A0A077ZBN3_TRITR Loading...

Lipocalin domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZBN3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 531 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.5	Very low	57.9	Low	242 Å²	242	148 Å²	148	100%	1.192	78%	0.78	S	S	*	*				0	107.2	0	-85.7	171.7	154.1	0	0	108.1
2	T	48.5	Very low	58.7	Low	137 Å²	137	145.1 Å²	145.1	84%	0.84	76%	0.764	S	S	*	*			trans	-128.6	93.4	-153	30.1	0	0	0	0	109
3	I	54.4	Low	59.5	Low	167 Å²	167	142.9 Å²	142.9	86%	0.856	75%	0.753	S	S	*	*			trans	-147.3	96	164.4	-56.8	178.8	0	0	0	106.2
4	K	56.2	Low	60	Low	210 Å²	210	139 Å²	139	91%	0.913	73%	0.732	S	S	*	*	S	Bend	trans	-167.4	-0.7	162.7	-108.4	167.6	-168.8	-171.3	0	115.3
5	S	56.5	Low	60.2	Low	103 Å²	103	137.3 Å²	137.3	72%	0.72	72%	0.723	S	S	*	*	S	Bend	trans	-96.1	1	-173.4	-162.6	0	0	0	0	115.9
6	A	58.1	Low	60.3	Low	84 Å²	84	134.6 Å²	134.6	69%	0.694	71%	0.708	S	S	*	*	S	Bend	trans	-89.9	-20.1	-168.8	0	0	0	0	0	115.3
7	V	59.1	Low	60.3	Low	119 Å²	119	130.8 Å²	130.8	72%	0.721	70%	0.695	S	S	*	*	S	Bend	trans	-88.4	-24.1	-172	-171.7	0	0	0	0	112.6
8	M	56.8	Low	60.2	Low	166 Å²	166	129 Å²	129	82%	0.818	69%	0.69	S	S	*	*	H	α-helix	trans	-79.5	-26.9	179.8	-120.1	-176.6	146.4	0	0	113.3	F10 L12	M8-F10 VanDerWaalsContact C-N 3.31Å; M8-F10 PolarHBondContact O-N 3.17Å; M8-L12 PolarHBondContact O-N 3.42Å
9	S	64.2	Low	60	Low	69 Å²	69	127.6 Å²	127.6	48%	0.483	69%	0.686	S	S	.	*	H	α-helix	trans	-70.9	-25.8	176.7	-74.5	0	0	0	0	113.2	L13	S9-L13 WeakPolarHBondContact O-CB 3.18Å; S9-L13 WeakPolarHBondContact O-CD1 3.39Å; S9-L13 WeakPolarHBondContact O-CG 3.49Å; S9-L13 PolarHBondContact O-N 3.04Å
10	F	67.1	Low	59.8	Low	147 Å²	147	128.6 Å²	128.6	65%	0.645	69%	0.686	S	S	*	*	H	α-helix	trans	-73.7	-36.9	-178.5	-148.5	-95.3	0	0	0	112.3	M8 L14	M8-F10 VanDerWaalsContact C-N 3.31Å; M8-F10 PolarHBondContact O-N 3.17Å; F10-L14 HydrophobicContact CE1-CD1 4.29Å; F10-L14 WeakPolarHBondContact O-CB 3.45Å; F10-L14 PolarHBondContact O-N 3.38Å
11	W	69.6	Low	59.4	Low	184 Å²	184	128.5 Å²	128.5	70%	0.697	69%	0.69	S	S	*	*	H	α-helix	trans	-72.4	-34.1	175	-86.9	94.4	0	0	0	113.1	L14 L15	W11-L14 PolarHBondContact O-N 3.45Å; W11-L15 PolarHBondContact O-N 3.36Å
12	L	67.5	Low	59.4	Low	113 Å²	113	121.5 Å²	121.5	59%	0.592	67%	0.665	S	S	*	*	H	α-helix	trans	-68.6	-39.3	175.2	-133.1	88.7	0	0	0	111.6	M8 L14 L15 L16	M8-L12 PolarHBondContact O-N 3.42Å; L12-L14 VanDerWaalsContact C-N 3.34Å; L12-L15 PolarHBondContact O-N 2.96Å; L12-L16 WeakPolarHBondContact O-CB 3.28Å; L12-L16 WeakPolarHBondContact O-CD1 3.3Å; L12-L16 PolarHBondContact O-N 3.42Å
13	L	68.5	Low	59.3	Low	117 Å²	117	121.4 Å²	121.4	61%	0.613	67%	0.665	S	S	*	*	H	α-helix	trans	-67.3	-34.3	174.6	-80.2	160.4	0	0	0	112.2	S9 L16 S17	S9-L13 WeakPolarHBondContact O-CB 3.18Å; S9-L13 WeakPolarHBondContact O-CD1 3.39Å; S9-L13 WeakPolarHBondContact O-CG 3.49Å; S9-L13 PolarHBondContact O-N 3.04Å; L13-L16 PolarHBondContact O-N 2.8Å; L13-S17 WeakPolarHBondContact O-CB 3.37Å; L13-S17 PolarHBondContact O-N 2.8Å; L13-S17 PolarHBondContact O-OG 2.82Å
14	L	67.3	Low	59.2	Low	88 Å²	88	119.1 Å²	119.1	46%	0.461	66%	0.664	S	S	.	*	H	α-helix	trans	-70.5	-39.8	176.1	-140.4	127.4	0	0	0	111.7	F10 W11 L12 S17 V18	F10-L14 HydrophobicContact CE1-CD1 4.29Å; F10-L14 WeakPolarHBondContact O-CB 3.45Å; F10-L14 PolarHBondContact O-N 3.38Å; W11-L14 PolarHBondContact O-N 3.45Å; L12-L14 VanDerWaalsContact C-N 3.34Å; L14-S17 WeakPolarHBondContact CA-OG 3.44Å; L14-S17 PolarHBondContact O-N 3.17Å; L14-S17 PolarHBondContact O-OG 3.36Å; L14-V18 WeakPolarHBondContact O-CG2 3.23Å; L14-V18 PolarHBondContact O-N 3.33Å; L14-V18 VanDerWaalsContact O-N 3.16Å
15	L	62.9	Low	58.8	Low	114 Å²	114	112.4 Å²	112.4	60%	0.597	65%	0.654	S	S	*	*	H	α-helix	trans	-66	-35.5	172.2	-96.6	152.7	0	0	0	112.9	W11 L12 V18 V19	W11-L15 PolarHBondContact O-N 3.36Å; L12-L15 PolarHBondContact O-N 2.96Å; L15-V18 PolarHBondContact O-N 3.35Å; L15-V19 VanDerWaalsContact O-CG2 3.32Å; L15-V19 WeakPolarHBondContact O-CG2 3.28Å; L15-V19 PolarHBondContact O-N 3.27Å
16	L	61.5	Low	58.1	Low	94 Å²	94	113.9 Å²	113.9	49%	0.492	66%	0.661	S	S	.	*	H	α-helix	trans	-71.7	-31.2	173.2	-95.5	132.3	0	0	0	112.9	L12 L13 V18 V19 Q20	L12-L16 WeakPolarHBondContact O-CB 3.28Å; L12-L16 WeakPolarHBondContact O-CD1 3.3Å; L12-L16 PolarHBondContact O-N 3.42Å; L13-L16 PolarHBondContact O-N 2.8Å; L16-V18 VanDerWaalsContact C-N 3.34Å; L16-V19 PolarHBondContact O-N 3.5Å; L16-Q20 PolarHBondContact O-N 2.93Å
17	S	59.6	Low	57.5	Low	69 Å²	69	118.7 Å²	118.7	48%	0.483	67%	0.669	S	S	.	*	H	α-helix	trans	-72.4	-24.4	174.3	66	0	0	0	0	113.8	L13 L14	L13-S17 WeakPolarHBondContact O-CB 3.37Å; L13-S17 PolarHBondContact O-N 2.8Å; L13-S17 PolarHBondContact O-OG 2.82Å; L14-S17 WeakPolarHBondContact CA-OG 3.44Å; L14-S17 PolarHBondContact O-N 3.17Å; L14-S17 PolarHBondContact O-OG 3.36Å
18	V	59	Low	56.5	Low	99 Å²	99	125.6 Å²	125.6	60%	0.6	68%	0.682	S	S	*	*	H	α-helix	trans	-81.8	-19.2	174.6	174.7	0	0	0	0	112.3	L14 L15 L16	L14-V18 WeakPolarHBondContact O-CG2 3.23Å; L14-V18 PolarHBondContact O-N 3.33Å; L14-V18 VanDerWaalsContact O-N 3.16Å; L15-V18 PolarHBondContact O-N 3.35Å; L16-V18 VanDerWaalsContact C-N 3.34Å
19	V	57.2	Low	55.6	Low	102 Å²	102	120.1 Å²	120.1	62%	0.618	67%	0.669	S	S	*	*	H	α-helix	trans	-94.3	-13	-178.7	175	0	0	0	0	113	L15 L16	L15-V19 VanDerWaalsContact O-CG2 3.32Å; L15-V19 WeakPolarHBondContact O-CG2 3.28Å; L15-V19 PolarHBondContact O-N 3.27Å; L16-V19 PolarHBondContact O-N 3.5Å
20	Q	55.6	Low	54.4	Low	147 Å²	147	125.3 Å²	125.3	69%	0.687	69%	0.685	S	S	*	*	S	Bend	trans	-96.6	6.1	-176.9	-73.4	-165.2	-26.7	0	0	116.2	L16	L16-Q20 PolarHBondContact O-N 2.93Å
21	T	50.9	Low	53	Low	127 Å²	127	129.1 Å²	129.1	78%	0.779	70%	0.697	S	S	*	*	S	Bend	trans	-94.5	16	175.4	54	0	0	0	0	114.7
22	S	46.8	Very low	51.5	Low	95 Å²	95	126.9 Å²	126.9	66%	0.664	70%	0.698	S	S	*	*			trans	-127.2	61.3	178.9	50.7	0	0	0	0	112.5
23	T	47	Very low	50.1	Low	136 Å²	136	128.3 Å²	128.3	83%	0.834	71%	0.705	S	S	*	*			trans	-145.2	84.3	164	56.3	0	0	0	0	110.8
24	S	52	Low	48.7	Very low	119 Å²	119	127.7 Å²	127.7	83%	0.832	71%	0.708	S	S	*	*			trans	-116.6	110.8	158.5	56.2	0	0	0	0	108.2
25	G	47.5	Very low	47.6	Very low	68 Å²	68	132.7 Å²	132.7	70%	0.701	73%	0.729	S	S	*	*			trans	-68.7	-180	174.8	0	0	0	0	0	113.8
26	P	41.2	Very low	46.4	Very low	135 Å²	135	134.9 Å²	134.9	88%	0.877	74%	0.736	S	S	*	*			trans	-95.8	130.4	-132	34.1	-32.8	0	0	0	113.3
27	Q	46.2	Very low	45.3	Very low	185 Å²	185	134.2 Å²	134.2	86%	0.864	74%	0.744	S	S	*	*			trans	-110.2	124.6	160.2	-72.1	-160.9	-5.3	0	0	109.8	G29	Q27-G29 PolarHBondContact O-N 2.95Å
28	R	37.9	Very low	44.3	Very low	264 Å²	264	139.4 Å²	139.4	100%	0.996	76%	0.763	S	S	*	*			trans	-56	100.5	163.1	-81.9	175	168.2	164.2	-4.3	108.3
29	G	38.8	Very low	43.6	Very low	51 Å²	51	141.5 Å²	141.5	53%	0.526	77%	0.77	S	S	.	*			trans	-154.7	119.6	175.1	0	0	0	0	0	107.5	Q27 Y31	Q27-G29 PolarHBondContact O-N 2.95Å; G29-Y31 PolarHBondContact O-N 3.09Å
30	Q	38.1	Very low	43.3	Very low	178 Å²	178	140.3 Å²	140.3	83%	0.832	77%	0.771	S	S	*	*			trans	-55.4	112.3	177.4	-67	168.9	-20.9	0	0	108.6	L32	Q30-L32 HydrophobicContact CB-CD1 4.05Å; Q30-L32 PolarHBondContact O-N 3.45Å
31	Y	37.3	Very low	43.3	Very low	226 Å²	226	139 Å²	139	89%	0.886	78%	0.775	S	S	*	*			trans	-71.1	79.4	160.9	-76	-87.6	0	0	0	107.2	G29 L33	G29-Y31 PolarHBondContact O-N 3.09Å; Y31-L33 VanDerWaalsContact C-N 3.3Å; Y31-L33 PolarHBondContact O-N 3.26Å; Y31-L33 VanDerWaalsContact O-N 3.1Å
32	L	37.7	Very low	43.9	Very low	137 Å²	137	138.1 Å²	138.1	72%	0.717	76%	0.76	S	S	*	*			trans	-63.9	100.8	151.6	-93.3	108.5	0	0	0	105.9	Q30	Q30-L32 HydrophobicContact CB-CD1 4.05Å; Q30-L32 PolarHBondContact O-N 3.45Å
33	L	39.5	Very low	44.7	Very low	144 Å²	144	137.3 Å²	137.3	75%	0.754	75%	0.753	S	S	*	*			trans	-47	133.2	150.4	-81.1	132.9	0	0	0	106.6	Y31 Q35	Y31-L33 VanDerWaalsContact C-N 3.3Å; Y31-L33 PolarHBondContact O-N 3.26Å; Y31-L33 VanDerWaalsContact O-N 3.1Å; L33-Q35 PolarHBondContact O-N 3.35Å
34	P	39.5	Very low	45.7	Very low	104 Å²	104	135 Å²	135	68%	0.675	74%	0.738	S	S	*	*			trans	-57	113.6	164.8	24.6	-28.7	0	0	0	105.4	Q36	P34-Q36 PolarHBondContact O-N 3.22Å
35	Q	42.6	Very low	46.3	Very low	193 Å²	193	130.1 Å²	130.1	90%	0.902	70%	0.703	S	S	*	*			trans	-67.8	65	163.7	-75.6	-168.4	-11.9	0	0	107.5	L33 A37	L33-Q35 PolarHBondContact O-N 3.35Å; Q35-A37 PolarHBondContact O-N 3.4Å
36	Q	38.7	Very low	47.3	Very low	159 Å²	159	129.6 Å²	129.6	74%	0.743	69%	0.687	S	S	*	*			trans	-75.4	87	153.2	-80.3	-177.7	-26.6	0	0	104.8	P34 M38	P34-Q36 PolarHBondContact O-N 3.22Å; Q36-M38 PolarHBondContact O-N 3.45Å
37	A	39.2	Very low	48.5	Very low	80 Å²	80	124.1 Å²	124.1	66%	0.661	65%	0.653	S	S	*	*			trans	-56.7	92.8	158.9	0	0	0	0	0	106.1	Q35 I39	Q35-A37 PolarHBondContact O-N 3.4Å; A37-I39 HydrophobicContact CB-CG1 4.39Å; A37-I39 PolarHBondContact O-N 3.03Å
38	M	37	Very low	49.2	Very low	178 Å²	178	120.5 Å²	120.5	88%	0.877	64%	0.64	S	S	*	*			trans	-66.5	85.3	163.8	-70.8	-127.9	-84.5	0	0	105.6	Q36 A40	Q36-M38 PolarHBondContact O-N 3.45Å; M38-A40 PolarHBondContact O-N 2.63Å
39	I	45.9	Very low	50.1	Low	144 Å²	144	110.7 Å²	110.7	74%	0.738	61%	0.607	S	S	*	*			trans	-62.4	104.2	168.2	-63.2	168.4	0	0	0	104.4	A37	A37-I39 HydrophobicContact CB-CG1 4.39Å; A37-I39 PolarHBondContact O-N 3.03Å
40	A	49.1	Very low	51.1	Low	77 Å²	77	108.5 Å²	108.5	64%	0.636	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-52.6	132.5	168.1	0	0	0	0	0	107.7	M38 K42	M38-A40 PolarHBondContact O-N 2.63Å; A40-K42 PolarHBondContact O-N 3.08Å
41	P	57.2	Low	52.2	Low	119 Å²	119	102.4 Å²	102.4	77%	0.773	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-54.2	131.4	179.6	21	-30.8	0	0	0	108.7
42	K	62.8	Low	52.9	Low	109 Å²	109	94.8 Å²	94.8	47%	0.474	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-56.5	134.5	178.3	-76.6	-175.4	-177.7	178.6	0	108.7	A40 V44	A40-K42 PolarHBondContact O-N 3.08Å; K42-V44 PolarHBondContact O-N 3.42Å
43	P	63.1	Low	53.5	Low	78 Å²	78	92.7 Å²	92.7	51%	0.506	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-52.5	142.1	172.7	16.2	-28.8	0	0	0	110.6	N76 F77 D78	P43-N76 VanDerWaalsContact CD-O 3.28Å; P43-N76 WeakPolarHBondContact CD-O 3.39Å; P43-F77 HydrophobicContact CB-CB 4.36Å; P43-F77 HydrophobicContact CG-CB 4.02Å; P43-F77 CarbonylContact O-C 3.52Å; P43-F77 WeakPolarHBondContact O-CA 3.33Å; P43-F77 WeakPolarHBondContact O-CB 3.42Å; P43-D78 PolarHBondContact O-N 2.89Å
44	V	68.9	Low	54.3	Low	87 Å²	87	88.7 Å²	88.7	53%	0.527	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	129.5	-179.4	179	0	0	0	0	108.8	K42 D78 V80	K42-V44 PolarHBondContact O-N 3.42Å; V44-D78 CarbonylContact C-O 3.55Å; V44-D78 WeakPolarHBondContact CA-O 3.45Å; V44-V80 HydrophobicContact CG1-CB 3.97Å; V44-V80 HydrophobicContact CG1-CG1 3.49Å; V44-V80 VanDerWaalsContact CG1-CG1 3.49Å; V44-V80 HydrophobicContact CG1-CG2 3.27Å
45	V	63.6	Low	55.1	Low	16 Å²	16	87.2 Å²	87.2	10%	0.097	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.3	-177.7	178.6	0	0	0	0	109.4	L49 F53 F77 D78 V79 V80	V45-L49 HydrophobicContact CG1-CB 3.81Å; V45-F53 HydrophobicContact CG1-CD2 3.73Å; V45-F53 HydrophobicContact CG1-CE2 3.88Å; V45-F53 HydrophobicContact CG2-CD2 4.26Å; V45-F53 HydrophobicContact CG2-CE2 4.39Å; V45-F77 HydrophobicContact CB-CD2 3.78Å; V45-F77 HydrophobicContact CB-CE2 4.18Å; V45-F77 HydrophobicContact CG2-CB 3.93Å; V45-F77 HydrophobicContact CG2-CD2 3.49Å; V45-F77 VanDerWaalsContact CG2-CD2 3.49Å; V45-F77 HydrophobicContact CG2-CE2 4.09Å; V45-F77 HydrophobicContact CG2-CG 3.8Å; V45-D78 PolarHBondContact N-O 3.04Å; V45-V79 VanDerWaalsContact O-CA 3.28Å; V45-V79 WeakPolarHBondContact O-CA 3.32Å; V45-V80 PolarHBondContact O-N 2.72Å
46	P	69.7	Low	55.7	Low	57 Å²	57	80.2 Å²	80.2	37%	0.37	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	141.8	170.3	-29.1	37.3	0	0	0	112.8	D48 L49 A50 V80	P46-D48 WeakPolarHBondContact CB-OD1 2.89Å; P46-D48 PolarHBondContact O-N 3.44Å; P46-D48 VanDerWaalsContact O-N 3.13Å; P46-L49 HydrophobicContact CB-CD1 4.35Å; P46-L49 HydrophobicContact CB-CG 4.41Å; P46-L49 HydrophobicContact CG-CD1 4.18Å; P46-L49 WeakPolarHBondContact O-CA 3.45Å; P46-L49 PolarHBondContact O-N 3.13Å; P46-A50 PolarHBondContact O-N 3.34Å; P46-A50 VanDerWaalsContact O-N 3.13Å; P46-V80 CarbonylContact C-O 3.55Å
47	A	65.4	Low	56.6	Low	20 Å²	20	75.9 Å²	75.9	17%	0.165	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-32.4	-176.4	0	0	0	0	0	114	L49 V79 V80 A87 V90	A47-L49 PolarHBondContact O-N 3.48Å; A47-V79 HydrophobicContact CB-CG1 4.1Å; A47-V80 WeakPolarHBondContact CB-O 3.41Å; A47-V80 PolarHBondContact N-O 3.01Å; A47-A87 HydrophobicContact CB-CB 3.96Å; A47-V90 HydrophobicContact CB-CG2 4.09Å
48	D	61.6	Low	57.5	Low	110 Å²	110	75.8 Å²	75.8	59%	0.588	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-9.6	175.9	66	-46.4	0	0	0	113.9	P46 H51	P46-D48 WeakPolarHBondContact CB-OD1 2.89Å; P46-D48 PolarHBondContact O-N 3.44Å; P46-D48 VanDerWaalsContact O-N 3.13Å; D48-H51 PolarHBondContact O-CE1 3.09Å; D48-H51 PolarHBondContact O-ND1 3.1Å
49	L	57.4	Low	58.3	Low	58 Å²	58	74.5 Å²	74.5	30%	0.304	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-13	176.5	-61.8	179.5	0	0	0	112.9	V45 P46 A47 H51 Y52 F53	V45-L49 HydrophobicContact CG1-CB 3.81Å; P46-L49 HydrophobicContact CB-CD1 4.35Å; P46-L49 HydrophobicContact CB-CG 4.41Å; P46-L49 HydrophobicContact CG-CD1 4.18Å; P46-L49 WeakPolarHBondContact O-CA 3.45Å; P46-L49 PolarHBondContact O-N 3.13Å; A47-L49 PolarHBondContact O-N 3.48Å; L49-H51 PolarHBondContact O-N 3.3Å; L49-H51 VanDerWaalsContact O-N 3.13Å; L49-Y52 HydrophobicContact CB-CD2 4.47Å; L49-Y52 HydrophobicContact CD2-CD2 4.09Å; L49-Y52 HydrophobicContact CD2-CE2 3.98Å; L49-Y52 WeakPolarHBondContact O-CB 3.26Å; L49-Y52 WeakPolarHBondContact O-CD2 3.32Å; L49-Y52 PolarHBondContact O-N 3.19Å; L49-F53 HydrophobicContact CB-CE2 4.36Å; L49-F53 WeakPolarHBondContact O-CD2 3.46Å
50	A	59.1	Low	58.6	Low	4 Å²	4	70.4 Å²	70.4	3%	0.033	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-57	-32	-176.2	0	0	0	0	0	113.5	P46 Y52 F53 Q54 V79	P46-A50 PolarHBondContact O-N 3.34Å; P46-A50 VanDerWaalsContact O-N 3.13Å; A50-Y52 PolarHBondContact O-N 3.1Å; A50-F53 PolarHBondContact O-N 3.46Å; A50-F53 VanDerWaalsContact O-N 3.08Å; A50-Q54 PolarHBondContact O-N 3.37Å; A50-V79 HydrophobicContact CB-CB 4.39Å; A50-V79 HydrophobicContact CB-CG1 3.63Å; A50-V79 HydrophobicContact CB-CG2 3.74Å
51	H	60.5	Low	59	Low	51 Å²	51	71.9 Å²	71.9	24%	0.236	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-69.2	-16.4	-179.9	68.3	-82.2	0	0	0	114	D48 L49 F53	D48-H51 PolarHBondContact O-CE1 3.09Å; D48-H51 PolarHBondContact O-ND1 3.1Å; L49-H51 PolarHBondContact O-N 3.3Å; L49-H51 VanDerWaalsContact O-N 3.13Å; H51-F53 VanDerWaalsContact C-N 3.31Å
52	Y	51.6	Low	59.2	Low	65 Å²	65	75.7 Å²	75.7	26%	0.255	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-77.6	-20.5	172.1	-67.7	-73.2	0	0	0	112.7	L49 A50 I340 N343	L49-Y52 HydrophobicContact CB-CD2 4.47Å; L49-Y52 HydrophobicContact CD2-CD2 4.09Å; L49-Y52 HydrophobicContact CD2-CE2 3.98Å; L49-Y52 WeakPolarHBondContact O-CB 3.26Å; L49-Y52 WeakPolarHBondContact O-CD2 3.32Å; L49-Y52 PolarHBondContact O-N 3.19Å; A50-Y52 PolarHBondContact O-N 3.1Å; Y52-I340 HydrophobicContact CD1-CG2 4.41Å; Y52-I340 HydrophobicContact CE1-CG2 4.13Å; Y52-N343 PolarHBondContact O-ND2 3.16Å
53	F	50.3	Low	58.7	Low	93 Å²	93	74.4 Å²	74.4	41%	0.408	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	-8.8	-172.8	-55.7	-79.6	0	0	0	113	V45 L49 A50 H51 F77	V45-F53 HydrophobicContact CG1-CD2 3.73Å; V45-F53 HydrophobicContact CG1-CE2 3.88Å; V45-F53 HydrophobicContact CG2-CD2 4.26Å; V45-F53 HydrophobicContact CG2-CE2 4.39Å; L49-F53 HydrophobicContact CB-CE2 4.36Å; L49-F53 WeakPolarHBondContact O-CD2 3.46Å; A50-F53 PolarHBondContact O-N 3.46Å; A50-F53 VanDerWaalsContact O-N 3.08Å; H51-F53 VanDerWaalsContact C-N 3.31Å; F53-F77 HydrophobicContact CB-CD1 4.43Å; F53-F77 HydrophobicContact CB-CE1 3.47Å; F53-F77 VanDerWaalsContact CB-CE1 3.47Å; F53-F77 HydrophobicContact CB-CE2 4.02Å; F53-F77 HydrophobicContact CB-CZ 3.19Å; F53-F77 HydrophobicContact CG-CE1 4.45Å; F53-F77 HydrophobicContact CG-CZ 4.28Å
54	Q	58.2	Low	58	Low	61 Å²	61	72.5 Å²	72.5	29%	0.285	37%	0.365	S	S	.	.	S	Bend	trans	-125.4	142.1	176.6	-85.5	166.9	49	0	0	111.4	A50 S56 A75 F77	A50-Q54 PolarHBondContact O-N 3.37Å; Q54-S56 PolarHBondContact O-N 3.02Å; Q54-A75 HydrophobicContact CG-CB 4.42Å; Q54-F77 HydrophobicContact CG-CE2 4.36Å; Q54-F77 HydrophobicContact CG-CZ 3.73Å; Q54-F77 VanDerWaalsContact NE2-CZ 3.34Å
55	L	56.4	Low	57.3	Low	72 Å²	72	71.5 Å²	71.5	38%	0.377	36%	0.357	S	S	.	.			trans	-62.8	89.5	159.4	-80.6	144.3	0	0	0	108.2	T60 R61 V72	L55-T60 HydrophobicContact CD2-CG2 3.75Å; L55-R61 HydrophobicContact CB-CB 4.45Å; L55-V72 HydrophobicContact CD1-CG1 4.03Å; L55-V72 HydrophobicContact CD1-CG2 3.71Å
56	S	53.5	Low	56.7	Low	46 Å²	46	74.7 Å²	74.7	32%	0.322	38%	0.38	S	S	.	.			trans	-79.9	-16.3	-171.1	44.4	0	0	0	0	113.5	Q54 P58	Q54-S56 PolarHBondContact O-N 3.02Å; S56-P58 VanDerWaalsContact O-CD 3.32Å; S56-P58 WeakPolarHBondContact O-CD 3.42Å
57	D	57.9	Low	55.2	Low	69 Å²	69	80.9 Å²	80.9	37%	0.369	40%	0.397	S	S	.	.			trans	-83.5	113.9	172.3	175.1	30.6	0	0	0	111	K59 T60 R61	D57-K59 PolarHBondContact O-N 3.46Å; D57-K59 WeakPolarHBondContact OD1-CB 3.39Å; D57-K59 PolarHBondContact OD1-N 3.24Å; D57-K59 VanDerWaalsContact OD1-N 3.11Å; D57-T60 PolarHBondContact O-N 2.84Å; D57-T60 VanDerWaalsContact OD2-CB 3.26Å; D57-T60 WeakPolarHBondContact OD2-CB 3.39Å; D57-T60 PolarHBondContact OD2-N 3.32Å; D57-T60 PolarHBondContact OD2-OG1 3.44Å; D57-R61 WeakPolarHBondContact O-CB 3.01Å; D57-R61 PolarHBondContact O-N 3.49Å
58	P	58.1	Low	53.8	Low	78 Å²	78	84.4 Å²	84.4	51%	0.506	41%	0.413	S	S	.	.	H	α-helix	trans	-59.5	-28.5	178.4	-20.5	32	0	0	0	112.9	S56 R62	S56-P58 VanDerWaalsContact O-CD 3.32Å; S56-P58 WeakPolarHBondContact O-CD 3.42Å; P58-R62 WeakPolarHBondContact O-CB 3.37Å; P58-R62 WeakPolarHBondContact O-CG 3.24Å; P58-R62 PolarHBondContact O-N 3.26Å
59	K	53.2	Low	52.9	Low	150 Å²	150	84.4 Å²	84.4	65%	0.652	42%	0.418	S	S	*	.	H	α-helix	trans	-73.8	-47.5	178.6	-169.1	-178.1	-178.6	-177.4	0	110.7	D57 R62 I63	D57-K59 PolarHBondContact O-N 3.46Å; D57-K59 WeakPolarHBondContact OD1-CB 3.39Å; D57-K59 PolarHBondContact OD1-N 3.24Å; D57-K59 VanDerWaalsContact OD1-N 3.11Å; K59-R62 PolarHBondContact O-N 3.2Å; K59-I63 HydrophobicContact CG-CD1 4.22Å; K59-I63 WeakPolarHBondContact O-CD1 3.47Å; K59-I63 VanDerWaalsContact O-CG1 3.24Å; K59-I63 WeakPolarHBondContact O-CG1 3.37Å; K59-I63 PolarHBondContact O-N 3.2Å
60	T	52.6	Low	52.4	Low	58 Å²	58	85.1 Å²	85.1	36%	0.356	44%	0.44	S	S	.	.	H	α-helix	trans	-62.4	-42.9	174.5	-58.9	0	0	0	0	111.2	L55 D57 R62 I63 V64	L55-T60 HydrophobicContact CD2-CG2 3.75Å; D57-T60 PolarHBondContact O-N 2.84Å; D57-T60 VanDerWaalsContact OD2-CB 3.26Å; D57-T60 WeakPolarHBondContact OD2-CB 3.39Å; D57-T60 PolarHBondContact OD2-N 3.32Å; D57-T60 PolarHBondContact OD2-OG1 3.44Å; T60-R62 PolarHBondContact O-N 2.92Å; T60-I63 PolarHBondContact O-N 2.87Å; T60-V64 HydrophobicContact CG2-CG2 4.28Å; T60-V64 VanDerWaalsContact O-CG2 3.29Å; T60-V64 WeakPolarHBondContact O-CG2 3.47Å; T60-V64 PolarHBondContact O-N 3.46Å
61	R	59.1	Low	51.6	Low	109 Å²	109	89 Å²	89	41%	0.411	46%	0.463	S	S	.	.	H	α-helix	trans	-60.6	-44.9	175.6	-171.4	171.9	179.7	164.6	0.4	112.2	L55 D57 I63 V64 D65	L55-R61 HydrophobicContact CB-CB 4.45Å; D57-R61 WeakPolarHBondContact O-CB 3.01Å; D57-R61 PolarHBondContact O-N 3.49Å; R61-I63 VanDerWaalsContact C-N 3.34Å; R61-I63 PolarHBondContact O-N 2.91Å; R61-V64 PolarHBondContact O-N 3.08Å; R61-D65 WeakPolarHBondContact O-CB 3.48Å; R61-D65 PolarHBondContact O-N 2.73Å
62	R	59.4	Low	51	Low	198 Å²	198	88.4 Å²	88.4	75%	0.747	46%	0.463	S	S	*	.	H	α-helix	trans	-61.5	-39.6	174	-81.2	-177.6	-174.7	-177.8	2.9	113	P58 K59 T60 S66	P58-R62 WeakPolarHBondContact O-CB 3.37Å; P58-R62 WeakPolarHBondContact O-CG 3.24Å; P58-R62 PolarHBondContact O-N 3.26Å; K59-R62 PolarHBondContact O-N 3.2Å; T60-R62 PolarHBondContact O-N 2.92Å; R62-S66 WeakPolarHBondContact O-CB 3.23Å; R62-S66 PolarHBondContact O-N 3.42Å; R62-S66 PolarHBondContact O-OG 3.44Å
63	I	52.4	Low	50.7	Low	82 Å²	82	90 Å²	90	42%	0.421	48%	0.481	S	S	.	.	H	α-helix	trans	-64.4	-50.8	176.7	-69.4	164.8	0	0	0	109.2	K59 T60 R61 D65 S66 Y67	K59-I63 HydrophobicContact CG-CD1 4.22Å; K59-I63 WeakPolarHBondContact O-CD1 3.47Å; K59-I63 VanDerWaalsContact O-CG1 3.24Å; K59-I63 WeakPolarHBondContact O-CG1 3.37Å; K59-I63 PolarHBondContact O-N 3.2Å; T60-I63 PolarHBondContact O-N 2.87Å; R61-I63 VanDerWaalsContact C-N 3.34Å; R61-I63 PolarHBondContact O-N 2.91Å; I63-D65 PolarHBondContact O-N 3.37Å; I63-S66 WeakPolarHBondContact CA-OG 3.4Å; I63-S66 PolarHBondContact O-N 2.91Å; I63-S66 VanDerWaalsContact O-N 3.13Å; I63-S66 PolarHBondContact O-OG 3.3Å; I63-Y67 HydrophobicContact CG2-CD2 3.81Å; I63-Y67 HydrophobicContact CG2-CE2 3.99Å; I63-Y67 VanDerWaalsContact O-CD2 3.28Å; I63-Y67 WeakPolarHBondContact O-CD2 3.44Å; I63-Y67 PolarHBondContact O-N 2.92Å
64	V	48.7	Very low	50.9	Low	38 Å²	38	91 Å²	91	23%	0.23	50%	0.497	C	S	.	.	H	α-helix	trans	-60.5	-46	179.3	176.5	0	0	0	0	111.3	T60 R61 S66 Y67 L68 V72	T60-V64 HydrophobicContact CG2-CG2 4.28Å; T60-V64 VanDerWaalsContact O-CG2 3.29Å; T60-V64 WeakPolarHBondContact O-CG2 3.47Å; T60-V64 PolarHBondContact O-N 3.46Å; R61-V64 PolarHBondContact O-N 3.08Å; V64-S66 VanDerWaalsContact C-N 3.28Å; V64-S66 PolarHBondContact O-N 3.18Å; V64-Y67 PolarHBondContact O-N 2.62Å; V64-L68 CarbonylContact O-C 3.59Å; V64-L68 WeakPolarHBondContact O-CA 3.18Å; V64-L68 PolarHBondContact O-N 2.86Å; V64-V72 HydrophobicContact CB-CG2 4.45Å; V64-V72 HydrophobicContact CG1-CG2 3.55Å
65	D	55.3	Low	50.9	Low	67 Å²	67	89.9 Å²	89.9	36%	0.358	50%	0.498	S	S	.	.	H	α-helix	trans	-64.7	-31	176.7	-75.9	-22.2	0	0	0	112.5	R61 I63	R61-D65 WeakPolarHBondContact O-CB 3.48Å; R61-D65 PolarHBondContact O-N 2.73Å; I63-D65 PolarHBondContact O-N 3.37Å
66	S	50.4	Low	51.2	Low	83 Å²	83	92 Å²	92	58%	0.58	51%	0.51	S	S	*	.	H	α-helix	trans	-74.6	-32	177.4	72	0	0	0	0	114	R62 I63 V64	R62-S66 WeakPolarHBondContact O-CB 3.23Å; R62-S66 PolarHBondContact O-N 3.42Å; R62-S66 PolarHBondContact O-OG 3.44Å; I63-S66 WeakPolarHBondContact CA-OG 3.4Å; I63-S66 PolarHBondContact O-N 2.91Å; I63-S66 VanDerWaalsContact O-N 3.13Å; I63-S66 PolarHBondContact O-OG 3.3Å; V64-S66 VanDerWaalsContact C-N 3.28Å; V64-S66 PolarHBondContact O-N 3.18Å
67	Y	38	Very low	51.8	Low	186 Å²	186	90.6 Å²	90.6	73%	0.729	50%	0.498	S	S	*	.	H	α-helix	trans	-93	-26.6	-179.7	-80	-79.1	0	0	0	112.3	I63 V64	I63-Y67 HydrophobicContact CG2-CD2 3.81Å; I63-Y67 HydrophobicContact CG2-CE2 3.99Å; I63-Y67 VanDerWaalsContact O-CD2 3.28Å; I63-Y67 WeakPolarHBondContact O-CD2 3.44Å; I63-Y67 PolarHBondContact O-N 2.92Å; V64-Y67 PolarHBondContact O-N 2.62Å
68	L	37	Very low	52.2	Low	95 Å²	95	91.3 Å²	91.3	50%	0.497	50%	0.502	S	S	.	.	S	Bend	trans	-145.3	73.5	-171.3	-70.8	175.9	0	0	0	110.9	V64 G70 V71	V64-L68 CarbonylContact O-C 3.59Å; V64-L68 WeakPolarHBondContact O-CA 3.18Å; V64-L68 PolarHBondContact O-N 2.86Å; L68-G70 PolarHBondContact O-N 3.14Å; L68-V71 HydrophobicContact CB-CB 3.85Å; L68-V71 HydrophobicContact CB-CG1 4.48Å; L68-V71 HydrophobicContact CB-CG2 3.63Å; L68-V71 HydrophobicContact CD1-CG1 4.35Å; L68-V71 HydrophobicContact CD1-CG2 4.4Å; L68-V71 HydrophobicContact CD2-CG2 4.35Å; L68-V71 HydrophobicContact CG-CG2 4.34Å; L68-V71 PolarHBondContact O-N 3.05Å
69	P	42.6	Very low	52.5	Low	109 Å²	109	88.6 Å²	88.6	71%	0.708	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	126.3	179.8	24.5	-33	0	0	0	110.7
70	G	46.5	Very low	53.1	Low	73 Å²	73	82.9 Å²	82.9	75%	0.753	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.2	0.5	177.9	0	0	0	0	0	115.9	L68	L68-G70 PolarHBondContact O-N 3.14Å
71	V	41.6	Very low	53.8	Low	87 Å²	87	83.1 Å²	83.1	53%	0.527	46%	0.46	S	S	.	.			trans	-79.1	-21	178.8	171.6	0	0	0	0	113.1	L68 P73	L68-V71 HydrophobicContact CB-CB 3.85Å; L68-V71 HydrophobicContact CB-CG1 4.48Å; L68-V71 HydrophobicContact CB-CG2 3.63Å; L68-V71 HydrophobicContact CD1-CG1 4.35Å; L68-V71 HydrophobicContact CD1-CG2 4.4Å; L68-V71 HydrophobicContact CD2-CG2 4.35Å; L68-V71 HydrophobicContact CG-CG2 4.34Å; L68-V71 PolarHBondContact O-N 3.05Å; V71-P73 WeakPolarHBondContact O-CD 3.09Å
72	V	47.8	Very low	54.1	Low	38 Å²	38	85.6 Å²	85.6	23%	0.23	49%	0.487	C	S	.	.	S	Bend	trans	-91.7	101.5	172.3	-173.6	0	0	0	0	108.2	L55 V64	L55-V72 HydrophobicContact CD1-CG1 4.03Å; L55-V72 HydrophobicContact CD1-CG2 3.71Å; V64-V72 HydrophobicContact CB-CG2 4.45Å; V64-V72 HydrophobicContact CG1-CG2 3.55Å
73	P	46	Very low	54	Low	98 Å²	98	79 Å²	79	64%	0.636	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-60.9	146.4	176.5	25.3	-33.1	0	0	0	109.9	V71 A75	V71-P73 WeakPolarHBondContact O-CD 3.09Å; P73-A75 PolarHBondContact O-N 3.43Å
74	P	53.8	Low	54.4	Low	115 Å²	115	77.5 Å²	77.5	75%	0.747	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-56.9	138.7	172	24.8	-32.3	0	0	0	109	N76	P74-N76 PolarHBondContact O-N 2.9Å; P74-N76 VanDerWaalsContact O-N 3.07Å
75	A	58.6	Low	55	Low	37 Å²	37	80.1 Å²	80.1	31%	0.306	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-52.9	120.9	176.8	0	0	0	0	0	109.1	Q54 P73 F77	Q54-A75 HydrophobicContact CG-CB 4.42Å; P73-A75 PolarHBondContact O-N 3.43Å; A75-F77 HydrophobicContact CB-CD1 4.06Å; A75-F77 HydrophobicContact CB-CE1 3.79Å; A75-F77 HydrophobicContact CB-CE2 4.43Å; A75-F77 HydrophobicContact CB-CG 4.47Å; A75-F77 HydrophobicContact CB-CZ 4.02Å; A75-F77 PolarHBondContact O-N 3.5Å
76	N	61.9	Low	55.2	Low	115 Å²	115	82.7 Å²	82.7	62%	0.615	52%	0.519	S	S	*	.	S	Bend	trans	-84.1	15.7	176.5	62	-21.2	0	0	0	112	P43 P74	P43-N76 VanDerWaalsContact CD-O 3.28Å; P43-N76 WeakPolarHBondContact CD-O 3.39Å; P74-N76 PolarHBondContact O-N 2.9Å; P74-N76 VanDerWaalsContact O-N 3.07Å
77	F	66.4	Low	55.4	Low	17 Å²	17	80 Å²	80	8%	0.075	50%	0.502	C	S	.	.	S	Bend	trans	-134.8	153	-178.9	59.8	-90.5	0	0	0	110.9	P43 V45 F53 Q54 A75 V79	P43-F77 HydrophobicContact CB-CB 4.36Å; P43-F77 HydrophobicContact CG-CB 4.02Å; P43-F77 CarbonylContact O-C 3.52Å; P43-F77 WeakPolarHBondContact O-CA 3.33Å; P43-F77 WeakPolarHBondContact O-CB 3.42Å; V45-F77 HydrophobicContact CB-CD2 3.78Å; V45-F77 HydrophobicContact CB-CE2 4.18Å; V45-F77 HydrophobicContact CG2-CB 3.93Å; V45-F77 HydrophobicContact CG2-CD2 3.49Å; V45-F77 VanDerWaalsContact CG2-CD2 3.49Å; V45-F77 HydrophobicContact CG2-CE2 4.09Å; V45-F77 HydrophobicContact CG2-CG 3.8Å; F53-F77 HydrophobicContact CB-CD1 4.43Å; F53-F77 HydrophobicContact CB-CE1 3.47Å; F53-F77 VanDerWaalsContact CB-CE1 3.47Å; F53-F77 HydrophobicContact CB-CE2 4.02Å; F53-F77 HydrophobicContact CB-CZ 3.19Å; F53-F77 HydrophobicContact CG-CE1 4.45Å; F53-F77 HydrophobicContact CG-CZ 4.28Å; Q54-F77 HydrophobicContact CG-CE2 4.36Å; Q54-F77 HydrophobicContact CG-CZ 3.73Å; Q54-F77 VanDerWaalsContact NE2-CZ 3.34Å; A75-F77 HydrophobicContact CB-CD1 4.06Å; A75-F77 HydrophobicContact CB-CE1 3.79Å; A75-F77 HydrophobicContact CB-CE2 4.43Å; A75-F77 HydrophobicContact CB-CG 4.47Å; A75-F77 HydrophobicContact CB-CZ 4.02Å; A75-F77 PolarHBondContact O-N 3.5Å; F77-V79 HydrophobicContact CD2-CG2 4.1Å; F77-V79 HydrophobicContact CE2-CG2 3.83Å
78	D	66.4	Low	55.8	Low	84 Å²	84	74.2 Å²	74.2	45%	0.449	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	137.4	174.9	-66	-33.4	0	0	0	109.9	P43 V44 V45	P43-D78 PolarHBondContact O-N 2.89Å; V44-D78 CarbonylContact C-O 3.55Å; V44-D78 WeakPolarHBondContact CA-O 3.45Å; V45-D78 PolarHBondContact N-O 3.04Å
79	V	64.8	Low	55.8	Low	21 Å²	21	74.6 Å²	74.6	13%	0.127	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	126.4	178.2	-172.8	0	0	0	0	109.5	V45 A47 A50 F77 P86 A87	V45-V79 VanDerWaalsContact O-CA 3.28Å; V45-V79 WeakPolarHBondContact O-CA 3.32Å; A47-V79 HydrophobicContact CB-CG1 4.1Å; A50-V79 HydrophobicContact CB-CB 4.39Å; A50-V79 HydrophobicContact CB-CG1 3.63Å; A50-V79 HydrophobicContact CB-CG2 3.74Å; F77-V79 HydrophobicContact CD2-CG2 4.1Å; F77-V79 HydrophobicContact CE2-CG2 3.83Å; V79-P86 WeakPolarHBondContact O-CA 3.21Å; V79-A87 HydrophobicContact CB-CB 4.45Å; V79-A87 HydrophobicContact CG1-CB 3.87Å; V79-A87 PolarHBondContact O-N 3.18Å
80	V	66.4	Low	55.4	Low	30 Å²	30	71.6 Å²	71.6	18%	0.182	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	144.3	178.5	-65.7	0	0	0	0	112.2	V44 V45 P46 A47 N85	V44-V80 HydrophobicContact CG1-CB 3.97Å; V44-V80 HydrophobicContact CG1-CG1 3.49Å; V44-V80 VanDerWaalsContact CG1-CG1 3.49Å; V44-V80 HydrophobicContact CG1-CG2 3.27Å; V45-V80 PolarHBondContact O-N 2.72Å; P46-V80 CarbonylContact C-O 3.55Å; A47-V80 WeakPolarHBondContact CB-O 3.41Å; A47-V80 PolarHBondContact N-O 3.01Å; V80-N85 CarbonylContact C-O 3.57Å; V80-N85 VanDerWaalsContact CA-O 3.24Å; V80-N85 WeakPolarHBondContact CA-O 2.9Å
81	D	67.8	Low	54.6	Low	63 Å²	63	73.1 Å²	73.1	34%	0.337	49%	0.49	S	S	.	.			trans	-72.5	180	168.4	72	7.6	0	0	0	111.7	G83 G84 N85	D81-G83 PolarHBondContact O-N 3.25Å; D81-G83 VanDerWaalsContact O-N 3.08Å; D81-G83 WeakPolarHBondContact OD1-CA 3.3Å; D81-G83 PolarHBondContact OD1-N 2.97Å; D81-G84 PolarHBondContact O-N 3.29Å; D81-G84 PolarHBondContact OD1-N 2.83Å; D81-N85 PolarHBondContact N-O 3.05Å; D81-N85 PolarHBondContact OD1-N 2.9Å; D81-N85 PolarHBondContact OD2-ND2 3.36Å
82	V	64	Low	54.2	Low	161 Å²	161	73.4 Å²	73.4	98%	0.976	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-17.3	177.7	-173.9	0	0	0	0	112.3
83	G	58.8	Low	53.4	Low	60 Å²	60	80.7 Å²	80.7	62%	0.619	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	5.2	177.7	0	0	0	0	0	114.9	D81 N85	D81-G83 PolarHBondContact O-N 3.25Å; D81-G83 VanDerWaalsContact O-N 3.08Å; D81-G83 WeakPolarHBondContact OD1-CA 3.3Å; D81-G83 PolarHBondContact OD1-N 2.97Å; G83-N85 VanDerWaalsContact C-N 3.3Å; G83-N85 PolarHBondContact O-N 2.89Å
84	G	59	Low	52.9	Low	50 Å²	50	81.2 Å²	81.2	52%	0.515	52%	0.521	S	S	.	.	S	Bend	trans	77.9	9.4	-178.5	0	0	0	0	0	114.8	D81	D81-G84 PolarHBondContact O-N 3.29Å; D81-G84 PolarHBondContact OD1-N 2.83Å
85	N	62.5	Low	52.1	Low	94 Å²	94	79 Å²	79	50%	0.503	51%	0.507	S	S	.	.			trans	-86.8	148.2	177.2	-56.5	-63.1	0	0	0	110.8	V80 D81 G83 A87	V80-N85 CarbonylContact C-O 3.57Å; V80-N85 VanDerWaalsContact CA-O 3.24Å; V80-N85 WeakPolarHBondContact CA-O 2.9Å; D81-N85 PolarHBondContact N-O 3.05Å; D81-N85 PolarHBondContact OD1-N 2.9Å; D81-N85 PolarHBondContact OD2-ND2 3.36Å; G83-N85 VanDerWaalsContact C-N 3.3Å; G83-N85 PolarHBondContact O-N 2.89Å; N85-A87 PolarHBondContact O-N 3.46Å; N85-A87 VanDerWaalsContact O-N 3.09Å
86	P	59.1	Low	51.4	Low	120 Å²	120	82 Å²	82	78%	0.779	52%	0.521	S	S	*	.	B	Isolated β-bridge	trans	-59	115.5	177.4	23.8	-33.2	0	0	0	110.8	V79	V79-P86 WeakPolarHBondContact O-CA 3.21Å
87	A	54.2	Low	50.4	Low	28 Å²	28	77.2 Å²	77.2	23%	0.231	50%	0.498	C	S	.	.			trans	-82.5	118.9	-179.8	0	0	0	0	0	110.1	A47 V79 N85 V90	A47-A87 HydrophobicContact CB-CB 3.96Å; V79-A87 HydrophobicContact CB-CB 4.45Å; V79-A87 HydrophobicContact CG1-CB 3.87Å; V79-A87 PolarHBondContact O-N 3.18Å; N85-A87 PolarHBondContact O-N 3.46Å; N85-A87 VanDerWaalsContact O-N 3.09Å; A87-V90 HydrophobicContact CB-CG2 4.29Å
88	G	47	Very low	49.1	Very low	64 Å²	64	78.6 Å²	78.6	66%	0.66	51%	0.506	S	S	*	.			trans	-60.4	159.3	168.3	0	0	0	0	0	112	V90	G88-V90 WeakPolarHBondContact O-CG2 3.37Å; G88-V90 PolarHBondContact O-N 2.89Å
89	A	36.6	Very low	48.2	Very low	103 Å²	103	76.6 Å²	76.6	85%	0.851	50%	0.497	S	S	*	.			trans	-38.3	108.3	-171.7	0	0	0	0	0	114.6
90	V	34.6	Very low	47.4	Very low	45 Å²	45	79.5 Å²	79.5	27%	0.273	51%	0.509	S	S	.	.			trans	-87.1	116.9	-176.3	179.7	0	0	0	0	109.8	A47 A87 G88 V92	A47-V90 HydrophobicContact CB-CG2 4.09Å; A87-V90 HydrophobicContact CB-CG2 4.29Å; G88-V90 WeakPolarHBondContact O-CG2 3.37Å; G88-V90 PolarHBondContact O-N 2.89Å; V90-V92 HydrophobicContact CG1-CB 4.49Å; V90-V92 HydrophobicContact CG1-CG2 3.51Å
91	T	28.7	Very low	46.5	Very low	106 Å²	106	78 Å²	78	65%	0.65	50%	0.5	S	S	*	.			trans	-102.2	111.4	171.1	39.9	0	0	0	0	108.9
92	V	33.1	Very low	45.4	Very low	93 Å²	93	75.8 Å²	75.8	56%	0.564	49%	0.489	S	S	*	.			trans	-140.4	133.7	-179.8	-178.2	0	0	0	0	113	V90	V90-V92 HydrophobicContact CG1-CB 4.49Å; V90-V92 HydrophobicContact CG1-CG2 3.51Å
93	K	31.5	Very low	44.9	Very low	191 Å²	191	72.3 Å²	72.3	83%	0.83	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-70.7	142.8	176.2	-73.1	169.6	172.9	172.5	0	111.3	P95	K93-P95 WeakPolarHBondContact O-CD 3.32Å
94	V	35.1	Very low	44.4	Very low	108 Å²	108	71.5 Å²	71.5	66%	0.655	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-53.9	124.7	169	-178.6	0	0	0	0	108.9	T96 V99	V94-T96 PolarHBondContact O-N 3.49Å; V94-T96 VanDerWaalsContact O-N 3.16Å; V94-V99 HydrophobicContact CG1-CG2 3.96Å
95	P	37.5	Very low	43.8	Very low	70 Å²	70	70.7 Å²	70.7	46%	0.455	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-60.8	120.3	178.3	-22.3	32.5	0	0	0	110.1	K93 A97 L98	K93-P95 WeakPolarHBondContact O-CD 3.32Å; P95-A97 HydrophobicContact CB-CB 4.18Å; P95-A97 PolarHBondContact O-N 2.84Å; P95-L98 PolarHBondContact O-N 2.82Å
96	T	44.1	Very low	43.1	Very low	98 Å²	98	69.6 Å²	69.6	60%	0.601	42%	0.423	S	S	*	.	H	α-helix	trans	-50.6	-32.9	178	-39	0	0	0	0	112.2	V94 L98 V99 Q100	V94-T96 PolarHBondContact O-N 3.49Å; V94-T96 VanDerWaalsContact O-N 3.16Å; T96-L98 VanDerWaalsContact C-N 3.34Å; T96-L98 PolarHBondContact O-N 3.47Å; T96-V99 PolarHBondContact O-N 2.89Å; T96-Q100 HydrophobicContact CG2-CG 4.43Å; T96-Q100 WeakPolarHBondContact O-CB 3.26Å; T96-Q100 VanDerWaalsContact O-CG 3.26Å; T96-Q100 WeakPolarHBondContact O-CG 3.43Å; T96-Q100 PolarHBondContact O-N 3.37Å
97	A	41.6	Very low	42.7	Very low	15 Å²	15	69.6 Å²	69.6	12%	0.124	41%	0.408	C	S	.	.	H	α-helix	trans	-43.1	-49.5	169.8	0	0	0	0	0	115.6	P95 Q100 G101 S292	P95-A97 HydrophobicContact CB-CB 4.18Å; P95-A97 PolarHBondContact O-N 2.84Å; A97-Q100 PolarHBondContact O-N 3.03Å; A97-G101 PolarHBondContact O-N 2.81Å; A97-S292 VanDerWaalsContact CA-O 3.27Å; A97-S292 WeakPolarHBondContact CA-O 3.45Å; A97-S292 WeakPolarHBondContact CB-O 3.17Å
98	L	38.9	Very low	42.3	Very low	46 Å²	46	69.5 Å²	69.5	24%	0.241	40%	0.403	C	S	.	.	H	α-helix	trans	-78.3	-37.2	-170.7	-143.6	148.6	0	0	0	109.9	P95 T96 G101 V102 F344	P95-L98 PolarHBondContact O-N 2.82Å; T96-L98 VanDerWaalsContact C-N 3.34Å; T96-L98 PolarHBondContact O-N 3.47Å; L98-G101 PolarHBondContact O-N 3.2Å; L98-V102 WeakPolarHBondContact O-CG2 3.47Å; L98-V102 PolarHBondContact O-N 2.79Å; L98-V102 VanDerWaalsContact O-N 3.08Å; L98-F344 HydrophobicContact CD2-CE2 4.39Å; L98-F344 HydrophobicContact CD2-CZ 4.24Å
99	V	46.5	Very low	42.1	Very low	43 Å²	43	69.3 Å²	69.3	26%	0.261	40%	0.395	S	S	.	.	H	α-helix	trans	-62	-44.7	170.2	-178.9	0	0	0	0	110.6	V94 T96 V102 Q103	V94-V99 HydrophobicContact CG1-CG2 3.96Å; T96-V99 PolarHBondContact O-N 2.89Å; V99-V102 PolarHBondContact O-N 3.36Å; V99-Q103 WeakPolarHBondContact O-CB 3.43Å; V99-Q103 VanDerWaalsContact O-CG 3.3Å; V99-Q103 WeakPolarHBondContact O-CG 3.31Å; V99-Q103 PolarHBondContact O-N 3.35Å
100	Q	48.8	Very low	42.7	Very low	81 Å²	81	68 Å²	68	38%	0.379	37%	0.373	S	S	.	.	H	α-helix	trans	-64.6	-40.4	177	-75.2	173.4	-8.2	0	0	112.4	T96 A97 Q103 L104	T96-Q100 HydrophobicContact CG2-CG 4.43Å; T96-Q100 WeakPolarHBondContact O-CB 3.26Å; T96-Q100 VanDerWaalsContact O-CG 3.26Å; T96-Q100 WeakPolarHBondContact O-CG 3.43Å; T96-Q100 PolarHBondContact O-N 3.37Å; A97-Q100 PolarHBondContact O-N 3.03Å; Q100-Q103 PolarHBondContact O-N 2.84Å; Q100-L104 VanDerWaalsContact O-CB 3.3Å; Q100-L104 WeakPolarHBondContact O-CB 3.49Å; Q100-L104 PolarHBondContact O-N 3.47Å
101	G	46.7	Very low	43	Very low	0 Å²	0	68.7 Å²	68.7	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-60.1	-44.5	175.9	0	0	0	0	0	113.1	A97 L98 L104 A105	A97-G101 PolarHBondContact O-N 2.81Å; L98-G101 PolarHBondContact O-N 3.2Å; G101-L104 PolarHBondContact O-N 2.81Å; G101-A105 WeakPolarHBondContact O-CB 3.31Å; G101-A105 PolarHBondContact O-N 3.21Å
102	V	46.5	Very low	43.9	Very low	16 Å²	16	70.8 Å²	70.8	10%	0.097	39%	0.39	C	S	.	.	H	α-helix	trans	-67.4	-44.7	176.6	173.5	0	0	0	0	111.2	L98 V99 L104 A105 E106 F344 P351 L352	L98-V102 WeakPolarHBondContact O-CG2 3.47Å; L98-V102 PolarHBondContact O-N 2.79Å; L98-V102 VanDerWaalsContact O-N 3.08Å; V99-V102 PolarHBondContact O-N 3.36Å; V102-L104 VanDerWaalsContact C-N 3.29Å; V102-L104 PolarHBondContact O-N 2.86Å; V102-A105 WeakPolarHBondContact O-CB 3.36Å; V102-A105 PolarHBondContact O-N 2.97Å; V102-E106 WeakPolarHBondContact O-CG 3.25Å; V102-E106 PolarHBondContact O-N 3.37Å; V102-F344 HydrophobicContact CG2-CE1 4.09Å; V102-F344 HydrophobicContact CG2-CZ 4.02Å; V102-P351 HydrophobicContact CG1-CB 4.42Å; V102-P351 HydrophobicContact CG1-CG 4.23Å; V102-L352 HydrophobicContact CG1-CD2 3.57Å; V102-L352 HydrophobicContact CG1-CG 4.33Å
103	Q	51.7	Low	44.5	Very low	88 Å²	88	69.4 Å²	69.4	41%	0.411	38%	0.382	S	S	.	.	H	α-helix	trans	-64.1	-32.9	176.4	-74.3	176.6	-7.8	0	0	113.3	V99 Q100 R107	V99-Q103 WeakPolarHBondContact O-CB 3.43Å; V99-Q103 VanDerWaalsContact O-CG 3.3Å; V99-Q103 WeakPolarHBondContact O-CG 3.31Å; V99-Q103 PolarHBondContact O-N 3.35Å; Q100-Q103 PolarHBondContact O-N 2.84Å; Q103-R107 PolarHBondContact O-N 2.86Å; Q103-R107 VanDerWaalsContact O-N 3.08Å
104	L	49.8	Very low	44.9	Very low	43 Å²	43	63 Å²	63	23%	0.225	37%	0.371	C	S	.	.	H	α-helix	trans	-69.5	-46	173.8	-176	65.1	0	0	0	110.3	Q100 G101 V102 E106 R107 I108 V291	Q100-L104 VanDerWaalsContact O-CB 3.3Å; Q100-L104 WeakPolarHBondContact O-CB 3.49Å; Q100-L104 PolarHBondContact O-N 3.47Å; G101-L104 PolarHBondContact O-N 2.81Å; V102-L104 VanDerWaalsContact C-N 3.29Å; V102-L104 PolarHBondContact O-N 2.86Å; L104-E106 VanDerWaalsContact C-N 3.29Å; L104-E106 PolarHBondContact O-N 3.44Å; L104-R107 PolarHBondContact O-N 2.99Å; L104-I108 HydrophobicContact CD1-CD1 4.12Å; L104-I108 HydrophobicContact CD1-CG1 4.36Å; L104-I108 HydrophobicContact CD2-CD1 4.37Å; L104-I108 HydrophobicContact CG-CD1 3.75Å; L104-I108 HydrophobicContact CG-CG1 4.39Å; L104-I108 WeakPolarHBondContact O-CB 3.49Å; L104-I108 VanDerWaalsContact O-CG1 3.23Å; L104-I108 WeakPolarHBondContact O-CG1 3.45Å; L104-I108 PolarHBondContact O-N 3.4Å; L104-V291 HydrophobicContact CD2-CG2 3.52Å
105	A	46.2	Very low	45.1	Very low	32 Å²	32	64.9 Å²	64.9	26%	0.264	38%	0.377	S	S	.	.	H	α-helix	trans	-58.1	-40.5	175.2	0	0	0	0	0	112	G101 V102 A109 L313	G101-A105 WeakPolarHBondContact O-CB 3.31Å; G101-A105 PolarHBondContact O-N 3.21Å; V102-A105 WeakPolarHBondContact O-CB 3.36Å; V102-A105 PolarHBondContact O-N 2.97Å; A105-A109 VanDerWaalsContact O-CB 3.24Å; A105-A109 WeakPolarHBondContact O-CB 3.49Å; A105-A109 PolarHBondContact O-N 3.08Å; A105-L313 HydrophobicContact CB-CD2 4.31Å
106	E	46.2	Very low	45.2	Very low	72 Å²	72	65.1 Å²	65.1	34%	0.336	38%	0.378	S	S	.	.	H	α-helix	trans	-63.8	-45.8	173.8	-75.5	-173.3	148.9	0	0	112.7	V102 L104 I108 A109 D110	V102-E106 WeakPolarHBondContact O-CG 3.25Å; V102-E106 PolarHBondContact O-N 3.37Å; L104-E106 VanDerWaalsContact C-N 3.29Å; L104-E106 PolarHBondContact O-N 3.44Å; E106-I108 VanDerWaalsContact C-N 3.33Å; E106-I108 PolarHBondContact O-N 3.44Å; E106-A109 PolarHBondContact O-N 2.96Å; E106-D110 WeakPolarHBondContact O-CB 3.43Å; E106-D110 PolarHBondContact O-N 3.33Å
107	R	51	Low	44.8	Very low	120 Å²	120	66.1 Å²	66.1	45%	0.453	38%	0.379	S	S	.	.	H	α-helix	trans	-63.7	-39.3	178.3	-84.9	-173.7	-73.9	157.5	-5	112.7	Q103 L104 G111 K112	Q103-R107 PolarHBondContact O-N 2.86Å; Q103-R107 VanDerWaalsContact O-N 3.08Å; L104-R107 PolarHBondContact O-N 2.99Å; R107-G111 PolarHBondContact O-N 2.86Å; R107-K112 PolarHBondContact O-N 2.71Å; R107-K112 VanDerWaalsContact O-N 3.1Å
108	I	46.5	Very low	44.5	Very low	26 Å²	26	70.9 Å²	70.9	13%	0.133	41%	0.412	C	S	.	.	H	α-helix	trans	-65.1	-46.7	175.8	-70.1	171.5	0	0	0	109.5	L104 E106 D110 G111 V113 L279 I283	L104-I108 HydrophobicContact CD1-CD1 4.12Å; L104-I108 HydrophobicContact CD1-CG1 4.36Å; L104-I108 HydrophobicContact CD2-CD1 4.37Å; L104-I108 HydrophobicContact CG-CD1 3.75Å; L104-I108 HydrophobicContact CG-CG1 4.39Å; L104-I108 WeakPolarHBondContact O-CB 3.49Å; L104-I108 VanDerWaalsContact O-CG1 3.23Å; L104-I108 WeakPolarHBondContact O-CG1 3.45Å; L104-I108 PolarHBondContact O-N 3.4Å; E106-I108 VanDerWaalsContact C-N 3.33Å; E106-I108 PolarHBondContact O-N 3.44Å; I108-D110 PolarHBondContact O-N 3.2Å; I108-G111 PolarHBondContact O-N 3.15Å; I108-V113 HydrophobicContact CG1-CG2 4.47Å; I108-L279 HydrophobicContact CG2-CD1 3.9Å; I108-L279 HydrophobicContact CG2-CD2 3.58Å; I108-L279 HydrophobicContact CG2-CG 4.02Å; I108-L279 WeakPolarHBondContact O-CD1 3.47Å; I108-I283 HydrophobicContact CD1-CD1 4.05Å; I108-I283 HydrophobicContact CG2-CD1 3.92Å
109	A	43.4	Very low	44.3	Very low	59 Å²	59	71.8 Å²	71.8	49%	0.488	43%	0.432	S	S	.	.	H	α-helix	trans	-66.8	-34.9	179.4	0	0	0	0	0	113.6	A105 E106 G111	A105-A109 VanDerWaalsContact O-CB 3.24Å; A105-A109 WeakPolarHBondContact O-CB 3.49Å; A105-A109 PolarHBondContact O-N 3.08Å; E106-A109 PolarHBondContact O-N 2.96Å; A109-G111 PolarHBondContact O-N 3.29Å
110	D	47.6	Very low	43.6	Very low	75 Å²	75	79 Å²	79	40%	0.401	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	0.6	176.3	-88.4	-2.3	0	0	0	113.1	E106 I108 K112 K502	E106-D110 WeakPolarHBondContact O-CB 3.43Å; E106-D110 PolarHBondContact O-N 3.33Å; I108-D110 PolarHBondContact O-N 3.2Å; D110-K112 HydrophobicContact CB-CD 4.4Å; D110-K112 HydrophobicContact CB-CG 4.24Å; D110-K112 PolarHBondContact O-N 3.16Å; D110-K502 IonicContact OD1-NZ 2.62Å; D110-K502 PolarHBondContact OD1-NZ 3.18Å; D110-K502 IonicContact OD2-NZ 2.72Å; D110-K502 PolarHBondContact OD2-NZ 3.43Å
111	G	41.1	Very low	42.7	Very low	61 Å²	61	83.6 Å²	83.6	63%	0.629	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	18.2	-178.8	0	0	0	0	0	114.1	R107 I108 A109 V113	R107-G111 PolarHBondContact O-N 2.86Å; I108-G111 PolarHBondContact O-N 3.15Å; A109-G111 PolarHBondContact O-N 3.29Å; G111-V113 VanDerWaalsContact C-N 3.3Å; G111-V113 PolarHBondContact O-N 3.42Å
112	K	47.4	Very low	42	Very low	149 Å²	149	88.9 Å²	88.9	65%	0.648	52%	0.516	S	S	*	.			trans	-93.5	44.8	-177.4	-69.7	-176.5	-178.1	174.6	0	112.1	R107 D110 G114	R107-K112 PolarHBondContact O-N 2.71Å; R107-K112 VanDerWaalsContact O-N 3.1Å; D110-K112 HydrophobicContact CB-CD 4.4Å; D110-K112 HydrophobicContact CB-CG 4.24Å; D110-K112 PolarHBondContact O-N 3.16Å; K112-G114 PolarHBondContact O-N 2.87Å
113	V	46.9	Very low	41.3	Very low	65 Å²	65	98.1 Å²	98.1	39%	0.394	56%	0.555	S	S	.	*			trans	-87	84.6	174.5	-169.4	0	0	0	0	108.6	I108 G111	I108-V113 HydrophobicContact CG1-CG2 4.47Å; G111-V113 VanDerWaalsContact C-N 3.3Å; G111-V113 PolarHBondContact O-N 3.42Å
114	G	40.3	Very low	40.2	Very low	57 Å²	57	99.5 Å²	99.5	59%	0.588	57%	0.574	S	S	*	*			trans	-92.4	142	158.2	0	0	0	0	0	108.9	K112 P116	K112-G114 PolarHBondContact O-N 2.87Å; G114-P116 VanDerWaalsContact O-CD 3.26Å; G114-P116 WeakPolarHBondContact O-CD 3.46Å
115	N	39.6	Very low	39.4	Very low	146 Å²	146	103.5 Å²	103.5	78%	0.781	60%	0.601	S	S	*	*			trans	-33.9	105	-178.9	-102.8	0.1	0	0	0	112.7	L117	N115-L117 PolarHBondContact O-N 2.9Å
116	P	38.7	Very low	38.8	Very low	75 Å²	75	108.7 Å²	108.7	49%	0.487	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79	16.1	-173.8	29.4	-31.9	0	0	0	113.9	G114	G114-P116 VanDerWaalsContact O-CD 3.26Å; G114-P116 WeakPolarHBondContact O-CD 3.46Å
117	L	35.1	Very low	38.3	Very low	119 Å²	119	113.1 Å²	113.1	62%	0.623	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.2	-0.9	-170.2	-99.1	145.4	0	0	0	115.8	N115 F121	N115-L117 PolarHBondContact O-N 2.9Å; L117-F121 HydrophobicContact CD2-CD2 4.27Å; L117-F121 HydrophobicContact CD2-CE2 3.71Å
118	S	36.4	Very low	37.6	Very low	116 Å²	116	112.4 Å²	112.4	81%	0.811	66%	0.663	S	S	*	*	S	Bend	trans	-98.2	9.6	-174.5	66.5	0	0	0	0	116.2
119	G	33.7	Very low	37.1	Very low	64 Å²	64	115.9 Å²	115.9	66%	0.66	69%	0.69	S	S	*	*	S	Bend	trans	-142.9	-3.9	-173.1	0	0	0	0	0	118.5
120	F	32.5	Very low	36.6	Very low	196 Å²	196	120.4 Å²	120.4	86%	0.86	71%	0.705	S	S	*	*	S	Bend	trans	-122.8	3.8	-167.3	-89.5	-86.1	0	0	0	116.3
121	F	29.7	Very low	36	Very low	176 Å²	176	124.8 Å²	124.8	77%	0.772	72%	0.723	S	S	*	*			trans	-101.1	85.6	168	-69.5	-79.6	0	0	0	110.1	L117	L117-F121 HydrophobicContact CD2-CD2 4.27Å; L117-F121 HydrophobicContact CD2-CE2 3.71Å
122	S	31.3	Very low	35.7	Very low	111 Å²	111	130.2 Å²	130.2	78%	0.776	73%	0.732	S	S	*	*			trans	-142.2	109.9	161.4	-85.8	0	0	0	0	110.1
123	K	31.5	Very low	35.1	Very low	210 Å²	210	126.4 Å²	126.4	91%	0.913	74%	0.735	S	S	*	*			trans	65.1	97.9	160.3	-68	177.6	174.9	176.7	0	117.1
124	S	28.6	Very low	34.6	Very low	117 Å²	117	131.1 Å²	131.1	82%	0.818	76%	0.758	S	S	*	*				-171	86.7	122.5	-168.6	0	0	0	0	110.5
125	T	32.8	Very low	34.5	Very low	128 Å²	128	133.5 Å²	133.5	79%	0.785	77%	0.765	S	S	*	*			trans	-155.4	120.7	157.5	26.5	0	0	0	0	109.6
126	N	34.2	Very low	34.3	Very low	141 Å²	141	129.8 Å²	129.8	75%	0.754	76%	0.761	S	S	*	*			trans	68.8	115.6	152.1	-56.8	-9.9	0	0	0	118.9
127	N	36	Very low	34.3	Very low	165 Å²	165	135.5 Å²	135.5	88%	0.882	78%	0.779	S	S	*	*				-177.3	126.1	105.6	-86.3	-14.4	0	0	0	112.1
128	S	36.6	Very low	34.4	Very low	104 Å²	104	138.2 Å²	138.2	73%	0.727	79%	0.788	S	S	*	*			trans	-82.5	154.6	163.1	49.9	0	0	0	0	111
129	S	36	Very low	34.5	Very low	99 Å²	99	136.2 Å²	136.2	69%	0.692	79%	0.786	S	S	*	*			trans	63.8	105	162.5	57.5	0	0	0	0	116.4
130	L	32.5	Very low	34.8	Very low	155 Å²	155	139.1 Å²	139.1	81%	0.812	80%	0.796	S	S	*	*				101.5	106.5	83.3	-96.1	152.5	0	0	0	109.3
131	E	35.5	Very low	34.9	Very low	167 Å²	167	133.8 Å²	133.8	78%	0.78	80%	0.796	S	S	*	*				175.9	132.4	111.8	-92.7	-167.7	149.4	0	0	112
132	H	34.7	Very low	35.4	Very low	175 Å²	175	128.6 Å²	128.6	81%	0.81	79%	0.793	S	S	*	*			trans	30.8	131.9	140.1	-65.2	79.8	0	0	0	119.6
133	G	33.8	Very low	35.7	Very low	68 Å²	68	129.8 Å²	129.8	70%	0.701	80%	0.801	S	S	*	*			cis	161.6	157.8	8.5	0	0	0	0	0	109.9
134	N	37.5	Very low	36.4	Very low	165 Å²	165	125.2 Å²	125.2	88%	0.882	80%	0.795	S	S	*	*			trans	66.9	139.4	164.1	-88.1	-3.3	0	0	0	119
135	S	37.9	Very low	37.5	Very low	106 Å²	106	128.2 Å²	128.2	74%	0.741	80%	0.801	S	S	*	*			cis	177.6	147.6	-1.9	42.7	0	0	0	0	108.7
136	G	36.1	Very low	37.9	Very low	68 Å²	68	128 Å²	128	70%	0.701	80%	0.804	S	S	*	*			trans	123.8	87.6	155.1	0	0	0	0	0	114.2
137	K	37.6	Very low	38.4	Very low	195 Å²	195	124.5 Å²	124.5	85%	0.848	80%	0.802	S	S	*	*				77.6	134.7	101.4	-89.2	-175.3	176.6	177.8	0	113.3
138	Q	38.3	Very low	39	Very low	176 Å²	176	124.2 Å²	124.2	82%	0.822	80%	0.798	S	S	*	*			cis	-179.7	143.2	-3	-144	172.8	0.7	0	0	104.4
139	G	38.1	Very low	39.5	Very low	75 Å²	75	124 Å²	124	77%	0.773	79%	0.794	S	S	*	*			trans	148.2	80	161.5	0	0	0	0	0	119.1
140	S	40.1	Very low	40.2	Very low	125 Å²	125	126.7 Å²	126.7	87%	0.874	80%	0.801	S	S	*	*			trans	46.6	105.3	135	-171.3	0	0	0	0	121.6
141	G	33.7	Very low	41.4	Very low	83 Å²	83	126 Å²	126	86%	0.856	80%	0.797	S	S	*	*				50.6	109.2	123.4	0	0	0	0	0	120.6
142	G	39.9	Very low	42.2	Very low	68 Å²	68	127.1 Å²	127.1	70%	0.701	80%	0.8	S	S	*	*			trans	178.5	99.2	164.1	0	0	0	0	0	113.6	S144	G142-S144 PolarHBondContact O-N 2.7Å; G142-S144 PolarHBondContact O-OG 3.44Å
143	S	38.1	Very low	43.1	Very low	135 Å²	135	124 Å²	124	94%	0.944	79%	0.794	S	S	*	*			trans	-63.3	124.5	174.1	-47.2	0	0	0	0	111
144	S	47.4	Very low	44.1	Very low	114 Å²	114	130.7 Å²	130.7	80%	0.797	80%	0.804	S	S	*	*			trans	-116.6	90.6	-177.9	-58.5	0	0	0	0	111.6	G142	G142-S144 PolarHBondContact O-N 2.7Å; G142-S144 PolarHBondContact O-OG 3.44Å
145	I	51.7	Low	44.9	Very low	181 Å²	181	130.4 Å²	130.4	93%	0.928	80%	0.802	S	S	*	*			trans	-140.2	60.4	149.7	-150.7	164.7	0	0	0	109.3
146	S	39.9	Very low	45.8	Very low	122 Å²	122	131.1 Å²	131.1	85%	0.853	80%	0.804	S	S	*	*			trans	-90.3	113.7	166.8	62.6	0	0	0	0	108.8
147	G	45.9	Very low	46.5	Very low	69 Å²	69	137.7 Å²	137.7	71%	0.711	81%	0.813	S	S	*	*			trans	-178.6	1.3	177.9	0	0	0	0	0	117.4	P149	G147-P149 WeakPolarHBondContact O-CD 3.21Å
148	I	48.5	Very low	46.9	Very low	158 Å²	158	132.4 Å²	132.4	81%	0.81	81%	0.806	S	S	*	*			trans	-106.9	109.9	176	-56	178	0	0	0	108.6	N150	I148-N150 PolarHBondContact O-N 3.36Å
149	P	45.4	Very low	47.6	Very low	99 Å²	99	129.8 Å²	129.8	64%	0.643	81%	0.805	S	S	*	*			trans	-66.9	125.5	174.4	-1.6	11	0	0	0	110.8	G147 I151	G147-P149 WeakPolarHBondContact O-CD 3.21Å; P149-I151 HydrophobicContact CB-CD1 4.45Å; P149-I151 PolarHBondContact O-N 3.4Å
150	N	51.9	Low	47.9	Very low	157 Å²	157	132.6 Å²	132.6	84%	0.84	81%	0.806	S	S	*	*			trans	-74.5	53.1	173.2	-97.6	-15.2	0	0	0	112.3	I148	I148-N150 PolarHBondContact O-N 3.36Å
151	I	57.7	Low	48.5	Very low	141 Å²	141	132.8 Å²	132.8	72%	0.723	80%	0.802	S	S	*	*			trans	-114.3	94	178.3	-59.8	170.1	0	0	0	108.6	P149 P153	P149-I151 HydrophobicContact CB-CD1 4.45Å; P149-I151 PolarHBondContact O-N 3.4Å; I151-P153 WeakPolarHBondContact O-CD 3.25Å
152	F	51.2	Low	49.4	Very low	190 Å²	190	136.7 Å²	136.7	83%	0.833	80%	0.798	S	S	*	*			trans	-74.6	116.9	165.4	-87.8	-91	0	0	0	109.1	K154	F152-K154 PolarHBondContact O-N 3.21Å
153	P	54.4	Low	49.7	Very low	108 Å²	108	139.4 Å²	139.4	70%	0.701	80%	0.803	S	S	*	*			trans	-65.4	121.7	168.8	25.1	-29.9	0	0	0	109.1	I151 L155	I151-P153 WeakPolarHBondContact O-CD 3.25Å; P153-L155 PolarHBondContact O-N 2.85Å
154	K	54.6	Low	50.1	Low	209 Å²	209	137.3 Å²	137.3	91%	0.909	79%	0.794	S	S	*	*			trans	-65.1	103.3	173.3	-71.7	-179.7	-179.8	175.9	0	108.6	F152	F152-K154 PolarHBondContact O-N 3.21Å
155	L	53.7	Low	49.8	Very low	160 Å²	160	137.9 Å²	137.9	84%	0.838	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-64	134.1	173.1	-72.9	165.3	0	0	0	109.9	P153 K157	P153-L155 PolarHBondContact O-N 2.85Å; L155-K157 PolarHBondContact O-N 3.37Å
156	P	57.5	Low	48.8	Very low	121 Å²	121	136 Å²	136	79%	0.786	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-63.4	133.8	175.9	23.8	-30.6	0	0	0	110.9	A158	P156-A158 PolarHBondContact O-N 2.93Å
157	K	51.2	Low	48.7	Very low	205 Å²	205	133.6 Å²	133.6	89%	0.891	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-60.3	122.8	172.8	-106.9	174.5	174.9	177.5	0	109.2	L155	L155-K157 PolarHBondContact O-N 3.37Å
158	A	46	Very low	47.9	Very low	84 Å²	84	137.6 Å²	137.6	69%	0.694	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-61	139.8	172.4	0	0	0	0	0	110.6	P156 V160	P156-A158 PolarHBondContact O-N 2.93Å; A158-V160 PolarHBondContact O-N 3.19Å
159	P	53	Low	47.5	Very low	122 Å²	122	140.8 Å²	140.8	79%	0.792	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-68.2	124.9	180	26	-31.2	0	0	0	110.7	V161	P159-V161 PolarHBondContact O-N 3.3Å
160	V	45.1	Very low	46.9	Very low	133 Å²	133	142.6 Å²	142.6	81%	0.806	80%	0.798	S	S	*	*			trans	-76.4	103.3	170.6	178.5	0	0	0	0	107.5	A158	A158-V160 PolarHBondContact O-N 3.19Å
161	V	52.1	Low	46	Very low	129 Å²	129	139.8 Å²	139.8	78%	0.782	79%	0.791	S	S	*	*			trans	-85.6	112.8	167.8	-179.6	0	0	0	0	107.6	P159	P159-V161 PolarHBondContact O-N 3.3Å
162	Q	53.2	Low	45.1	Very low	165 Å²	165	141 Å²	141	77%	0.771	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70.4	137	172	-67.2	174	12.9	0	0	109.4	A164	Q162-A164 PolarHBondContact O-N 2.93Å
163	P	45.9	Very low	44.4	Very low	125 Å²	125	140.3 Å²	140.3	81%	0.812	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-68.6	125.7	174.8	26.4	-30.4	0	0	0	110
164	A	46.2	Very low	43.8	Very low	91 Å²	91	140.5 Å²	140.5	75%	0.752	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-65.9	147.4	174.3	0	0	0	0	0	111.2	Q162	Q162-A164 PolarHBondContact O-N 2.93Å
165	P	41	Very low	43.3	Very low	126 Å²	126	136.9 Å²	136.9	82%	0.818	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-74	145.4	-174	29.5	-33.4	0	0	0	112.7	G167	P165-G167 PolarHBondContact O-N 2.94Å
166	V	31.4	Very low	42.5	Very low	143 Å²	143	140.4 Å²	140.4	87%	0.867	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-61.2	124.1	175.6	-179.2	0	0	0	0	110.4
167	G	36.4	Very low	41.6	Very low	71 Å²	71	140.3 Å²	140.3	73%	0.732	80%	0.797	S	S	*	*			trans	-116.3	113.4	165.8	0	0	0	0	0	110.4	P165	P165-G167 PolarHBondContact O-N 2.94Å
168	L	30.2	Very low	41.2	Very low	152 Å²	152	139.6 Å²	139.6	80%	0.796	80%	0.797	S	S	*	*			trans	-55	139.7	158.3	-96.5	78	0	0	0	109.2
169	Y	38.8	Very low	41.4	Very low	226 Å²	226	142 Å²	142	89%	0.886	80%	0.802	S	S	*	*			trans	-166.1	121.8	132.4	-93.7	-67.7	0	0	0	111.5
170	D	34	Very low	41	Very low	136 Å²	136	141.6 Å²	141.6	73%	0.727	80%	0.799	S	S	*	*			trans	3.6	134.8	152.7	-72.3	-45	0	0	0	123.4
171	S	33.4	Very low	40.9	Very low	98 Å²	98	144.5 Å²	144.5	69%	0.685	80%	0.804	S	S	*	*				64.4	116.9	129.1	-53.9	0	0	0	0	119.7
172	I	38.2	Very low	40.1	Very low	167 Å²	167	144 Å²	144	86%	0.856	81%	0.807	S	S	*	*				171.3	116.4	120.4	-80.6	150.1	0	0	0	108.2
173	M	35.8	Very low	39.2	Very low	175 Å²	175	139.6 Å²	139.6	86%	0.862	81%	0.805	S	S	*	*			trans	-80.8	163.9	168.1	-81.3	-128.5	152.7	0	0	111.4
174	P	42	Very low	38.8	Very low	112 Å²	112	143.2 Å²	143.2	73%	0.727	81%	0.814	S	S	*	*				-142.6	132.7	112.7	31.7	-13.7	0	0	0	116.1
175	T	44	Very low	38.4	Very low	133 Å²	133	142.5 Å²	142.5	82%	0.816	82%	0.815	S	S	*	*			trans	60.5	124.3	135.6	52.4	0	0	0	0	123.6
176	R	37	Very low	38.2	Very low	235 Å²	235	142.5 Å²	142.5	89%	0.887	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-96.4	145.2	171.4	178.2	-173.9	-161.3	174.3	6.6	110.6
177	P	39.9	Very low	38.6	Very low	118 Å²	118	143.2 Å²	143.2	77%	0.766	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-86.6	141.5	164.2	-7.8	26.2	0	0	0	113
178	E	41	Very low	38.6	Very low	191 Å²	191	144.5 Å²	144.5	89%	0.893	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-83.7	143.4	-172.3	-159.7	163.8	-161.4	0	0	112.1
179	V	51.5	Low	38.9	Very low	133 Å²	133	142.3 Å²	142.3	81%	0.806	81%	0.808	S	S	*	*			trans	-130.5	133.6	171	-179	0	0	0	0	109.2
180	P	44.9	Very low	38.7	Very low	114 Å²	114	136.7 Å²	136.7	74%	0.74	81%	0.807	S	S	*	*			trans	-85.3	138.3	-161.1	-7.1	26.9	0	0	0	113.9
181	E	41.8	Very low	38.6	Very low	195 Å²	195	134 Å²	134	91%	0.911	81%	0.812	S	S	*	*			trans	-74.6	120.7	159.7	-76.9	-177.7	147.3	0	0	109.5
182	S	36.5	Very low	38.3	Very low	119 Å²	119	132.9 Å²	132.9	83%	0.832	82%	0.816	S	S	*	*			trans	-157	114.8	165.9	-75.2	0	0	0	0	111.3
183	G	33.2	Very low	38	Very low	71 Å²	71	131.1 Å²	131.1	73%	0.732	81%	0.813	S	S	*	*			trans	106	97.2	130.7	0	0	0	0	0	117.4
184	M	38.3	Very low	37.8	Very low	202 Å²	202	131.9 Å²	131.9	100%	0.995	81%	0.811	S	S	*	*				155.5	107.1	125.1	-81.2	-161.3	-122.2	0	0	106.4
185	G	36.9	Very low	37	Very low	75 Å²	75	131.5 Å²	131.5	77%	0.773	82%	0.818	S	S	*	*			cis	135.8	121.8	27.8	0	0	0	0	0	106.8
186	P	38.2	Very low	36.3	Very low	126 Å²	126	131.4 Å²	131.4	82%	0.818	82%	0.817	S	S	*	*			trans	-109.3	163.1	-167.4	39.7	-32	0	0	0	113.9
187	I	38.7	Very low	35.9	Very low	158 Å²	158	129.8 Å²	129.8	81%	0.81	82%	0.819	S	S	*	*			trans	-146.6	97.6	164	-52.2	-179.9	0	0	0	106.9
188	S	36.2	Very low	35.3	Very low	98 Å²	98	127.3 Å²	127.3	69%	0.685	82%	0.815	S	S	*	*				65.9	133.6	92.2	99	0	0	0	0	112.7
189	S	37.2	Very low	34.7	Very low	107 Å²	107	123.6 Å²	123.6	75%	0.748	81%	0.811	S	S	*	*			cis	-170.4	152.1	17.4	-78	0	0	0	0	111.4
190	A	33.3	Very low	33.6	Very low	107 Å²	107	123.9 Å²	123.9	88%	0.884	81%	0.813	S	S	*	*			trans	55	123.1	137.4	0	0	0	0	0	122.4
191	G	32.6	Very low	32.8	Very low	79 Å²	79	121.3 Å²	121.3	81%	0.814	81%	0.807	S	S	*	*			trans	155.7	89.5	155.8	0	0	0	0	0	112
192	G	28	Very low	32	Very low	75 Å²	75	114.2 Å²	114.2	77%	0.773	79%	0.786	S	S	*	*			trans	-65.6	160.2	-174.8	0	0	0	0	0	114.5
193	V	31.1	Very low	31.7	Very low	131 Å²	131	115.1 Å²	115.1	79%	0.794	78%	0.78	S	S	*	*			trans	174.4	124.7	140.9	153.7	0	0	0	0	108.9
194	K	31.2	Very low	31.5	Very low	190 Å²	190	114.4 Å²	114.4	83%	0.826	77%	0.772	S	S	*	*			trans	67.5	132.1	153	-73.8	170.7	-176.2	-179.3	0	121.1
195	A	26.2	Very low	31.2	Very low	105 Å²	105	112.3 Å²	112.3	87%	0.868	76%	0.76	S	S	*	*			trans	-40.6	129.1	167.4	0	0	0	0	0	113.2
196	V	29.5	Very low	31	Very low	131 Å²	131	114.8 Å²	114.8	79%	0.794	75%	0.754	S	S	*	*			trans	-131.1	113	160.5	176.9	0	0	0	0	106.6	G198	V196-G198 PolarHBondContact O-N 3.37Å
197	E	27.6	Very low	30.8	Very low	200 Å²	200	113 Å²	113	94%	0.935	73%	0.734	S	S	*	*			trans	-54.4	103.3	161.6	-72.3	171.6	138.5	0	0	108.3	S199	E197-S199 PolarHBondContact O-N 2.7Å
198	G	27.1	Very low	30.5	Very low	67 Å²	67	112 Å²	112	69%	0.691	73%	0.726	S	S	*	*			trans	-90.7	90	176.2	0	0	0	0	0	109.9	V196 T200	V196-G198 PolarHBondContact O-N 3.37Å; G198-T200 PolarHBondContact O-N 2.95Å; G198-T200 VanDerWaalsContact O-N 3.17Å
199	S	29	Very low	30.4	Very low	113 Å²	113	111.6 Å²	111.6	79%	0.79	72%	0.72	S	S	*	*			trans	-41.7	112	169.1	179.4	0	0	0	0	112.2	E197 G201	E197-S199 PolarHBondContact O-N 2.7Å; S199-G201 PolarHBondContact O-N 3.22Å
200	T	28.3	Very low	30.2	Very low	139 Å²	139	111.8 Å²	111.8	85%	0.853	71%	0.713	S	S	*	*			trans	-73.4	82.9	156.9	49.1	0	0	0	0	107.6	G198 G202	G198-T200 PolarHBondContact O-N 2.95Å; G198-T200 VanDerWaalsContact O-N 3.17Å; T200-G202 PolarHBondContact O-N 3.37Å
201	G	27.3	Very low	30.5	Very low	60 Å²	60	111.5 Å²	111.5	62%	0.619	70%	0.695	S	S	*	*			trans	-66.7	83.1	171.8	0	0	0	0	0	110.2	S199	S199-G201 PolarHBondContact O-N 3.22Å
202	G	25.9	Very low	30.9	Very low	45 Å²	45	116.1 Å²	116.1	46%	0.464	69%	0.688	S	S	.	*			trans	-65.9	129.6	174.4	0	0	0	0	0	110.2	T200 G204 E205	T200-G202 PolarHBondContact O-N 3.37Å; G202-G204 PolarHBondContact O-N 2.94Å; G202-E205 PolarHBondContact O-N 2.89Å
203	I	30.4	Very low	31.6	Very low	139 Å²	139	117 Å²	117	71%	0.713	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-55	-9.5	176.4	-58.4	168.8	0	0	0	112.3	E205	I203-E205 PolarHBondContact O-N 3.3Å
204	G	29.4	Very low	31.7	Very low	55 Å²	55	113.5 Å²	113.5	57%	0.567	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-70.2	-14.5	171.3	0	0	0	0	0	116.6	G202	G202-G204 PolarHBondContact O-N 2.94Å
205	E	30.2	Very low	32.4	Very low	158 Å²	158	110.5 Å²	110.5	74%	0.738	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-84.2	-17.9	-179.5	-66.3	-155.1	159.6	0	0	114.4	G202 I203 F207	G202-E205 PolarHBondContact O-N 2.89Å; I203-E205 PolarHBondContact O-N 3.3Å; E205-F207 VanDerWaalsContact C-N 3.29Å; E205-F207 PolarHBondContact O-N 2.86Å
206	I	34.4	Very low	33.3	Very low	127 Å²	127	112 Å²	112	65%	0.651	63%	0.634	S	S	*	*	S	Bend	trans	-74.5	-22.9	178.7	-61.1	173.8	0	0	0	111.4
207	F	33	Very low	33.9	Very low	88 Å²	88	113.3 Å²	113.3	39%	0.386	63%	0.63	S	S	.	*	S	Bend	trans	-107.3	-6.1	-172	-66.4	-78.7	0	0	0	114.9	E205 P209 L210 I211	E205-F207 VanDerWaalsContact C-N 3.29Å; E205-F207 PolarHBondContact O-N 2.86Å; F207-P209 VanDerWaalsContact C-N 3.34Å; F207-L210 HydrophobicContact CD1-CD1 4.34Å; F207-L210 PolarHBondContact O-N 3.37Å; F207-I211 PolarHBondContact O-N 3.2Å
208	Q	33.4	Very low	34.2	Very low	139 Å²	139	110.9 Å²	110.9	65%	0.65	62%	0.622	S	S	*	*	H	α-helix	trans	-56.4	-37.3	175.2	-84.2	-143.6	5	0	0	114.7	L210 I211 R212	Q208-L210 VanDerWaalsContact C-N 3.32Å; Q208-L210 PolarHBondContact O-N 2.88Å; Q208-I211 PolarHBondContact O-N 2.96Å; Q208-R212 PolarHBondContact O-N 3.17Å
209	P	33.7	Very low	34.8	Very low	88 Å²	88	115.5 Å²	115.5	57%	0.571	63%	0.626	S	S	*	*	H	α-helix	trans	-64.6	-35.8	178.3	-20.7	32.3	0	0	0	113	F207 E213	F207-P209 VanDerWaalsContact C-N 3.34Å; P209-E213 PolarHBondContact O-N 3.43Å; P209-E213 VanDerWaalsContact O-N 3.12Å
210	L	32.6	Very low	34.7	Very low	112 Å²	112	118.8 Å²	118.8	59%	0.586	63%	0.634	S	S	*	*	H	α-helix	trans	-74.5	-34.2	-178.7	-91.8	145.9	0	0	0	112.8	F207 Q208 A214	F207-L210 HydrophobicContact CD1-CD1 4.34Å; F207-L210 PolarHBondContact O-N 3.37Å; Q208-L210 VanDerWaalsContact C-N 3.32Å; Q208-L210 PolarHBondContact O-N 2.88Å; L210-A214 PolarHBondContact O-N 2.96Å
211	I	40.5	Very low	34.8	Very low	101 Å²	101	115.8 Å²	115.8	52%	0.518	63%	0.63	S	S	.	*	H	α-helix	trans	-69.4	-38.6	175.5	-64.7	169.5	0	0	0	110.4	F207 Q208 A214 Q215	F207-I211 PolarHBondContact O-N 3.2Å; Q208-I211 PolarHBondContact O-N 2.96Å; I211-A214 PolarHBondContact O-N 2.93Å; I211-Q215 WeakPolarHBondContact O-CG 3.3Å; I211-Q215 PolarHBondContact O-N 3.32Å; I211-Q215 VanDerWaalsContact O-N 3.16Å
212	R	40.1	Very low	35.1	Very low	175 Å²	175	119.3 Å²	119.3	66%	0.66	64%	0.642	S	S	*	*	H	α-helix	trans	-69.1	-40.5	178.4	-172.9	173	152.6	179.1	-6	112.3	Q208 A214 Q215 E216	Q208-R212 PolarHBondContact O-N 3.17Å; R212-A214 VanDerWaalsContact C-N 3.33Å; R212-A214 PolarHBondContact O-N 2.82Å; R212-Q215 PolarHBondContact O-N 3.2Å; R212-E216 PolarHBondContact O-N 3.24Å
213	E	42	Very low	35.2	Very low	95 Å²	95	120.6 Å²	120.6	44%	0.444	66%	0.655	S	S	.	*	H	α-helix	trans	-65.3	-34.5	175.8	-165.9	-176	163	0	0	112.5	P209 E216 K217	P209-E213 PolarHBondContact O-N 3.43Å; P209-E213 VanDerWaalsContact O-N 3.12Å; E213-E216 PolarHBondContact O-N 3.35Å; E213-K217 HydrophobicContact CG-CD 4.41Å; E213-K217 PolarHBondContact O-N 2.71Å; E213-K217 IonicContact OE1-NZ 2.67Å; E213-K217 PolarHBondContact OE1-NZ 3.4Å
214	A	35.1	Very low	35.1	Very low	56 Å²	56	125 Å²	125	46%	0.463	66%	0.663	S	S	.	*	H	α-helix	trans	-70.5	-30.6	174.7	0	0	0	0	0	113	L210 I211 R212 L218	L210-A214 PolarHBondContact O-N 2.96Å; I211-A214 PolarHBondContact O-N 2.93Å; R212-A214 VanDerWaalsContact C-N 3.33Å; R212-A214 PolarHBondContact O-N 2.82Å; A214-L218 WeakPolarHBondContact O-CD1 3.47Å
215	Q	44.5	Very low	35.2	Very low	128 Å²	128	130.4 Å²	130.4	60%	0.598	67%	0.673	S	S	*	*	H	α-helix	trans	-77.6	-28.7	174.5	-75.1	177.6	-54.3	0	0	113	I211 R212	I211-Q215 WeakPolarHBondContact O-CG 3.3Å; I211-Q215 PolarHBondContact O-N 3.32Å; I211-Q215 VanDerWaalsContact O-N 3.16Å; R212-Q215 PolarHBondContact O-N 3.2Å
216	E	45.9	Very low	35.2	Very low	135 Å²	135	133.8 Å²	133.8	63%	0.631	68%	0.681	S	S	*	*	H	α-helix	trans	-78	-32.7	179.2	-131.4	167.5	-177	0	0	112.3	R212 E213 L218	R212-E216 PolarHBondContact O-N 3.24Å; E213-E216 PolarHBondContact O-N 3.35Å; E216-L218 VanDerWaalsContact C-N 3.29Å; E216-L218 PolarHBondContact O-N 3.27Å
217	K	40.8	Very low	35.2	Very low	160 Å²	160	133.2 Å²	133.2	70%	0.696	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-5.3	178.3	-75.8	176.5	172.7	167.1	0	115.1	E213	E213-K217 HydrophobicContact CG-CD 4.41Å; E213-K217 PolarHBondContact O-N 2.71Å; E213-K217 IonicContact OE1-NZ 2.67Å; E213-K217 PolarHBondContact OE1-NZ 3.4Å
218	L	35.2	Very low	35.1	Very low	149 Å²	149	137.7 Å²	137.7	78%	0.78	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	6.2	-179.4	-81.5	166.8	0	0	0	114.3	A214 E216	A214-L218 WeakPolarHBondContact O-CD1 3.47Å; E216-L218 VanDerWaalsContact C-N 3.29Å; E216-L218 PolarHBondContact O-N 3.27Å
219	Q	38.5	Very low	34.9	Very low	164 Å²	164	135.8 Å²	135.8	77%	0.766	71%	0.71	S	S	*	*	S	Bend	trans	-105.5	119.4	176.5	-69.9	179.3	53.4	0	0	112.1
220	L	28.9	Very low	35	Very low	182 Å²	182	137.6 Å²	137.6	95%	0.953	72%	0.724	S	S	*	*			trans	-46.9	141.8	-179.5	-70.4	137.2	0	0	0	115.8
221	G	29.8	Very low	34.9	Very low	75 Å²	75	139.5 Å²	139.5	77%	0.773	73%	0.734	S	S	*	*			trans	172.5	140.2	152.4	0	0	0	0	0	115.4
222	P	32.5	Very low	34.7	Very low	135 Å²	135	140.5 Å²	140.5	88%	0.877	75%	0.747	S	S	*	*			trans	-111.9	157.4	-149.6	37	-24.2	0	0	0	115.5
223	G	27.9	Very low	34.3	Very low	72 Å²	72	137.4 Å²	137.4	74%	0.742	75%	0.748	S	S	*	*			trans	122.7	128.2	136.9	0	0	0	0	0	119.4
224	R	30	Very low	34	Very low	230 Å²	230	138 Å²	138	87%	0.868	76%	0.762	S	S	*	*			trans	108.4	113	131	-67.1	-170.7	170.6	177.1	-0.5	120.6
225	H	31.1	Very low	34	Very low	170 Å²	170	140.9 Å²	140.9	79%	0.787	78%	0.779	S	S	*	*				67.6	115.5	129.9	-71.3	-67.8	0	0	0	121.6
226	Y	29.4	Very low	33.5	Very low	229 Å²	229	138 Å²	138	90%	0.898	78%	0.784	S	S	*	*			trans	-104.7	153.4	152.6	-86.8	-86.7	0	0	0	109.8
227	P	34.7	Very low	32.9	Very low	115 Å²	115	139.6 Å²	139.6	75%	0.747	80%	0.796	S	S	*	*				-144.6	176	119.4	35.8	-19.3	0	0	0	110.6
228	E	31.1	Very low	32.7	Very low	181 Å²	181	139 Å²	139	85%	0.846	81%	0.806	S	S	*	*			cis	-168	158.6	-23	177.9	166.1	167.4	0	0	105.1
229	S	29.6	Very low	32.5	Very low	100 Å²	100	142.8 Å²	142.8	70%	0.699	81%	0.81	S	S	*	*			trans	-68	163.7	-169.3	55.7	0	0	0	0	118.4
230	S	34.6	Very low	32.4	Very low	125 Å²	125	139.7 Å²	139.7	87%	0.874	81%	0.812	S	S	*	*			trans	-155.2	136.3	139.3	46.2	0	0	0	0	113.2
231	L	31.4	Very low	32.8	Very low	153 Å²	153	135.5 Å²	135.5	80%	0.801	80%	0.796	S	S	*	*			trans	-85.3	160.6	174.3	-108.2	101.6	0	0	0	111.5
232	P	35.9	Very low	33.1	Very low	121 Å²	121	139 Å²	139	79%	0.786	80%	0.797	S	S	*	*				-150.2	148.8	93.4	33.8	-13.3	0	0	0	114.4
233	T	31.3	Very low	33.3	Very low	111 Å²	111	137.4 Å²	137.4	68%	0.681	79%	0.786	S	S	*	*				92.2	110	61.6	-40.3	0	0	0	0	115.9
234	S	35.1	Very low	33.6	Very low	106 Å²	106	140.6 Å²	140.6	74%	0.741	79%	0.786	S	S	*	*			trans	68.8	155.5	152.9	90.2	0	0	0	0	118.8
235	S	35.6	Very low	33.9	Very low	118 Å²	118	137.2 Å²	137.2	83%	0.825	79%	0.785	S	S	*	*			cis	-173.1	162.8	14.6	23.4	0	0	0	0	109.9
236	G	33.5	Very low	34.2	Very low	68 Å²	68	137.8 Å²	137.8	70%	0.701	79%	0.788	S	S	*	*			trans	129	90.8	158.4	0	0	0	0	0	115
237	L	33.8	Very low	34.6	Very low	168 Å²	168	136.6 Å²	136.6	88%	0.88	79%	0.788	S	S	*	*				50.5	115.9	90.5	-68.3	166.8	0	0	0	113.2
238	T	36.3	Very low	34.7	Very low	147 Å²	147	136.3 Å²	136.3	90%	0.902	79%	0.789	S	S	*	*				-171.7	155.2	75.6	3.9	0	0	0	0	112.7
239	R	30.6	Very low	34.9	Very low	228 Å²	228	133.2 Å²	133.2	86%	0.86	79%	0.787	S	S	*	*			trans	-108.3	146.8	-172.8	173.8	-173.4	-174.2	-177.2	2.5	110.8
240	A	37.5	Very low	35.3	Very low	99 Å²	99	134.4 Å²	134.4	82%	0.818	79%	0.79	S	S	*	*			trans	-162	133.7	150.5	0	0	0	0	0	111.7
241	P	36.5	Very low	35.5	Very low	95 Å²	95	135.7 Å²	135.7	62%	0.617	79%	0.787	S	S	*	*			trans	-123.2	171.6	-174.7	42.7	-31	0	0	0	116.8
242	L	35.7	Very low	35.6	Very low	149 Å²	149	137.7 Å²	137.7	78%	0.78	79%	0.79	S	S	*	*			trans	75	164.9	154	-74.2	161.4	0	0	0	119.6
243	P	38.8	Very low	35.7	Very low	101 Å²	101	136.6 Å²	136.6	66%	0.656	78%	0.783	S	S	*	*			cis	-137.9	168.4	-5.1	20	6.3	0	0	0	117.3
244	D	32.5	Very low	35.8	Very low	139 Å²	139	140.7 Å²	140.7	74%	0.743	79%	0.791	S	S	*	*			trans	39.5	132.2	137.4	-45.2	-26.7	0	0	0	123.4
245	N	37.3	Very low	35.9	Very low	159 Å²	159	141.6 Å²	141.6	85%	0.85	80%	0.795	S	S	*	*			trans	-147.3	119.7	152.5	-104.5	-20.1	0	0	0	111.4
246	E	36.5	Very low	35.8	Very low	181 Å²	181	143.4 Å²	143.4	85%	0.846	79%	0.794	S	S	*	*			trans	-68.9	146.1	163.8	-77.4	172.7	115.8	0	0	111.1
247	F	38	Very low	36	Very low	204 Å²	204	145.5 Å²	145.5	90%	0.895	80%	0.795	S	S	*	*			trans	-141.5	130.7	153.5	-102.9	-81.3	0	0	0	111.6
248	S	37.3	Very low	36.1	Very low	110 Å²	110	144.9 Å²	144.9	77%	0.769	79%	0.793	S	S	*	*			trans	-76.6	155.6	-172.4	-46.6	0	0	0	0	114.4
249	S	34.3	Very low	36	Very low	115 Å²	115	142.9 Å²	142.9	80%	0.804	78%	0.782	S	S	*	*			trans	-72.5	149.7	177.7	49.1	0	0	0	0	114.5
250	V	39.5	Very low	36.2	Very low	125 Å²	125	138.2 Å²	138.2	76%	0.758	78%	0.781	S	S	*	*			trans	-125.5	121	168.7	179	0	0	0	0	108.8	F252	V250-F252 HydrophobicContact CG1-CD2 4.09Å; V250-F252 HydrophobicContact CG1-CE2 4.13Å
251	D	37.2	Very low	36.2	Very low	153 Å²	153	141.6 Å²	141.6	82%	0.818	78%	0.78	S	S	*	*			trans	-88.7	142.1	172.2	-84.6	-42	0	0	0	111.3
252	F	33.9	Very low	36.1	Very low	194 Å²	194	145.8 Å²	145.8	85%	0.851	79%	0.788	S	S	*	*			trans	-142	150.2	156.5	-92.9	-83.7	0	0	0	112.1	V250	V250-F252 HydrophobicContact CG1-CD2 4.09Å; V250-F252 HydrophobicContact CG1-CE2 4.13Å
253	P	38.3	Very low	36	Very low	99 Å²	99	150.6 Å²	150.6	64%	0.643	80%	0.796	S	S	*	*			trans	-107.7	133.1	-150.3	37.4	-28.3	0	0	0	113.9
254	F	34.1	Very low	35.8	Very low	196 Å²	196	148.2 Å²	148.2	86%	0.86	79%	0.79	S	S	*	*			trans	-142.6	136.7	152.1	-73.7	-74.6	0	0	0	109.2	I256	F254-I256 PolarHBondContact O-N 2.85Å
255	P	37.5	Very low	35.9	Very low	126 Å²	126	143.8 Å²	143.8	82%	0.818	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-77.4	119.7	-169.4	30.8	-31.3	0	0	0	110.6
256	I	32.9	Very low	35.8	Very low	155 Å²	155	139.9 Å²	139.9	80%	0.795	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-87.8	131.8	173.8	-60	175.7	0	0	0	108.1	F254	F254-I256 PolarHBondContact O-N 2.85Å
257	P	38.1	Very low	35.8	Very low	112 Å²	112	134 Å²	134	73%	0.727	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-59	141.8	180	-18.2	29.3	0	0	0	111.9
258	D	35.8	Very low	35.8	Very low	156 Å²	156	127.5 Å²	127.5	83%	0.834	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-52.1	127.8	178.7	-71.6	-47.7	0	0	0	111.5
259	P	33.1	Very low	35.8	Very low	104 Å²	104	128.3 Å²	128.3	68%	0.675	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-65.9	141.3	179.8	25.9	-32.4	0	0	0	110.3	Q261	P259-Q261 PolarHBondContact O-N 3.45Å; P259-Q261 VanDerWaalsContact O-N 3.17Å
260	P	35.1	Very low	36	Very low	130 Å²	130	126.4 Å²	126.4	84%	0.844	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-57.7	124.9	179.2	22.8	-31.6	0	0	0	110.2	K262	P260-K262 PolarHBondContact O-N 3.32Å
261	Q	37.2	Very low	35.8	Very low	171 Å²	171	121.3 Å²	121.3	80%	0.799	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-60.3	130.1	177.6	-69.7	-175.9	-4.8	0	0	111.1	P259	P259-Q261 PolarHBondContact O-N 3.45Å; P259-Q261 VanDerWaalsContact O-N 3.17Å
262	K	35	Very low	36	Very low	182 Å²	182	120.3 Å²	120.3	79%	0.791	64%	0.64	S	S	*	*	S	Bend	trans	77.5	117.5	153	-67	174.7	178.6	173.8	0	118.4	P260	P260-K262 PolarHBondContact O-N 3.32Å
263	R	33.7	Very low	36.2	Very low	250 Å²	250	115.7 Å²	115.7	94%	0.943	63%	0.632	S	S	*	*	S	Bend	trans	94.2	107.6	151	-64.5	178.8	176	-165	-1.6	117.1
264	G	35.5	Very low	36.2	Very low	51 Å²	51	116.1 Å²	116.1	53%	0.526	63%	0.628	S	S	.	*			trans	109.3	92.5	165	0	0	0	0	0	112.7
265	G	34.6	Very low	36.2	Very low	47 Å²	47	109.6 Å²	109.6	49%	0.485	62%	0.615	S	S	.	*			trans	-64.4	166.5	176.2	0	0	0	0	0	112.3	V267 T268 Q269	G265-V267 PolarHBondContact O-N 3.39Å; G265-T268 PolarHBondContact N-OG1 2.76Å; G265-T268 WeakPolarHBondContact O-CA 3.37Å; G265-T268 WeakPolarHBondContact O-CB 3.18Å; G265-T268 PolarHBondContact O-N 2.96Å; G265-T268 PolarHBondContact O-OG1 3.15Å; G265-Q269 PolarHBondContact O-N 3.38Å
266	L	34.5	Very low	36.3	Very low	76 Å²	76	106.4 Å²	106.4	40%	0.398	59%	0.591	S	S	.	*	H	α-helix	trans	-53.1	-30	178.3	-172.7	79.8	0	0	0	112.8	T268 Q269 I270 K319	L266-T268 VanDerWaalsContact C-N 3.35Å; L266-Q269 CarbonylContact O-C 3.45Å; L266-Q269 WeakPolarHBondContact O-CB 3.48Å; L266-Q269 PolarHBondContact O-N 3.46Å; L266-Q269 VanDerWaalsContact O-N 3.17Å; L266-I270 HydrophobicContact CD2-CD1 4.05Å; L266-I270 HydrophobicContact CG-CD1 3.93Å; L266-I270 HydrophobicContact CG-CG1 4.41Å; L266-I270 VanDerWaalsContact O-CG1 3.3Å; L266-I270 WeakPolarHBondContact O-CG1 3.42Å; L266-I270 PolarHBondContact O-N 2.79Å; L266-K319 HydrophobicContact CD2-CD 3.79Å; L266-K319 VanDerWaalsContact CD2-CE 3.42Å
267	V	37.3	Very low	36.8	Very low	58 Å²	58	103.1 Å²	103.1	35%	0.352	58%	0.575	S	S	.	*	H	α-helix	trans	-64.7	-37.8	173.8	178.5	0	0	0	0	111.7	G265 Q269 I270 L271	G265-V267 PolarHBondContact O-N 3.39Å; V267-Q269 VanDerWaalsContact C-N 3.32Å; V267-Q269 PolarHBondContact O-N 3.22Å; V267-I270 PolarHBondContact O-N 3.49Å; V267-L271 HydrophobicContact CG1-CD1 3.74Å; V267-L271 HydrophobicContact CG1-CG 4.26Å; V267-L271 VanDerWaalsContact O-CB 3.28Å; V267-L271 WeakPolarHBondContact O-CB 3.26Å; V267-L271 VanDerWaalsContact O-CG 3.23Å; V267-L271 WeakPolarHBondContact O-CG 3.42Å; V267-L271 PolarHBondContact O-N 3.02Å
268	T	36.7	Very low	36.9	Very low	67 Å²	67	105.9 Å²	105.9	41%	0.411	58%	0.576	S	S	.	*	H	α-helix	trans	-63	-40.2	171.4	-45.7	0	0	0	0	110.7	G265 L266 H272	G265-T268 PolarHBondContact N-OG1 2.76Å; G265-T268 WeakPolarHBondContact O-CA 3.37Å; G265-T268 WeakPolarHBondContact O-CB 3.18Å; G265-T268 PolarHBondContact O-N 2.96Å; G265-T268 PolarHBondContact O-OG1 3.15Å; L266-T268 VanDerWaalsContact C-N 3.35Å; T268-H272 VanDerWaalsContact O-CB 3.28Å; T268-H272 WeakPolarHBondContact O-CB 3.11Å; T268-H272 PolarHBondContact O-N 2.87Å
269	Q	38.1	Very low	37	Very low	127 Å²	127	99.7 Å²	99.7	59%	0.593	54%	0.542	S	S	*	.	H	α-helix	trans	-69.2	-38.4	175.8	-72.3	-178.2	-20.3	0	0	112.8	G265 L266 V267 H272 S273	G265-Q269 PolarHBondContact O-N 3.38Å; L266-Q269 CarbonylContact O-C 3.45Å; L266-Q269 WeakPolarHBondContact O-CB 3.48Å; L266-Q269 PolarHBondContact O-N 3.46Å; L266-Q269 VanDerWaalsContact O-N 3.17Å; V267-Q269 VanDerWaalsContact C-N 3.32Å; V267-Q269 PolarHBondContact O-N 3.22Å; Q269-H272 WeakPolarHBondContact O-CB 3.27Å; Q269-H272 PolarHBondContact O-N 3.08Å; Q269-S273 WeakPolarHBondContact O-CB 2.79Å; Q269-S273 PolarHBondContact O-N 3.04Å
270	I	37.1	Very low	37.3	Very low	75 Å²	75	96.8 Å²	96.8	39%	0.385	53%	0.527	S	S	.	.	H	α-helix	trans	-69.9	-46.6	177.5	-68.8	166.5	0	0	0	109.7	L266 V267 H272 S273 I274	L266-I270 HydrophobicContact CD2-CD1 4.05Å; L266-I270 HydrophobicContact CG-CD1 3.93Å; L266-I270 HydrophobicContact CG-CG1 4.41Å; L266-I270 VanDerWaalsContact O-CG1 3.3Å; L266-I270 WeakPolarHBondContact O-CG1 3.42Å; L266-I270 PolarHBondContact O-N 2.79Å; V267-I270 PolarHBondContact O-N 3.49Å; I270-H272 VanDerWaalsContact C-N 3.26Å; I270-H272 PolarHBondContact O-N 3.49Å; I270-S273 WeakPolarHBondContact CA-OG 3.32Å; I270-S273 WeakPolarHBondContact O-CA 3.37Å; I270-S273 WeakPolarHBondContact O-CB 3.43Å; I270-S273 PolarHBondContact O-N 2.92Å; I270-S273 PolarHBondContact O-OG 3.46Å; I270-I274 HydrophobicContact CG2-CD1 4.01Å; I270-I274 HydrophobicContact CG2-CG1 4.33Å; I270-I274 WeakPolarHBondContact O-CG1 3.5Å; I270-I274 PolarHBondContact O-N 2.96Å; I270-I274 VanDerWaalsContact O-N 3.08Å
271	L	35.6	Very low	37.7	Very low	18 Å²	18	97.5 Å²	97.5	9%	0.094	52%	0.524	C	S	.	.	H	α-helix	trans	-62.7	-32.2	174.5	-68.3	170.4	0	0	0	112.4	V267 S273 I274 G275 L276 A280	V267-L271 HydrophobicContact CG1-CD1 3.74Å; V267-L271 HydrophobicContact CG1-CG 4.26Å; V267-L271 VanDerWaalsContact O-CB 3.28Å; V267-L271 WeakPolarHBondContact O-CB 3.26Å; V267-L271 VanDerWaalsContact O-CG 3.23Å; V267-L271 WeakPolarHBondContact O-CG 3.42Å; V267-L271 PolarHBondContact O-N 3.02Å; L271-S273 VanDerWaalsContact C-N 3.34Å; L271-I274 HydrophobicContact CD2-CD1 4.43Å; L271-G275 PolarHBondContact O-N 3.34Å; L271-L276 HydrophobicContact CD2-CB 4.15Å; L271-L276 HydrophobicContact CD2-CD1 4.29Å; L271-L276 PolarHBondContact O-N 3.39Å; L271-A280 HydrophobicContact CB-CB 4.44Å; L271-A280 HydrophobicContact CD1-CB 3.68Å
272	H	43	Very low	38	Very low	132 Å²	132	94 Å²	94	61%	0.611	51%	0.507	S	S	*	.	H	α-helix	trans	-63.9	-35.9	167.5	-120.5	-105.1	0	0	0	112.7	T268 Q269 I270	T268-H272 VanDerWaalsContact O-CB 3.28Å; T268-H272 WeakPolarHBondContact O-CB 3.11Å; T268-H272 PolarHBondContact O-N 2.87Å; Q269-H272 WeakPolarHBondContact O-CB 3.27Å; Q269-H272 PolarHBondContact O-N 3.08Å; I270-H272 VanDerWaalsContact C-N 3.26Å; I270-H272 PolarHBondContact O-N 3.49Å
273	S	36.6	Very low	38.4	Very low	97 Å²	97	87.6 Å²	87.6	68%	0.678	48%	0.482	S	S	*	.	H	α-helix	trans	-78.4	-20.9	-178.3	72.9	0	0	0	0	114.3	Q269 I270 L271	Q269-S273 WeakPolarHBondContact O-CB 2.79Å; Q269-S273 PolarHBondContact O-N 3.04Å; I270-S273 WeakPolarHBondContact CA-OG 3.32Å; I270-S273 WeakPolarHBondContact O-CA 3.37Å; I270-S273 WeakPolarHBondContact O-CB 3.43Å; I270-S273 PolarHBondContact O-N 2.92Å; I270-S273 PolarHBondContact O-OG 3.46Å; L271-S273 VanDerWaalsContact C-N 3.34Å
274	I	39.7	Very low	39.1	Very low	109 Å²	109	78.3 Å²	78.3	56%	0.559	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	8.8	175.9	10.4	174.8	0	0	0	113.3	I270 L271 L276	I270-I274 HydrophobicContact CG2-CD1 4.01Å; I270-I274 HydrophobicContact CG2-CG1 4.33Å; I270-I274 WeakPolarHBondContact O-CG1 3.5Å; I270-I274 PolarHBondContact O-N 2.96Å; I270-I274 VanDerWaalsContact O-N 3.08Å; L271-I274 HydrophobicContact CD2-CD1 4.43Å; I274-L276 VanDerWaalsContact C-N 3.26Å; I274-L276 HydrophobicContact CB-CD1 4.39Å; I274-L276 HydrophobicContact CD1-CD1 4.27Å; I274-L276 PolarHBondContact O-N 3.02Å
275	G	34	Very low	39.7	Very low	58 Å²	58	79.8 Å²	79.8	60%	0.598	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	16.3	176.2	0	0	0	0	0	114.8	L271 N277	L271-G275 PolarHBondContact O-N 3.34Å; G275-N277 VanDerWaalsContact C-N 3.3Å; G275-N277 PolarHBondContact O-N 3.4Å
276	L	38.3	Very low	40.5	Very low	59 Å²	59	82.7 Å²	82.7	31%	0.309	46%	0.455	S	S	.	.			trans	-96.1	39.4	-176.5	-72.1	168.3	0	0	0	112	L271 I274 K278 L279	L271-L276 HydrophobicContact CD2-CB 4.15Å; L271-L276 HydrophobicContact CD2-CD1 4.29Å; L271-L276 PolarHBondContact O-N 3.39Å; I274-L276 VanDerWaalsContact C-N 3.26Å; I274-L276 HydrophobicContact CB-CD1 4.39Å; I274-L276 HydrophobicContact CD1-CD1 4.27Å; I274-L276 PolarHBondContact O-N 3.02Å; L276-K278 PolarHBondContact O-N 3.37Å; L276-K278 VanDerWaalsContact O-N 3.09Å; L276-L279 HydrophobicContact CB-CB 4.05Å; L276-L279 HydrophobicContact CD2-CB 4.37Å; L276-L279 HydrophobicContact CD2-CD1 4.1Å; L276-L279 HydrophobicContact CD2-CD2 4.28Å; L276-L279 HydrophobicContact CD2-CG 4.49Å; L276-L279 WeakPolarHBondContact O-CB 3.4Å; L276-L279 PolarHBondContact O-N 3.16Å
277	N	42.9	Very low	41.3	Very low	87 Å²	87	83.1 Å²	83.1	47%	0.465	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.8	-172.1	-55.1	-14.4	0	0	0	113.5	G275	G275-N277 VanDerWaalsContact C-N 3.3Å; G275-N277 PolarHBondContact O-N 3.4Å
278	K	40.3	Very low	41.7	Very low	169 Å²	169	80.6 Å²	80.6	74%	0.735	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-16.9	177.3	-78.1	-173.8	174.1	-178.1	0	114.1	L276 Q282	L276-K278 PolarHBondContact O-N 3.37Å; L276-K278 VanDerWaalsContact O-N 3.09Å; K278-Q282 WeakPolarHBondContact O-CG 3.23Å
279	L	39	Very low	42.2	Very low	26 Å²	26	82.8 Å²	82.8	14%	0.136	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-26.3	-174.4	-130.3	93.8	0	0	0	112.3	I108 L276 D281 Q282 I283	I108-L279 HydrophobicContact CG2-CD1 3.9Å; I108-L279 HydrophobicContact CG2-CD2 3.58Å; I108-L279 HydrophobicContact CG2-CG 4.02Å; I108-L279 WeakPolarHBondContact O-CD1 3.47Å; L276-L279 HydrophobicContact CB-CB 4.05Å; L276-L279 HydrophobicContact CD2-CB 4.37Å; L276-L279 HydrophobicContact CD2-CD1 4.1Å; L276-L279 HydrophobicContact CD2-CD2 4.28Å; L276-L279 HydrophobicContact CD2-CG 4.49Å; L276-L279 WeakPolarHBondContact O-CB 3.4Å; L276-L279 PolarHBondContact O-N 3.16Å; L279-D281 PolarHBondContact O-N 3.21Å; L279-Q282 PolarHBondContact O-N 3.25Å; L279-I283 HydrophobicContact CD2-CD1 4.06Å; L279-I283 HydrophobicContact CG-CD1 4.25Å
280	A	38.6	Very low	42.8	Very low	43 Å²	43	80.5 Å²	80.5	36%	0.355	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-25.9	179	0	0	0	0	0	113.2	L271	L271-A280 HydrophobicContact CB-CB 4.44Å; L271-A280 HydrophobicContact CD1-CB 3.68Å
281	D	44.8	Very low	43.2	Very low	146 Å²	146	77.7 Å²	77.7	78%	0.781	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-1.7	-173.6	-63.6	-27.3	0	0	0	113.8	L279	L279-D281 PolarHBondContact O-N 3.21Å
282	Q	43.6	Very low	43.6	Very low	96 Å²	96	80.5 Å²	80.5	45%	0.449	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	-4.3	-162.1	-74.4	-168.9	-10.3	0	0	117.3	K278 L279	K278-Q282 WeakPolarHBondContact O-CG 3.23Å; L279-Q282 PolarHBondContact O-N 3.25Å
283	I	42.3	Very low	44.1	Very low	49 Å²	49	76.4 Å²	76.4	25%	0.251	45%	0.447	S	S	.	.			trans	-115.8	108.6	-177.4	-58.2	172.4	0	0	0	109.8	I108 L279 V288	I108-I283 HydrophobicContact CD1-CD1 4.05Å; I108-I283 HydrophobicContact CG2-CD1 3.92Å; L279-I283 HydrophobicContact CD2-CD1 4.06Å; L279-I283 HydrophobicContact CG-CD1 4.25Å; I283-V288 HydrophobicContact CG2-CG2 3.8Å
284	S	48.7	Very low	44.9	Very low	55 Å²	55	72.3 Å²	72.3	39%	0.385	42%	0.417	S	S	.	.			trans	-81.6	142.8	170.3	72.7	0	0	0	0	110.5	D286 E287	S284-D286 PolarHBondContact O-N 3.12Å; S284-D286 VanDerWaalsContact O-N 3.1Å; S284-E287 PolarHBondContact N-OE2 2.94Å; S284-E287 PolarHBondContact O-N 3.22Å; S284-E287 VanDerWaalsContact O-N 3.09Å; S284-E287 WeakPolarHBondContact OG-CG 3.45Å; S284-E287 PolarHBondContact OG-N 3.27Å; S284-E287 PolarHBondContact OG-OE2 3.38Å
285	L	47.9	Very low	45.7	Very low	82 Å²	82	72.8 Å²	72.8	43%	0.429	41%	0.412	S	S	.	.	H	α-helix	trans	-58.2	-25.2	177.5	-167.8	73.1	0	0	0	112.4	K289	L285-K289 WeakPolarHBondContact O-CG 3.31Å; L285-K289 PolarHBondContact O-N 3.14Å; L285-K289 VanDerWaalsContact O-N 3.16Å
286	D	52.3	Low	47.1	Very low	108 Å²	108	72.2 Å²	72.2	58%	0.578	40%	0.398	S	S	*	.	H	α-helix	trans	-74.9	-29.3	179.7	-63.4	-32.3	0	0	0	112.6	S284 K289 A290	S284-D286 PolarHBondContact O-N 3.12Å; S284-D286 VanDerWaalsContact O-N 3.1Å; D286-K289 PolarHBondContact O-N 3.37Å; D286-K289 IonicContact OD1-NZ 3.39Å; D286-K289 PolarHBondContact OD1-NZ 3Å; D286-A290 WeakPolarHBondContact O-CB 3.4Å; D286-A290 PolarHBondContact O-N 2.56Å
287	E	49.8	Very low	47.9	Very low	84 Å²	84	72 Å²	72	39%	0.393	40%	0.4	S	S	.	.	H	α-helix	trans	-70.2	-34.1	172.9	-76.3	171.2	136.9	0	0	112.4	S284 A290	S284-E287 PolarHBondContact N-OE2 2.94Å; S284-E287 PolarHBondContact O-N 3.22Å; S284-E287 VanDerWaalsContact O-N 3.09Å; S284-E287 WeakPolarHBondContact OG-CG 3.45Å; S284-E287 PolarHBondContact OG-N 3.27Å; S284-E287 PolarHBondContact OG-OE2 3.38Å; E287-A290 PolarHBondContact O-N 3.07Å
288	V	47	Very low	48.9	Very low	5 Å²	5	71.5 Å²	71.5	3%	0.03	42%	0.416	C	S	.	.	H	α-helix	trans	-71.5	-38.1	175.4	-179.2	0	0	0	0	110.9	I283 A290 V291 Y310 L313	I283-V288 HydrophobicContact CG2-CG2 3.8Å; V288-A290 VanDerWaalsContact C-N 3.28Å; V288-A290 PolarHBondContact O-N 3.12Å; V288-V291 PolarHBondContact O-N 2.88Å; V288-Y310 HydrophobicContact CG1-CD2 4.41Å; V288-Y310 HydrophobicContact CG1-CE2 4.5Å; V288-L313 HydrophobicContact CG1-CB 3.65Å; V288-L313 HydrophobicContact CG2-CB 4.25Å; V288-L313 WeakPolarHBondContact CG2-O 3.5Å
289	K	47.6	Very low	50.1	Low	113 Å²	113	65.9 Å²	65.9	49%	0.491	40%	0.395	S	S	.	.	H	α-helix	trans	-66.4	-29	173.2	-71.9	171.4	-173.3	165.4	0	112.8	L285 D286 V291	L285-K289 WeakPolarHBondContact O-CG 3.31Å; L285-K289 PolarHBondContact O-N 3.14Å; L285-K289 VanDerWaalsContact O-N 3.16Å; D286-K289 PolarHBondContact O-N 3.37Å; D286-K289 IonicContact OD1-NZ 3.39Å; D286-K289 PolarHBondContact OD1-NZ 3Å; K289-V291 VanDerWaalsContact C-N 3.26Å; K289-V291 PolarHBondContact O-N 2.83Å
290	A	50.7	Low	50.8	Low	80 Å²	80	70.3 Å²	70.3	66%	0.661	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-14.5	179.1	0	0	0	0	0	113.6	D286 E287 V288 S292	D286-A290 WeakPolarHBondContact O-CB 3.4Å; D286-A290 PolarHBondContact O-N 2.56Å; E287-A290 PolarHBondContact O-N 3.07Å; V288-A290 VanDerWaalsContact C-N 3.28Å; V288-A290 PolarHBondContact O-N 3.12Å; A290-S292 VanDerWaalsContact C-N 3.3Å; A290-S292 PolarHBondContact O-N 3.41Å
291	V	45.3	Very low	51.5	Low	15 Å²	15	71.2 Å²	71.2	9%	0.091	44%	0.44	C	S	.	.	S	Bend	trans	-73.5	88.9	171	-170.8	0	0	0	0	108.5	L104 V288 K289 G293 I294	L104-V291 HydrophobicContact CD2-CG2 3.52Å; V288-V291 PolarHBondContact O-N 2.88Å; K289-V291 VanDerWaalsContact C-N 3.26Å; K289-V291 PolarHBondContact O-N 2.83Å; V291-G293 PolarHBondContact O-N 3.01Å; V291-I294 HydrophobicContact CB-CD1 4.02Å; V291-I294 HydrophobicContact CB-CG1 4.35Å; V291-I294 HydrophobicContact CG1-CD1 3.58Å; V291-I294 HydrophobicContact CG1-CG1 3.93Å; V291-I294 PolarHBondContact O-N 2.93Å; V291-I294 VanDerWaalsContact O-N 3.14Å
292	S	43.6	Very low	52	Low	77 Å²	77	65.5 Å²	65.5	54%	0.538	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.5	117.1	179.9	58.8	0	0	0	0	109.7	A97 A290	A97-S292 VanDerWaalsContact CA-O 3.27Å; A97-S292 WeakPolarHBondContact CA-O 3.45Å; A97-S292 WeakPolarHBondContact CB-O 3.17Å; A290-S292 VanDerWaalsContact C-N 3.3Å; A290-S292 PolarHBondContact O-N 3.41Å
293	G	53.5	Low	52.3	Low	46 Å²	46	63.6 Å²	63.6	47%	0.474	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.5	-9.7	175.4	0	0	0	0	0	116.8	V291	V291-G293 PolarHBondContact O-N 3.01Å
294	I	52.2	Low	52.6	Low	11 Å²	11	65.3 Å²	65.3	6%	0.056	42%	0.421	C	S	.	.			trans	-90.6	116.9	167.3	-55.3	-178.4	0	0	0	107.7	V291 L309 Y310 L313	V291-I294 HydrophobicContact CB-CD1 4.02Å; V291-I294 HydrophobicContact CB-CG1 4.35Å; V291-I294 HydrophobicContact CG1-CD1 3.58Å; V291-I294 HydrophobicContact CG1-CG1 3.93Å; V291-I294 PolarHBondContact O-N 2.93Å; V291-I294 VanDerWaalsContact O-N 3.14Å; I294-L309 HydrophobicContact CD1-CD2 3.65Å; I294-L309 HydrophobicContact CD1-CG 4.14Å; I294-L309 HydrophobicContact CG1-CD2 4.12Å; I294-Y310 HydrophobicContact CG2-CD2 4.2Å; I294-Y310 HydrophobicContact CG2-CG 4.5Å; I294-L313 HydrophobicContact CD1-CD1 3.45Å; I294-L313 VanDerWaalsContact CD1-CD1 3.45Å
295	R	58.1	Low	52.6	Low	119 Å²	119	65.6 Å²	65.6	45%	0.449	42%	0.418	S	S	.	.			trans	-120	143.8	-172.9	-72.5	-171.4	-178.1	163	7.7	110.4	T299 P300 S306 Y310	R295-T299 WeakPolarHBondContact CB-OG1 3.5Å; R295-P300 WeakPolarHBondContact CD-O 3.16Å; R295-P300 PolarHBondContact NH1-O 2.56Å; R295-S306 CarbonylContact O-C 3.55Å; R295-Y310 WeakPolarHBondContact O-CB 3.1Å
296	P	62.9	Low	52.7	Low	47 Å²	47	62.2 Å²	62.2	31%	0.305	40%	0.401	S	S	.	.			trans	-56.3	145.5	176.8	-15.3	23.3	0	0	0	111.5	G298 T299 S302 Y310	P296-G298 PolarHBondContact O-N 3.16Å; P296-T299 HydrophobicContact CB-CG2 3.95Å; P296-T299 HydrophobicContact CG-CG2 3.95Å; P296-T299 PolarHBondContact O-N 2.8Å; P296-T299 VanDerWaalsContact O-N 3.15Å; P296-T299 PolarHBondContact O-OG1 3.12Å; P296-S302 WeakPolarHBondContact O-CB 3.42Å; P296-S302 PolarHBondContact O-OG 2.97Å; P296-Y310 HydrophobicContact CB-CD1 4Å; P296-Y310 HydrophobicContact CB-CD2 4.46Å; P296-Y310 HydrophobicContact CB-CE1 3.76Å; P296-Y310 HydrophobicContact CB-CE2 4.27Å; P296-Y310 HydrophobicContact CB-CG 4.34Å; P296-Y310 HydrophobicContact CG-CD2 4.22Å; P296-Y310 HydrophobicContact CG-CE1 4.09Å; P296-Y310 HydrophobicContact CG-CE2 3.76Å
297	P	55.2	Low	52.7	Low	54 Å²	54	57.1 Å²	57.1	35%	0.351	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	131.3	176.1	-5.8	10.4	0	0	0	110.6	N311	P297-N311 WeakPolarHBondContact CD-OD1 3.32Å; P297-N311 WeakPolarHBondContact CG-ND2 3.36Å; P297-N311 WeakPolarHBondContact CG-OD1 3.3Å
298	G	63.3	Low	52.9	Low	77 Å²	77	55.2 Å²	55.2	79%	0.794	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	88	3.2	178.3	0	0	0	0	0	114.9	P296 S302	P296-G298 PolarHBondContact O-N 3.16Å; G298-S302 PolarHBondContact N-OG 2.92Å
299	T	66	Low	53.2	Low	50 Å²	50	56.4 Å²	56.4	31%	0.307	38%	0.379	S	S	.	.	S	Bend	trans	-87.2	147.5	171.6	57	0	0	0	0	110.9	R295 P296 G301 S302	R295-T299 WeakPolarHBondContact CB-OG1 3.5Å; P296-T299 HydrophobicContact CB-CG2 3.95Å; P296-T299 HydrophobicContact CG-CG2 3.95Å; P296-T299 PolarHBondContact O-N 2.8Å; P296-T299 VanDerWaalsContact O-N 3.15Å; P296-T299 PolarHBondContact O-OG1 3.12Å; T299-G301 PolarHBondContact O-N 3.05Å; T299-S302 PolarHBondContact N-OG 3.08Å; T299-S302 WeakPolarHBondContact O-CB 3.3Å; T299-S302 PolarHBondContact O-N 3.11Å; T299-S302 PolarHBondContact O-OG 3.22Å
300	P	54.4	Low	53.7	Low	119 Å²	119	52.4 Å²	52.4	77%	0.773	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	125.4	178	-27.8	35	0	0	0	111.6	R295 S302	R295-P300 WeakPolarHBondContact CD-O 3.16Å; R295-P300 PolarHBondContact NH1-O 2.56Å; P300-S302 VanDerWaalsContact C-N 3.31Å; P300-S302 PolarHBondContact O-N 2.93Å
301	G	52.8	Low	54	Low	63 Å²	63	50.6 Å²	50.6	65%	0.649	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	10.9	-175.7	0	0	0	0	0	115.9	T299	T299-G301 PolarHBondContact O-N 3.05Å
302	S	54.2	Low	54.4	Low	26 Å²	26	54.6 Å²	54.6	18%	0.182	36%	0.36	C	S	.	.			trans	-76.2	118.4	157.9	74.6	0	0	0	0	108.7	P296 G298 T299 P300 S306	P296-S302 WeakPolarHBondContact O-CB 3.42Å; P296-S302 PolarHBondContact O-OG 2.97Å; G298-S302 PolarHBondContact N-OG 2.92Å; T299-S302 PolarHBondContact N-OG 3.08Å; T299-S302 WeakPolarHBondContact O-CB 3.3Å; T299-S302 PolarHBondContact O-N 3.11Å; T299-S302 PolarHBondContact O-OG 3.22Å; P300-S302 VanDerWaalsContact C-N 3.31Å; P300-S302 PolarHBondContact O-N 2.93Å; S302-S306 VanDerWaalsContact CA-OG 3.3Å; S302-S306 WeakPolarHBondContact CA-OG 3.44Å
303	S	51.5	Low	54.6	Low	55 Å²	55	51.6 Å²	51.6	39%	0.385	34%	0.338	S	S	.	.			trans	-75.2	161.4	163.2	65.9	0	0	0	0	108.9	I305 S306 G307	S303-I305 PolarHBondContact O-N 3.27Å; S303-I305 VanDerWaalsContact O-N 3.15Å; S303-S306 PolarHBondContact N-OG 3.48Å; S303-S306 PolarHBondContact O-N 2.84Å; S303-S306 VanDerWaalsContact O-N 3.08Å; S303-S306 PolarHBondContact O-OG 3.35Å; S303-S306 PolarHBondContact OG-N 2.97Å; S303-S306 PolarHBondContact OG-OG 2.82Å; S303-G307 PolarHBondContact O-N 3.03Å
304	V	47.8	Very low	54.8	Low	86 Å²	86	50.3 Å²	50.3	52%	0.521	32%	0.321	S	S	.	.	H	α-helix	trans	-54.9	-34.2	173.3	-179.8	0	0	0	0	110.6	A308 M332	V304-A308 VanDerWaalsContact O-CB 3.23Å; V304-A308 WeakPolarHBondContact O-CB 3.32Å; V304-A308 PolarHBondContact O-N 3.4Å; V304-M332 HydrophobicContact CG2-SD 4.49Å
305	I	48	Very low	54.7	Low	61 Å²	61	53.5 Å²	53.5	31%	0.313	34%	0.338	S	S	.	.	H	α-helix	trans	-69.4	-46.4	176.9	-60	170.2	0	0	0	111.3	S303 G307 A308 L309 I340	S303-I305 PolarHBondContact O-N 3.27Å; S303-I305 VanDerWaalsContact O-N 3.15Å; I305-G307 VanDerWaalsContact C-N 3.29Å; I305-G307 PolarHBondContact O-N 2.04Å; I305-A308 PolarHBondContact O-N 2.83Å; I305-L309 VanDerWaalsContact O-CB 3.25Å; I305-L309 WeakPolarHBondContact O-CB 3.06Å; I305-L309 PolarHBondContact O-N 3.35Å; I305-I340 HydrophobicContact CD1-CB 4.09Å; I305-I340 HydrophobicContact CD1-CD1 4.12Å; I305-I340 HydrophobicContact CD1-CG2 3.36Å
306	S	50.2	Low	54.1	Low	10 Å²	10	50.2 Å²	50.2	7%	0.07	34%	0.336	C	S	.	.	H	α-helix	trans	-69.4	-30.5	177.8	72	0	0	0	0	112	R295 S302 S303 Y310	R295-S306 CarbonylContact O-C 3.55Å; S302-S306 VanDerWaalsContact CA-OG 3.3Å; S302-S306 WeakPolarHBondContact CA-OG 3.44Å; S303-S306 PolarHBondContact N-OG 3.48Å; S303-S306 PolarHBondContact O-N 2.84Å; S303-S306 VanDerWaalsContact O-N 3.08Å; S303-S306 PolarHBondContact O-OG 3.35Å; S303-S306 PolarHBondContact OG-N 2.97Å; S303-S306 PolarHBondContact OG-OG 2.82Å; S306-Y310 WeakPolarHBondContact O-CB 3.39Å; S306-Y310 PolarHBondContact O-N 3.41Å
307	G	52.8	Low	53.3	Low	2 Å²	2	51.6 Å²	51.6	2%	0.021	34%	0.341	C	S	.	.	H	α-helix	trans	-70.1	-41.1	170.9	0	0	0	0	0	113.4	S303 I305 Y310 N311	S303-G307 PolarHBondContact O-N 3.03Å; I305-G307 VanDerWaalsContact C-N 3.29Å; I305-G307 PolarHBondContact O-N 2.04Å; G307-Y310 WeakPolarHBondContact O-CB 3.38Å; G307-Y310 PolarHBondContact O-N 2.82Å; G307-N311 VanDerWaalsContact O-CG 3.27Å; G307-N311 PolarHBondContact O-N 2.92Å
308	A	53.2	Low	52.9	Low	44 Å²	44	53.3 Å²	53.3	36%	0.364	35%	0.353	S	S	.	.	H	α-helix	trans	-65.5	-45.3	174.5	0	0	0	0	0	110.9	V304 I305 Y310 N311 I312	V304-A308 VanDerWaalsContact O-CB 3.23Å; V304-A308 WeakPolarHBondContact O-CB 3.32Å; V304-A308 PolarHBondContact O-N 3.4Å; I305-A308 PolarHBondContact O-N 2.83Å; A308-Y310 VanDerWaalsContact C-N 3.32Å; A308-Y310 PolarHBondContact O-N 2.91Å; A308-N311 PolarHBondContact O-N 2.77Å; A308-I312 VanDerWaalsContact O-CG1 3.25Å; A308-I312 WeakPolarHBondContact O-CG1 3.46Å; A308-I312 PolarHBondContact O-N 3.3Å
309	L	53.1	Low	52	Low	30 Å²	30	56.5 Å²	56.5	16%	0.157	34%	0.344	C	S	.	.	H	α-helix	trans	-63.2	-39	174.2	-168.2	66.7	0	0	0	111.2	I294 I305 I312 L313	I294-L309 HydrophobicContact CD1-CD2 3.65Å; I294-L309 HydrophobicContact CD1-CG 4.14Å; I294-L309 HydrophobicContact CG1-CD2 4.12Å; I305-L309 VanDerWaalsContact O-CB 3.25Å; I305-L309 WeakPolarHBondContact O-CB 3.06Å; I305-L309 PolarHBondContact O-N 3.35Å; L309-I312 PolarHBondContact O-N 2.9Å; L309-L313 HydrophobicContact CD1-CD1 4.35Å; L309-L313 HydrophobicContact CG-CD1 3.91Å; L309-L313 HydrophobicContact CG-CG 4.44Å; L309-L313 WeakPolarHBondContact O-CB 3.41Å; L309-L313 WeakPolarHBondContact O-CG 3.28Å; L309-L313 PolarHBondContact O-N 2.83Å
310	Y	58.4	Low	51.3	Low	28 Å²	28	62.1 Å²	62.1	11%	0.11	37%	0.367	C	S	.	.	H	α-helix	trans	-59.3	-48.6	171.4	-178.4	-89	0	0	0	111.1	V288 I294 R295 P296 S306 G307 A308 I312 L313 S314	V288-Y310 HydrophobicContact CG1-CD2 4.41Å; V288-Y310 HydrophobicContact CG1-CE2 4.5Å; I294-Y310 HydrophobicContact CG2-CD2 4.2Å; I294-Y310 HydrophobicContact CG2-CG 4.5Å; R295-Y310 WeakPolarHBondContact O-CB 3.1Å; P296-Y310 HydrophobicContact CB-CD1 4Å; P296-Y310 HydrophobicContact CB-CD2 4.46Å; P296-Y310 HydrophobicContact CB-CE1 3.76Å; P296-Y310 HydrophobicContact CB-CE2 4.27Å; P296-Y310 HydrophobicContact CB-CG 4.34Å; P296-Y310 HydrophobicContact CG-CD2 4.22Å; P296-Y310 HydrophobicContact CG-CE1 4.09Å; P296-Y310 HydrophobicContact CG-CE2 3.76Å; S306-Y310 WeakPolarHBondContact O-CB 3.39Å; S306-Y310 PolarHBondContact O-N 3.41Å; G307-Y310 WeakPolarHBondContact O-CB 3.38Å; G307-Y310 PolarHBondContact O-N 2.82Å; A308-Y310 VanDerWaalsContact C-N 3.32Å; A308-Y310 PolarHBondContact O-N 2.91Å; Y310-I312 VanDerWaalsContact C-N 3.34Å; Y310-I312 PolarHBondContact O-N 2.9Å; Y310-L313 PolarHBondContact O-N 3.32Å; Y310-S314 WeakPolarHBondContact CD1-OG 3.19Å; Y310-S314 WeakPolarHBondContact CE1-OG 3.06Å; Y310-S314 WeakPolarHBondContact O-CA 3.44Å; Y310-S314 WeakPolarHBondContact O-CB 3.38Å; Y310-S314 PolarHBondContact O-N 3.22Å; Y310-S314 PolarHBondContact O-OG 2.86Å
311	N	57.4	Low	50.9	Low	43 Å²	43	62 Å²	62	23%	0.23	35%	0.354	C	S	.	.	H	α-helix	trans	-62.2	-41.5	179.8	-72.1	-17.8	0	0	0	112	P297 G307 A308 S314	P297-N311 WeakPolarHBondContact CD-OD1 3.32Å; P297-N311 WeakPolarHBondContact CG-ND2 3.36Å; P297-N311 WeakPolarHBondContact CG-OD1 3.3Å; G307-N311 VanDerWaalsContact O-CG 3.27Å; G307-N311 PolarHBondContact O-N 2.92Å; A308-N311 PolarHBondContact O-N 2.77Å; N311-S314 WeakPolarHBondContact CA-OG 3.23Å
312	I	53.6	Low	50.3	Low	99 Å²	99	61.2 Å²	61.2	51%	0.508	34%	0.342	S	S	.	.	H	α-helix	trans	-62.1	-45	175.9	-68	164.5	0	0	0	110.7	A308 L309 Y310	A308-I312 VanDerWaalsContact O-CG1 3.25Å; A308-I312 WeakPolarHBondContact O-CG1 3.46Å; A308-I312 PolarHBondContact O-N 3.3Å; L309-I312 PolarHBondContact O-N 2.9Å; Y310-I312 VanDerWaalsContact C-N 3.34Å; Y310-I312 PolarHBondContact O-N 2.9Å
313	L	48.7	Very low	49.8	Very low	14 Å²	14	70.7 Å²	70.7	7%	0.073	37%	0.374	C	S	.	.	H	α-helix	trans	-79.3	-29.8	-177.1	-67.4	173.3	0	0	0	113.4	A105 V288 I294 L309 Y310 N315	A105-L313 HydrophobicContact CB-CD2 4.31Å; V288-L313 HydrophobicContact CG1-CB 3.65Å; V288-L313 HydrophobicContact CG2-CB 4.25Å; V288-L313 WeakPolarHBondContact CG2-O 3.5Å; I294-L313 HydrophobicContact CD1-CD1 3.45Å; I294-L313 VanDerWaalsContact CD1-CD1 3.45Å; L309-L313 HydrophobicContact CD1-CD1 4.35Å; L309-L313 HydrophobicContact CG-CD1 3.91Å; L309-L313 HydrophobicContact CG-CG 4.44Å; L309-L313 WeakPolarHBondContact O-CB 3.41Å; L309-L313 WeakPolarHBondContact O-CG 3.28Å; L309-L313 PolarHBondContact O-N 2.83Å; Y310-L313 PolarHBondContact O-N 3.32Å; L313-N315 VanDerWaalsContact C-N 3.33Å; L313-N315 PolarHBondContact O-N 3.45Å
314	S	56.4	Low	49.3	Very low	18 Å²	18	71.8 Å²	71.8	13%	0.126	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	1.6	-175	61.1	0	0	0	0	114.2	Y310 N311 A316	Y310-S314 WeakPolarHBondContact CD1-OG 3.19Å; Y310-S314 WeakPolarHBondContact CE1-OG 3.06Å; Y310-S314 WeakPolarHBondContact O-CA 3.44Å; Y310-S314 WeakPolarHBondContact O-CB 3.38Å; Y310-S314 PolarHBondContact O-N 3.22Å; Y310-S314 PolarHBondContact O-OG 2.86Å; N311-S314 WeakPolarHBondContact CA-OG 3.23Å; S314-A316 PolarHBondContact O-N 2.84Å; S314-A316 VanDerWaalsContact O-N 3.13Å
315	N	50.3	Low	49.1	Very low	79 Å²	79	71.2 Å²	71.2	42%	0.422	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	32.9	-175.5	-74.5	-36.2	0	0	0	112.7	L313 D317	L313-N315 VanDerWaalsContact C-N 3.33Å; L313-N315 PolarHBondContact O-N 3.45Å; N315-D317 PolarHBondContact O-N 2.94Å
316	A	46.9	Very low	48.7	Very low	49 Å²	49	74 Å²	74	41%	0.405	38%	0.383	S	S	.	.			trans	-70.6	128.1	-179	0	0	0	0	0	110.4	S314 P318	S314-A316 PolarHBondContact O-N 2.84Å; S314-A316 VanDerWaalsContact O-N 3.13Å; A316-P318 WeakPolarHBondContact O-CD 3.42Å
317	D	45.6	Very low	48.3	Very low	77 Å²	77	80.6 Å²	80.6	41%	0.412	41%	0.411	S	S	.	.			trans	-56.2	115.4	-170.7	-164	-23.2	0	0	0	112	N315 K319	N315-D317 PolarHBondContact O-N 2.94Å; D317-K319 PolarHBondContact O-N 3.43Å; D317-K319 PolarHBondContact OD1-N 2.93Å
318	P	45.6	Very low	47.7	Very low	90 Å²	90	84.3 Å²	84.3	58%	0.584	43%	0.43	S	S	*	.	H	α-helix	trans	-65.2	-22.6	-179.7	23.7	-31.2	0	0	0	112.2	A316 A322	A316-P318 WeakPolarHBondContact O-CD 3.42Å; P318-A322 WeakPolarHBondContact O-CA 3.44Å; P318-A322 WeakPolarHBondContact O-CB 3.43Å; P318-A322 PolarHBondContact O-N 3.22Å
319	K	44.6	Very low	47	Very low	143 Å²	143	86.4 Å²	86.4	62%	0.622	44%	0.438	S	S	*	.	H	α-helix	trans	-74.7	-29.9	-174.9	-74.2	-171.3	171.9	-170.4	0	114	L266 D317	L266-K319 HydrophobicContact CD2-CD 3.79Å; L266-K319 VanDerWaalsContact CD2-CE 3.42Å; D317-K319 PolarHBondContact O-N 3.43Å; D317-K319 PolarHBondContact OD1-N 2.93Å
320	E	51.2	Low	46.4	Very low	169 Å²	169	91.4 Å²	91.4	79%	0.79	46%	0.461	S	S	*	.	H	α-helix	trans	-83.8	-21.4	-177.4	-150.3	175.3	-177.1	0	0	112.4
321	K	46.9	Very low	45.5	Very low	115 Å²	115	96.1 Å²	96.1	50%	0.5	49%	0.488	S	S	.	.	H	α-helix	trans	-115.1	-4.7	176.6	-77	-174.6	177.2	-179.4	0	115.7	R323 T324 I325	K321-R323 PolarHBondContact O-N 2.9Å; K321-T324 PolarHBondContact O-N 2.98Å; K321-I325 HydrophobicContact CB-CD1 4.03Å; K321-I325 HydrophobicContact CB-CG1 4.4Å; K321-I325 WeakPolarHBondContact O-CB 3.49Å; K321-I325 VanDerWaalsContact O-CG1 3.31Å; K321-I325 WeakPolarHBondContact O-CG1 3.38Å; K321-I325 PolarHBondContact O-N 2.88Å
322	A	40.8	Very low	44.3	Very low	47 Å²	47	97.8 Å²	97.8	39%	0.388	50%	0.495	S	S	.	.	H	α-helix	trans	-56.1	-33.6	176	0	0	0	0	0	112.9	P318 Q326	P318-A322 WeakPolarHBondContact O-CA 3.44Å; P318-A322 WeakPolarHBondContact O-CB 3.43Å; P318-A322 PolarHBondContact O-N 3.22Å; A322-Q326 WeakPolarHBondContact O-CB 3.37Å; A322-Q326 PolarHBondContact O-N 2.69Å
323	R	43.5	Very low	43.2	Very low	226 Å²	226	96.4 Å²	96.4	85%	0.853	50%	0.498	S	S	*	.	H	α-helix	trans	-71.4	-34.7	177	-70.4	-175.1	175.9	173.2	-0.5	113.1	K321 K327	K321-R323 PolarHBondContact O-N 2.9Å; R323-K327 PolarHBondContact O-N 3.03Å
324	T	41.3	Very low	42.5	Very low	78 Å²	78	100.9 Å²	100.9	48%	0.479	53%	0.526	S	S	.	.	H	α-helix	trans	-77.2	-41.7	177.4	-36	0	0	0	0	110.6	K321 K327 D328	K321-T324 PolarHBondContact O-N 2.98Å; T324-K327 PolarHBondContact O-N 3.41Å; T324-D328 VanDerWaalsContact O-CB 3.31Å; T324-D328 WeakPolarHBondContact O-CB 3.32Å; T324-D328 PolarHBondContact O-N 2.73Å
325	I	41.8	Very low	41.3	Very low	74 Å²	74	102.7 Å²	102.7	38%	0.379	55%	0.547	S	S	.	.	H	α-helix	trans	-67.4	-37	177.1	-65.5	169.3	0	0	0	111	K321 K327 D328 V329	K321-I325 HydrophobicContact CB-CD1 4.03Å; K321-I325 HydrophobicContact CB-CG1 4.4Å; K321-I325 WeakPolarHBondContact O-CB 3.49Å; K321-I325 VanDerWaalsContact O-CG1 3.31Å; K321-I325 WeakPolarHBondContact O-CG1 3.38Å; K321-I325 PolarHBondContact O-N 2.88Å; I325-K327 PolarHBondContact O-N 2.95Å; I325-D328 PolarHBondContact O-N 3.12Å; I325-V329 HydrophobicContact CG2-CG2 3.64Å; I325-V329 WeakPolarHBondContact O-CB 3.07Å; I325-V329 WeakPolarHBondContact O-CG2 3.31Å; I325-V329 PolarHBondContact O-N 2.98Å
326	Q	41.2	Very low	40.6	Very low	120 Å²	120	101.7 Å²	101.7	56%	0.561	55%	0.546	S	S	*	.	H	α-helix	trans	-65.2	-41.1	177	-172.3	162.8	4.5	0	0	111.9	A322 E330	A322-Q326 WeakPolarHBondContact O-CB 3.37Å; A322-Q326 PolarHBondContact O-N 2.69Å; Q326-E330 WeakPolarHBondContact O-CB 3.31Å; Q326-E330 VanDerWaalsContact O-CG 3.31Å; Q326-E330 WeakPolarHBondContact O-CG 3.16Å; Q326-E330 PolarHBondContact O-N 3.48Å
327	K	41	Very low	40.4	Very low	148 Å²	148	102.2 Å²	102.2	64%	0.643	54%	0.543	S	S	*	.	H	α-helix	trans	-72	-31.4	177.6	-150.5	176	-173.8	178.6	0	112.8	R323 T324 I325 N331	R323-K327 PolarHBondContact O-N 3.03Å; T324-K327 PolarHBondContact O-N 3.41Å; I325-K327 PolarHBondContact O-N 2.95Å; K327-N331 WeakPolarHBondContact O-CB 3.46Å; K327-N331 PolarHBondContact O-N 3.1Å; K327-N331 PolarHBondContact O-ND2 3.1Å
328	D	39.8	Very low	40.7	Very low	79 Å²	79	101.4 Å²	101.4	42%	0.422	54%	0.538	S	S	.	.	H	α-helix	trans	-82.2	-31.6	177.4	-77.2	-13.9	0	0	0	112.7	T324 I325 M332	T324-D328 VanDerWaalsContact O-CB 3.31Å; T324-D328 WeakPolarHBondContact O-CB 3.32Å; T324-D328 PolarHBondContact O-N 2.73Å; I325-D328 PolarHBondContact O-N 3.12Å; D328-M332 HydrophobicContact CB-CE 3.83Å; D328-M332 VanDerWaalsContact O-CB 3.27Å; D328-M332 WeakPolarHBondContact O-CB 3.31Å; D328-M332 WeakPolarHBondContact O-CG 3.07Å; D328-M332 PolarHBondContact O-N 3.43Å
329	V	38.9	Very low	40.9	Very low	89 Å²	89	98.5 Å²	98.5	54%	0.539	52%	0.521	S	S	.	.	H	α-helix	trans	-77.3	-32	176.1	171.1	0	0	0	0	111.7	I325	I325-V329 HydrophobicContact CG2-CG2 3.64Å; I325-V329 WeakPolarHBondContact O-CB 3.07Å; I325-V329 WeakPolarHBondContact O-CG2 3.31Å; I325-V329 PolarHBondContact O-N 2.98Å
330	E	40.7	Very low	41.5	Very low	135 Å²	135	92.6 Å²	92.6	63%	0.631	50%	0.497	S	S	*	.	H	α-helix	trans	-73.4	-25.4	173.3	-77	173.2	178.6	0	0	113	Q326	Q326-E330 WeakPolarHBondContact O-CB 3.31Å; Q326-E330 VanDerWaalsContact O-CG 3.31Å; Q326-E330 WeakPolarHBondContact O-CG 3.16Å; Q326-E330 PolarHBondContact O-N 3.48Å
331	N	40.2	Very low	41.9	Very low	126 Å²	126	86.7 Å²	86.7	67%	0.674	47%	0.47	S	S	*	.	H	α-helix	trans	-103.2	-6.1	-178.4	-70.2	-48.3	0	0	0	114.7	K327	K327-N331 WeakPolarHBondContact O-CB 3.46Å; K327-N331 PolarHBondContact O-N 3.1Å; K327-N331 PolarHBondContact O-ND2 3.1Å
332	M	32	Very low	42.6	Very low	79 Å²	79	84.4 Å²	84.4	39%	0.389	46%	0.461	S	S	.	.	S	Bend	trans	-91.1	136.1	174.7	-83	179.7	-144.8	0	0	111	V304 D328 V334	V304-M332 HydrophobicContact CG2-SD 4.49Å; D328-M332 HydrophobicContact CB-CE 3.83Å; D328-M332 VanDerWaalsContact O-CB 3.27Å; D328-M332 WeakPolarHBondContact O-CB 3.31Å; D328-M332 WeakPolarHBondContact O-CG 3.07Å; D328-M332 PolarHBondContact O-N 3.43Å; M332-V334 VanDerWaalsContact C-N 3.34Å; M332-V334 WeakPolarHBondContact O-CG2 3.11Å; M332-V334 PolarHBondContact O-N 3.24Å
333	A	30.6	Very low	43.6	Very low	69 Å²	69	84.8 Å²	84.8	57%	0.57	46%	0.456	S	S	*	.			trans	-46	92.7	173.7	0	0	0	0	0	111.8	G335 S336	A333-G335 PolarHBondContact O-N 3.27Å; A333-S336 PolarHBondContact O-N 2.94Å; A333-S336 VanDerWaalsContact O-N 3.12Å; A333-S336 PolarHBondContact O-OG 2.83Å; A333-S336 VanDerWaalsContact O-OG 3.1Å
334	V	33.2	Very low	44.6	Very low	109 Å²	109	76.4 Å²	76.4	66%	0.661	43%	0.426	S	S	*	.	H	α-helix	trans	-54.3	-25.5	180	177.5	0	0	0	0	111.1	M332 L338	M332-V334 VanDerWaalsContact C-N 3.34Å; M332-V334 WeakPolarHBondContact O-CG2 3.11Å; M332-V334 PolarHBondContact O-N 3.24Å; V334-L338 WeakPolarHBondContact O-CB 3.27Å; V334-L338 PolarHBondContact O-N 3.16Å
335	G	31.2	Very low	45.7	Very low	55 Å²	55	72.8 Å²	72.8	57%	0.567	40%	0.404	S	S	*	.	H	α-helix	trans	-67.3	-38.8	178.2	0	0	0	0	0	115.7	A333 A339	A333-G335 PolarHBondContact O-N 3.27Å; G335-A339 PolarHBondContact O-N 3.29Å
336	S	35.3	Very low	47	Very low	58 Å²	58	72.8 Å²	72.8	41%	0.406	40%	0.404	S	S	.	.	H	α-helix	trans	-78.4	-37.6	-172.6	47.7	0	0	0	0	112.8	A333 I340	A333-S336 PolarHBondContact O-N 2.94Å; A333-S336 VanDerWaalsContact O-N 3.12Å; A333-S336 PolarHBondContact O-OG 2.83Å; A333-S336 VanDerWaalsContact O-OG 3.1Å; S336-I340 WeakPolarHBondContact O-CG1 3.22Å; S336-I340 PolarHBondContact O-N 2.97Å
337	N	43	Very low	48.2	Very low	61 Å²	61	71.3 Å²	71.3	33%	0.326	40%	0.398	S	S	.	.	H	α-helix	trans	-73	-32.8	177.4	-69.2	-36.7	0	0	0	112.4	L341	N337-L341 PolarHBondContact O-N 3.18Å
338	L	51.2	Low	49.3	Very low	60 Å²	60	69.1 Å²	69.1	31%	0.314	40%	0.399	S	S	.	.	H	α-helix	trans	-65.4	-50.8	175.7	-170.1	64.6	0	0	0	110.5	V334 I340 L341 E342 P380	V334-L338 WeakPolarHBondContact O-CB 3.27Å; V334-L338 PolarHBondContact O-N 3.16Å; L338-I340 PolarHBondContact O-N 3.37Å; L338-I340 VanDerWaalsContact O-N 3.16Å; L338-L341 CarbonylContact O-C 3.55Å; L338-L341 WeakPolarHBondContact O-CA 3.25Å; L338-L341 WeakPolarHBondContact O-CB 2.96Å; L338-L341 PolarHBondContact O-N 2.92Å; L338-E342 HydrophobicContact CG-CG 4.28Å; L338-E342 WeakPolarHBondContact O-CG 3.47Å; L338-E342 PolarHBondContact O-N 3.2Å; L338-P380 HydrophobicContact CD1-CB 3.44Å; L338-P380 VanDerWaalsContact CD1-CB 3.44Å
339	A	50.9	Low	50.4	Low	28 Å²	28	73 Å²	73	23%	0.231	42%	0.419	C	S	.	.	H	α-helix	trans	-57.1	-34.8	-179.7	0	0	0	0	0	113.5	G335 N343	G335-A339 PolarHBondContact O-N 3.29Å; A339-N343 WeakPolarHBondContact O-CB 3.39Å; A339-N343 PolarHBondContact O-N 2.94Å; A339-N343 PolarHBondContact O-ND2 3.46Å
340	I	56.1	Low	51.7	Low	20 Å²	20	69.2 Å²	69.2	10%	0.103	40%	0.396	C	S	.	.	H	α-helix	trans	-69.6	-41.3	175.6	-61	165	0	0	0	110.9	Y52 I305 S336 L338 N343 F344	Y52-I340 HydrophobicContact CD1-CG2 4.41Å; Y52-I340 HydrophobicContact CE1-CG2 4.13Å; I305-I340 HydrophobicContact CD1-CB 4.09Å; I305-I340 HydrophobicContact CD1-CD1 4.12Å; I305-I340 HydrophobicContact CD1-CG2 3.36Å; S336-I340 WeakPolarHBondContact O-CG1 3.22Å; S336-I340 PolarHBondContact O-N 2.97Å; L338-I340 PolarHBondContact O-N 3.37Å; L338-I340 VanDerWaalsContact O-N 3.16Å; I340-N343 PolarHBondContact O-N 3.41Å; I340-F344 WeakPolarHBondContact O-CB 3.43Å; I340-F344 PolarHBondContact O-N 3.01Å
341	L	60.1	Low	52.7	Low	44 Å²	44	64.7 Å²	64.7	23%	0.23	38%	0.379	C	S	.	.	H	α-helix	trans	-64.4	-44.5	175.5	-174.9	67.4	0	0	0	111	N337 L338 N343 F344 L345 L511 L513	N337-L341 PolarHBondContact O-N 3.18Å; L338-L341 CarbonylContact O-C 3.55Å; L338-L341 WeakPolarHBondContact O-CA 3.25Å; L338-L341 WeakPolarHBondContact O-CB 2.96Å; L338-L341 PolarHBondContact O-N 2.92Å; L341-N343 VanDerWaalsContact C-N 3.34Å; L341-N343 PolarHBondContact O-N 2.9Å; L341-F344 PolarHBondContact O-N 2.03Å; L341-L345 HydrophobicContact CD1-CD1 4.16Å; L341-L345 HydrophobicContact CD1-CG 4.36Å; L341-L345 HydrophobicContact CG-CD1 3.91Å; L341-L345 HydrophobicContact CG-CG 4.43Å; L341-L345 VanDerWaalsContact O-CG 3.25Å; L341-L345 WeakPolarHBondContact O-CG 3.49Å; L341-L345 PolarHBondContact O-N 2.89Å; L341-L511 HydrophobicContact CD1-CD1 3.87Å; L341-L513 HydrophobicContact CD2-CD2 4.14Å
342	E	62.1	Low	53.8	Low	68 Å²	68	59.3 Å²	59.3	32%	0.318	35%	0.35	S	S	.	.	H	α-helix	trans	-55.9	-49.8	174.3	-60.9	-172.1	147.2	0	0	110.8	L338 F344 L345 L346 L381	L338-E342 HydrophobicContact CG-CG 4.28Å; L338-E342 WeakPolarHBondContact O-CG 3.47Å; L338-E342 PolarHBondContact O-N 3.2Å; E342-F344 VanDerWaalsContact C-N 3.33Å; E342-F344 PolarHBondContact O-N 3.49Å; E342-L345 PolarHBondContact O-N 3.06Å; E342-L346 HydrophobicContact CB-CD1 4.37Å; E342-L346 VanDerWaalsContact O-CB 3.24Å; E342-L346 WeakPolarHBondContact O-CB 3.16Å; E342-L346 WeakPolarHBondContact O-CG 3.33Å; E342-L346 PolarHBondContact O-N 3.44Å; E342-L381 HydrophobicContact CB-CD2 3.97Å; E342-L381 HydrophobicContact CG-CD2 3.6Å
343	N	62.1	Low	55.6	Low	54 Å²	54	56.7 Å²	56.7	29%	0.289	34%	0.34	S	S	.	.	H	α-helix	trans	-60	-41.4	177	-81.4	-31.5	0	0	0	112.4	Y52 A339 I340 L341 L345 Q347	Y52-N343 PolarHBondContact O-ND2 3.16Å; A339-N343 WeakPolarHBondContact O-CB 3.39Å; A339-N343 PolarHBondContact O-N 2.94Å; A339-N343 PolarHBondContact O-ND2 3.46Å; I340-N343 PolarHBondContact O-N 3.41Å; L341-N343 VanDerWaalsContact C-N 3.34Å; L341-N343 PolarHBondContact O-N 2.9Å; N343-L345 VanDerWaalsContact C-N 3.32Å; N343-L345 PolarHBondContact O-N 3.26Å; N343-Q347 WeakPolarHBondContact O-CB 3.28Å; N343-Q347 WeakPolarHBondContact O-CG 3.34Å; N343-Q347 PolarHBondContact O-N 2.98Å
344	F	64.8	Low	57.5	Low	51 Å²	51	55.4 Å²	55.4	22%	0.224	32%	0.323	C	S	.	.	H	α-helix	trans	-70.3	-28.4	179.8	-164.1	-119	0	0	0	112.7	L98 V102 I340 L341 E342 S350 P351 L352	L98-F344 HydrophobicContact CD2-CE2 4.39Å; L98-F344 HydrophobicContact CD2-CZ 4.24Å; V102-F344 HydrophobicContact CG2-CE1 4.09Å; V102-F344 HydrophobicContact CG2-CZ 4.02Å; I340-F344 WeakPolarHBondContact O-CB 3.43Å; I340-F344 PolarHBondContact O-N 3.01Å; L341-F344 PolarHBondContact O-N 2.03Å; E342-F344 VanDerWaalsContact C-N 3.33Å; E342-F344 PolarHBondContact O-N 3.49Å; F344-S350 WeakPolarHBondContact O-CB 3.35Å; F344-S350 PolarHBondContact O-OG 3.03Å; F344-P351 HydrophobicContact CE2-CG 4.31Å; F344-P351 HydrophobicContact CZ-CG 3.8Å; F344-L352 HydrophobicContact CD1-CD1 3.3Å; F344-L352 HydrophobicContact CD1-CG 3.87Å; F344-L352 HydrophobicContact CE1-CB 4.36Å; F344-L352 HydrophobicContact CE1-CD1 3.23Å; F344-L352 HydrophobicContact CE1-CD2 4.46Å; F344-L352 HydrophobicContact CE1-CG 3.4Å; F344-L352 VanDerWaalsContact CE1-CG 3.4Å; F344-L352 HydrophobicContact CZ-CD1 4.4Å; F344-L352 HydrophobicContact CZ-CG 4.17Å
345	L	64.2	Low	59.2	Low	1 Å²	1	55.4 Å²	55.4	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-84	-32.4	177.5	-63.3	175.2	0	0	0	112.8	L341 E342 N343 L352 L381 C472 W507 L513	L341-L345 HydrophobicContact CD1-CD1 4.16Å; L341-L345 HydrophobicContact CD1-CG 4.36Å; L341-L345 HydrophobicContact CG-CD1 3.91Å; L341-L345 HydrophobicContact CG-CG 4.43Å; L341-L345 VanDerWaalsContact O-CG 3.25Å; L341-L345 WeakPolarHBondContact O-CG 3.49Å; L341-L345 PolarHBondContact O-N 2.89Å; E342-L345 PolarHBondContact O-N 3.06Å; N343-L345 VanDerWaalsContact C-N 3.32Å; N343-L345 PolarHBondContact O-N 3.26Å; L345-L352 HydrophobicContact CD2-CB 4.11Å; L345-L352 HydrophobicContact CD2-CD1 3.58Å; L345-L381 HydrophobicContact CD1-CD1 3.87Å; L345-C472 WeakPolarHBondContact O-CB 3.03Å; L345-W507 HydrophobicContact CD2-CH2 3.52Å; L345-W507 HydrophobicContact CD2-CZ3 3.34Å; L345-L513 HydrophobicContact CD1-CD1 4.04Å; L345-L513 HydrophobicContact CD1-CD2 3.92Å; L345-L513 HydrophobicContact CD2-CD1 4.38Å
346	L	68.4	Low	61.5	Low	74 Å²	74	58.2 Å²	58.2	39%	0.387	32%	0.322	S	S	.	.	H	α-helix	trans	-97.3	-14.7	-171.6	-59.8	176.1	0	0	0	113.6	E342 P348 L381 Y474	E342-L346 HydrophobicContact CB-CD1 4.37Å; E342-L346 VanDerWaalsContact O-CB 3.24Å; E342-L346 WeakPolarHBondContact O-CB 3.16Å; E342-L346 WeakPolarHBondContact O-CG 3.33Å; E342-L346 PolarHBondContact O-N 3.44Å; L346-P348 WeakPolarHBondContact O-CD 3.09Å; L346-L381 HydrophobicContact CD1-CD2 4.29Å; L346-Y474 WeakPolarHBondContact CD2-O 3.47Å
347	Q	66.3	Low	63.8	Low	90 Å²	90	56.4 Å²	56.4	42%	0.421	31%	0.308	S	S	.	.			trans	-72.4	125.1	177.9	-82	178.9	7.1	0	0	111.5	N343 N349 S350 C353	N343-Q347 WeakPolarHBondContact O-CB 3.28Å; N343-Q347 WeakPolarHBondContact O-CG 3.34Å; N343-Q347 PolarHBondContact O-N 2.98Å; Q347-N349 PolarHBondContact O-N 3.05Å; Q347-S350 WeakPolarHBondContact O-CB 3.42Å; Q347-S350 PolarHBondContact O-N 3.13Å; Q347-C353 VanDerWaalsContact O-CB 3.26Å; Q347-C353 WeakPolarHBondContact O-CB 3.42Å
348	P	64.1	Low	66	Low	102 Å²	102	57 Å²	57	66%	0.662	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-24.7	-179.7	-26	34.2	0	0	0	115.1	L346 S350	L346-P348 WeakPolarHBondContact O-CD 3.09Å; P348-S350 VanDerWaalsContact C-N 3.35Å
349	N	62.9	Low	68	Low	160 Å²	160	56 Å²	56	86%	0.856	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-3.8	179.1	-61.2	-30.2	0	0	0	112.7	Q347	Q347-N349 PolarHBondContact O-N 3.05Å
350	S	66	Low	70.1	Confident	9 Å²	9	55.5 Å²	55.5	6%	0.063	31%	0.312	C	S	.	.	S	Bend	trans	-69	137.3	176.7	177.9	0	0	0	0	109.7	F344 Q347 P348 L352 C353	F344-S350 WeakPolarHBondContact O-CB 3.35Å; F344-S350 PolarHBondContact O-OG 3.03Å; Q347-S350 WeakPolarHBondContact O-CB 3.42Å; Q347-S350 PolarHBondContact O-N 3.13Å; P348-S350 VanDerWaalsContact C-N 3.35Å; S350-L352 PolarHBondContact O-N 2.84Å; S350-L352 VanDerWaalsContact O-N 3.12Å; S350-L352 PolarHBondContact OG-N 3.43Å; S350-L352 VanDerWaalsContact OG-N 3.11Å; S350-C353 WeakPolarHBondContact O-CB 3.27Å; S350-C353 PolarHBondContact O-N 3.13Å
351	P	61.8	Low	71.8	Confident	41 Å²	41	59 Å²	59	27%	0.266	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-20.9	170.7	26.6	-34.4	0	0	0	112.4	V102 F344	V102-P351 HydrophobicContact CG1-CB 4.42Å; V102-P351 HydrophobicContact CG1-CG 4.23Å; F344-P351 HydrophobicContact CE2-CG 4.31Å; F344-P351 HydrophobicContact CZ-CG 3.8Å
352	L	64.3	Low	73.3	Confident	12 Å²	12	62.3 Å²	62.3	6%	0.063	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-14	175.4	-61.9	-169.6	0	0	0	114	V102 F344 L345 S350 L354 W507	V102-L352 HydrophobicContact CG1-CD2 3.57Å; V102-L352 HydrophobicContact CG1-CG 4.33Å; F344-L352 HydrophobicContact CD1-CD1 3.3Å; F344-L352 HydrophobicContact CD1-CG 3.87Å; F344-L352 HydrophobicContact CE1-CB 4.36Å; F344-L352 HydrophobicContact CE1-CD1 3.23Å; F344-L352 HydrophobicContact CE1-CD2 4.46Å; F344-L352 HydrophobicContact CE1-CG 3.4Å; F344-L352 VanDerWaalsContact CE1-CG 3.4Å; F344-L352 HydrophobicContact CZ-CD1 4.4Å; F344-L352 HydrophobicContact CZ-CG 4.17Å; L345-L352 HydrophobicContact CD2-CB 4.11Å; L345-L352 HydrophobicContact CD2-CD1 3.58Å; S350-L352 PolarHBondContact O-N 2.84Å; S350-L352 VanDerWaalsContact O-N 3.12Å; S350-L352 PolarHBondContact OG-N 3.43Å; S350-L352 VanDerWaalsContact OG-N 3.11Å; L352-L354 VanDerWaalsContact C-N 3.32Å; L352-L354 PolarHBondContact O-N 2.78Å; L352-W507 HydrophobicContact CB-CH2 4.41Å; L352-W507 HydrophobicContact CD1-CE3 4.19Å; L352-W507 HydrophobicContact CD1-CH2 4.15Å; L352-W507 HydrophobicContact CD1-CZ3 3.85Å; L352-W507 HydrophobicContact CD2-CD2 4.44Å; L352-W507 HydrophobicContact CD2-CZ2 4.26Å
353	C	69.9	Low	74.9	Confident	25 Å²	25	59.5 Å²	59.5	17%	0.169	34%	0.343	C	S	.	.	S	Bend	trans	-73.3	93.7	171.2	178	0	0	0	0	108.5	Q347 S350 C472	Q347-C353 VanDerWaalsContact O-CB 3.26Å; Q347-C353 WeakPolarHBondContact O-CB 3.42Å; S350-C353 WeakPolarHBondContact O-CB 3.27Å; S350-C353 PolarHBondContact O-N 3.13Å; C353-C472 HydrophobicContact CB-CB 3.68Å; C353-C472 WeakPolarHBondContact CB-SG 3.36Å; C353-C472 VanDerWaalsContact SG-CA 3.51Å; C353-C472 WeakPolarHBondContact SG-CB 3.43Å; C353-C472 CovalentContact SG-SG 2.03Å; C353-C472 PolarHBondContact SG-SG 2.96Å
354	L	69.6	Low	76.4	Confident	42 Å²	42	59.7 Å²	59.7	22%	0.22	34%	0.344	C	S	.	.			trans	-63	151.2	174.4	-72.1	174	0	0	0	110.6	L352 N473	L352-L354 VanDerWaalsContact C-N 3.32Å; L352-L354 PolarHBondContact O-N 2.78Å; L354-N473 HydrophobicContact CB-CB 4.48Å; L354-N473 WeakPolarHBondContact CB-ND2 3.49Å; L354-N473 WeakPolarHBondContact CD1-ND2 3.41Å
355	P	70	Confident	77.8	Confident	108 Å²	108	57.3 Å²	57.3	70%	0.701	33%	0.334	S	S	*	.			trans	-56.5	151.6	-179.5	23.9	-34.3	0	0	0	111.3	P357	P355-P357 VanDerWaalsContact O-N 3.16Å
356	K	78.4	Confident	79.3	Confident	115 Å²	115	60.2 Å²	60.2	50%	0.5	35%	0.349	S	S	.	.			trans	-45.9	123.7	179.7	-178.9	-175.8	174.4	-177.6	0	109.9	H450	K356-H450 VanDerWaalsContact CE-CE1 3.4Å; K356-H450 WeakPolarHBondContact CE-CE1 3.35Å
357	P	83.3	Confident	80.6	Confident	20 Å²	20	57 Å²	57	13%	0.13	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-68.3	148.1	-174.8	27.1	-34	0	0	0	111.1	P355 T359 H450 I452 T469	P355-P357 VanDerWaalsContact O-N 3.16Å; P357-T359 PolarHBondContact O-N 3.13Å; P357-H450 HydrophobicContact CG-CB 4.03Å; P357-I452 HydrophobicContact CB-CG2 3.66Å; P357-I452 HydrophobicContact CG-CG2 3.94Å; P357-T469 HydrophobicContact CB-CG2 4.34Å; P357-T469 HydrophobicContact CG-CG2 3.68Å
358	A	89.4	Confident	82	Confident	74 Å²	74	52.8 Å²	52.8	61%	0.612	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-68.9	128.2	172.1	0	0	0	0	0	109.6
359	T	93.1	Very high	83.5	Confident	38 Å²	38	49.4 Å²	49.4	23%	0.233	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-89.7	159.3	-179.5	61.3	0	0	0	0	111.6	P357 S361 Q433 Q435 H450 I451	P357-T359 PolarHBondContact O-N 3.13Å; T359-S361 PolarHBondContact O-N 3.22Å; T359-Q433 WeakPolarHBondContact CB-O 3.45Å; T359-Q433 PolarHBondContact OG1-O 2.97Å; T359-Q435 HydrophobicContact CG2-CG 3.66Å; T359-H450 HydrophobicContact CG2-CB 3.73Å; T359-I451 CarbonylContact C-O 3.55Å; T359-I451 VanDerWaalsContact CA-O 3.27Å; T359-I451 WeakPolarHBondContact CA-O 3.28Å
360	V	94.8	Very high	85	Confident	17 Å²	17	42.4 Å²	42.4	10%	0.103	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-64.8	126.2	172.5	178.9	0	0	0	0	109.4	D362 F363 Q433 I451 T454	V360-D362 WeakPolarHBondContact CG1-OD1 3.3Å; V360-F363 HydrophobicContact CB-CB 4.44Å; V360-F363 HydrophobicContact CG1-CB 4.4Å; V360-Q433 CarbonylContact O-C 3.51Å; V360-I451 HydrophobicContact CG2-CG2 4.26Å; V360-I451 PolarHBondContact N-O 2.77Å; V360-T454 HydrophobicContact CG1-CG2 4.42Å; V360-T454 HydrophobicContact CG2-CG2 4.33Å
361	S	92.3	Very high	86.3	Confident	93 Å²	93	45.5 Å²	45.5	65%	0.65	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-26.5	-172.9	48.1	0	0	0	0	114.3	T359 Q433	T359-S361 PolarHBondContact O-N 3.22Å; S361-Q433 VanDerWaalsContact O-CG 3.25Å; S361-Q433 WeakPolarHBondContact O-CG 3.47Å; S361-Q433 PolarHBondContact O-NE2 2.97Å
362	D	91.8	Very high	88	Confident	115 Å²	115	43.5 Å²	43.5	62%	0.615	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	31.9	-177.3	58.9	-34.3	0	0	0	111.3	V360 D364	V360-D362 WeakPolarHBondContact CG1-OD1 3.3Å; D362-D364 PolarHBondContact O-N 3.5Å; D362-D364 VanDerWaalsContact O-N 3.16Å
363	F	95	Very high	89.5	Confident	9 Å²	9	44.6 Å²	44.6	4%	0.039	26%	0.258	C	S	.	.			trans	-67.7	114.1	-179.1	177.4	-103.1	0	0	0	111.4	V360 V365 F368 Q433 L436 I451 T454 Y463	V360-F363 HydrophobicContact CB-CB 4.44Å; V360-F363 HydrophobicContact CG1-CB 4.4Å; F363-V365 HydrophobicContact CD1-CG2 4.19Å; F363-V365 HydrophobicContact CE1-CG2 3.74Å; F363-F368 HydrophobicContact CE2-CB 3.9Å; F363-F368 AromaticContact CE2-CD2 3.87Å; F363-F368 HydrophobicContact CE2-CD2 3.87Å; F363-F368 AromaticContact CE2-CG 3.98Å; F363-F368 HydrophobicContact CE2-CG 3.98Å; F363-F368 HydrophobicContact CZ-CB 3.64Å; F363-F368 HydrophobicContact CZ-CD1 4.05Å; F363-F368 AromaticContact CZ-CD2 3.88Å; F363-F368 HydrophobicContact CZ-CD2 3.88Å; F363-F368 AromaticContact CZ-CG 3.6Å; F363-F368 HydrophobicContact CZ-CG 3.6Å; F363-Q433 PolarHBondContact O-OE1 3.06Å; F363-Q433 VanDerWaalsContact O-OE1 3.13Å; F363-L436 HydrophobicContact CE1-CD2 4.13Å; F363-L436 HydrophobicContact CZ-CD1 4.46Å; F363-I451 HydrophobicContact CD2-CB 4.23Å; F363-I451 HydrophobicContact CD2-CG1 4.21Å; F363-I451 HydrophobicContact CD2-CG2 4Å; F363-I451 HydrophobicContact CE2-CB 4.29Å; F363-I451 HydrophobicContact CE2-CG1 3.81Å; F363-I451 HydrophobicContact CE2-CG2 4.09Å; F363-I451 HydrophobicContact CZ-CG1 4.11Å; F363-T454 HydrophobicContact CD2-CG2 4.32Å; F363-Y463 HydrophobicContact CD2-CE2 4.36Å; F363-Y463 HydrophobicContact CE2-CE2 4.36Å
364	D	94.7	Very high	90.7	Very high	57 Å²	57	43.6 Å²	43.6	31%	0.305	25%	0.251	S	S	.	.			trans	-95.4	119	172.6	175.1	27.2	0	0	0	111.8	D362 D366 S367 F368 Y463	D362-D364 PolarHBondContact O-N 3.5Å; D362-D364 VanDerWaalsContact O-N 3.16Å; D364-D366 VanDerWaalsContact C-N 3.3Å; D364-D366 PolarHBondContact O-N 2.83Å; D364-D366 PolarHBondContact OD1-N 3.08Å; D364-S367 VanDerWaalsContact OD2-CB 3.3Å; D364-S367 WeakPolarHBondContact OD2-CB 3.37Å; D364-S367 PolarHBondContact OD2-N 3.42Å; D364-S367 VanDerWaalsContact OD2-N 3.1Å; D364-S367 PolarHBondContact OD2-OG 3.05Å; D364-F368 PolarHBondContact O-N 2.9Å; D364-Y463 WeakPolarHBondContact CB-OH 3.4Å; D364-Y463 PolarHBondContact N-OH 2.78Å; D364-Y463 WeakPolarHBondContact O-CE2 3.42Å
365	V	94.4	Very high	91.9	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-33.8	179.3	179.7	0	0	0	0	111.3	F363 F368 T369 G400 T404 V430	F363-V365 HydrophobicContact CD1-CG2 4.19Å; F363-V365 HydrophobicContact CE1-CG2 3.74Å; V365-F368 WeakPolarHBondContact O-CA 3.37Å; V365-F368 WeakPolarHBondContact O-CB 3.35Å; V365-F368 PolarHBondContact O-N 3.47Å; V365-F368 VanDerWaalsContact O-N 3.08Å; V365-T369 WeakPolarHBondContact O-CG2 3.13Å; V365-T369 PolarHBondContact O-N 3.26Å; V365-T369 VanDerWaalsContact O-N 3.12Å; V365-G400 VanDerWaalsContact CG2-O 3.25Å; V365-G400 WeakPolarHBondContact CG2-O 3.29Å; V365-T404 HydrophobicContact CG1-CG2 4.02Å; V365-V430 HydrophobicContact CB-CG2 4.5Å; V365-V430 HydrophobicContact CG1-CG2 4.14Å; V365-V430 HydrophobicContact CG2-CB 4.44Å; V365-V430 HydrophobicContact CG2-CG1 4.14Å; V365-V430 HydrophobicContact CG2-CG2 3.5Å; V365-V430 VanDerWaalsContact CG2-CG2 3.5Å
366	D	94.4	Very high	93.1	Very high	62 Å²	62	37.1 Å²	37.1	33%	0.332	21%	0.211	S	C	.	.	H	α-helix	trans	-67	-45.9	-177.9	-72.4	-16.7	0	0	0	110.5	D364 F368 T369 K393	D364-D366 VanDerWaalsContact C-N 3.3Å; D364-D366 PolarHBondContact O-N 2.83Å; D364-D366 PolarHBondContact OD1-N 3.08Å; D366-F368 PolarHBondContact O-N 3.32Å; D366-T369 PolarHBondContact O-N 3.17Å; D366-T369 PolarHBondContact O-OG1 2.84Å; D366-K393 WeakPolarHBondContact OD1-CE 3.47Å; D366-K393 IonicContact OD1-NZ 2.82Å; D366-K393 PolarHBondContact OD1-NZ 3.2Å; D366-K393 IonicContact OD2-NZ 2.81Å; D366-K393 PolarHBondContact OD2-NZ 2.92Å
367	S	96.3	Very high	93.8	Very high	7 Å²	7	33.3 Å²	33.3	5%	0.049	19%	0.194	C	C	.	.	H	α-helix	trans	-60.1	-22.9	171.2	-63.6	0	0	0	0	114.1	D364 L457 G461 Q462 Y463 R481	D364-S367 VanDerWaalsContact OD2-CB 3.3Å; D364-S367 WeakPolarHBondContact OD2-CB 3.37Å; D364-S367 PolarHBondContact OD2-N 3.42Å; D364-S367 VanDerWaalsContact OD2-N 3.1Å; D364-S367 PolarHBondContact OD2-OG 3.05Å; S367-L457 WeakPolarHBondContact OG-CD2 3.49Å; S367-G461 WeakPolarHBondContact CA-O 3.34Å; S367-G461 PolarHBondContact OG-O 2.85Å; S367-G461 VanDerWaalsContact OG-O 3.05Å; S367-Q462 WeakPolarHBondContact O-CA 3.5Å; S367-Y463 VanDerWaalsContact CB-CE2 3.44Å; S367-Y463 PolarHBondContact O-N 3.5Å; S367-Y463 VanDerWaalsContact O-N 3.09Å; S367-R481 PolarHBondContact O-NH2 2.9Å
368	F	96.4	Very high	94	Very high	1 Å²	1	32.3 Å²	32.3	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-84.3	-26.1	177.7	179	-103.4	0	0	0	113.8	F363 D364 V365 D366 W372 Y391 F406 L436 I451 Y463 V466 M468 R481	F363-F368 HydrophobicContact CE2-CB 3.9Å; F363-F368 AromaticContact CE2-CD2 3.87Å; F363-F368 HydrophobicContact CE2-CD2 3.87Å; F363-F368 AromaticContact CE2-CG 3.98Å; F363-F368 HydrophobicContact CE2-CG 3.98Å; F363-F368 HydrophobicContact CZ-CB 3.64Å; F363-F368 HydrophobicContact CZ-CD1 4.05Å; F363-F368 AromaticContact CZ-CD2 3.88Å; F363-F368 HydrophobicContact CZ-CD2 3.88Å; F363-F368 AromaticContact CZ-CG 3.6Å; F363-F368 HydrophobicContact CZ-CG 3.6Å; D364-F368 PolarHBondContact O-N 2.9Å; V365-F368 WeakPolarHBondContact O-CA 3.37Å; V365-F368 WeakPolarHBondContact O-CB 3.35Å; V365-F368 PolarHBondContact O-N 3.47Å; V365-F368 VanDerWaalsContact O-N 3.08Å; D366-F368 PolarHBondContact O-N 3.32Å; F368-W372 HydrophobicContact CD2-CZ2 4.17Å; F368-W372 PolarHBondContact O-NE1 2.83Å; F368-Y391 HydrophobicContact CD1-CD2 4.07Å; F368-Y391 HydrophobicContact CD1-CG 4.49Å; F368-Y391 HydrophobicContact CE1-CD1 4.44Å; F368-Y391 AromaticContact CE1-CD2 3.35Å; F368-Y391 HydrophobicContact CE1-CD2 3.35Å; F368-Y391 AromaticContact CE1-CE2 3.62Å; F368-Y391 HydrophobicContact CE1-CE2 3.62Å; F368-Y391 AromaticContact CE1-CG 3.81Å; F368-Y391 HydrophobicContact CE1-CG 3.81Å; F368-Y391 HydrophobicContact CE2-CD2 4.34Å; F368-Y391 HydrophobicContact CE2-CE2 4.11Å; F368-Y391 AromaticContact CZ-CD2 3.52Å; F368-Y391 HydrophobicContact CZ-CD2 3.52Å; F368-Y391 AromaticContact CZ-CE2 3.29Å; F368-Y391 HydrophobicContact CZ-CE2 3.29Å; F368-Y391 HydrophobicContact CZ-CG 4.36Å; F368-Y391 AromaticContact CZ-CZ 3.96Å; F368-F406 HydrophobicContact CE1-CE2 4.43Å; F368-F406 HydrophobicContact CE1-CZ 4.41Å; F368-L436 HydrophobicContact CE1-CD1 4.06Å; F368-L436 HydrophobicContact CZ-CD1 4.09Å; F368-I451 HydrophobicContact CE2-CD1 4.15Å; F368-Y463 HydrophobicContact CB-CD2 4.42Å; F368-V466 HydrophobicContact CD2-CG1 4.07Å; F368-V466 HydrophobicContact CD2-CG2 4.49Å; F368-V466 HydrophobicContact CE2-CG1 4.35Å; F368-V466 HydrophobicContact CE2-CG2 4.02Å; F368-M468 HydrophobicContact CE2-CE 4.24Å; F368-M468 HydrophobicContact CZ-CE 4.19Å; F368-R481 PolarHBondContact O-NH2 2.86Å
369	T	94.5	Very high	93.8	Very high	31 Å²	31	30.6 Å²	30.6	19%	0.19	17%	0.17	C	C	.	.			trans	-64.4	160.3	-178.7	62.8	0	0	0	0	114.2	V365 D366 K393 Q462 R481	V365-T369 WeakPolarHBondContact O-CG2 3.13Å; V365-T369 PolarHBondContact O-N 3.26Å; V365-T369 VanDerWaalsContact O-N 3.12Å; D366-T369 PolarHBondContact O-N 3.17Å; D366-T369 PolarHBondContact O-OG1 2.84Å; T369-K393 HydrophobicContact CG2-CB 4.01Å; T369-Q462 PolarHBondContact O-NE2 2.81Å; T369-R481 VanDerWaalsContact O-CZ 3.25Å; T369-R481 PolarHBondContact O-NH1 3.45Å; T369-R481 PolarHBondContact O-NH2 3.02Å
370	G	94.1	Very high	92.8	Very high	14 Å²	14	29.9 Å²	29.9	14%	0.144	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	102.8	-162.1	179.9	0	0	0	0	0	113	T390 Y391 R481	G370-T390 WeakPolarHBondContact O-CA 3.49Å; G370-Y391 PolarHBondContact N-O 3.05Å; G370-Y391 PolarHBondContact O-N 3.05Å; G370-R481 VanDerWaalsContact C-NH1 3.33Å
371	R	94.6	Very high	92	Very high	73 Å²	73	30.2 Å²	30.2	28%	0.275	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	143.4	-175	-164.1	-175.3	-57.4	170.1	4	113.2	Y373 M388 I389 R481 F529	R371-Y373 WeakPolarHBondContact CD-OH 3.27Å; R371-Y373 HydrophobicContact CG-CE2 4.38Å; R371-M388 HydrophobicContact CG-CG 3.98Å; R371-M388 HydrophobicContact CG-SD 3.75Å; R371-I389 CarbonylContact C-O 3.43Å; R371-I389 WeakPolarHBondContact CA-O 3.26Å; R371-R481 WeakPolarHBondContact O-CD 3.12Å; R371-R481 PolarHBondContact O-NH1 3.34Å; R371-F529 PolarHBondContact NH2-O 2.84Å
372	W	96.6	Very high	91.4	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	146	-178.1	-72.6	103.7	0	0	0	111.2	F368 M388 I389 Y391 Y463 V466 L479 A480 R481	F368-W372 HydrophobicContact CD2-CZ2 4.17Å; F368-W372 PolarHBondContact O-NE1 2.83Å; W372-M388 CarbonylContact O-C 3.52Å; W372-M388 WeakPolarHBondContact O-CA 3.29Å; W372-M388 WeakPolarHBondContact O-CG 3.37Å; W372-I389 WeakPolarHBondContact CB-O 3.13Å; W372-I389 PolarHBondContact N-O 3.19Å; W372-I389 PolarHBondContact O-N 2.86Å; W372-Y391 AromaticContact CD1-CD2 3.39Å; W372-Y391 AromaticContact CD1-CE2 3.64Å; W372-Y391 HydrophobicContact CG-CD2 4.49Å; W372-Y391 HydrophobicContact CG-CE2 4.4Å; W372-Y391 AromaticContact NE1-CD2 3.66Å; W372-Y463 WeakPolarHBondContact CH2-O 3.41Å; W372-V466 HydrophobicContact CD2-CG2 4.48Å; W372-V466 HydrophobicContact CE3-CG2 4.31Å; W372-V466 HydrophobicContact CH2-CB 4.47Å; W372-V466 HydrophobicContact CH2-CG1 3.78Å; W372-V466 HydrophobicContact CH2-CG2 4.05Å; W372-V466 HydrophobicContact CZ2-CG1 4.05Å; W372-V466 HydrophobicContact CZ2-CG2 4.21Å; W372-V466 HydrophobicContact CZ3-CG2 4.12Å; W372-L479 HydrophobicContact CB-CB 4.05Å; W372-L479 HydrophobicContact CB-CD1 3.92Å; W372-L479 HydrophobicContact CD2-CB 4.12Å; W372-L479 HydrophobicContact CE3-CB 3.78Å; W372-L479 HydrophobicContact CG-CB 4.28Å; W372-L479 HydrophobicContact CG-CD1 4.14Å; W372-A480 VanDerWaalsContact CE3-C 3.5Å; W372-R481 HydrophobicContact CE3-CG 4.29Å; W372-R481 HydrophobicContact CH2-CG 4.16Å; W372-R481 VanDerWaalsContact CH2-NE 3.32Å; W372-R481 VanDerWaalsContact CZ2-NE 3.28Å; W372-R481 VanDerWaalsContact CZ2-NH2 3.29Å; W372-R481 HydrophobicContact CZ3-CG 3.83Å
373	Y	95.4	Very high	90.6	Very high	34 Å²	34	23.3 Å²	23.3	13%	0.133	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132.5	174.6	-63.6	-87.4	0	0	0	109.7	R371 V375 M388 L479 A480 R481 P483 Y519 F524	R371-Y373 WeakPolarHBondContact CD-OH 3.27Å; R371-Y373 HydrophobicContact CG-CE2 4.38Å; Y373-V375 PolarHBondContact O-N 2.87Å; Y373-M388 HydrophobicContact CD1-CB 4.11Å; Y373-M388 HydrophobicContact CD1-CG 3.85Å; Y373-M388 HydrophobicContact CE1-CB 4.24Å; Y373-M388 HydrophobicContact CE1-CG 3.68Å; Y373-L479 CarbonylContact O-C 3.53Å; Y373-L479 VanDerWaalsContact O-CA 3.3Å; Y373-L479 WeakPolarHBondContact O-CA 3.48Å; Y373-A480 PolarHBondContact N-O 3.41Å; Y373-A480 PolarHBondContact O-N 3.07Å; Y373-R481 WeakPolarHBondContact CD2-O 3.24Å; Y373-R481 WeakPolarHBondContact CE2-O 3.33Å; Y373-P483 HydrophobicContact CD1-CG 4.48Å; Y373-P483 HydrophobicContact CD2-CG 4.18Å; Y373-P483 HydrophobicContact CG-CG 3.79Å; Y373-Y519 HydrophobicContact CD1-CE2 4.1Å; Y373-F524 HydrophobicContact CD1-CD2 4.17Å; Y373-F524 AromaticContact CD1-CE2 3.85Å; Y373-F524 HydrophobicContact CD1-CE2 3.85Å; Y373-F524 HydrophobicContact CD1-CZ 4.16Å; Y373-F524 AromaticContact CE1-CD2 3.97Å; Y373-F524 HydrophobicContact CE1-CD2 3.97Å; Y373-F524 HydrophobicContact CE1-CE2 4.14Å; Y373-F524 HydrophobicContact CE1-CG 4.33Å
374	Q	95.4	Very high	90	Very high	4 Å²	4	23.6 Å²	23.6	2%	0.019	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	123.2	175.2	-173.9	-171.7	68.7	0	0	110.2	Y377 G384 S387 H477 L479 V517	Q374-Y377 VanDerWaalsContact CD-CB 3.46Å; Q374-G384 PolarHBondContact OE1-O 2.97Å; Q374-S387 WeakPolarHBondContact CB-O 3.38Å; Q374-S387 PolarHBondContact N-O 3.09Å; Q374-H477 PolarHBondContact NE2-ND1 3.09Å; Q374-H477 VanDerWaalsContact NE2-ND1 3.11Å; Q374-L479 HydrophobicContact CB-CD2 3.99Å; Q374-L479 HydrophobicContact CG-CD2 4.34Å; Q374-V517 HydrophobicContact CG-CG2 4.1Å
375	V	95.8	Very high	89.7	Confident	11 Å²	11	21.7 Å²	21.7	7%	0.067	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	-21.8	179.7	-67.3	0	0	0	0	112.6	Y373 V478 A480 P483 Y486 P516 V517	Y373-V375 PolarHBondContact O-N 2.87Å; V375-V478 HydrophobicContact CG2-CB 3.9Å; V375-V478 HydrophobicContact CG2-CG1 3.68Å; V375-V478 VanDerWaalsContact CG2-O 3.27Å; V375-V478 WeakPolarHBondContact CG2-O 3.15Å; V375-V478 PolarHBondContact N-O 2.67Å; V375-A480 HydrophobicContact CG1-CB 3.79Å; V375-A480 HydrophobicContact CG2-CB 4.04Å; V375-P483 HydrophobicContact CG1-CB 3.83Å; V375-P483 HydrophobicContact CG1-CG 4.03Å; V375-Y486 HydrophobicContact CB-CD1 3.72Å; V375-Y486 HydrophobicContact CB-CE1 3.77Å; V375-Y486 HydrophobicContact CB-CG 4.36Å; V375-Y486 HydrophobicContact CG1-CD1 3.95Å; V375-Y486 HydrophobicContact CG1-CG 4.28Å; V375-Y486 HydrophobicContact CG2-CD1 3.62Å; V375-Y486 HydrophobicContact CG2-CD2 4.1Å; V375-Y486 HydrophobicContact CG2-CE1 3.46Å; V375-Y486 VanDerWaalsContact CG2-CE1 3.46Å; V375-Y486 HydrophobicContact CG2-CE2 3.95Å; V375-Y486 HydrophobicContact CG2-CG 3.95Å; V375-P516 CarbonylContact O-C 3.55Å; V375-P516 WeakPolarHBondContact O-CA 3.39Å; V375-V517 PolarHBondContact O-N 3.47Å
376	V	94.4	Very high	89.6	Confident	4 Å²	4	21.7 Å²	21.7	2%	0.024	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	143.5	170.6	-178.2	0	0	0	0	107.8	L476 H477 V478 V514 A515	V376-L476 HydrophobicContact CG1-CD2 4.27Å; V376-H477 WeakPolarHBondContact O-CA 3.33Å; V376-V478 HydrophobicContact CB-CB 3.7Å; V376-V478 HydrophobicContact CB-CG2 3.66Å; V376-V478 HydrophobicContact CG1-CG2 4.27Å; V376-V478 HydrophobicContact CG2-CB 3.96Å; V376-V478 HydrophobicContact CG2-CG2 3.97Å; V376-V478 PolarHBondContact N-O 2.87Å; V376-V478 PolarHBondContact O-N 3.3Å; V376-V514 HydrophobicContact CG1-CG1 3.28Å; V376-A515 WeakPolarHBondContact CA-O 3.5Å; V376-A515 WeakPolarHBondContact CG1-O 3.4Å
377	Y	92.7	Very high	89.5	Confident	34 Å²	34	18.8 Å²	18.8	13%	0.133	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	174.2	-179.2	76.6	-59.8	0	0	0	111.4	Q374 P379 P385 L476 V514 A515 V517	Q374-Y377 VanDerWaalsContact CD-CB 3.46Å; Y377-P379 HydrophobicContact CD2-CG 4.38Å; Y377-P379 HydrophobicContact CE1-CG 3.97Å; Y377-P379 VanDerWaalsContact CE2-CA 3.46Å; Y377-P379 HydrophobicContact CE2-CB 3.77Å; Y377-P379 HydrophobicContact CE2-CG 3.82Å; Y377-P379 VanDerWaalsContact O-CD 3.31Å; Y377-P379 WeakPolarHBondContact O-CD 3.1Å; Y377-P385 HydrophobicContact CE1-CB 4.04Å; Y377-P385 HydrophobicContact CE2-CB 4.07Å; Y377-L476 CarbonylContact C-O 3.54Å; Y377-L476 VanDerWaalsContact CA-O 3.29Å; Y377-L476 WeakPolarHBondContact CA-O 3.32Å; Y377-V514 WeakPolarHBondContact O-CA 3.47Å; Y377-A515 WeakPolarHBondContact CD1-O 3.48Å; Y377-A515 HydrophobicContact CE1-CB 4.09Å; Y377-A515 PolarHBondContact N-O 3.19Å; Y377-A515 PolarHBondContact O-N 3.22Å; Y377-V517 HydrophobicContact CD1-CG2 3.59Å; Y377-V517 HydrophobicContact CE1-CG2 4.03Å; Y377-V517 HydrophobicContact CG-CG2 4.37Å
378	S	89.1	Confident	89.3	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.106	C	C	.	.			trans	-107.2	90.2	173.6	-70.9	0	0	0	0	111	P380 L381 S382 L476 L513	S378-P380 VanDerWaalsContact C-CD 3.43Å; S378-L381 CarbonylContact O-C 3.6Å; S378-L381 PolarHBondContact O-N 3.5Å; S378-S382 PolarHBondContact N-OG 3Å; S378-S382 WeakPolarHBondContact O-CB 2.89Å; S378-S382 PolarHBondContact O-N 2.9Å; S378-S382 PolarHBondContact O-OG 3.33Å; S378-L476 PolarHBondContact N-O 2.6Å; S378-L476 PolarHBondContact OG-N 2.74Å; S378-L476 PolarHBondContact OG-O 3.22Å; S378-L513 WeakPolarHBondContact CA-O 3.17Å; S378-L513 WeakPolarHBondContact CB-O 3.32Å; S378-L513 PolarHBondContact OG-O 3.16Å
379	P	83.3	Confident	89.2	Confident	38 Å²	38	19.1 Å²	19.1	25%	0.247	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-48.9	-45.8	-171.5	-20.2	23.9	0	0	0	116.2	Y377 L381 A515	Y377-P379 HydrophobicContact CD2-CG 4.38Å; Y377-P379 HydrophobicContact CE1-CG 3.97Å; Y377-P379 VanDerWaalsContact CE2-CA 3.46Å; Y377-P379 HydrophobicContact CE2-CB 3.77Å; Y377-P379 HydrophobicContact CE2-CG 3.82Å; Y377-P379 VanDerWaalsContact O-CD 3.31Å; Y377-P379 WeakPolarHBondContact O-CD 3.1Å; P379-L381 PolarHBondContact O-N 2.9Å; P379-A515 HydrophobicContact CG-CB 3.63Å
380	P	73.9	Confident	89.2	Confident	22 Å²	22	18.5 Å²	18.5	14%	0.143	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-73.2	-9.6	-178.6	26.3	-30.4	0	0	0	113.7	L338 S378 L513	L338-P380 HydrophobicContact CD1-CB 3.44Å; L338-P380 VanDerWaalsContact CD1-CB 3.44Å; S378-P380 VanDerWaalsContact C-CD 3.43Å; P380-L513 HydrophobicContact CG-CD2 3.55Å
381	L	77.7	Confident	89.2	Confident	24 Å²	24	18.3 Å²	18.3	13%	0.126	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-125.9	8.5	-172.4	-61.9	170.1	0	0	0	112.6	E342 L345 L346 S378 P379 Y474 P475	E342-L381 HydrophobicContact CB-CD2 3.97Å; E342-L381 HydrophobicContact CG-CD2 3.6Å; L345-L381 HydrophobicContact CD1-CD1 3.87Å; L346-L381 HydrophobicContact CD1-CD2 4.29Å; S378-L381 CarbonylContact O-C 3.6Å; S378-L381 PolarHBondContact O-N 3.5Å; P379-L381 PolarHBondContact O-N 2.9Å; L381-Y474 VanDerWaalsContact CD1-CB 3.44Å; L381-Y474 HydrophobicContact CD1-CG 4.27Å; L381-P475 HydrophobicContact CB-CB 3.91Å
382	S	79.7	Confident	89.2	Confident	25 Å²	25	21.4 Å²	21.4	18%	0.175	12%	0.116	C	C	.	.	S	Bend	trans	-122.8	154.9	-174.5	-58.3	0	0	0	0	111.1	S378 G384 H477	S378-S382 PolarHBondContact N-OG 3Å; S378-S382 WeakPolarHBondContact O-CB 2.89Å; S378-S382 PolarHBondContact O-N 2.9Å; S378-S382 PolarHBondContact O-OG 3.33Å; S382-G384 PolarHBondContact O-N 2.68Å; S382-H477 PolarHBondContact OG-CE1 3.39Å
383	S	74.8	Confident	88.9	Confident	39 Å²	39	24.4 Å²	24.4	27%	0.273	13%	0.129	S	C	.	.	S	Bend	trans	-65.7	-17	-178.9	57.8	0	0	0	0	114.6	R422	S383-R422 PolarHBondContact O-NH1 3.21Å; S383-R422 VanDerWaalsContact O-NH1 3.1Å
384	G	82.6	Confident	88.7	Confident	14 Å²	14	27.8 Å²	27.8	14%	0.144	15%	0.149	C	C	.	.			trans	154.6	172.6	179.3	0	0	0	0	0	111.4	Q374 S382	Q374-G384 PolarHBondContact OE1-O 2.97Å; S382-G384 PolarHBondContact O-N 2.68Å
385	P	88.4	Confident	88.4	Confident	18 Å²	18	29.6 Å²	29.6	12%	0.117	16%	0.164	C	C	.	.	S	Bend	trans	-74.4	-174.9	166.2	30.9	-30.5	0	0	0	111.1	Y377 S387 T412 T413 T415	Y377-P385 HydrophobicContact CE1-CB 4.04Å; Y377-P385 HydrophobicContact CE2-CB 4.07Å; P385-S387 VanDerWaalsContact C-N 3.31Å; P385-S387 PolarHBondContact O-N 3.16Å; P385-T412 WeakPolarHBondContact O-CG2 3.15Å; P385-T413 CarbonylContact C-O 3.45Å; P385-T415 HydrophobicContact CB-CG2 4.44Å; P385-T415 HydrophobicContact CG-CG2 3.76Å
386	C	91.5	Very high	88.2	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.007	18%	0.18	C	C	.	.	S	Bend	trans	51.5	46.4	170	-59.9	0	0	0	0	114	T413 C522 F524	C386-T413 HydrophobicContact CB-CG2 3.45Å; C386-T413 VanDerWaalsContact CB-CG2 3.45Å; C386-T413 PolarHBondContact O-N 2.75Å; C386-C522 VanDerWaalsContact CA-SG 3.53Å; C386-C522 HydrophobicContact CB-CB 3.67Å; C386-C522 WeakPolarHBondContact CB-SG 3.38Å; C386-C522 WeakPolarHBondContact SG-CA 3.43Å; C386-C522 WeakPolarHBondContact SG-CB 3.46Å; C386-C522 CovalentContact SG-SG 2.04Å; C386-C522 PolarHBondContact SG-SG 3.04Å; C386-F524 HydrophobicContact CB-CZ 4.23Å; C386-F524 WeakPolarHBondContact O-CE1 3.44Å; C386-F524 WeakPolarHBondContact O-CZ 3.32Å
387	S	92.6	Very high	87.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	135.2	172.4	179.4	0	0	0	0	111	Q374 P385 I389 E410 Y411	Q374-S387 WeakPolarHBondContact CB-O 3.38Å; Q374-S387 PolarHBondContact N-O 3.09Å; P385-S387 VanDerWaalsContact C-N 3.31Å; P385-S387 PolarHBondContact O-N 3.16Å; S387-I389 WeakPolarHBondContact OG-CG1 3.24Å; S387-E410 VanDerWaalsContact OG-CG 3.28Å; S387-E410 WeakPolarHBondContact OG-CG 3.17Å; S387-E410 PolarHBondContact OG-OE1 3.18Å; S387-Y411 CarbonylContact C-O 3.56Å; S387-Y411 WeakPolarHBondContact CA-O 3.39Å
388	M	92.8	Very high	87.4	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.015	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	129.3	166.7	-176.7	-115.1	-58.3	0	0	109.2	R371 W372 Y373 E410 Y411 F524 F529	R371-M388 HydrophobicContact CG-CG 3.98Å; R371-M388 HydrophobicContact CG-SD 3.75Å; W372-M388 CarbonylContact O-C 3.52Å; W372-M388 WeakPolarHBondContact O-CA 3.29Å; W372-M388 WeakPolarHBondContact O-CG 3.37Å; Y373-M388 HydrophobicContact CD1-CB 4.11Å; Y373-M388 HydrophobicContact CD1-CG 3.85Å; Y373-M388 HydrophobicContact CE1-CB 4.24Å; Y373-M388 HydrophobicContact CE1-CG 3.68Å; M388-E410 WeakPolarHBondContact O-CA 3.34Å; M388-Y411 PolarHBondContact N-O 3.1Å; M388-Y411 PolarHBondContact O-N 3.47Å; M388-F524 HydrophobicContact CB-CD1 3.66Å; M388-F524 HydrophobicContact CB-CE1 3.44Å; M388-F524 VanDerWaalsContact CB-CE1 3.44Å; M388-F524 HydrophobicContact CB-CG 4.5Å; M388-F524 HydrophobicContact CB-CZ 4.12Å; M388-F524 HydrophobicContact CE-CB 4.23Å; M388-F524 HydrophobicContact CE-CD1 4.01Å; M388-F524 HydrophobicContact CE-CG 4.33Å; M388-F529 HydrophobicContact CE-CD2 3.06Å; M388-F529 HydrophobicContact CE-CE2 3.08Å; M388-F529 HydrophobicContact CE-CG 3.84Å; M388-F529 HydrophobicContact CE-CZ 3.81Å; M388-F529 HydrophobicContact SD-CB 4.23Å; M388-F529 HydrophobicContact SD-CD1 3.72Å; M388-F529 HydrophobicContact SD-CD2 3.31Å; M388-F529 WeakPolarHBondContact SD-CD2 3.32Å; M388-F529 HydrophobicContact SD-CE1 3.59Å; M388-F529 VanDerWaalsContact SD-CE1 3.59Å; M388-F529 HydrophobicContact SD-CE2 3.28Å; M388-F529 WeakPolarHBondContact SD-CE2 3.09Å; M388-F529 HydrophobicContact SD-CG 3.49Å; M388-F529 WeakPolarHBondContact SD-CG 3.44Å; M388-F529 HydrophobicContact SD-CZ 3.35Å; M388-F529 WeakPolarHBondContact SD-CZ 3.04Å
389	I	93.6	Very high	87.3	Confident	12 Å²	12	44.9 Å²	44.9	6%	0.062	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	136.7	-169	-53.7	157.7	0	0	0	108.8	R371 W372 S387 Y391 F409 E410 L479	R371-I389 CarbonylContact C-O 3.43Å; R371-I389 WeakPolarHBondContact CA-O 3.26Å; W372-I389 WeakPolarHBondContact CB-O 3.13Å; W372-I389 PolarHBondContact N-O 3.19Å; W372-I389 PolarHBondContact O-N 2.86Å; S387-I389 WeakPolarHBondContact OG-CG1 3.24Å; I389-Y391 HydrophobicContact CG2-CD1 4.13Å; I389-Y391 HydrophobicContact CG2-CE1 3.48Å; I389-Y391 VanDerWaalsContact CG2-CE1 3.48Å; I389-Y391 HydrophobicContact CG2-CE2 3.97Å; I389-Y391 VanDerWaalsContact CG2-CZ 3.41Å; I389-F409 CarbonylContact C-O 3.45Å; I389-F409 VanDerWaalsContact CA-O 3.31Å; I389-F409 WeakPolarHBondContact CA-O 3.46Å; I389-E410 HydrophobicContact CG1-CB 4.13Å; I389-E410 HydrophobicContact CG1-CG 3.91Å; I389-L479 HydrophobicContact CD1-CD1 3.86Å; I389-L479 HydrophobicContact CD1-CD2 3.93Å
390	T	94.4	Very high	87.3	Confident	19 Å²	19	43.6 Å²	43.6	12%	0.117	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.2	172.1	-66.9	0	0	0	0	109.9	G370 T408 F409 F529	G370-T390 WeakPolarHBondContact O-CA 3.49Å; T390-T408 WeakPolarHBondContact O-CA 3.49Å; T390-F409 PolarHBondContact N-O 3.11Å; T390-F409 PolarHBondContact O-N 3.22Å; T390-F529 WeakPolarHBondContact OG1-CD1 3.48Å; T390-F529 WeakPolarHBondContact OG1-CE1 3.5Å
391	Y	94.7	Very high	88.1	Confident	9 Å²	9	46.9 Å²	46.9	4%	0.035	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120	174	-59.7	-56.1	0	0	0	110.2	F368 G370 W372 I389 F406 D407 T408 Y438 L479	F368-Y391 HydrophobicContact CD1-CD2 4.07Å; F368-Y391 HydrophobicContact CD1-CG 4.49Å; F368-Y391 HydrophobicContact CE1-CD1 4.44Å; F368-Y391 AromaticContact CE1-CD2 3.35Å; F368-Y391 HydrophobicContact CE1-CD2 3.35Å; F368-Y391 AromaticContact CE1-CE2 3.62Å; F368-Y391 HydrophobicContact CE1-CE2 3.62Å; F368-Y391 AromaticContact CE1-CG 3.81Å; F368-Y391 HydrophobicContact CE1-CG 3.81Å; F368-Y391 HydrophobicContact CE2-CD2 4.34Å; F368-Y391 HydrophobicContact CE2-CE2 4.11Å; F368-Y391 AromaticContact CZ-CD2 3.52Å; F368-Y391 HydrophobicContact CZ-CD2 3.52Å; F368-Y391 AromaticContact CZ-CE2 3.29Å; F368-Y391 HydrophobicContact CZ-CE2 3.29Å; F368-Y391 HydrophobicContact CZ-CG 4.36Å; F368-Y391 AromaticContact CZ-CZ 3.96Å; G370-Y391 PolarHBondContact N-O 3.05Å; G370-Y391 PolarHBondContact O-N 3.05Å; W372-Y391 AromaticContact CD1-CD2 3.39Å; W372-Y391 AromaticContact CD1-CE2 3.64Å; W372-Y391 HydrophobicContact CG-CD2 4.49Å; W372-Y391 HydrophobicContact CG-CE2 4.4Å; W372-Y391 AromaticContact NE1-CD2 3.66Å; I389-Y391 HydrophobicContact CG2-CD1 4.13Å; I389-Y391 HydrophobicContact CG2-CE1 3.48Å; I389-Y391 VanDerWaalsContact CG2-CE1 3.48Å; I389-Y391 HydrophobicContact CG2-CE2 3.97Å; I389-Y391 VanDerWaalsContact CG2-CZ 3.41Å; Y391-F406 AromaticContact CD1-CD2 3.76Å; Y391-F406 HydrophobicContact CD1-CD2 3.76Å; Y391-F406 AromaticContact CD1-CE2 3.67Å; Y391-F406 HydrophobicContact CD1-CE2 3.67Å; Y391-F406 HydrophobicContact CE1-CE2 4.13Å; Y391-F406 HydrophobicContact CG-CD2 4.2Å; Y391-F406 HydrophobicContact CG-CE2 4.26Å; Y391-D407 WeakPolarHBondContact CA-O 3.36Å; Y391-T408 VanDerWaalsContact CE1-OG1 3.32Å; Y391-T408 WeakPolarHBondContact CE1-OG1 3.08Å; Y391-Y438 HydrophobicContact CD1-CE1 4.29Å; Y391-Y438 AromaticContact CE1-CE1 3.56Å; Y391-Y438 HydrophobicContact CE1-CE1 3.56Å; Y391-Y438 AromaticContact CE1-CZ 3.94Å; Y391-Y438 WeakPolarHBondContact CE1-OH 3.19Å; Y391-L479 HydrophobicContact CE2-CD1 4.2Å
392	K	93.7	Very high	88.7	Confident	139 Å²	139	48.9 Å²	48.9	60%	0.604	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	117	179.9	-177.9	176.3	-178.3	172.4	0	110.1	I394 F406 D407	K392-I394 PolarHBondContact O-N 2.99Å; K392-F406 CarbonylContact O-C 3.53Å; K392-F406 WeakPolarHBondContact O-CA 3.06Å; K392-F406 WeakPolarHBondContact O-CB 3.4Å; K392-D407 HydrophobicContact CB-CB 4.45Å; K392-D407 PolarHBondContact N-O 2.78Å; K392-D407 PolarHBondContact O-N 2.9Å
393	K	91.6	Very high	89.1	Confident	63 Å²	63	49.1 Å²	49.1	27%	0.274	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	125.5	176.1	-170.8	171	65.3	172.9	0	109.8	D366 T369 D396 T404	D366-K393 WeakPolarHBondContact OD1-CE 3.47Å; D366-K393 IonicContact OD1-NZ 2.82Å; D366-K393 PolarHBondContact OD1-NZ 3.2Å; D366-K393 IonicContact OD2-NZ 2.81Å; D366-K393 PolarHBondContact OD2-NZ 2.92Å; T369-K393 HydrophobicContact CG2-CB 4.01Å; K393-D396 HydrophobicContact CD-CB 3.91Å; K393-D396 IonicContact NZ-OD2 2.7Å; K393-D396 PolarHBondContact NZ-OD2 3.04Å; K393-T404 HydrophobicContact CD-CG2 3.87Å; K393-T404 HydrophobicContact CG-CG2 4.04Å
394	I	91.2	Very high	89.8	Confident	105 Å²	105	47.3 Å²	47.3	54%	0.538	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	-24.1	179.9	58.1	171.6	0	0	0	112.6	K392 I405 D407	K392-I394 PolarHBondContact O-N 2.99Å; I394-I405 HydrophobicContact CD1-CB 4.43Å; I394-I405 HydrophobicContact CD1-CG2 3.75Å; I394-I405 HydrophobicContact CG1-CB 4.02Å; I394-I405 HydrophobicContact CG1-CG2 3.84Å; I394-I405 WeakPolarHBondContact CG1-O 3.33Å; I394-I405 PolarHBondContact N-O 2.55Å; I394-D407 HydrophobicContact CG2-CB 3.86Å
395	A	89.2	Confident	90.2	Very high	42 Å²	42	49.2 Å²	49.2	35%	0.347	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	127.9	172.2	0	0	0	0	0	109.5	T404 I405	A395-T404 CarbonylContact O-C 3.57Å; A395-T404 WeakPolarHBondContact O-CA 3.46Å; A395-T404 WeakPolarHBondContact O-CG2 3.38Å; A395-I405 HydrophobicContact CB-CB 4.14Å; A395-I405 HydrophobicContact CB-CD1 4.49Å; A395-I405 HydrophobicContact CB-CG1 4.29Å; A395-I405 PolarHBondContact N-O 2.83Å; A395-I405 VanDerWaalsContact N-O 3.08Å; A395-I405 PolarHBondContact O-N 2.84Å
396	D	90.6	Very high	90.3	Very high	74 Å²	74	48.4 Å²	48.4	40%	0.396	27%	0.274	S	S	.	.			trans	-107.3	122.3	-179.3	-171.1	-7.4	0	0	0	110.5	K393 K399 G400	K393-D396 HydrophobicContact CD-CB 3.91Å; K393-D396 IonicContact NZ-OD2 2.7Å; K393-D396 PolarHBondContact NZ-OD2 3.04Å; D396-K399 VanDerWaalsContact OD1-CA 3.23Å; D396-K399 WeakPolarHBondContact OD1-CA 3.01Å; D396-K399 PolarHBondContact OD1-N 3.45Å; D396-G400 PolarHBondContact OD1-N 2.84Å
397	V	87	Confident	90.3	Very high	69 Å²	69	51.8 Å²	51.8	42%	0.418	29%	0.292	S	S	.	.	S	Bend	trans	-109.2	110.1	173.3	-179.7	0	0	0	0	107.8	K399 G400 N401 S402 T404	V397-K399 PolarHBondContact O-N 2.72Å; V397-G400 PolarHBondContact O-N 3.27Å; V397-N401 WeakPolarHBondContact O-CA 3.22Å; V397-N401 VanDerWaalsContact O-CB 3.26Å; V397-N401 WeakPolarHBondContact O-CB 3.46Å; V397-N401 PolarHBondContact O-N 3.33Å; V397-S402 WeakPolarHBondContact CG1-O 3.43Å; V397-T404 PolarHBondContact N-OG1 3.08Å; V397-T404 PolarHBondContact O-OG1 3.27Å
398	G	83.4	Confident	90.3	Very high	49 Å²	49	52 Å²	52	51%	0.505	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	36.9	171.7	0	0	0	0	0	114.9	N401	G398-N401 PolarHBondContact O-ND2 2.81Å
399	K	86.9	Confident	90.2	Very high	178 Å²	178	54.2 Å²	54.2	77%	0.774	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	65	54	-178.1	-51.4	-177.1	179.1	-177.1	0	112.6	D396 V397	D396-K399 VanDerWaalsContact OD1-CA 3.23Å; D396-K399 WeakPolarHBondContact OD1-CA 3.01Å; D396-K399 PolarHBondContact OD1-N 3.45Å; V397-K399 PolarHBondContact O-N 2.72Å
400	G	84.1	Confident	90.1	Very high	10 Å²	10	55 Å²	55	10%	0.103	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.2	12	177.9	0	0	0	0	0	115	V365 D396 V397 T404	V365-G400 VanDerWaalsContact CG2-O 3.25Å; V365-G400 WeakPolarHBondContact CG2-O 3.29Å; D396-G400 PolarHBondContact OD1-N 2.84Å; V397-G400 PolarHBondContact O-N 3.27Å; G400-T404 VanDerWaalsContact CA-OG1 3.3Å; G400-T404 WeakPolarHBondContact CA-OG1 3.48Å
401	N	89	Confident	89.9	Confident	91 Å²	91	55.4 Å²	55.4	49%	0.487	31%	0.306	S	S	.	.			trans	-72.4	175.5	175.5	-76.9	-43.3	0	0	0	112.2	V397 G398 G403 T404	V397-N401 WeakPolarHBondContact O-CA 3.22Å; V397-N401 VanDerWaalsContact O-CB 3.26Å; V397-N401 WeakPolarHBondContact O-CB 3.46Å; V397-N401 PolarHBondContact O-N 3.33Å; G398-N401 PolarHBondContact O-ND2 2.81Å; N401-G403 PolarHBondContact O-N 3.48Å; N401-T404 PolarHBondContact N-OG1 2.83Å; N401-T404 VanDerWaalsContact O-CB 3.31Å; N401-T404 WeakPolarHBondContact O-CB 3.39Å; N401-T404 PolarHBondContact O-N 3.48Å; N401-T404 PolarHBondContact O-OG1 3Å
402	S	90.6	Very high	89.7	Confident	66 Å²	66	55.2 Å²	55.2	46%	0.462	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.1	125.6	176	-60	0	0	0	0	112	V397 V430 K431 G432	V397-S402 WeakPolarHBondContact CG1-O 3.43Å; S402-V430 CarbonylContact C-O 3.4Å; S402-V430 VanDerWaalsContact CA-O 3.31Å; S402-V430 WeakPolarHBondContact CA-O 3.21Å; S402-K431 WeakPolarHBondContact CB-O 3.47Å; S402-K431 VanDerWaalsContact OG-C 3.3Å; S402-K431 PolarHBondContact OG-O 2.86Å; S402-G432 WeakPolarHBondContact OG-CA 3.48Å
403	G	88.2	Confident	89.3	Confident	31 Å²	31	49.4 Å²	49.4	32%	0.32	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.3	-15	-175.3	0	0	0	0	0	114.2	N401 I405 V430	N401-G403 PolarHBondContact O-N 3.48Å; G403-I405 VanDerWaalsContact O-CG1 3.32Å; G403-I405 WeakPolarHBondContact O-CG1 3.2Å; G403-I405 PolarHBondContact O-N 3.11Å; G403-V430 PolarHBondContact N-O 2.98Å
404	T	89	Confident	88.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.279	C	S	.	.			trans	-57.5	133.1	172.1	-64.1	0	0	0	0	110.2	V365 K393 A395 V397 G400 N401 V429 V430	V365-T404 HydrophobicContact CG1-CG2 4.02Å; K393-T404 HydrophobicContact CD-CG2 3.87Å; K393-T404 HydrophobicContact CG-CG2 4.04Å; A395-T404 CarbonylContact O-C 3.57Å; A395-T404 WeakPolarHBondContact O-CA 3.46Å; A395-T404 WeakPolarHBondContact O-CG2 3.38Å; V397-T404 PolarHBondContact N-OG1 3.08Å; V397-T404 PolarHBondContact O-OG1 3.27Å; G400-T404 VanDerWaalsContact CA-OG1 3.3Å; G400-T404 WeakPolarHBondContact CA-OG1 3.48Å; N401-T404 PolarHBondContact N-OG1 2.83Å; N401-T404 VanDerWaalsContact O-CB 3.31Å; N401-T404 WeakPolarHBondContact O-CB 3.39Å; N401-T404 PolarHBondContact O-N 3.48Å; N401-T404 PolarHBondContact O-OG1 3Å; T404-V429 WeakPolarHBondContact O-CA 3.25Å; T404-V430 HydrophobicContact CG2-CG2 4.24Å; T404-V430 PolarHBondContact O-N 2.82Å
405	I	91.6	Very high	87.4	Confident	55 Å²	55	45.6 Å²	45.6	28%	0.282	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.7	-176.9	-46.9	-178.6	0	0	0	109.2	I394 A395 G403 Y427 G428 V429	I394-I405 HydrophobicContact CD1-CB 4.43Å; I394-I405 HydrophobicContact CD1-CG2 3.75Å; I394-I405 HydrophobicContact CG1-CB 4.02Å; I394-I405 HydrophobicContact CG1-CG2 3.84Å; I394-I405 WeakPolarHBondContact CG1-O 3.33Å; I394-I405 PolarHBondContact N-O 2.55Å; A395-I405 HydrophobicContact CB-CB 4.14Å; A395-I405 HydrophobicContact CB-CD1 4.49Å; A395-I405 HydrophobicContact CB-CG1 4.29Å; A395-I405 PolarHBondContact N-O 2.83Å; A395-I405 VanDerWaalsContact N-O 3.08Å; A395-I405 PolarHBondContact O-N 2.84Å; G403-I405 VanDerWaalsContact O-CG1 3.32Å; G403-I405 WeakPolarHBondContact O-CG1 3.2Å; G403-I405 PolarHBondContact O-N 3.11Å; I405-Y427 HydrophobicContact CG2-CD2 4.45Å; I405-G428 WeakPolarHBondContact CA-O 3.41Å; I405-G428 WeakPolarHBondContact CG2-O 3.48Å; I405-V429 HydrophobicContact CG1-CG2 4.32Å; I405-V429 HydrophobicContact CG2-CG2 4.44Å
406	F	91.8	Very high	86.5	Confident	1 Å²	1	48.7 Å²	48.7	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	142.3	172.3	55	-88.4	0	0	0	110.6	F368 Y391 K392 Y427 G428 V430 L436 Y438	F368-F406 HydrophobicContact CE1-CE2 4.43Å; F368-F406 HydrophobicContact CE1-CZ 4.41Å; Y391-F406 AromaticContact CD1-CD2 3.76Å; Y391-F406 HydrophobicContact CD1-CD2 3.76Å; Y391-F406 AromaticContact CD1-CE2 3.67Å; Y391-F406 HydrophobicContact CD1-CE2 3.67Å; Y391-F406 HydrophobicContact CE1-CE2 4.13Å; Y391-F406 HydrophobicContact CG-CD2 4.2Å; Y391-F406 HydrophobicContact CG-CE2 4.26Å; K392-F406 CarbonylContact O-C 3.53Å; K392-F406 WeakPolarHBondContact O-CA 3.06Å; K392-F406 WeakPolarHBondContact O-CB 3.4Å; F406-Y427 CarbonylContact O-C 3.54Å; F406-Y427 WeakPolarHBondContact O-CA 3.5Å; F406-G428 PolarHBondContact N-O 2.87Å; F406-G428 PolarHBondContact O-N 3.09Å; F406-V430 HydrophobicContact CD1-CG2 4.44Å; F406-V430 HydrophobicContact CE1-CG2 4.12Å; F406-L436 HydrophobicContact CE1-CD2 4.1Å; F406-L436 HydrophobicContact CZ-CD1 4.11Å; F406-L436 HydrophobicContact CZ-CD2 4.33Å; F406-Y438 HydrophobicContact CE2-CD1 4.38Å; F406-Y438 AromaticContact CE2-CE1 3.45Å; F406-Y438 HydrophobicContact CE2-CE1 3.45Å; F406-Y438 VanDerWaalsContact CE2-CE1 3.45Å; F406-Y438 AromaticContact CE2-CZ 3.64Å; F406-Y438 WeakPolarHBondContact CE2-OH 3.32Å; F406-Y438 AromaticContact CZ-CE1 3.88Å; F406-Y438 HydrophobicContact CZ-CE1 3.88Å; F406-Y438 HydrophobicContact CZ-CE2 4.36Å; F406-Y438 AromaticContact CZ-CZ 3.66Å; F406-Y438 WeakPolarHBondContact CZ-OH 3.49Å
407	D	91.2	Very high	85.3	Confident	72 Å²	72	51.5 Å²	51.5	39%	0.385	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	145.3	168.9	-170.7	10.2	0	0	0	109.2	Y391 K392 I394	Y391-D407 WeakPolarHBondContact CA-O 3.36Å; K392-D407 HydrophobicContact CB-CB 4.45Å; K392-D407 PolarHBondContact N-O 2.78Å; K392-D407 PolarHBondContact O-N 2.9Å; I394-D407 HydrophobicContact CG2-CB 3.86Å
408	T	92.2	Very high	84.5	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.031	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	130.4	176.4	178.3	0	0	0	0	110.1	T390 Y391 S425 G426 Y438 T440	T390-T408 WeakPolarHBondContact O-CA 3.49Å; Y391-T408 VanDerWaalsContact CE1-OG1 3.32Å; Y391-T408 WeakPolarHBondContact CE1-OG1 3.08Å; T408-S425 CarbonylContact O-C 3.59Å; T408-S425 VanDerWaalsContact O-CA 3.29Å; T408-S425 WeakPolarHBondContact O-CA 3.22Å; T408-G426 WeakPolarHBondContact CG2-O 3.38Å; T408-G426 PolarHBondContact N-O 3.05Å; T408-G426 PolarHBondContact O-N 3.45Å; T408-Y438 HydrophobicContact CG2-CD1 4.17Å; T408-Y438 HydrophobicContact CG2-CE1 4.42Å; T408-T440 HydrophobicContact CG2-CG2 3.86Å
409	F	90.8	Very high	83.9	Confident	49 Å²	49	53.3 Å²	53.3	22%	0.215	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	124.9	171.2	-175.4	-79.6	0	0	0	109.1	I389 T390 I423 L528 F529	I389-F409 CarbonylContact C-O 3.45Å; I389-F409 VanDerWaalsContact CA-O 3.31Å; I389-F409 WeakPolarHBondContact CA-O 3.46Å; T390-F409 PolarHBondContact N-O 3.11Å; T390-F409 PolarHBondContact O-N 3.22Å; F409-I423 HydrophobicContact CD2-CG2 4.38Å; F409-I423 HydrophobicContact CE1-CG2 4.18Å; F409-I423 HydrophobicContact CE2-CG2 3.54Å; F409-I423 HydrophobicContact CZ-CG2 3.45Å; F409-I423 VanDerWaalsContact CZ-CG2 3.45Å; F409-L528 HydrophobicContact CE1-CD2 4.47Å; F409-L528 HydrophobicContact CZ-CD2 4.17Å; F409-F529 HydrophobicContact CB-CE1 4.44Å; F409-F529 HydrophobicContact CD1-CD1 4.21Å; F409-F529 AromaticContact CD1-CE1 3.22Å; F409-F529 HydrophobicContact CD1-CE1 3.22Å; F409-F529 HydrophobicContact CD1-CE2 4.23Å; F409-F529 AromaticContact CD1-CZ 3.24Å; F409-F529 HydrophobicContact CD1-CZ 3.24Å; F409-F529 AromaticContact CE1-CE1 3.74Å; F409-F529 HydrophobicContact CE1-CE1 3.74Å; F409-F529 AromaticContact CE1-CE2 3.91Å; F409-F529 HydrophobicContact CE1-CE2 3.91Å; F409-F529 AromaticContact CE1-CZ 3.34Å; F409-F529 HydrophobicContact CE1-CZ 3.34Å; F409-F529 HydrophobicContact CG-CE1 4.22Å
410	E	91.3	Very high	83.6	Confident	29 Å²	29	53.7 Å²	53.7	14%	0.136	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.3	-179.5	176.9	177.8	-163	0	0	109.9	S387 M388 I389 T412 I423 A424	S387-E410 VanDerWaalsContact OG-CG 3.28Å; S387-E410 WeakPolarHBondContact OG-CG 3.17Å; S387-E410 PolarHBondContact OG-OE1 3.18Å; M388-E410 WeakPolarHBondContact O-CA 3.34Å; I389-E410 HydrophobicContact CG1-CB 4.13Å; I389-E410 HydrophobicContact CG1-CG 3.91Å; E410-T412 WeakPolarHBondContact CG-OG1 3.42Å; E410-T412 PolarHBondContact OE1-OG1 2.86Å; E410-I423 WeakPolarHBondContact O-CA 3.2Å; E410-A424 HydrophobicContact CB-CB 4.32Å; E410-A424 PolarHBondContact N-O 3.19Å; E410-A424 PolarHBondContact O-N 2.63Å
411	Y	89.8	Confident	83.6	Confident	27 Å²	27	55.9 Å²	55.9	11%	0.106	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	118.7	168.1	179.1	-84.7	0	0	0	109	S387 M388 P421 I423 F524 P525 L528	S387-Y411 CarbonylContact C-O 3.56Å; S387-Y411 WeakPolarHBondContact CA-O 3.39Å; M388-Y411 PolarHBondContact N-O 3.1Å; M388-Y411 PolarHBondContact O-N 3.47Å; Y411-P421 HydrophobicContact CD2-CB 4.37Å; Y411-P421 HydrophobicContact CE1-CB 4.25Å; Y411-P421 HydrophobicContact CE2-CB 3.5Å; Y411-P421 VanDerWaalsContact CE2-CB 3.5Å; Y411-P421 HydrophobicContact CE2-CG 4.1Å; Y411-P421 VanDerWaalsContact CZ-CB 3.43Å; Y411-P421 WeakPolarHBondContact OH-CB 3.49Å; Y411-I423 HydrophobicContact CD2-CD1 4.46Å; Y411-I423 HydrophobicContact CD2-CG1 4.04Å; Y411-F524 HydrophobicContact CD1-CD1 4.07Å; Y411-F524 HydrophobicContact CD1-CE1 4.43Å; Y411-F524 HydrophobicContact CE1-CD1 4.41Å; Y411-P525 HydrophobicContact CD1-CG 4.49Å; Y411-P525 HydrophobicContact CD2-CG 4.32Å; Y411-P525 HydrophobicContact CE1-CG 4.08Å; Y411-P525 HydrophobicContact CE2-CG 3.89Å; Y411-L528 HydrophobicContact CD2-CD1 4.02Å; Y411-L528 HydrophobicContact CE2-CD1 3.91Å
412	T	90	Very high	83.5	Confident	5 Å²	5	58.3 Å²	58.3	3%	0.031	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.2	-178	-47.4	0	0	0	0	109.7	P385 E410 P421 R422	P385-T412 WeakPolarHBondContact O-CG2 3.15Å; E410-T412 WeakPolarHBondContact CG-OG1 3.42Å; E410-T412 PolarHBondContact OE1-OG1 2.86Å; T412-P421 WeakPolarHBondContact O-CA 3.15Å; T412-R422 PolarHBondContact N-O 3.12Å; T412-R422 PolarHBondContact O-N 3.19Å
413	T	85.1	Confident	83.3	Confident	16 Å²	16	59.7 Å²	59.7	10%	0.098	33%	0.331	C	S	.	.			trans	-117	151	173.5	-179.3	0	0	0	0	110.4	P385 C386 S419	P385-T413 CarbonylContact C-O 3.45Å; C386-T413 HydrophobicContact CB-CG2 3.45Å; C386-T413 VanDerWaalsContact CB-CG2 3.45Å; C386-T413 PolarHBondContact O-N 2.75Å; T413-S419 PolarHBondContact OG1-OG 2.77Å
414	G	74.7	Confident	83.2	Confident	22 Å²	22	58.4 Å²	58.4	23%	0.227	32%	0.318	C	S	.	.			trans	-70.4	171.6	165.1	0	0	0	0	0	111.1	N416 S419	G414-N416 PolarHBondContact O-N 2.68Å; G414-S419 WeakPolarHBondContact CA-OG 3.3Å; G414-S419 PolarHBondContact N-OG 2.96Å
415	T	68.1	Low	83.2	Confident	66 Å²	66	60.5 Å²	60.5	41%	0.405	33%	0.332	S	S	.	.	S	Bend	trans	-69.4	-15.1	170.6	48	0	0	0	0	113	P385 L521	P385-T415 HydrophobicContact CB-CG2 4.44Å; P385-T415 HydrophobicContact CG-CG2 3.76Å; T415-L521 HydrophobicContact CG2-CD1 4.34Å
416	N	70.8	Confident	83.2	Confident	107 Å²	107	58.7 Å²	58.7	57%	0.572	33%	0.327	S	S	*	.	S	Bend	trans	-93.9	130.4	-179.5	-68	9.2	0	0	0	109.6	G414 S418 S419	G414-N416 PolarHBondContact O-N 2.68Å; N416-S418 PolarHBondContact O-N 2.84Å; N416-S419 VanDerWaalsContact O-CB 3.3Å; N416-S419 WeakPolarHBondContact O-CB 3.33Å; N416-S419 PolarHBondContact O-N 2.95Å; N416-S419 PolarHBondContact O-OG 3.32Å
417	P	66.2	Low	83.2	Confident	133 Å²	133	62.9 Å²	62.9	86%	0.864	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-25.4	179.6	-26.2	33.6	0	0	0	114.3
418	S	68.9	Low	83.2	Confident	120 Å²	120	59.4 Å²	59.4	84%	0.839	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-4.8	178.3	-48.3	0	0	0	0	114	N416 K420	N416-S418 PolarHBondContact O-N 2.84Å; S418-K420 PolarHBondContact O-N 2.77Å
419	S	71.9	Confident	83.3	Confident	36 Å²	36	61 Å²	61	25%	0.252	34%	0.335	S	S	.	.	S	Bend	trans	-68.4	128.2	179.4	65.2	0	0	0	0	110	T413 G414 N416 P421	T413-S419 PolarHBondContact OG1-OG 2.77Å; G414-S419 WeakPolarHBondContact CA-OG 3.3Å; G414-S419 PolarHBondContact N-OG 2.96Å; N416-S419 VanDerWaalsContact O-CB 3.3Å; N416-S419 WeakPolarHBondContact O-CB 3.33Å; N416-S419 PolarHBondContact O-N 2.95Å; N416-S419 PolarHBondContact O-OG 3.32Å; S419-P421 WeakPolarHBondContact O-CD 3.3Å
420	K	81.4	Confident	83.4	Confident	187 Å²	187	58.8 Å²	58.8	81%	0.813	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-66	124.9	177	-175.4	177.9	178.4	179.2	0	108.3	S418	S418-K420 PolarHBondContact O-N 2.77Å
421	P	84.1	Confident	83.5	Confident	55 Å²	55	62.9 Å²	62.9	36%	0.357	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-63.7	144.9	177.9	26.4	-34.1	0	0	0	110.5	Y411 T412 S419	Y411-P421 HydrophobicContact CD2-CB 4.37Å; Y411-P421 HydrophobicContact CE1-CB 4.25Å; Y411-P421 HydrophobicContact CE2-CB 3.5Å; Y411-P421 VanDerWaalsContact CE2-CB 3.5Å; Y411-P421 HydrophobicContact CE2-CG 4.1Å; Y411-P421 VanDerWaalsContact CZ-CB 3.43Å; Y411-P421 WeakPolarHBondContact OH-CB 3.49Å; T412-P421 WeakPolarHBondContact O-CA 3.15Å; S419-P421 WeakPolarHBondContact O-CD 3.3Å
422	R	86.3	Confident	83.6	Confident	142 Å²	142	62.4 Å²	62.4	54%	0.536	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	131.8	174.9	-57.3	-179.6	79.6	-174.7	5.4	107.7	S383 T412	S383-R422 PolarHBondContact O-NH1 3.21Å; S383-R422 VanDerWaalsContact O-NH1 3.1Å; T412-R422 PolarHBondContact N-O 3.12Å; T412-R422 PolarHBondContact O-N 3.19Å
423	I	85.9	Confident	83.6	Confident	95 Å²	95	66.6 Å²	66.6	49%	0.487	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	133	177	-60.4	174	0	0	0	107.2	F409 E410 Y411	F409-I423 HydrophobicContact CD2-CG2 4.38Å; F409-I423 HydrophobicContact CE1-CG2 4.18Å; F409-I423 HydrophobicContact CE2-CG2 3.54Å; F409-I423 HydrophobicContact CZ-CG2 3.45Å; F409-I423 VanDerWaalsContact CZ-CG2 3.45Å; E410-I423 WeakPolarHBondContact O-CA 3.2Å; Y411-I423 HydrophobicContact CD2-CD1 4.46Å; Y411-I423 HydrophobicContact CD2-CG1 4.04Å
424	A	86.7	Confident	84	Confident	4 Å²	4	65.8 Å²	65.8	3%	0.033	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	121.8	171.8	0	0	0	0	0	109.7	E410 S441 N442	E410-A424 HydrophobicContact CB-CB 4.32Å; E410-A424 PolarHBondContact N-O 3.19Å; E410-A424 PolarHBondContact O-N 2.63Å; A424-S441 WeakPolarHBondContact CA-OG 3.28Å; A424-N442 HydrophobicContact CB-CB 4.08Å; A424-N442 WeakPolarHBondContact CB-ND2 3.24Å
425	S	88.8	Confident	85	Confident	44 Å²	44	67 Å²	67	31%	0.308	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	157.4	168.1	59.3	0	0	0	0	111	T408 T440 S441	T408-S425 CarbonylContact O-C 3.59Å; T408-S425 VanDerWaalsContact O-CA 3.29Å; T408-S425 WeakPolarHBondContact O-CA 3.22Å; S425-T440 CarbonylContact O-C 3.56Å; S425-T440 WeakPolarHBondContact O-CA 3.45Å; S425-S441 PolarHBondContact N-OG 3.08Å; S425-S441 PolarHBondContact O-N 3.28Å; S425-S441 PolarHBondContact O-OG 2.69Å
426	G	90.4	Very high	86.2	Confident	17 Å²	17	64 Å²	64	18%	0.175	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.2	-162.5	-179.5	0	0	0	0	0	112.7	T408 R439	T408-G426 WeakPolarHBondContact CG2-O 3.38Å; T408-G426 PolarHBondContact N-O 3.05Å; T408-G426 PolarHBondContact O-N 3.45Å; G426-R439 CarbonylContact C-O 3.5Å; G426-R439 WeakPolarHBondContact CA-O 3.34Å
427	Y	92.1	Very high	87.3	Confident	89 Å²	89	60.8 Å²	60.8	35%	0.349	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	155.9	173.4	65.3	-88.5	0	0	0	111.2	I405 F406 V429 Y438 R439	I405-Y427 HydrophobicContact CG2-CD2 4.45Å; F406-Y427 CarbonylContact O-C 3.54Å; F406-Y427 WeakPolarHBondContact O-CA 3.5Å; Y427-V429 HydrophobicContact CD2-CG2 3.91Å; Y427-V429 HydrophobicContact CE2-CG2 3.98Å; Y427-Y438 WeakPolarHBondContact O-CA 3.38Å; Y427-R439 HydrophobicContact CE1-CB 3.99Å; Y427-R439 HydrophobicContact CE1-CG 4.3Å; Y427-R439 HydrophobicContact CE2-CB 4.41Å; Y427-R439 PolarHBondContact N-O 2.79Å; Y427-R439 PolarHBondContact O-N 3.1Å; Y427-R439 PolarHBondContact OH-NH1 2.97Å
428	G	92.2	Very high	88.5	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	145.1	171.1	0	0	0	0	0	111.2	I405 F406 I437	I405-G428 WeakPolarHBondContact CA-O 3.41Å; I405-G428 WeakPolarHBondContact CG2-O 3.48Å; F406-G428 PolarHBondContact N-O 2.87Å; F406-G428 PolarHBondContact O-N 3.09Å; G428-I437 CarbonylContact C-O 3.03Å; G428-I437 WeakPolarHBondContact CA-O 3.21Å
429	V	93	Very high	89.4	Confident	37 Å²	37	54.1 Å²	54.1	22%	0.224	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	132.1	176.5	-174.3	0	0	0	0	109.5	T404 I405 Y427 K431 L436 I437	T404-V429 WeakPolarHBondContact O-CA 3.25Å; I405-V429 HydrophobicContact CG1-CG2 4.32Å; I405-V429 HydrophobicContact CG2-CG2 4.44Å; Y427-V429 HydrophobicContact CD2-CG2 3.91Å; Y427-V429 HydrophobicContact CE2-CG2 3.98Å; V429-K431 PolarHBondContact O-N 3.39Å; V429-L436 CarbonylContact O-C 3.51Å; V429-L436 WeakPolarHBondContact O-CA 3.43Å; V429-I437 PolarHBondContact N-O 3.46Å; V429-I437 PolarHBondContact O-N 2.81Å
430	V	94.1	Very high	90.1	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.024	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	118.5	174.2	-178.3	0	0	0	0	108.4	V365 S402 G403 T404 F406 L436	V365-V430 HydrophobicContact CB-CG2 4.5Å; V365-V430 HydrophobicContact CG1-CG2 4.14Å; V365-V430 HydrophobicContact CG2-CB 4.44Å; V365-V430 HydrophobicContact CG2-CG1 4.14Å; V365-V430 HydrophobicContact CG2-CG2 3.5Å; V365-V430 VanDerWaalsContact CG2-CG2 3.5Å; S402-V430 CarbonylContact C-O 3.4Å; S402-V430 VanDerWaalsContact CA-O 3.31Å; S402-V430 WeakPolarHBondContact CA-O 3.21Å; G403-V430 PolarHBondContact N-O 2.98Å; T404-V430 HydrophobicContact CG2-CG2 4.24Å; T404-V430 PolarHBondContact O-N 2.82Å; F406-V430 HydrophobicContact CD1-CG2 4.44Å; F406-V430 HydrophobicContact CE1-CG2 4.12Å; V430-L436 HydrophobicContact CB-CD2 4.32Å; V430-L436 HydrophobicContact CG1-CD2 4.46Å; V430-L436 HydrophobicContact CG2-CD2 3.85Å
431	K	92.8	Very high	90.3	Very high	114 Å²	114	48.3 Å²	48.3	50%	0.496	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-33	176	-171.7	-179.2	-175.6	168.3	0	111.7	S402 V429 Q435 I437	S402-K431 WeakPolarHBondContact CB-O 3.47Å; S402-K431 VanDerWaalsContact OG-C 3.3Å; S402-K431 PolarHBondContact OG-O 2.86Å; V429-K431 PolarHBondContact O-N 3.39Å; K431-Q435 HydrophobicContact CB-CB 4.27Å; K431-Q435 PolarHBondContact N-O 2.82Å; K431-I437 HydrophobicContact CB-CD1 4.38Å; K431-I437 HydrophobicContact CB-CG1 4.32Å; K431-I437 HydrophobicContact CD-CD1 4.17Å
432	G	91.5	Very high	90	Very high	18 Å²	18	48.9 Å²	48.9	19%	0.186	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.6	-169.2	179.6	0	0	0	0	0	110.3	S402 G434 Q435	S402-G432 WeakPolarHBondContact OG-CA 3.48Å; G432-G434 PolarHBondContact O-N 2.85Å; G432-Q435 PolarHBondContact N-O 2.84Å; G432-Q435 PolarHBondContact O-N 3.13Å
433	Q	91.5	Very high	89.5	Confident	92 Å²	92	43.8 Å²	43.8	43%	0.43	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	113.4	-175.7	-64.1	-67.1	15.6	0	0	112.1	T359 V360 S361 F363 Q435	T359-Q433 WeakPolarHBondContact CB-O 3.45Å; T359-Q433 PolarHBondContact OG1-O 2.97Å; V360-Q433 CarbonylContact O-C 3.51Å; S361-Q433 VanDerWaalsContact O-CG 3.25Å; S361-Q433 WeakPolarHBondContact O-CG 3.47Å; S361-Q433 PolarHBondContact O-NE2 2.97Å; F363-Q433 PolarHBondContact O-OE1 3.06Å; F363-Q433 VanDerWaalsContact O-OE1 3.13Å; Q433-Q435 PolarHBondContact O-N 2.85Å
434	G	93	Very high	89	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.3	15.1	-176.9	0	0	0	0	0	115	G432 H450 I451	G432-G434 PolarHBondContact O-N 2.85Å; G434-H450 CarbonylContact O-C 3.45Å; G434-H450 WeakPolarHBondContact O-CA 3.4Å; G434-I451 PolarHBondContact O-N 2.74Å
435	Q	94.9	Very high	88.9	Confident	47 Å²	47	49.6 Å²	49.6	22%	0.22	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	118.7	-179.7	-70.1	177.9	56.1	0	0	110.5	T359 K431 G432 Q433	T359-Q435 HydrophobicContact CG2-CG 3.66Å; K431-Q435 HydrophobicContact CB-CB 4.27Å; K431-Q435 PolarHBondContact N-O 2.82Å; G432-Q435 PolarHBondContact N-O 2.84Å; G432-Q435 PolarHBondContact O-N 3.13Å; Q433-Q435 PolarHBondContact O-N 2.85Å
436	L	94.7	Very high	88.7	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	151.2	-175.7	-53.2	177.8	0	0	0	110.1	F363 F368 F406 V429 V430 Y438 R448 V449 I451	F363-L436 HydrophobicContact CE1-CD2 4.13Å; F363-L436 HydrophobicContact CZ-CD1 4.46Å; F368-L436 HydrophobicContact CE1-CD1 4.06Å; F368-L436 HydrophobicContact CZ-CD1 4.09Å; F406-L436 HydrophobicContact CE1-CD2 4.1Å; F406-L436 HydrophobicContact CZ-CD1 4.11Å; F406-L436 HydrophobicContact CZ-CD2 4.33Å; V429-L436 CarbonylContact O-C 3.51Å; V429-L436 WeakPolarHBondContact O-CA 3.43Å; V430-L436 HydrophobicContact CB-CD2 4.32Å; V430-L436 HydrophobicContact CG1-CD2 4.46Å; V430-L436 HydrophobicContact CG2-CD2 3.85Å; L436-Y438 HydrophobicContact CB-CD2 4.18Å; L436-Y438 HydrophobicContact CB-CE2 3.66Å; L436-Y438 HydrophobicContact CD1-CE2 3.88Å; L436-Y438 HydrophobicContact CG-CE2 4.42Å; L436-R448 WeakPolarHBondContact O-CA 3.36Å; L436-V449 HydrophobicContact CB-CB 4.38Å; L436-V449 PolarHBondContact N-O 3.39Å; L436-V449 PolarHBondContact O-N 2.93Å; L436-I451 HydrophobicContact CD1-CD1 4.13Å; L436-I451 HydrophobicContact CD1-CG1 4.14Å
437	I	93.3	Very high	88.6	Confident	41 Å²	41	53.6 Å²	53.6	21%	0.21	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	122.3	170.7	-54.5	179.2	0	0	0	107.6	G428 V429 K431 D446 I447 R448	G428-I437 CarbonylContact C-O 3.03Å; G428-I437 WeakPolarHBondContact CA-O 3.21Å; V429-I437 PolarHBondContact N-O 3.46Å; V429-I437 PolarHBondContact O-N 2.81Å; K431-I437 HydrophobicContact CB-CD1 4.38Å; K431-I437 HydrophobicContact CB-CG1 4.32Å; K431-I437 HydrophobicContact CD-CD1 4.17Å; I437-D446 HydrophobicContact CG2-CB 3.73Å; I437-I447 CarbonylContact C-O 3.57Å; I437-I447 WeakPolarHBondContact CA-O 3.35Å; I437-R448 HydrophobicContact CG1-CG 4.37Å
438	Y	91	Very high	88.6	Confident	17 Å²	17	56.4 Å²	56.4	7%	0.067	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	143.2	178	-74.4	-91.9	0	0	0	111.2	Y391 F406 T408 Y427 L436 D446 I447 V449	Y391-Y438 HydrophobicContact CD1-CE1 4.29Å; Y391-Y438 AromaticContact CE1-CE1 3.56Å; Y391-Y438 HydrophobicContact CE1-CE1 3.56Å; Y391-Y438 AromaticContact CE1-CZ 3.94Å; Y391-Y438 WeakPolarHBondContact CE1-OH 3.19Å; F406-Y438 HydrophobicContact CE2-CD1 4.38Å; F406-Y438 AromaticContact CE2-CE1 3.45Å; F406-Y438 HydrophobicContact CE2-CE1 3.45Å; F406-Y438 VanDerWaalsContact CE2-CE1 3.45Å; F406-Y438 AromaticContact CE2-CZ 3.64Å; F406-Y438 WeakPolarHBondContact CE2-OH 3.32Å; F406-Y438 AromaticContact CZ-CE1 3.88Å; F406-Y438 HydrophobicContact CZ-CE1 3.88Å; F406-Y438 HydrophobicContact CZ-CE2 4.36Å; F406-Y438 AromaticContact CZ-CZ 3.66Å; F406-Y438 WeakPolarHBondContact CZ-OH 3.49Å; T408-Y438 HydrophobicContact CG2-CD1 4.17Å; T408-Y438 HydrophobicContact CG2-CE1 4.42Å; Y427-Y438 WeakPolarHBondContact O-CA 3.38Å; L436-Y438 HydrophobicContact CB-CD2 4.18Å; L436-Y438 HydrophobicContact CB-CE2 3.66Å; L436-Y438 HydrophobicContact CD1-CE2 3.88Å; L436-Y438 HydrophobicContact CG-CE2 4.42Å; Y438-D446 WeakPolarHBondContact O-CA 3.28Å; Y438-I447 PolarHBondContact N-O 3.1Å; Y438-I447 PolarHBondContact O-N 3.35Å; Y438-V449 HydrophobicContact CD2-CB 3.85Å; Y438-V449 HydrophobicContact CD2-CG2 3.46Å; Y438-V449 VanDerWaalsContact CD2-CG2 3.46Å; Y438-V449 HydrophobicContact CE2-CB 3.84Å; Y438-V449 HydrophobicContact CE2-CG1 4.21Å; Y438-V449 HydrophobicContact CE2-CG2 3.84Å; Y438-V449 HydrophobicContact CG-CG2 4.49Å
439	R	88.7	Confident	88.6	Confident	96 Å²	96	57.1 Å²	57.1	36%	0.362	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	125.6	162.4	179.4	175.5	-69.2	166.7	-5.8	108.4	G426 Y427 P444 D446	G426-R439 CarbonylContact C-O 3.5Å; G426-R439 WeakPolarHBondContact CA-O 3.34Å; Y427-R439 HydrophobicContact CE1-CB 3.99Å; Y427-R439 HydrophobicContact CE1-CG 4.3Å; Y427-R439 HydrophobicContact CE2-CB 4.41Å; Y427-R439 PolarHBondContact N-O 2.79Å; Y427-R439 PolarHBondContact O-N 3.1Å; Y427-R439 PolarHBondContact OH-NH1 2.97Å; R439-P444 PolarHBondContact NE-O 3.17Å; R439-D446 IonicContact CZ-OD1 3.02Å; R439-D446 IonicContact NE-OD1 2.87Å; R439-D446 PolarHBondContact NE-OD1 3.22Å; R439-D446 VanDerWaalsContact NH2-CG 3.26Å; R439-D446 IonicContact NH2-OD1 2.67Å; R439-D446 PolarHBondContact NH2-OD1 2.96Å; R439-D446 IonicContact NH2-OD2 3.3Å; R439-D446 PolarHBondContact NH2-OD2 3.35Å
440	T	86.5	Confident	88.7	Confident	19 Å²	19	55.5 Å²	55.5	12%	0.117	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	161	-174.4	50.9	0	0	0	0	110.5	T408 S425 N442 S443	T408-T440 HydrophobicContact CG2-CG2 3.86Å; S425-T440 CarbonylContact O-C 3.56Å; S425-T440 WeakPolarHBondContact O-CA 3.45Å; T440-N442 VanDerWaalsContact CB-OD1 3.29Å; T440-N442 WeakPolarHBondContact CB-OD1 3.26Å; T440-N442 PolarHBondContact O-N 3.27Å; T440-N442 PolarHBondContact OG1-OD1 3.36Å; T440-S443 PolarHBondContact N-O 3.33Å; T440-S443 CarbonylContact O-C 3.56Å; T440-S443 PolarHBondContact O-N 3.19Å; T440-S443 WeakPolarHBondContact OG1-CB 3.45Å; T440-S443 PolarHBondContact OG1-N 2.93Å
441	S	84.1	Confident	88.8	Confident	81 Å²	81	55.3 Å²	55.3	57%	0.566	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.8	176.9	40.4	0	0	0	0	113.5	A424 S425	A424-S441 WeakPolarHBondContact CA-OG 3.28Å; S425-S441 PolarHBondContact N-OG 3.08Å; S425-S441 PolarHBondContact O-N 3.28Å; S425-S441 PolarHBondContact O-OG 2.69Å
442	N	78	Confident	89	Confident	68 Å²	68	50.7 Å²	50.7	36%	0.364	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-12.5	173.1	66.5	-0.5	0	0	0	113.7	A424 T440	A424-N442 HydrophobicContact CB-CB 4.08Å; A424-N442 WeakPolarHBondContact CB-ND2 3.24Å; T440-N442 VanDerWaalsContact CB-OD1 3.29Å; T440-N442 WeakPolarHBondContact CB-OD1 3.26Å; T440-N442 PolarHBondContact O-N 3.27Å; T440-N442 PolarHBondContact OG1-OD1 3.36Å
443	S	76.8	Confident	89.3	Confident	34 Å²	34	51.7 Å²	51.7	24%	0.238	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	87.1	-178.3	-58	0	0	0	0	109.5	T440 N445 I447	T440-S443 PolarHBondContact N-O 3.33Å; T440-S443 CarbonylContact O-C 3.56Å; T440-S443 PolarHBondContact O-N 3.19Å; T440-S443 WeakPolarHBondContact OG1-CB 3.45Å; T440-S443 PolarHBondContact OG1-N 2.93Å; S443-N445 PolarHBondContact O-N 2.87Å; S443-N445 VanDerWaalsContact O-N 3.16Å; S443-I447 WeakPolarHBondContact OG-CD1 3.35Å
444	P	75.1	Confident	89.6	Confident	97 Å²	97	48.6 Å²	48.6	63%	0.63	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.9	-18	-175.2	26.6	-34.8	0	0	0	113	R439	R439-P444 PolarHBondContact NE-O 3.17Å
445	N	84.4	Confident	89.8	Confident	125 Å²	125	49 Å²	49	67%	0.668	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	149.9	176.5	-63.9	-33.3	0	0	0	111.3	S443 I447	S443-N445 PolarHBondContact O-N 2.87Å; S443-N445 VanDerWaalsContact O-N 3.16Å; N445-I447 PolarHBondContact O-N 3.12Å
446	D	85.5	Confident	89.9	Confident	85 Å²	85	49.6 Å²	49.6	46%	0.455	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	114.1	176.7	-70.1	-8.4	0	0	0	111.2	I437 Y438 R439	I437-D446 HydrophobicContact CG2-CB 3.73Å; Y438-D446 WeakPolarHBondContact O-CA 3.28Å; R439-D446 IonicContact CZ-OD1 3.02Å; R439-D446 IonicContact NE-OD1 2.87Å; R439-D446 PolarHBondContact NE-OD1 3.22Å; R439-D446 VanDerWaalsContact NH2-CG 3.26Å; R439-D446 IonicContact NH2-OD1 2.67Å; R439-D446 PolarHBondContact NH2-OD1 2.96Å; R439-D446 IonicContact NH2-OD2 3.3Å; R439-D446 PolarHBondContact NH2-OD2 3.35Å
447	I	88	Confident	90	Very high	60 Å²	60	54.2 Å²	54.2	31%	0.308	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	122.1	175.9	-59.2	174.8	0	0	0	108.8	I437 Y438 S443 N445 V449 V470	I437-I447 CarbonylContact C-O 3.57Å; I437-I447 WeakPolarHBondContact CA-O 3.35Å; Y438-I447 PolarHBondContact N-O 3.1Å; Y438-I447 PolarHBondContact O-N 3.35Å; S443-I447 WeakPolarHBondContact OG-CD1 3.35Å; N445-I447 PolarHBondContact O-N 3.12Å; I447-V449 HydrophobicContact CG2-CG2 4Å; I447-V470 HydrophobicContact CG2-CG1 3.68Å
448	R	90.8	Very high	90.1	Very high	148 Å²	148	53.9 Å²	53.9	56%	0.558	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	113.4	174.9	-69.7	-175.6	-77.4	-125.4	3.2	110	L436 I437 V470	L436-R448 WeakPolarHBondContact O-CA 3.36Å; I437-R448 HydrophobicContact CG1-CG 4.37Å; R448-V470 WeakPolarHBondContact O-CA 3.48Å; R448-V470 WeakPolarHBondContact O-CB 3.32Å; R448-V470 WeakPolarHBondContact O-CG1 3.44Å
449	V	93.7	Very high	90.3	Very high	14 Å²	14	63.6 Å²	63.6	9%	0.085	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	139.4	-179.8	177.9	0	0	0	0	109.6	L436 Y438 I447 M468 T469 V470	L436-V449 HydrophobicContact CB-CB 4.38Å; L436-V449 PolarHBondContact N-O 3.39Å; L436-V449 PolarHBondContact O-N 2.93Å; Y438-V449 HydrophobicContact CD2-CB 3.85Å; Y438-V449 HydrophobicContact CD2-CG2 3.46Å; Y438-V449 VanDerWaalsContact CD2-CG2 3.46Å; Y438-V449 HydrophobicContact CE2-CB 3.84Å; Y438-V449 HydrophobicContact CE2-CG1 4.21Å; Y438-V449 HydrophobicContact CE2-CG2 3.84Å; Y438-V449 HydrophobicContact CG-CG2 4.49Å; I447-V449 HydrophobicContact CG2-CG2 4Å; V449-M468 HydrophobicContact CG1-CB 3.86Å; V449-T469 CarbonylContact C-O 3.33Å; V449-T469 WeakPolarHBondContact CA-O 3.25Å; V449-V470 HydrophobicContact CG2-CG1 4.19Å
450	H	95	Very high	90.6	Very high	4 Å²	4	67.5 Å²	67.5	2%	0.019	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	122.7	179.4	-51.9	-64.6	0	0	0	108.4	K356 P357 T359 G434 I452 M468 T469 T471	K356-H450 VanDerWaalsContact CE-CE1 3.4Å; K356-H450 WeakPolarHBondContact CE-CE1 3.35Å; P357-H450 HydrophobicContact CG-CB 4.03Å; T359-H450 HydrophobicContact CG2-CB 3.73Å; G434-H450 CarbonylContact O-C 3.45Å; G434-H450 WeakPolarHBondContact O-CA 3.4Å; H450-I452 HydrophobicContact CB-CG2 4.24Å; H450-M468 WeakPolarHBondContact O-CA 3.32Å; H450-T469 HydrophobicContact CB-CG2 4.33Å; H450-T469 PolarHBondContact N-O 2.78Å; H450-T469 PolarHBondContact O-N 2.62Å; H450-T471 PolarHBondContact NE2-OG1 3.02Å
451	I	96.5	Very high	91	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	113.4	169.2	-53.1	-57.5	0	0	0	107.4	T359 V360 F363 F368 G434 L436 T454 M468	T359-I451 CarbonylContact C-O 3.55Å; T359-I451 VanDerWaalsContact CA-O 3.27Å; T359-I451 WeakPolarHBondContact CA-O 3.28Å; V360-I451 HydrophobicContact CG2-CG2 4.26Å; V360-I451 PolarHBondContact N-O 2.77Å; F363-I451 HydrophobicContact CD2-CB 4.23Å; F363-I451 HydrophobicContact CD2-CG1 4.21Å; F363-I451 HydrophobicContact CD2-CG2 4Å; F363-I451 HydrophobicContact CE2-CB 4.29Å; F363-I451 HydrophobicContact CE2-CG1 3.81Å; F363-I451 HydrophobicContact CE2-CG2 4.09Å; F363-I451 HydrophobicContact CZ-CG1 4.11Å; F368-I451 HydrophobicContact CE2-CD1 4.15Å; G434-I451 PolarHBondContact O-N 2.74Å; L436-I451 HydrophobicContact CD1-CD1 4.13Å; L436-I451 HydrophobicContact CD1-CG1 4.14Å; I451-T454 HydrophobicContact CG2-CG2 3.91Å; I451-M468 HydrophobicContact CD1-CB 3.83Å; I451-M468 HydrophobicContact CD1-CE 4.3Å
452	I	95.8	Very high	91.6	Very high	17 Å²	17	66.3 Å²	66.3	9%	0.087	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-14.5	-172.1	61.8	167.9	0	0	0	113	P357 H450 V467 T469 F497 L503	P357-I452 HydrophobicContact CB-CG2 3.66Å; P357-I452 HydrophobicContact CG-CG2 3.94Å; H450-I452 HydrophobicContact CB-CG2 4.24Å; I452-V467 HydrophobicContact CD1-CB 4.5Å; I452-V467 HydrophobicContact CD1-CG1 3.68Å; I452-V467 HydrophobicContact CG1-CB 3.9Å; I452-V467 HydrophobicContact CG1-CG1 3.59Å; I452-V467 WeakPolarHBondContact CG1-O 3.45Å; I452-V467 PolarHBondContact N-O 3.27Å; I452-T469 HydrophobicContact CB-CG2 4.5Å; I452-T469 HydrophobicContact CD1-CG2 3.92Å; I452-T469 HydrophobicContact CG1-CG2 4.22Å; I452-T469 HydrophobicContact CG2-CG2 3.51Å; I452-F497 HydrophobicContact CD1-CE1 3.89Å; I452-F497 HydrophobicContact CD1-CZ 4.28Å; I452-F497 HydrophobicContact CG1-CE1 4.11Å; I452-F497 HydrophobicContact CG1-CZ 4.31Å; I452-F497 WeakPolarHBondContact O-CZ 3.42Å; I452-L503 HydrophobicContact CD1-CD1 3.7Å
453	K	97.2	Very high	92.6	Very high	38 Å²	38	63.8 Å²	63.8	17%	0.165	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	146.1	172.4	-177.2	163.9	170.4	51.7	0	110.4	Y465 V466 V467 E493 F497	K453-Y465 HydrophobicContact CD-CE2 4.47Å; K453-Y465 WeakPolarHBondContact CE-OH 3.44Å; K453-Y465 HydrophobicContact CG-CE2 4.11Å; K453-Y465 PolarHBondContact NZ-OH 2.87Å; K453-Y465 VanDerWaalsContact NZ-OH 3.12Å; K453-V466 WeakPolarHBondContact O-CA 3.31Å; K453-V467 HydrophobicContact CB-CB 4.03Å; K453-V467 HydrophobicContact CB-CG2 3.88Å; K453-V467 HydrophobicContact CG-CG2 4.43Å; K453-V467 PolarHBondContact O-N 2.79Å; K453-E493 VanDerWaalsContact CE-OE1 3.32Å; K453-E493 WeakPolarHBondContact CE-OE1 3.29Å; K453-E493 IonicContact NZ-OE1 2.74Å; K453-E493 PolarHBondContact NZ-OE1 2.79Å; K453-F497 HydrophobicContact CB-CD1 4.3Å; K453-F497 HydrophobicContact CB-CE1 3.76Å; K453-F497 HydrophobicContact CB-CE2 4.25Å; K453-F497 HydrophobicContact CB-CZ 3.73Å; K453-F497 HydrophobicContact CD-CB 3.94Å; K453-F497 HydrophobicContact CD-CD1 3.56Å; K453-F497 HydrophobicContact CD-CD2 3.51Å; K453-F497 HydrophobicContact CD-CE1 3.85Å; K453-F497 HydrophobicContact CD-CE2 3.79Å; K453-F497 HydrophobicContact CD-CG 3.37Å; K453-F497 HydrophobicContact CD-CZ 3.95Å; K453-F497 HydrophobicContact CG-CE1 4.5Å; K453-F497 HydrophobicContact CG-CZ 4.47Å
454	T	97.9	Very high	93.6	Very high	28 Å²	28	62.7 Å²	62.7	17%	0.172	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	151	171.7	51.9	0	0	0	0	108.9	V360 F363 I451 Y463 V466	V360-T454 HydrophobicContact CG1-CG2 4.42Å; V360-T454 HydrophobicContact CG2-CG2 4.33Å; F363-T454 HydrophobicContact CD2-CG2 4.32Å; I451-T454 HydrophobicContact CG2-CG2 3.91Å; T454-Y463 HydrophobicContact CG2-CD1 4.24Å; T454-Y463 HydrophobicContact CG2-CD2 4.19Å; T454-Y463 HydrophobicContact CG2-CE1 4.17Å; T454-Y463 HydrophobicContact CG2-CE2 4.12Å; T454-Y463 HydrophobicContact CG2-CG 4.26Å; T454-V466 HydrophobicContact CG2-CG1 4.12Å
455	G	97.5	Very high	94.7	Very high	7 Å²	7	58.1 Å²	58.1	7%	0.072	29%	0.286	C	S	.	.			trans	-80.2	177.1	166.1	0	0	0	0	0	111.8	Y463 Y465	G455-Y463 VanDerWaalsContact O-CD1 3.29Å; G455-Y463 WeakPolarHBondContact O-CD1 3.31Å; G455-Y465 VanDerWaalsContact CA-CD1 3.48Å; G455-Y465 PolarHBondContact N-O 2.93Å
456	P	97.3	Very high	95.3	Very high	60 Å²	60	52.2 Å²	52.2	39%	0.39	25%	0.254	S	S	.	.			trans	-65.5	159.8	175.4	30.2	-36	0	0	0	111.6	D464 Y490	P456-D464 PolarHBondContact O-N 3.34Å; P456-Y490 HydrophobicContact CG-CE1 3.93Å; P456-Y490 WeakPolarHBondContact CG-OH 3.26Å
457	L	97.3	Very high	95.9	Very high	99 Å²	99	48.1 Å²	48.1	52%	0.518	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-73.2	132	169.6	-62.2	178.2	0	0	0	110.2	S367 Q462 Y463	S367-L457 WeakPolarHBondContact OG-CD2 3.49Å; L457-Q462 CarbonylContact C-O 3.53Å; L457-Q462 WeakPolarHBondContact CA-O 3.49Å; L457-Y463 HydrophobicContact CD2-CD1 3.53Å; L457-Y463 HydrophobicContact CD2-CE1 3.57Å; L457-Y463 HydrophobicContact CD2-CG 4.2Å; L457-Y463 HydrophobicContact CG-CD1 4.44Å; L457-Y463 HydrophobicContact CG-CE1 4.37Å
458	N	95	Very high	96.2	Very high	34 Å²	34	45.9 Å²	45.9	18%	0.182	22%	0.22	C	C	.	.			trans	-85.6	-176.5	174.3	62.9	34.7	0	0	0	112.3	R460 G461 Q462 D464	N458-R460 PolarHBondContact O-N 3.06Å; N458-R460 WeakPolarHBondContact OD1-CA 3.48Å; N458-R460 WeakPolarHBondContact OD1-CB 3.38Å; N458-R460 PolarHBondContact OD1-N 2.93Å; N458-G461 PolarHBondContact O-N 2.78Å; N458-G461 PolarHBondContact OD1-N 3.02Å; N458-Q462 PolarHBondContact N-O 2.93Å; N458-Q462 PolarHBondContact ND2-O 3.29Å; N458-Q462 PolarHBondContact OD1-N 3.49Å; N458-Q462 VanDerWaalsContact OD1-N 3.17Å; N458-Q462 PolarHBondContact OD1-O 2.75Å; N458-D464 VanDerWaalsContact CB-OD1 3.28Å; N458-D464 WeakPolarHBondContact CB-OD1 3.46Å; N458-D464 PolarHBondContact ND2-OD1 2.99Å
459	K	94.8	Very high	96.3	Very high	222 Å²	222	39 Å²	39	97%	0.965	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.7	179.6	-61.9	-176.7	-178.9	-179.9	0	113.9
460	R	94.3	Very high	96.1	Very high	177 Å²	177	39.3 Å²	39.3	67%	0.668	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	4.9	176.4	-58.1	-170.5	-65.1	-131.9	-3.7	113	N458 Q462	N458-R460 PolarHBondContact O-N 3.06Å; N458-R460 WeakPolarHBondContact OD1-CA 3.48Å; N458-R460 WeakPolarHBondContact OD1-CB 3.38Å; N458-R460 PolarHBondContact OD1-N 2.93Å; R460-Q462 VanDerWaalsContact C-N 3.27Å; R460-Q462 HydrophobicContact CB-CG 4.37Å; R460-Q462 VanDerWaalsContact NE-OE1 3.07Å; R460-Q462 PolarHBondContact O-N 2.95Å
461	G	96.1	Very high	95.4	Very high	37 Å²	37	41.8 Å²	41.8	38%	0.381	21%	0.212	S	C	.	.	S	Bend	trans	68	26.8	-174.4	0	0	0	0	0	113	S367 N458	S367-G461 WeakPolarHBondContact CA-O 3.34Å; S367-G461 PolarHBondContact OG-O 2.85Å; S367-G461 VanDerWaalsContact OG-O 3.05Å; N458-G461 PolarHBondContact O-N 2.78Å; N458-G461 PolarHBondContact OD1-N 3.02Å
462	Q	96.6	Very high	94.6	Very high	39 Å²	39	41.9 Å²	41.9	18%	0.182	21%	0.213	C	C	.	.			trans	-113.3	147.6	179	-69.8	173.7	-29.3	0	0	110.4	S367 T369 L457 N458 R460 D464	S367-Q462 WeakPolarHBondContact O-CA 3.5Å; T369-Q462 PolarHBondContact O-NE2 2.81Å; L457-Q462 CarbonylContact C-O 3.53Å; L457-Q462 WeakPolarHBondContact CA-O 3.49Å; N458-Q462 PolarHBondContact N-O 2.93Å; N458-Q462 PolarHBondContact ND2-O 3.29Å; N458-Q462 PolarHBondContact OD1-N 3.49Å; N458-Q462 VanDerWaalsContact OD1-N 3.17Å; N458-Q462 PolarHBondContact OD1-O 2.75Å; R460-Q462 VanDerWaalsContact C-N 3.27Å; R460-Q462 HydrophobicContact CB-CG 4.37Å; R460-Q462 VanDerWaalsContact NE-OE1 3.07Å; R460-Q462 PolarHBondContact O-N 2.95Å; Q462-D464 PolarHBondContact O-N 3.04Å
463	Y	98.1	Very high	93.9	Very high	15 Å²	15	41.7 Å²	41.7	6%	0.059	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-61.4	137.3	170.8	-62.2	-57.6	0	0	0	110.7	F363 D364 S367 F368 W372 T454 G455 L457 V466 R481	F363-Y463 HydrophobicContact CD2-CE2 4.36Å; F363-Y463 HydrophobicContact CE2-CE2 4.36Å; D364-Y463 WeakPolarHBondContact CB-OH 3.4Å; D364-Y463 PolarHBondContact N-OH 2.78Å; D364-Y463 WeakPolarHBondContact O-CE2 3.42Å; S367-Y463 VanDerWaalsContact CB-CE2 3.44Å; S367-Y463 PolarHBondContact O-N 3.5Å; S367-Y463 VanDerWaalsContact O-N 3.09Å; F368-Y463 HydrophobicContact CB-CD2 4.42Å; W372-Y463 WeakPolarHBondContact CH2-O 3.41Å; T454-Y463 HydrophobicContact CG2-CD1 4.24Å; T454-Y463 HydrophobicContact CG2-CD2 4.19Å; T454-Y463 HydrophobicContact CG2-CE1 4.17Å; T454-Y463 HydrophobicContact CG2-CE2 4.12Å; T454-Y463 HydrophobicContact CG2-CG 4.26Å; G455-Y463 VanDerWaalsContact O-CD1 3.29Å; G455-Y463 WeakPolarHBondContact O-CD1 3.31Å; L457-Y463 HydrophobicContact CD2-CD1 3.53Å; L457-Y463 HydrophobicContact CD2-CE1 3.57Å; L457-Y463 HydrophobicContact CD2-CG 4.2Å; L457-Y463 HydrophobicContact CG-CD1 4.44Å; L457-Y463 HydrophobicContact CG-CE1 4.37Å; Y463-V466 HydrophobicContact CD2-CG1 4.32Å; Y463-V466 HydrophobicContact CG-CG1 4.49Å; Y463-R481 WeakPolarHBondContact O-CG 3.43Å; Y463-R481 PolarHBondContact O-NE 2.84Å; Y463-R481 VanDerWaalsContact O-NE 3.09Å
464	D	97.9	Very high	93.1	Very high	11 Å²	11	39.9 Å²	39.9	6%	0.059	20%	0.204	C	C	.	.	S	Bend	trans	-72.5	-35.6	175.7	-92	-13.9	0	0	0	113.2	P456 N458 Q462 A480 R481 Q485 Y490	P456-D464 PolarHBondContact O-N 3.34Å; N458-D464 VanDerWaalsContact CB-OD1 3.28Å; N458-D464 WeakPolarHBondContact CB-OD1 3.46Å; N458-D464 PolarHBondContact ND2-OD1 2.99Å; Q462-D464 PolarHBondContact O-N 3.04Å; D464-A480 WeakPolarHBondContact O-CA 3.5Å; D464-R481 PolarHBondContact O-N 3.37Å; D464-Q485 PolarHBondContact OD2-NE2 3.44Å; D464-Y490 HydrophobicContact CB-CD2 4.42Å; D464-Y490 HydrophobicContact CB-CE2 3.6Å; D464-Y490 WeakPolarHBondContact OD2-CE2 3.23Å; D464-Y490 PolarHBondContact OD2-OH 3.43Å
465	Y	98.3	Very high	92.6	Very high	1 Å²	1	39.9 Å²	39.9	0%	0.004	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	162.6	174.3	73.1	-94.3	0	0	0	111	K453 G455 V467 L479 Y486 Y490 E493 V494	K453-Y465 HydrophobicContact CD-CE2 4.47Å; K453-Y465 WeakPolarHBondContact CE-OH 3.44Å; K453-Y465 HydrophobicContact CG-CE2 4.11Å; K453-Y465 PolarHBondContact NZ-OH 2.87Å; K453-Y465 VanDerWaalsContact NZ-OH 3.12Å; G455-Y465 VanDerWaalsContact CA-CD1 3.48Å; G455-Y465 PolarHBondContact N-O 2.93Å; Y465-V467 HydrophobicContact CD2-CG2 4.32Å; Y465-V467 HydrophobicContact CE2-CG2 4.24Å; Y465-L479 CarbonylContact C-O 3.57Å; Y465-L479 WeakPolarHBondContact CA-O 3.01Å; Y465-L479 WeakPolarHBondContact CB-O 3.47Å; Y465-Y486 HydrophobicContact CG-CD2 4.29Å; Y465-Y486 HydrophobicContact CG-CE2 4.25Å; Y465-Y490 HydrophobicContact CD1-CD1 4.08Å; Y465-Y490 AromaticContact CD1-CD2 3.71Å; Y465-Y490 HydrophobicContact CD1-CD2 3.71Å; Y465-Y490 HydrophobicContact CD1-CE2 4.29Å; Y465-Y490 AromaticContact CD1-CG 3.59Å; Y465-Y490 HydrophobicContact CD1-CG 3.59Å; Y465-Y490 AromaticContact CE1-CD1 3.66Å; Y465-Y490 HydrophobicContact CE1-CD1 3.66Å; Y465-Y490 HydrophobicContact CE1-CD2 4.17Å; Y465-Y490 HydrophobicContact CE1-CE1 4.28Å; Y465-Y490 AromaticContact CE1-CG 3.6Å; Y465-Y490 HydrophobicContact CE1-CG 3.6Å; Y465-E493 PolarHBondContact OH-OE1 2.79Å; Y465-V494 HydrophobicContact CD2-CG2 3.86Å; Y465-V494 HydrophobicContact CE1-CG2 4.34Å; Y465-V494 HydrophobicContact CE2-CG2 3.4Å; Y465-V494 VanDerWaalsContact CE2-CG2 3.4Å
466	V	98.2	Very high	92.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	143.4	172.6	-67.7	0	0	0	0	110	F368 W372 K453 T454 Y463 M468 V478 L479	F368-V466 HydrophobicContact CD2-CG1 4.07Å; F368-V466 HydrophobicContact CD2-CG2 4.49Å; F368-V466 HydrophobicContact CE2-CG1 4.35Å; F368-V466 HydrophobicContact CE2-CG2 4.02Å; W372-V466 HydrophobicContact CD2-CG2 4.48Å; W372-V466 HydrophobicContact CE3-CG2 4.31Å; W372-V466 HydrophobicContact CH2-CB 4.47Å; W372-V466 HydrophobicContact CH2-CG1 3.78Å; W372-V466 HydrophobicContact CH2-CG2 4.05Å; W372-V466 HydrophobicContact CZ2-CG1 4.05Å; W372-V466 HydrophobicContact CZ2-CG2 4.21Å; W372-V466 HydrophobicContact CZ3-CG2 4.12Å; K453-V466 WeakPolarHBondContact O-CA 3.31Å; T454-V466 HydrophobicContact CG2-CG1 4.12Å; Y463-V466 HydrophobicContact CD2-CG1 4.32Å; Y463-V466 HydrophobicContact CG-CG1 4.49Å; V466-M468 HydrophobicContact CG2-CE 4.25Å; V466-V478 WeakPolarHBondContact O-CA 3.07Å; V466-L479 HydrophobicContact CG2-CB 3.79Å; V466-L479 HydrophobicContact CG2-CD1 4.44Å; V466-L479 HydrophobicContact CG2-CG 4.33Å; V466-L479 PolarHBondContact N-O 3.24Å; V466-L479 PolarHBondContact O-N 3.01Å
467	V	97.6	Very high	92.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	118.8	172.8	-173.5	0	0	0	0	107.6	I452 K453 Y465 L476 V478 V494 F497 L498	I452-V467 HydrophobicContact CD1-CB 4.5Å; I452-V467 HydrophobicContact CD1-CG1 3.68Å; I452-V467 HydrophobicContact CG1-CB 3.9Å; I452-V467 HydrophobicContact CG1-CG1 3.59Å; I452-V467 WeakPolarHBondContact CG1-O 3.45Å; I452-V467 PolarHBondContact N-O 3.27Å; K453-V467 HydrophobicContact CB-CB 4.03Å; K453-V467 HydrophobicContact CB-CG2 3.88Å; K453-V467 HydrophobicContact CG-CG2 4.43Å; K453-V467 PolarHBondContact O-N 2.79Å; Y465-V467 HydrophobicContact CD2-CG2 4.32Å; Y465-V467 HydrophobicContact CE2-CG2 4.24Å; V467-L476 HydrophobicContact CG1-CD1 4.49Å; V467-V478 HydrophobicContact CB-CG2 4.5Å; V467-V478 HydrophobicContact CG1-CG2 4.16Å; V467-V478 HydrophobicContact CG2-CG1 4.3Å; V467-V478 HydrophobicContact CG2-CG2 4.07Å; V467-V494 HydrophobicContact CG2-CG1 4.12Å; V467-F497 HydrophobicContact CG1-CE1 4.46Å; V467-L498 HydrophobicContact CG1-CD2 3.99Å
468	M	95.2	Very high	92.2	Very high	13 Å²	13	33.8 Å²	33.8	6%	0.064	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	144.6	-178.3	62.7	175.8	56.4	0	0	111	F368 V449 H450 I451 V466 H477 L479	F368-M468 HydrophobicContact CE2-CE 4.24Å; F368-M468 HydrophobicContact CZ-CE 4.19Å; V449-M468 HydrophobicContact CG1-CB 3.86Å; H450-M468 WeakPolarHBondContact O-CA 3.32Å; I451-M468 HydrophobicContact CD1-CB 3.83Å; I451-M468 HydrophobicContact CD1-CE 4.3Å; V466-M468 HydrophobicContact CG2-CE 4.25Å; M468-H477 HydrophobicContact CG-CB 3.66Å; M468-H477 WeakPolarHBondContact CG-O 3.28Å; M468-H477 PolarHBondContact N-O 2.83Å; M468-H477 PolarHBondContact O-N 3.16Å; M468-H477 VanDerWaalsContact O-O 3.13Å; M468-H477 HydrophobicContact SD-CB 4.1Å; M468-L479 HydrophobicContact CE-CD1 3.31Å; M468-L479 HydrophobicContact CE-CG 3.9Å; M468-L479 HydrophobicContact SD-CD1 3.97Å; M468-L479 HydrophobicContact SD-CG 4.24Å
469	T	92.5	Very high	92.4	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.012	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	168.1	179.8	176.5	0	0	0	0	109.6	P357 V449 H450 I452 N473	P357-T469 HydrophobicContact CB-CG2 4.34Å; P357-T469 HydrophobicContact CG-CG2 3.68Å; V449-T469 CarbonylContact C-O 3.33Å; V449-T469 WeakPolarHBondContact CA-O 3.25Å; H450-T469 HydrophobicContact CB-CG2 4.33Å; H450-T469 PolarHBondContact N-O 2.78Å; H450-T469 PolarHBondContact O-N 2.62Å; I452-T469 HydrophobicContact CB-CG2 4.5Å; I452-T469 HydrophobicContact CD1-CG2 3.92Å; I452-T469 HydrophobicContact CG1-CG2 4.22Å; I452-T469 HydrophobicContact CG2-CG2 3.51Å; T469-N473 WeakPolarHBondContact OG1-CA 3.4Å; T469-N473 PolarHBondContact OG1-O 2.55Å
470	V	89	Confident	92.5	Very high	21 Å²	21	21.6 Å²	21.6	13%	0.127	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-178	170.8	-58.9	0	0	0	0	111.7	I447 R448 V449 N473 Y474	I447-V470 HydrophobicContact CG2-CG1 3.68Å; R448-V470 WeakPolarHBondContact O-CA 3.48Å; R448-V470 WeakPolarHBondContact O-CB 3.32Å; R448-V470 WeakPolarHBondContact O-CG1 3.44Å; V449-V470 HydrophobicContact CG2-CG1 4.19Å; V470-N473 PolarHBondContact O-N 3.42Å; V470-N473 VanDerWaalsContact O-N 3.1Å; V470-Y474 WeakPolarHBondContact CG2-O 3.37Å
471	T	81.3	Confident	92.6	Very high	56 Å²	56	14 Å²	14	34%	0.344	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	138.1	168	-53.1	0	0	0	0	109.4	H450 N473	H450-T471 PolarHBondContact NE2-OG1 3.02Å; T471-N473 VanDerWaalsContact C-N 3.34Å
472	C	78.9	Confident	92.5	Very high	3 Å²	3	15.5 Å²	15.5	2%	0.02	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	74	16.5	-167.1	-49.3	0	0	0	0	115.2	L345 C353 Y474	L345-C472 WeakPolarHBondContact O-CB 3.03Å; C353-C472 HydrophobicContact CB-CB 3.68Å; C353-C472 WeakPolarHBondContact CB-SG 3.36Å; C353-C472 VanDerWaalsContact SG-CA 3.51Å; C353-C472 WeakPolarHBondContact SG-CB 3.43Å; C353-C472 CovalentContact SG-SG 2.03Å; C353-C472 PolarHBondContact SG-SG 2.96Å; C472-Y474 PolarHBondContact O-N 3.22Å
473	N	80.7	Confident	92.4	Very high	12 Å²	12	14.1 Å²	14.1	6%	0.064	8%	0.076	C	C	.	.	S	Bend	trans	65.9	-6.3	169.8	-73.4	-10.6	0	0	0	117.6	L354 T469 V470 T471 L503	L354-N473 HydrophobicContact CB-CB 4.48Å; L354-N473 WeakPolarHBondContact CB-ND2 3.49Å; L354-N473 WeakPolarHBondContact CD1-ND2 3.41Å; T469-N473 WeakPolarHBondContact OG1-CA 3.4Å; T469-N473 PolarHBondContact OG1-O 2.55Å; V470-N473 PolarHBondContact O-N 3.42Å; V470-N473 VanDerWaalsContact O-N 3.1Å; T471-N473 VanDerWaalsContact C-N 3.34Å; N473-L503 HydrophobicContact CB-CD2 3.46Å; N473-L503 VanDerWaalsContact CB-CD2 3.46Å; N473-L503 VanDerWaalsContact CG-CD2 3.43Å; N473-L503 VanDerWaalsContact ND2-CD2 3.31Å; N473-L503 WeakPolarHBondContact ND2-CD2 3.36Å
474	Y	80.6	Confident	92.2	Very high	1 Å²	1	17 Å²	17	0%	0.004	10%	0.096	C	C	.	.			trans	-139.8	145.1	177.6	-59.3	-81.5	0	0	0	112.3	L346 L381 V470 C472 L476 L503 W507 S508 L513 V514	L346-Y474 WeakPolarHBondContact CD2-O 3.47Å; L381-Y474 VanDerWaalsContact CD1-CB 3.44Å; L381-Y474 HydrophobicContact CD1-CG 4.27Å; V470-Y474 WeakPolarHBondContact CG2-O 3.37Å; C472-Y474 PolarHBondContact O-N 3.22Å; Y474-L476 HydrophobicContact CD1-CB 4.32Å; Y474-L503 PolarHBondContact OH-O 3.39Å; Y474-W507 HydrophobicContact CD2-CH2 4.41Å; Y474-W507 AromaticContact CE2-CH2 3.62Å; Y474-W507 HydrophobicContact CE2-CH2 3.62Å; Y474-W507 HydrophobicContact CE2-CZ2 4.1Å; Y474-S508 WeakPolarHBondContact OH-CB 3.46Å; Y474-L513 HydrophobicContact CE1-CB 4.1Å; Y474-V514 HydrophobicContact CD1-CG2 4.41Å; Y474-V514 HydrophobicContact CE1-CG2 3.6Å
475	P	88.4	Confident	92	Very high	28 Å²	28	19.8 Å²	19.8	18%	0.182	11%	0.108	C	C	.	.	S	Bend	cis	-66.5	147.8	0.6	27.5	-36	0	0	0	113.1	L381	L381-P475 HydrophobicContact CB-CB 3.91Å
476	L	91.6	Very high	92	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.8	174.3	-177.5	143.1	0	0	0	108.8	V376 Y377 S378 V467 Y474 V478 L498 L503 V514	V376-L476 HydrophobicContact CG1-CD2 4.27Å; Y377-L476 CarbonylContact C-O 3.54Å; Y377-L476 VanDerWaalsContact CA-O 3.29Å; Y377-L476 WeakPolarHBondContact CA-O 3.32Å; S378-L476 PolarHBondContact N-O 2.6Å; S378-L476 PolarHBondContact OG-N 2.74Å; S378-L476 PolarHBondContact OG-O 3.22Å; V467-L476 HydrophobicContact CG1-CD1 4.49Å; Y474-L476 HydrophobicContact CD1-CB 4.32Å; L476-V478 HydrophobicContact CD2-CG2 4.15Å; L476-L498 HydrophobicContact CD1-CD2 3.62Å; L476-L498 HydrophobicContact CD2-CD1 4.21Å; L476-L498 HydrophobicContact CD2-CD2 4.27Å; L476-L503 HydrophobicContact CD1-CB 4.2Å; L476-L503 HydrophobicContact CD1-CD1 3.71Å; L476-L503 HydrophobicContact CD1-CD2 4.48Å; L476-L503 HydrophobicContact CD1-CG 4.35Å; L476-V514 HydrophobicContact CD2-CG1 4.08Å
477	H	94.5	Very high	91.8	Very high	37 Å²	37	25.5 Å²	25.5	17%	0.171	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.8	172	-55.3	-82.7	0	0	0	110.5	Q374 V376 S382 M468 L479	Q374-H477 PolarHBondContact NE2-ND1 3.09Å; Q374-H477 VanDerWaalsContact NE2-ND1 3.11Å; V376-H477 WeakPolarHBondContact O-CA 3.33Å; S382-H477 PolarHBondContact OG-CE1 3.39Å; M468-H477 HydrophobicContact CG-CB 3.66Å; M468-H477 WeakPolarHBondContact CG-O 3.28Å; M468-H477 PolarHBondContact N-O 2.83Å; M468-H477 PolarHBondContact O-N 3.16Å; M468-H477 VanDerWaalsContact O-O 3.13Å; M468-H477 HydrophobicContact SD-CB 4.1Å; H477-L479 HydrophobicContact CB-CD2 4.37Å
478	V	97.2	Very high	91.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.3	162.6	-174.1	0	0	0	0	107.1	V375 V376 V466 V467 L476 Y486 V494 L498	V375-V478 HydrophobicContact CG2-CB 3.9Å; V375-V478 HydrophobicContact CG2-CG1 3.68Å; V375-V478 VanDerWaalsContact CG2-O 3.27Å; V375-V478 WeakPolarHBondContact CG2-O 3.15Å; V375-V478 PolarHBondContact N-O 2.67Å; V376-V478 HydrophobicContact CB-CB 3.7Å; V376-V478 HydrophobicContact CB-CG2 3.66Å; V376-V478 HydrophobicContact CG1-CG2 4.27Å; V376-V478 HydrophobicContact CG2-CB 3.96Å; V376-V478 HydrophobicContact CG2-CG2 3.97Å; V376-V478 PolarHBondContact N-O 2.87Å; V376-V478 PolarHBondContact O-N 3.3Å; V466-V478 WeakPolarHBondContact O-CA 3.07Å; V467-V478 HydrophobicContact CB-CG2 4.5Å; V467-V478 HydrophobicContact CG1-CG2 4.16Å; V467-V478 HydrophobicContact CG2-CG1 4.3Å; V467-V478 HydrophobicContact CG2-CG2 4.07Å; L476-V478 HydrophobicContact CD2-CG2 4.15Å; V478-Y486 HydrophobicContact CG1-CE2 3.75Å; V478-V494 HydrophobicContact CG1-CG1 4.3Å; V478-V494 HydrophobicContact CG2-CG1 3.91Å; V478-L498 HydrophobicContact CG2-CD1 4.4Å
479	L	97.6	Very high	91.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	141.1	175.5	-51.7	-174.5	0	0	0	109.4	W372 Y373 Q374 I389 Y391 Y465 V466 M468 H477	W372-L479 HydrophobicContact CB-CB 4.05Å; W372-L479 HydrophobicContact CB-CD1 3.92Å; W372-L479 HydrophobicContact CD2-CB 4.12Å; W372-L479 HydrophobicContact CE3-CB 3.78Å; W372-L479 HydrophobicContact CG-CB 4.28Å; W372-L479 HydrophobicContact CG-CD1 4.14Å; Y373-L479 CarbonylContact O-C 3.53Å; Y373-L479 VanDerWaalsContact O-CA 3.3Å; Y373-L479 WeakPolarHBondContact O-CA 3.48Å; Q374-L479 HydrophobicContact CB-CD2 3.99Å; Q374-L479 HydrophobicContact CG-CD2 4.34Å; I389-L479 HydrophobicContact CD1-CD1 3.86Å; I389-L479 HydrophobicContact CD1-CD2 3.93Å; Y391-L479 HydrophobicContact CE2-CD1 4.2Å; Y465-L479 CarbonylContact C-O 3.57Å; Y465-L479 WeakPolarHBondContact CA-O 3.01Å; Y465-L479 WeakPolarHBondContact CB-O 3.47Å; V466-L479 HydrophobicContact CG2-CB 3.79Å; V466-L479 HydrophobicContact CG2-CD1 4.44Å; V466-L479 HydrophobicContact CG2-CG 4.33Å; V466-L479 PolarHBondContact N-O 3.24Å; V466-L479 PolarHBondContact O-N 3.01Å; M468-L479 HydrophobicContact CE-CD1 3.31Å; M468-L479 HydrophobicContact CE-CG 3.9Å; M468-L479 HydrophobicContact SD-CD1 3.97Å; M468-L479 HydrophobicContact SD-CG 4.24Å; H477-L479 HydrophobicContact CB-CD2 4.37Å
480	A	97.8	Very high	92	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	150.9	176.6	0	0	0	0	0	111.2	W372 Y373 V375 D464 Y486	W372-A480 VanDerWaalsContact CE3-C 3.5Å; Y373-A480 PolarHBondContact N-O 3.41Å; Y373-A480 PolarHBondContact O-N 3.07Å; V375-A480 HydrophobicContact CG1-CB 3.79Å; V375-A480 HydrophobicContact CG2-CB 4.04Å; D464-A480 WeakPolarHBondContact O-CA 3.5Å; A480-Y486 HydrophobicContact CB-CD2 3.94Å; A480-Y486 HydrophobicContact CB-CG 3.87Å
481	R	95.9	Very high	92.4	Very high	19 Å²	19	41.5 Å²	41.5	7%	0.072	20%	0.201	C	C	.	.	S	Bend	trans	-70	-39.2	173.1	-62.4	-59.2	-171.9	167.7	3.9	112	S367 F368 T369 G370 R371 W372 Y373 Y463 D464	S367-R481 PolarHBondContact O-NH2 2.9Å; F368-R481 PolarHBondContact O-NH2 2.86Å; T369-R481 VanDerWaalsContact O-CZ 3.25Å; T369-R481 PolarHBondContact O-NH1 3.45Å; T369-R481 PolarHBondContact O-NH2 3.02Å; G370-R481 VanDerWaalsContact C-NH1 3.33Å; R371-R481 WeakPolarHBondContact O-CD 3.12Å; R371-R481 PolarHBondContact O-NH1 3.34Å; W372-R481 HydrophobicContact CE3-CG 4.29Å; W372-R481 HydrophobicContact CH2-CG 4.16Å; W372-R481 VanDerWaalsContact CH2-NE 3.32Å; W372-R481 VanDerWaalsContact CZ2-NE 3.28Å; W372-R481 VanDerWaalsContact CZ2-NH2 3.29Å; W372-R481 HydrophobicContact CZ3-CG 3.83Å; Y373-R481 WeakPolarHBondContact CD2-O 3.24Å; Y373-R481 WeakPolarHBondContact CE2-O 3.33Å; Y463-R481 WeakPolarHBondContact O-CG 3.43Å; Y463-R481 PolarHBondContact O-NE 2.84Å; Y463-R481 VanDerWaalsContact O-NE 3.09Å; D464-R481 PolarHBondContact O-N 3.37Å
482	D	94.7	Very high	93	Very high	67 Å²	67	46 Å²	46	36%	0.358	22%	0.216	S	C	.	.			trans	-133.5	108	178.1	-179.8	-17.1	0	0	0	108.3	V484 Q485 Y486	D482-V484 VanDerWaalsContact C-N 3.26Å; D482-V484 PolarHBondContact O-N 2.68Å; D482-V484 WeakPolarHBondContact OD1-CA 3.33Å; D482-V484 VanDerWaalsContact OD1-CB 3.32Å; D482-V484 WeakPolarHBondContact OD1-CB 3.29Å; D482-V484 PolarHBondContact OD1-N 3.13Å; D482-Q485 HydrophobicContact CB-CB 3.83Å; D482-Q485 PolarHBondContact O-N 3.48Å; D482-Q485 PolarHBondContact OD1-N 3.04Å; D482-Q485 VanDerWaalsContact OD1-N 3.14Å; D482-Y486 WeakPolarHBondContact O-CB 3.33Å; D482-Y486 PolarHBondContact O-N 3.21Å
483	P	94.3	Very high	93.8	Very high	10 Å²	10	49.6 Å²	49.6	7%	0.065	23%	0.232	C	C	.	.	H	α-helix	trans	-58.7	-33.1	177.5	-31.9	41.9	0	0	0	114.4	Y373 V375 K487 Y519	Y373-P483 HydrophobicContact CD1-CG 4.48Å; Y373-P483 HydrophobicContact CD2-CG 4.18Å; Y373-P483 HydrophobicContact CG-CG 3.79Å; V375-P483 HydrophobicContact CG1-CB 3.83Å; V375-P483 HydrophobicContact CG1-CG 4.03Å; P483-K487 WeakPolarHBondContact O-CB 3.14Å; P483-K487 PolarHBondContact O-N 2.74Å; P483-Y519 HydrophobicContact CB-CD1 4.12Å; P483-Y519 HydrophobicContact CB-CD2 3.59Å; P483-Y519 HydrophobicContact CB-CE1 4.43Å; P483-Y519 HydrophobicContact CB-CE2 3.94Å; P483-Y519 HydrophobicContact CB-CG 3.68Å; P483-Y519 HydrophobicContact CG-CD2 3.6Å; P483-Y519 HydrophobicContact CG-CE2 3.51Å; P483-Y519 HydrophobicContact CG-CG 4.19Å
484	V	94.2	Very high	94.6	Very high	76 Å²	76	49 Å²	49	46%	0.461	23%	0.229	S	C	.	.	H	α-helix	trans	-70.1	-50.6	179.4	-176.9	0	0	0	0	108.9	D482 Y486 K487 F488	D482-V484 VanDerWaalsContact C-N 3.26Å; D482-V484 PolarHBondContact O-N 2.68Å; D482-V484 WeakPolarHBondContact OD1-CA 3.33Å; D482-V484 VanDerWaalsContact OD1-CB 3.32Å; D482-V484 WeakPolarHBondContact OD1-CB 3.29Å; D482-V484 PolarHBondContact OD1-N 3.13Å; V484-Y486 VanDerWaalsContact C-N 3.29Å; V484-Y486 PolarHBondContact O-N 3.21Å; V484-K487 PolarHBondContact O-N 3.29Å; V484-F488 HydrophobicContact CG1-CD2 3.9Å; V484-F488 HydrophobicContact CG1-CE2 3.63Å; V484-F488 WeakPolarHBondContact O-CD2 3.33Å; V484-F488 PolarHBondContact O-N 2.94Å
485	Q	94.4	Very high	95.2	Very high	69 Å²	69	51.5 Å²	51.5	32%	0.322	24%	0.243	S	C	.	.	H	α-helix	trans	-60.2	-40.9	175.9	-170.8	-172.1	-19.6	0	0	111.6	D464 D482 F488 K489	D464-Q485 PolarHBondContact OD2-NE2 3.44Å; D482-Q485 HydrophobicContact CB-CB 3.83Å; D482-Q485 PolarHBondContact O-N 3.48Å; D482-Q485 PolarHBondContact OD1-N 3.04Å; D482-Q485 VanDerWaalsContact OD1-N 3.14Å; Q485-F488 PolarHBondContact O-N 3.08Å; Q485-K489 VanDerWaalsContact O-CB 3.28Å; Q485-K489 WeakPolarHBondContact O-CB 3.4Å; Q485-K489 PolarHBondContact O-N 2.84Å
486	Y	97.2	Very high	95.4	Very high	7 Å²	7	55.2 Å²	55.2	3%	0.027	26%	0.258	C	S	.	.	H	α-helix	trans	-58	-49.7	176.5	173	-92.2	0	0	0	112	V375 Y465 V478 A480 D482 V484 F488 K489 Y490 E491 V494	V375-Y486 HydrophobicContact CB-CD1 3.72Å; V375-Y486 HydrophobicContact CB-CE1 3.77Å; V375-Y486 HydrophobicContact CB-CG 4.36Å; V375-Y486 HydrophobicContact CG1-CD1 3.95Å; V375-Y486 HydrophobicContact CG1-CG 4.28Å; V375-Y486 HydrophobicContact CG2-CD1 3.62Å; V375-Y486 HydrophobicContact CG2-CD2 4.1Å; V375-Y486 HydrophobicContact CG2-CE1 3.46Å; V375-Y486 VanDerWaalsContact CG2-CE1 3.46Å; V375-Y486 HydrophobicContact CG2-CE2 3.95Å; V375-Y486 HydrophobicContact CG2-CG 3.95Å; Y465-Y486 HydrophobicContact CG-CD2 4.29Å; Y465-Y486 HydrophobicContact CG-CE2 4.25Å; V478-Y486 HydrophobicContact CG1-CE2 3.75Å; A480-Y486 HydrophobicContact CB-CD2 3.94Å; A480-Y486 HydrophobicContact CB-CG 3.87Å; D482-Y486 WeakPolarHBondContact O-CB 3.33Å; D482-Y486 PolarHBondContact O-N 3.21Å; V484-Y486 VanDerWaalsContact C-N 3.29Å; V484-Y486 PolarHBondContact O-N 3.21Å; Y486-F488 VanDerWaalsContact C-N 3.31Å; Y486-F488 PolarHBondContact O-N 2.89Å; Y486-K489 PolarHBondContact O-N 2.94Å; Y486-Y490 WeakPolarHBondContact O-CA 3.36Å; Y486-Y490 PolarHBondContact O-N 2.78Å; Y486-E491 HydrophobicContact CD1-CB 4.49Å; Y486-E491 HydrophobicContact CE1-CB 4.05Å; Y486-E491 HydrophobicContact CE1-CG 4.44Å; Y486-E491 PolarHBondContact O-N 2.92Å; Y486-V494 HydrophobicContact CE2-CB 4.42Å; Y486-V494 HydrophobicContact CE2-CG2 3.93Å; Y486-V494 WeakPolarHBondContact OH-CB 3.35Å; Y486-V494 WeakPolarHBondContact OH-CG1 3.33Å
487	K	95	Very high	95.6	Very high	115 Å²	115	57 Å²	57	50%	0.5	27%	0.266	S	S	.	.	H	α-helix	trans	-56.2	-45.9	179.9	-168.2	173	-173.4	168	0	111.8	P483 V484 E491	P483-K487 WeakPolarHBondContact O-CB 3.14Å; P483-K487 PolarHBondContact O-N 2.74Å; V484-K487 PolarHBondContact O-N 3.29Å; K487-E491 WeakPolarHBondContact CG-OE2 3.3Å
488	F	95.6	Very high	95.4	Very high	176 Å²	176	55.2 Å²	55.2	77%	0.772	26%	0.257	S	S	*	.	H	α-helix	trans	-77.3	-33.5	-177.7	-69.9	-65.8	0	0	0	114.3	V484 Q485 Y486	V484-F488 HydrophobicContact CG1-CD2 3.9Å; V484-F488 HydrophobicContact CG1-CE2 3.63Å; V484-F488 WeakPolarHBondContact O-CD2 3.33Å; V484-F488 PolarHBondContact O-N 2.94Å; Q485-F488 PolarHBondContact O-N 3.08Å; Y486-F488 VanDerWaalsContact C-N 3.31Å; Y486-F488 PolarHBondContact O-N 2.89Å
489	K	96.7	Very high	95.1	Very high	131 Å²	131	59.4 Å²	59.4	57%	0.57	28%	0.277	S	S	*	.	H	α-helix	trans	-107.6	-33.7	-168.4	-166.6	175.8	172.7	-164.3	0	114.6	Q485 Y486	Q485-K489 VanDerWaalsContact O-CB 3.28Å; Q485-K489 WeakPolarHBondContact O-CB 3.4Å; Q485-K489 PolarHBondContact O-N 2.84Å; Y486-K489 PolarHBondContact O-N 2.94Å
490	Y	97.6	Very high	94.7	Very high	9 Å²	9	63.5 Å²	63.5	4%	0.035	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	-19.2	-164.8	-56.6	-55.9	0	0	0	114.5	P456 D464 Y465 Y486 K492 E493 V494	P456-Y490 HydrophobicContact CG-CE1 3.93Å; P456-Y490 WeakPolarHBondContact CG-OH 3.26Å; D464-Y490 HydrophobicContact CB-CD2 4.42Å; D464-Y490 HydrophobicContact CB-CE2 3.6Å; D464-Y490 WeakPolarHBondContact OD2-CE2 3.23Å; D464-Y490 PolarHBondContact OD2-OH 3.43Å; Y465-Y490 HydrophobicContact CD1-CD1 4.08Å; Y465-Y490 AromaticContact CD1-CD2 3.71Å; Y465-Y490 HydrophobicContact CD1-CD2 3.71Å; Y465-Y490 HydrophobicContact CD1-CE2 4.29Å; Y465-Y490 AromaticContact CD1-CG 3.59Å; Y465-Y490 HydrophobicContact CD1-CG 3.59Å; Y465-Y490 AromaticContact CE1-CD1 3.66Å; Y465-Y490 HydrophobicContact CE1-CD1 3.66Å; Y465-Y490 HydrophobicContact CE1-CD2 4.17Å; Y465-Y490 HydrophobicContact CE1-CE1 4.28Å; Y465-Y490 AromaticContact CE1-CG 3.6Å; Y465-Y490 HydrophobicContact CE1-CG 3.6Å; Y486-Y490 WeakPolarHBondContact O-CA 3.36Å; Y486-Y490 PolarHBondContact O-N 2.78Å; Y490-K492 VanDerWaalsContact C-N 3.34Å; Y490-K492 PolarHBondContact O-N 3.18Å; Y490-E493 PolarHBondContact O-N 3.3Å; Y490-V494 WeakPolarHBondContact O-CG2 3.31Å; Y490-V494 PolarHBondContact O-N 2.9Å
491	E	95.6	Very high	94.2	Very high	55 Å²	55	68.6 Å²	68.6	26%	0.257	33%	0.333	S	S	.	.	H	α-helix	trans	-53.7	-47.8	-177.3	179.8	175.4	-157.4	0	0	112.5	Y486 K487 V494 N495	Y486-E491 HydrophobicContact CD1-CB 4.49Å; Y486-E491 HydrophobicContact CE1-CB 4.05Å; Y486-E491 HydrophobicContact CE1-CG 4.44Å; Y486-E491 PolarHBondContact O-N 2.92Å; K487-E491 WeakPolarHBondContact CG-OE2 3.3Å; E491-V494 PolarHBondContact O-N 3.24Å; E491-N495 WeakPolarHBondContact O-CB 3.45Å; E491-N495 VanDerWaalsContact O-CG 3.27Å; E491-N495 PolarHBondContact O-N 2.84Å; E491-N495 PolarHBondContact O-ND2 3.46Å
492	K	94.7	Very high	93.5	Very high	152 Å²	152	72.3 Å²	72.3	66%	0.661	35%	0.349	S	S	*	.	H	α-helix	trans	-59.9	-49.1	178.4	-178.2	178.4	171.4	-178.5	0	112.3	Y490 V494 N495 E496	Y490-K492 VanDerWaalsContact C-N 3.34Å; Y490-K492 PolarHBondContact O-N 3.18Å; K492-V494 VanDerWaalsContact C-N 3.32Å; K492-V494 PolarHBondContact O-N 3.26Å; K492-N495 PolarHBondContact O-N 3.32Å; K492-E496 WeakPolarHBondContact CE-OE1 3.36Å; K492-E496 IonicContact NZ-OE1 3.4Å; K492-E496 WeakPolarHBondContact O-CG 3.34Å; K492-E496 PolarHBondContact O-N 3.44Å
493	E	96.1	Very high	92.9	Very high	77 Å²	77	69.2 Å²	69.2	36%	0.36	33%	0.333	S	S	.	.	H	α-helix	trans	-61	-42.2	179.8	-175	-159.8	149.4	0	0	111.4	K453 Y465 Y490 F497	K453-E493 VanDerWaalsContact CE-OE1 3.32Å; K453-E493 WeakPolarHBondContact CE-OE1 3.29Å; K453-E493 IonicContact NZ-OE1 2.74Å; K453-E493 PolarHBondContact NZ-OE1 2.79Å; Y465-E493 PolarHBondContact OH-OE1 2.79Å; Y490-E493 PolarHBondContact O-N 3.3Å; E493-F497 WeakPolarHBondContact O-CB 3.4Å; E493-F497 PolarHBondContact O-N 3.07Å
494	V	96.4	Very high	92.1	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-68.3	-42	178.8	173.8	0	0	0	0	110.9	Y465 V467 V478 Y486 Y490 E491 K492 F497 L498	Y465-V494 HydrophobicContact CD2-CG2 3.86Å; Y465-V494 HydrophobicContact CE1-CG2 4.34Å; Y465-V494 HydrophobicContact CE2-CG2 3.4Å; Y465-V494 VanDerWaalsContact CE2-CG2 3.4Å; V467-V494 HydrophobicContact CG2-CG1 4.12Å; V478-V494 HydrophobicContact CG1-CG1 4.3Å; V478-V494 HydrophobicContact CG2-CG1 3.91Å; Y486-V494 HydrophobicContact CE2-CB 4.42Å; Y486-V494 HydrophobicContact CE2-CG2 3.93Å; Y486-V494 WeakPolarHBondContact OH-CB 3.35Å; Y486-V494 WeakPolarHBondContact OH-CG1 3.33Å; Y490-V494 WeakPolarHBondContact O-CG2 3.31Å; Y490-V494 PolarHBondContact O-N 2.9Å; E491-V494 PolarHBondContact O-N 3.24Å; K492-V494 VanDerWaalsContact C-N 3.32Å; K492-V494 PolarHBondContact O-N 3.26Å; V494-F497 WeakPolarHBondContact O-CB 3.41Å; V494-F497 PolarHBondContact O-N 3.05Å; V494-L498 HydrophobicContact CG1-CD1 3.9Å; V494-L498 HydrophobicContact CG1-CG 4.15Å; V494-L498 WeakPolarHBondContact O-CB 3.2Å; V494-L498 VanDerWaalsContact O-CG 3.23Å; V494-L498 WeakPolarHBondContact O-CG 3.49Å; V494-L498 PolarHBondContact O-N 3.36Å
495	N	93	Very high	90.8	Very high	54 Å²	54	67.8 Å²	67.8	29%	0.289	33%	0.327	S	S	.	.	H	α-helix	trans	-60.9	-46.5	175.4	-73.8	-21.4	0	0	0	111.6	E491 K492 F497 L498 E499	E491-N495 WeakPolarHBondContact O-CB 3.45Å; E491-N495 VanDerWaalsContact O-CG 3.27Å; E491-N495 PolarHBondContact O-N 2.84Å; E491-N495 PolarHBondContact O-ND2 3.46Å; K492-N495 PolarHBondContact O-N 3.32Å; N495-F497 VanDerWaalsContact C-N 3.3Å; N495-F497 PolarHBondContact O-N 2.96Å; N495-L498 PolarHBondContact O-N 3.02Å; N495-E499 WeakPolarHBondContact O-CB 3.12Å; N495-E499 VanDerWaalsContact O-CG 3.32Å; N495-E499 WeakPolarHBondContact O-CG 3.28Å; N495-E499 PolarHBondContact O-N 3.41Å
496	E	93.6	Very high	89.3	Confident	105 Å²	105	66.6 Å²	66.6	49%	0.491	33%	0.333	S	S	.	.	H	α-helix	trans	-59	-41	174.9	-72.9	173	-179.6	0	0	111.8	K492 A500	K492-E496 WeakPolarHBondContact CE-OE1 3.36Å; K492-E496 IonicContact NZ-OE1 3.4Å; K492-E496 WeakPolarHBondContact O-CG 3.34Å; K492-E496 PolarHBondContact O-N 3.44Å; E496-A500 VanDerWaalsContact O-CB 3.26Å; E496-A500 WeakPolarHBondContact O-CB 3.46Å; E496-A500 PolarHBondContact O-N 3.16Å
497	F	94.5	Very high	87.5	Confident	38 Å²	38	69 Å²	69	17%	0.167	34%	0.342	C	S	.	.	H	α-helix	trans	-63.3	-45.6	174.8	169.8	-98	0	0	0	112.6	I452 K453 V467 E493 V494 N495 A500 K501	I452-F497 HydrophobicContact CD1-CE1 3.89Å; I452-F497 HydrophobicContact CD1-CZ 4.28Å; I452-F497 HydrophobicContact CG1-CE1 4.11Å; I452-F497 HydrophobicContact CG1-CZ 4.31Å; I452-F497 WeakPolarHBondContact O-CZ 3.42Å; K453-F497 HydrophobicContact CB-CD1 4.3Å; K453-F497 HydrophobicContact CB-CE1 3.76Å; K453-F497 HydrophobicContact CB-CE2 4.25Å; K453-F497 HydrophobicContact CB-CZ 3.73Å; K453-F497 HydrophobicContact CD-CB 3.94Å; K453-F497 HydrophobicContact CD-CD1 3.56Å; K453-F497 HydrophobicContact CD-CD2 3.51Å; K453-F497 HydrophobicContact CD-CE1 3.85Å; K453-F497 HydrophobicContact CD-CE2 3.79Å; K453-F497 HydrophobicContact CD-CG 3.37Å; K453-F497 HydrophobicContact CD-CZ 3.95Å; K453-F497 HydrophobicContact CG-CE1 4.5Å; K453-F497 HydrophobicContact CG-CZ 4.47Å; V467-F497 HydrophobicContact CG1-CE1 4.46Å; E493-F497 WeakPolarHBondContact O-CB 3.4Å; E493-F497 PolarHBondContact O-N 3.07Å; V494-F497 WeakPolarHBondContact O-CB 3.41Å; V494-F497 PolarHBondContact O-N 3.05Å; N495-F497 VanDerWaalsContact C-N 3.3Å; N495-F497 PolarHBondContact O-N 2.96Å; F497-A500 PolarHBondContact O-N 3.47Å; F497-K501 HydrophobicContact CD2-CG 4.26Å; F497-K501 HydrophobicContact CE1-CG 4.17Å; F497-K501 HydrophobicContact CE2-CD 4.35Å; F497-K501 VanDerWaalsContact CE2-CE 3.48Å; F497-K501 HydrophobicContact CE2-CG 3.88Å; F497-K501 HydrophobicContact CZ-CD 4.42Å; F497-K501 HydrophobicContact CZ-CG 3.82Å; F497-K501 WeakPolarHBondContact O-CB 3.31Å; F497-K501 VanDerWaalsContact O-CG 3.31Å; F497-K501 WeakPolarHBondContact O-CG 3.47Å; F497-K501 PolarHBondContact O-N 3.46Å
498	L	92	Very high	86.1	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.9	-37.3	-179.8	-68.3	178.2	0	0	0	111.6	V467 L476 V478 V494 N495 K502 L503 I504	V467-L498 HydrophobicContact CG1-CD2 3.99Å; L476-L498 HydrophobicContact CD1-CD2 3.62Å; L476-L498 HydrophobicContact CD2-CD1 4.21Å; L476-L498 HydrophobicContact CD2-CD2 4.27Å; V478-L498 HydrophobicContact CG2-CD1 4.4Å; V494-L498 HydrophobicContact CG1-CD1 3.9Å; V494-L498 HydrophobicContact CG1-CG 4.15Å; V494-L498 WeakPolarHBondContact O-CB 3.2Å; V494-L498 VanDerWaalsContact O-CG 3.23Å; V494-L498 WeakPolarHBondContact O-CG 3.49Å; V494-L498 PolarHBondContact O-N 3.36Å; N495-L498 PolarHBondContact O-N 3.02Å; L498-K502 PolarHBondContact O-N 2.75Å; L498-L503 HydrophobicContact CB-CB 4.39Å; L498-L503 HydrophobicContact CD2-CB 4.22Å; L498-L503 HydrophobicContact CD2-CD1 3.65Å; L498-L503 WeakPolarHBondContact O-CB 3.44Å; L498-L503 PolarHBondContact O-N 3.29Å; L498-I504 HydrophobicContact CB-CB 4.39Å; L498-I504 HydrophobicContact CB-CD1 3.59Å; L498-I504 HydrophobicContact CB-CG1 3.78Å; L498-I504 HydrophobicContact CD1-CD1 3.5Å; L498-I504 VanDerWaalsContact CD1-CD1 3.5Å; L498-I504 HydrophobicContact CD1-CG1 4.26Å; L498-I504 HydrophobicContact CG-CD1 4.17Å; L498-I504 PolarHBondContact O-N 3.06Å
499	E	89.2	Confident	84.7	Confident	88 Å²	88	60.8 Å²	60.8	41%	0.411	31%	0.306	S	S	.	.	H	α-helix	trans	-64.9	-47.1	171.9	-71.3	-174	163.5	0	0	111.4	N495 K501 K502 I504 K509	N495-E499 WeakPolarHBondContact O-CB 3.12Å; N495-E499 VanDerWaalsContact O-CG 3.32Å; N495-E499 WeakPolarHBondContact O-CG 3.28Å; N495-E499 PolarHBondContact O-N 3.41Å; E499-K501 VanDerWaalsContact C-N 3.25Å; E499-K501 PolarHBondContact O-N 3.48Å; E499-K502 WeakPolarHBondContact O-CA 3.29Å; E499-K502 PolarHBondContact O-N 3.47Å; E499-I504 HydrophobicContact CG-CB 4.29Å; E499-K509 IonicContact OE1-NZ 3.92Å; E499-K509 PolarHBondContact OE1-NZ 3.23Å
500	A	89.4	Confident	83.1	Confident	85 Å²	85	57.9 Å²	57.9	70%	0.702	31%	0.307	S	S	*	.	H	α-helix	trans	-61.7	-32.8	178.1	0	0	0	0	0	112.8	E496 F497 K502	E496-A500 VanDerWaalsContact O-CB 3.26Å; E496-A500 WeakPolarHBondContact O-CB 3.46Å; E496-A500 PolarHBondContact O-N 3.16Å; F497-A500 PolarHBondContact O-N 3.47Å; A500-K502 PolarHBondContact O-N 3.32Å
501	K	87.4	Confident	81.7	Confident	107 Å²	107	60.9 Å²	60.9	47%	0.465	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	1.2	173.6	-68.2	-68.4	-175	-179.9	0	113.7	F497 E499 L503	F497-K501 HydrophobicContact CD2-CG 4.26Å; F497-K501 HydrophobicContact CE1-CG 4.17Å; F497-K501 HydrophobicContact CE2-CD 4.35Å; F497-K501 VanDerWaalsContact CE2-CE 3.48Å; F497-K501 HydrophobicContact CE2-CG 3.88Å; F497-K501 HydrophobicContact CZ-CD 4.42Å; F497-K501 HydrophobicContact CZ-CG 3.82Å; F497-K501 WeakPolarHBondContact O-CB 3.31Å; F497-K501 VanDerWaalsContact O-CG 3.31Å; F497-K501 WeakPolarHBondContact O-CG 3.47Å; F497-K501 PolarHBondContact O-N 3.46Å; E499-K501 VanDerWaalsContact C-N 3.25Å; E499-K501 PolarHBondContact O-N 3.48Å; K501-L503 HydrophobicContact CB-CD1 3.75Å; K501-L503 HydrophobicContact CB-CG 3.83Å; K501-L503 PolarHBondContact O-N 2.91Å
502	K	81.6	Confident	80.6	Confident	98 Å²	98	62.8 Å²	62.8	43%	0.426	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	26.3	-173.9	-54.3	-169.7	176.1	-156.6	0	113.9	D110 L498 E499 A500 A505	D110-K502 IonicContact OD1-NZ 2.62Å; D110-K502 PolarHBondContact OD1-NZ 3.18Å; D110-K502 IonicContact OD2-NZ 2.72Å; D110-K502 PolarHBondContact OD2-NZ 3.43Å; L498-K502 PolarHBondContact O-N 2.75Å; E499-K502 WeakPolarHBondContact O-CA 3.29Å; E499-K502 PolarHBondContact O-N 3.47Å; A500-K502 PolarHBondContact O-N 3.32Å; K502-A505 HydrophobicContact CB-CB 4.41Å
503	L	82.7	Confident	79.9	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.01	30%	0.303	C	S	.	.	S	Bend	trans	-82.3	-30.7	174	-61.2	170.1	0	0	0	110.4	I452 N473 Y474 L476 L498 K501 S508	I452-L503 HydrophobicContact CD1-CD1 3.7Å; N473-L503 HydrophobicContact CB-CD2 3.46Å; N473-L503 VanDerWaalsContact CB-CD2 3.46Å; N473-L503 VanDerWaalsContact CG-CD2 3.43Å; N473-L503 VanDerWaalsContact ND2-CD2 3.31Å; N473-L503 WeakPolarHBondContact ND2-CD2 3.36Å; Y474-L503 PolarHBondContact OH-O 3.39Å; L476-L503 HydrophobicContact CD1-CB 4.2Å; L476-L503 HydrophobicContact CD1-CD1 3.71Å; L476-L503 HydrophobicContact CD1-CD2 4.48Å; L476-L503 HydrophobicContact CD1-CG 4.35Å; L498-L503 HydrophobicContact CB-CB 4.39Å; L498-L503 HydrophobicContact CD2-CB 4.22Å; L498-L503 HydrophobicContact CD2-CD1 3.65Å; L498-L503 WeakPolarHBondContact O-CB 3.44Å; L498-L503 PolarHBondContact O-N 3.29Å; K501-L503 HydrophobicContact CB-CD1 3.75Å; K501-L503 HydrophobicContact CB-CG 3.83Å; K501-L503 PolarHBondContact O-N 2.91Å; L503-S508 WeakPolarHBondContact O-CB 3.19Å; L503-S508 PolarHBondContact O-OG 3.42Å
504	I	76.7	Confident	79.4	Confident	21 Å²	21	52.6 Å²	52.6	11%	0.108	29%	0.291	C	S	.	.	S	Bend	trans	-118.6	79.5	171.8	-56.2	177	0	0	0	108.1	L498 E499 S508 K509 V514	L498-I504 HydrophobicContact CB-CB 4.39Å; L498-I504 HydrophobicContact CB-CD1 3.59Å; L498-I504 HydrophobicContact CB-CG1 3.78Å; L498-I504 HydrophobicContact CD1-CD1 3.5Å; L498-I504 VanDerWaalsContact CD1-CD1 3.5Å; L498-I504 HydrophobicContact CD1-CG1 4.26Å; L498-I504 HydrophobicContact CG-CD1 4.17Å; L498-I504 PolarHBondContact O-N 3.06Å; E499-I504 HydrophobicContact CG-CB 4.29Å; I504-S508 VanDerWaalsContact CA-OG 3.3Å; I504-S508 WeakPolarHBondContact CA-OG 3.41Å; I504-K509 HydrophobicContact CG2-CD 4.09Å; I504-K509 HydrophobicContact CG2-CG 3.57Å; I504-V514 HydrophobicContact CD1-CB 4.2Å; I504-V514 HydrophobicContact CD1-CG1 3.8Å; I504-V514 HydrophobicContact CG1-CB 3.97Å; I504-V514 HydrophobicContact CG1-CG1 4.04Å; I504-V514 HydrophobicContact CG1-CG2 4.1Å
505	A	67	Low	79	Confident	35 Å²	35	53.1 Å²	53.1	29%	0.289	30%	0.295	S	S	.	.	S	Bend	trans	-143.7	135.8	-179.4	0	0	0	0	0	111.6	K502 W507 S508	K502-A505 HydrophobicContact CB-CB 4.41Å; A505-W507 PolarHBondContact O-N 3.07Å; A505-S508 PolarHBondContact N-OG 3.38Å; A505-S508 PolarHBondContact O-N 2.74Å; A505-S508 PolarHBondContact O-OG 3.44Å
506	G	63.2	Low	78.9	Confident	44 Å²	44	54.7 Å²	54.7	45%	0.454	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	-96.7	171.4	0	0	0	0	0	114	S508 K509 A510	G506-S508 PolarHBondContact O-N 2.85Å; G506-K509 PolarHBondContact O-N 3.2Å; G506-A510 WeakPolarHBondContact O-CB 3.39Å; G506-A510 PolarHBondContact O-N 3.41Å
507	W	59.7	Low	78.8	Confident	58 Å²	58	50.5 Å²	50.5	22%	0.22	29%	0.29	C	S	.	.	H	α-helix	trans	-64.1	-35	-178.1	69.3	-89	0	0	0	113.7	L345 L352 Y474 A505 A510 L511 L513	L345-W507 HydrophobicContact CD2-CH2 3.52Å; L345-W507 HydrophobicContact CD2-CZ3 3.34Å; L352-W507 HydrophobicContact CB-CH2 4.41Å; L352-W507 HydrophobicContact CD1-CE3 4.19Å; L352-W507 HydrophobicContact CD1-CH2 4.15Å; L352-W507 HydrophobicContact CD1-CZ3 3.85Å; L352-W507 HydrophobicContact CD2-CD2 4.44Å; L352-W507 HydrophobicContact CD2-CZ2 4.26Å; Y474-W507 HydrophobicContact CD2-CH2 4.41Å; Y474-W507 AromaticContact CE2-CH2 3.62Å; Y474-W507 HydrophobicContact CE2-CH2 3.62Å; Y474-W507 HydrophobicContact CE2-CZ2 4.1Å; A505-W507 PolarHBondContact O-N 3.07Å; W507-A510 PolarHBondContact O-N 3.21Å; W507-L511 HydrophobicContact CE3-CD1 4.07Å; W507-L511 WeakPolarHBondContact O-CB 3.39Å; W507-L511 WeakPolarHBondContact O-CG 3.4Å; W507-L511 PolarHBondContact O-N 3.12Å; W507-L513 HydrophobicContact CE3-CD1 3.51Å; W507-L513 HydrophobicContact CH2-CD1 3.73Å; W507-L513 HydrophobicContact CZ3-CD1 2.97Å; W507-L513 HydrophobicContact CZ3-CG 4.43Å
508	S	64.9	Low	78.5	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.014	30%	0.302	C	S	.	.	H	α-helix	trans	-73.2	-30.7	179.9	67.6	0	0	0	0	112.6	Y474 L503 I504 A505 G506 N512 L513	Y474-S508 WeakPolarHBondContact OH-CB 3.46Å; L503-S508 WeakPolarHBondContact O-CB 3.19Å; L503-S508 PolarHBondContact O-OG 3.42Å; I504-S508 VanDerWaalsContact CA-OG 3.3Å; I504-S508 WeakPolarHBondContact CA-OG 3.41Å; A505-S508 PolarHBondContact N-OG 3.38Å; A505-S508 PolarHBondContact O-N 2.74Å; A505-S508 PolarHBondContact O-OG 3.44Å; G506-S508 PolarHBondContact O-N 2.85Å; S508-N512 PolarHBondContact O-N 3.23Å; S508-L513 PolarHBondContact O-N 2.82Å
509	K	67.3	Low	78.2	Confident	115 Å²	115	56 Å²	56	50%	0.5	32%	0.316	S	S	.	.	H	α-helix	trans	-68	-45.6	166.5	-69.3	-171	179.7	-177.5	0	110.8	E499 I504 G506 L511 N512	E499-K509 IonicContact OE1-NZ 3.92Å; E499-K509 PolarHBondContact OE1-NZ 3.23Å; I504-K509 HydrophobicContact CG2-CD 4.09Å; I504-K509 HydrophobicContact CG2-CG 3.57Å; G506-K509 PolarHBondContact O-N 3.2Å; K509-L511 VanDerWaalsContact C-N 3.29Å; K509-L511 PolarHBondContact O-N 3.48Å; K509-N512 PolarHBondContact O-N 3.45Å
510	A	62.1	Low	78	Confident	71 Å²	71	58.3 Å²	58.3	59%	0.587	33%	0.331	S	S	*	.	H	α-helix	trans	-62.6	-34.5	-179.2	0	0	0	0	0	113.3	G506 W507	G506-A510 WeakPolarHBondContact O-CB 3.39Å; G506-A510 PolarHBondContact O-N 3.41Å; W507-A510 PolarHBondContact O-N 3.21Å
511	L	67.8	Low	77.7	Confident	71 Å²	71	58.5 Å²	58.5	37%	0.372	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	6.1	178.9	-64.1	-177.8	0	0	0	113.5	L341 W507 K509 L513	L341-L511 HydrophobicContact CD1-CD1 3.87Å; W507-L511 HydrophobicContact CE3-CD1 4.07Å; W507-L511 WeakPolarHBondContact O-CB 3.39Å; W507-L511 WeakPolarHBondContact O-CG 3.4Å; W507-L511 PolarHBondContact O-N 3.12Å; K509-L511 VanDerWaalsContact C-N 3.29Å; K509-L511 PolarHBondContact O-N 3.48Å; L511-L513 HydrophobicContact CB-CD1 4.17Å; L511-L513 HydrophobicContact CB-CD2 3.79Å; L511-L513 HydrophobicContact CB-CG 3.68Å; L511-L513 HydrophobicContact CD1-CD1 4.4Å; L511-L513 PolarHBondContact O-N 2.67Å; L511-L513 VanDerWaalsContact O-N 3.16Å
512	N	73.7	Confident	77.7	Confident	95 Å²	95	54.2 Å²	54.2	51%	0.508	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	41.6	-177.3	-164.3	28.6	0	0	0	113.1	S508 K509 V514	S508-N512 PolarHBondContact O-N 3.23Å; K509-N512 PolarHBondContact O-N 3.45Å; N512-V514 PolarHBondContact O-N 3.45Å
513	L	78.8	Confident	77.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.314	C	S	.	.			trans	-76	-16.1	-175.2	-60.3	-179.9	0	0	0	113.2	L341 L345 S378 P380 Y474 W507 S508 L511	L341-L513 HydrophobicContact CD2-CD2 4.14Å; L345-L513 HydrophobicContact CD1-CD1 4.04Å; L345-L513 HydrophobicContact CD1-CD2 3.92Å; L345-L513 HydrophobicContact CD2-CD1 4.38Å; S378-L513 WeakPolarHBondContact CA-O 3.17Å; S378-L513 WeakPolarHBondContact CB-O 3.32Å; S378-L513 PolarHBondContact OG-O 3.16Å; P380-L513 HydrophobicContact CG-CD2 3.55Å; Y474-L513 HydrophobicContact CE1-CB 4.1Å; W507-L513 HydrophobicContact CE3-CD1 3.51Å; W507-L513 HydrophobicContact CH2-CD1 3.73Å; W507-L513 HydrophobicContact CZ3-CD1 2.97Å; W507-L513 HydrophobicContact CZ3-CG 4.43Å; S508-L513 PolarHBondContact O-N 2.82Å; L511-L513 HydrophobicContact CB-CD1 4.17Å; L511-L513 HydrophobicContact CB-CD2 3.79Å; L511-L513 HydrophobicContact CB-CG 3.68Å; L511-L513 HydrophobicContact CD1-CD1 4.4Å; L511-L513 PolarHBondContact O-N 2.67Å; L511-L513 VanDerWaalsContact O-N 3.16Å
514	V	86	Confident	77.8	Confident	16 Å²	16	56.3 Å²	56.3	10%	0.097	32%	0.321	C	S	.	.	S	Bend	trans	-134.9	120	175	-173.2	0	0	0	0	106.5	V376 Y377 Y474 L476 I504 N512	V376-V514 HydrophobicContact CG1-CG1 3.28Å; Y377-V514 WeakPolarHBondContact O-CA 3.47Å; Y474-V514 HydrophobicContact CD1-CG2 4.41Å; Y474-V514 HydrophobicContact CE1-CG2 3.6Å; L476-V514 HydrophobicContact CD2-CG1 4.08Å; I504-V514 HydrophobicContact CD1-CB 4.2Å; I504-V514 HydrophobicContact CD1-CG1 3.8Å; I504-V514 HydrophobicContact CG1-CB 3.97Å; I504-V514 HydrophobicContact CG1-CG1 4.04Å; I504-V514 HydrophobicContact CG1-CG2 4.1Å; N512-V514 PolarHBondContact O-N 3.45Å
515	A	88.2	Confident	77.8	Confident	10 Å²	10	56.8 Å²	56.8	8%	0.083	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	141.8	-179.6	0	0	0	0	0	110.1	V376 Y377 P379	V376-A515 WeakPolarHBondContact CA-O 3.5Å; V376-A515 WeakPolarHBondContact CG1-O 3.4Å; Y377-A515 WeakPolarHBondContact CD1-O 3.48Å; Y377-A515 HydrophobicContact CE1-CB 4.09Å; Y377-A515 PolarHBondContact N-O 3.19Å; Y377-A515 PolarHBondContact O-N 3.22Å; P379-A515 HydrophobicContact CG-CB 3.63Å
516	P	91.2	Very high	77.9	Confident	87 Å²	87	60.6 Å²	60.6	57%	0.565	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	150.1	167.9	31	-34	0	0	0	110.2	V375	V375-P516 CarbonylContact O-C 3.55Å; V375-P516 WeakPolarHBondContact O-CA 3.39Å
517	V	91	Very high	78.1	Confident	18 Å²	18	63.2 Å²	63.2	11%	0.109	35%	0.354	C	S	.	.			trans	-87.3	126.3	171.4	178.7	0	0	0	0	108.6	Q374 V375 Y377 Y519 C522	Q374-V517 HydrophobicContact CG-CG2 4.1Å; V375-V517 PolarHBondContact O-N 3.47Å; Y377-V517 HydrophobicContact CD1-CG2 3.59Å; Y377-V517 HydrophobicContact CE1-CG2 4.03Å; Y377-V517 HydrophobicContact CG-CG2 4.37Å; V517-Y519 PolarHBondContact O-N 3.37Å; V517-Y519 VanDerWaalsContact O-N 3.07Å; V517-C522 WeakPolarHBondContact CG1-SG 3.4Å
518	D	88.1	Confident	78.2	Confident	77 Å²	77	64.1 Å²	64.1	41%	0.412	36%	0.363	S	S	.	.			trans	-77.3	93.8	168.6	-170.6	-3.7	0	0	0	109.8	N520 L521	D518-N520 PolarHBondContact O-N 3.17Å; D518-N520 VanDerWaalsContact O-N 3.12Å; D518-N520 WeakPolarHBondContact OD1-CB 3.39Å; D518-N520 PolarHBondContact OD1-N 3.04Å; D518-N520 PolarHBondContact OD1-ND2 3.04Å; D518-L521 HydrophobicContact CB-CD1 4.08Å; D518-L521 HydrophobicContact CB-CG 4.23Å; D518-L521 PolarHBondContact O-N 2.85Å
519	Y	85.2	Confident	78	Confident	77 Å²	77	64.9 Å²	64.9	30%	0.302	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-59.9	-23.3	-176.8	-172.4	-102.1	0	0	0	113.5	Y373 P483 V517 L521 C522 F524	Y373-Y519 HydrophobicContact CD1-CE2 4.1Å; P483-Y519 HydrophobicContact CB-CD1 4.12Å; P483-Y519 HydrophobicContact CB-CD2 3.59Å; P483-Y519 HydrophobicContact CB-CE1 4.43Å; P483-Y519 HydrophobicContact CB-CE2 3.94Å; P483-Y519 HydrophobicContact CB-CG 3.68Å; P483-Y519 HydrophobicContact CG-CD2 3.6Å; P483-Y519 HydrophobicContact CG-CE2 3.51Å; P483-Y519 HydrophobicContact CG-CG 4.19Å; V517-Y519 PolarHBondContact O-N 3.37Å; V517-Y519 VanDerWaalsContact O-N 3.07Å; Y519-L521 PolarHBondContact O-N 3.1Å; Y519-C522 HydrophobicContact CD2-CB 4.29Å; Y519-C522 PolarHBondContact O-N 2.87Å; Y519-C522 VanDerWaalsContact O-N 3.08Å; Y519-F524 HydrophobicContact CD2-CE2 4.3Å; Y519-F524 HydrophobicContact CE2-CD2 4.17Å; Y519-F524 AromaticContact CE2-CE2 3.63Å; Y519-F524 HydrophobicContact CE2-CE2 3.63Å
520	N	85.1	Confident	77.4	Confident	136 Å²	136	65.2 Å²	65.2	73%	0.727	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-66.4	-20.1	177.2	-61.1	-48.3	0	0	0	112.9	D518	D518-N520 PolarHBondContact O-N 3.17Å; D518-N520 VanDerWaalsContact O-N 3.12Å; D518-N520 WeakPolarHBondContact OD1-CB 3.39Å; D518-N520 PolarHBondContact OD1-N 3.04Å; D518-N520 PolarHBondContact OD1-ND2 3.04Å
521	L	84.9	Confident	76.8	Confident	89 Å²	89	70.8 Å²	70.8	47%	0.466	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-92.2	-8.4	176.8	-56.6	179.3	0	0	0	112.5	T415 D518 Y519	T415-L521 HydrophobicContact CG2-CD1 4.34Å; D518-L521 HydrophobicContact CB-CD1 4.08Å; D518-L521 HydrophobicContact CB-CG 4.23Å; D518-L521 PolarHBondContact O-N 2.85Å; Y519-L521 PolarHBondContact O-N 3.1Å
522	C	86.8	Confident	77.3	Confident	16 Å²	16	70.8 Å²	70.8	11%	0.108	39%	0.394	C	S	.	.			trans	-87.8	123.4	-176.2	-58.2	0	0	0	0	111.1	C386 V517 Y519 F524	C386-C522 VanDerWaalsContact CA-SG 3.53Å; C386-C522 HydrophobicContact CB-CB 3.67Å; C386-C522 WeakPolarHBondContact CB-SG 3.38Å; C386-C522 WeakPolarHBondContact SG-CA 3.43Å; C386-C522 WeakPolarHBondContact SG-CB 3.46Å; C386-C522 CovalentContact SG-SG 2.04Å; C386-C522 PolarHBondContact SG-SG 3.04Å; V517-C522 WeakPolarHBondContact CG1-SG 3.4Å; Y519-C522 HydrophobicContact CD2-CB 4.29Å; Y519-C522 PolarHBondContact O-N 2.87Å; Y519-C522 VanDerWaalsContact O-N 3.08Å; C522-F524 HydrophobicContact CB-CD2 4.29Å; C522-F524 HydrophobicContact CB-CE2 3.53Å; C522-F524 HydrophobicContact CB-CZ 3.97Å
523	V	82.7	Confident	77.5	Confident	110 Å²	110	69.5 Å²	69.5	67%	0.667	39%	0.388	S	S	*	.			trans	-110.6	114.4	174.4	-177.8	0	0	0	0	108.6
524	F	82.9	Confident	77.4	Confident	35 Å²	35	73.3 Å²	73.3	15%	0.154	41%	0.41	C	S	.	.			trans	-106.3	134.4	177	-64.6	-72.5	0	0	0	111.1	Y373 C386 M388 Y411 Y519 C522	Y373-F524 HydrophobicContact CD1-CD2 4.17Å; Y373-F524 AromaticContact CD1-CE2 3.85Å; Y373-F524 HydrophobicContact CD1-CE2 3.85Å; Y373-F524 HydrophobicContact CD1-CZ 4.16Å; Y373-F524 AromaticContact CE1-CD2 3.97Å; Y373-F524 HydrophobicContact CE1-CD2 3.97Å; Y373-F524 HydrophobicContact CE1-CE2 4.14Å; Y373-F524 HydrophobicContact CE1-CG 4.33Å; C386-F524 HydrophobicContact CB-CZ 4.23Å; C386-F524 WeakPolarHBondContact O-CE1 3.44Å; C386-F524 WeakPolarHBondContact O-CZ 3.32Å; M388-F524 HydrophobicContact CB-CD1 3.66Å; M388-F524 HydrophobicContact CB-CE1 3.44Å; M388-F524 VanDerWaalsContact CB-CE1 3.44Å; M388-F524 HydrophobicContact CB-CG 4.5Å; M388-F524 HydrophobicContact CB-CZ 4.12Å; M388-F524 HydrophobicContact CE-CB 4.23Å; M388-F524 HydrophobicContact CE-CD1 4.01Å; M388-F524 HydrophobicContact CE-CG 4.33Å; Y411-F524 HydrophobicContact CD1-CD1 4.07Å; Y411-F524 HydrophobicContact CD1-CE1 4.43Å; Y411-F524 HydrophobicContact CE1-CD1 4.41Å; Y519-F524 HydrophobicContact CD2-CE2 4.3Å; Y519-F524 HydrophobicContact CE2-CD2 4.17Å; Y519-F524 AromaticContact CE2-CE2 3.63Å; Y519-F524 HydrophobicContact CE2-CE2 3.63Å; C522-F524 HydrophobicContact CB-CD2 4.29Å; C522-F524 HydrophobicContact CB-CE2 3.53Å; C522-F524 HydrophobicContact CB-CZ 3.97Å
525	P	77.7	Confident	76.9	Confident	30 Å²	30	76.7 Å²	76.7	20%	0.195	43%	0.428	C	S	.	.			trans	-65.5	125.5	175.1	20.3	-26.7	0	0	0	110.2	Y411 T527 L528	Y411-P525 HydrophobicContact CD1-CG 4.49Å; Y411-P525 HydrophobicContact CD2-CG 4.32Å; Y411-P525 HydrophobicContact CE1-CG 4.08Å; Y411-P525 HydrophobicContact CE2-CG 3.89Å; P525-T527 PolarHBondContact O-N 3.38Å; P525-L528 HydrophobicContact CB-CB 4.15Å; P525-L528 HydrophobicContact CB-CD1 3.63Å; P525-L528 HydrophobicContact CB-CG 4.29Å; P525-L528 HydrophobicContact CG-CB 3.83Å; P525-L528 HydrophobicContact CG-CD1 3.13Å; P525-L528 HydrophobicContact CG-CG 4.02Å
526	P	67.8	Low	76.2	Confident	115 Å²	115	80.9 Å²	80.9	75%	0.747	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-23.8	-171.6	24.4	-33.4	0	0	0	113.6
527	T	68.8	Low	75.2	Confident	100 Å²	100	80.5 Å²	80.5	61%	0.613	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-10.2	-170.3	51.9	0	0	0	0	114.7	P525 F529	P525-T527 PolarHBondContact O-N 3.38Å; T527-F529 PolarHBondContact O-N 2.98Å; T527-F529 VanDerWaalsContact O-N 3.1Å
528	L	62.2	Low	74	Confident	76 Å²	76	84.9 Å²	84.9	40%	0.398	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-11	-172.6	-107.9	158.9	0	0	0	113.1	F409 Y411 P525	F409-L528 HydrophobicContact CE1-CD2 4.47Å; F409-L528 HydrophobicContact CZ-CD2 4.17Å; Y411-L528 HydrophobicContact CD2-CD1 4.02Å; Y411-L528 HydrophobicContact CE2-CD1 3.91Å; P525-L528 HydrophobicContact CB-CB 4.15Å; P525-L528 HydrophobicContact CB-CD1 3.63Å; P525-L528 HydrophobicContact CB-CG 4.29Å; P525-L528 HydrophobicContact CG-CB 3.83Å; P525-L528 HydrophobicContact CG-CD1 3.13Å; P525-L528 HydrophobicContact CG-CG 4.02Å
529	F	59.9	Low	73	Confident	19 Å²	19	85.5 Å²	85.5	8%	0.083	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.7	31.7	-172.7	-66.4	-93.4	0	0	0	113.6	R371 M388 T390 F409 T527 D531	R371-F529 PolarHBondContact NH2-O 2.84Å; M388-F529 HydrophobicContact CE-CD2 3.06Å; M388-F529 HydrophobicContact CE-CE2 3.08Å; M388-F529 HydrophobicContact CE-CG 3.84Å; M388-F529 HydrophobicContact CE-CZ 3.81Å; M388-F529 HydrophobicContact SD-CB 4.23Å; M388-F529 HydrophobicContact SD-CD1 3.72Å; M388-F529 HydrophobicContact SD-CD2 3.31Å; M388-F529 WeakPolarHBondContact SD-CD2 3.32Å; M388-F529 HydrophobicContact SD-CE1 3.59Å; M388-F529 VanDerWaalsContact SD-CE1 3.59Å; M388-F529 HydrophobicContact SD-CE2 3.28Å; M388-F529 WeakPolarHBondContact SD-CE2 3.09Å; M388-F529 HydrophobicContact SD-CG 3.49Å; M388-F529 WeakPolarHBondContact SD-CG 3.44Å; M388-F529 HydrophobicContact SD-CZ 3.35Å; M388-F529 WeakPolarHBondContact SD-CZ 3.04Å; T390-F529 WeakPolarHBondContact OG1-CD1 3.48Å; T390-F529 WeakPolarHBondContact OG1-CE1 3.5Å; F409-F529 HydrophobicContact CB-CE1 4.44Å; F409-F529 HydrophobicContact CD1-CD1 4.21Å; F409-F529 AromaticContact CD1-CE1 3.22Å; F409-F529 HydrophobicContact CD1-CE1 3.22Å; F409-F529 HydrophobicContact CD1-CE2 4.23Å; F409-F529 AromaticContact CD1-CZ 3.24Å; F409-F529 HydrophobicContact CD1-CZ 3.24Å; F409-F529 AromaticContact CE1-CE1 3.74Å; F409-F529 HydrophobicContact CE1-CE1 3.74Å; F409-F529 AromaticContact CE1-CE2 3.91Å; F409-F529 HydrophobicContact CE1-CE2 3.91Å; F409-F529 AromaticContact CE1-CZ 3.34Å; F409-F529 HydrophobicContact CE1-CZ 3.34Å; F409-F529 HydrophobicContact CG-CE1 4.22Å; T527-F529 PolarHBondContact O-N 2.98Å; T527-F529 VanDerWaalsContact O-N 3.1Å; F529-D531 PolarHBondContact O-N 3.03Å; F529-D531 VanDerWaalsContact O-N 3.12Å
530	N	54.6	Low	71.9	Confident	121 Å²	121	86.3 Å²	86.3	65%	0.647	48%	0.484	S	S	*	.			trans	-61.8	118.8	172.4	-71	-19.6	0	0	0	109.1
531	D	49.9	Very low	70.7	Confident	188 Å²	188	81.7 Å²	81.7	100%	1.005	46%	0.462	S	S	*	.			trans	-67.1	0	175.8	-72.7	-42.7	0	0	0	111.7	F529	F529-D531 PolarHBondContact O-N 3.03Å; F529-D531 VanDerWaalsContact O-N 3.12Å

Retrieved 531 of 531 residues in 270.1 ms (Link to these results)

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