N 3.14Å; E369-L372 PolarHBondContact O-N 2.81Å; D370-L372 VanDerWaalsContact C-N 3.32Å; D370-L372 PolarHBondContact O-N 3.43Å; L372-G374 PolarHBondContact O-N 2.91Å; L372-K375 WeakPolarHBondContact O-CB 3.4Å; L372-K375 WeakPolarHBondContact O-CG 3.5Å; L372-K375 PolarHBondContact O-N 2.97Å; L372-A379 HydrophobicContact CD2-CB 4.13Å; L372-L381 HydrophobicContact CD1-CD2 4.36Å; L372-L381 HydrophobicContact CD1-CG 4.28Å; L372-L381 HydrophobicContact CG-CD2 4.21Å; L372-V396 HydrophobicContact CB-CG2 3.8Å; L372-V396 HydrophobicContact CD1-CG2 4.46Å; L372-V396 HydrophobicContact CD2-CG2 4.27Å; L372-V396 HydrophobicContact CG-CG2 4.4Å; L372-V401 HydrophobicContact CB-CG1 4.47Å; L372-V401 HydrophobicContact CB-CG2 3.76Å; L372-V401 HydrophobicContact CD1-CG1 3.84Å; L372-V452 HydrophobicContact CD2-CG2 4.26Å
373	Y	88.3	Confident	89.2	Confident	196 Å²	196	55.7 Å²	55.7	77%	0.769	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	125.8	179.4	-171.8	-97.6	0	0	0	111.4	E369 D370 K375	E369-Y373 WeakPolarHBondContact O-CB 3.42Å; E369-Y373 PolarHBondContact O-N 3.31Å; D370-Y373 WeakPolarHBondContact O-CB 3.22Å; D370-Y373 PolarHBondContact O-N 2.67Å; Y373-K375 VanDerWaalsContact C-N 3.26Å; Y373-K375 PolarHBondContact O-N 3.04Å
374	G	82.2	Confident	89.3	Confident	78 Å²	78	59.1 Å²	59.1	80%	0.804	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	11.4	179.8	0	0	0	0	0	115.4	L372	L372-G374 PolarHBondContact O-N 2.91Å
375	K	88	Confident	89.1	Confident	86 Å²	86	56.4 Å²	56.4	37%	0.374	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-83.5	156.4	172.9	-61.1	-66.5	-178.3	-177.8	0	111.1	L372 Y373 A379 V396 M456	L372-K375 WeakPolarHBondContact O-CB 3.4Å; L372-K375 WeakPolarHBondContact O-CG 3.5Å; L372-K375 PolarHBondContact O-N 2.97Å; Y373-K375 VanDerWaalsContact C-N 3.26Å; Y373-K375 PolarHBondContact O-N 3.04Å; K375-A379 HydrophobicContact CB-CB 3.62Å; K375-A379 HydrophobicContact CG-CB 4.44Å; K375-V396 HydrophobicContact CB-CG2 4.37Å; K375-M456 HydrophobicContact CD-CE 3.98Å
376	P	87.8	Confident	88.6	Confident	47 Å²	47	55.3 Å²	55.3	31%	0.305	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-67.7	158.8	176.7	29.4	-36.5	0	0	0	112.2	G378 A379 Y450 M456	P376-G378 PolarHBondContact O-N 3.11Å; P376-A379 WeakPolarHBondContact O-CB 3.41Å; P376-A379 PolarHBondContact O-N 2.81Å; P376-A379 VanDerWaalsContact O-N 3.08Å; P376-Y450 HydrophobicContact CG-CD2 4.06Å; P376-Y450 HydrophobicContact CG-CE2 4.29Å; P376-M456 HydrophobicContact CG-CE 3.71Å; P376-M456 HydrophobicContact CG-SD 3.8Å
377	D	87.4	Confident	88.1	Confident	74 Å²	74	57.3 Å²	57.3	40%	0.396	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	136.5	172.8	-75.7	5.7	0	0	0	111.3	D398 G399 V446	D377-D398 PolarHBondContact OD1-N 3.47Å; D377-D398 PolarHBondContact OD2-N 2.98Å; D377-D398 VanDerWaalsContact OD2-N 3.11Å; D377-G399 PolarHBondContact OD1-N 2.94Å; D377-V446 HydrophobicContact CB-CG1 4.39Å
378	G	85.4	Confident	87.4	Confident	2 Å²	2	63.4 Å²	63.4	2%	0.021	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	-0.4	-173.1	0	0	0	0	0	114.8	P376 V396 R447 A449 Y450	P376-G378 PolarHBondContact O-N 3.11Å; G378-V396 PolarHBondContact N-O 3.03Å; G378-R447 WeakPolarHBondContact CA-O 3.33Å; G378-A449 PolarHBondContact O-N 3.05Å; G378-Y450 PolarHBondContact O-N 2.94Å; G378-Y450 VanDerWaalsContact O-N 3.09Å
379	A	91.3	Very high	86.7	Confident	1 Å²	1	66 Å²	66	1%	0.008	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	131.4	166.7	0	0	0	0	0	110.8	L372 K375 P376 V395 V396 Y450 M456	L372-A379 HydrophobicContact CD2-CB 4.13Å; K375-A379 HydrophobicContact CB-CB 3.62Å; K375-A379 HydrophobicContact CG-CB 4.44Å; P376-A379 WeakPolarHBondContact O-CB 3.41Å; P376-A379 PolarHBondContact O-N 2.81Å; P376-A379 VanDerWaalsContact O-N 3.08Å; A379-V395 CarbonylContact O-C 3.46Å; A379-V395 WeakPolarHBondContact O-CA 3.31Å; A379-V396 HydrophobicContact CB-CG2 4.1Å; A379-V396 PolarHBondContact O-N 3.09Å; A379-Y450 CarbonylContact C-O 3.55Å; A379-Y450 VanDerWaalsContact CA-O 3.29Å; A379-Y450 WeakPolarHBondContact CA-O 3.42Å; A379-M456 HydrophobicContact CB-CE 4.27Å
380	F	94.4	Very high	86.4	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	160.5	-172	81.4	-78.6	0	0	0	114.1	H352 W358 S394 V395 V429 L448 Y450 P451 V452	H352-F380 AromaticContact CD2-CE1 3.74Å; H352-F380 AromaticContact CD2-CZ 3.83Å; H352-F380 AromaticContact NE2-CE1 3.76Å; W358-F380 HydrophobicContact CB-CD2 4.28Å; W358-F380 HydrophobicContact CB-CE2 3.47Å; W358-F380 VanDerWaalsContact CB-CE2 3.47Å; W358-F380 HydrophobicContact CB-CZ 3.62Å; W358-F380 HydrophobicContact CD2-CE2 4.38Å; W358-F380 AromaticContact CG-CE2 3.92Å; W358-F380 HydrophobicContact CG-CE2 3.92Å; W358-F380 AromaticContact CG-CZ 3.94Å; W358-F380 HydrophobicContact CG-CZ 3.94Å; F380-S394 CarbonylContact C-O 3.52Å; F380-S394 VanDerWaalsContact CA-O 3.23Å; F380-S394 WeakPolarHBondContact CA-O 3.47Å; F380-V395 HydrophobicContact CB-CB 4.08Å; F380-V395 HydrophobicContact CB-CG2 4.03Å; F380-V429 HydrophobicContact CE2-CG1 3.86Å; F380-V429 HydrophobicContact CE2-CG2 3.98Å; F380-V429 HydrophobicContact CZ-CG1 3.52Å; F380-V429 HydrophobicContact CZ-CG2 4.49Å; F380-L448 HydrophobicContact CB-CD2 3.71Å; F380-L448 HydrophobicContact CD1-CB 3.68Å; F380-L448 HydrophobicContact CD1-CD2 4.23Å; F380-L448 HydrophobicContact CD1-CG 4.48Å; F380-L448 HydrophobicContact CD2-CB 4.17Å; F380-L448 HydrophobicContact CD2-CD1 4.12Å; F380-L448 HydrophobicContact CD2-CD2 3.87Å; F380-L448 HydrophobicContact CD2-CG 4.27Å; F380-L448 HydrophobicContact CE1-CB 3.69Å; F380-L448 HydrophobicContact CE2-CB 4.18Å; F380-L448 HydrophobicContact CE2-CD1 4.12Å; F380-L448 HydrophobicContact CG-CB 3.94Å; F380-L448 HydrophobicContact CG-CD2 3.67Å; F380-L448 HydrophobicContact CG-CG 4.26Å; F380-L448 HydrophobicContact CZ-CB 3.96Å; F380-Y450 WeakPolarHBondContact CD1-O 3.23Å; F380-Y450 PolarHBondContact N-O 3.08Å; F380-P451 HydrophobicContact CE1-CB 4.34Å; F380-P451 HydrophobicContact CE1-CG 3.89Å; F380-P451 HydrophobicContact CZ-CB 4.49Å; F380-P451 HydrophobicContact CZ-CG 4.13Å; F380-V452 PolarHBondContact O-N 3.07Å
381	L	93.1	Very high	86.4	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	156.3	166	63.8	79.7	0	0	0	110.5	W358 V360 I363 A368 L371 L372 R383 S394 V452	W358-L381 CarbonylContact O-C 3.58Å; W358-L381 WeakPolarHBondContact O-CA 3.33Å; W358-L381 WeakPolarHBondContact O-CB 3.09Å; V360-L381 HydrophobicContact CG2-CB 4.41Å; I363-L381 HydrophobicContact CD1-CD1 3.62Å; I363-L381 HydrophobicContact CD1-CD2 3.8Å; I363-L381 HydrophobicContact CD1-CG 4.36Å; A368-L381 HydrophobicContact CB-CD1 4.04Å; A368-L381 HydrophobicContact CB-CD2 4.26Å; L371-L381 HydrophobicContact CB-CD2 4.28Å; L371-L381 HydrophobicContact CD1-CD2 4.18Å; L372-L381 HydrophobicContact CD1-CD2 4.36Å; L372-L381 HydrophobicContact CD1-CG 4.28Å; L372-L381 HydrophobicContact CG-CD2 4.21Å; L381-R383 HydrophobicContact CD1-CB 4.15Å; L381-R383 HydrophobicContact CD1-CG 4.21Å; L381-S394 PolarHBondContact N-O 2.84Å; L381-S394 PolarHBondContact O-N 3.5Å; L381-V452 HydrophobicContact CB-CB 4.09Å; L381-V452 HydrophobicContact CB-CG1 3.75Å; L381-V452 HydrophobicContact CD2-CB 4.36Å; L381-V452 HydrophobicContact CD2-CG1 4.29Å; L381-V452 HydrophobicContact CD2-CG2 4.21Å
382	I	94	Very high	86.5	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131	171.7	-62.1	179.9	0	0	0	108	W358 F359 V360 Y391 A392 C393 I406 L425 V429	W358-I382 HydrophobicContact CE3-CB 4.03Å; W358-I382 HydrophobicContact CE3-CD1 3.86Å; W358-I382 HydrophobicContact CE3-CG1 4.09Å; W358-I382 HydrophobicContact CZ3-CB 4.2Å; W358-I382 HydrophobicContact CZ3-CD1 3.77Å; W358-I382 HydrophobicContact CZ3-CG1 4.35Å; W358-I382 PolarHBondContact O-N 3.03Å; F359-I382 CarbonylContact C-O 3.58Å; F359-I382 WeakPolarHBondContact CA-O 3.42Å; F359-I382 HydrophobicContact CD2-CB 4.14Å; F359-I382 HydrophobicContact CD2-CG2 3.97Å; F359-I382 WeakPolarHBondContact CD2-O 3.42Å; F359-I382 HydrophobicContact CE2-CG2 4.17Å; V360-I382 PolarHBondContact N-O 3.1Å; I382-Y391 HydrophobicContact CG2-CD1 4.45Å; I382-A392 WeakPolarHBondContact CA-O 3.44Å; I382-C393 HydrophobicContact CG1-CB 4.35Å; I382-I406 HydrophobicContact CD1-CD1 3.73Å; I382-I406 HydrophobicContact CG1-CD1 4.18Å; I382-I406 HydrophobicContact CG2-CD1 4.16Å; I382-L425 HydrophobicContact CG2-CD1 4.39Å; I382-V429 HydrophobicContact CD1-CG2 3.41Å; I382-V429 VanDerWaalsContact CD1-CG2 3.41Å
383	R	91.3	Very high	86.6	Confident	14 Å²	14	58 Å²	58	5%	0.053	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	163.5	-179.5	62	-177.1	177.4	77.8	1.8	111.6	V360 I363 L381 S385 A392 S394 H403	V360-R383 VanDerWaalsContact O-CA 3.23Å; V360-R383 WeakPolarHBondContact O-CA 3.4Å; V360-R383 VanDerWaalsContact O-CB 3.31Å; V360-R383 WeakPolarHBondContact O-CB 3.35Å; I363-R383 HydrophobicContact CD1-CB 4.12Å; I363-R383 HydrophobicContact CG1-CB 3.63Å; I363-R383 HydrophobicContact CG1-CG 4.39Å; I363-R383 WeakPolarHBondContact O-CD 3.39Å; L381-R383 HydrophobicContact CD1-CB 4.15Å; L381-R383 HydrophobicContact CD1-CG 4.21Å; R383-S385 PolarHBondContact O-N 3.39Å; R383-A392 HydrophobicContact CG-CB 4.05Å; R383-A392 PolarHBondContact N-O 3.15Å; R383-A392 PolarHBondContact O-N 3.32Å; R383-S394 PolarHBondContact NE-OG 2.92Å; R383-H403 PolarHBondContact NH2-ND1 3.47Å
384	E	88.1	Confident	86.8	Confident	99 Å²	99	48.7 Å²	48.7	46%	0.463	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	136.6	170.2	-67.6	-157.8	158.1	0	0	110.8	Y391	E384-Y391 HydrophobicContact CG-CE1 4.28Å
385	S	83.2	Confident	87.3	Confident	25 Å²	25	45 Å²	45	18%	0.175	24%	0.243	C	C	.	.			trans	-81.3	151.2	174.4	-167.7	0	0	0	0	109.8	R383 K387 C390	R383-S385 PolarHBondContact O-N 3.39Å; S385-K387 PolarHBondContact O-N 2.84Å; S385-K387 PolarHBondContact OG-N 3.28Å; S385-C390 WeakPolarHBondContact CB-O 3.24Å; S385-C390 PolarHBondContact N-O 2.8Å; S385-C390 VanDerWaalsContact N-O 3.1Å
386	S	78.3	Confident	87.5	Confident	124 Å²	124	41 Å²	41	87%	0.867	23%	0.226	S	C	*	.	S	Bend	trans	-63.2	-11	168.6	-45.1	0	0	0	0	112.7
387	K	79	Confident	87.5	Confident	126 Å²	126	38.8 Å²	38.8	55%	0.548	21%	0.211	S	C	.	.	S	Bend	trans	-91.7	123.7	172	-65.7	-178.8	175.3	178.4	0	109.9	S385 G389 C390	S385-K387 PolarHBondContact O-N 2.84Å; S385-K387 PolarHBondContact OG-N 3.28Å; K387-G389 PolarHBondContact O-N 3.26Å; K387-C390 HydrophobicContact CB-CB 4.14Å; K387-C390 PolarHBondContact O-N 2.89Å; K387-C390 VanDerWaalsContact O-N 3.15Å
388	K	74.3	Confident	87.4	Confident	215 Å²	215	40.8 Å²	40.8	94%	0.935	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	128.3	177.3	-73.1	-170.1	175.7	-174.1	0	111.1
389	G	73.4	Confident	87.1	Confident	55 Å²	55	43.6 Å²	43.6	57%	0.567	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	17.5	178.4	0	0	0	0	0	114.7	K387 S408	K387-G389 PolarHBondContact O-N 3.26Å; G389-S408 VanDerWaalsContact O-CB 3.22Å; G389-S408 WeakPolarHBondContact O-CB 3.16Å
390	C	86.2	Confident	86.9	Confident	22 Å²	22	50 Å²	50	15%	0.149	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	155.1	172.8	-65.4	0	0	0	0	110.3	S385 K387 V405	S385-C390 WeakPolarHBondContact CB-O 3.24Å; S385-C390 PolarHBondContact N-O 2.8Å; S385-C390 VanDerWaalsContact N-O 3.1Å; K387-C390 HydrophobicContact CB-CB 4.14Å; K387-C390 PolarHBondContact O-N 2.89Å; K387-C390 VanDerWaalsContact O-N 3.15Å; C390-V405 HydrophobicContact CB-CG1 4.13Å
391	Y	90.7	Very high	86.7	Confident	49 Å²	49	51.7 Å²	51.7	19%	0.192	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	162.4	171.7	-63.2	-88.6	0	0	0	110	F359 I382 E384 I406 Y413 L425	F359-Y391 AromaticContact CE2-CD1 3.84Å; F359-Y391 HydrophobicContact CE2-CD1 3.84Å; F359-Y391 AromaticContact CE2-CE1 3.77Å; F359-Y391 HydrophobicContact CE2-CE1 3.77Å; F359-Y391 HydrophobicContact CZ-CD1 4.31Å; F359-Y391 AromaticContact CZ-CE1 3.79Å; F359-Y391 HydrophobicContact CZ-CE1 3.79Å; I382-Y391 HydrophobicContact CG2-CD1 4.45Å; E384-Y391 HydrophobicContact CG-CE1 4.28Å; Y391-I406 PolarHBondContact N-O 3.1Å; Y391-I406 PolarHBondContact O-N 3.2Å; Y391-Y413 HydrophobicContact CD2-CD1 4.39Å; Y391-Y413 HydrophobicContact CD2-CE1 4.09Å; Y391-Y413 AromaticContact CE2-CE1 3.78Å; Y391-Y413 HydrophobicContact CE2-CE1 3.78Å; Y391-L425 HydrophobicContact CD1-CD1 3.85Å; Y391-L425 HydrophobicContact CD2-CD1 3.93Å; Y391-L425 HydrophobicContact CD2-CD2 4.07Å; Y391-L425 HydrophobicContact CD2-CG 4.44Å; Y391-L425 HydrophobicContact CE1-CD1 3.87Å; Y391-L425 HydrophobicContact CE2-CD1 3.97Å; Y391-L425 HydrophobicContact CG-CD1 3.87Å; Y391-L425 HydrophobicContact CG-CD2 4.24Å
392	A	90.3	Very high	86.5	Confident	5 Å²	5	53.9 Å²	53.9	4%	0.041	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.3	173.5	0	0	0	0	0	109.4	I382 R383 C404	I382-A392 WeakPolarHBondContact CA-O 3.44Å; R383-A392 HydrophobicContact CG-CB 4.05Å; R383-A392 PolarHBondContact N-O 3.15Å; R383-A392 PolarHBondContact O-N 3.32Å; A392-C404 CarbonylContact C-O 3.53Å; A392-C404 WeakPolarHBondContact CA-O 3.22Å
393	C	91.9	Very high	86.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	118.2	169.6	-172.7	0	0	0	0	108.8	I382 H403 C404 I406 F415	I382-C393 HydrophobicContact CG1-CB 4.35Å; C393-H403 CarbonylContact O-C 3.4Å; C393-H403 WeakPolarHBondContact O-CA 3.38Å; C393-C404 HydrophobicContact CB-CB 4.36Å; C393-C404 PolarHBondContact N-O 3.26Å; C393-C404 PolarHBondContact O-N 3.19Å; C393-I406 HydrophobicContact CB-CD1 3.94Å; C393-I406 HydrophobicContact CB-CG1 4.26Å; C393-F415 HydrophobicContact CB-CE1 3.71Å; C393-F415 HydrophobicContact CB-CZ 4.06Å
394	S	92.5	Very high	86.2	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.5	172.1	-61.1	0	0	0	0	108.1	F380 L381 R383 K402 H403	F380-S394 CarbonylContact C-O 3.52Å; F380-S394 VanDerWaalsContact CA-O 3.23Å; F380-S394 WeakPolarHBondContact CA-O 3.47Å; L381-S394 PolarHBondContact N-O 2.84Å; L381-S394 PolarHBondContact O-N 3.5Å; R383-S394 PolarHBondContact NE-OG 2.92Å; S394-K402 WeakPolarHBondContact CA-O 3.32Å; S394-H403 PolarHBondContact OG-CE1 3.09Å; S394-H403 VanDerWaalsContact OG-CE1 3.25Å; S394-H403 PolarHBondContact OG-ND1 2.9Å
395	V	92.8	Very high	86.2	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	140.3	-174.6	61.9	0	0	0	0	111.1	A379 F380 K402 L437 L444 V446 L448	A379-V395 CarbonylContact O-C 3.46Å; A379-V395 WeakPolarHBondContact O-CA 3.31Å; F380-V395 HydrophobicContact CB-CB 4.08Å; F380-V395 HydrophobicContact CB-CG2 4.03Å; V395-K402 PolarHBondContact N-O 2.94Å; V395-K402 PolarHBondContact O-N 2.98Å; V395-L437 HydrophobicContact CG1-CD1 4.29Å; V395-L444 HydrophobicContact CG1-CD2 4.3Å; V395-V446 HydrophobicContact CG1-CG2 4.49Å; V395-V446 HydrophobicContact CG2-CG2 3.88Å; V395-L448 HydrophobicContact CB-CD2 4.39Å; V395-L448 HydrophobicContact CG2-CD2 4.14Å
396	V	91.3	Very high	86.6	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.024	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	125.1	173.8	-174.1	0	0	0	0	109.6	L372 K375 G378 A379 E400 V401	L372-V396 HydrophobicContact CB-CG2 3.8Å; L372-V396 HydrophobicContact CD1-CG2 4.46Å; L372-V396 HydrophobicContact CD2-CG2 4.27Å; L372-V396 HydrophobicContact CG-CG2 4.4Å; K375-V396 HydrophobicContact CB-CG2 4.37Å; G378-V396 PolarHBondContact N-O 3.03Å; A379-V396 HydrophobicContact CB-CG2 4.1Å; A379-V396 PolarHBondContact O-N 3.09Å; V396-E400 WeakPolarHBondContact CA-O 3.22Å; V396-V401 HydrophobicContact CG2-CG2 4.27Å
397	A	88	Confident	87	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	128.3	174.7	0	0	0	0	0	110.7	G399 E400 K402 L444 V446	A397-G399 PolarHBondContact O-N 3.28Å; A397-E400 PolarHBondContact N-O 2.9Å; A397-E400 PolarHBondContact O-N 3Å; A397-K402 HydrophobicContact CB-CD 4.05Å; A397-K402 PolarHBondContact O-NZ 2.98Å; A397-L444 HydrophobicContact CB-CD2 4.44Å; A397-V446 HydrophobicContact CB-CB 4.29Å; A397-V446 HydrophobicContact CB-CG1 3.57Å; A397-V446 HydrophobicContact CB-CG2 3.7Å
398	D	84.9	Confident	87.3	Confident	115 Å²	115	48 Å²	48	62%	0.615	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.8	34.6	-175.5	-47.1	-58	0	0	0	112.3	D377 E400 K402	D377-D398 PolarHBondContact OD1-N 3.47Å; D377-D398 PolarHBondContact OD2-N 2.98Å; D377-D398 VanDerWaalsContact OD2-N 3.11Å; D398-E400 PolarHBondContact O-N 3.27Å; D398-K402 IonicContact OD2-NZ 3.66Å; D398-K402 PolarHBondContact OD2-NZ 3.5Å
399	G	80.9	Confident	87.7	Confident	62 Å²	62	39.8 Å²	39.8	64%	0.639	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.2	1.4	-176.9	0	0	0	0	0	115.9	D377 A397	D377-G399 PolarHBondContact OD1-N 2.94Å; A397-G399 PolarHBondContact O-N 3.28Å
400	E	86.6	Confident	88.1	Confident	136 Å²	136	42.9 Å²	42.9	64%	0.636	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	146.2	176.4	-65.5	-170.2	159	0	0	112.1	V396 A397 D398 K402	V396-E400 WeakPolarHBondContact CA-O 3.22Å; A397-E400 PolarHBondContact N-O 2.9Å; A397-E400 PolarHBondContact O-N 3Å; D398-E400 PolarHBondContact O-N 3.27Å; E400-K402 PolarHBondContact O-N 3.47Å
401	V	89.6	Confident	87.7	Confident	35 Å²	35	50.2 Å²	50.2	21%	0.212	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	115.4	176.6	-177.1	0	0	0	0	110	E369 L372 V396	E369-V401 HydrophobicContact CG-CB 4.06Å; E369-V401 HydrophobicContact CG-CG1 3.94Å; L372-V401 HydrophobicContact CB-CG1 4.47Å; L372-V401 HydrophobicContact CB-CG2 3.76Å; L372-V401 HydrophobicContact CD1-CG1 3.84Å; V396-V401 HydrophobicContact CG2-CG2 4.27Å
402	K	89.3	Confident	87.5	Confident	46 Å²	46	48.3 Å²	48.3	20%	0.2	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	147.2	177	-65.3	176.2	-174.5	151	0	110.3	S394 V395 A397 D398 E400 S443 L444	S394-K402 WeakPolarHBondContact CA-O 3.32Å; V395-K402 PolarHBondContact N-O 2.94Å; V395-K402 PolarHBondContact O-N 2.98Å; A397-K402 HydrophobicContact CB-CD 4.05Å; A397-K402 PolarHBondContact O-NZ 2.98Å; D398-K402 IonicContact OD2-NZ 3.66Å; D398-K402 PolarHBondContact OD2-NZ 3.5Å; E400-K402 PolarHBondContact O-N 3.47Å; K402-S443 PolarHBondContact NZ-O 3.13Å; K402-L444 HydrophobicContact CB-CD2 3.66Å; K402-L444 HydrophobicContact CD-CD2 3.41Å; K402-L444 VanDerWaalsContact CD-CD2 3.41Å; K402-L444 HydrophobicContact CD-CG 4.47Å; K402-L444 HydrophobicContact CG-CD2 4.13Å
403	H	89.8	Confident	87.3	Confident	46 Å²	46	50.5 Å²	50.5	21%	0.213	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	123.5	-175.7	-58.7	-99	0	0	0	110.7	R365 E369 R383 C393 S394	R365-H403 VanDerWaalsContact CG-CE1 3.45Å; R365-H403 WeakPolarHBondContact CG-CE1 3.38Å; E369-H403 WeakPolarHBondContact CG-NE2 3.04Å; E369-H403 IonicContact OE1-CD2 3.05Å; E369-H403 IonicContact OE1-CE1 2.71Å; E369-H403 IonicContact OE1-NE2 3.66Å; E369-H403 PolarHBondContact OE1-NE2 3.11Å; R383-H403 PolarHBondContact NH2-ND1 3.47Å; C393-H403 CarbonylContact O-C 3.4Å; C393-H403 WeakPolarHBondContact O-CA 3.38Å; S394-H403 PolarHBondContact OG-CE1 3.09Å; S394-H403 VanDerWaalsContact OG-CE1 3.25Å; S394-H403 PolarHBondContact OG-ND1 2.9Å
404	C	88.4	Confident	87.1	Confident	21 Å²	21	50.5 Å²	50.5	14%	0.142	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.2	-179.8	-53.6	0	0	0	0	110.1	A392 C393 F415 L444	A392-C404 CarbonylContact C-O 3.53Å; A392-C404 WeakPolarHBondContact CA-O 3.22Å; C393-C404 HydrophobicContact CB-CB 4.36Å; C393-C404 PolarHBondContact N-O 3.26Å; C393-C404 PolarHBondContact O-N 3.19Å; C404-F415 HydrophobicContact CB-CD1 3.74Å; C404-F415 HydrophobicContact CB-CE1 3.7Å; C404-L444 WeakPolarHBondContact SG-CD1 3.38Å
405	V	88.7	Confident	86.7	Confident	45 Å²	45	51.4 Å²	51.4	27%	0.273	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	130.3	174.9	-178.2	0	0	0	0	108.8	C390 Y407	C390-V405 HydrophobicContact CB-CG1 4.13Å; V405-Y407 HydrophobicContact CB-CE2 4.48Å; V405-Y407 HydrophobicContact CG1-CD1 4.33Å; V405-Y407 HydrophobicContact CG1-CE1 4.02Å; V405-Y407 HydrophobicContact CG1-CE2 4.35Å
406	I	90.6	Very high	86.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120	167.9	-59	168.5	0	0	0	107.3	I382 Y391 C393 Y413 G414 F415 L425 L428	I382-I406 HydrophobicContact CD1-CD1 3.73Å; I382-I406 HydrophobicContact CG1-CD1 4.18Å; I382-I406 HydrophobicContact CG2-CD1 4.16Å; Y391-I406 PolarHBondContact N-O 3.1Å; Y391-I406 PolarHBondContact O-N 3.2Å; C393-I406 HydrophobicContact CB-CD1 3.94Å; C393-I406 HydrophobicContact CB-CG1 4.26Å; I406-Y413 HydrophobicContact CG2-CD1 4.32Å; I406-G414 CarbonylContact C-O 3.48Å; I406-G414 WeakPolarHBondContact CA-O 3.49Å; I406-F415 HydrophobicContact CD1-CE1 4.04Å; I406-F415 HydrophobicContact CD1-CZ 4.21Å; I406-F415 HydrophobicContact CG1-CD1 3.84Å; I406-F415 HydrophobicContact CG1-CE1 3.4Å; I406-F415 HydrophobicContact CG1-CZ 3.98Å; I406-L425 HydrophobicContact CD1-CD2 4.14Å; I406-L425 HydrophobicContact CG2-CD2 3.86Å; I406-L428 HydrophobicContact CD1-CD2 4.21Å; I406-L428 HydrophobicContact CG2-CD1 3.85Å
407	Y	87.8	Confident	85.2	Confident	98 Å²	98	60.4 Å²	60.4	38%	0.384	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	129.7	177.5	-62.7	-80.1	0	0	0	109.8	V405 Y413 G414 F415	V405-Y407 HydrophobicContact CB-CE2 4.48Å; V405-Y407 HydrophobicContact CG1-CD1 4.33Å; V405-Y407 HydrophobicContact CG1-CE1 4.02Å; V405-Y407 HydrophobicContact CG1-CE2 4.35Å; Y407-Y413 WeakPolarHBondContact O-CA 3.45Å; Y407-G414 PolarHBondContact N-O 2.8Å; Y407-G414 PolarHBondContact O-N 2.86Å; Y407-F415 WeakPolarHBondContact CE2-O 3.23Å
408	S	86.3	Confident	84.4	Confident	53 Å²	53	64.2 Å²	64.2	37%	0.371	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	114.8	166.1	-171.1	0	0	0	0	108.1	G389 Y413	G389-S408 VanDerWaalsContact O-CB 3.22Å; G389-S408 WeakPolarHBondContact O-CB 3.16Å; S408-Y413 WeakPolarHBondContact OG-CE1 3.42Å
409	T	82.6	Confident	83.8	Confident	44 Å²	44	65 Å²	65	27%	0.27	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	166.2	179.2	71.1	0	0	0	0	110.3	R411 G412 N420	T409-R411 PolarHBondContact O-N 2.81Å; T409-R411 VanDerWaalsContact O-N 3.11Å; T409-R411 PolarHBondContact OG1-N 2.78Å; T409-G412 PolarHBondContact N-O 3.05Å; T409-G412 PolarHBondContact O-N 3.44Å; T409-G412 PolarHBondContact OG1-N 3.46Å; T409-G412 PolarHBondContact OG1-O 2.84Å; T409-N420 HydrophobicContact CG2-CB 4.39Å; T409-N420 WeakPolarHBondContact CG2-ND2 3.29Å
410	A	80.6	Confident	83.6	Confident	119 Å²	119	62.3 Å²	62.3	98%	0.983	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-19.6	175.2	0	0	0	0	0	113.6
411	R	78.1	Confident	83.3	Confident	177 Å²	177	60.7 Å²	60.7	67%	0.668	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-15.6	177.2	-66.6	-177.6	65	-173.3	-2.3	113.4	T409 N420	T409-R411 PolarHBondContact O-N 2.81Å; T409-R411 VanDerWaalsContact O-N 3.11Å; T409-R411 PolarHBondContact OG1-N 2.78Å; R411-N420 CarbonylContact C-O 3.51Å
412	G	85.7	Confident	83.1	Confident	8 Å²	8	60.4 Å²	60.4	8%	0.082	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	135.7	-167.7	-174.2	0	0	0	0	0	113.2	T409 Y422	T409-G412 PolarHBondContact N-O 3.05Å; T409-G412 PolarHBondContact O-N 3.44Å; T409-G412 PolarHBondContact OG1-N 3.46Å; T409-G412 PolarHBondContact OG1-O 2.84Å; G412-Y422 CarbonylContact C-O 3.41Å; G412-Y422 WeakPolarHBondContact CA-O 3.4Å
413	Y	86.7	Confident	82.9	Confident	52 Å²	52	62.7 Å²	62.7	20%	0.204	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	148.1	178.9	-60.8	-90.6	0	0	0	110.8	Y391 I406 Y407 S408 N420 L421 Y422 L425	Y391-Y413 HydrophobicContact CD2-CD1 4.39Å; Y391-Y413 HydrophobicContact CD2-CE1 4.09Å; Y391-Y413 AromaticContact CE2-CE1 3.78Å; Y391-Y413 HydrophobicContact CE2-CE1 3.78Å; I406-Y413 HydrophobicContact CG2-CD1 4.32Å; Y407-Y413 WeakPolarHBondContact O-CA 3.45Å; S408-Y413 WeakPolarHBondContact OG-CE1 3.42Å; Y413-N420 CarbonylContact O-C 3.47Å; Y413-N420 WeakPolarHBondContact O-CA 3.33Å; Y413-L421 PolarHBondContact O-N 2.94Å; Y413-Y422 PolarHBondContact N-O 3.19Å; Y413-Y422 VanDerWaalsContact O-CD2 3.3Å; Y413-Y422 WeakPolarHBondContact O-CD2 3.47Å; Y413-Y422 PolarHBondContact O-N 2.88Å; Y413-L425 HydrophobicContact CD1-CD2 3.59Å; Y413-L425 HydrophobicContact CD1-CG 3.98Å; Y413-L425 HydrophobicContact CE1-CD2 4.1Å; Y413-L425 HydrophobicContact CE1-CG 4.05Å; Y413-L425 HydrophobicContact CG-CD2 4.03Å; Y413-L425 HydrophobicContact CG-CG 4.36Å
414	G	86.9	Confident	82.8	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.6	169.2	174.4	0	0	0	0	0	113.6	I406 Y407 N420	I406-G414 CarbonylContact C-O 3.48Å; I406-G414 WeakPolarHBondContact CA-O 3.49Å; Y407-G414 PolarHBondContact N-O 2.8Å; Y407-G414 PolarHBondContact O-N 2.86Å; G414-N420 VanDerWaalsContact C-OD1 3.31Å; G414-N420 VanDerWaalsContact CA-OD1 3.22Å; G414-N420 WeakPolarHBondContact CA-OD1 3.48Å; G414-N420 PolarHBondContact O-OD1 3.2Å
415	F	84.8	Confident	82.8	Confident	18 Å²	18	62.4 Å²	62.4	8%	0.079	34%	0.339	C	S	.	.	S	Bend	trans	-84.8	-24.5	-179.8	-68.3	-70.4	0	0	0	113.5	C393 C404 I406 Y407 L428 Y432 L437 H440	C393-F415 HydrophobicContact CB-CE1 3.71Å; C393-F415 HydrophobicContact CB-CZ 4.06Å; C404-F415 HydrophobicContact CB-CD1 3.74Å; C404-F415 HydrophobicContact CB-CE1 3.7Å; I406-F415 HydrophobicContact CD1-CE1 4.04Å; I406-F415 HydrophobicContact CD1-CZ 4.21Å; I406-F415 HydrophobicContact CG1-CD1 3.84Å; I406-F415 HydrophobicContact CG1-CE1 3.4Å; I406-F415 HydrophobicContact CG1-CZ 3.98Å; Y407-F415 WeakPolarHBondContact CE2-O 3.23Å; F415-L428 HydrophobicContact CE2-CD2 3.8Å; F415-L428 HydrophobicContact CE2-CG 4.43Å; F415-L428 HydrophobicContact CZ-CD2 3.95Å; F415-Y432 HydrophobicContact CD2-CD2 4.14Å; F415-Y432 AromaticContact CD2-CE2 3.69Å; F415-Y432 HydrophobicContact CD2-CE2 3.69Å; F415-Y432 AromaticContact CE2-CD2 3.58Å; F415-Y432 HydrophobicContact CE2-CD2 3.58Å; F415-Y432 AromaticContact CE2-CE2 3.61Å; F415-Y432 HydrophobicContact CE2-CE2 3.61Å; F415-Y432 HydrophobicContact CE2-CG 4.18Å; F415-L437 HydrophobicContact CD2-CD2 3.87Å; F415-L437 HydrophobicContact CE2-CD2 3.42Å; F415-L437 VanDerWaalsContact CE2-CD2 3.42Å; F415-L437 HydrophobicContact CZ-CD2 3.94Å; F415-H440 HydrophobicContact CB-CB 4.4Å; F415-H440 AromaticContact CD2-CD2 3.98Å
416	A	80.8	Confident	82.7	Confident	36 Å²	36	63.1 Å²	63.1	30%	0.298	34%	0.338	S	S	.	.	S	Bend	trans	-158.7	149.2	179.4	0	0	0	0	0	111.6	Y419 N420	A416-Y419 CarbonylContact O-C 3.23Å; A416-Y419 WeakPolarHBondContact O-CA 3.4Å; A416-Y419 WeakPolarHBondContact O-CB 3.14Å; A416-Y419 PolarHBondContact O-N 2.93Å; A416-N420 PolarHBondContact O-OD1 2.93Å
417	E	71.3	Confident	82.5	Confident	157 Å²	157	67.2 Å²	67.2	73%	0.734	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	141.9	166.3	-74.4	-172.3	168.3	0	0	110.5	N420	E417-N420 WeakPolarHBondContact CG-ND2 3.25Å
418	P	71	Confident	82.5	Confident	81 Å²	81	62.5 Å²	62.5	53%	0.526	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.6	10.1	6.3	35.8	-37.1	0	0	0	115.3	N420	P418-N420 VanDerWaalsContact C-N 3.3Å; P418-N420 PolarHBondContact O-N 3.04Å
419	Y	73.4	Confident	82.7	Confident	130 Å²	130	60 Å²	60	51%	0.51	32%	0.321	S	S	.	.			trans	-88.5	24.4	-169.1	-54.3	-74.4	0	0	0	114.9	A416 L421	A416-Y419 CarbonylContact O-C 3.23Å; A416-Y419 WeakPolarHBondContact O-CA 3.4Å; A416-Y419 WeakPolarHBondContact O-CB 3.14Å; A416-Y419 PolarHBondContact O-N 2.93Å; Y419-L421 PolarHBondContact O-N 3.01Å
420	N	77.6	Confident	82.8	Confident	7 Å²	7	59.5 Å²	59.5	4%	0.037	32%	0.317	C	S	.	.			trans	-81.7	61.8	173.3	-60.7	-26.2	0	0	0	110.6	T409 R411 Y413 G414 A416 E417 P418	T409-N420 HydrophobicContact CG2-CB 4.39Å; T409-N420 WeakPolarHBondContact CG2-ND2 3.29Å; R411-N420 CarbonylContact C-O 3.51Å; Y413-N420 CarbonylContact O-C 3.47Å; Y413-N420 WeakPolarHBondContact O-CA 3.33Å; G414-N420 VanDerWaalsContact C-OD1 3.31Å; G414-N420 VanDerWaalsContact CA-OD1 3.22Å; G414-N420 WeakPolarHBondContact CA-OD1 3.48Å; G414-N420 PolarHBondContact O-OD1 3.2Å; A416-N420 PolarHBondContact O-OD1 2.93Å; E417-N420 WeakPolarHBondContact CG-ND2 3.25Å; P418-N420 VanDerWaalsContact C-N 3.3Å; P418-N420 PolarHBondContact O-N 3.04Å
421	L	79.7	Confident	83	Confident	102 Å²	102	57.2 Å²	57.2	53%	0.534	29%	0.286	S	S	.	.			trans	-105.3	-7.1	-166.3	-62.7	170.9	0	0	0	113.8	Y413 Y419	Y413-L421 PolarHBondContact O-N 2.94Å; Y419-L421 PolarHBondContact O-N 3.01Å
422	Y	85.6	Confident	83.3	Confident	29 Å²	29	49 Å²	49	11%	0.114	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-88.9	130.9	-173.8	-54.5	-73.7	0	0	0	111.1	G412 Y413 S424 E427 L428 H431 Y432	G412-Y422 CarbonylContact C-O 3.41Å; G412-Y422 WeakPolarHBondContact CA-O 3.4Å; Y413-Y422 PolarHBondContact N-O 3.19Å; Y413-Y422 VanDerWaalsContact O-CD2 3.3Å; Y413-Y422 WeakPolarHBondContact O-CD2 3.47Å; Y413-Y422 PolarHBondContact O-N 2.88Å; Y422-S424 VanDerWaalsContact C-N 3.26Å; Y422-S424 PolarHBondContact O-N 3.09Å; Y422-E427 HydrophobicContact CD1-CG 4.15Å; Y422-L428 HydrophobicContact CD2-CB 3.85Å; Y422-L428 HydrophobicContact CD2-CD1 3.98Å; Y422-L428 HydrophobicContact CD2-CG 3.89Å; Y422-L428 HydrophobicContact CE2-CG 4.38Å; Y422-L428 HydrophobicContact CG-CB 3.85Å; Y422-L428 HydrophobicContact CG-CG 4.41Å; Y422-H431 HydrophobicContact CD1-CB 4.39Å; Y422-H431 HydrophobicContact CE1-CB 3.61Å; Y422-H431 AromaticContact CE1-CG 3.61Å; Y422-H431 AromaticContact CZ-CD2 3.64Å; Y422-H431 AromaticContact CZ-CG 3.73Å; Y422-H431 PolarHBondContact OH-CD2 2.94Å; Y422-H431 VanDerWaalsContact OH-CG 3.31Å; Y422-H431 PolarHBondContact OH-NE2 2.9Å; Y422-Y432 AromaticContact CE2-CE2 3.71Å; Y422-Y432 HydrophobicContact CE2-CE2 3.71Å; Y422-Y432 PolarHBondContact OH-OH 3.26Å
423	S	83.9	Confident	83.2	Confident	94 Å²	94	49.7 Å²	49.7	66%	0.657	26%	0.256	S	S	*	.	S	Bend	trans	-71.2	-21.4	-176.4	67.2	0	0	0	0	113.3	E427	S423-E427 WeakPolarHBondContact CB-OE2 3.42Å; S423-E427 PolarHBondContact N-OE2 3.36Å; S423-E427 PolarHBondContact OG-OE2 3.35Å
424	S	88.6	Confident	82.8	Confident	41 Å²	41	50.7 Å²	50.7	29%	0.287	26%	0.262	S	S	.	.	S	Bend	trans	-146.2	160.6	177.6	64	0	0	0	0	111.8	Y422 K426 E427 L428	Y422-S424 VanDerWaalsContact C-N 3.26Å; Y422-S424 PolarHBondContact O-N 3.09Å; S424-K426 PolarHBondContact O-N 3.01Å; S424-E427 PolarHBondContact O-N 3.08Å; S424-E427 WeakPolarHBondContact OG-CB 3.42Å; S424-E427 PolarHBondContact OG-N 3.07Å; S424-L428 PolarHBondContact O-N 3.26Å
425	L	87.3	Confident	82.5	Confident	19 Å²	19	52.2 Å²	52.2	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-58.8	-35.3	171.1	-70.5	174.9	0	0	0	111.9	W358 F359 I382 Y391 I406 Y413 L428 V429	W358-L425 HydrophobicContact CH2-CB 3.98Å; W358-L425 HydrophobicContact CZ3-CB 4.19Å; F359-L425 HydrophobicContact CD2-CD1 4.41Å; F359-L425 HydrophobicContact CE2-CD1 4Å; I382-L425 HydrophobicContact CG2-CD1 4.39Å; Y391-L425 HydrophobicContact CD1-CD1 3.85Å; Y391-L425 HydrophobicContact CD2-CD1 3.93Å; Y391-L425 HydrophobicContact CD2-CD2 4.07Å; Y391-L425 HydrophobicContact CD2-CG 4.44Å; Y391-L425 HydrophobicContact CE1-CD1 3.87Å; Y391-L425 HydrophobicContact CE2-CD1 3.97Å; Y391-L425 HydrophobicContact CG-CD1 3.87Å; Y391-L425 HydrophobicContact CG-CD2 4.24Å; I406-L425 HydrophobicContact CD1-CD2 4.14Å; I406-L425 HydrophobicContact CG2-CD2 3.86Å; Y413-L425 HydrophobicContact CD1-CD2 3.59Å; Y413-L425 HydrophobicContact CD1-CG 3.98Å; Y413-L425 HydrophobicContact CE1-CD2 4.1Å; Y413-L425 HydrophobicContact CE1-CG 4.05Å; Y413-L425 HydrophobicContact CG-CD2 4.03Å; Y413-L425 HydrophobicContact CG-CG 4.36Å; L425-L428 WeakPolarHBondContact O-CB 3.37Å; L425-L428 PolarHBondContact O-N 3.21Å; L425-V429 WeakPolarHBondContact O-CG2 3.47Å; L425-V429 PolarHBondContact O-N 2.98Å
426	K	88.5	Confident	82.4	Confident	60 Å²	60	52.3 Å²	52.3	26%	0.261	27%	0.274	S	S	.	.	H	α-helix	trans	-62	-45.3	177	177.1	173.2	173.9	163.2	0	112.2	Y353 E355 W358 S424 L428 V429 L430	Y353-K426 VanDerWaalsContact O-CE 3.32Å; Y353-K426 WeakPolarHBondContact O-CE 3.37Å; Y353-K426 PolarHBondContact O-NZ 3.35Å; E355-K426 HydrophobicContact CG-CD 4.35Å; W358-K426 HydrophobicContact CH2-CB 4.32Å; W358-K426 HydrophobicContact CZ2-CB 4Å; W358-K426 HydrophobicContact CZ2-CG 4.41Å; S424-K426 PolarHBondContact O-N 3.01Å; K426-L428 VanDerWaalsContact C-N 3.31Å; K426-L428 PolarHBondContact O-N 2.92Å; K426-V429 PolarHBondContact O-N 3.3Å; K426-L430 HydrophobicContact CG-CD1 4.11Å; K426-L430 WeakPolarHBondContact O-CG 3.45Å; K426-L430 PolarHBondContact O-N 2.93Å
427	E	85.1	Confident	82.4	Confident	86 Å²	86	50.7 Å²	50.7	40%	0.402	26%	0.261	S	S	.	.	H	α-helix	trans	-64.6	-38.8	177.7	-168.8	-179.9	-163.4	0	0	111.6	Y422 S423 S424 L430 H431	Y422-E427 HydrophobicContact CD1-CG 4.15Å; S423-E427 WeakPolarHBondContact CB-OE2 3.42Å; S423-E427 PolarHBondContact N-OE2 3.36Å; S423-E427 PolarHBondContact OG-OE2 3.35Å; S424-E427 PolarHBondContact O-N 3.08Å; S424-E427 WeakPolarHBondContact OG-CB 3.42Å; S424-E427 PolarHBondContact OG-N 3.07Å; E427-L430 PolarHBondContact O-N 2.8Å; E427-H431 PolarHBondContact O-N 3.25Å
428	L	88.5	Confident	82.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.2	-46.8	172.6	-178.2	156	0	0	0	111.3	I406 F415 Y422 S424 L425 K426 H431 Y432	I406-L428 HydrophobicContact CD1-CD2 4.21Å; I406-L428 HydrophobicContact CG2-CD1 3.85Å; F415-L428 HydrophobicContact CE2-CD2 3.8Å; F415-L428 HydrophobicContact CE2-CG 4.43Å; F415-L428 HydrophobicContact CZ-CD2 3.95Å; Y422-L428 HydrophobicContact CD2-CB 3.85Å; Y422-L428 HydrophobicContact CD2-CD1 3.98Å; Y422-L428 HydrophobicContact CD2-CG 3.89Å; Y422-L428 HydrophobicContact CE2-CG 4.38Å; Y422-L428 HydrophobicContact CG-CB 3.85Å; Y422-L428 HydrophobicContact CG-CG 4.41Å; S424-L428 PolarHBondContact O-N 3.26Å; L425-L428 WeakPolarHBondContact O-CB 3.37Å; L425-L428 PolarHBondContact O-N 3.21Å; K426-L428 VanDerWaalsContact C-N 3.31Å; K426-L428 PolarHBondContact O-N 2.92Å; L428-H431 PolarHBondContact O-N 3.36Å; L428-Y432 HydrophobicContact CD2-CD2 3.85Å; L428-Y432 HydrophobicContact CD2-CE2 4.33Å; L428-Y432 HydrophobicContact CG-CD2 3.91Å; L428-Y432 HydrophobicContact CG-CE2 4Å; L428-Y432 VanDerWaalsContact O-CD2 3.24Å; L428-Y432 WeakPolarHBondContact O-CD2 3.37Å; L428-Y432 PolarHBondContact O-N 3.32Å
429	V	89.3	Confident	82.6	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-46.5	178	168.9	0	0	0	0	111.7	H352 W358 F380 I382 L425 K426 H431 Y432 Q433 L448	H352-V429 HydrophobicContact CB-CG1 4.28Å; W358-V429 HydrophobicContact CD2-CG1 4.35Å; W358-V429 HydrophobicContact CD2-CG2 4.01Å; W358-V429 HydrophobicContact CE3-CG2 3.88Å; W358-V429 HydrophobicContact CG-CG1 4.46Å; W358-V429 HydrophobicContact CH2-CG2 4.04Å; W358-V429 HydrophobicContact CZ2-CB 4.34Å; W358-V429 HydrophobicContact CZ2-CG2 4.14Å; W358-V429 HydrophobicContact CZ3-CG2 3.9Å; F380-V429 HydrophobicContact CE2-CG1 3.86Å; F380-V429 HydrophobicContact CE2-CG2 3.98Å; F380-V429 HydrophobicContact CZ-CG1 3.52Å; F380-V429 HydrophobicContact CZ-CG2 4.49Å; I382-V429 HydrophobicContact CD1-CG2 3.41Å; I382-V429 VanDerWaalsContact CD1-CG2 3.41Å; L425-V429 WeakPolarHBondContact O-CG2 3.47Å; L425-V429 PolarHBondContact O-N 2.98Å; K426-V429 PolarHBondContact O-N 3.3Å; V429-H431 PolarHBondContact O-N 2.8Å; V429-Y432 PolarHBondContact O-N 2.83Å; V429-Q433 PolarHBondContact O-N 3.02Å; V429-L448 HydrophobicContact CG2-CD1 4.27Å
430	L	85.1	Confident	82.6	Confident	34 Å²	34	44.5 Å²	44.5	18%	0.178	23%	0.232	C	C	.	.	H	α-helix	trans	-63.5	-27.6	179	-72	172.4	0	0	0	112.9	H352 Y353 K426 E427 Q433	H352-L430 HydrophobicContact CB-CD2 3.91Å; Y353-L430 HydrophobicContact CD1-CD1 4.25Å; Y353-L430 HydrophobicContact CD1-CD2 4.47Å; Y353-L430 HydrophobicContact CD2-CD2 4.18Å; Y353-L430 HydrophobicContact CE1-CD1 3.92Å; Y353-L430 HydrophobicContact CE1-CD2 4.31Å; Y353-L430 HydrophobicContact CE2-CD2 3.98Å; Y353-L430 HydrophobicContact CG-CD2 4.41Å; K426-L430 HydrophobicContact CG-CD1 4.11Å; K426-L430 WeakPolarHBondContact O-CG 3.45Å; K426-L430 PolarHBondContact O-N 2.93Å; E427-L430 PolarHBondContact O-N 2.8Å; L430-Q433 VanDerWaalsContact O-CG 3.28Å; L430-Q433 WeakPolarHBondContact O-CG 3.46Å; L430-Q433 PolarHBondContact O-NE2 3.37Å
431	H	84.2	Confident	82.4	Confident	71 Å²	71	47.8 Å²	47.8	33%	0.329	25%	0.25	S	S	.	.	H	α-helix	trans	-75.5	-51.5	172.8	-175.9	84.6	0	0	0	111.8	Y422 E427 L428 V429 Q433 Q434 T435	Y422-H431 HydrophobicContact CD1-CB 4.39Å; Y422-H431 HydrophobicContact CE1-CB 3.61Å; Y422-H431 AromaticContact CE1-CG 3.61Å; Y422-H431 AromaticContact CZ-CD2 3.64Å; Y422-H431 AromaticContact CZ-CG 3.73Å; Y422-H431 PolarHBondContact OH-CD2 2.94Å; Y422-H431 VanDerWaalsContact OH-CG 3.31Å; Y422-H431 PolarHBondContact OH-NE2 2.9Å; E427-H431 PolarHBondContact O-N 3.25Å; L428-H431 PolarHBondContact O-N 3.36Å; V429-H431 PolarHBondContact O-N 2.8Å; H431-Q433 PolarHBondContact O-N 2.84Å; H431-Q434 PolarHBondContact O-N 3.35Å; H431-T435 PolarHBondContact NE2-OG1 3.14Å; H431-T435 PolarHBondContact O-N 2.89Å
432	Y	84.9	Confident	82	Confident	3 Å²	3	49.9 Å²	49.9	1%	0.012	26%	0.262	C	S	.	.	H	α-helix	trans	-77.2	-3	-176.6	-70.1	-67.6	0	0	0	114.7	F415 Y422 L428 V429 Q434 T435 L437 H440 L448	F415-Y432 HydrophobicContact CD2-CD2 4.14Å; F415-Y432 AromaticContact CD2-CE2 3.69Å; F415-Y432 HydrophobicContact CD2-CE2 3.69Å; F415-Y432 AromaticContact CE2-CD2 3.58Å; F415-Y432 HydrophobicContact CE2-CD2 3.58Å; F415-Y432 AromaticContact CE2-CE2 3.61Å; F415-Y432 HydrophobicContact CE2-CE2 3.61Å; F415-Y432 HydrophobicContact CE2-CG 4.18Å; Y422-Y432 AromaticContact CE2-CE2 3.71Å; Y422-Y432 HydrophobicContact CE2-CE2 3.71Å; Y422-Y432 PolarHBondContact OH-OH 3.26Å; L428-Y432 HydrophobicContact CD2-CD2 3.85Å; L428-Y432 HydrophobicContact CD2-CE2 4.33Å; L428-Y432 HydrophobicContact CG-CD2 3.91Å; L428-Y432 HydrophobicContact CG-CE2 4Å; L428-Y432 VanDerWaalsContact O-CD2 3.24Å; L428-Y432 WeakPolarHBondContact O-CD2 3.37Å; L428-Y432 PolarHBondContact O-N 3.32Å; V429-Y432 PolarHBondContact O-N 2.83Å; Y432-Q434 VanDerWaalsContact C-N 3.29Å; Y432-T435 CarbonylContact C-O 3.5Å; Y432-T435 WeakPolarHBondContact CA-O 3.41Å; Y432-L437 HydrophobicContact CD1-CD2 3.58Å; Y432-L437 HydrophobicContact CD1-CG 4.41Å; Y432-L437 HydrophobicContact CD2-CD2 4.38Å; Y432-L437 HydrophobicContact CE1-CD2 4.07Å; Y432-L437 HydrophobicContact CG-CD2 3.8Å; Y432-H440 AromaticContact CE1-NE2 3.72Å; Y432-H440 AromaticContact CZ-NE2 3.42Å; Y432-H440 PolarHBondContact OH-NE2 3Å; Y432-L448 PolarHBondContact O-N 2.93Å
433	Q	84.8	Confident	81.1	Confident	23 Å²	23	51.8 Å²	51.8	11%	0.107	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-32.6	162.1	86.5	-173.3	-34.7	0	0	111	L350 H352 V429 L430 H431 R447 L448	L350-Q433 VanDerWaalsContact CD1-OE1 3.25Å; H352-Q433 VanDerWaalsContact CG-OE1 3.23Å; H352-Q433 PolarHBondContact ND1-OE1 2.77Å; V429-Q433 PolarHBondContact O-N 3.02Å; L430-Q433 VanDerWaalsContact O-CG 3.28Å; L430-Q433 WeakPolarHBondContact O-CG 3.46Å; L430-Q433 PolarHBondContact O-NE2 3.37Å; H431-Q433 PolarHBondContact O-N 2.84Å; Q433-R447 WeakPolarHBondContact O-CD 3.36Å; Q433-L448 WeakPolarHBondContact CA-O 3.39Å; Q433-L448 VanDerWaalsContact CB-O 3.32Å; Q433-L448 WeakPolarHBondContact CB-O 3.46Å
434	Q	77.7	Confident	80.7	Confident	73 Å²	73	47.6 Å²	47.6	34%	0.341	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-26.3	-178.4	-66.1	-179.8	-5.5	0	0	111.9	D347 H431 Y432 R447	D347-Q434 PolarHBondContact OD2-NE2 3.1Å; D347-Q434 VanDerWaalsContact OD2-NE2 3.11Å; H431-Q434 PolarHBondContact O-N 3.35Å; Y432-Q434 VanDerWaalsContact C-N 3.29Å; Q434-R447 PolarHBondContact O-NE 3.45Å; Q434-R447 PolarHBondContact O-NH1 3.06Å
435	T	80.2	Confident	80.3	Confident	33 Å²	33	51.1 Å²	51.1	20%	0.202	27%	0.266	C	S	.	.	S	Bend	trans	-110.6	131.7	-177.5	-54.3	0	0	0	0	111.6	H431 Y432	H431-T435 PolarHBondContact NE2-OG1 3.14Å; H431-T435 PolarHBondContact O-N 2.89Å; Y432-T435 CarbonylContact C-O 3.5Å; Y432-T435 WeakPolarHBondContact CA-O 3.41Å
436	S	82.6	Confident	80	Confident	19 Å²	19	50.9 Å²	50.9	13%	0.133	27%	0.265	C	S	.	.			trans	-68.9	141.9	179	-179.2	0	0	0	0	111.7	V438 N445	S436-V438 PolarHBondContact O-N 3.47Å; S436-V438 PolarHBondContact OG-N 3.48Å; S436-N445 PolarHBondContact OG-OD1 2.88Å
437	L	81.4	Confident	80	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-70.8	-4.3	175.9	-69.8	173.3	0	0	0	113.6	V395 F415 Y432 Q439 H440 N441 L444 V446 L448	V395-L437 HydrophobicContact CG1-CD1 4.29Å; F415-L437 HydrophobicContact CD2-CD2 3.87Å; F415-L437 HydrophobicContact CE2-CD2 3.42Å; F415-L437 VanDerWaalsContact CE2-CD2 3.42Å; F415-L437 HydrophobicContact CZ-CD2 3.94Å; Y432-L437 HydrophobicContact CD1-CD2 3.58Å; Y432-L437 HydrophobicContact CD1-CG 4.41Å; Y432-L437 HydrophobicContact CD2-CD2 4.38Å; Y432-L437 HydrophobicContact CE1-CD2 4.07Å; Y432-L437 HydrophobicContact CG-CD2 3.8Å; L437-Q439 PolarHBondContact O-N 3.17Å; L437-H440 PolarHBondContact O-N 3.36Å; L437-N441 PolarHBondContact O-N 3.48Å; L437-L444 CarbonylContact C-O 3.59Å; L437-L444 VanDerWaalsContact C-O 3.23Å; L437-L444 HydrophobicContact CB-CB 3.85Å; L437-L444 HydrophobicContact CB-CD1 4.5Å; L437-L444 WeakPolarHBondContact CB-O 3.19Å; L437-V446 PolarHBondContact N-O 2.87Å; L437-L448 HydrophobicContact CD1-CD2 3.96Å
438	V	78	Confident	80.1	Confident	49 Å²	49	50.2 Å²	50.2	30%	0.297	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-53.5	-29	178	70.8	0	0	0	0	112.6	S436 H440 N441 L444	S436-V438 PolarHBondContact O-N 3.47Å; S436-V438 PolarHBondContact OG-N 3.48Å; V438-H440 PolarHBondContact O-N 3.3Å; V438-N441 WeakPolarHBondContact CA-O 3.45Å; V438-N441 CarbonylContact O-C 3.58Å; V438-N441 PolarHBondContact O-N 3.25Å; V438-L444 PolarHBondContact N-O 3.42Å
439	Q	68.6	Low	79.9	Confident	136 Å²	136	51.9 Å²	51.9	64%	0.636	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-62.7	-23	178.4	-62.8	-178.7	-9.5	0	0	113.6	L437	L437-Q439 PolarHBondContact O-N 3.17Å
440	H	73.1	Confident	79.9	Confident	53 Å²	53	56.4 Å²	56.4	25%	0.245	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-24.4	179.6	-61.7	-65.3	0	0	0	112.9	F415 Y432 L437 V438	F415-H440 HydrophobicContact CB-CB 4.4Å; F415-H440 AromaticContact CD2-CD2 3.98Å; Y432-H440 AromaticContact CE1-NE2 3.72Å; Y432-H440 AromaticContact CZ-NE2 3.42Å; Y432-H440 PolarHBondContact OH-NE2 3Å; L437-H440 PolarHBondContact O-N 3.36Å; V438-H440 PolarHBondContact O-N 3.3Å
441	N	72.4	Confident	80.2	Confident	77 Å²	77	54.9 Å²	54.9	41%	0.412	28%	0.28	S	S	.	.			trans	-158.3	120.8	177.1	-173.7	-22.9	0	0	0	109.5	L437 V438 S443 L444	L437-N441 PolarHBondContact O-N 3.48Å; V438-N441 WeakPolarHBondContact CA-O 3.45Å; V438-N441 CarbonylContact O-C 3.58Å; V438-N441 PolarHBondContact O-N 3.25Å; N441-S443 PolarHBondContact O-N 3.1Å; N441-S443 WeakPolarHBondContact OD1-CB 3.36Å; N441-S443 PolarHBondContact OD1-N 2.97Å; N441-S443 PolarHBondContact OD1-OG 2.8Å; N441-L444 HydrophobicContact CB-CB 4.29Å; N441-L444 HydrophobicContact CB-CD1 3.75Å; N441-L444 HydrophobicContact CB-CG 3.96Å; N441-L444 PolarHBondContact O-N 3.47Å
442	D	71.2	Confident	80.3	Confident	145 Å²	145	52.2 Å²	52.2	78%	0.775	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-21.7	179.9	-63.3	-36.5	0	0	0	113.2	L444	D442-L444 VanDerWaalsContact C-N 3.31Å
443	S	67.9	Low	80.2	Confident	70 Å²	70	57.2 Å²	57.2	49%	0.49	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	0.6	175.3	-53.6	0	0	0	0	114	K402 N441	K402-S443 PolarHBondContact NZ-O 3.13Å; N441-S443 PolarHBondContact O-N 3.1Å; N441-S443 WeakPolarHBondContact OD1-CB 3.36Å; N441-S443 PolarHBondContact OD1-N 2.97Å; N441-S443 PolarHBondContact OD1-OG 2.8Å
444	L	75.8	Confident	80.1	Confident	6 Å²	6	57.1 Å²	57.1	3%	0.031	30%	0.295	C	S	.	.			trans	-116.5	56.5	-179	-66	175	0	0	0	111.3	V395 A397 K402 C404 L437 V438 N441 D442 V446	V395-L444 HydrophobicContact CG1-CD2 4.3Å; A397-L444 HydrophobicContact CB-CD2 4.44Å; K402-L444 HydrophobicContact CB-CD2 3.66Å; K402-L444 HydrophobicContact CD-CD2 3.41Å; K402-L444 VanDerWaalsContact CD-CD2 3.41Å; K402-L444 HydrophobicContact CD-CG 4.47Å; K402-L444 HydrophobicContact CG-CD2 4.13Å; C404-L444 WeakPolarHBondContact SG-CD1 3.38Å; L437-L444 CarbonylContact C-O 3.59Å; L437-L444 VanDerWaalsContact C-O 3.23Å; L437-L444 HydrophobicContact CB-CB 3.85Å; L437-L444 HydrophobicContact CB-CD1 4.5Å; L437-L444 WeakPolarHBondContact CB-O 3.19Å; V438-L444 PolarHBondContact N-O 3.42Å; N441-L444 HydrophobicContact CB-CB 4.29Å; N441-L444 HydrophobicContact CB-CD1 3.75Å; N441-L444 HydrophobicContact CB-CG 3.96Å; N441-L444 PolarHBondContact O-N 3.47Å; D442-L444 VanDerWaalsContact C-N 3.31Å; L444-V446 PolarHBondContact O-N 3.47Å
445	N	79.5	Confident	79.3	Confident	115 Å²	115	62.9 Å²	62.9	62%	0.615	32%	0.322	S	S	*	.			trans	-77.5	55.7	175	-169.1	25.1	0	0	0	112.6	S436	S436-N445 PolarHBondContact OG-OD1 2.88Å
446	V	81.6	Confident	78.3	Confident	13 Å²	13	64.4 Å²	64.4	8%	0.079	33%	0.328	C	S	.	.			trans	-137.3	158.3	179.6	-66.9	0	0	0	0	110.8	D377 V395 A397 L437 L444	D377-V446 HydrophobicContact CB-CG1 4.39Å; V395-V446 HydrophobicContact CG1-CG2 4.49Å; V395-V446 HydrophobicContact CG2-CG2 3.88Å; A397-V446 HydrophobicContact CB-CB 4.29Å; A397-V446 HydrophobicContact CB-CG1 3.57Å; A397-V446 HydrophobicContact CB-CG2 3.7Å; L437-V446 PolarHBondContact N-O 2.87Å; L444-V446 PolarHBondContact O-N 3.47Å
447	R	87.4	Confident	76.6	Confident	133 Å²	133	68.2 Å²	68.2	50%	0.502	35%	0.352	S	S	.	.			trans	-107.8	158.7	172.6	-61.1	179.8	-172.2	-164.5	-3.1	109.1	G378 Q433 Q434 A449	G378-R447 WeakPolarHBondContact CA-O 3.33Å; Q433-R447 WeakPolarHBondContact O-CD 3.36Å; Q434-R447 PolarHBondContact O-NE 3.45Å; Q434-R447 PolarHBondContact O-NH1 3.06Å; R447-A449 PolarHBondContact O-N 2.8Å
448	L	88.3	Confident	74.6	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	39%	0.39	C	S	.	.			trans	-76.7	72.5	171.3	-58.9	-173.9	0	0	0	109	H352 F380 V395 V429 Y432 Q433 L437	H352-L448 PolarHBondContact NE2-O 2.72Å; F380-L448 HydrophobicContact CB-CD2 3.71Å; F380-L448 HydrophobicContact CD1-CB 3.68Å; F380-L448 HydrophobicContact CD1-CD2 4.23Å; F380-L448 HydrophobicContact CD1-CG 4.48Å; F380-L448 HydrophobicContact CD2-CB 4.17Å; F380-L448 HydrophobicContact CD2-CD1 4.12Å; F380-L448 HydrophobicContact CD2-CD2 3.87Å; F380-L448 HydrophobicContact CD2-CG 4.27Å; F380-L448 HydrophobicContact CE1-CB 3.69Å; F380-L448 HydrophobicContact CE2-CB 4.18Å; F380-L448 HydrophobicContact CE2-CD1 4.12Å; F380-L448 HydrophobicContact CG-CB 3.94Å; F380-L448 HydrophobicContact CG-CD2 3.67Å; F380-L448 HydrophobicContact CG-CG 4.26Å; F380-L448 HydrophobicContact CZ-CB 3.96Å; V395-L448 HydrophobicContact CB-CD2 4.39Å; V395-L448 HydrophobicContact CG2-CD2 4.14Å; V429-L448 HydrophobicContact CG2-CD1 4.27Å; Y432-L448 PolarHBondContact O-N 2.93Å; Q433-L448 WeakPolarHBondContact CA-O 3.39Å; Q433-L448 VanDerWaalsContact CB-O 3.32Å; Q433-L448 WeakPolarHBondContact CB-O 3.46Å; L437-L448 HydrophobicContact CD1-CD2 3.96Å
449	A	84.2	Confident	72.9	Confident	35 Å²	35	78.8 Å²	78.8	29%	0.289	42%	0.415	S	S	.	.			trans	-90.8	-30.9	-166.3	0	0	0	0	0	113.7	H352 G378 R447	H352-A449 PolarHBondContact CE1-O 3.49Å; H352-A449 PolarHBondContact NE2-O 2.97Å; G378-A449 PolarHBondContact O-N 3.05Å; R447-A449 PolarHBondContact O-N 2.8Å
450	Y	89	Confident	71.1	Confident	94 Å²	94	78.3 Å²	78.3	37%	0.369	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	104	-174.1	-49.5	-72.1	0	0	0	111.1	P376 G378 A379 F380 M456	P376-Y450 HydrophobicContact CG-CD2 4.06Å; P376-Y450 HydrophobicContact CG-CE2 4.29Å; G378-Y450 PolarHBondContact O-N 2.94Å; G378-Y450 VanDerWaalsContact O-N 3.09Å; A379-Y450 CarbonylContact C-O 3.55Å; A379-Y450 VanDerWaalsContact CA-O 3.29Å; A379-Y450 WeakPolarHBondContact CA-O 3.42Å; F380-Y450 WeakPolarHBondContact CD1-O 3.23Å; F380-Y450 PolarHBondContact N-O 3.08Å; Y450-M456 HydrophobicContact CD1-SD 4.32Å; Y450-M456 HydrophobicContact CG-CE 4.4Å; Y450-M456 HydrophobicContact CG-SD 4.23Å
451	P	90.5	Very high	69	Low	2 Å²	2	91 Å²	91	1%	0.013	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	137.2	172	-26.8	39.2	0	0	0	110.6	P351 H352 T357 W358 F380 H453 A454	P351-P451 HydrophobicContact CB-CG 4.11Å; H352-P451 WeakPolarHBondContact NE2-CD 3.43Å; T357-P451 CarbonylContact O-C 3.6Å; T357-P451 VanDerWaalsContact O-CB 3.22Å; T357-P451 WeakPolarHBondContact O-CB 3.43Å; T357-P451 WeakPolarHBondContact OG1-CB 3.3Å; W358-P451 HydrophobicContact CB-CB 3.91Å; F380-P451 HydrophobicContact CE1-CB 4.34Å; F380-P451 HydrophobicContact CE1-CG 3.89Å; F380-P451 HydrophobicContact CZ-CB 4.49Å; F380-P451 HydrophobicContact CZ-CG 4.13Å; P451-H453 PolarHBondContact O-N 2.86Å; P451-H453 VanDerWaalsContact O-N 3.09Å; P451-A454 HydrophobicContact CB-CB 3.97Å; P451-A454 HydrophobicContact CG-CB 4.28Å; P451-A454 WeakPolarHBondContact O-CB 3.5Å; P451-A454 PolarHBondContact O-N 3.29Å
452	V	86.6	Confident	68.9	Low	15 Å²	15	91.7 Å²	91.7	9%	0.091	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-31.7	-173.2	67.4	0	0	0	0	114.6	T357 V360 L371 L372 F380 L381	T357-V452 PolarHBondContact O-N 3.3Å; V360-V452 HydrophobicContact CG2-CG1 4.28Å; L371-V452 HydrophobicContact CB-CG2 4.28Å; L372-V452 HydrophobicContact CD2-CG2 4.26Å; F380-V452 PolarHBondContact O-N 3.07Å; L381-V452 HydrophobicContact CB-CB 4.09Å; L381-V452 HydrophobicContact CB-CG1 3.75Å; L381-V452 HydrophobicContact CD2-CB 4.36Å; L381-V452 HydrophobicContact CD2-CG1 4.29Å; L381-V452 HydrophobicContact CD2-CG2 4.21Å
453	H	84.1	Confident	68.7	Low	108 Å²	108	88.8 Å²	88.8	50%	0.5	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	6.1	179.6	-60.4	-53.9	0	0	0	113.9	K356 T357 P451	K356-H453 PolarHBondContact O-CD2 3.17Å; T357-H453 PolarHBondContact O-N 3.38Å; P451-H453 PolarHBondContact O-N 2.86Å; P451-H453 VanDerWaalsContact O-N 3.09Å
454	A	80.9	Confident	68.8	Low	21 Å²	21	89.9 Å²	89.9	17%	0.174	46%	0.456	C	S	.	.	S	Bend	trans	-73	144.5	171.7	0	0	0	0	0	111.1	P351 P451 M456	P351-A454 HydrophobicContact CB-CB 3.55Å; P351-A454 HydrophobicContact CG-CB 3.91Å; P451-A454 HydrophobicContact CB-CB 3.97Å; P451-A454 HydrophobicContact CG-CB 4.28Å; P451-A454 WeakPolarHBondContact O-CB 3.5Å; P451-A454 PolarHBondContact O-N 3.29Å; A454-M456 PolarHBondContact O-N 3.39Å; A454-M456 VanDerWaalsContact O-N 3.1Å
455	Q	61.9	Low	68.4	Low	194 Å²	194	94.8 Å²	94.8	91%	0.907	48%	0.482	S	S	*	.			trans	-65.5	112.3	170.4	-74.7	-175.7	-5.7	0	0	108.9
456	M	59	Low	67.7	Low	66 Å²	66	93.6 Å²	93.6	33%	0.325	47%	0.473	S	S	.	.			trans	-64.1	134.4	177.9	-73.6	-88.7	-174.2	0	0	109.9	K375 P376 A379 Y450 A454 S458	K375-M456 HydrophobicContact CD-CE 3.98Å; P376-M456 HydrophobicContact CG-CE 3.71Å; P376-M456 HydrophobicContact CG-SD 3.8Å; A379-M456 HydrophobicContact CB-CE 4.27Å; Y450-M456 HydrophobicContact CD1-SD 4.32Å; Y450-M456 HydrophobicContact CG-CE 4.4Å; Y450-M456 HydrophobicContact CG-SD 4.23Å; A454-M456 PolarHBondContact O-N 3.39Å; A454-M456 VanDerWaalsContact O-N 3.1Å; M456-S458 PolarHBondContact O-N 3.11Å
457	P	47.9	Very low	66.7	Low	98 Å²	98	98.9 Å²	98.9	64%	0.636	50%	0.499	S	S	*	.			trans	-59.5	126.3	165.1	-15.1	27.8	0	0	0	108.6	L459	P457-L459 PolarHBondContact O-N 3.4Å
458	S	39.2	Very low	65.3	Low	115 Å²	115	96.5 Å²	96.5	80%	0.804	50%	0.499	S	S	*	.			trans	-56.9	115.6	174.8	-36	0	0	0	0	108.9	M456 C460	M456-S458 PolarHBondContact O-N 3.11Å; S458-C460 PolarHBondContact O-N 3.45Å
459	L	41.5	Very low	63.5	Low	158 Å²	158	103.9 Å²	103.9	83%	0.827	54%	0.538	S	S	*	.			trans	-62.8	99.8	168.6	-87	140.9	0	0	0	108.2	P457 R461	P457-L459 PolarHBondContact O-N 3.4Å; L459-R461 PolarHBondContact O-N 2.99Å
460	C	30.2	Very low	61.8	Low	126 Å²	126	109.7 Å²	109.7	85%	0.851	56%	0.558	S	S	*	*			trans	-60.3	119.8	160.5	-75.7	0	0	0	0	107.4	S458	S458-C460 PolarHBondContact O-N 3.45Å
461	R	30.4	Very low	59.3	Low	319 Å²	319	111.1 Å²	111.1	100%	1.204	58%	0.576	S	S	*	*			trans	-69	0	175.1	-113.8	-175.2	-177.2	-175.7	1.2	112.1	L459	L459-R461 PolarHBondContact O-N 2.99Å

Retrieved 461 of 461 residues in 371.8 ms (Link to these results)

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