A0A087YF19_POEFO Loading...

5-hydroxytryptamine receptor 3A

Forms serotonin (5-hydroxytryptamine/5-HT3)-activated cation-selective channel complexes, which when activated cause fast, depolarizing responses in neurons.

AlphaFold DB , UniProt , Accession A0A087YF19, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 474 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	V	58.7	Low	69	Low	151 Å²	151	142.3 Å²	142.3	92%	0.915	68%	0.679	S	S	*	*				0	-52.7	0	-171	0	0	0	0	112.3	L3 Y4 L5	V1-L3 PolarHBondContact O-N 3.42Å; V1-Y4 PolarHBondContact O-N 3.16Å; V1-L5 HydrophobicContact CG1-CD1 4.12Å; V1-L5 PolarHBondContact O-N 3.48Å
2	Y	60.2	Low	69.5	Low	203 Å²	203	136.5 Å²	136.5	80%	0.796	66%	0.659	S	S	*	*	H	α-helix	trans	-63.3	-37.1	-177	-140.2	-93.9	0	0	0	115.2	R6	Y2-R6 PolarHBondContact O-N 2.99Å
3	L	64	Low	69.3	Low	155 Å²	155	131.2 Å²	131.2	81%	0.812	65%	0.645	S	S	*	*	H	α-helix	trans	-68.9	-34	175.5	-93.9	117.1	0	0	0	113.4	V1 R6 A7	V1-L3 PolarHBondContact O-N 3.42Å; L3-R6 PolarHBondContact O-N 3.49Å; L3-A7 PolarHBondContact O-N 3.47Å
4	Y	61.6	Low	69.1	Low	190 Å²	190	127.7 Å²	127.7	75%	0.745	64%	0.639	S	S	*	*	H	α-helix	trans	-70.9	-38.4	178.6	-93.3	-91.2	0	0	0	111.9	V1 R6 A7 L8	V1-Y4 PolarHBondContact O-N 3.16Å; Y4-R6 VanDerWaalsContact C-N 3.34Å; Y4-R6 PolarHBondContact O-N 3.23Å; Y4-A7 PolarHBondContact O-N 3.35Å; Y4-L8 PolarHBondContact O-N 2.93Å; Y4-L8 VanDerWaalsContact O-N 3.09Å
5	L	69.8	Low	68.8	Low	108 Å²	108	125.1 Å²	125.1	57%	0.565	63%	0.632	S	S	*	*	H	α-helix	trans	-64.3	-36.9	175	-103.2	108.1	0	0	0	112.7	V1 L8 L9	V1-L5 HydrophobicContact CG1-CD1 4.12Å; V1-L5 PolarHBondContact O-N 3.48Å; L5-L8 PolarHBondContact O-N 3.33Å; L5-L9 PolarHBondContact O-N 3.31Å
6	R	74.9	Confident	68.4	Low	177 Å²	177	123 Å²	123	67%	0.668	62%	0.622	S	S	*	*	H	α-helix	trans	-67.5	-38.9	176.7	-107.1	-175.4	175.4	-179.2	-0.9	112.7	Y2 L3 Y4 Y10	Y2-R6 PolarHBondContact O-N 2.99Å; L3-R6 PolarHBondContact O-N 3.49Å; Y4-R6 VanDerWaalsContact C-N 3.34Å; Y4-R6 PolarHBondContact O-N 3.23Å; R6-Y10 PolarHBondContact O-N 3.32Å
7	A	73.2	Confident	67.5	Low	53 Å²	53	121.8 Å²	121.8	44%	0.438	62%	0.617	S	S	.	*	H	α-helix	trans	-66.7	-39.2	176.2	0	0	0	0	0	111.9	L3 Y4 Y10 L11	L3-A7 PolarHBondContact O-N 3.47Å; Y4-A7 PolarHBondContact O-N 3.35Å; A7-Y10 PolarHBondContact O-N 3.15Å; A7-L11 WeakPolarHBondContact O-CG 3.44Å; A7-L11 PolarHBondContact O-N 3.17Å
8	L	73.8	Confident	66.6	Low	112 Å²	112	125.7 Å²	125.7	59%	0.586	62%	0.624	S	S	*	*	H	α-helix	trans	-67.1	-41.4	176.9	-119.1	139	0	0	0	112.3	Y4 L5 Y10 L11 V12	Y4-L8 PolarHBondContact O-N 2.93Å; Y4-L8 VanDerWaalsContact O-N 3.09Å; L5-L8 PolarHBondContact O-N 3.33Å; L8-Y10 VanDerWaalsContact C-N 3.35Å; L8-Y10 PolarHBondContact O-N 3.49Å; L8-L11 PolarHBondContact O-N 3.32Å; L8-V12 WeakPolarHBondContact O-CB 3.33Å; L8-V12 VanDerWaalsContact O-CG2 3.25Å; L8-V12 WeakPolarHBondContact O-CG2 3.4Å; L8-V12 PolarHBondContact O-N 3.43Å
9	L	74.6	Confident	65.6	Low	119 Å²	119	126.9 Å²	126.9	62%	0.623	63%	0.627	S	S	*	*	H	α-helix	trans	-65.3	-36.4	174.4	-84.3	157.8	0	0	0	112.6	L5 S13	L5-L9 PolarHBondContact O-N 3.31Å; L9-S13 VanDerWaalsContact O-CB 3.28Å; L9-S13 WeakPolarHBondContact O-CB 3.45Å; L9-S13 PolarHBondContact O-N 3Å
10	Y	74.6	Confident	64.7	Low	179 Å²	179	127.8 Å²	127.8	70%	0.702	63%	0.63	S	S	*	*	H	α-helix	trans	-68.2	-41.1	174.5	-106.1	-90.6	0	0	0	112.4	R6 A7 L8 S13 C14	R6-Y10 PolarHBondContact O-N 3.32Å; A7-Y10 PolarHBondContact O-N 3.15Å; L8-Y10 VanDerWaalsContact C-N 3.35Å; L8-Y10 PolarHBondContact O-N 3.49Å; Y10-S13 PolarHBondContact O-N 3.16Å; Y10-C14 WeakPolarHBondContact O-CB 3.11Å; Y10-C14 PolarHBondContact O-N 2.69Å
11	L	73.4	Confident	63.7	Low	118 Å²	118	129.8 Å²	129.8	62%	0.618	64%	0.637	S	S	*	*	H	α-helix	trans	-66.5	-41.7	176.5	-78.5	166.1	0	0	0	111.8	A7 L8 C14 V15	A7-L11 WeakPolarHBondContact O-CG 3.44Å; A7-L11 PolarHBondContact O-N 3.17Å; L8-L11 PolarHBondContact O-N 3.32Å; L11-C14 PolarHBondContact O-N 3Å; L11-V15 VanDerWaalsContact O-CG2 3.26Å; L11-V15 WeakPolarHBondContact O-CG2 3.39Å; L11-V15 PolarHBondContact O-N 3.34Å
12	V	74.8	Confident	62.9	Low	73 Å²	73	128.5 Å²	128.5	44%	0.442	62%	0.624	S	S	.	*	H	α-helix	trans	-66.2	-41.3	176.4	172.9	0	0	0	0	111.1	L8 V15 I16	L8-V12 WeakPolarHBondContact O-CB 3.33Å; L8-V12 VanDerWaalsContact O-CG2 3.25Å; L8-V12 WeakPolarHBondContact O-CG2 3.4Å; L8-V12 PolarHBondContact O-N 3.43Å; V12-V15 PolarHBondContact O-N 3.11Å; V12-I16 HydrophobicContact CG1-CD1 3.65Å; V12-I16 HydrophobicContact CG1-CG1 4.39Å; V12-I16 WeakPolarHBondContact O-CB 3.25Å; V12-I16 WeakPolarHBondContact O-CD1 3.44Å; V12-I16 WeakPolarHBondContact O-CG1 3.4Å; V12-I16 PolarHBondContact O-N 2.95Å
13	S	67.9	Low	62	Low	68 Å²	68	128 Å²	128	48%	0.476	63%	0.626	S	S	.	*	H	α-helix	trans	-65.1	-40	175.1	-165.4	0	0	0	0	112.1	L9 Y10 I16 N17	L9-S13 VanDerWaalsContact O-CB 3.28Å; L9-S13 WeakPolarHBondContact O-CB 3.45Å; L9-S13 PolarHBondContact O-N 3Å; Y10-S13 PolarHBondContact O-N 3.16Å; S13-I16 PolarHBondContact O-N 3.13Å; S13-N17 WeakPolarHBondContact O-CB 3.36Å; S13-N17 PolarHBondContact O-N 3.5Å
14	C	65.4	Low	61.1	Low	82 Å²	82	129.4 Å²	129.4	55%	0.554	63%	0.626	S	S	*	*	H	α-helix	trans	-62.6	-43.9	173.1	-101.5	0	0	0	0	112	Y10 L11 N17 W18	Y10-C14 WeakPolarHBondContact O-CB 3.11Å; Y10-C14 PolarHBondContact O-N 2.69Å; L11-C14 PolarHBondContact O-N 3Å; C14-N17 PolarHBondContact O-N 3.4Å; C14-W18 VanDerWaalsContact O-CB 3.27Å; C14-W18 WeakPolarHBondContact O-CB 3.31Å; C14-W18 PolarHBondContact O-N 2.78Å
15	V	65.2	Low	60.2	Low	88 Å²	88	125.7 Å²	125.7	53%	0.533	63%	0.625	S	S	.	*	H	α-helix	trans	-66.5	-39.3	179.2	171.5	0	0	0	0	111.5	L11 V12 W18 Q19	L11-V15 VanDerWaalsContact O-CG2 3.26Å; L11-V15 WeakPolarHBondContact O-CG2 3.39Å; L11-V15 PolarHBondContact O-N 3.34Å; V12-V15 PolarHBondContact O-N 3.11Å; V15-W18 PolarHBondContact O-N 2.97Å; V15-Q19 PolarHBondContact O-N 2.76Å
16	I	61.7	Low	58.9	Low	92 Å²	92	126.3 Å²	126.3	47%	0.472	64%	0.635	S	S	.	*	H	α-helix	trans	-67	-42.2	176.7	-66.9	166.6	0	0	0	111	V12 S13 Q19 Q20	V12-I16 HydrophobicContact CG1-CD1 3.65Å; V12-I16 HydrophobicContact CG1-CG1 4.39Å; V12-I16 WeakPolarHBondContact O-CB 3.25Å; V12-I16 WeakPolarHBondContact O-CD1 3.44Å; V12-I16 WeakPolarHBondContact O-CG1 3.4Å; V12-I16 PolarHBondContact O-N 2.95Å; S13-I16 PolarHBondContact O-N 3.13Å; I16-Q19 PolarHBondContact O-N 3.46Å; I16-Q20 PolarHBondContact O-N 2.87Å
17	N	53	Low	57.7	Low	103 Å²	103	123.1 Å²	123.1	55%	0.551	64%	0.64	S	S	*	*	H	α-helix	trans	-67.6	-37.1	174.9	-106.8	0.6	0	0	0	112.3	S13 C14 Q19 Q20 E21	S13-N17 WeakPolarHBondContact O-CB 3.36Å; S13-N17 PolarHBondContact O-N 3.5Å; C14-N17 PolarHBondContact O-N 3.4Å; N17-Q19 VanDerWaalsContact C-N 3.32Å; N17-Q19 PolarHBondContact O-N 3.31Å; N17-Q20 PolarHBondContact O-N 2.93Å; N17-Q20 VanDerWaalsContact O-N 3.14Å; N17-E21 PolarHBondContact O-N 3Å
18	W	51.8	Low	56.5	Low	192 Å²	192	126.1 Å²	126.1	73%	0.727	65%	0.649	S	S	*	*	H	α-helix	trans	-67.5	-32.8	178.4	-142.8	78.6	0	0	0	112.1	C14 V15 Q20	C14-W18 VanDerWaalsContact O-CB 3.27Å; C14-W18 WeakPolarHBondContact O-CB 3.31Å; C14-W18 PolarHBondContact O-N 2.78Å; V15-W18 PolarHBondContact O-N 2.97Å; W18-Q20 VanDerWaalsContact C-N 3.34Å
19	Q	48.2	Very low	55.5	Low	149 Å²	149	126 Å²	126	70%	0.696	66%	0.655	S	S	*	*	H	α-helix	trans	-71.5	-24.6	171.8	-98	174.2	-52	0	0	113.7	V15 I16 N17	V15-Q19 PolarHBondContact O-N 2.76Å; I16-Q19 PolarHBondContact O-N 3.46Å; N17-Q19 VanDerWaalsContact C-N 3.32Å; N17-Q19 PolarHBondContact O-N 3.31Å
20	Q	47	Very low	54.7	Low	144 Å²	144	122.9 Å²	122.9	67%	0.673	65%	0.652	S	S	*	*	H	α-helix	trans	-84.7	-15.8	177.8	-97.5	173	-17.7	0	0	114.1	I16 N17 W18	I16-Q20 PolarHBondContact O-N 2.87Å; N17-Q20 PolarHBondContact O-N 2.93Å; N17-Q20 VanDerWaalsContact O-N 3.14Å; W18-Q20 VanDerWaalsContact C-N 3.34Å
21	E	43.2	Very low	54.1	Low	169 Å²	169	123.8 Å²	123.8	79%	0.79	65%	0.654	S	S	*	*	S	Bend	trans	-98.9	1.9	-176.8	-127.3	171.1	-167.5	0	0	115.2	N17 K23	N17-E21 PolarHBondContact O-N 3Å; E21-K23 PolarHBondContact O-N 3.39Å
22	I	42	Very low	53.7	Low	125 Å²	125	124.8 Å²	124.8	64%	0.641	65%	0.653	S	S	*	*			trans	-81.5	64.9	160.3	-50.6	179.8	0	0	0	108.4	K24	I22-K24 PolarHBondContact O-N 3.5Å
23	K	41.6	Very low	53.2	Low	193 Å²	193	123.4 Å²	123.4	84%	0.839	65%	0.65	S	S	*	*			trans	-62.8	104.6	159	-102.6	173.7	176.2	171.2	0	106.5	E21	E21-K23 PolarHBondContact O-N 3.39Å
24	K	44.7	Very low	53.5	Low	183 Å²	183	126.9 Å²	126.9	80%	0.796	66%	0.663	S	S	*	*			trans	-44.7	130.6	160	-80	-179.4	176.4	178.8	0	106.9	I22	I22-K24 PolarHBondContact O-N 3.5Å
25	P	42.7	Very low	54.7	Low	112 Å²	112	125.1 Å²	125.1	73%	0.727	65%	0.654	S	S	*	*			trans	-53.2	142.8	172.9	24	-32.2	0	0	0	107.7	S27	P25-S27 PolarHBondContact O-N 3.48Å
26	P	42.6	Very low	55.9	Low	121 Å²	121	122.6 Å²	122.6	79%	0.786	64%	0.639	S	S	*	*			trans	-53.8	119.5	176.9	22.2	-31	0	0	0	107.7	N28	P26-N28 VanDerWaalsContact C-N 3.29Å; P26-N28 PolarHBondContact O-N 3.18Å
27	S	50	Low	57.3	Low	111 Å²	111	123 Å²	123	78%	0.776	64%	0.642	S	S	*	*			trans	-61.7	99.2	169.3	55.3	0	0	0	0	106.1	P25 P29	P25-S27 PolarHBondContact O-N 3.48Å; S27-P29 WeakPolarHBondContact O-CD 3.39Å
28	N	47.8	Very low	59.1	Low	116 Å²	116	120.6 Å²	120.6	62%	0.62	63%	0.631	S	S	*	*			trans	-78.2	96.5	161.1	-109.5	-1.8	0	0	0	105.5	P26 G30 R31	P26-N28 VanDerWaalsContact C-N 3.29Å; P26-N28 PolarHBondContact O-N 3.18Å; N28-G30 PolarHBondContact O-N 2.85Å; N28-R31 HydrophobicContact CB-CB 4.26Å; N28-R31 PolarHBondContact O-N 3.4Å; N28-R31 VanDerWaalsContact O-N 3.16Å
29	P	54.3	Low	61.1	Low	109 Å²	109	117.1 Å²	117.1	71%	0.708	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-25.7	178.2	24.4	-34.8	0	0	0	111.4	S27 R31 A33	S27-P29 WeakPolarHBondContact O-CD 3.39Å; P29-R31 PolarHBondContact O-N 2.99Å; P29-A33 WeakPolarHBondContact O-CB 3.49Å
30	G	56.7	Low	63.3	Low	54 Å²	54	110 Å²	110	56%	0.557	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-12.7	-179.6	0	0	0	0	0	116.7	N28	N28-G30 PolarHBondContact O-N 2.85Å
31	R	62.5	Low	65.5	Low	198 Å²	198	104.5 Å²	104.5	75%	0.747	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-30.6	-174.6	-167.6	175.4	179.7	-178.3	-0.5	113	N28 P29	N28-R31 HydrophobicContact CB-CB 4.26Å; N28-R31 PolarHBondContact O-N 3.4Å; N28-R31 VanDerWaalsContact O-N 3.16Å; P29-R31 PolarHBondContact O-N 2.99Å
32	F	65.1	Low	67.8	Low	138 Å²	138	101.4 Å²	101.4	61%	0.605	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	-10.6	-178.6	-58.3	-73.5	0	0	0	113.3	N34 A35 V38	F32-N34 PolarHBondContact O-N 3.49Å; F32-N34 VanDerWaalsContact O-N 3.12Å; F32-A35 WeakPolarHBondContact O-CB 3.34Å; F32-A35 PolarHBondContact O-N 3.38Å; F32-V38 HydrophobicContact CB-CG2 4.45Å
33	A	63.8	Low	70.3	Confident	45 Å²	45	101 Å²	101	37%	0.372	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.3	-179.4	0	0	0	0	0	114.3	P29 R39	P29-A33 WeakPolarHBondContact O-CB 3.49Å; A33-R39 WeakPolarHBondContact O-CD 3.47Å; A33-R39 WeakPolarHBondContact O-CG 3.26Å
34	N	75	Confident	72.8	Confident	141 Å²	141	92.3 Å²	92.3	75%	0.754	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-9.9	177.2	-72.8	-6.9	0	0	0	113.7	F32 T36	F32-N34 PolarHBondContact O-N 3.49Å; F32-N34 VanDerWaalsContact O-N 3.12Å; N34-T36 PolarHBondContact O-N 3.08Å
35	A	89.1	Confident	75.1	Confident	44 Å²	44	86.7 Å²	86.7	36%	0.364	49%	0.492	S	S	.	.	S	Bend	trans	-71.1	130.6	-179.8	0	0	0	0	0	110.4	F32 L37 V38 R39	F32-A35 WeakPolarHBondContact O-CB 3.34Å; F32-A35 PolarHBondContact O-N 3.38Å; A35-L37 VanDerWaalsContact C-N 3.34Å; A35-L37 PolarHBondContact O-N 2.87Å; A35-V38 HydrophobicContact CB-CB 4.26Å; A35-V38 HydrophobicContact CB-CG2 3.96Å; A35-V38 PolarHBondContact O-N 3.33Å; A35-V38 VanDerWaalsContact O-N 3.07Å; A35-R39 PolarHBondContact O-N 3.09Å
36	T	90.8	Very high	77.5	Confident	36 Å²	36	85 Å²	85	22%	0.221	49%	0.488	C	S	.	.	H	α-helix	trans	-52.9	-48.3	-174.9	-49.8	0	0	0	0	112.7	N34 V38 R39 L40 F105 D106 V108	N34-T36 PolarHBondContact O-N 3.08Å; T36-V38 VanDerWaalsContact C-N 3.32Å; T36-V38 PolarHBondContact O-N 3.46Å; T36-R39 PolarHBondContact O-N 3.4Å; T36-L40 WeakPolarHBondContact O-CB 3.26Å; T36-L40 PolarHBondContact O-N 2.97Å; T36-F105 VanDerWaalsContact CG2-C 3.49Å; T36-F105 HydrophobicContact CG2-CB 3.94Å; T36-F105 WeakPolarHBondContact CG2-O 3.24Å; T36-D106 HydrophobicContact CG2-CB 3.8Å; T36-V108 HydrophobicContact CG2-CG2 4.1Å
37	L	91.6	Very high	79.7	Confident	100 Å²	100	82.5 Å²	82.5	52%	0.524	48%	0.484	S	S	.	.	H	α-helix	trans	-67.1	-31.7	-178.8	-64.3	179.7	0	0	0	113.2	A35 A41 V108 V111	A35-L37 VanDerWaalsContact C-N 3.34Å; A35-L37 PolarHBondContact O-N 2.87Å; L37-A41 VanDerWaalsContact O-CB 3.23Å; L37-A41 WeakPolarHBondContact O-CB 3.43Å; L37-A41 PolarHBondContact O-N 3.42Å; L37-V108 HydrophobicContact CD2-CG1 4.19Å; L37-V108 HydrophobicContact CD2-CG2 4.41Å; L37-V111 HydrophobicContact CD2-CG2 4.24Å
38	V	91.1	Very high	81.9	Confident	53 Å²	53	79.2 Å²	79.2	32%	0.321	46%	0.455	S	S	.	.	H	α-helix	trans	-71	-46.8	176.6	177.9	0	0	0	0	109.5	F32 A35 T36 L40 A41 D42	F32-V38 HydrophobicContact CB-CG2 4.45Å; A35-V38 HydrophobicContact CB-CB 4.26Å; A35-V38 HydrophobicContact CB-CG2 3.96Å; A35-V38 PolarHBondContact O-N 3.33Å; A35-V38 VanDerWaalsContact O-N 3.07Å; T36-V38 VanDerWaalsContact C-N 3.32Å; T36-V38 PolarHBondContact O-N 3.46Å; V38-L40 VanDerWaalsContact C-N 3.32Å; V38-L40 PolarHBondContact O-N 3.01Å; V38-A41 PolarHBondContact O-N 2.97Å; V38-D42 WeakPolarHBondContact O-CB 3.34Å; V38-D42 VanDerWaalsContact O-CG 3.28Å; V38-D42 PolarHBondContact O-N 3.46Å
39	R	93.1	Very high	84.2	Confident	119 Å²	119	80.9 Å²	80.9	45%	0.449	46%	0.456	S	S	.	.	H	α-helix	trans	-58	-43.7	174.9	-69.5	175.1	53.5	-149.3	-10.6	112.2	A33 A35 T36 F43 F105	A33-R39 WeakPolarHBondContact O-CD 3.47Å; A33-R39 WeakPolarHBondContact O-CG 3.26Å; A35-R39 PolarHBondContact O-N 3.09Å; T36-R39 PolarHBondContact O-N 3.4Å; R39-F43 VanDerWaalsContact O-CB 3.3Å; R39-F43 WeakPolarHBondContact O-CB 3.31Å; R39-F43 PolarHBondContact O-N 3.46Å; R39-F105 HydrophobicContact CB-CE1 4.26Å
40	L	94.3	Very high	86	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	44%	0.444	C	S	.	.	H	α-helix	trans	-66.3	-45.5	178	179.1	59.8	0	0	0	111.3	T36 V38 D42 F43 L44 W100 F105 V108 V111	T36-L40 WeakPolarHBondContact O-CB 3.26Å; T36-L40 PolarHBondContact O-N 2.97Å; V38-L40 VanDerWaalsContact C-N 3.32Å; V38-L40 PolarHBondContact O-N 3.01Å; L40-D42 VanDerWaalsContact C-N 3.33Å; L40-D42 PolarHBondContact O-N 3.41Å; L40-F43 WeakPolarHBondContact O-CB 3.47Å; L40-F43 PolarHBondContact O-N 2.94Å; L40-L44 HydrophobicContact CD1-CD1 3.96Å; L40-L44 HydrophobicContact CD1-CG 4.02Å; L40-L44 HydrophobicContact CG-CD1 3.99Å; L40-L44 HydrophobicContact CG-CG 4.43Å; L40-L44 VanDerWaalsContact O-CG 3.31Å; L40-L44 WeakPolarHBondContact O-CG 3.47Å; L40-L44 PolarHBondContact O-N 3.31Å; L40-W100 HydrophobicContact CD1-CB 4Å; L40-W100 HydrophobicContact CD1-CD2 3.79Å; L40-W100 HydrophobicContact CD1-CE3 4.36Å; L40-W100 HydrophobicContact CD1-CG 3.6Å; L40-W100 HydrophobicContact CD2-CD2 4.32Å; L40-W100 HydrophobicContact CD2-CZ2 4.07Å; L40-F105 HydrophobicContact CB-CD1 3.78Å; L40-F105 HydrophobicContact CB-CE1 4.05Å; L40-F105 HydrophobicContact CB-CG 4.3Å; L40-F105 HydrophobicContact CD1-CD1 4.13Å; L40-F105 HydrophobicContact CD1-CD2 3.96Å; L40-F105 HydrophobicContact CD1-CE1 4.17Å; L40-F105 HydrophobicContact CD1-CE2 4.01Å; L40-F105 HydrophobicContact CD1-CG 4.02Å; L40-F105 HydrophobicContact CD1-CZ 4.11Å; L40-V108 HydrophobicContact CD2-CG1 3.94Å; L40-V111 HydrophobicContact CD2-CB 4.12Å; L40-V111 HydrophobicContact CD2-CG1 4.29Å; L40-V111 HydrophobicContact CD2-CG2 4.38Å
41	A	93	Very high	87.8	Confident	27 Å²	27	81.7 Å²	81.7	22%	0.223	46%	0.455	C	S	.	.	H	α-helix	trans	-61.9	-41.5	177.6	0	0	0	0	0	111.9	L37 V38 L44 S45	L37-A41 VanDerWaalsContact O-CB 3.23Å; L37-A41 WeakPolarHBondContact O-CB 3.43Å; L37-A41 PolarHBondContact O-N 3.42Å; V38-A41 PolarHBondContact O-N 2.97Å; A41-L44 PolarHBondContact O-N 3.44Å; A41-S45 WeakPolarHBondContact O-CB 3.32Å; A41-S45 PolarHBondContact O-N 3Å; A41-S45 PolarHBondContact O-OG 3.32Å
42	D	92.5	Very high	89.4	Confident	104 Å²	104	76.4 Å²	76.4	56%	0.556	45%	0.445	S	S	*	.	H	α-helix	trans	-65.7	-41.3	176	-70.7	-22.3	0	0	0	111.4	V38 L40 S45 A46	V38-D42 WeakPolarHBondContact O-CB 3.34Å; V38-D42 VanDerWaalsContact O-CG 3.28Å; V38-D42 PolarHBondContact O-N 3.46Å; L40-D42 VanDerWaalsContact C-N 3.33Å; L40-D42 PolarHBondContact O-N 3.41Å; D42-S45 PolarHBondContact O-N 3.46Å; D42-A46 VanDerWaalsContact O-CB 3.32Å; D42-A46 WeakPolarHBondContact O-CB 3.33Å; D42-A46 PolarHBondContact O-N 2.9Å
43	F	94.4	Very high	90.9	Very high	117 Å²	117	71.3 Å²	71.3	51%	0.513	42%	0.422	S	S	.	.	H	α-helix	trans	-60.1	-48.9	175	175.7	-99.2	0	0	0	112	R39 L40 S45 A46 W100 F105	R39-F43 VanDerWaalsContact O-CB 3.3Å; R39-F43 WeakPolarHBondContact O-CB 3.31Å; R39-F43 PolarHBondContact O-N 3.46Å; L40-F43 WeakPolarHBondContact O-CB 3.47Å; L40-F43 PolarHBondContact O-N 2.94Å; F43-S45 VanDerWaalsContact C-N 3.34Å; F43-S45 PolarHBondContact O-N 3.49Å; F43-A46 PolarHBondContact O-N 2.87Å; F43-W100 HydrophobicContact CE1-CB 4.31Å; F43-F105 HydrophobicContact CB-CE1 4.44Å; F43-F105 HydrophobicContact CB-CZ 4.01Å; F43-F105 HydrophobicContact CD1-CE2 4.34Å; F43-F105 HydrophobicContact CD1-CZ 4.04Å; F43-F105 HydrophobicContact CD2-CZ 4.4Å; F43-F105 AromaticContact CG-CZ 3.89Å; F43-F105 HydrophobicContact CG-CZ 3.89Å
44	L	94.4	Very high	92.5	Very high	10 Å²	10	69.2 Å²	69.2	5%	0.052	40%	0.404	C	S	.	.	H	α-helix	trans	-69.5	-30.6	179.6	-65.4	174.7	0	0	0	112.6	L40 A41 L98 W100 V111 L113	L40-L44 HydrophobicContact CD1-CD1 3.96Å; L40-L44 HydrophobicContact CD1-CG 4.02Å; L40-L44 HydrophobicContact CG-CD1 3.99Å; L40-L44 HydrophobicContact CG-CG 4.43Å; L40-L44 VanDerWaalsContact O-CG 3.31Å; L40-L44 WeakPolarHBondContact O-CG 3.47Å; L40-L44 PolarHBondContact O-N 3.31Å; A41-L44 PolarHBondContact O-N 3.44Å; L44-L98 HydrophobicContact CB-CD2 4.13Å; L44-L98 HydrophobicContact CD2-CD2 4.44Å; L44-W100 HydrophobicContact CD1-CE3 3.98Å; L44-W100 HydrophobicContact CD1-CZ3 4.04Å; L44-W100 HydrophobicContact CD2-CE3 3.95Å; L44-V111 HydrophobicContact CD1-CG1 4.19Å; L44-L113 HydrophobicContact CD1-CD1 4.2Å
45	S	92	Very high	93.5	Very high	65 Å²	65	63.5 Å²	63.5	46%	0.455	37%	0.374	S	S	.	.	H	α-helix	trans	-81.6	-21.8	179.6	-57.7	0	0	0	0	112.8	A41 D42 F43 G47 Y48	A41-S45 WeakPolarHBondContact O-CB 3.32Å; A41-S45 PolarHBondContact O-N 3Å; A41-S45 PolarHBondContact O-OG 3.32Å; D42-S45 PolarHBondContact O-N 3.46Å; F43-S45 VanDerWaalsContact C-N 3.34Å; F43-S45 PolarHBondContact O-N 3.49Å; S45-G47 PolarHBondContact O-N 2.91Å; S45-Y48 PolarHBondContact O-N 3.34Å
46	A	92.9	Very high	93.8	Very high	77 Å²	77	69 Å²	69	64%	0.636	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	107.6	-177.7	0	0	0	0	0	111.2	D42 F43 Y48	D42-A46 VanDerWaalsContact O-CB 3.32Å; D42-A46 WeakPolarHBondContact O-CB 3.33Å; D42-A46 PolarHBondContact O-N 2.9Å; F43-A46 PolarHBondContact O-N 2.87Å; A46-Y48 VanDerWaalsContact C-N 3.28Å; A46-Y48 PolarHBondContact O-N 2.89Å
47	G	89.4	Confident	94.1	Very high	68 Å²	68	70.8 Å²	70.8	70%	0.701	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	-2.6	177.3	0	0	0	0	0	115	S45	S45-G47 PolarHBondContact O-N 2.91Å
48	Y	96.2	Very high	94.3	Very high	43 Å²	43	74.9 Å²	74.9	17%	0.169	41%	0.407	C	S	.	.			trans	-64.5	134.8	177	-172.9	-97.7	0	0	0	111.6	S45 A46 K50 D95 F97 L98 N117 W119	S45-Y48 PolarHBondContact O-N 3.34Å; A46-Y48 VanDerWaalsContact C-N 3.28Å; A46-Y48 PolarHBondContact O-N 2.89Å; Y48-K50 HydrophobicContact CE1-CB 4.36Å; Y48-D95 WeakPolarHBondContact CE2-OD2 3.45Å; Y48-D95 PolarHBondContact OH-OD2 2.93Å; Y48-F97 HydrophobicContact CD2-CB 4.2Å; Y48-F97 HydrophobicContact CE2-CB 4.21Å; Y48-L98 HydrophobicContact CD2-CD2 3.95Å; Y48-L98 HydrophobicContact CD2-CG 4.41Å; Y48-L98 HydrophobicContact CE2-CD1 4.34Å; Y48-L98 HydrophobicContact CE2-CD2 3.87Å; Y48-L98 HydrophobicContact CE2-CG 3.87Å; Y48-N117 WeakPolarHBondContact CD1-O 3.32Å; Y48-N117 VanDerWaalsContact CE1-O 3.23Å; Y48-N117 WeakPolarHBondContact CE1-O 3.37Å; Y48-W119 PolarHBondContact OH-N 3.47Å
49	K	95.5	Very high	94.5	Very high	150 Å²	150	81 Å²	81	65%	0.652	42%	0.424	S	S	*	.			trans	-115.5	92	-178.7	-63	-60.7	-176.1	-177.1	0	110.2	G51 V52	K49-G51 PolarHBondContact O-N 3.24Å; K49-V52 HydrophobicContact CB-CB 4.42Å; K49-V52 HydrophobicContact CB-CG2 3.91Å; K49-V52 PolarHBondContact O-N 2.93Å
50	K	93.1	Very high	94.6	Very high	104 Å²	104	78.2 Å²	78.2	45%	0.452	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-38.2	-178.7	-178.9	-171.3	178.9	179.8	0	115.4	Y48 V52 A116 W119	Y48-K50 HydrophobicContact CE1-CB 4.36Å; K50-V52 PolarHBondContact O-N 3.45Å; K50-A116 WeakPolarHBondContact CD-O 3.29Å; K50-A116 WeakPolarHBondContact CE-O 3.33Å; K50-A116 PolarHBondContact NZ-O 2.88Å; K50-W119 WeakPolarHBondContact O-CB 3.35Å
51	G	93.8	Very high	94.7	Very high	77 Å²	77	80.3 Å²	80.3	79%	0.794	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-6.1	-175	0	0	0	0	0	114.9	K49	K49-G51 PolarHBondContact O-N 3.24Å
52	V	96.1	Very high	95	Very high	87 Å²	87	79.3 Å²	79.3	53%	0.527	43%	0.426	S	S	.	.	S	Bend	trans	-102.7	135.4	-174.5	-176.6	0	0	0	0	109.4	K49 K50	K49-V52 HydrophobicContact CB-CB 4.42Å; K49-V52 HydrophobicContact CB-CG2 3.91Å; K49-V52 PolarHBondContact O-N 2.93Å; K50-V52 PolarHBondContact O-N 3.45Å
53	R	97.1	Very high	95.2	Very high	31 Å²	31	78.6 Å²	78.6	12%	0.117	42%	0.421	C	S	.	.			trans	-59	127.5	173.8	-175.3	165.5	62.6	81.1	-6.9	109.4	V55 W58 T60 W119 D187	R53-V55 VanDerWaalsContact C-N 3.28Å; R53-V55 HydrophobicContact CG-CG2 4.48Å; R53-V55 VanDerWaalsContact NH1-CG1 3.32Å; R53-V55 PolarHBondContact O-N 2.92Å; R53-W58 PolarHBondContact NH2-O 3.35Å; R53-T60 PolarHBondContact NH1-O 2.6Å; R53-W119 HydrophobicContact CB-CZ2 4.44Å; R53-W119 HydrophobicContact CG-CH2 4.41Å; R53-W119 HydrophobicContact CG-CZ2 4.14Å; R53-D187 IonicContact CZ-OD1 2.89Å; R53-D187 IonicContact NE-OD1 3.08Å; R53-D187 PolarHBondContact NE-OD1 3.08Å; R53-D187 IonicContact NH2-OD1 2.96Å; R53-D187 PolarHBondContact NH2-OD1 2.88Å
54	P	96.6	Very high	95.4	Very high	1 Å²	1	73 Å²	73	1%	0.006	40%	0.397	C	S	.	.	S	Bend	trans	-82.5	65	-164.5	33.2	-37.9	0	0	0	113.5	D95 E96 F97 W119	P54-D95 HydrophobicContact CB-CB 3.98Å; P54-D95 WeakPolarHBondContact CB-OD1 3.38Å; P54-D95 VanDerWaalsContact CB-OD2 3.32Å; P54-D95 WeakPolarHBondContact CB-OD2 3.41Å; P54-D95 HydrophobicContact CG-CB 4.11Å; P54-E96 PolarHBondContact O-N 3.49Å; P54-F97 HydrophobicContact CB-CD2 3.97Å; P54-F97 HydrophobicContact CB-CE2 4.33Å; P54-W119 VanDerWaalsContact CD-CD2 3.49Å; P54-W119 VanDerWaalsContact CD-CE3 3.47Å; P54-W119 HydrophobicContact CG-CD2 4.27Å; P54-W119 HydrophobicContact CG-CE3 3.85Å; P54-W119 HydrophobicContact CG-CZ3 4.41Å
55	V	97	Very high	95.6	Very high	21 Å²	21	73.3 Å²	73.3	13%	0.127	40%	0.401	C	S	.	.			trans	-127.4	145.6	178.6	-65.5	0	0	0	0	111.6	R53 D57 T62 F97	R53-V55 VanDerWaalsContact C-N 3.28Å; R53-V55 HydrophobicContact CG-CG2 4.48Å; R53-V55 VanDerWaalsContact NH1-CG1 3.32Å; R53-V55 PolarHBondContact O-N 2.92Å; V55-D57 WeakPolarHBondContact CB-O 3.29Å; V55-D57 VanDerWaalsContact CG2-O 3.24Å; V55-D57 WeakPolarHBondContact CG2-O 3.49Å; V55-T62 WeakPolarHBondContact CG1-OG1 3.43Å; V55-F97 WeakPolarHBondContact O-CZ 3.18Å
56	K	95.4	Very high	95.9	Very high	159 Å²	159	70.2 Å²	70.2	69%	0.691	38%	0.379	S	S	*	.	S	Bend	trans	-77.8	-40	172	-70.2	165.5	-172.9	167.9	0	112.1	E96 F97	K56-E96 WeakPolarHBondContact CB-OE2 3.42Å; K56-E96 VanDerWaalsContact CD-OE2 3.3Å; K56-E96 WeakPolarHBondContact CD-OE2 3.32Å; K56-E96 HydrophobicContact CG-CB 4.41Å; K56-E96 WeakPolarHBondContact CG-OE2 3.28Å; K56-E96 PolarHBondContact N-OE2 3.4Å; K56-F97 HydrophobicContact CG-CE1 4.11Å
57	D	96.6	Very high	96	Very high	73 Å²	73	66.7 Å²	66.7	39%	0.39	35%	0.35	S	S	.	.	S	Bend	trans	-102.8	124.9	172	-171.7	-3.2	0	0	0	109.6	V55 R59 T60	V55-D57 WeakPolarHBondContact CB-O 3.29Å; V55-D57 VanDerWaalsContact CG2-O 3.24Å; V55-D57 WeakPolarHBondContact CG2-O 3.49Å; D57-R59 PolarHBondContact O-N 2.97Å; D57-R59 PolarHBondContact OD1-N 3.34Å; D57-T60 HydrophobicContact CB-CG2 4.28Å; D57-T60 PolarHBondContact O-N 3.2Å; D57-T60 PolarHBondContact O-OG1 3.46Å
58	W	95.4	Very high	96.3	Very high	186 Å²	186	63.5 Å²	63.5	71%	0.705	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.5	179.6	65.4	-89.6	0	0	0	112.3	R53 T60	R53-W58 PolarHBondContact NH2-O 3.35Å; W58-T60 VanDerWaalsContact C-N 3.31Å; W58-T60 PolarHBondContact O-N 3.11Å
59	R	95.6	Very high	96.3	Very high	183 Å²	183	62.9 Å²	62.9	69%	0.691	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-17.5	-179.4	-62.2	179.5	177.5	-169.5	0.3	113.9	D57	D57-R59 PolarHBondContact O-N 2.97Å; D57-R59 PolarHBondContact OD1-N 3.34Å
60	T	95.9	Very high	96.4	Very high	59 Å²	59	56 Å²	56	36%	0.362	29%	0.286	S	S	.	.	S	Bend	trans	-86.9	127.4	179.9	51.3	0	0	0	0	110.1	R53 D57 W58	R53-T60 PolarHBondContact NH1-O 2.6Å; D57-T60 HydrophobicContact CB-CG2 4.28Å; D57-T60 PolarHBondContact O-N 3.2Å; D57-T60 PolarHBondContact O-OG1 3.46Å; W58-T60 VanDerWaalsContact C-N 3.31Å; W58-T60 PolarHBondContact O-N 3.11Å
61	S	96.2	Very high	96.5	Very high	45 Å²	45	55.1 Å²	55.1	32%	0.315	28%	0.28	S	S	.	.			trans	-74.2	144.1	176.6	61.8	0	0	0	0	111.5	D186	S61-D186 VanDerWaalsContact CA-O 3.29Å; S61-D186 WeakPolarHBondContact CA-O 3.38Å; S61-D186 WeakPolarHBondContact CB-O 3.4Å
62	T	98	Very high	96.6	Very high	6 Å²	6	52 Å²	52	4%	0.037	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	114.5	173.1	-57.7	0	0	0	0	108.9	V55 W93 W119 D187 I188 N189	V55-T62 WeakPolarHBondContact CG1-OG1 3.43Å; T62-W93 HydrophobicContact CG2-CB 4.23Å; T62-W119 HydrophobicContact CG2-CH2 4.43Å; T62-W119 HydrophobicContact CG2-CZ3 4.19Å; T62-D187 PolarHBondContact N-O 3.17Å; T62-I188 WeakPolarHBondContact O-CA 3.41Å; T62-N189 PolarHBondContact O-N 2.93Å; T62-N189 VanDerWaalsContact O-N 3.15Å
63	I	97.9	Very high	96.6	Very high	89 Å²	89	49.1 Å²	49.1	46%	0.456	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	122.6	179.3	-57.9	172.9	0	0	0	109.7	N189 T191	I63-N189 CarbonylContact C-O 3.55Å; I63-N189 WeakPolarHBondContact CA-O 3.28Å; I63-T191 HydrophobicContact CG2-CG2 3.66Å; I63-T191 WeakPolarHBondContact CG2-OG1 3.47Å
64	V	98.4	Very high	96.4	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	110.6	175.5	-174.3	0	0	0	0	108.8	I66 Q91 W93 P121 I123 I188 N189 I190 T191	V64-I66 HydrophobicContact CG1-CG2 3.91Å; V64-Q91 HydrophobicContact CG1-CB 4.11Å; V64-W93 HydrophobicContact CG2-CB 4.28Å; V64-P121 HydrophobicContact CG1-CG 4.32Å; V64-P121 HydrophobicContact CG2-CB 4.07Å; V64-P121 HydrophobicContact CG2-CG 3.91Å; V64-I123 HydrophobicContact CG1-CG1 4.3Å; V64-I188 HydrophobicContact CG2-CG2 3.93Å; V64-N189 PolarHBondContact N-O 3.35Å; V64-I190 WeakPolarHBondContact O-CA 3.41Å; V64-T191 PolarHBondContact O-N 2.98Å
65	A	98.1	Very high	96.3	Very high	16 Å²	16	56.1 Å²	56.1	13%	0.132	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	120.9	174	0	0	0	0	0	109.6	Q91 S92 T191 M193	A65-Q91 CarbonylContact O-C 3.53Å; A65-Q91 VanDerWaalsContact O-CA 3.22Å; A65-Q91 WeakPolarHBondContact O-CA 3.36Å; A65-S92 PolarHBondContact N-O 3.08Å; A65-S92 PolarHBondContact O-N 2.98Å; A65-T191 CarbonylContact C-O 3.55Å; A65-T191 WeakPolarHBondContact CA-O 3.45Å; A65-T191 WeakPolarHBondContact CA-OG1 3.46Å; A65-M193 HydrophobicContact CB-CB 4.34Å; A65-M193 WeakPolarHBondContact O-CE 3.31Å
66	I	97.9	Very high	96.2	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	153.5	-178	66.9	172	0	0	0	111.7	V64 Y89 R90 Q91 F178 I190 T191 L192 M193 M235 F237	V64-I66 HydrophobicContact CG1-CG2 3.91Å; I66-Y89 HydrophobicContact CB-CE2 4.11Å; I66-Y89 HydrophobicContact CG2-CE2 4.21Å; I66-Y89 VanDerWaalsContact CG2-OH 3.3Å; I66-Y89 WeakPolarHBondContact CG2-OH 3.47Å; I66-R90 WeakPolarHBondContact CA-O 3.47Å; I66-Q91 HydrophobicContact CG2-CB 4.06Å; I66-F178 HydrophobicContact CD1-CB 3.84Å; I66-F178 HydrophobicContact CD1-CD2 4.47Å; I66-F178 HydrophobicContact CD1-CG 4.07Å; I66-I190 HydrophobicContact CD1-CG2 3.68Å; I66-I190 HydrophobicContact CG1-CG2 3.85Å; I66-I190 HydrophobicContact CG2-CG2 4.32Å; I66-T191 PolarHBondContact N-O 3.12Å; I66-L192 WeakPolarHBondContact O-CA 3.36Å; I66-M193 PolarHBondContact O-N 3.43Å; I66-M235 HydrophobicContact CD1-CB 3.85Å; I66-M235 HydrophobicContact CD1-CG 3.85Å; I66-M235 HydrophobicContact CG1-CG 4.4Å; I66-F237 HydrophobicContact CD1-CE2 3.64Å; I66-F237 HydrophobicContact CD1-CZ 3.93Å; I66-F237 HydrophobicContact CG1-CE2 4.36Å; I66-F237 HydrophobicContact CG1-CZ 4.14Å
67	D	96.6	Very high	96.1	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.016	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	148.2	172	-179	49.3	0	0	0	111.2	R90 M193 R194	D67-R90 HydrophobicContact CB-CG 3.77Å; D67-R90 PolarHBondContact N-O 3.48Å; D67-R90 PolarHBondContact O-N 3.05Å; D67-R90 IonicContact OD2-CZ 3.5Å; D67-R90 IonicContact OD2-NE 2.85Å; D67-R90 PolarHBondContact OD2-NE 2.89Å; D67-R90 IonicContact OD2-NH2 3.71Å; D67-R90 PolarHBondContact OD2-NH2 3.16Å; D67-M193 HydrophobicContact CB-CB 3.88Å; D67-R194 IonicContact OD1-CZ 2.99Å; D67-R194 VanDerWaalsContact OD1-CZ 3.32Å; D67-R194 IonicContact OD1-NE 3.42Å; D67-R194 PolarHBondContact OD1-NE 2.75Å; D67-R194 IonicContact OD1-NH2 3.22Å; D67-R194 PolarHBondContact OD1-NH2 2.91Å; D67-R194 IonicContact OD2-CZ 3.65Å; D67-R194 VanDerWaalsContact OD2-CZ 3.22Å; D67-R194 IonicContact OD2-NE 2.71Å; D67-R194 PolarHBondContact OD2-NE 2.93Å; D67-R194 IonicContact OD2-NH2 2.76Å; D67-R194 PolarHBondContact OD2-NH2 2.96Å; D67-R194 VanDerWaalsContact OD2-NH2 3.08Å
68	L	95.1	Very high	95.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	130.7	-169.8	-172.7	77.9	0	0	0	109.4	V87 L176 F178 L199 F237	L68-V87 HydrophobicContact CD1-CB 3.64Å; L68-V87 HydrophobicContact CD1-CG1 4.08Å; L68-V87 HydrophobicContact CD1-CG2 3.65Å; L68-V87 HydrophobicContact CG-CB 4.41Å; L68-L176 HydrophobicContact CD2-CD1 4.07Å; L68-F178 HydrophobicContact CD1-CE2 4.49Å; L68-F178 HydrophobicContact CD1-CZ 4.06Å; L68-L199 VanDerWaalsContact O-CD1 3.3Å; L68-L199 WeakPolarHBondContact O-CD1 3.15Å; L68-F237 HydrophobicContact CB-CD1 4.29Å; L68-F237 HydrophobicContact CB-CE1 4.12Å; L68-F237 HydrophobicContact CB-CZ 4.35Å; L68-F237 HydrophobicContact CD2-CB 4.04Å; L68-F237 HydrophobicContact CD2-CD1 4.15Å; L68-F237 HydrophobicContact CD2-CD2 4.38Å; L68-F237 HydrophobicContact CD2-CG 3.94Å
69	M	96	Very high	95.5	Very high	31 Å²	31	46 Å²	46	15%	0.153	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.7	168.9	-57.6	172.5	-177.8	0	0	108.7	Y71 V87 W88 V205	M69-Y71 PolarHBondContact O-N 2.86Å; M69-V87 CarbonylContact O-C 3.5Å; M69-V87 WeakPolarHBondContact O-CA 3.47Å; M69-W88 HydrophobicContact CB-CB 4.31Å; M69-W88 PolarHBondContact N-O 2.96Å; M69-W88 PolarHBondContact O-N 3.36Å; M69-V205 HydrophobicContact CB-CG2 3.78Å
70	V	96.5	Very high	95.2	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.024	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	116.5	177.4	-179.9	0	0	0	0	108.4	I73 V87 F206 L214 I217 V239	V70-I73 HydrophobicContact CG1-CD1 4.04Å; V70-V87 HydrophobicContact CG2-CG1 4.25Å; V70-F206 HydrophobicContact CG1-CD2 4.07Å; V70-F206 HydrophobicContact CG1-CE2 4.16Å; V70-L214 HydrophobicContact CB-CD2 4.05Å; V70-L214 HydrophobicContact CG1-CD2 4.48Å; V70-I217 HydrophobicContact CB-CD1 4.28Å; V70-I217 HydrophobicContact CG2-CD1 3.72Å; V70-I217 HydrophobicContact CG2-CG1 4.26Å; V70-V239 HydrophobicContact CG2-CG1 4.31Å; V70-V239 HydrophobicContact CG2-CG2 4.28Å
71	Y	95.7	Very high	95.1	Very high	86 Å²	86	41.1 Å²	41.1	34%	0.337	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-47.2	179.2	-179.5	-92.5	0	0	0	111.1	M69 Y86 W88 V205 F206 M207	M69-Y71 PolarHBondContact O-N 2.86Å; Y71-Y86 WeakPolarHBondContact CB-O 3.36Å; Y71-Y86 AromaticContact CD1-CD1 3.62Å; Y71-Y86 HydrophobicContact CD1-CD1 3.62Å; Y71-Y86 HydrophobicContact CD1-CE1 4.23Å; Y71-Y86 HydrophobicContact CE1-CD1 4.47Å; Y71-Y86 AromaticContact CG-CD1 3.98Å; Y71-Y86 HydrophobicContact CG-CD1 3.98Å; Y71-Y86 HydrophobicContact CG-CE1 4.49Å; Y71-Y86 PolarHBondContact N-O 2.89Å; Y71-W88 AromaticContact CD2-CE2 3.78Å; Y71-W88 HydrophobicContact CD2-CH2 4.43Å; Y71-W88 AromaticContact CD2-CZ2 3.66Å; Y71-W88 HydrophobicContact CD2-CZ2 3.66Å; Y71-W88 AromaticContact CD2-NE1 3.89Å; Y71-W88 AromaticContact CE2-CZ2 3.82Å; Y71-W88 HydrophobicContact CE2-CZ2 3.82Å; Y71-V205 HydrophobicContact CD2-CB 4.38Å; Y71-V205 WeakPolarHBondContact CD2-O 3.46Å; Y71-F206 WeakPolarHBondContact O-CA 3.39Å; Y71-M207 PolarHBondContact O-N 3.45Å
72	S	95.6	Very high	95	Very high	12 Å²	12	40.3 Å²	40.3	8%	0.084	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	153.4	177.4	63.8	0	0	0	0	113.1	L74 Y86	S72-L74 WeakPolarHBondContact OG-CD2 3.37Å; S72-Y86 PolarHBondContact N-O 3.35Å; S72-Y86 PolarHBondContact O-N 3.49Å
73	I	96.5	Very high	94.9	Very high	26 Å²	26	40 Å²	40	13%	0.133	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	112.7	164.2	-51.1	-55.7	0	0	0	106.4	V70 V76 L83 T85 F206 W212 I241	V70-I73 HydrophobicContact CG1-CD1 4.04Å; I73-V76 HydrophobicContact CG2-CG2 3.81Å; I73-L83 HydrophobicContact CG2-CD1 3.92Å; I73-T85 HydrophobicContact CD1-CG2 3.57Å; I73-F206 HydrophobicContact CG1-CE2 4.12Å; I73-F206 HydrophobicContact CG1-CZ 4.34Å; I73-W212 HydrophobicContact CB-CB 4.18Å; I73-W212 HydrophobicContact CG1-CB 4.15Å; I73-W212 HydrophobicContact CG2-CB 4.35Å; I73-W212 HydrophobicContact CG2-CG 4.2Å; I73-I241 HydrophobicContact CD1-CG2 3.94Å; I73-I241 HydrophobicContact CG1-CG2 4.1Å; I73-I241 HydrophobicContact CG2-CD1 4.46Å
74	L	94.3	Very high	94.8	Very high	88 Å²	88	36.6 Å²	36.6	46%	0.461	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-43.9	-173.1	-65.4	178.2	0	0	0	111.8	S72 T84 Q155	S72-L74 WeakPolarHBondContact OG-CD2 3.37Å; L74-T84 HydrophobicContact CB-CG2 3.94Å; L74-T84 HydrophobicContact CD1-CG2 4.01Å; L74-T84 PolarHBondContact N-O 3Å; L74-Q155 HydrophobicContact CD1-CG 4.07Å
75	N	94.3	Very high	94.7	Very high	92 Å²	92	36.6 Å²	36.6	49%	0.492	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	145.1	-179.5	-167.5	25.2	0	0	0	110.7	T84	N75-T84 PolarHBondContact N-O 3.37Å; N75-T84 PolarHBondContact O-N 3.23Å
76	V	94.3	Very high	94.5	Very high	11 Å²	11	38.7 Å²	38.7	7%	0.067	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	114.1	170.8	-177.4	0	0	0	0	106.3	I73 E78 L83 L162 W212 I241	I73-V76 HydrophobicContact CG2-CG2 3.81Å; V76-E78 HydrophobicContact CG1-CG 4.29Å; V76-L83 HydrophobicContact CG2-CD1 3.7Å; V76-L162 HydrophobicContact CG1-CD1 3.64Å; V76-L162 HydrophobicContact CG1-CD2 4.24Å; V76-W212 HydrophobicContact CB-CZ2 3.9Å; V76-W212 HydrophobicContact CG1-CZ2 3.88Å; V76-W212 HydrophobicContact CG2-CD2 4.23Å; V76-W212 HydrophobicContact CG2-CG 4.48Å; V76-W212 HydrophobicContact CG2-CZ2 3.75Å; V76-I241 HydrophobicContact CG2-CD1 4.39Å
77	D	93.1	Very high	94.4	Very high	44 Å²	44	38.7 Å²	38.7	24%	0.235	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	95.1	178.3	-173.3	-25.1	0	0	0	108.6	K79 N80 Q81 V82	D77-K79 VanDerWaalsContact C-N 3.26Å; D77-K79 PolarHBondContact O-N 3.49Å; D77-K79 WeakPolarHBondContact OD1-CB 3.39Å; D77-K79 PolarHBondContact OD1-N 3.32Å; D77-K79 VanDerWaalsContact OD1-N 3.13Å; D77-N80 HydrophobicContact CB-CB 4.48Å; D77-N80 PolarHBondContact OD1-N 3.44Å; D77-N80 PolarHBondContact OD2-ND2 3.33Å; D77-Q81 WeakPolarHBondContact O-CA 3.39Å; D77-Q81 PolarHBondContact O-N 3.38Å; D77-V82 HydrophobicContact CB-CB 4.36Å; D77-V82 PolarHBondContact N-O 3.47Å; D77-V82 PolarHBondContact O-N 2.93Å
78	E	90.4	Very high	94.4	Very high	22 Å²	22	43.9 Å²	43.9	10%	0.103	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-28	-178	-57.1	89.2	164.7	0	0	112.1	V76 Q81 L162 I164 R243 P299 T301	V76-E78 HydrophobicContact CG1-CG 4.29Å; E78-Q81 PolarHBondContact O-NE2 2.98Å; E78-L162 HydrophobicContact CG-CD1 4.32Å; E78-I164 HydrophobicContact CB-CG2 3.93Å; E78-I164 HydrophobicContact CG-CG2 3.73Å; E78-R243 IonicContact OE1-CZ 3.38Å; E78-R243 IonicContact OE1-NH1 3.74Å; E78-R243 PolarHBondContact OE1-NH1 3.47Å; E78-R243 IonicContact OE1-NH2 3.2Å; E78-R243 PolarHBondContact OE1-NH2 3.27Å; E78-P299 HydrophobicContact CB-CB 3.79Å; E78-P299 HydrophobicContact CB-CG 3.82Å; E78-P299 HydrophobicContact CG-CG 4.07Å; E78-T301 HydrophobicContact CB-CG2 4.21Å; E78-T301 WeakPolarHBondContact O-CG2 3.42Å
79	K	88.1	Confident	94.5	Very high	149 Å²	149	44.2 Å²	44.2	65%	0.648	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-47.2	179.7	-178	-178	179.8	-179.1	0	111	D77	D77-K79 VanDerWaalsContact C-N 3.26Å; D77-K79 PolarHBondContact O-N 3.49Å; D77-K79 WeakPolarHBondContact OD1-CB 3.39Å; D77-K79 PolarHBondContact OD1-N 3.32Å; D77-K79 VanDerWaalsContact OD1-N 3.13Å
80	N	90.8	Very high	94.5	Very high	104 Å²	104	45.5 Å²	45.5	56%	0.556	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-4	-179.2	-63.8	-42.3	0	0	0	113.1	D77 V82	D77-N80 HydrophobicContact CB-CB 4.48Å; D77-N80 PolarHBondContact OD1-N 3.44Å; D77-N80 PolarHBondContact OD2-ND2 3.33Å; N80-V82 VanDerWaalsContact C-N 3.34Å; N80-V82 HydrophobicContact CB-CG2 4.14Å
81	Q	92.3	Very high	94.5	Very high	36 Å²	36	45.4 Å²	45.4	17%	0.168	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	43.9	-178.6	-60.1	-76.5	-63.3	0	0	111.7	D77 E78 A159 C160 L162	D77-Q81 WeakPolarHBondContact O-CA 3.39Å; D77-Q81 PolarHBondContact O-N 3.38Å; E78-Q81 PolarHBondContact O-NE2 2.98Å; Q81-A159 WeakPolarHBondContact O-CA 3.24Å; Q81-C160 CarbonylContact C-O 3.49Å; Q81-C160 WeakPolarHBondContact CB-O 3.27Å; Q81-C160 PolarHBondContact O-N 2.86Å; Q81-C160 VanDerWaalsContact O-O 3.09Å; Q81-C160 PolarHBondContact OE1-O 3.11Å; Q81-L162 PolarHBondContact OE1-O 3.11Å
82	V	94.7	Very high	94.6	Very high	27 Å²	27	42 Å²	42	16%	0.164	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132.7	-176.2	176.8	0	0	0	0	110.7	D77 N80 V129 V157 T158	D77-V82 HydrophobicContact CB-CB 4.36Å; D77-V82 PolarHBondContact N-O 3.47Å; D77-V82 PolarHBondContact O-N 2.93Å; N80-V82 VanDerWaalsContact C-N 3.34Å; N80-V82 HydrophobicContact CB-CG2 4.14Å; V82-V129 HydrophobicContact CG1-CG2 4.15Å; V82-V129 HydrophobicContact CG2-CG2 4.24Å; V82-V157 HydrophobicContact CG1-CG1 3.57Å; V82-T158 WeakPolarHBondContact CA-O 3.38Å
83	L	95.9	Very high	94.8	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	128.9	171.4	176	67.2	0	0	0	109.4	I73 V76 T85 T158 C160 C174 I241	I73-L83 HydrophobicContact CG2-CD1 3.92Å; V76-L83 HydrophobicContact CG2-CD1 3.7Å; L83-T85 HydrophobicContact CD1-CG2 4.05Å; L83-T85 HydrophobicContact CD2-CG2 3.72Å; L83-T85 HydrophobicContact CG-CG2 3.72Å; L83-T158 PolarHBondContact N-O 2.89Å; L83-T158 PolarHBondContact O-N 3.38Å; L83-T158 PolarHBondContact O-OG1 3.41Å; L83-C160 HydrophobicContact CB-CB 4.31Å; L83-C174 HydrophobicContact CD2-CB 3.58Å; L83-I241 HydrophobicContact CD1-CD1 4.2Å
84	T	96.1	Very high	94.9	Very high	17 Å²	17	43.7 Å²	43.7	10%	0.104	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	116.3	172.3	-53.9	0	0	0	0	110	L74 N75 Q155 V156 V157	L74-T84 HydrophobicContact CB-CG2 3.94Å; L74-T84 HydrophobicContact CD1-CG2 4.01Å; L74-T84 PolarHBondContact N-O 3Å; N75-T84 PolarHBondContact N-O 3.37Å; N75-T84 PolarHBondContact O-N 3.23Å; T84-Q155 HydrophobicContact CG2-CG 4.22Å; T84-V156 CarbonylContact C-O 3.54Å; T84-V156 WeakPolarHBondContact CA-O 2.97Å; T84-V157 HydrophobicContact CG2-CG2 4.17Å
85	T	95.7	Very high	95	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	153.8	178.5	60.8	0	0	0	0	111.6	I73 L83 V156	I73-T85 HydrophobicContact CD1-CG2 3.57Å; L83-T85 HydrophobicContact CD1-CG2 4.05Å; L83-T85 HydrophobicContact CD2-CG2 3.72Å; L83-T85 HydrophobicContact CG-CG2 3.72Å; T85-V156 PolarHBondContact N-O 2.7Å; T85-V156 PolarHBondContact O-N 2.87Å
86	Y	95.6	Very high	95.1	Very high	60 Å²	60	38 Å²	38	24%	0.235	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	119.2	168.1	-168.2	-110.1	0	0	0	108.6	Y71 S72 W88 P153 Q155	Y71-Y86 WeakPolarHBondContact CB-O 3.36Å; Y71-Y86 AromaticContact CD1-CD1 3.62Å; Y71-Y86 HydrophobicContact CD1-CD1 3.62Å; Y71-Y86 HydrophobicContact CD1-CE1 4.23Å; Y71-Y86 HydrophobicContact CE1-CD1 4.47Å; Y71-Y86 AromaticContact CG-CD1 3.98Å; Y71-Y86 HydrophobicContact CG-CD1 3.98Å; Y71-Y86 HydrophobicContact CG-CE1 4.49Å; Y71-Y86 PolarHBondContact N-O 2.89Å; S72-Y86 PolarHBondContact N-O 3.35Å; S72-Y86 PolarHBondContact O-N 3.49Å; Y86-W88 AromaticContact CE1-NE1 3.83Å; Y86-P153 HydrophobicContact CE1-CB 4.34Å; Y86-P153 HydrophobicContact CE2-CB 4.12Å; Y86-P153 WeakPolarHBondContact OH-CB 3.45Å; Y86-Q155 HydrophobicContact CD2-CB 4.28Å
87	V	95.8	Very high	95.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	143.5	-174.1	-57.6	0	0	0	0	110.4	L68 M69 V70 P153 I154 V156	L68-V87 HydrophobicContact CD1-CB 3.64Å; L68-V87 HydrophobicContact CD1-CG1 4.08Å; L68-V87 HydrophobicContact CD1-CG2 3.65Å; L68-V87 HydrophobicContact CG-CB 4.41Å; M69-V87 CarbonylContact O-C 3.5Å; M69-V87 WeakPolarHBondContact O-CA 3.47Å; V70-V87 HydrophobicContact CG2-CG1 4.25Å; V87-P153 WeakPolarHBondContact O-CA 3.26Å; V87-I154 HydrophobicContact CG2-CB 3.95Å; V87-I154 WeakPolarHBondContact CG2-O 3.48Å; V87-I154 PolarHBondContact N-O 3.11Å; V87-I154 PolarHBondContact O-N 2.97Å; V87-V156 HydrophobicContact CG2-CG2 3.76Å
88	W	96.3	Very high	95.4	Very high	112 Å²	112	40.2 Å²	40.2	42%	0.424	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	116.6	164.9	-64.9	-2.2	0	0	0	107.6	M69 Y71 Y86 V205	M69-W88 HydrophobicContact CB-CB 4.31Å; M69-W88 PolarHBondContact N-O 2.96Å; M69-W88 PolarHBondContact O-N 3.36Å; Y71-W88 AromaticContact CD2-CE2 3.78Å; Y71-W88 HydrophobicContact CD2-CH2 4.43Å; Y71-W88 AromaticContact CD2-CZ2 3.66Å; Y71-W88 HydrophobicContact CD2-CZ2 3.66Å; Y71-W88 AromaticContact CD2-NE1 3.89Å; Y71-W88 AromaticContact CE2-CZ2 3.82Å; Y71-W88 HydrophobicContact CE2-CZ2 3.82Å; Y86-W88 AromaticContact CE1-NE1 3.83Å; W88-V205 HydrophobicContact CE3-CB 4.47Å; W88-V205 HydrophobicContact CE3-CG1 4.08Å; W88-V205 HydrophobicContact CE3-CG2 4.46Å; W88-V205 HydrophobicContact CH2-CG1 4.23Å; W88-V205 HydrophobicContact CZ3-CB 4.22Å; W88-V205 HydrophobicContact CZ3-CG1 3.63Å
89	Y	96.2	Very high	95.7	Very high	6 Å²	6	42.3 Å²	42.3	2%	0.024	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	135.3	-178.7	173.8	-93.2	0	0	0	109.2	I66 Q91 K152 I154 F178	I66-Y89 HydrophobicContact CB-CE2 4.11Å; I66-Y89 HydrophobicContact CG2-CE2 4.21Å; I66-Y89 VanDerWaalsContact CG2-OH 3.3Å; I66-Y89 WeakPolarHBondContact CG2-OH 3.47Å; Y89-Q91 HydrophobicContact CE1-CB 3.8Å; Y89-Q91 HydrophobicContact CE1-CG 3.83Å; Y89-Q91 PolarHBondContact OH-OE1 3.1Å; Y89-K152 WeakPolarHBondContact CB-O 3.36Å; Y89-K152 HydrophobicContact CD1-CD 4.18Å; Y89-K152 HydrophobicContact CD1-CG 3.74Å; Y89-K152 PolarHBondContact N-O 3.45Å; Y89-K152 PolarHBondContact O-N 3.26Å; Y89-I154 HydrophobicContact CD1-CD1 3.96Å; Y89-I154 HydrophobicContact CD2-CD1 4.38Å; Y89-I154 HydrophobicContact CG-CD1 3.7Å; Y89-F178 HydrophobicContact CD2-CD1 4.47Å; Y89-F178 AromaticContact CD2-CE1 3.72Å; Y89-F178 HydrophobicContact CD2-CE1 3.72Å; Y89-F178 HydrophobicContact CD2-CZ 4.14Å; Y89-F178 AromaticContact CE2-CD1 3.83Å; Y89-F178 HydrophobicContact CE2-CD1 3.83Å; Y89-F178 AromaticContact CE2-CE1 3.52Å; Y89-F178 HydrophobicContact CE2-CE1 3.52Å; Y89-F178 HydrophobicContact CE2-CZ 4.27Å
90	R	96.1	Very high	96.1	Very high	59 Å²	59	35.8 Å²	35.8	22%	0.223	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	142	171.1	62.5	-178.7	172.8	175.7	-2.3	109.9	I66 D67 N150 Y151 M193	I66-R90 WeakPolarHBondContact CA-O 3.47Å; D67-R90 HydrophobicContact CB-CG 3.77Å; D67-R90 PolarHBondContact N-O 3.48Å; D67-R90 PolarHBondContact O-N 3.05Å; D67-R90 IonicContact OD2-CZ 3.5Å; D67-R90 IonicContact OD2-NE 2.85Å; D67-R90 PolarHBondContact OD2-NE 2.89Å; D67-R90 IonicContact OD2-NH2 3.71Å; D67-R90 PolarHBondContact OD2-NH2 3.16Å; R90-N150 WeakPolarHBondContact CA-O 3.41Å; R90-Y151 HydrophobicContact CB-CD1 3.55Å; R90-Y151 HydrophobicContact CB-CE1 3.84Å; R90-Y151 HydrophobicContact CB-CG 4.41Å; R90-Y151 HydrophobicContact CG-CE1 4.46Å; R90-M193 HydrophobicContact CG-CE 4.22Å; R90-M193 HydrophobicContact CG-SD 4.21Å
91	Q	97.4	Very high	96.4	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.009	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	150.4	173.6	67	-179.9	40.9	0	0	110.1	V64 A65 I66 Y89 W93 N150	V64-Q91 HydrophobicContact CG1-CB 4.11Å; A65-Q91 CarbonylContact O-C 3.53Å; A65-Q91 VanDerWaalsContact O-CA 3.22Å; A65-Q91 WeakPolarHBondContact O-CA 3.36Å; I66-Q91 HydrophobicContact CG2-CB 4.06Å; Y89-Q91 HydrophobicContact CE1-CB 3.8Å; Y89-Q91 HydrophobicContact CE1-CG 3.83Å; Y89-Q91 PolarHBondContact OH-OE1 3.1Å; Q91-W93 HydrophobicContact CG-CE3 4.2Å; Q91-W93 HydrophobicContact CG-CZ3 3.88Å; Q91-W93 VanDerWaalsContact NE2-CZ3 3.35Å; Q91-N150 HydrophobicContact CG-CB 3.97Å; Q91-N150 PolarHBondContact N-O 2.89Å; Q91-N150 PolarHBondContact O-N 3.27Å
92	S	98.1	Very high	96.6	Very high	13 Å²	13	33.1 Å²	33.1	9%	0.091	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	142.8	171.2	60.8	0	0	0	0	111.5	A65 V148 M193	A65-S92 PolarHBondContact N-O 3.08Å; A65-S92 PolarHBondContact O-N 2.98Å; S92-V148 WeakPolarHBondContact CA-O 3.23Å; S92-V148 VanDerWaalsContact CB-O 3.32Å; S92-V148 WeakPolarHBondContact CB-O 3.25Å; S92-M193 VanDerWaalsContact OG-CE 3.26Å; S92-M193 WeakPolarHBondContact OG-CE 3.45Å
93	W	98.2	Very high	96.6	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.008	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	165.9	175.5	67	96.5	0	0	0	109.1	T62 V64 Q91 W119 V120 P121 V148 N150	T62-W93 HydrophobicContact CG2-CB 4.23Å; V64-W93 HydrophobicContact CG2-CB 4.28Å; Q91-W93 HydrophobicContact CG-CE3 4.2Å; Q91-W93 HydrophobicContact CG-CZ3 3.88Å; Q91-W93 VanDerWaalsContact NE2-CZ3 3.35Å; W93-W119 WeakPolarHBondContact CZ2-O 3.43Å; W93-W119 AromaticContact NE1-CE3 3.84Å; W93-V120 HydrophobicContact CH2-CG1 4.49Å; W93-V120 HydrophobicContact CH2-CG2 4.39Å; W93-V120 HydrophobicContact CZ2-CG2 4.39Å; W93-P121 HydrophobicContact CD2-CG 4.5Å; W93-P121 HydrophobicContact CE3-CG 4.41Å; W93-V148 HydrophobicContact CD2-CB 4.09Å; W93-V148 HydrophobicContact CD2-CG1 4.46Å; W93-V148 HydrophobicContact CE3-CB 4.47Å; W93-V148 HydrophobicContact CH2-CB 4.24Å; W93-V148 HydrophobicContact CH2-CG1 3.55Å; W93-V148 HydrophobicContact CZ2-CB 3.84Å; W93-V148 HydrophobicContact CZ2-CG1 3.4Å; W93-V148 VanDerWaalsContact CZ2-CG1 3.4Å; W93-V148 HydrophobicContact CZ2-CG2 4.41Å; W93-V148 HydrophobicContact CZ3-CG1 4.13Å; W93-V148 PolarHBondContact N-O 3.41Å; W93-V148 VanDerWaalsContact N-O 3.16Å; W93-V148 PolarHBondContact O-N 3.45Å; W93-N150 HydrophobicContact CH2-CB 3.99Å; W93-N150 HydrophobicContact CZ3-CB 3.7Å
94	T	98.2	Very high	96.5	Very high	72 Å²	72	43.4 Å²	43.4	44%	0.442	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.3	177.3	-53.2	0	0	0	0	109.3	G146	T94-G146 WeakPolarHBondContact CA-O 3.38Å
95	D	97.8	Very high	96.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.209	C	C	.	.			trans	-110.2	111.6	171	-174.6	-43.1	0	0	0	108.5	Y48 P54 F97 L98 G146 V148	Y48-D95 WeakPolarHBondContact CE2-OD2 3.45Å; Y48-D95 PolarHBondContact OH-OD2 2.93Å; P54-D95 HydrophobicContact CB-CB 3.98Å; P54-D95 WeakPolarHBondContact CB-OD1 3.38Å; P54-D95 VanDerWaalsContact CB-OD2 3.32Å; P54-D95 WeakPolarHBondContact CB-OD2 3.41Å; P54-D95 HydrophobicContact CG-CB 4.11Å; D95-F97 PolarHBondContact O-N 3.01Å; D95-F97 WeakPolarHBondContact OD1-CA 3.34Å; D95-F97 WeakPolarHBondContact OD1-CB 3.36Å; D95-F97 PolarHBondContact OD1-N 2.95Å; D95-L98 HydrophobicContact CB-CB 4.18Å; D95-L98 HydrophobicContact CB-CD1 4.05Å; D95-L98 HydrophobicContact CB-CG 4.17Å; D95-L98 PolarHBondContact O-N 3.3Å; D95-L98 PolarHBondContact OD1-N 3.22Å; D95-L98 VanDerWaalsContact OD1-N 3.12Å; D95-L98 WeakPolarHBondContact OD2-CD1 3.35Å; D95-G146 PolarHBondContact N-O 3.41Å; D95-G146 WeakPolarHBondContact O-CA 3.06Å; D95-V148 HydrophobicContact CB-CG2 3.95Å
96	E	96.8	Very high	96.4	Very high	62 Å²	62	49.6 Å²	49.6	29%	0.29	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-8.6	-174.8	-64.6	-175.9	-168.7	0	0	114.2	P54 K56	P54-E96 PolarHBondContact O-N 3.49Å; K56-E96 WeakPolarHBondContact CB-OE2 3.42Å; K56-E96 VanDerWaalsContact CD-OE2 3.3Å; K56-E96 WeakPolarHBondContact CD-OE2 3.32Å; K56-E96 HydrophobicContact CG-CB 4.41Å; K56-E96 WeakPolarHBondContact CG-OE2 3.28Å; K56-E96 PolarHBondContact N-OE2 3.4Å
97	F	96.4	Very high	96.4	Very high	98 Å²	98	52 Å²	52	43%	0.43	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-22.8	-179.8	-54.4	-53.5	0	0	0	112.5	Y48 P54 V55 K56 D95 V99	Y48-F97 HydrophobicContact CD2-CB 4.2Å; Y48-F97 HydrophobicContact CE2-CB 4.21Å; P54-F97 HydrophobicContact CB-CD2 3.97Å; P54-F97 HydrophobicContact CB-CE2 4.33Å; V55-F97 WeakPolarHBondContact O-CZ 3.18Å; K56-F97 HydrophobicContact CG-CE1 4.11Å; D95-F97 PolarHBondContact O-N 3.01Å; D95-F97 WeakPolarHBondContact OD1-CA 3.34Å; D95-F97 WeakPolarHBondContact OD1-CB 3.36Å; D95-F97 PolarHBondContact OD1-N 2.95Å; F97-V99 VanDerWaalsContact C-N 3.27Å; F97-V99 PolarHBondContact O-N 3.5Å
98	L	96.4	Very high	96.4	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.016	26%	0.263	C	S	.	.	S	Bend	trans	-89.4	55.7	177.3	-61.9	177.3	0	0	0	112.4	L44 Y48 D95 V118 V142 G146 V148	L44-L98 HydrophobicContact CB-CD2 4.13Å; L44-L98 HydrophobicContact CD2-CD2 4.44Å; Y48-L98 HydrophobicContact CD2-CD2 3.95Å; Y48-L98 HydrophobicContact CD2-CG 4.41Å; Y48-L98 HydrophobicContact CE2-CD1 4.34Å; Y48-L98 HydrophobicContact CE2-CD2 3.87Å; Y48-L98 HydrophobicContact CE2-CG 3.87Å; D95-L98 HydrophobicContact CB-CB 4.18Å; D95-L98 HydrophobicContact CB-CD1 4.05Å; D95-L98 HydrophobicContact CB-CG 4.17Å; D95-L98 PolarHBondContact O-N 3.3Å; D95-L98 PolarHBondContact OD1-N 3.22Å; D95-L98 VanDerWaalsContact OD1-N 3.12Å; D95-L98 WeakPolarHBondContact OD2-CD1 3.35Å; L98-V118 HydrophobicContact CD1-CB 4.44Å; L98-V118 HydrophobicContact CD1-CG1 3.74Å; L98-V142 HydrophobicContact CB-CG1 3.97Å; L98-V142 HydrophobicContact CD1-CG1 4.35Å; L98-V142 HydrophobicContact CD1-CG2 4.4Å; L98-G146 WeakPolarHBondContact O-CA 3.28Å; L98-V148 HydrophobicContact CD1-CG2 4.3Å
99	V	96.4	Very high	96.3	Very high	66 Å²	66	54.1 Å²	54.1	40%	0.4	27%	0.27	S	S	.	.			trans	-120.7	139.7	-175.8	178.3	0	0	0	0	109.5	F97 H144	F97-V99 VanDerWaalsContact C-N 3.27Å; F97-V99 PolarHBondContact O-N 3.5Å; V99-H144 WeakPolarHBondContact CG1-O 3.34Å
100	W	96.4	Very high	96.3	Very high	12 Å²	12	58.1 Å²	58.1	5%	0.045	29%	0.289	C	S	.	.			trans	-147	161.5	174.7	69.5	96.7	0	0	0	111.3	L40 F43 L44 F105 V108 V111 V142 T143 H144	L40-W100 HydrophobicContact CD1-CB 4Å; L40-W100 HydrophobicContact CD1-CD2 3.79Å; L40-W100 HydrophobicContact CD1-CE3 4.36Å; L40-W100 HydrophobicContact CD1-CG 3.6Å; L40-W100 HydrophobicContact CD2-CD2 4.32Å; L40-W100 HydrophobicContact CD2-CZ2 4.07Å; F43-W100 HydrophobicContact CE1-CB 4.31Å; L44-W100 HydrophobicContact CD1-CE3 3.98Å; L44-W100 HydrophobicContact CD1-CZ3 4.04Å; L44-W100 HydrophobicContact CD2-CE3 3.95Å; W100-F105 HydrophobicContact CB-CD2 4.38Å; W100-F105 HydrophobicContact CB-CE2 4.24Å; W100-F105 AromaticContact CD1-CD2 3.89Å; W100-F105 HydrophobicContact CG-CD2 4.43Å; W100-V108 PolarHBondContact NE1-O 3.24Å; W100-V111 HydrophobicContact CH2-CB 4.48Å; W100-V111 HydrophobicContact CH2-CG1 3.7Å; W100-V111 HydrophobicContact CZ2-CG1 4.29Å; W100-V111 HydrophobicContact CZ3-CG1 4.2Å; W100-V142 HydrophobicContact CH2-CG1 4.47Å; W100-V142 HydrophobicContact CZ3-CG1 4.03Å; W100-T143 WeakPolarHBondContact CH2-O 3.34Å; W100-T143 VanDerWaalsContact CZ3-O 3.28Å; W100-T143 WeakPolarHBondContact CZ3-O 3.42Å; W100-H144 HydrophobicContact CD2-CB 3.95Å; W100-H144 HydrophobicContact CE3-CB 4.41Å; W100-H144 HydrophobicContact CG-CB 4.42Å; W100-H144 HydrophobicContact CH2-CB 4.26Å; W100-H144 VanDerWaalsContact CH2-N 3.32Å; W100-H144 HydrophobicContact CZ2-CB 3.77Å; W100-H144 PolarHBondContact N-O 2.84Å
101	N	97.1	Very high	96.3	Very high	71 Å²	71	55.8 Å²	55.8	38%	0.38	28%	0.281	S	S	.	.			trans	-87.1	120.2	170	-173.1	10.2	0	0	0	109.3	E103 D104	N101-E103 PolarHBondContact O-N 3.5Å; N101-D104 PolarHBondContact O-N 3Å
102	P	96.3	Very high	96.3	Very high	13 Å²	13	58.7 Å²	58.7	8%	0.084	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-56.1	-33.7	178.9	-27.7	36.3	0	0	0	113.9	D104 F105 E107 K109 H144	P102-D104 PolarHBondContact O-N 3.41Å; P102-F105 CarbonylContact O-C 3.55Å; P102-F105 PolarHBondContact O-N 3.33Å; P102-E107 VanDerWaalsContact O-CA 3.29Å; P102-E107 WeakPolarHBondContact O-CA 3.33Å; P102-E107 PolarHBondContact O-N 2.99Å; P102-K109 HydrophobicContact CB-CG 4.33Å; P102-K109 HydrophobicContact CG-CG 4.24Å; P102-H144 HydrophobicContact CG-CB 3.81Å
103	E	95.5	Very high	96.2	Very high	139 Å²	139	58.7 Å²	58.7	65%	0.65	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-59.6	-32.8	-178.3	-61.9	-179.7	167.6	0	0	112.5	N101 F105	N101-E103 PolarHBondContact O-N 3.5Å; E103-F105 VanDerWaalsContact C-N 3.27Å; E103-F105 PolarHBondContact O-N 2.86Å
104	D	94.1	Very high	96.1	Very high	105 Å²	105	60.7 Å²	60.7	56%	0.561	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-76.2	-16.2	-179.7	-64.7	-33.6	0	0	0	113.1	N101 P102	N101-D104 PolarHBondContact O-N 3Å; P102-D104 PolarHBondContact O-N 3.41Å
105	F	94.6	Very high	96	Very high	17 Å²	17	58.4 Å²	58.4	8%	0.075	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-131.6	50.2	-172.6	-61.6	-85.5	0	0	0	111.6	T36 R39 L40 F43 W100 P102 E103 E107 V108	T36-F105 VanDerWaalsContact CG2-C 3.49Å; T36-F105 HydrophobicContact CG2-CB 3.94Å; T36-F105 WeakPolarHBondContact CG2-O 3.24Å; R39-F105 HydrophobicContact CB-CE1 4.26Å; L40-F105 HydrophobicContact CB-CD1 3.78Å; L40-F105 HydrophobicContact CB-CE1 4.05Å; L40-F105 HydrophobicContact CB-CG 4.3Å; L40-F105 HydrophobicContact CD1-CD1 4.13Å; L40-F105 HydrophobicContact CD1-CD2 3.96Å; L40-F105 HydrophobicContact CD1-CE1 4.17Å; L40-F105 HydrophobicContact CD1-CE2 4.01Å; L40-F105 HydrophobicContact CD1-CG 4.02Å; L40-F105 HydrophobicContact CD1-CZ 4.11Å; F43-F105 HydrophobicContact CB-CE1 4.44Å; F43-F105 HydrophobicContact CB-CZ 4.01Å; F43-F105 HydrophobicContact CD1-CE2 4.34Å; F43-F105 HydrophobicContact CD1-CZ 4.04Å; F43-F105 HydrophobicContact CD2-CZ 4.4Å; F43-F105 AromaticContact CG-CZ 3.89Å; F43-F105 HydrophobicContact CG-CZ 3.89Å; W100-F105 HydrophobicContact CB-CD2 4.38Å; W100-F105 HydrophobicContact CB-CE2 4.24Å; W100-F105 AromaticContact CD1-CD2 3.89Å; W100-F105 HydrophobicContact CG-CD2 4.43Å; P102-F105 CarbonylContact O-C 3.55Å; P102-F105 PolarHBondContact O-N 3.33Å; E103-F105 VanDerWaalsContact C-N 3.27Å; E103-F105 PolarHBondContact O-N 2.86Å; F105-E107 VanDerWaalsContact C-N 3.31Å; F105-E107 PolarHBondContact O-N 2.9Å; F105-V108 VanDerWaalsContact O-CB 3.3Å; F105-V108 WeakPolarHBondContact O-CB 3.41Å; F105-V108 WeakPolarHBondContact O-CG2 3.32Å; F105-V108 PolarHBondContact O-N 3.45Å; F105-V108 VanDerWaalsContact O-N 3.13Å
106	D	94	Very high	95.9	Very high	129 Å²	129	61.4 Å²	61.4	69%	0.69	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	40.1	171	-158.4	26	0	0	0	113.4	T36 V108	T36-D106 HydrophobicContact CG2-CB 3.8Å; D106-V108 PolarHBondContact O-N 3.16Å; D106-V108 VanDerWaalsContact O-N 3.14Å
107	E	95.7	Very high	95.8	Very high	110 Å²	110	62.6 Å²	62.6	51%	0.514	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	23.7	-179.3	-63.1	-65.3	159.1	0	0	114.4	P102 F105 K109	P102-E107 VanDerWaalsContact O-CA 3.29Å; P102-E107 WeakPolarHBondContact O-CA 3.33Å; P102-E107 PolarHBondContact O-N 2.99Å; F105-E107 VanDerWaalsContact C-N 3.31Å; F105-E107 PolarHBondContact O-N 2.9Å; E107-K109 PolarHBondContact O-N 3.26Å
108	V	95.6	Very high	95.8	Very high	29 Å²	29	58.1 Å²	58.1	18%	0.176	31%	0.313	C	S	.	.			trans	-69.6	113.4	177.4	173.7	0	0	0	0	109.8	T36 L37 L40 W100 F105 D106 Q110	T36-V108 HydrophobicContact CG2-CG2 4.1Å; L37-V108 HydrophobicContact CD2-CG1 4.19Å; L37-V108 HydrophobicContact CD2-CG2 4.41Å; L40-V108 HydrophobicContact CD2-CG1 3.94Å; W100-V108 PolarHBondContact NE1-O 3.24Å; F105-V108 VanDerWaalsContact O-CB 3.3Å; F105-V108 WeakPolarHBondContact O-CB 3.41Å; F105-V108 WeakPolarHBondContact O-CG2 3.32Å; F105-V108 PolarHBondContact O-N 3.45Å; F105-V108 VanDerWaalsContact O-N 3.13Å; D106-V108 PolarHBondContact O-N 3.16Å; D106-V108 VanDerWaalsContact O-N 3.14Å; V108-Q110 WeakPolarHBondContact CG1-O 3.36Å
109	K	95.8	Very high	95.8	Very high	128 Å²	128	58.9 Å²	58.9	56%	0.557	32%	0.316	S	S	*	.			trans	-96.7	-19	-179.9	-66.8	-178.3	-177.5	-176.5	0	114.4	P102 E107 T143 H144	P102-K109 HydrophobicContact CB-CG 4.33Å; P102-K109 HydrophobicContact CG-CG 4.24Å; E107-K109 PolarHBondContact O-N 3.26Å; K109-T143 CarbonylContact O-C 3.48Å; K109-T143 WeakPolarHBondContact O-CA 3.32Å; K109-H144 PolarHBondContact O-N 3.04Å
110	Q	96.2	Very high	95.9	Very high	90 Å²	90	58.3 Å²	58.3	42%	0.421	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	139.5	-177.9	-171.8	179.5	48.1	0	0	110	V108 Y141 V142	V108-Q110 WeakPolarHBondContact CG1-O 3.36Å; Q110-Y141 HydrophobicContact CG-CD1 3.8Å; Q110-Y141 HydrophobicContact CG-CG 4.38Å; Q110-V142 CarbonylContact C-O 3.58Å; Q110-V142 VanDerWaalsContact CA-O 3.29Å; Q110-V142 WeakPolarHBondContact CA-O 3.46Å; Q110-V142 WeakPolarHBondContact CG-O 2.98Å
111	V	96.3	Very high	95.9	Very high	10 Å²	10	58 Å²	58	6%	0.061	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147.9	176.5	66.3	0	0	0	0	109.8	L37 L40 L44 W100 L113 V142	L37-V111 HydrophobicContact CD2-CG2 4.24Å; L40-V111 HydrophobicContact CD2-CB 4.12Å; L40-V111 HydrophobicContact CD2-CG1 4.29Å; L40-V111 HydrophobicContact CD2-CG2 4.38Å; L44-V111 HydrophobicContact CD1-CG1 4.19Å; W100-V111 HydrophobicContact CH2-CB 4.48Å; W100-V111 HydrophobicContact CH2-CG1 3.7Å; W100-V111 HydrophobicContact CZ2-CG1 4.29Å; W100-V111 HydrophobicContact CZ3-CG1 4.2Å; V111-L113 HydrophobicContact CG1-CD2 4.31Å; V111-L113 HydrophobicContact CG1-CG 4.14Å; V111-L113 HydrophobicContact CG2-CD2 4.24Å; V111-V142 HydrophobicContact CG1-CB 4.27Å; V111-V142 PolarHBondContact N-O 3.13Å; V111-V142 PolarHBondContact O-N 2.99Å
112	S	96.9	Very high	95.9	Very high	64 Å²	64	56.8 Å²	56.8	45%	0.448	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	125.4	169.7	52.1	0	0	0	0	110	V140	S112-V140 VanDerWaalsContact CA-O 3.32Å; S112-V140 WeakPolarHBondContact CA-O 3.45Å
113	L	95.9	Very high	95.8	Very high	13 Å²	13	56.9 Å²	56.9	7%	0.068	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	149.5	177.6	-63.4	-178.1	0	0	0	110.4	L44 V111 T115 V118 Y139 V140 V142	L44-L113 HydrophobicContact CD1-CD1 4.2Å; V111-L113 HydrophobicContact CG1-CD2 4.31Å; V111-L113 HydrophobicContact CG1-CG 4.14Å; V111-L113 HydrophobicContact CG2-CD2 4.24Å; L113-T115 PolarHBondContact O-N 2.72Å; L113-V118 HydrophobicContact CB-CG1 4.46Å; L113-V118 HydrophobicContact CD1-CG1 4.35Å; L113-Y139 WeakPolarHBondContact O-CA 3.22Å; L113-V140 PolarHBondContact N-O 3.22Å; L113-V140 PolarHBondContact O-N 3.17Å; L113-V142 HydrophobicContact CB-CG2 4.48Å; L113-V142 HydrophobicContact CD1-CG2 3.94Å; L113-V142 HydrophobicContact CG-CG2 4.26Å
114	P	96.6	Very high	95.8	Very high	44 Å²	44	53.8 Å²	53.8	29%	0.286	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	130.8	173.5	-23.3	33.9	0	0	0	111.5	A116 N117 P138 Y139	P114-A116 PolarHBondContact O-N 3.48Å; P114-A116 VanDerWaalsContact O-N 3.11Å; P114-N117 HydrophobicContact CB-CB 4.5Å; P114-N117 PolarHBondContact O-N 3.23Å; P114-P138 CarbonylContact C-O 3.32Å; P114-P138 WeakPolarHBondContact CA-O 3.35Å; P114-Y139 HydrophobicContact CG-CE1 4.18Å
115	T	96	Very high	95.9	Very high	24 Å²	24	49.2 Å²	49.2	15%	0.147	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-54.9	-32.3	175.8	-48.6	0	0	0	0	111.3	L113 N117 V118 V120 I137 P138 Y139 V140	L113-T115 PolarHBondContact O-N 2.72Å; T115-N117 PolarHBondContact O-N 3.4Å; T115-V118 PolarHBondContact O-N 3.37Å; T115-V120 HydrophobicContact CG2-CG2 3.97Å; T115-I137 PolarHBondContact OG1-O 2.99Å; T115-P138 PolarHBondContact N-O 2.78Å; T115-P138 VanDerWaalsContact OG1-C 3.23Å; T115-P138 PolarHBondContact OG1-O 3.39Å; T115-Y139 PolarHBondContact OG1-N 3.37Å; T115-V140 HydrophobicContact CG2-CG1 4.13Å
116	A	95.1	Very high	95.8	Very high	62 Å²	62	51 Å²	51	51%	0.512	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-66.5	-15.5	178.4	0	0	0	0	0	114.4	K50 P114	K50-A116 WeakPolarHBondContact CD-O 3.29Å; K50-A116 WeakPolarHBondContact CE-O 3.33Å; K50-A116 PolarHBondContact NZ-O 2.88Å; P114-A116 PolarHBondContact O-N 3.48Å; P114-A116 VanDerWaalsContact O-N 3.11Å
117	N	94.6	Very high	95.9	Very high	88 Å²	88	46.5 Å²	46.5	47%	0.471	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-102	-12.3	-175.7	-67.5	-0.8	0	0	0	113.5	Y48 P114 T115	Y48-N117 WeakPolarHBondContact CD1-O 3.32Å; Y48-N117 VanDerWaalsContact CE1-O 3.23Å; Y48-N117 WeakPolarHBondContact CE1-O 3.37Å; P114-N117 HydrophobicContact CB-CB 4.5Å; P114-N117 PolarHBondContact O-N 3.23Å; T115-N117 PolarHBondContact O-N 3.4Å
118	V	96.1	Very high	95.7	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.018	25%	0.245	C	C	.	.	S	Bend	trans	-106.9	154.7	-179.2	-61.6	0	0	0	0	111.3	L98 L113 T115 V120 V140	L98-V118 HydrophobicContact CD1-CB 4.44Å; L98-V118 HydrophobicContact CD1-CG1 3.74Å; L113-V118 HydrophobicContact CB-CG1 4.46Å; L113-V118 HydrophobicContact CD1-CG1 4.35Å; T115-V118 PolarHBondContact O-N 3.37Å; V118-V120 HydrophobicContact CG2-CG2 4.14Å; V118-V140 HydrophobicContact CG2-CG2 3.83Å
119	W	97.6	Very high	95.5	Very high	19 Å²	19	47.4 Å²	47.4	7%	0.072	26%	0.26	C	S	.	.			trans	-66.3	138	167.9	179.8	91.3	0	0	0	109.7	Y48 K50 R53 P54 T62 W93 P121 I188	Y48-W119 PolarHBondContact OH-N 3.47Å; K50-W119 WeakPolarHBondContact O-CB 3.35Å; R53-W119 HydrophobicContact CB-CZ2 4.44Å; R53-W119 HydrophobicContact CG-CH2 4.41Å; R53-W119 HydrophobicContact CG-CZ2 4.14Å; P54-W119 VanDerWaalsContact CD-CD2 3.49Å; P54-W119 VanDerWaalsContact CD-CE3 3.47Å; P54-W119 HydrophobicContact CG-CD2 4.27Å; P54-W119 HydrophobicContact CG-CE3 3.85Å; P54-W119 HydrophobicContact CG-CZ3 4.41Å; T62-W119 HydrophobicContact CG2-CH2 4.43Å; T62-W119 HydrophobicContact CG2-CZ3 4.19Å; W93-W119 WeakPolarHBondContact CZ2-O 3.43Å; W93-W119 AromaticContact NE1-CE3 3.84Å; W119-P121 HydrophobicContact CH2-CB 3.67Å; W119-P121 HydrophobicContact CH2-CG 4.42Å; W119-P121 HydrophobicContact CZ2-CB 4.4Å; W119-P121 HydrophobicContact CZ3-CB 3.94Å; W119-P121 HydrophobicContact CZ3-CG 4.19Å; W119-I188 HydrophobicContact CH2-CD1 3.9Å; W119-I188 HydrophobicContact CH2-CG1 4.43Å; W119-I188 HydrophobicContact CZ2-CD1 4.1Å
120	V	97.3	Very high	95.2	Very high	54 Å²	54	46.1 Å²	46.1	33%	0.327	26%	0.259	S	S	.	.			trans	-132.7	130	-179.7	-179.2	0	0	0	0	108.7	W93 T115 V118	W93-V120 HydrophobicContact CH2-CG1 4.49Å; W93-V120 HydrophobicContact CH2-CG2 4.39Å; W93-V120 HydrophobicContact CZ2-CG2 4.39Å; T115-V120 HydrophobicContact CG2-CG2 3.97Å; V118-V120 HydrophobicContact CG2-CG2 4.14Å
121	P	97.4	Very high	94.2	Very high	7 Å²	7	48.3 Å²	48.3	5%	0.045	28%	0.279	C	S	.	.			trans	-69.4	147.3	178.4	28.8	-35.1	0	0	0	111.7	V64 W93 W119 I123 I188	V64-P121 HydrophobicContact CG1-CG 4.32Å; V64-P121 HydrophobicContact CG2-CB 4.07Å; V64-P121 HydrophobicContact CG2-CG 3.91Å; W93-P121 HydrophobicContact CD2-CG 4.5Å; W93-P121 HydrophobicContact CE3-CG 4.41Å; W119-P121 HydrophobicContact CH2-CB 3.67Å; W119-P121 HydrophobicContact CH2-CG 4.42Å; W119-P121 HydrophobicContact CZ2-CB 4.4Å; W119-P121 HydrophobicContact CZ3-CB 3.94Å; W119-P121 HydrophobicContact CZ3-CG 4.19Å; P121-I123 VanDerWaalsContact C-N 3.25Å; P121-I123 HydrophobicContact CB-CD1 4.25Å; P121-I123 HydrophobicContact CB-CG1 4.11Å; P121-I123 HydrophobicContact CG-CG1 4.19Å; P121-I123 PolarHBondContact O-N 3.46Å; P121-I188 HydrophobicContact CB-CD1 3.99Å
122	D	95.6	Very high	93.3	Very high	45 Å²	45	48.5 Å²	48.5	24%	0.241	28%	0.283	C	S	.	.			trans	-83.6	53.1	-178	64.4	-39	0	0	0	112.8	L124 S180 W181 L182 H183	D122-L124 PolarHBondContact O-N 3.24Å; D122-S180 WeakPolarHBondContact O-CA 3.48Å; D122-S180 PolarHBondContact OD1-OG 3.46Å; D122-S180 PolarHBondContact OD2-OG 2.89Å; D122-S180 VanDerWaalsContact OD2-OG 3.12Å; D122-W181 PolarHBondContact O-N 3.33Å; D122-W181 PolarHBondContact OD2-N 3.37Å; D122-L182 PolarHBondContact OD2-N 3.49Å; D122-H183 IonicContact OD1-CE1 3.93Å; D122-H183 IonicContact OD1-ND1 2.8Å; D122-H183 PolarHBondContact OD1-ND1 3.15Å; D122-H183 IonicContact OD2-ND1 3.33Å
123	I	96.1	Very high	92.8	Very high	15 Å²	15	54.6 Å²	54.6	8%	0.077	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	117.2	179.1	-50.1	-56.7	0	0	0	110.6	V64 P121 F178 Q179 I188 I190	V64-I123 HydrophobicContact CG1-CG1 4.3Å; P121-I123 VanDerWaalsContact C-N 3.25Å; P121-I123 HydrophobicContact CB-CD1 4.25Å; P121-I123 HydrophobicContact CB-CG1 4.11Å; P121-I123 HydrophobicContact CG-CG1 4.19Å; P121-I123 PolarHBondContact O-N 3.46Å; I123-F178 HydrophobicContact CG2-CB 4.07Å; I123-F178 HydrophobicContact CG2-CD1 3.95Å; I123-Q179 WeakPolarHBondContact CA-O 3.39Å; I123-I188 HydrophobicContact CD1-CG2 4.24Å; I123-I190 HydrophobicContact CD1-CD1 4.08Å; I123-I190 HydrophobicContact CD1-CG1 4.39Å
124	L	94.6	Very high	92.5	Very high	74 Å²	74	56.3 Å²	56.3	39%	0.387	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	163.5	-175.3	-74.3	154.3	0	0	0	111	D122 F178 Q179 W181	D122-L124 PolarHBondContact O-N 3.24Å; L124-F178 WeakPolarHBondContact O-CA 3.43Å; L124-Q179 PolarHBondContact N-O 2.9Å; L124-Q179 PolarHBondContact O-N 2.87Å; L124-W181 HydrophobicContact CD1-CB 3.59Å; L124-W181 HydrophobicContact CD1-CG 4.18Å
125	I	95.4	Very high	92.2	Very high	8 Å²	8	57.6 Å²	57.6	4%	0.041	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127.3	175.3	-55.4	178.8	0	0	0	108.9	E127 F128 V156 T158 T177 F178	I125-E127 VanDerWaalsContact C-N 3.34Å; I125-E127 HydrophobicContact CG2-CB 4.48Å; I125-E127 WeakPolarHBondContact CG2-OE2 3.3Å; I125-E127 PolarHBondContact O-N 3.45Å; I125-F128 HydrophobicContact CB-CD1 4.26Å; I125-F128 HydrophobicContact CB-CD2 3.7Å; I125-F128 HydrophobicContact CB-CE1 4.15Å; I125-F128 HydrophobicContact CB-CE2 3.59Å; I125-F128 HydrophobicContact CB-CG 4.03Å; I125-F128 HydrophobicContact CB-CZ 3.83Å; I125-F128 HydrophobicContact CD1-CE1 3.86Å; I125-F128 HydrophobicContact CD1-CE2 4.16Å; I125-F128 HydrophobicContact CD1-CZ 3.55Å; I125-F128 HydrophobicContact CG1-CD2 4.44Å; I125-F128 HydrophobicContact CG1-CE1 4.34Å; I125-F128 HydrophobicContact CG1-CE2 3.82Å; I125-F128 HydrophobicContact CG1-CZ 3.76Å; I125-F128 VanDerWaalsContact O-CD2 3.24Å; I125-F128 WeakPolarHBondContact O-CD2 3.42Å; I125-F128 PolarHBondContact O-N 2.62Å; I125-V156 HydrophobicContact CD1-CG1 3.84Å; I125-V156 HydrophobicContact CD1-CG2 3.86Å; I125-T158 HydrophobicContact CG2-CG2 4.11Å; I125-T177 VanDerWaalsContact CA-O 3.29Å; I125-T177 WeakPolarHBondContact CA-O 3.27Å; I125-F178 HydrophobicContact CD1-CE1 3.81Å; I125-F178 HydrophobicContact CD1-CE2 4.15Å; I125-F178 HydrophobicContact CD1-CZ 3.59Å; I125-F178 HydrophobicContact CG1-CD1 3.96Å; I125-F178 HydrophobicContact CG1-CD2 4.49Å; I125-F178 HydrophobicContact CG1-CE1 3.7Å; I125-F178 HydrophobicContact CG1-CE2 4.28Å; I125-F178 HydrophobicContact CG1-CG 4.36Å; I125-F178 HydrophobicContact CG1-CZ 3.88Å
126	N	93.9	Very high	91.9	Very high	56 Å²	56	63.3 Å²	63.3	30%	0.299	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-37.5	-177.6	-73.3	-13.1	0	0	0	113.2	F128 T177 Q179 E234	N126-F128 PolarHBondContact O-N 2.94Å; N126-T177 PolarHBondContact N-O 2.94Å; N126-T177 VanDerWaalsContact N-O 3.08Å; N126-Q179 PolarHBondContact ND2-NE2 2.94Å; N126-Q179 VanDerWaalsContact OD1-CG 3.3Å; N126-Q179 WeakPolarHBondContact OD1-CG 3.4Å; N126-Q179 PolarHBondContact OD1-NE2 3.22Å; N126-E234 PolarHBondContact ND2-OE1 3.44Å
127	E	94.9	Very high	91.9	Very high	34 Å²	34	62.9 Å²	62.9	16%	0.159	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	7.4	-175.7	-58.9	91.5	157.6	0	0	113.7	I125 V129 T158 A159 S175 T177	I125-E127 VanDerWaalsContact C-N 3.34Å; I125-E127 HydrophobicContact CG2-CB 4.48Å; I125-E127 WeakPolarHBondContact CG2-OE2 3.3Å; I125-E127 PolarHBondContact O-N 3.45Å; E127-V129 PolarHBondContact O-N 2.87Å; E127-T158 HydrophobicContact CB-CG2 4Å; E127-T158 CarbonylContact O-C 3.57Å; E127-T158 WeakPolarHBondContact O-CA 3.31Å; E127-A159 PolarHBondContact O-N 2.96Å; E127-S175 WeakPolarHBondContact OE1-CB 3.36Å; E127-S175 PolarHBondContact OE1-OG 3.42Å; E127-T177 WeakPolarHBondContact OE1-CB 3.49Å; E127-T177 PolarHBondContact OE1-N 2.97Å; E127-T177 PolarHBondContact OE1-OG1 3.32Å; E127-T177 WeakPolarHBondContact OE2-CB 3.4Å; E127-T177 PolarHBondContact OE2-N 3.35Å
128	F	92.5	Very high	92	Very high	76 Å²	76	62.2 Å²	62.2	33%	0.333	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	130.2	-179.5	-85.5	-39.3	0	0	0	112.5	I125 N126 V156 T158	I125-F128 HydrophobicContact CB-CD1 4.26Å; I125-F128 HydrophobicContact CB-CD2 3.7Å; I125-F128 HydrophobicContact CB-CE1 4.15Å; I125-F128 HydrophobicContact CB-CE2 3.59Å; I125-F128 HydrophobicContact CB-CG 4.03Å; I125-F128 HydrophobicContact CB-CZ 3.83Å; I125-F128 HydrophobicContact CD1-CE1 3.86Å; I125-F128 HydrophobicContact CD1-CE2 4.16Å; I125-F128 HydrophobicContact CD1-CZ 3.55Å; I125-F128 HydrophobicContact CG1-CD2 4.44Å; I125-F128 HydrophobicContact CG1-CE1 4.34Å; I125-F128 HydrophobicContact CG1-CE2 3.82Å; I125-F128 HydrophobicContact CG1-CZ 3.76Å; I125-F128 VanDerWaalsContact O-CD2 3.24Å; I125-F128 WeakPolarHBondContact O-CD2 3.42Å; I125-F128 PolarHBondContact O-N 2.62Å; N126-F128 PolarHBondContact O-N 2.94Å; F128-V156 HydrophobicContact CD1-CG1 4.43Å; F128-V156 HydrophobicContact CE1-CB 4.18Å; F128-V156 HydrophobicContact CE1-CG1 3.82Å; F128-V156 HydrophobicContact CE1-CG2 4.16Å; F128-V156 HydrophobicContact CZ-CG2 4.46Å; F128-T158 HydrophobicContact CD1-CG2 4.15Å
129	V	91	Very high	92	Very high	82 Å²	82	68.6 Å²	68.6	50%	0.497	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-21.4	172.7	-63.5	0	0	0	0	113	V82 E127 V157 A159	V82-V129 HydrophobicContact CG1-CG2 4.15Å; V82-V129 HydrophobicContact CG2-CG2 4.24Å; E127-V129 PolarHBondContact O-N 2.87Å; V129-V157 HydrophobicContact CG2-CB 4.33Å; V129-V157 HydrophobicContact CG2-CG1 3.66Å; V129-V157 WeakPolarHBondContact CG2-O 3.47Å; V129-V157 PolarHBondContact N-O 3.02Å; V129-A159 HydrophobicContact CG1-CB 3.74Å
130	D	88.8	Confident	92	Very high	100 Å²	100	67.9 Å²	67.9	54%	0.535	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	147.7	177	-168.6	12.7	0	0	0	110.4	G132 V157	D130-G132 PolarHBondContact O-N 3.14Å; D130-V157 HydrophobicContact CB-CB 4.04Å; D130-V157 HydrophobicContact CB-CG1 4.11Å; D130-V157 HydrophobicContact CB-CG2 4.31Å
131	V	76.3	Confident	92.1	Very high	137 Å²	137	70.5 Å²	70.5	83%	0.83	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	92.4	176	-172.3	0	0	0	0	106.6
132	G	76.8	Confident	92.1	Very high	14 Å²	14	70.2 Å²	70.2	14%	0.144	37%	0.366	C	S	.	.			trans	-54.6	166.7	-178.2	0	0	0	0	0	113.9	D130 S134	D130-G132 PolarHBondContact O-N 3.14Å; G132-S134 VanDerWaalsContact C-N 3.29Å; G132-S134 PolarHBondContact O-N 3.21Å
133	K	85.9	Confident	92.2	Very high	192 Å²	192	69.2 Å²	69.2	84%	0.835	36%	0.362	S	S	*	.			trans	-81.7	72.7	-178.4	-59.4	177	-176.1	175.7	0	110.5
134	S	89.8	Confident	92.3	Very high	49 Å²	49	70.8 Å²	70.8	34%	0.343	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-94.7	132.9	177.5	-51.1	0	0	0	0	110.4	G132 I154 Q155	G132-S134 VanDerWaalsContact C-N 3.29Å; G132-S134 PolarHBondContact O-N 3.21Å; S134-I154 WeakPolarHBondContact OG-CA 3.42Å; S134-Q155 PolarHBondContact OG-N 3.37Å
135	P	90.3	Very high	92.4	Very high	70 Å²	70	73.9 Å²	73.9	46%	0.455	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-69.2	138.9	173	29.9	-33.5	0	0	0	109.9	P153	P135-P153 HydrophobicContact CG-CG 3.69Å
136	D	90.1	Very high	92.4	Very high	145 Å²	145	73.5 Å²	73.5	78%	0.775	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-76.8	132.4	172.9	-168.5	22	0	0	0	110	P138	D136-P138 WeakPolarHBondContact O-CD 3.45Å
137	I	95.1	Very high	92.6	Very high	53 Å²	53	73.4 Å²	73.4	27%	0.272	38%	0.378	S	S	.	.			trans	-101.2	109.4	-178.9	-55	-56.1	0	0	0	108.2	T115 Y139 K152	T115-I137 PolarHBondContact OG1-O 2.99Å; I137-Y139 VanDerWaalsContact C-N 3.26Å; I137-Y139 PolarHBondContact O-N 3.17Å; I137-K152 HydrophobicContact CG1-CB 4.12Å
138	P	96.5	Very high	92.8	Very high	73 Å²	73	71.8 Å²	71.8	47%	0.474	37%	0.371	S	S	.	.			trans	-78.8	-6.1	-166.6	29	-33.9	0	0	0	114.2	P114 T115 D136	P114-P138 CarbonylContact C-O 3.32Å; P114-P138 WeakPolarHBondContact CA-O 3.35Å; T115-P138 PolarHBondContact N-O 2.78Å; T115-P138 VanDerWaalsContact OG1-C 3.23Å; T115-P138 PolarHBondContact OG1-O 3.39Å; D136-P138 WeakPolarHBondContact O-CD 3.45Å
139	Y	96.9	Very high	93	Very high	138 Å²	138	70.2 Å²	70.2	54%	0.541	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	146.5	-175.6	-64.5	-77.9	0	0	0	112.6	L113 P114 T115 I137	L113-Y139 WeakPolarHBondContact O-CA 3.22Å; P114-Y139 HydrophobicContact CG-CE1 4.18Å; T115-Y139 PolarHBondContact OG1-N 3.37Å; I137-Y139 VanDerWaalsContact C-N 3.26Å; I137-Y139 PolarHBondContact O-N 3.17Å
140	V	97.8	Very high	93.3	Very high	3 Å²	3	66.7 Å²	66.7	2%	0.018	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	154.9	167.4	-64.7	0	0	0	0	109.8	S112 L113 T115 V118 V142 V148 N150	S112-V140 VanDerWaalsContact CA-O 3.32Å; S112-V140 WeakPolarHBondContact CA-O 3.45Å; L113-V140 PolarHBondContact N-O 3.22Å; L113-V140 PolarHBondContact O-N 3.17Å; T115-V140 HydrophobicContact CG2-CG1 4.13Å; V118-V140 HydrophobicContact CG2-CG2 3.83Å; V140-V142 HydrophobicContact CG2-CG2 4.29Å; V140-V148 HydrophobicContact CB-CG1 4.05Å; V140-V148 HydrophobicContact CG2-CG1 3.95Å; V140-N150 HydrophobicContact CG1-CB 3.87Å
141	Y	97.8	Very high	93.7	Very high	110 Å²	110	66.5 Å²	66.5	43%	0.431	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	139.4	167.9	-79.5	-64.9	0	0	0	110.1	Q110 V148 Q149 Y151	Q110-Y141 HydrophobicContact CG-CD1 3.8Å; Q110-Y141 HydrophobicContact CG-CG 4.38Å; Y141-V148 CarbonylContact O-C 3.58Å; Y141-V148 WeakPolarHBondContact O-CA 3.43Å; Y141-Q149 PolarHBondContact N-O 2.92Å; Y141-Q149 PolarHBondContact O-N 3.11Å; Y141-Y151 HydrophobicContact CD2-CE2 4.48Å
142	V	97.9	Very high	94.6	Very high	0 Å²	0	63 Å²	63	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	133.3	173.3	-172.4	0	0	0	0	108.1	L98 W100 Q110 V111 L113 V140 V148	L98-V142 HydrophobicContact CB-CG1 3.97Å; L98-V142 HydrophobicContact CD1-CG1 4.35Å; L98-V142 HydrophobicContact CD1-CG2 4.4Å; W100-V142 HydrophobicContact CH2-CG1 4.47Å; W100-V142 HydrophobicContact CZ3-CG1 4.03Å; Q110-V142 CarbonylContact C-O 3.58Å; Q110-V142 VanDerWaalsContact CA-O 3.29Å; Q110-V142 WeakPolarHBondContact CA-O 3.46Å; Q110-V142 WeakPolarHBondContact CG-O 2.98Å; V111-V142 HydrophobicContact CG1-CB 4.27Å; V111-V142 PolarHBondContact N-O 3.13Å; V111-V142 PolarHBondContact O-N 2.99Å; L113-V142 HydrophobicContact CB-CG2 4.48Å; L113-V142 HydrophobicContact CD1-CG2 3.94Å; L113-V142 HydrophobicContact CG-CG2 4.26Å; V140-V142 HydrophobicContact CG2-CG2 4.29Å; V142-V148 HydrophobicContact CG1-CG2 4.29Å; V142-V148 HydrophobicContact CG2-CG1 4.28Å; V142-V148 HydrophobicContact CG2-CG2 4.14Å
143	T	98	Very high	95.5	Very high	24 Å²	24	63.4 Å²	63.4	15%	0.147	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	159.9	174.4	66.4	0	0	0	0	110.7	W100 K109 E145 G146 L147	W100-T143 WeakPolarHBondContact CH2-O 3.34Å; W100-T143 VanDerWaalsContact CZ3-O 3.28Å; W100-T143 WeakPolarHBondContact CZ3-O 3.42Å; K109-T143 CarbonylContact O-C 3.48Å; K109-T143 WeakPolarHBondContact O-CA 3.32Å; T143-E145 PolarHBondContact O-N 3.49Å; T143-G146 PolarHBondContact O-N 2.89Å; T143-L147 HydrophobicContact CG2-CB 4.38Å; T143-L147 PolarHBondContact N-O 3.04Å; T143-L147 VanDerWaalsContact OG1-CB 3.26Å; T143-L147 WeakPolarHBondContact OG1-CB 3.36Å; T143-L147 PolarHBondContact OG1-N 2.98Å; T143-L147 PolarHBondContact OG1-O 3.23Å
144	H	97.3	Very high	95.9	Very high	49 Å²	49	55.3 Å²	55.3	23%	0.227	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.9	-179.4	74.8	85.9	0	0	0	114.1	V99 W100 P102 K109 G146	V99-H144 WeakPolarHBondContact CG1-O 3.34Å; W100-H144 HydrophobicContact CD2-CB 3.95Å; W100-H144 HydrophobicContact CE3-CB 4.41Å; W100-H144 HydrophobicContact CG-CB 4.42Å; W100-H144 HydrophobicContact CH2-CB 4.26Å; W100-H144 VanDerWaalsContact CH2-N 3.32Å; W100-H144 HydrophobicContact CZ2-CB 3.77Å; W100-H144 PolarHBondContact N-O 2.84Å; P102-H144 HydrophobicContact CG-CB 3.81Å; K109-H144 PolarHBondContact O-N 3.04Å; H144-G146 VanDerWaalsContact C-N 3.3Å
145	E	96.9	Very high	96.1	Very high	138 Å²	138	55 Å²	55	65%	0.645	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-3	176.9	-57.1	-177.3	166.3	0	0	113.2	T143	T143-E145 PolarHBondContact O-N 3.49Å
146	G	96.1	Very high	96.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.246	C	C	.	.	S	Bend	trans	89.2	1.9	-176.7	0	0	0	0	0	114.4	T94 D95 L98 T143 H144 V148	T94-G146 WeakPolarHBondContact CA-O 3.38Å; D95-G146 PolarHBondContact N-O 3.41Å; D95-G146 WeakPolarHBondContact O-CA 3.06Å; L98-G146 WeakPolarHBondContact O-CA 3.28Å; T143-G146 PolarHBondContact O-N 2.89Å; H144-G146 VanDerWaalsContact C-N 3.3Å; G146-V148 PolarHBondContact O-N 3.23Å
147	L	98.1	Very high	96.6	Very high	54 Å²	54	45.5 Å²	45.5	28%	0.283	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	116.3	173.4	-175.1	74.8	0	0	0	109.7	T143 Q149	T143-L147 HydrophobicContact CG2-CB 4.38Å; T143-L147 PolarHBondContact N-O 3.04Å; T143-L147 VanDerWaalsContact OG1-CB 3.26Å; T143-L147 WeakPolarHBondContact OG1-CB 3.36Å; T143-L147 PolarHBondContact OG1-N 2.98Å; T143-L147 PolarHBondContact OG1-O 3.23Å; L147-Q149 HydrophobicContact CD2-CG 4.39Å; L147-Q149 HydrophobicContact CG-CG 4.46Å
148	V	98.3	Very high	96.7	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	130.9	174.6	-173.8	0	0	0	0	109	S92 W93 D95 L98 V140 Y141 V142 G146	S92-V148 WeakPolarHBondContact CA-O 3.23Å; S92-V148 VanDerWaalsContact CB-O 3.32Å; S92-V148 WeakPolarHBondContact CB-O 3.25Å; W93-V148 HydrophobicContact CD2-CB 4.09Å; W93-V148 HydrophobicContact CD2-CG1 4.46Å; W93-V148 HydrophobicContact CE3-CB 4.47Å; W93-V148 HydrophobicContact CH2-CB 4.24Å; W93-V148 HydrophobicContact CH2-CG1 3.55Å; W93-V148 HydrophobicContact CZ2-CB 3.84Å; W93-V148 HydrophobicContact CZ2-CG1 3.4Å; W93-V148 VanDerWaalsContact CZ2-CG1 3.4Å; W93-V148 HydrophobicContact CZ2-CG2 4.41Å; W93-V148 HydrophobicContact CZ3-CG1 4.13Å; W93-V148 PolarHBondContact N-O 3.41Å; W93-V148 VanDerWaalsContact N-O 3.16Å; W93-V148 PolarHBondContact O-N 3.45Å; D95-V148 HydrophobicContact CB-CG2 3.95Å; L98-V148 HydrophobicContact CD1-CG2 4.3Å; V140-V148 HydrophobicContact CB-CG1 4.05Å; V140-V148 HydrophobicContact CG2-CG1 3.95Å; Y141-V148 CarbonylContact O-C 3.58Å; Y141-V148 WeakPolarHBondContact O-CA 3.43Å; V142-V148 HydrophobicContact CG1-CG2 4.29Å; V142-V148 HydrophobicContact CG2-CG1 4.28Å; V142-V148 HydrophobicContact CG2-CG2 4.14Å; G146-V148 PolarHBondContact O-N 3.23Å
149	Q	98.1	Very high	96.6	Very high	43 Å²	43	41.7 Å²	41.7	20%	0.201	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	122.6	178	-59.7	-178	-29.7	0	0	110	Y141 L147 Y151	Y141-Q149 PolarHBondContact N-O 2.92Å; Y141-Q149 PolarHBondContact O-N 3.11Å; L147-Q149 HydrophobicContact CD2-CG 4.39Å; L147-Q149 HydrophobicContact CG-CG 4.46Å; Q149-Y151 HydrophobicContact CB-CD2 4.48Å; Q149-Y151 HydrophobicContact CB-CE2 3.67Å; Q149-Y151 PolarHBondContact OE1-OH 3.43Å
150	N	97.6	Very high	96.5	Very high	8 Å²	8	35.6 Å²	35.6	4%	0.043	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	119.9	179	-172.9	1.8	0	0	0	110	R90 Q91 W93 V140	R90-N150 WeakPolarHBondContact CA-O 3.41Å; Q91-N150 HydrophobicContact CG-CB 3.97Å; Q91-N150 PolarHBondContact N-O 2.89Å; Q91-N150 PolarHBondContact O-N 3.27Å; W93-N150 HydrophobicContact CH2-CB 3.99Å; W93-N150 HydrophobicContact CZ3-CB 3.7Å; V140-N150 HydrophobicContact CG1-CB 3.87Å
151	Y	96.4	Very high	96.3	Very high	96 Å²	96	41.2 Å²	41.2	38%	0.376	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	121.9	179.7	-58.9	-90.5	0	0	0	108.4	R90 Y141 Q149	R90-Y151 HydrophobicContact CB-CD1 3.55Å; R90-Y151 HydrophobicContact CB-CE1 3.84Å; R90-Y151 HydrophobicContact CB-CG 4.41Å; R90-Y151 HydrophobicContact CG-CE1 4.46Å; Y141-Y151 HydrophobicContact CD2-CE2 4.48Å; Q149-Y151 HydrophobicContact CB-CD2 4.48Å; Q149-Y151 HydrophobicContact CB-CE2 3.67Å; Q149-Y151 PolarHBondContact OE1-OH 3.43Å
152	K	94.8	Very high	96	Very high	63 Å²	63	36.2 Å²	36.2	27%	0.274	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	134.3	178.5	59.6	-176.9	-174.5	-175.9	0	111.6	Y89 I137 I154	Y89-K152 WeakPolarHBondContact CB-O 3.36Å; Y89-K152 HydrophobicContact CD1-CD 4.18Å; Y89-K152 HydrophobicContact CD1-CG 3.74Å; Y89-K152 PolarHBondContact N-O 3.45Å; Y89-K152 PolarHBondContact O-N 3.26Å; I137-K152 HydrophobicContact CG1-CB 4.12Å; K152-I154 HydrophobicContact CD-CD1 4.37Å; K152-I154 HydrophobicContact CD-CG1 4.44Å; K152-I154 HydrophobicContact CG-CD1 4.28Å; K152-I154 HydrophobicContact CG-CG1 4.1Å
153	P	95.4	Very high	95.6	Very high	24 Å²	24	41.1 Å²	41.1	16%	0.156	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	140.8	164.5	31.9	-31.9	0	0	0	109.6	Y86 V87 P135	Y86-P153 HydrophobicContact CE1-CB 4.34Å; Y86-P153 HydrophobicContact CE2-CB 4.12Å; Y86-P153 WeakPolarHBondContact OH-CB 3.45Å; V87-P153 WeakPolarHBondContact O-CA 3.26Å; P135-P153 HydrophobicContact CG-CG 3.69Å
154	I	94.1	Very high	95.2	Very high	21 Å²	21	40.2 Å²	40.2	11%	0.108	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	125.7	178.8	-47.1	177	0	0	0	108.6	V87 Y89 S134 K152 V156	V87-I154 HydrophobicContact CG2-CB 3.95Å; V87-I154 WeakPolarHBondContact CG2-O 3.48Å; V87-I154 PolarHBondContact N-O 3.11Å; V87-I154 PolarHBondContact O-N 2.97Å; Y89-I154 HydrophobicContact CD1-CD1 3.96Å; Y89-I154 HydrophobicContact CD2-CD1 4.38Å; Y89-I154 HydrophobicContact CG-CD1 3.7Å; S134-I154 WeakPolarHBondContact OG-CA 3.42Å; K152-I154 HydrophobicContact CD-CD1 4.37Å; K152-I154 HydrophobicContact CD-CG1 4.44Å; K152-I154 HydrophobicContact CG-CD1 4.28Å; K152-I154 HydrophobicContact CG-CG1 4.1Å; I154-V156 HydrophobicContact CB-CG2 4.06Å; I154-V156 HydrophobicContact CG2-CG2 3.6Å
155	Q	95.8	Very high	94.7	Very high	42 Å²	42	44 Å²	44	20%	0.196	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	113.9	160.3	-175.2	179.9	25.5	0	0	108.2	L74 T84 Y86 S134	L74-Q155 HydrophobicContact CD1-CG 4.07Å; T84-Q155 HydrophobicContact CG2-CG 4.22Å; Y86-Q155 HydrophobicContact CD2-CB 4.28Å; S134-Q155 PolarHBondContact OG-N 3.37Å
156	V	94.6	Very high	94.2	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	116	-174.8	173.4	0	0	0	0	109.1	T84 T85 V87 I125 F128 I154 T158 L176	T84-V156 CarbonylContact C-O 3.54Å; T84-V156 WeakPolarHBondContact CA-O 2.97Å; T85-V156 PolarHBondContact N-O 2.7Å; T85-V156 PolarHBondContact O-N 2.87Å; V87-V156 HydrophobicContact CG2-CG2 3.76Å; I125-V156 HydrophobicContact CD1-CG1 3.84Å; I125-V156 HydrophobicContact CD1-CG2 3.86Å; F128-V156 HydrophobicContact CD1-CG1 4.43Å; F128-V156 HydrophobicContact CE1-CB 4.18Å; F128-V156 HydrophobicContact CE1-CG1 3.82Å; F128-V156 HydrophobicContact CE1-CG2 4.16Å; F128-V156 HydrophobicContact CZ-CG2 4.46Å; I154-V156 HydrophobicContact CB-CG2 4.06Å; I154-V156 HydrophobicContact CG2-CG2 3.6Å; V156-T158 HydrophobicContact CG1-CG2 3.37Å; V156-L176 HydrophobicContact CG1-CD2 3.73Å
157	V	96.2	Very high	93.8	Very high	16 Å²	16	41.4 Å²	41.4	10%	0.097	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	106.8	174.3	-168.5	0	0	0	0	107.8	V82 T84 V129 D130	V82-V157 HydrophobicContact CG1-CG1 3.57Å; T84-V157 HydrophobicContact CG2-CG2 4.17Å; V129-V157 HydrophobicContact CG2-CB 4.33Å; V129-V157 HydrophobicContact CG2-CG1 3.66Å; V129-V157 WeakPolarHBondContact CG2-O 3.47Å; V129-V157 PolarHBondContact N-O 3.02Å; D130-V157 HydrophobicContact CB-CB 4.04Å; D130-V157 HydrophobicContact CB-CG1 4.11Å; D130-V157 HydrophobicContact CB-CG2 4.31Å
158	T	95.9	Very high	93.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	144	-169.8	46.4	0	0	0	0	113	V82 L83 I125 E127 F128 V156 L176	V82-T158 WeakPolarHBondContact CA-O 3.38Å; L83-T158 PolarHBondContact N-O 2.89Å; L83-T158 PolarHBondContact O-N 3.38Å; L83-T158 PolarHBondContact O-OG1 3.41Å; I125-T158 HydrophobicContact CG2-CG2 4.11Å; E127-T158 HydrophobicContact CB-CG2 4Å; E127-T158 CarbonylContact O-C 3.57Å; E127-T158 WeakPolarHBondContact O-CA 3.31Å; F128-T158 HydrophobicContact CD1-CG2 4.15Å; V156-T158 HydrophobicContact CG1-CG2 3.37Å; T158-L176 HydrophobicContact CG2-CD2 3.7Å
159	A	95.8	Very high	92.9	Very high	46 Å²	46	40.2 Å²	40.2	38%	0.38	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	129.5	166.5	0	0	0	0	0	110	Q81 E127 V129	Q81-A159 WeakPolarHBondContact O-CA 3.24Å; E127-A159 PolarHBondContact O-N 2.96Å; V129-A159 HydrophobicContact CG1-CB 3.74Å
160	C	94.4	Very high	92.5	Very high	10 Å²	10	38.3 Å²	38.3	7%	0.068	20%	0.197	C	C	.	.			trans	-143.6	133.5	176.9	174.1	0	0	0	0	109.9	Q81 L83 L162 C174	Q81-C160 CarbonylContact C-O 3.49Å; Q81-C160 WeakPolarHBondContact CB-O 3.27Å; Q81-C160 PolarHBondContact O-N 2.86Å; Q81-C160 VanDerWaalsContact O-O 3.09Å; Q81-C160 PolarHBondContact OE1-O 3.11Å; L83-C160 HydrophobicContact CB-CB 4.31Å; C160-L162 PolarHBondContact O-N 3.35Å; C160-L162 VanDerWaalsContact O-N 3.11Å; C160-C174 HydrophobicContact CB-CB 3.74Å; C160-C174 WeakPolarHBondContact CB-SG 3.49Å; C160-C174 WeakPolarHBondContact SG-CA 3.27Å; C160-C174 WeakPolarHBondContact SG-CB 3.3Å; C160-C174 CovalentContact SG-SG 2.03Å; C160-C174 PolarHBondContact SG-SG 3.32Å
161	T	91.9	Very high	92.3	Very high	121 Å²	121	41.5 Å²	41.5	74%	0.742	22%	0.216	S	C	*	.			trans	-73.5	102.4	174	52.6	0	0	0	0	110
162	L	91.8	Very high	92.2	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.026	20%	0.2	C	C	.	.			trans	-93.9	132.4	-178.8	-62.1	168.3	0	0	0	110.1	V76 E78 Q81 C160 Q172	V76-L162 HydrophobicContact CG1-CD1 3.64Å; V76-L162 HydrophobicContact CG1-CD2 4.24Å; E78-L162 HydrophobicContact CG-CD1 4.32Å; Q81-L162 PolarHBondContact OE1-O 3.11Å; C160-L162 PolarHBondContact O-N 3.35Å; C160-L162 VanDerWaalsContact O-N 3.11Å; L162-Q172 HydrophobicContact CD2-CB 3.97Å; L162-Q172 HydrophobicContact CD2-CG 3.84Å
163	N	89.3	Confident	92.3	Very high	103 Å²	103	39.9 Å²	39.9	55%	0.551	21%	0.211	S	C	*	.			trans	-109.2	110.3	177	-175.3	-4.7	0	0	0	110.6	Y165 Q172	N163-Y165 WeakPolarHBondContact OD1-CB 3.38Å; N163-Y165 PolarHBondContact OD1-N 3.42Å; N163-Q172 PolarHBondContact O-NE2 3.42Å
164	I	89.8	Confident	92.4	Very high	6 Å²	6	38.8 Å²	38.8	3%	0.031	20%	0.204	C	C	.	.			trans	-96.7	7.3	-178.8	63.6	159.1	0	0	0	113.9	E78 N166 F167 T301 P306	E78-I164 HydrophobicContact CB-CG2 3.93Å; E78-I164 HydrophobicContact CG-CG2 3.73Å; I164-N166 PolarHBondContact O-N 3.37Å; I164-N166 VanDerWaalsContact O-N 3.12Å; I164-F167 VanDerWaalsContact O-CB 3.32Å; I164-F167 WeakPolarHBondContact O-CB 3.41Å; I164-F167 PolarHBondContact O-N 3.23Å; I164-T301 HydrophobicContact CD1-CG2 3.57Å; I164-T301 HydrophobicContact CG1-CG2 4.12Å; I164-P306 WeakPolarHBondContact O-CB 3.48Å
165	Y	87.6	Confident	92.5	Very high	128 Å²	128	39.6 Å²	39.6	50%	0.502	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-39.8	-174.6	-176.2	-104.5	0	0	0	112.6	N163 L307	N163-Y165 WeakPolarHBondContact OD1-CB 3.38Å; N163-Y165 PolarHBondContact OD1-N 3.42Å; Y165-L307 WeakPolarHBondContact O-CB 3Å; Y165-L307 PolarHBondContact O-N 3.34Å
166	N	87.1	Confident	92.5	Very high	74 Å²	74	37.6 Å²	37.6	40%	0.396	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	18.2	-178.5	-65.7	-29.3	0	0	0	114	I164 F169	I164-N166 PolarHBondContact O-N 3.37Å; I164-N166 VanDerWaalsContact O-N 3.12Å; N166-F169 CarbonylContact O-C 3.55Å; N166-F169 VanDerWaalsContact O-C 3.3Å; N166-F169 VanDerWaalsContact O-CA 3.27Å; N166-F169 WeakPolarHBondContact O-CA 3.25Å; N166-F169 VanDerWaalsContact O-CB 3.28Å; N166-F169 WeakPolarHBondContact O-CB 3.26Å; N166-F169 PolarHBondContact O-N 2.82Å
167	F	87.5	Confident	92.6	Very high	9 Å²	9	37.8 Å²	37.8	4%	0.039	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	138.3	178.8	179.4	-83.3	0	0	0	112.3	I164 F169 Y248 L252 L298 P306 I308	I164-F167 VanDerWaalsContact O-CB 3.32Å; I164-F167 WeakPolarHBondContact O-CB 3.41Å; I164-F167 PolarHBondContact O-N 3.23Å; F167-F169 VanDerWaalsContact C-N 3.33Å; F167-Y248 HydrophobicContact CE1-CD1 4.15Å; F167-Y248 HydrophobicContact CE1-CG 4.34Å; F167-Y248 HydrophobicContact CE2-CD1 4.4Å; F167-Y248 HydrophobicContact CE2-CE1 4.26Å; F167-Y248 AromaticContact CZ-CD1 3.47Å; F167-Y248 HydrophobicContact CZ-CD1 3.47Å; F167-Y248 VanDerWaalsContact CZ-CD1 3.47Å; F167-Y248 HydrophobicContact CZ-CD2 4.31Å; F167-Y248 AromaticContact CZ-CE1 3.65Å; F167-Y248 HydrophobicContact CZ-CE1 3.65Å; F167-Y248 HydrophobicContact CZ-CE2 4.48Å; F167-Y248 AromaticContact CZ-CG 3.81Å; F167-Y248 HydrophobicContact CZ-CG 3.81Å; F167-L252 HydrophobicContact CE1-CD1 3.94Å; F167-L298 HydrophobicContact CD1-CD2 3.71Å; F167-L298 HydrophobicContact CE1-CD2 3.2Å; F167-L298 HydrophobicContact CE2-CD2 4.45Å; F167-L298 HydrophobicContact CZ-CD2 3.62Å; F167-P306 HydrophobicContact CB-CB 3.9Å; F167-I308 HydrophobicContact CD1-CG2 3.94Å
168	P	88.9	Confident	92.6	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.013	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	cis	-89.8	14.1	2.6	37.4	-38.7	0	0	0	114.4	P245 Y248	P168-P245 HydrophobicContact CB-CB 4.21Å; P168-P245 HydrophobicContact CG-CB 4.01Å; P168-Y248 HydrophobicContact CB-CD2 3.9Å; P168-Y248 HydrophobicContact CB-CG 3.89Å
169	F	88.6	Confident	92.6	Very high	27 Å²	27	38 Å²	38	12%	0.118	20%	0.203	C	C	.	.	S	Bend	trans	-104	43.6	-169	-66.2	-60	0	0	0	110.5	N166 F167 P245 W468 W471	N166-F169 CarbonylContact O-C 3.55Å; N166-F169 VanDerWaalsContact O-C 3.3Å; N166-F169 VanDerWaalsContact O-CA 3.27Å; N166-F169 WeakPolarHBondContact O-CA 3.25Å; N166-F169 VanDerWaalsContact O-CB 3.28Å; N166-F169 WeakPolarHBondContact O-CB 3.26Å; N166-F169 PolarHBondContact O-N 2.82Å; F167-F169 VanDerWaalsContact C-N 3.33Å; F169-P245 HydrophobicContact CD1-CB 3.37Å; F169-P245 HydrophobicContact CD1-CG 3.61Å; F169-P245 HydrophobicContact CE1-CB 3.27Å; F169-P245 HydrophobicContact CE1-CG 3.45Å; F169-P245 VanDerWaalsContact CE1-CG 3.45Å; F169-P245 HydrophobicContact CG-CB 4.34Å; F169-P245 HydrophobicContact CZ-CB 4.13Å; F169-W468 AromaticContact CE1-NE1 3.51Å; F169-W468 AromaticContact CE2-CD1 3.61Å; F169-W468 AromaticContact CE2-NE1 3.75Å; F169-W468 AromaticContact CZ-CD1 3.45Å; F169-W468 VanDerWaalsContact CZ-CD1 3.45Å; F169-W468 AromaticContact CZ-NE1 3.06Å; F169-W471 VanDerWaalsContact C-CZ2 3.46Å; F169-W471 HydrophobicContact CB-CD2 3.64Å; F169-W471 HydrophobicContact CB-CE3 3.88Å; F169-W471 HydrophobicContact CB-CG 4.35Å; F169-W471 HydrophobicContact CB-CH2 3.62Å; F169-W471 HydrophobicContact CB-CZ2 3.37Å; F169-W471 HydrophobicContact CB-CZ3 3.88Å; F169-W471 HydrophobicContact CD1-CD2 4.21Å; F169-W471 AromaticContact CD1-CE3 3.53Å; F169-W471 HydrophobicContact CD1-CE3 3.53Å; F169-W471 AromaticContact CD1-CH2 3.41Å; F169-W471 HydrophobicContact CD1-CH2 3.41Å; F169-W471 VanDerWaalsContact CD1-CH2 3.41Å; F169-W471 HydrophobicContact CD1-CZ2 4.12Å; F169-W471 AromaticContact CD1-CZ3 3.08Å; F169-W471 HydrophobicContact CD1-CZ3 3.08Å; F169-W471 HydrophobicContact CE1-CE3 4.19Å; F169-W471 HydrophobicContact CE1-CH2 4.45Å; F169-W471 AromaticContact CE1-CZ3 3.8Å; F169-W471 HydrophobicContact CE1-CZ3 3.8Å; F169-W471 HydrophobicContact CG-CD2 4.01Å; F169-W471 AromaticContact CG-CE3 3.77Å; F169-W471 HydrophobicContact CG-CE3 3.77Å; F169-W471 AromaticContact CG-CH2 3.92Å; F169-W471 HydrophobicContact CG-CH2 3.92Å; F169-W471 HydrophobicContact CG-CZ2 4.17Å; F169-W471 AromaticContact CG-CZ3 3.73Å; F169-W471 HydrophobicContact CG-CZ3 3.73Å; F169-W471 WeakPolarHBondContact O-CZ2 3.36Å; F169-W471 PolarHBondContact O-NE1 3.47Å
170	D	89.9	Confident	92.6	Very high	3 Å²	3	36 Å²	36	2%	0.016	19%	0.187	C	C	.	.			trans	-98.3	146.7	-170.6	59.5	-43.1	0	0	0	113.1	Q172 W212 R243	D170-Q172 PolarHBondContact OD2-NE2 2.69Å; D170-W212 WeakPolarHBondContact OD2-CH2 3.35Å; D170-R243 PolarHBondContact O-N 3.2Å; D170-R243 VanDerWaalsContact O-N 3.13Å; D170-R243 WeakPolarHBondContact OD1-CB 3.42Å; D170-R243 WeakPolarHBondContact OD1-CD 3.47Å; D170-R243 IonicContact OD1-CZ 3.32Å; D170-R243 IonicContact OD1-NE 2.84Å; D170-R243 PolarHBondContact OD1-NE 3.11Å; D170-R243 IonicContact OD1-NH2 3.08Å; D170-R243 IonicContact OD2-CZ 2.73Å; D170-R243 IonicContact OD2-NE 2.77Å; D170-R243 PolarHBondContact OD2-NE 3.19Å; D170-R243 IonicContact OD2-NH2 2.72Å; D170-R243 PolarHBondContact OD2-NH2 3.49Å
171	V	93.1	Very high	92.6	Very high	75 Å²	75	44 Å²	44	46%	0.455	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.8	171.3	178.9	0	0	0	0	107.2	L215 V240 I241 R242	V171-L215 HydrophobicContact CG1-CD1 4.18Å; V171-V240 HydrophobicContact CG1-CG1 3.78Å; V171-I241 CarbonylContact C-O 3.59Å; V171-I241 WeakPolarHBondContact CA-O 3.42Å; V171-R242 HydrophobicContact CG2-CB 4.28Å; V171-R242 HydrophobicContact CG2-CG 4.16Å
172	Q	94.8	Very high	92.7	Very high	5 Å²	5	44.2 Å²	44.2	2%	0.023	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	141.5	-179.4	-52	-60.3	-20.6	0	0	109.9	L162 N163 D170 W212 V240 I241	L162-Q172 HydrophobicContact CD2-CB 3.97Å; L162-Q172 HydrophobicContact CD2-CG 3.84Å; N163-Q172 PolarHBondContact O-NE2 3.42Å; D170-Q172 PolarHBondContact OD2-NE2 2.69Å; Q172-W212 HydrophobicContact CG-CH2 3.79Å; Q172-W212 HydrophobicContact CG-CZ3 3.83Å; Q172-V240 WeakPolarHBondContact O-CA 3.39Å; Q172-I241 HydrophobicContact CB-CD1 4.25Å; Q172-I241 HydrophobicContact CB-CG1 3.79Å; Q172-I241 HydrophobicContact CG-CG1 4.48Å; Q172-I241 PolarHBondContact N-O 3.49Å; Q172-I241 PolarHBondContact O-N 3.39Å
173	K	95.6	Very high	92.9	Very high	120 Å²	120	46 Å²	46	52%	0.522	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	99.6	177.4	179.1	-179.3	179	-177.7	0	108.8	H238 V240	K173-H238 VanDerWaalsContact CE-CG 3.5Å; K173-H238 HydrophobicContact CG-CB 4.28Å; K173-V240 HydrophobicContact CG-CG2 4.19Å
174	C	96.7	Very high	93.1	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.007	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	141.9	179.6	-63.7	0	0	0	0	111.3	L83 C160 H238 V239	L83-C174 HydrophobicContact CD2-CB 3.58Å; C160-C174 HydrophobicContact CB-CB 3.74Å; C160-C174 WeakPolarHBondContact CB-SG 3.49Å; C160-C174 WeakPolarHBondContact SG-CA 3.27Å; C160-C174 WeakPolarHBondContact SG-CB 3.3Å; C160-C174 CovalentContact SG-SG 2.03Å; C160-C174 PolarHBondContact SG-SG 3.32Å; C174-H238 CarbonylContact O-C 3.55Å; C174-H238 WeakPolarHBondContact O-CA 3.48Å; C174-V239 PolarHBondContact N-O 2.96Å; C174-V239 VanDerWaalsContact N-O 3.08Å; C174-V239 PolarHBondContact O-N 3.22Å
175	S	96.4	Very high	93.4	Very high	38 Å²	38	43.8 Å²	43.8	27%	0.266	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	139.1	176.2	56.7	0	0	0	0	111.4	E127 F237	E127-S175 WeakPolarHBondContact OE1-CB 3.36Å; E127-S175 PolarHBondContact OE1-OG 3.42Å; S175-F237 CarbonylContact C-O 3.3Å; S175-F237 WeakPolarHBondContact CA-O 3.42Å
176	L	96.4	Very high	93.7	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	104.3	166.1	-55.9	178	0	0	0	106.9	L68 V156 T158 F178 F237 V239	L68-L176 HydrophobicContact CD2-CD1 4.07Å; V156-L176 HydrophobicContact CG1-CD2 3.73Å; T158-L176 HydrophobicContact CG2-CD2 3.7Å; L176-F178 HydrophobicContact CB-CE2 3.99Å; L176-F237 HydrophobicContact CB-CB 4.35Å; L176-F237 PolarHBondContact N-O 3.26Å; L176-F237 PolarHBondContact O-N 3.44Å; L176-V239 HydrophobicContact CD1-CG2 3.83Å; L176-V239 HydrophobicContact CG-CG2 4.3Å
177	T	96.8	Very high	94.2	Very high	4 Å²	4	42.2 Å²	42.2	3%	0.025	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	105.9	-176.7	-57.2	0	0	0	0	109.9	I125 N126 E127 E234 K236	I125-T177 VanDerWaalsContact CA-O 3.29Å; I125-T177 WeakPolarHBondContact CA-O 3.27Å; N126-T177 PolarHBondContact N-O 2.94Å; N126-T177 VanDerWaalsContact N-O 3.08Å; E127-T177 WeakPolarHBondContact OE1-CB 3.49Å; E127-T177 PolarHBondContact OE1-N 2.97Å; E127-T177 PolarHBondContact OE1-OG1 3.32Å; E127-T177 WeakPolarHBondContact OE2-CB 3.4Å; E127-T177 PolarHBondContact OE2-N 3.35Å; T177-E234 HydrophobicContact CG2-CB 4.1Å; T177-E234 HydrophobicContact CG2-CG 4.08Å; T177-K236 HydrophobicContact CG2-CD 4.35Å; T177-K236 VanDerWaalsContact CG2-CE 3.45Å; T177-K236 HydrophobicContact CG2-CG 3.88Å; T177-K236 WeakPolarHBondContact OG1-CE 3.35Å
178	F	96.8	Very high	94.6	Very high	3 Å²	3	41.9 Å²	41.9	1%	0.013	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	127	175.8	-68.6	-100.8	0	0	0	110.4	I66 L68 Y89 I123 L124 I125 L176 M235 F237	I66-F178 HydrophobicContact CD1-CB 3.84Å; I66-F178 HydrophobicContact CD1-CD2 4.47Å; I66-F178 HydrophobicContact CD1-CG 4.07Å; L68-F178 HydrophobicContact CD1-CE2 4.49Å; L68-F178 HydrophobicContact CD1-CZ 4.06Å; Y89-F178 HydrophobicContact CD2-CD1 4.47Å; Y89-F178 AromaticContact CD2-CE1 3.72Å; Y89-F178 HydrophobicContact CD2-CE1 3.72Å; Y89-F178 HydrophobicContact CD2-CZ 4.14Å; Y89-F178 AromaticContact CE2-CD1 3.83Å; Y89-F178 HydrophobicContact CE2-CD1 3.83Å; Y89-F178 AromaticContact CE2-CE1 3.52Å; Y89-F178 HydrophobicContact CE2-CE1 3.52Å; Y89-F178 HydrophobicContact CE2-CZ 4.27Å; I123-F178 HydrophobicContact CG2-CB 4.07Å; I123-F178 HydrophobicContact CG2-CD1 3.95Å; L124-F178 WeakPolarHBondContact O-CA 3.43Å; I125-F178 HydrophobicContact CD1-CE1 3.81Å; I125-F178 HydrophobicContact CD1-CE2 4.15Å; I125-F178 HydrophobicContact CD1-CZ 3.59Å; I125-F178 HydrophobicContact CG1-CD1 3.96Å; I125-F178 HydrophobicContact CG1-CD2 4.49Å; I125-F178 HydrophobicContact CG1-CE1 3.7Å; I125-F178 HydrophobicContact CG1-CE2 4.28Å; I125-F178 HydrophobicContact CG1-CG 4.36Å; I125-F178 HydrophobicContact CG1-CZ 3.88Å; L176-F178 HydrophobicContact CB-CE2 3.99Å; F178-M235 PolarHBondContact N-O 2.99Å; F178-M235 PolarHBondContact O-N 2.89Å; F178-F237 AromaticContact CD2-CD2 3.46Å; F178-F237 HydrophobicContact CD2-CD2 3.46Å; F178-F237 VanDerWaalsContact CD2-CD2 3.46Å; F178-F237 AromaticContact CD2-CE2 3.55Å; F178-F237 HydrophobicContact CD2-CE2 3.55Å; F178-F237 AromaticContact CE2-CD2 3.56Å; F178-F237 HydrophobicContact CE2-CD2 3.56Å; F178-F237 AromaticContact CE2-CE2 3.84Å; F178-F237 HydrophobicContact CE2-CE2 3.84Å; F178-F237 HydrophobicContact CG-CE2 4.37Å
179	Q	95.4	Very high	95	Very high	16 Å²	16	43.5 Å²	43.5	8%	0.075	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	163.4	172.8	64.2	167.9	-3	0	0	111.8	I123 L124 N126 A233 E234	I123-Q179 WeakPolarHBondContact CA-O 3.39Å; L124-Q179 PolarHBondContact N-O 2.9Å; L124-Q179 PolarHBondContact O-N 2.87Å; N126-Q179 PolarHBondContact ND2-NE2 2.94Å; N126-Q179 VanDerWaalsContact OD1-CG 3.3Å; N126-Q179 WeakPolarHBondContact OD1-CG 3.4Å; N126-Q179 PolarHBondContact OD1-NE2 3.22Å; Q179-A233 WeakPolarHBondContact CB-O 3.5Å; Q179-E234 HydrophobicContact CB-CG 4.21Å
180	S	96.3	Very high	95.5	Very high	5 Å²	5	42.3 Å²	42.3	4%	0.035	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	141.3	161.8	177.2	0	0	0	0	109	D122 H183	D122-S180 WeakPolarHBondContact O-CA 3.48Å; D122-S180 PolarHBondContact OD1-OG 3.46Å; D122-S180 PolarHBondContact OD2-OG 2.89Å; D122-S180 VanDerWaalsContact OD2-OG 3.12Å; S180-H183 VanDerWaalsContact OG-CB 3.31Å; S180-H183 WeakPolarHBondContact OG-CB 3.48Å; S180-H183 PolarHBondContact OG-N 2.91Å; S180-H183 PolarHBondContact OG-ND1 3.4Å
181	W	93.3	Very high	95.8	Very high	179 Å²	179	44.7 Å²	44.7	68%	0.678	23%	0.226	S	C	*	.	S	Bend	trans	-80.8	-34.8	179.1	-173.6	-101.1	0	0	0	112.4	D122 L124	D122-W181 PolarHBondContact O-N 3.33Å; D122-W181 PolarHBondContact OD2-N 3.37Å; L124-W181 HydrophobicContact CD1-CB 3.59Å; L124-W181 HydrophobicContact CD1-CG 4.18Å
182	L	94.4	Very high	96	Very high	124 Å²	124	43.1 Å²	43.1	65%	0.649	22%	0.215	S	C	*	.	S	Bend	trans	-107.5	-42.3	-177.3	-176.4	65	0	0	0	113.4	D122	D122-L182 PolarHBondContact OD2-N 3.49Å
183	H	95.4	Very high	96	Very high	44 Å²	44	45.9 Å²	45.9	20%	0.204	23%	0.228	C	C	.	.			trans	-82.5	137.5	-166.7	-58.7	90.3	0	0	0	112.1	D122 S180 D187 I188 Y232	D122-H183 IonicContact OD1-CE1 3.93Å; D122-H183 IonicContact OD1-ND1 2.8Å; D122-H183 PolarHBondContact OD1-ND1 3.15Å; D122-H183 IonicContact OD2-ND1 3.33Å; S180-H183 VanDerWaalsContact OG-CB 3.31Å; S180-H183 WeakPolarHBondContact OG-CB 3.48Å; S180-H183 PolarHBondContact OG-N 2.91Å; S180-H183 PolarHBondContact OG-ND1 3.4Å; H183-D187 HydrophobicContact CB-CB 3.89Å; H183-I188 HydrophobicContact CB-CB 4.06Å; H183-I188 HydrophobicContact CB-CD1 3.74Å; H183-I188 HydrophobicContact CB-CG1 3.78Å; H183-I188 WeakPolarHBondContact ND1-CD1 3.49Å; H183-Y232 VanDerWaalsContact O-CD1 3.32Å; H183-Y232 WeakPolarHBondContact O-CD1 3.27Å
184	T	95.1	Very high	95.9	Very high	29 Å²	29	42.8 Å²	42.8	18%	0.178	21%	0.213	C	C	.	.			trans	-77	172.7	174.3	64.7	0	0	0	0	111.1	D186 D187 I188 Y231 Y232	T184-D186 PolarHBondContact O-N 2.84Å; T184-D187 PolarHBondContact O-N 3.39Å; T184-I188 PolarHBondContact O-N 2.73Å; T184-Y231 CarbonylContact C-O 3.56Å; T184-Y231 WeakPolarHBondContact CA-O 3.49Å; T184-Y231 WeakPolarHBondContact CB-O 3.38Å; T184-Y232 HydrophobicContact CG2-CE1 4.32Å
185	I	95.3	Very high	95.9	Very high	32 Å²	32	45.1 Å²	45.1	16%	0.164	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.6	178	-168.1	165	0	0	0	113.5	D187 Y221 I223 Y231 A233	I185-D187 VanDerWaalsContact C-N 3.31Å; I185-Y221 WeakPolarHBondContact CD1-OH 3.47Å; I185-I223 HydrophobicContact CD1-CD1 3.86Å; I185-I223 HydrophobicContact CD1-CG1 4.01Å; I185-I223 HydrophobicContact CD1-CG2 4.4Å; I185-Y231 PolarHBondContact N-O 3.38Å; I185-A233 HydrophobicContact CG1-CB 4.3Å
186	D	94.3	Very high	95.8	Very high	116 Å²	116	46.8 Å²	46.8	62%	0.62	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-24	178.4	-66.6	-32.8	0	0	0	112.3	S61 T184	S61-D186 VanDerWaalsContact CA-O 3.29Å; S61-D186 WeakPolarHBondContact CA-O 3.38Å; S61-D186 WeakPolarHBondContact CB-O 3.4Å; T184-D186 PolarHBondContact O-N 2.84Å
187	D	96.3	Very high	95.6	Very high	53 Å²	53	54.2 Å²	54.2	28%	0.283	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-48.2	176.4	-83	-40.7	0	0	0	112.1	R53 T62 H183 T184 I185	R53-D187 IonicContact CZ-OD1 2.89Å; R53-D187 IonicContact NE-OD1 3.08Å; R53-D187 PolarHBondContact NE-OD1 3.08Å; R53-D187 IonicContact NH2-OD1 2.96Å; R53-D187 PolarHBondContact NH2-OD1 2.88Å; T62-D187 PolarHBondContact N-O 3.17Å; H183-D187 HydrophobicContact CB-CB 3.89Å; T184-D187 PolarHBondContact O-N 3.39Å; I185-D187 VanDerWaalsContact C-N 3.31Å
188	I	97.5	Very high	95.5	Very high	2 Å²	2	61 Å²	61	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	121.8	-178.2	-62.5	-177.1	0	0	0	109.6	T62 V64 W119 P121 I123 H183 T184	T62-I188 WeakPolarHBondContact O-CA 3.41Å; V64-I188 HydrophobicContact CG2-CG2 3.93Å; W119-I188 HydrophobicContact CH2-CD1 3.9Å; W119-I188 HydrophobicContact CH2-CG1 4.43Å; W119-I188 HydrophobicContact CZ2-CD1 4.1Å; P121-I188 HydrophobicContact CB-CD1 3.99Å; I123-I188 HydrophobicContact CD1-CG2 4.24Å; H183-I188 HydrophobicContact CB-CB 4.06Å; H183-I188 HydrophobicContact CB-CD1 3.74Å; H183-I188 HydrophobicContact CB-CG1 3.78Å; H183-I188 WeakPolarHBondContact ND1-CD1 3.49Å; T184-I188 PolarHBondContact O-N 2.73Å
189	N	97.4	Very high	95.4	Very high	36 Å²	36	61 Å²	61	19%	0.193	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	149.1	170.7	-163.7	6.3	0	0	0	110.6	T62 I63 V64 Y221 A233	T62-N189 PolarHBondContact O-N 2.93Å; T62-N189 VanDerWaalsContact O-N 3.15Å; I63-N189 CarbonylContact C-O 3.55Å; I63-N189 WeakPolarHBondContact CA-O 3.28Å; V64-N189 PolarHBondContact N-O 3.35Å; N189-Y221 PolarHBondContact OD1-OH 3.09Å; N189-A233 WeakPolarHBondContact OD1-CB 3Å
190	I	97.5	Very high	95.3	Very high	2 Å²	2	65.5 Å²	65.5	1%	0.01	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	134.3	-174.5	-57	178.9	0	0	0	109.9	V64 I66 I123 Y221 A233 M235	V64-I190 WeakPolarHBondContact O-CA 3.41Å; I66-I190 HydrophobicContact CD1-CG2 3.68Å; I66-I190 HydrophobicContact CG1-CG2 3.85Å; I66-I190 HydrophobicContact CG2-CG2 4.32Å; I123-I190 HydrophobicContact CD1-CD1 4.08Å; I123-I190 HydrophobicContact CD1-CG1 4.39Å; I190-Y221 WeakPolarHBondContact O-CE2 3.3Å; I190-A233 HydrophobicContact CB-CB 4.48Å; I190-A233 WeakPolarHBondContact CD1-O 3.44Å; I190-A233 HydrophobicContact CG1-CB 4.3Å; I190-M235 HydrophobicContact CG2-CB 3.76Å
191	T	97.1	Very high	95.1	Very high	53 Å²	53	70.1 Å²	70.1	33%	0.325	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	167.5	176.8	57.4	0	0	0	0	110.9	I63 V64 A65 I66	I63-T191 HydrophobicContact CG2-CG2 3.66Å; I63-T191 WeakPolarHBondContact CG2-OG1 3.47Å; V64-T191 PolarHBondContact O-N 2.98Å; A65-T191 CarbonylContact C-O 3.55Å; A65-T191 WeakPolarHBondContact CA-O 3.45Å; A65-T191 WeakPolarHBondContact CA-OG1 3.46Å; I66-T191 PolarHBondContact N-O 3.12Å
192	L	96.9	Very high	95.1	Very high	43 Å²	43	62.4 Å²	62.4	23%	0.225	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	136.4	174.2	-65.6	169.6	0	0	0	110.4	I66 R194 P196 S219 M235 F237	I66-L192 WeakPolarHBondContact O-CA 3.36Å; L192-R194 VanDerWaalsContact C-N 3.29Å; L192-R194 VanDerWaalsContact CB-O 3.3Å; L192-R194 WeakPolarHBondContact CB-O 3.12Å; L192-R194 PolarHBondContact O-N 2.91Å; L192-P196 HydrophobicContact CD1-CG 3.86Å; L192-S219 VanDerWaalsContact CD1-OG 3.29Å; L192-S219 WeakPolarHBondContact CD1-OG 2.82Å; L192-M235 HydrophobicContact CD1-CE 4.36Å; L192-M235 HydrophobicContact CD1-SD 4.42Å; L192-M235 HydrophobicContact CD2-CE 3.93Å; L192-M235 HydrophobicContact CD2-CG 4.08Å; L192-M235 HydrophobicContact CD2-SD 3.79Å; L192-M235 HydrophobicContact CG-CE 3.69Å; L192-M235 HydrophobicContact CG-SD 4.06Å; L192-F237 HydrophobicContact CD2-CE1 3.87Å; L192-F237 HydrophobicContact CD2-CZ 3.76Å
193	M	95.3	Very high	95	Very high	62 Å²	62	60.3 Å²	60.3	31%	0.305	30%	0.302	S	S	.	.	S	Bend	trans	-71.9	-25.4	174.4	-164.2	178.3	-68.4	0	0	112.6	A65 I66 D67 R90 S92	A65-M193 HydrophobicContact CB-CB 4.34Å; A65-M193 WeakPolarHBondContact O-CE 3.31Å; I66-M193 PolarHBondContact O-N 3.43Å; D67-M193 HydrophobicContact CB-CB 3.88Å; R90-M193 HydrophobicContact CG-CE 4.22Å; R90-M193 HydrophobicContact CG-SD 4.21Å; S92-M193 VanDerWaalsContact OG-CE 3.26Å; S92-M193 WeakPolarHBondContact OG-CE 3.45Å
194	R	94.4	Very high	94.9	Very high	56 Å²	56	62.9 Å²	62.9	21%	0.211	33%	0.325	C	S	.	.	S	Bend	trans	-124.2	157.8	179.4	-63.1	-172.1	-71	173	-2.4	110.4	D67 L192 D202	D67-R194 IonicContact OD1-CZ 2.99Å; D67-R194 VanDerWaalsContact OD1-CZ 3.32Å; D67-R194 IonicContact OD1-NE 3.42Å; D67-R194 PolarHBondContact OD1-NE 2.75Å; D67-R194 IonicContact OD1-NH2 3.22Å; D67-R194 PolarHBondContact OD1-NH2 2.91Å; D67-R194 IonicContact OD2-CZ 3.65Å; D67-R194 VanDerWaalsContact OD2-CZ 3.22Å; D67-R194 IonicContact OD2-NE 2.71Å; D67-R194 PolarHBondContact OD2-NE 2.93Å; D67-R194 IonicContact OD2-NH2 2.76Å; D67-R194 PolarHBondContact OD2-NH2 2.96Å; D67-R194 VanDerWaalsContact OD2-NH2 3.08Å; L192-R194 VanDerWaalsContact C-N 3.29Å; L192-R194 VanDerWaalsContact CB-O 3.3Å; L192-R194 WeakPolarHBondContact CB-O 3.12Å; L192-R194 PolarHBondContact O-N 2.91Å; R194-D202 IonicContact CZ-OD2 2.65Å; R194-D202 VanDerWaalsContact CZ-OD2 3.23Å; R194-D202 IonicContact NH1-OD2 3.46Å; R194-D202 PolarHBondContact NH1-OD2 3.47Å; R194-D202 IonicContact NH2-OD2 2.72Å; R194-D202 PolarHBondContact NH2-OD2 3.26Å
195	S	94.9	Very high	94.9	Very high	49 Å²	49	63.2 Å²	63.2	34%	0.343	33%	0.326	S	S	.	.			trans	-58.5	140.1	171.4	55.5	0	0	0	0	111.3	E197 K198 L199	S195-E197 PolarHBondContact O-N 3.13Å; S195-E197 VanDerWaalsContact O-N 3.11Å; S195-K198 PolarHBondContact O-N 3.33Å; S195-K198 VanDerWaalsContact O-N 3.12Å; S195-K198 WeakPolarHBondContact OG-CD 3.44Å; S195-K198 VanDerWaalsContact OG-CG 3.31Å; S195-K198 WeakPolarHBondContact OG-CG 3.39Å; S195-L199 PolarHBondContact O-N 3.45Å
196	P	94	Very high	94.9	Very high	74 Å²	74	62.4 Å²	62.4	48%	0.481	32%	0.322	S	S	.	.	H	α-helix	trans	-52.3	-34.3	178.4	-28	33.7	0	0	0	114.7	L192 L199 R200	L192-P196 HydrophobicContact CD1-CG 3.86Å; P196-L199 PolarHBondContact O-N 3.22Å; P196-R200 WeakPolarHBondContact O-CB 3.48Å; P196-R200 PolarHBondContact O-N 2.94Å
197	E	93.8	Very high	94.8	Very high	156 Å²	156	61.3 Å²	61.3	73%	0.729	31%	0.314	S	S	*	.	H	α-helix	trans	-64.3	-46.5	179.1	-65	167.5	-174.8	0	0	112.3	S195 L199 R200	S195-E197 PolarHBondContact O-N 3.13Å; S195-E197 VanDerWaalsContact O-N 3.11Å; E197-L199 VanDerWaalsContact C-N 3.28Å; E197-L199 PolarHBondContact O-N 3.48Å; E197-R200 WeakPolarHBondContact O-CB 3.4Å; E197-R200 PolarHBondContact O-N 3.48Å
198	K	94	Very high	94.5	Very high	148 Å²	148	62.9 Å²	62.9	64%	0.643	32%	0.322	S	S	*	.	H	α-helix	trans	-64.3	-34.2	176.5	-72.4	-178.4	-178.3	178.7	0	112.4	S195	S195-K198 PolarHBondContact O-N 3.33Å; S195-K198 VanDerWaalsContact O-N 3.12Å; S195-K198 WeakPolarHBondContact OG-CD 3.44Å; S195-K198 VanDerWaalsContact OG-CG 3.31Å; S195-K198 WeakPolarHBondContact OG-CG 3.39Å
199	L	93.9	Very high	94.1	Very high	1 Å²	1	71 Å²	71	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-69.9	-39.7	176.3	178.9	73.8	0	0	0	111.4	L68 S195 P196 E197 D201 D202 I217 F237	L68-L199 VanDerWaalsContact O-CD1 3.3Å; L68-L199 WeakPolarHBondContact O-CD1 3.15Å; S195-L199 PolarHBondContact O-N 3.45Å; P196-L199 PolarHBondContact O-N 3.22Å; E197-L199 VanDerWaalsContact C-N 3.28Å; E197-L199 PolarHBondContact O-N 3.48Å; L199-D201 VanDerWaalsContact C-N 3.3Å; L199-D201 PolarHBondContact O-N 2.93Å; L199-D202 WeakPolarHBondContact O-CB 3.28Å; L199-D202 PolarHBondContact O-N 2.89Å; L199-I217 HydrophobicContact CD1-CG2 4.39Å; L199-I217 HydrophobicContact CD2-CG2 4.28Å; L199-I217 HydrophobicContact CG-CB 4.4Å; L199-I217 HydrophobicContact CG-CG2 4.14Å; L199-F237 HydrophobicContact CD2-CD1 3.8Å; L199-F237 HydrophobicContact CD2-CE1 3.55Å
200	R	94.6	Very high	93.7	Very high	111 Å²	111	71 Å²	71	42%	0.419	37%	0.369	S	S	.	.	H	α-helix	trans	-54.9	-45.7	-177.9	-177.4	-176.3	178.8	-85	5	112.7	P196 E197 H216 I217 L218	P196-R200 WeakPolarHBondContact O-CB 3.48Å; P196-R200 PolarHBondContact O-N 2.94Å; E197-R200 WeakPolarHBondContact O-CB 3.4Å; E197-R200 PolarHBondContact O-N 3.48Å; R200-H216 HydrophobicContact CG-CB 3.87Å; R200-H216 VanDerWaalsContact O-CA 3.25Å; R200-H216 WeakPolarHBondContact O-CA 3.41Å; R200-H216 VanDerWaalsContact O-CB 3.28Å; R200-H216 WeakPolarHBondContact O-CB 3.5Å; R200-I217 VanDerWaalsContact CA-O 3.25Å; R200-I217 WeakPolarHBondContact CA-O 3.48Å; R200-I217 PolarHBondContact O-N 3.08Å; R200-L218 HydrophobicContact CG-CD2 4.01Å
201	D	92.7	Very high	93.4	Very high	102 Å²	102	74.6 Å²	74.6	55%	0.545	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	9.5	-173.8	-58.5	-29.6	0	0	0	112.5	L199 K203	L199-D201 VanDerWaalsContact C-N 3.3Å; L199-D201 PolarHBondContact O-N 2.93Å; D201-K203 PolarHBondContact O-N 3.36Å; D201-K203 VanDerWaalsContact O-N 3.12Å
202	D	92.7	Very high	93.3	Very high	17 Å²	17	72.7 Å²	72.7	9%	0.091	37%	0.372	C	S	.	.			trans	-73.5	106.3	-178.9	-166.4	2.2	0	0	0	111.6	R194 L199 S204	R194-D202 IonicContact CZ-OD2 2.65Å; R194-D202 VanDerWaalsContact CZ-OD2 3.23Å; R194-D202 IonicContact NH1-OD2 3.46Å; R194-D202 PolarHBondContact NH1-OD2 3.47Å; R194-D202 IonicContact NH2-OD2 2.72Å; R194-D202 PolarHBondContact NH2-OD2 3.26Å; L199-D202 WeakPolarHBondContact O-CB 3.28Å; L199-D202 PolarHBondContact O-N 2.89Å; D202-S204 PolarHBondContact OD1-N 2.9Å; D202-S204 PolarHBondContact OD1-OG 2.9Å; D202-S204 VanDerWaalsContact OD1-OG 3.14Å
203	K	92.8	Very high	93.1	Very high	80 Å²	80	72.7 Å²	72.7	35%	0.348	37%	0.371	S	S	.	.			trans	-126.1	15.1	173.4	-54.8	-175.5	-170.1	-167.5	0	111.7	D201 V205 F206 L214 L215	D201-K203 PolarHBondContact O-N 3.36Å; D201-K203 VanDerWaalsContact O-N 3.12Å; K203-V205 PolarHBondContact O-N 3.39Å; K203-F206 PolarHBondContact O-N 3.44Å; K203-L214 WeakPolarHBondContact CE-O 3.25Å; K203-L214 HydrophobicContact CG-CD2 4.48Å; K203-L214 PolarHBondContact NZ-O 2.87Å; K203-L215 WeakPolarHBondContact CE-O 3.41Å; K203-L215 PolarHBondContact NZ-O 3.38Å
204	S	92.8	Very high	93.2	Very high	98 Å²	98	69.9 Å²	69.9	69%	0.685	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-30.4	-166.4	66.6	0	0	0	0	113.3	D202	D202-S204 PolarHBondContact OD1-N 2.9Å; D202-S204 PolarHBondContact OD1-OG 2.9Å; D202-S204 VanDerWaalsContact OD1-OG 3.14Å
205	V	94.1	Very high	93.2	Very high	36 Å²	36	69 Å²	69	22%	0.218	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	1.5	-178	-58.8	0	0	0	0	113.4	M69 Y71 W88 K203	M69-V205 HydrophobicContact CB-CG2 3.78Å; Y71-V205 HydrophobicContact CD2-CB 4.38Å; Y71-V205 WeakPolarHBondContact CD2-O 3.46Å; W88-V205 HydrophobicContact CE3-CB 4.47Å; W88-V205 HydrophobicContact CE3-CG1 4.08Å; W88-V205 HydrophobicContact CE3-CG2 4.46Å; W88-V205 HydrophobicContact CH2-CG1 4.23Å; W88-V205 HydrophobicContact CZ3-CB 4.22Å; W88-V205 HydrophobicContact CZ3-CG1 3.63Å; K203-V205 PolarHBondContact O-N 3.39Å
206	F	95.9	Very high	93.1	Very high	15 Å²	15	68.9 Å²	68.9	7%	0.066	35%	0.351	C	S	.	.			trans	-74.9	130.9	-171.8	-177.3	-101.6	0	0	0	112.3	V70 Y71 I73 K203 N208 L214	V70-F206 HydrophobicContact CG1-CD2 4.07Å; V70-F206 HydrophobicContact CG1-CE2 4.16Å; Y71-F206 WeakPolarHBondContact O-CA 3.39Å; I73-F206 HydrophobicContact CG1-CE2 4.12Å; I73-F206 HydrophobicContact CG1-CZ 4.34Å; K203-F206 PolarHBondContact O-N 3.44Å; F206-N208 VanDerWaalsContact CD1-OD1 3.29Å; F206-N208 WeakPolarHBondContact CD1-OD1 3.42Å; F206-N208 PolarHBondContact O-N 3.02Å; F206-N208 VanDerWaalsContact O-N 3.09Å; F206-L214 HydrophobicContact CB-CD2 4.26Å; F206-L214 HydrophobicContact CD1-CB 3.9Å; F206-L214 HydrophobicContact CD2-CB 3.84Å; F206-L214 HydrophobicContact CD2-CD2 3.84Å; F206-L214 HydrophobicContact CD2-CG 4.46Å; F206-L214 HydrophobicContact CE1-CB 3.81Å; F206-L214 HydrophobicContact CE2-CB 3.74Å; F206-L214 HydrophobicContact CE2-CD2 4.42Å; F206-L214 HydrophobicContact CG-CB 3.92Å; F206-L214 HydrophobicContact CG-CD2 4.04Å; F206-L214 HydrophobicContact CZ-CB 3.73Å
207	M	93.1	Very high	93.2	Very high	93 Å²	93	65.4 Å²	65.4	46%	0.458	33%	0.328	S	S	.	.			trans	-76.9	94.4	177.5	-171.5	176.7	-178	0	0	111.4	Y71 Q209	Y71-M207 PolarHBondContact O-N 3.45Å; M207-Q209 VanDerWaalsContact C-N 3.28Å; M207-Q209 PolarHBondContact O-N 3.35Å
208	N	89.3	Confident	93.4	Very high	86 Å²	86	60.7 Å²	60.7	46%	0.46	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-12.4	-174.1	-79.7	-46.3	0	0	0	116.4	F206 G210 R244	F206-N208 VanDerWaalsContact CD1-OD1 3.29Å; F206-N208 WeakPolarHBondContact CD1-OD1 3.42Å; F206-N208 PolarHBondContact O-N 3.02Å; F206-N208 VanDerWaalsContact O-N 3.09Å; N208-G210 VanDerWaalsContact C-N 3.29Å; N208-G210 PolarHBondContact O-N 2.91Å; N208-R244 PolarHBondContact O-NH2 2.75Å
209	Q	87.9	Confident	93.5	Very high	174 Å²	174	54.9 Å²	54.9	81%	0.813	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-1.4	-173.6	-67.4	178.7	-23.5	0	0	114.2	M207	M207-Q209 VanDerWaalsContact C-N 3.28Å; M207-Q209 PolarHBondContact O-N 3.35Å
210	G	89.4	Confident	93.5	Very high	35 Å²	35	58 Å²	58	36%	0.361	30%	0.302	S	S	.	.	S	Bend	trans	-76.9	176	176.7	0	0	0	0	0	114.2	N208 W212 R244	N208-G210 VanDerWaalsContact C-N 3.29Å; N208-G210 PolarHBondContact O-N 2.91Å; G210-W212 PolarHBondContact O-N 2.9Å; G210-R244 WeakPolarHBondContact O-CD 3.32Å; G210-R244 PolarHBondContact O-NE 3.19Å
211	E	91.4	Very high	93.6	Very high	78 Å²	78	56.8 Å²	56.8	36%	0.364	30%	0.298	S	S	.	.	S	Bend	trans	-62.7	-30.7	173.4	-172.2	-168.8	156.5	0	0	112.5	R243 R244 Y248	E211-R243 HydrophobicContact CG-CG 4.28Å; E211-R243 IonicContact OE1-CZ 3.28Å; E211-R243 IonicContact OE1-NE 3.66Å; E211-R243 IonicContact OE1-NH1 3.8Å; E211-R243 PolarHBondContact OE1-NH1 3.49Å; E211-R244 VanDerWaalsContact O-CB 3.3Å; E211-R244 WeakPolarHBondContact O-CB 3.42Å; E211-R244 VanDerWaalsContact O-CG 3.28Å; E211-R244 WeakPolarHBondContact O-CG 3.32Å; E211-R244 PolarHBondContact O-N 3.34Å; E211-Y248 PolarHBondContact OE1-OH 3.26Å; E211-Y248 VanDerWaalsContact OE1-OH 3.05Å
212	W	94.6	Very high	93.7	Very high	12 Å²	12	56.5 Å²	56.5	5%	0.045	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	140.2	-175.3	-65.7	90.7	0	0	0	111.9	I73 V76 D170 Q172 G210 I241 R243	I73-W212 HydrophobicContact CB-CB 4.18Å; I73-W212 HydrophobicContact CG1-CB 4.15Å; I73-W212 HydrophobicContact CG2-CB 4.35Å; I73-W212 HydrophobicContact CG2-CG 4.2Å; V76-W212 HydrophobicContact CB-CZ2 3.9Å; V76-W212 HydrophobicContact CG1-CZ2 3.88Å; V76-W212 HydrophobicContact CG2-CD2 4.23Å; V76-W212 HydrophobicContact CG2-CG 4.48Å; V76-W212 HydrophobicContact CG2-CZ2 3.75Å; D170-W212 WeakPolarHBondContact OD2-CH2 3.35Å; Q172-W212 HydrophobicContact CG-CH2 3.79Å; Q172-W212 HydrophobicContact CG-CZ3 3.83Å; G210-W212 PolarHBondContact O-N 2.9Å; W212-I241 HydrophobicContact CD2-CD1 3.96Å; W212-I241 HydrophobicContact CE3-CB 4.02Å; W212-I241 HydrophobicContact CE3-CD1 3.64Å; W212-I241 HydrophobicContact CE3-CG1 3.73Å; W212-I241 HydrophobicContact CG-CD1 4.46Å; W212-I241 HydrophobicContact CZ3-CD1 4.01Å; W212-I241 HydrophobicContact CZ3-CG1 3.99Å; W212-R243 HydrophobicContact CE3-CB 4.1Å; W212-R243 HydrophobicContact CH2-CB 4.05Å; W212-R243 HydrophobicContact CH2-CG 4.48Å; W212-R243 VanDerWaalsContact CZ2-NH2 3.28Å; W212-R243 HydrophobicContact CZ3-CB 3.79Å
213	E	94.4	Very high	93.7	Very high	44 Å²	44	60.2 Å²	60.2	21%	0.206	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130	172.5	-176.2	-174.7	177.4	0	0	109.7	I241 R242	E213-I241 CarbonylContact O-C 3.48Å; E213-I241 VanDerWaalsContact O-CA 3.29Å; E213-I241 WeakPolarHBondContact O-CA 3.42Å; E213-R242 VanDerWaalsContact CD-NH2 3.33Å; E213-R242 PolarHBondContact N-O 2.92Å; E213-R242 PolarHBondContact O-N 2.92Å; E213-R242 IonicContact OE1-NH2 2.73Å; E213-R242 PolarHBondContact OE1-NH2 2.99Å; E213-R242 IonicContact OE2-CZ 3.24Å; E213-R242 IonicContact OE2-NE 2.69Å; E213-R242 PolarHBondContact OE2-NE 3.09Å; E213-R242 IonicContact OE2-NH2 3.52Å; E213-R242 PolarHBondContact OE2-NH2 3.41Å
214	L	95.9	Very high	93.6	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.01	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	120.4	171.9	-178.2	66.8	0	0	0	110.1	V70 K203 F206 I217 V239 I241	V70-L214 HydrophobicContact CB-CD2 4.05Å; V70-L214 HydrophobicContact CG1-CD2 4.48Å; K203-L214 WeakPolarHBondContact CE-O 3.25Å; K203-L214 HydrophobicContact CG-CD2 4.48Å; K203-L214 PolarHBondContact NZ-O 2.87Å; F206-L214 HydrophobicContact CB-CD2 4.26Å; F206-L214 HydrophobicContact CD1-CB 3.9Å; F206-L214 HydrophobicContact CD2-CB 3.84Å; F206-L214 HydrophobicContact CD2-CD2 3.84Å; F206-L214 HydrophobicContact CD2-CG 4.46Å; F206-L214 HydrophobicContact CE1-CB 3.81Å; F206-L214 HydrophobicContact CE2-CB 3.74Å; F206-L214 HydrophobicContact CE2-CD2 4.42Å; F206-L214 HydrophobicContact CG-CB 3.92Å; F206-L214 HydrophobicContact CG-CD2 4.04Å; F206-L214 HydrophobicContact CZ-CB 3.73Å; L214-I217 HydrophobicContact CD1-CG1 4.24Å; L214-I217 HydrophobicContact CD2-CD1 4.25Å; L214-I217 HydrophobicContact CD2-CG1 4.42Å; L214-V239 HydrophobicContact CD1-CG1 3.92Å; L214-I241 HydrophobicContact CD1-CG2 4.19Å
215	L	94.3	Very high	93.4	Very high	38 Å²	38	57.3 Å²	57.3	20%	0.199	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-58	177.7	-66	-174	0	0	0	111.6	V171 K203 V240 R242	V171-L215 HydrophobicContact CG1-CD1 4.18Å; K203-L215 WeakPolarHBondContact CE-O 3.41Å; K203-L215 PolarHBondContact NZ-O 3.38Å; L215-V240 HydrophobicContact CB-CB 4.46Å; L215-V240 HydrophobicContact CB-CG1 4.24Å; L215-V240 HydrophobicContact CD1-CG1 4.14Å; L215-V240 PolarHBondContact N-O 3.45Å; L215-R242 HydrophobicContact CD1-CB 3.99Å; L215-R242 HydrophobicContact CD2-CB 4.16Å; L215-R242 HydrophobicContact CG-CB 3.99Å
216	H	94.5	Very high	92.7	Very high	47 Å²	47	60.3 Å²	60.3	22%	0.218	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	160.3	-179.7	45.4	-97.2	0	0	0	111.6	R200 V240	R200-H216 HydrophobicContact CG-CB 3.87Å; R200-H216 VanDerWaalsContact O-CA 3.25Å; R200-H216 WeakPolarHBondContact O-CA 3.41Å; R200-H216 VanDerWaalsContact O-CB 3.28Å; R200-H216 WeakPolarHBondContact O-CB 3.5Å; H216-V240 WeakPolarHBondContact NE2-CG2 3.49Å; H216-V240 PolarHBondContact O-N 3.42Å; H216-V240 VanDerWaalsContact O-N 3.1Å
217	I	96.3	Very high	91.9	Very high	1 Å²	1	65 Å²	65	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	107.7	176.6	-56.4	165.5	0	0	0	108.8	V70 L199 R200 L214 F237 H238	V70-I217 HydrophobicContact CB-CD1 4.28Å; V70-I217 HydrophobicContact CG2-CD1 3.72Å; V70-I217 HydrophobicContact CG2-CG1 4.26Å; L199-I217 HydrophobicContact CD1-CG2 4.39Å; L199-I217 HydrophobicContact CD2-CG2 4.28Å; L199-I217 HydrophobicContact CG-CB 4.4Å; L199-I217 HydrophobicContact CG-CG2 4.14Å; R200-I217 VanDerWaalsContact CA-O 3.25Å; R200-I217 WeakPolarHBondContact CA-O 3.48Å; R200-I217 PolarHBondContact O-N 3.08Å; L214-I217 HydrophobicContact CD1-CG1 4.24Å; L214-I217 HydrophobicContact CD2-CD1 4.25Å; L214-I217 HydrophobicContact CD2-CG1 4.42Å; I217-F237 HydrophobicContact CG2-CB 4.39Å; I217-F237 HydrophobicContact CG2-CD1 4.04Å; I217-H238 WeakPolarHBondContact CA-O 3.48Å
218	L	96.1	Very high	91.1	Very high	56 Å²	56	66.9 Å²	66.9	29%	0.293	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	132.3	179.1	-49	171	0	0	0	109.9	R200 F237 H238	R200-L218 HydrophobicContact CG-CD2 4.01Å; L218-F237 CarbonylContact O-C 3.5Å; L218-F237 VanDerWaalsContact O-CA 3.31Å; L218-F237 WeakPolarHBondContact O-CA 3.06Å; L218-H238 HydrophobicContact CB-CB 4.16Å; L218-H238 PolarHBondContact N-O 2.98Å; L218-H238 PolarHBondContact O-N 3.21Å
219	S	96.1	Very high	90.8	Very high	26 Å²	26	69.7 Å²	69.7	18%	0.182	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	145.1	172.2	49.3	0	0	0	0	110.9	L192 K236	L192-S219 VanDerWaalsContact CD1-OG 3.29Å; L192-S219 WeakPolarHBondContact CD1-OG 2.82Å; S219-K236 CarbonylContact C-O 3.57Å; S219-K236 WeakPolarHBondContact CA-O 3.41Å
220	N	95.6	Very high	90.8	Very high	67 Å²	67	65.2 Å²	65.2	36%	0.358	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	117.4	175.8	-170.8	16.6	0	0	0	110.4	K222 K236	N220-K222 VanDerWaalsContact ND2-CE 3.3Å; N220-K222 WeakPolarHBondContact ND2-CE 3.46Å; N220-K236 HydrophobicContact CB-CB 4.45Å; N220-K236 PolarHBondContact N-O 3.37Å; N220-K236 PolarHBondContact O-N 2.85Å
221	Y	96.4	Very high	91.1	Very high	85 Å²	85	68.8 Å²	68.8	33%	0.333	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	134.9	173.8	177.9	-98.6	0	0	0	110.1	I185 N189 I190 I223 A233 M235	I185-Y221 WeakPolarHBondContact CD1-OH 3.47Å; N189-Y221 PolarHBondContact OD1-OH 3.09Å; I190-Y221 WeakPolarHBondContact O-CE2 3.3Å; Y221-I223 HydrophobicContact CE1-CD1 4.41Å; Y221-I223 HydrophobicContact CE1-CG1 3.88Å; Y221-A233 HydrophobicContact CE2-CB 4.23Å; Y221-M235 HydrophobicContact CD2-CE 3.96Å; Y221-M235 HydrophobicContact CG-CE 4.43Å
222	K	94.4	Very high	91.2	Very high	96 Å²	96	67.3 Å²	67.3	42%	0.417	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	153	175.1	-70.7	-168.2	175.5	-172.3	0	110.4	N220 E234 K236	N220-K222 VanDerWaalsContact ND2-CE 3.3Å; N220-K222 WeakPolarHBondContact ND2-CE 3.46Å; K222-E234 HydrophobicContact CB-CB 4.41Å; K222-E234 PolarHBondContact N-O 2.59Å; K222-E234 PolarHBondContact O-N 3.31Å; K222-E234 VanDerWaalsContact O-O 3.11Å; K222-K236 HydrophobicContact CD-CD 4.28Å
223	I	93.6	Very high	91.3	Very high	96 Å²	96	66.9 Å²	66.9	49%	0.492	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	125.4	166.5	-55.5	176.2	0	0	0	106.3	I185 Y221 Y231 Y232	I185-I223 HydrophobicContact CD1-CD1 3.86Å; I185-I223 HydrophobicContact CD1-CG1 4.01Å; I185-I223 HydrophobicContact CD1-CG2 4.4Å; Y221-I223 HydrophobicContact CE1-CD1 4.41Å; Y221-I223 HydrophobicContact CE1-CG1 3.88Å; I223-Y231 HydrophobicContact CG2-CD1 3.82Å; I223-Y231 HydrophobicContact CG2-CG 4.31Å; I223-Y232 WeakPolarHBondContact CA-O 3.49Å
224	F	89.4	Confident	91.4	Very high	79 Å²	79	65.1 Å²	65.1	35%	0.346	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	142.3	179.6	175.8	-109.4	0	0	0	109.8	V226 Y231 Y232 E234	F224-V226 HydrophobicContact CD1-CG2 4.27Å; F224-V226 HydrophobicContact CE1-CG2 3.27Å; F224-V226 HydrophobicContact CZ-CG2 3.53Å; F224-Y231 CarbonylContact O-C 3.59Å; F224-Y231 WeakPolarHBondContact O-CA 3.42Å; F224-Y232 HydrophobicContact CD1-CD2 4.4Å; F224-Y232 PolarHBondContact N-O 3.12Å; F224-Y232 PolarHBondContact O-N 3.48Å; F224-E234 VanDerWaalsContact CB-CD 3.43Å; F224-E234 HydrophobicContact CB-CG 3.72Å
225	S	89.3	Confident	91.4	Very high	38 Å²	38	65.3 Å²	65.3	27%	0.266	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	133.8	175.8	165.5	0	0	0	0	107.9	D227 D230	S225-D227 PolarHBondContact OG-O 3.09Å; S225-D227 VanDerWaalsContact OG-O 3.05Å; S225-D230 WeakPolarHBondContact CA-O 3.2Å; S225-D230 VanDerWaalsContact CB-O 3.32Å; S225-D230 WeakPolarHBondContact CB-O 3.37Å; S225-D230 PolarHBondContact OG-O 3.12Å
226	V	79.4	Confident	91.6	Very high	98 Å²	98	65.5 Å²	65.5	59%	0.594	33%	0.329	S	S	*	.	S	Bend	trans	-93.5	-55.1	177	178.3	0	0	0	0	109.5	F224	F224-V226 HydrophobicContact CD1-CG2 4.27Å; F224-V226 HydrophobicContact CE1-CG2 3.27Å; F224-V226 HydrophobicContact CZ-CG2 3.53Å
227	D	79.6	Confident	91.7	Very high	113 Å²	113	63.3 Å²	63.3	60%	0.604	32%	0.319	S	S	*	.	S	Bend	trans	-114.9	133.9	172.2	-61.8	-41.5	0	0	0	105.7	S225 D229 D230	S225-D227 PolarHBondContact OG-O 3.09Å; S225-D227 VanDerWaalsContact OG-O 3.05Å; D227-D229 PolarHBondContact O-N 3.02Å; D227-D230 PolarHBondContact O-N 3.5Å
228	N	75.8	Confident	91.7	Very high	134 Å²	134	65 Å²	65	72%	0.717	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-3.5	-167	-75.9	-30.1	0	0	0	117.1	Y231	N228-Y231 WeakPolarHBondContact O-CE2 3.34Å; N228-Y231 PolarHBondContact O-OH 3.15Å
229	D	82.3	Confident	91.7	Very high	145 Å²	145	62.4 Å²	62.4	78%	0.775	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-28.7	-179.6	-63.3	-31	0	0	0	112.9	D227	D227-D229 PolarHBondContact O-N 3.02Å
230	D	89	Confident	91.7	Very high	79 Å²	79	61.6 Å²	61.6	42%	0.422	31%	0.307	S	S	.	.			trans	-109.8	125.2	-177.6	-70	-39.6	0	0	0	112	S225 D227 Y232	S225-D230 WeakPolarHBondContact CA-O 3.2Å; S225-D230 VanDerWaalsContact CB-O 3.32Å; S225-D230 WeakPolarHBondContact CB-O 3.37Å; S225-D230 PolarHBondContact OG-O 3.12Å; D227-D230 PolarHBondContact O-N 3.5Å; D230-Y232 HydrophobicContact CB-CE2 3.92Å
231	Y	93.8	Very high	91.7	Very high	110 Å²	110	58.4 Å²	58.4	43%	0.431	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.9	-179.6	-62	-89.6	0	0	0	111	T184 I185 I223 F224 N228	T184-Y231 CarbonylContact C-O 3.56Å; T184-Y231 WeakPolarHBondContact CA-O 3.49Å; T184-Y231 WeakPolarHBondContact CB-O 3.38Å; I185-Y231 PolarHBondContact N-O 3.38Å; I223-Y231 HydrophobicContact CG2-CD1 3.82Å; I223-Y231 HydrophobicContact CG2-CG 4.31Å; F224-Y231 CarbonylContact O-C 3.59Å; F224-Y231 WeakPolarHBondContact O-CA 3.42Å; N228-Y231 WeakPolarHBondContact O-CE2 3.34Å; N228-Y231 PolarHBondContact O-OH 3.15Å
232	Y	95.2	Very high	91.6	Very high	47 Å²	47	58.4 Å²	58.4	18%	0.184	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	139.7	-179.1	-61.8	-88.7	0	0	0	110.5	H183 T184 I223 F224 D230	H183-Y232 VanDerWaalsContact O-CD1 3.32Å; H183-Y232 WeakPolarHBondContact O-CD1 3.27Å; T184-Y232 HydrophobicContact CG2-CE1 4.32Å; I223-Y232 WeakPolarHBondContact CA-O 3.49Å; F224-Y232 HydrophobicContact CD1-CD2 4.4Å; F224-Y232 PolarHBondContact N-O 3.12Å; F224-Y232 PolarHBondContact O-N 3.48Å; D230-Y232 HydrophobicContact CB-CE2 3.92Å
233	A	96.4	Very high	91.6	Very high	4 Å²	4	54.1 Å²	54.1	3%	0.033	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	121.2	173.9	0	0	0	0	0	110.5	Q179 I185 N189 I190 Y221	Q179-A233 WeakPolarHBondContact CB-O 3.5Å; I185-A233 HydrophobicContact CG1-CB 4.3Å; N189-A233 WeakPolarHBondContact OD1-CB 3Å; I190-A233 HydrophobicContact CB-CB 4.48Å; I190-A233 WeakPolarHBondContact CD1-O 3.44Å; I190-A233 HydrophobicContact CG1-CB 4.3Å; Y221-A233 HydrophobicContact CE2-CB 4.23Å
234	E	95.7	Very high	91.5	Very high	7 Å²	7	54.1 Å²	54.1	3%	0.033	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	135	175.9	-67.1	-169.7	146.5	0	0	111.2	N126 T177 Q179 K222 F224 K236	N126-E234 PolarHBondContact ND2-OE1 3.44Å; T177-E234 HydrophobicContact CG2-CB 4.1Å; T177-E234 HydrophobicContact CG2-CG 4.08Å; Q179-E234 HydrophobicContact CB-CG 4.21Å; K222-E234 HydrophobicContact CB-CB 4.41Å; K222-E234 PolarHBondContact N-O 2.59Å; K222-E234 PolarHBondContact O-N 3.31Å; K222-E234 VanDerWaalsContact O-O 3.11Å; F224-E234 VanDerWaalsContact CB-CD 3.43Å; F224-E234 HydrophobicContact CB-CG 3.72Å; E234-K236 WeakPolarHBondContact OE2-CE 3.41Å; E234-K236 IonicContact OE2-NZ 2.88Å; E234-K236 PolarHBondContact OE2-NZ 3.4Å
235	M	97.3	Very high	91.6	Very high	5 Å²	5	51.6 Å²	51.6	3%	0.025	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	113.1	166.8	-177.2	60.4	67	0	0	110.3	I66 F178 I190 L192 Y221 F237	I66-M235 HydrophobicContact CD1-CB 3.85Å; I66-M235 HydrophobicContact CD1-CG 3.85Å; I66-M235 HydrophobicContact CG1-CG 4.4Å; F178-M235 PolarHBondContact N-O 2.99Å; F178-M235 PolarHBondContact O-N 2.89Å; I190-M235 HydrophobicContact CG2-CB 3.76Å; L192-M235 HydrophobicContact CD1-CE 4.36Å; L192-M235 HydrophobicContact CD1-SD 4.42Å; L192-M235 HydrophobicContact CD2-CE 3.93Å; L192-M235 HydrophobicContact CD2-CG 4.08Å; L192-M235 HydrophobicContact CD2-SD 3.79Å; L192-M235 HydrophobicContact CG-CE 3.69Å; L192-M235 HydrophobicContact CG-SD 4.06Å; Y221-M235 HydrophobicContact CD2-CE 3.96Å; Y221-M235 HydrophobicContact CG-CE 4.43Å; M235-F237 HydrophobicContact CB-CE2 4.41Å; M235-F237 HydrophobicContact CG-CD2 4.3Å; M235-F237 HydrophobicContact CG-CE2 3.57Å; M235-F237 HydrophobicContact CG-CZ 3.77Å
236	K	96.7	Very high	91.6	Very high	43 Å²	43	56.2 Å²	56.2	19%	0.187	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.1	-178.8	-61.8	-170.2	173.7	170	0	110.8	T177 S219 N220 K222 E234	T177-K236 HydrophobicContact CG2-CD 4.35Å; T177-K236 VanDerWaalsContact CG2-CE 3.45Å; T177-K236 HydrophobicContact CG2-CG 3.88Å; T177-K236 WeakPolarHBondContact OG1-CE 3.35Å; S219-K236 CarbonylContact C-O 3.57Å; S219-K236 WeakPolarHBondContact CA-O 3.41Å; N220-K236 HydrophobicContact CB-CB 4.45Å; N220-K236 PolarHBondContact N-O 3.37Å; N220-K236 PolarHBondContact O-N 2.85Å; K222-K236 HydrophobicContact CD-CD 4.28Å; E234-K236 WeakPolarHBondContact OE2-CE 3.41Å; E234-K236 IonicContact OE2-NZ 2.88Å; E234-K236 PolarHBondContact OE2-NZ 3.4Å
237	F	96.9	Very high	92.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	118.4	168	-61.1	-92.9	0	0	0	109.7	I66 L68 S175 L176 F178 L192 L199 I217 L218 M235	I66-F237 HydrophobicContact CD1-CE2 3.64Å; I66-F237 HydrophobicContact CD1-CZ 3.93Å; I66-F237 HydrophobicContact CG1-CE2 4.36Å; I66-F237 HydrophobicContact CG1-CZ 4.14Å; L68-F237 HydrophobicContact CB-CD1 4.29Å; L68-F237 HydrophobicContact CB-CE1 4.12Å; L68-F237 HydrophobicContact CB-CZ 4.35Å; L68-F237 HydrophobicContact CD2-CB 4.04Å; L68-F237 HydrophobicContact CD2-CD1 4.15Å; L68-F237 HydrophobicContact CD2-CD2 4.38Å; L68-F237 HydrophobicContact CD2-CG 3.94Å; S175-F237 CarbonylContact C-O 3.3Å; S175-F237 WeakPolarHBondContact CA-O 3.42Å; L176-F237 HydrophobicContact CB-CB 4.35Å; L176-F237 PolarHBondContact N-O 3.26Å; L176-F237 PolarHBondContact O-N 3.44Å; F178-F237 AromaticContact CD2-CD2 3.46Å; F178-F237 HydrophobicContact CD2-CD2 3.46Å; F178-F237 VanDerWaalsContact CD2-CD2 3.46Å; F178-F237 AromaticContact CD2-CE2 3.55Å; F178-F237 HydrophobicContact CD2-CE2 3.55Å; F178-F237 AromaticContact CE2-CD2 3.56Å; F178-F237 HydrophobicContact CE2-CD2 3.56Å; F178-F237 AromaticContact CE2-CE2 3.84Å; F178-F237 HydrophobicContact CE2-CE2 3.84Å; F178-F237 HydrophobicContact CG-CE2 4.37Å; L192-F237 HydrophobicContact CD2-CE1 3.87Å; L192-F237 HydrophobicContact CD2-CZ 3.76Å; L199-F237 HydrophobicContact CD2-CD1 3.8Å; L199-F237 HydrophobicContact CD2-CE1 3.55Å; I217-F237 HydrophobicContact CG2-CB 4.39Å; I217-F237 HydrophobicContact CG2-CD1 4.04Å; L218-F237 CarbonylContact O-C 3.5Å; L218-F237 VanDerWaalsContact O-CA 3.31Å; L218-F237 WeakPolarHBondContact O-CA 3.06Å; M235-F237 HydrophobicContact CB-CE2 4.41Å; M235-F237 HydrophobicContact CG-CD2 4.3Å; M235-F237 HydrophobicContact CG-CE2 3.57Å; M235-F237 HydrophobicContact CG-CZ 3.77Å
238	H	96.6	Very high	92.5	Very high	38 Å²	38	54.9 Å²	54.9	18%	0.176	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	108	169.4	-63.5	-63.9	0	0	0	109.4	K173 C174 I217 L218	K173-H238 VanDerWaalsContact CE-CG 3.5Å; K173-H238 HydrophobicContact CG-CB 4.28Å; C174-H238 CarbonylContact O-C 3.55Å; C174-H238 WeakPolarHBondContact O-CA 3.48Å; I217-H238 WeakPolarHBondContact CA-O 3.48Å; L218-H238 HydrophobicContact CB-CB 4.16Å; L218-H238 PolarHBondContact N-O 2.98Å; L218-H238 PolarHBondContact O-N 3.21Å
239	V	96.8	Very high	93.1	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	111.9	173.8	-176.8	0	0	0	0	107.6	V70 C174 L176 L214 I241	V70-V239 HydrophobicContact CG2-CG1 4.31Å; V70-V239 HydrophobicContact CG2-CG2 4.28Å; C174-V239 PolarHBondContact N-O 2.96Å; C174-V239 VanDerWaalsContact N-O 3.08Å; C174-V239 PolarHBondContact O-N 3.22Å; L176-V239 HydrophobicContact CD1-CG2 3.83Å; L176-V239 HydrophobicContact CG-CG2 4.3Å; L214-V239 HydrophobicContact CD1-CG1 3.92Å; V239-I241 HydrophobicContact CG1-CG2 4.01Å
240	V	96.4	Very high	93.4	Very high	9 Å²	9	47.1 Å²	47.1	6%	0.055	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	117.6	-179.2	-173	0	0	0	0	109.5	V171 Q172 K173 L215 H216	V171-V240 HydrophobicContact CG1-CG1 3.78Å; Q172-V240 WeakPolarHBondContact O-CA 3.39Å; K173-V240 HydrophobicContact CG-CG2 4.19Å; L215-V240 HydrophobicContact CB-CB 4.46Å; L215-V240 HydrophobicContact CB-CG1 4.24Å; L215-V240 HydrophobicContact CD1-CG1 4.14Å; L215-V240 PolarHBondContact N-O 3.45Å; H216-V240 WeakPolarHBondContact NE2-CG2 3.49Å; H216-V240 PolarHBondContact O-N 3.42Å; H216-V240 VanDerWaalsContact O-N 3.1Å
241	I	95.8	Very high	93.5	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	149.5	-176.1	60	177.5	0	0	0	111	I73 V76 L83 V171 Q172 W212 E213 L214 V239	I73-I241 HydrophobicContact CD1-CG2 3.94Å; I73-I241 HydrophobicContact CG1-CG2 4.1Å; I73-I241 HydrophobicContact CG2-CD1 4.46Å; V76-I241 HydrophobicContact CG2-CD1 4.39Å; L83-I241 HydrophobicContact CD1-CD1 4.2Å; V171-I241 CarbonylContact C-O 3.59Å; V171-I241 WeakPolarHBondContact CA-O 3.42Å; Q172-I241 HydrophobicContact CB-CD1 4.25Å; Q172-I241 HydrophobicContact CB-CG1 3.79Å; Q172-I241 HydrophobicContact CG-CG1 4.48Å; Q172-I241 PolarHBondContact N-O 3.49Å; Q172-I241 PolarHBondContact O-N 3.39Å; W212-I241 HydrophobicContact CD2-CD1 3.96Å; W212-I241 HydrophobicContact CE3-CB 4.02Å; W212-I241 HydrophobicContact CE3-CD1 3.64Å; W212-I241 HydrophobicContact CE3-CG1 3.73Å; W212-I241 HydrophobicContact CG-CD1 4.46Å; W212-I241 HydrophobicContact CZ3-CD1 4.01Å; W212-I241 HydrophobicContact CZ3-CG1 3.99Å; E213-I241 CarbonylContact O-C 3.48Å; E213-I241 VanDerWaalsContact O-CA 3.29Å; E213-I241 WeakPolarHBondContact O-CA 3.42Å; L214-I241 HydrophobicContact CD1-CG2 4.19Å; V239-I241 HydrophobicContact CG1-CG2 4.01Å
242	R	94.2	Very high	93.3	Very high	85 Å²	85	42.2 Å²	42.2	32%	0.321	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	135.3	177.6	178.9	172.8	65.6	-178.8	-1.1	110.3	V171 E213 L215	V171-R242 HydrophobicContact CG2-CB 4.28Å; V171-R242 HydrophobicContact CG2-CG 4.16Å; E213-R242 VanDerWaalsContact CD-NH2 3.33Å; E213-R242 PolarHBondContact N-O 2.92Å; E213-R242 PolarHBondContact O-N 2.92Å; E213-R242 IonicContact OE1-NH2 2.73Å; E213-R242 PolarHBondContact OE1-NH2 2.99Å; E213-R242 IonicContact OE2-CZ 3.24Å; E213-R242 IonicContact OE2-NE 2.69Å; E213-R242 PolarHBondContact OE2-NE 3.09Å; E213-R242 IonicContact OE2-NH2 3.52Å; E213-R242 PolarHBondContact OE2-NH2 3.41Å; L215-R242 HydrophobicContact CD1-CB 3.99Å; L215-R242 HydrophobicContact CD2-CB 4.16Å; L215-R242 HydrophobicContact CG-CB 3.99Å
243	R	93.2	Very high	93	Very high	5 Å²	5	41.6 Å²	41.6	2%	0.019	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	144	176	-165.4	-178.3	-55	-102.9	3.9	110.9	E78 D170 E211 W212 P245 Y248	E78-R243 IonicContact OE1-CZ 3.38Å; E78-R243 IonicContact OE1-NH1 3.74Å; E78-R243 PolarHBondContact OE1-NH1 3.47Å; E78-R243 IonicContact OE1-NH2 3.2Å; E78-R243 PolarHBondContact OE1-NH2 3.27Å; D170-R243 PolarHBondContact O-N 3.2Å; D170-R243 VanDerWaalsContact O-N 3.13Å; D170-R243 WeakPolarHBondContact OD1-CB 3.42Å; D170-R243 WeakPolarHBondContact OD1-CD 3.47Å; D170-R243 IonicContact OD1-CZ 3.32Å; D170-R243 IonicContact OD1-NE 2.84Å; D170-R243 PolarHBondContact OD1-NE 3.11Å; D170-R243 IonicContact OD1-NH2 3.08Å; D170-R243 IonicContact OD2-CZ 2.73Å; D170-R243 IonicContact OD2-NE 2.77Å; D170-R243 PolarHBondContact OD2-NE 3.19Å; D170-R243 IonicContact OD2-NH2 2.72Å; D170-R243 PolarHBondContact OD2-NH2 3.49Å; E211-R243 HydrophobicContact CG-CG 4.28Å; E211-R243 IonicContact OE1-CZ 3.28Å; E211-R243 IonicContact OE1-NE 3.66Å; E211-R243 IonicContact OE1-NH1 3.8Å; E211-R243 PolarHBondContact OE1-NH1 3.49Å; W212-R243 HydrophobicContact CE3-CB 4.1Å; W212-R243 HydrophobicContact CH2-CB 4.05Å; W212-R243 HydrophobicContact CH2-CG 4.48Å; W212-R243 VanDerWaalsContact CZ2-NH2 3.28Å; W212-R243 HydrophobicContact CZ3-CB 3.79Å; R243-P245 WeakPolarHBondContact O-CD 3.49Å; R243-Y248 HydrophobicContact CG-CE2 4.41Å
244	R	92	Very high	92.6	Very high	97 Å²	97	46.8 Å²	46.8	37%	0.366	23%	0.228	S	C	.	.			trans	-84.1	110.6	168.8	-65.4	-179.5	-173.9	-74.7	4	109.7	N208 G210 E211 L246	N208-R244 PolarHBondContact O-NH2 2.75Å; G210-R244 WeakPolarHBondContact O-CD 3.32Å; G210-R244 PolarHBondContact O-NE 3.19Å; E211-R244 VanDerWaalsContact O-CB 3.3Å; E211-R244 WeakPolarHBondContact O-CB 3.42Å; E211-R244 VanDerWaalsContact O-CG 3.28Å; E211-R244 WeakPolarHBondContact O-CG 3.32Å; E211-R244 PolarHBondContact O-N 3.34Å; R244-L246 PolarHBondContact O-N 3.26Å
245	P	90.4	Very high	92.5	Very high	26 Å²	26	48.6 Å²	48.6	17%	0.169	24%	0.24	C	C	.	.			trans	-85.5	-8.8	-166.6	33.9	-38.4	0	0	0	114.7	P168 F169 R243 F247 Y248 T249	P168-P245 HydrophobicContact CB-CB 4.21Å; P168-P245 HydrophobicContact CG-CB 4.01Å; F169-P245 HydrophobicContact CD1-CB 3.37Å; F169-P245 HydrophobicContact CD1-CG 3.61Å; F169-P245 HydrophobicContact CE1-CB 3.27Å; F169-P245 HydrophobicContact CE1-CG 3.45Å; F169-P245 VanDerWaalsContact CE1-CG 3.45Å; F169-P245 HydrophobicContact CG-CB 4.34Å; F169-P245 HydrophobicContact CZ-CB 4.13Å; R243-P245 WeakPolarHBondContact O-CD 3.49Å; P245-F247 PolarHBondContact O-N 2.69Å; P245-Y248 PolarHBondContact O-N 3.44Å; P245-T249 WeakPolarHBondContact O-CB 3.28Å; P245-T249 PolarHBondContact O-N 3.38Å; P245-T249 PolarHBondContact O-OG1 3.09Å
246	L	89.1	Confident	92.2	Very high	135 Å²	135	48.4 Å²	48.4	71%	0.707	24%	0.239	S	C	*	.	H	α-helix	trans	-58.8	-44.7	-167.9	-72.1	173.4	0	0	0	113	R244 Y248 T249 V250	R244-L246 PolarHBondContact O-N 3.26Å; L246-Y248 PolarHBondContact O-N 2.94Å; L246-T249 PolarHBondContact O-N 3.28Å; L246-V250 WeakPolarHBondContact O-CG2 3.33Å; L246-V250 PolarHBondContact O-N 3.28Å
247	F	90	Very high	91.9	Very high	138 Å²	138	49.7 Å²	49.7	61%	0.605	25%	0.25	S	S	*	.	H	α-helix	trans	-59.1	-47.6	178.8	176.2	-96	0	0	0	111.6	P245 N251	P245-F247 PolarHBondContact O-N 2.69Å; F247-N251 WeakPolarHBondContact CD2-ND2 3.06Å; F247-N251 WeakPolarHBondContact CE2-ND2 3.36Å; F247-N251 VanDerWaalsContact CZ-ND2 3.26Å; F247-N251 WeakPolarHBondContact CZ-ND2 3.32Å; F247-N251 WeakPolarHBondContact O-CB 3.43Å; F247-N251 PolarHBondContact O-N 3.32Å; F247-N251 PolarHBondContact O-ND2 3.03Å
248	Y	89.5	Confident	91.8	Very high	44 Å²	44	55.5 Å²	55.5	17%	0.173	28%	0.276	C	S	.	.	H	α-helix	trans	-69.1	-38.3	179.4	-61.8	-73.3	0	0	0	112.3	F167 P168 E211 R243 P245 L246 V250 N251 L252	F167-Y248 HydrophobicContact CE1-CD1 4.15Å; F167-Y248 HydrophobicContact CE1-CG 4.34Å; F167-Y248 HydrophobicContact CE2-CD1 4.4Å; F167-Y248 HydrophobicContact CE2-CE1 4.26Å; F167-Y248 AromaticContact CZ-CD1 3.47Å; F167-Y248 HydrophobicContact CZ-CD1 3.47Å; F167-Y248 VanDerWaalsContact CZ-CD1 3.47Å; F167-Y248 HydrophobicContact CZ-CD2 4.31Å; F167-Y248 AromaticContact CZ-CE1 3.65Å; F167-Y248 HydrophobicContact CZ-CE1 3.65Å; F167-Y248 HydrophobicContact CZ-CE2 4.48Å; F167-Y248 AromaticContact CZ-CG 3.81Å; F167-Y248 HydrophobicContact CZ-CG 3.81Å; P168-Y248 HydrophobicContact CB-CD2 3.9Å; P168-Y248 HydrophobicContact CB-CG 3.89Å; E211-Y248 PolarHBondContact OE1-OH 3.26Å; E211-Y248 VanDerWaalsContact OE1-OH 3.05Å; R243-Y248 HydrophobicContact CG-CE2 4.41Å; P245-Y248 PolarHBondContact O-N 3.44Å; L246-Y248 PolarHBondContact O-N 2.94Å; Y248-V250 PolarHBondContact O-N 3.18Å; Y248-N251 PolarHBondContact O-N 2.9Å; Y248-L252 HydrophobicContact CD1-CD1 4.13Å; Y248-L252 WeakPolarHBondContact O-CA 3.3Å; Y248-L252 WeakPolarHBondContact O-CB 3.35Å; Y248-L252 WeakPolarHBondContact O-CG 3.27Å; Y248-L252 PolarHBondContact O-N 2.93Å
249	T	87.8	Confident	91.7	Very high	35 Å²	35	55.1 Å²	55.1	22%	0.215	28%	0.275	C	S	.	.	I	π-helix	trans	-60	-47.7	177.2	-60.8	0	0	0	0	110.9	P245 L246 L253 L254	P245-T249 WeakPolarHBondContact O-CB 3.28Å; P245-T249 PolarHBondContact O-N 3.38Å; P245-T249 PolarHBondContact O-OG1 3.09Å; L246-T249 PolarHBondContact O-N 3.28Å; T249-L253 HydrophobicContact CG2-CD1 4.22Å; T249-L253 WeakPolarHBondContact O-CB 3.39Å; T249-L253 PolarHBondContact O-N 3.13Å; T249-L253 VanDerWaalsContact O-N 3.11Å; T249-L254 PolarHBondContact O-N 3.42Å
250	V	89.7	Confident	91.5	Very high	82 Å²	82	55.9 Å²	55.9	50%	0.497	28%	0.278	S	S	.	.	I	π-helix	trans	-69.7	-43.1	-179.9	174.9	0	0	0	0	111.7	L246 Y248 L254	L246-V250 WeakPolarHBondContact O-CG2 3.33Å; L246-V250 PolarHBondContact O-N 3.28Å; Y248-V250 PolarHBondContact O-N 3.18Å; V250-L254 WeakPolarHBondContact O-CB 3.41Å
251	N	89.9	Confident	91.4	Very high	76 Å²	76	58.7 Å²	58.7	41%	0.406	30%	0.296	S	S	.	.	I	π-helix	trans	-84.7	-21.9	-172.9	-68.4	-32.5	0	0	0	114.4	F247 Y248 P255	F247-N251 WeakPolarHBondContact CD2-ND2 3.06Å; F247-N251 WeakPolarHBondContact CE2-ND2 3.36Å; F247-N251 VanDerWaalsContact CZ-ND2 3.26Å; F247-N251 WeakPolarHBondContact CZ-ND2 3.32Å; F247-N251 WeakPolarHBondContact O-CB 3.43Å; F247-N251 PolarHBondContact O-N 3.32Å; F247-N251 PolarHBondContact O-ND2 3.03Å; Y248-N251 PolarHBondContact O-N 2.9Å; N251-P255 WeakPolarHBondContact O-CG 2.92Å
252	L	90.1	Very high	91.3	Very high	10 Å²	10	61.2 Å²	61.2	5%	0.052	31%	0.308	C	S	.	.	I	π-helix	trans	-106.2	-47.5	-178.2	-56.7	179.7	0	0	0	112.5	F167 Y248 F290 V294 L298 I308 F312	F167-L252 HydrophobicContact CE1-CD1 3.94Å; Y248-L252 HydrophobicContact CD1-CD1 4.13Å; Y248-L252 WeakPolarHBondContact O-CA 3.3Å; Y248-L252 WeakPolarHBondContact O-CB 3.35Å; Y248-L252 WeakPolarHBondContact O-CG 3.27Å; Y248-L252 PolarHBondContact O-N 2.93Å; L252-F290 WeakPolarHBondContact O-CZ 3.4Å; L252-V294 HydrophobicContact CD2-CB 4.33Å; L252-V294 HydrophobicContact CD2-CG1 3.92Å; L252-V294 HydrophobicContact CD2-CG2 3.6Å; L252-L298 HydrophobicContact CD1-CD2 4.27Å; L252-I308 HydrophobicContact CB-CD1 4.34Å; L252-I308 HydrophobicContact CD1-CD1 4.32Å; L252-F312 HydrophobicContact CB-CZ 4.17Å
253	L	87.7	Confident	91.4	Very high	33 Å²	33	57.3 Å²	57.3	17%	0.173	29%	0.293	C	S	.	.	I	π-helix	trans	-79.8	-41.3	-174.7	-63	176.9	0	0	0	112.1	T249 S256 V257 I308 Y311	T249-L253 HydrophobicContact CG2-CD1 4.22Å; T249-L253 WeakPolarHBondContact O-CB 3.39Å; T249-L253 PolarHBondContact O-N 3.13Å; T249-L253 VanDerWaalsContact O-N 3.11Å; L253-S256 PolarHBondContact O-N 3.5Å; L253-V257 WeakPolarHBondContact O-CG2 3.42Å; L253-V257 PolarHBondContact O-N 2.96Å; L253-I308 HydrophobicContact CD2-CD1 3.79Å; L253-I308 HydrophobicContact CD2-CG1 4.24Å; L253-I308 HydrophobicContact CG-CD1 4.3Å; L253-Y311 HydrophobicContact CD2-CD1 4.49Å; L253-Y311 HydrophobicContact CD2-CE1 4.22Å
254	L	89.7	Confident	91.4	Very high	114 Å²	114	58.7 Å²	58.7	60%	0.597	30%	0.301	S	S	*	.	H	α-helix	trans	-60.5	-47.6	-176.9	-171.1	71.2	0	0	0	113.1	T249 V250 S256 V257 F258	T249-L254 PolarHBondContact O-N 3.42Å; V250-L254 WeakPolarHBondContact O-CB 3.41Å; L254-S256 VanDerWaalsContact C-N 3.33Å; L254-S256 PolarHBondContact O-N 3.12Å; L254-V257 PolarHBondContact O-N 2.99Å; L254-F258 PolarHBondContact O-N 3.33Å
255	P	92.3	Very high	91.5	Very high	45 Å²	45	57 Å²	57	29%	0.292	30%	0.301	S	S	.	.	H	α-helix	trans	-64.2	-38.2	177.3	-22.4	35.9	0	0	0	112.4	N251 V257 F258 L259 F290	N251-P255 WeakPolarHBondContact O-CG 2.92Å; P255-V257 PolarHBondContact O-N 3.5Å; P255-F258 PolarHBondContact O-N 2.95Å; P255-L259 WeakPolarHBondContact O-CG 3.42Å; P255-L259 PolarHBondContact O-N 3.27Å; P255-F290 HydrophobicContact CB-CD2 4.27Å; P255-F290 HydrophobicContact CB-CE2 3.77Å; P255-F290 HydrophobicContact CB-CZ 4.18Å; P255-F290 HydrophobicContact CG-CE2 4.11Å
256	S	91.6	Very high	91.5	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65	-40.5	177.9	-177.1	0	0	0	0	112.2	L253 L254 M260 Y311	L253-S256 PolarHBondContact O-N 3.5Å; L254-S256 VanDerWaalsContact C-N 3.33Å; L254-S256 PolarHBondContact O-N 3.12Å; S256-M260 WeakPolarHBondContact O-CG 3.41Å; S256-M260 PolarHBondContact O-N 3.23Å; S256-M260 VanDerWaalsContact O-N 3.16Å; S256-Y311 WeakPolarHBondContact OG-CE1 3.34Å
257	V	90.9	Very high	91.6	Very high	70 Å²	70	49.9 Å²	49.9	42%	0.424	26%	0.262	S	S	.	.	H	α-helix	trans	-65.9	-41.5	175.6	171.4	0	0	0	0	110.3	L253 L254 P255 L259 M260 V261	L253-V257 WeakPolarHBondContact O-CG2 3.42Å; L253-V257 PolarHBondContact O-N 2.96Å; L254-V257 PolarHBondContact O-N 2.99Å; P255-V257 PolarHBondContact O-N 3.5Å; V257-L259 PolarHBondContact O-N 3.22Å; V257-M260 WeakPolarHBondContact O-CB 3.48Å; V257-M260 PolarHBondContact O-N 3.24Å; V257-V261 WeakPolarHBondContact O-CG2 3.32Å; V257-V261 PolarHBondContact O-N 3.01Å
258	F	93.9	Very high	91.5	Very high	123 Å²	123	50.7 Å²	50.7	54%	0.539	27%	0.265	S	S	.	.	H	α-helix	trans	-59.4	-46.3	177	178.7	-98	0	0	0	112.3	L254 P255 M260 V261 M262	L254-F258 PolarHBondContact O-N 3.33Å; P255-F258 PolarHBondContact O-N 2.95Å; F258-M260 VanDerWaalsContact C-N 3.3Å; F258-M260 PolarHBondContact O-N 3.4Å; F258-V261 PolarHBondContact O-N 3.24Å; F258-M262 HydrophobicContact CD1-CG 4.21Å; F258-M262 HydrophobicContact CE1-CG 3.78Å; F258-M262 HydrophobicContact CE1-SD 4.44Å; F258-M262 HydrophobicContact CE2-CE 3.96Å; F258-M262 HydrophobicContact CE2-CG 4.48Å; F258-M262 HydrophobicContact CZ-CE 4.07Å; F258-M262 HydrophobicContact CZ-CG 3.93Å; F258-M262 HydrophobicContact CZ-SD 4.03Å; F258-M262 WeakPolarHBondContact O-CG 3.32Å; F258-M262 PolarHBondContact O-N 2.99Å
259	L	94	Very high	91.5	Very high	30 Å²	30	51.1 Å²	51.1	16%	0.157	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-35.9	177.4	-67.6	173.9	0	0	0	112.2	P255 V257 M262 D263 L283 Y287	P255-L259 WeakPolarHBondContact O-CG 3.42Å; P255-L259 PolarHBondContact O-N 3.27Å; V257-L259 PolarHBondContact O-N 3.22Å; L259-M262 PolarHBondContact O-N 3.25Å; L259-D263 PolarHBondContact O-N 2.98Å; L259-L283 HydrophobicContact CB-CD1 4.36Å; L259-L283 HydrophobicContact CD2-CD1 3.64Å; L259-Y287 HydrophobicContact CB-CD2 4.2Å; L259-Y287 HydrophobicContact CD1-CD2 3.66Å; L259-Y287 HydrophobicContact CD1-CE2 4.46Å; L259-Y287 HydrophobicContact CD1-CG 4.43Å
260	M	93.5	Very high	91.4	Very high	16 Å²	16	52.7 Å²	52.7	8%	0.079	28%	0.282	C	S	.	.	H	α-helix	trans	-65.1	-41.6	173.9	-78.8	-63.6	173.2	0	0	113	S256 V257 F258 M262 D263 I264 C315 L318 L319	S256-M260 WeakPolarHBondContact O-CG 3.41Å; S256-M260 PolarHBondContact O-N 3.23Å; S256-M260 VanDerWaalsContact O-N 3.16Å; V257-M260 WeakPolarHBondContact O-CB 3.48Å; V257-M260 PolarHBondContact O-N 3.24Å; F258-M260 VanDerWaalsContact C-N 3.3Å; F258-M260 PolarHBondContact O-N 3.4Å; M260-M262 VanDerWaalsContact C-N 3.32Å; M260-M262 PolarHBondContact O-N 3.39Å; M260-D263 WeakPolarHBondContact O-CB 3.39Å; M260-D263 PolarHBondContact O-N 3.22Å; M260-I264 PolarHBondContact O-N 3.16Å; M260-C315 VanDerWaalsContact CE-C 3.48Å; M260-C315 HydrophobicContact CE-CB 3.21Å; M260-C315 WeakPolarHBondContact CE-O 3.31Å; M260-C315 VanDerWaalsContact CE-SG 3.59Å; M260-L318 HydrophobicContact CE-CB 4.39Å; M260-L319 HydrophobicContact CE-CD2 4.36Å; M260-L319 HydrophobicContact CE-CG 4.06Å; M260-L319 HydrophobicContact SD-CD2 4.24Å
261	V	93.9	Very high	91	Very high	69 Å²	69	49.9 Å²	49.9	42%	0.418	27%	0.265	S	S	.	.	H	α-helix	trans	-63.7	-41.1	174.4	174.2	0	0	0	0	110.7	V257 F258 D263 I264 V265	V257-V261 WeakPolarHBondContact O-CG2 3.32Å; V257-V261 PolarHBondContact O-N 3.01Å; F258-V261 PolarHBondContact O-N 3.24Å; V261-D263 VanDerWaalsContact C-N 3.28Å; V261-D263 PolarHBondContact O-N 2.98Å; V261-I264 WeakPolarHBondContact O-CB 3.5Å; V261-I264 PolarHBondContact O-N 3.26Å; V261-V265 WeakPolarHBondContact O-CG2 3.46Å; V261-V265 PolarHBondContact O-N 3.32Å
262	M	94.9	Very high	90.4	Very high	53 Å²	53	50.9 Å²	50.9	26%	0.261	27%	0.27	S	S	.	.	H	α-helix	trans	-61.7	-35.3	175.4	-69.9	-59.9	105	0	0	112.5	F258 L259 M260 V265 G266 F279 L283	F258-M262 HydrophobicContact CD1-CG 4.21Å; F258-M262 HydrophobicContact CE1-CG 3.78Å; F258-M262 HydrophobicContact CE1-SD 4.44Å; F258-M262 HydrophobicContact CE2-CE 3.96Å; F258-M262 HydrophobicContact CE2-CG 4.48Å; F258-M262 HydrophobicContact CZ-CE 4.07Å; F258-M262 HydrophobicContact CZ-CG 3.93Å; F258-M262 HydrophobicContact CZ-SD 4.03Å; F258-M262 WeakPolarHBondContact O-CG 3.32Å; F258-M262 PolarHBondContact O-N 2.99Å; L259-M262 PolarHBondContact O-N 3.25Å; M260-M262 VanDerWaalsContact C-N 3.32Å; M260-M262 PolarHBondContact O-N 3.39Å; M262-V265 HydrophobicContact CE-CG2 4.4Å; M262-V265 PolarHBondContact O-N 3.04Å; M262-G266 PolarHBondContact O-N 2.94Å; M262-F279 HydrophobicContact CB-CZ 4.47Å; M262-F279 WeakPolarHBondContact O-CE1 3.49Å; M262-L283 HydrophobicContact CB-CD1 3.92Å; M262-L283 HydrophobicContact CB-CD2 4.49Å
263	D	95	Very high	89.7	Confident	2 Å²	2	54 Å²	54	1%	0.011	29%	0.292	C	S	.	.	H	α-helix	trans	-63.9	-42.8	175.7	-171.9	59.9	0	0	0	112.6	L259 M260 V261 V265 G266 F267 K280 L283 L319 S322 Y453	L259-D263 PolarHBondContact O-N 2.98Å; M260-D263 WeakPolarHBondContact O-CB 3.39Å; M260-D263 PolarHBondContact O-N 3.22Å; V261-D263 VanDerWaalsContact C-N 3.28Å; V261-D263 PolarHBondContact O-N 2.98Å; D263-V265 VanDerWaalsContact C-N 3.3Å; D263-V265 PolarHBondContact O-N 3.12Å; D263-G266 WeakPolarHBondContact O-CA 3.49Å; D263-G266 PolarHBondContact O-N 2.88Å; D263-G266 VanDerWaalsContact O-N 3.09Å; D263-F267 VanDerWaalsContact O-CD2 3.3Å; D263-F267 WeakPolarHBondContact O-CD2 3.34Å; D263-K280 VanDerWaalsContact CG-NZ 3.35Å; D263-K280 PolarHBondContact O-NZ 2.89Å; D263-K280 VanDerWaalsContact O-NZ 3.12Å; D263-K280 IonicContact OD1-NZ 3.08Å; D263-K280 PolarHBondContact OD1-NZ 3.4Å; D263-K280 IonicContact OD2-NZ 3.22Å; D263-L283 VanDerWaalsContact CA-CD2 3.41Å; D263-L283 HydrophobicContact CB-CD2 3.47Å; D263-L283 VanDerWaalsContact CB-CD2 3.47Å; D263-L319 HydrophobicContact CB-CD2 3.56Å; D263-S322 PolarHBondContact OD2-OG 3.16Å; D263-Y453 VanDerWaalsContact OD2-CE1 3.28Å; D263-Y453 WeakPolarHBondContact OD2-CE1 3.32Å; D263-Y453 PolarHBondContact OD2-OH 3.34Å
264	I	93.8	Very high	89.2	Confident	35 Å²	35	54.1 Å²	54.1	18%	0.179	30%	0.302	C	S	.	.	H	α-helix	trans	-60	-43.9	173.5	-62	171.2	0	0	0	109.7	M260 V261 G266 F267 F450 Y453 L454 V457	M260-I264 PolarHBondContact O-N 3.16Å; V261-I264 WeakPolarHBondContact O-CB 3.5Å; V261-I264 PolarHBondContact O-N 3.26Å; I264-G266 PolarHBondContact O-N 3.02Å; I264-F267 WeakPolarHBondContact O-CB 3.47Å; I264-F267 PolarHBondContact O-N 3.4Å; I264-F267 VanDerWaalsContact O-N 3.12Å; I264-F450 HydrophobicContact CG2-CE2 4.1Å; I264-F450 HydrophobicContact CG2-CZ 4.32Å; I264-Y453 HydrophobicContact CG1-CE1 4.37Å; I264-L454 HydrophobicContact CG2-CD1 4.4Å; I264-V457 HydrophobicContact CD1-CG1 4.27Å
265	V	93.1	Very high	89.1	Confident	62 Å²	62	54.5 Å²	54.5	38%	0.376	30%	0.301	S	S	.	.	H	α-helix	trans	-60.1	-35.7	176.3	173.6	0	0	0	0	111.3	V261 M262 D263 F267 F268	V261-V265 WeakPolarHBondContact O-CG2 3.46Å; V261-V265 PolarHBondContact O-N 3.32Å; M262-V265 HydrophobicContact CE-CG2 4.4Å; M262-V265 PolarHBondContact O-N 3.04Å; D263-V265 VanDerWaalsContact C-N 3.3Å; D263-V265 PolarHBondContact O-N 3.12Å; V265-F267 PolarHBondContact O-N 3.23Å; V265-F267 VanDerWaalsContact O-N 3.15Å; V265-F268 PolarHBondContact O-N 3.21Å
266	G	91.8	Very high	89	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-56.5	-26.8	176	0	0	0	0	0	114.6	M262 D263 I264 F268 L269 R276 F279	M262-G266 PolarHBondContact O-N 2.94Å; D263-G266 WeakPolarHBondContact O-CA 3.49Å; D263-G266 PolarHBondContact O-N 2.88Å; D263-G266 VanDerWaalsContact O-N 3.09Å; I264-G266 PolarHBondContact O-N 3.02Å; G266-F268 VanDerWaalsContact C-N 3.32Å; G266-F268 PolarHBondContact O-N 3.18Å; G266-L269 PolarHBondContact O-N 3.19Å; G266-R276 WeakPolarHBondContact O-CG 3.46Å; G266-F279 VanDerWaalsContact CA-CE1 3.47Å
267	F	90.3	Very high	89	Confident	11 Å²	11	53.9 Å²	53.9	5%	0.048	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-21	176.6	-78	-91.6	0	0	0	114	D263 I264 V265 L269 K280 S322 E325 F450 Y453	D263-F267 VanDerWaalsContact O-CD2 3.3Å; D263-F267 WeakPolarHBondContact O-CD2 3.34Å; I264-F267 WeakPolarHBondContact O-CB 3.47Å; I264-F267 PolarHBondContact O-N 3.4Å; I264-F267 VanDerWaalsContact O-N 3.12Å; V265-F267 PolarHBondContact O-N 3.23Å; V265-F267 VanDerWaalsContact O-N 3.15Å; F267-L269 PolarHBondContact O-N 3.47Å; F267-K280 VanDerWaalsContact CE2-NZ 3.3Å; F267-S322 WeakPolarHBondContact CE2-OG 3.49Å; F267-S322 WeakPolarHBondContact CZ-OG 3.41Å; F267-E325 WeakPolarHBondContact CE1-OE1 3.42Å; F267-E325 VanDerWaalsContact CE1-OE2 3.31Å; F267-E325 WeakPolarHBondContact CE1-OE2 3.37Å; F267-E325 WeakPolarHBondContact CZ-OE2 3.25Å; F267-F450 HydrophobicContact CB-CD2 3.46Å; F267-F450 VanDerWaalsContact CB-CD2 3.46Å; F267-F450 HydrophobicContact CB-CE2 3.62Å; F267-F450 HydrophobicContact CB-CG 4.32Å; F267-F450 HydrophobicContact CD1-CB 4.04Å; F267-F450 AromaticContact CD1-CD2 3.61Å; F267-F450 HydrophobicContact CD1-CD2 3.61Å; F267-F450 HydrophobicContact CD1-CG 4.23Å; F267-F450 AromaticContact CD2-CD2 3.89Å; F267-F450 HydrophobicContact CD2-CD2 3.89Å; F267-F450 HydrophobicContact CD2-CE2 4.15Å; F267-F450 HydrophobicContact CE1-CB 4.41Å; F267-F450 HydrophobicContact CE1-CD2 4.25Å; F267-F450 HydrophobicContact CE2-CD2 4.48Å; F267-F450 AromaticContact CG-CD2 3.39Å; F267-F450 HydrophobicContact CG-CD2 3.39Å; F267-F450 AromaticContact CG-CE2 3.89Å; F267-F450 HydrophobicContact CG-CE2 3.89Å; F267-F450 HydrophobicContact CG-CG 4.37Å; F267-Y453 HydrophobicContact CD2-CD1 4.37Å; F267-Y453 HydrophobicContact CD2-CE1 4.47Å; F267-Y453 AromaticContact CE2-CD1 3.5Å; F267-Y453 HydrophobicContact CE2-CD1 3.5Å; F267-Y453 AromaticContact CE2-CE1 3.59Å; F267-Y453 HydrophobicContact CE2-CE1 3.59Å; F267-Y453 HydrophobicContact CE2-CG 4.19Å; F267-Y453 AromaticContact CZ-CD1 3.83Å; F267-Y453 HydrophobicContact CZ-CD1 3.83Å; F267-Y453 HydrophobicContact CZ-CE1 4.25Å; F267-Y453 HydrophobicContact CZ-CG 4.06Å
268	F	88.6	Confident	89.1	Confident	154 Å²	154	53.5 Å²	53.5	68%	0.675	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-10.2	176.8	-64.8	-68.9	0	0	0	113.1	V265 G266 F450	V265-F268 PolarHBondContact O-N 3.21Å; G266-F268 VanDerWaalsContact C-N 3.32Å; G266-F268 PolarHBondContact O-N 3.18Å; F268-F450 HydrophobicContact CZ-CZ 4.32Å
269	L	89.2	Confident	89.2	Confident	53 Å²	53	51 Å²	51	28%	0.277	29%	0.285	S	S	.	.	S	Bend	trans	-73.7	136.7	173.6	-81.1	75.7	0	0	0	110.1	G266 F267 E275 R276	G266-L269 PolarHBondContact O-N 3.19Å; F267-L269 PolarHBondContact O-N 3.47Å; L269-E275 HydrophobicContact CD2-CB 4.42Å; L269-R276 HydrophobicContact CB-CB 3.98Å; L269-R276 HydrophobicContact CB-CG 4.17Å; L269-R276 WeakPolarHBondContact O-CD 3.01Å
270	P	85.3	Confident	89.2	Confident	69 Å²	69	49.8 Å²	49.8	45%	0.448	28%	0.279	S	S	.	.			trans	-64.5	137.3	176.9	27.1	-33.5	0	0	0	110.6	D272	P270-D272 PolarHBondContact O-N 2.95Å
271	P	81.8	Confident	89.3	Confident	23 Å²	23	53.3 Å²	53.3	15%	0.149	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-67.2	-19.8	179.9	27.4	-34.3	0	0	0	113	S273 I329 V330	P271-S273 VanDerWaalsContact C-N 3.31Å; P271-S273 PolarHBondContact O-N 3.31Å; P271-I329 HydrophobicContact CB-CG2 3.85Å; P271-I329 HydrophobicContact CG-CG2 4.24Å; P271-V330 HydrophobicContact CB-CG2 4.34Å
272	D	76.9	Confident	89.4	Confident	97 Å²	97	54.3 Å²	54.3	52%	0.519	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-70.1	-25.9	-174.8	-56.5	-25.7	0	0	0	113.4	P270 V333	P270-D272 PolarHBondContact O-N 2.95Å; D272-V333 VanDerWaalsContact OD1-CG1 3.24Å; D272-V333 WeakPolarHBondContact OD1-CG1 3.42Å
273	S	75.9	Confident	89.4	Confident	74 Å²	74	52.6 Å²	52.6	52%	0.517	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-83.8	-8.5	-171.2	-57	0	0	0	0	114.3	P271 E275	P271-S273 VanDerWaalsContact C-N 3.31Å; P271-S273 PolarHBondContact O-N 3.31Å; S273-E275 PolarHBondContact O-N 3.47Å
274	G	76.4	Confident	89.4	Confident	36 Å²	36	54 Å²	54	37%	0.371	30%	0.303	S	S	.	.	S	Bend	trans	69.6	-26.1	-174.7	0	0	0	0	0	115	R276 V277	G274-R276 PolarHBondContact O-N 3.16Å; G274-R276 VanDerWaalsContact O-N 3.16Å; G274-V277 PolarHBondContact O-N 2.89Å; G274-V277 VanDerWaalsContact O-N 3.09Å
275	E	87.8	Confident	89.5	Confident	122 Å²	122	57.7 Å²	57.7	57%	0.57	32%	0.322	S	S	*	.	H	α-helix	trans	-56.5	-30.3	178.4	-61.6	-56	155.3	0	0	113.7	L269 S273 V277 S278 F279	L269-E275 HydrophobicContact CD2-CB 4.42Å; S273-E275 PolarHBondContact O-N 3.47Å; E275-V277 VanDerWaalsContact C-N 3.32Å; E275-V277 PolarHBondContact O-N 3.16Å; E275-S278 PolarHBondContact O-N 3.41Å; E275-F279 WeakPolarHBondContact O-CB 3.45Å; E275-F279 PolarHBondContact O-N 3.31Å
276	R	90.5	Very high	89.7	Confident	1 Å²	1	56.4 Å²	56.4	0%	0.004	32%	0.321	C	S	.	.	H	α-helix	trans	-61.3	-38.3	177.1	-173.5	176.2	162.9	177.7	-9.2	112.6	G266 L269 G274 K280 T326 D446	G266-R276 WeakPolarHBondContact O-CG 3.46Å; L269-R276 HydrophobicContact CB-CB 3.98Å; L269-R276 HydrophobicContact CB-CG 4.17Å; L269-R276 WeakPolarHBondContact O-CD 3.01Å; G274-R276 PolarHBondContact O-N 3.16Å; G274-R276 VanDerWaalsContact O-N 3.16Å; R276-K280 PolarHBondContact O-N 3.43Å; R276-K280 VanDerWaalsContact O-N 3.16Å; R276-T326 HydrophobicContact CB-CG2 4.26Å; R276-T326 HydrophobicContact CG-CG2 3.66Å; R276-T326 PolarHBondContact NE-OG1 3.36Å; R276-D446 IonicContact CZ-OD1 3.23Å; R276-D446 VanDerWaalsContact CZ-OD1 3.24Å; R276-D446 IonicContact NH1-OD1 2.75Å; R276-D446 PolarHBondContact NH1-OD1 3.48Å; R276-D446 IonicContact NH1-OD2 3.2Å; R276-D446 PolarHBondContact NH1-OD2 2.91Å; R276-D446 VanDerWaalsContact NH1-OD2 3.08Å; R276-D446 IonicContact NH2-OD1 2.79Å; R276-D446 PolarHBondContact NH2-OD1 3.49Å
277	V	91.8	Very high	89.8	Confident	31 Å²	31	56.4 Å²	56.4	19%	0.188	32%	0.321	C	S	.	.	H	α-helix	trans	-69.2	-46.2	177.7	177	0	0	0	0	109.8	G274 E275 F279 K280 I281 T326 V327 V330	G274-V277 PolarHBondContact O-N 2.89Å; G274-V277 VanDerWaalsContact O-N 3.09Å; E275-V277 VanDerWaalsContact C-N 3.32Å; E275-V277 PolarHBondContact O-N 3.16Å; V277-F279 PolarHBondContact O-N 2.92Å; V277-K280 PolarHBondContact O-N 2.78Å; V277-I281 HydrophobicContact CG1-CD1 3.8Å; V277-I281 HydrophobicContact CG1-CG1 4.43Å; V277-I281 WeakPolarHBondContact O-CG1 3.29Å; V277-I281 PolarHBondContact O-N 2.94Å; V277-T326 HydrophobicContact CG2-CG2 3.82Å; V277-V327 HydrophobicContact CG1-CG2 4.33Å; V277-V330 HydrophobicContact CG2-CB 4.39Å; V277-V330 HydrophobicContact CG2-CG2 3.83Å
278	S	93.6	Very high	90	Very high	62 Å²	62	57.6 Å²	57.6	43%	0.434	33%	0.331	S	S	.	.	H	α-helix	trans	-56.8	-49.3	177.2	-170.8	0	0	0	0	111.2	E275 K280 I281 T282	E275-S278 PolarHBondContact O-N 3.41Å; S278-K280 PolarHBondContact O-N 3.27Å; S278-I281 PolarHBondContact O-N 3.23Å; S278-T282 PolarHBondContact O-N 3.3Å; S278-T282 PolarHBondContact O-OG1 3.39Å; S278-T282 VanDerWaalsContact O-OG1 3.11Å
279	F	94.8	Very high	90.3	Very high	70 Å²	70	53.7 Å²	53.7	31%	0.307	32%	0.32	S	S	.	.	H	α-helix	trans	-55.8	-49	177	177.8	-94.2	0	0	0	112.7	M262 G266 E275 V277 I281 T282 L283	M262-F279 HydrophobicContact CB-CZ 4.47Å; M262-F279 WeakPolarHBondContact O-CE1 3.49Å; G266-F279 VanDerWaalsContact CA-CE1 3.47Å; E275-F279 WeakPolarHBondContact O-CB 3.45Å; E275-F279 PolarHBondContact O-N 3.31Å; V277-F279 PolarHBondContact O-N 2.92Å; F279-I281 PolarHBondContact O-N 3.14Å; F279-T282 PolarHBondContact O-N 3.09Å; F279-L283 WeakPolarHBondContact O-CB 3.43Å; F279-L283 PolarHBondContact O-N 2.94Å
280	K	94.4	Very high	90.4	Very high	5 Å²	5	52.6 Å²	52.6	2%	0.022	31%	0.313	C	S	.	.	H	α-helix	trans	-67.2	-34.2	-179.8	-73.8	-171.1	176.1	-73.1	0	112.9	D263 F267 R276 V277 S278 L283 L284 S322 L323 T326	D263-K280 VanDerWaalsContact CG-NZ 3.35Å; D263-K280 PolarHBondContact O-NZ 2.89Å; D263-K280 VanDerWaalsContact O-NZ 3.12Å; D263-K280 IonicContact OD1-NZ 3.08Å; D263-K280 PolarHBondContact OD1-NZ 3.4Å; D263-K280 IonicContact OD2-NZ 3.22Å; F267-K280 VanDerWaalsContact CE2-NZ 3.3Å; R276-K280 PolarHBondContact O-N 3.43Å; R276-K280 VanDerWaalsContact O-N 3.16Å; V277-K280 PolarHBondContact O-N 2.78Å; S278-K280 PolarHBondContact O-N 3.27Å; K280-L283 PolarHBondContact O-N 2.97Å; K280-L284 WeakPolarHBondContact O-CB 3.18Å; K280-L284 PolarHBondContact O-N 3.46Å; K280-S322 WeakPolarHBondContact CE-OG 3.28Å; K280-S322 PolarHBondContact NZ-OG 2.84Å; K280-L323 HydrophobicContact CB-CD1 3.79Å; K280-T326 HydrophobicContact CD-CG2 4.38Å; K280-T326 VanDerWaalsContact CD-OG1 3.25Å; K280-T326 WeakPolarHBondContact CD-OG1 3.32Å; K280-T326 VanDerWaalsContact CE-OG1 3.28Å; K280-T326 WeakPolarHBondContact CE-OG1 3.42Å
281	I	95.2	Very high	90.7	Very high	91 Å²	91	51.8 Å²	51.8	47%	0.467	30%	0.304	S	S	.	.	H	α-helix	trans	-65	-46.5	173	-69.1	170.1	0	0	0	110.6	V277 S278 F279 L283 L284 L285 L323	V277-I281 HydrophobicContact CG1-CD1 3.8Å; V277-I281 HydrophobicContact CG1-CG1 4.43Å; V277-I281 WeakPolarHBondContact O-CG1 3.29Å; V277-I281 PolarHBondContact O-N 2.94Å; S278-I281 PolarHBondContact O-N 3.23Å; F279-I281 PolarHBondContact O-N 3.14Å; I281-L283 VanDerWaalsContact C-N 3.28Å; I281-L283 PolarHBondContact O-N 2.99Å; I281-L284 PolarHBondContact O-N 3.11Å; I281-L285 PolarHBondContact O-N 3.45Å; I281-L323 HydrophobicContact CG1-CD1 3.85Å; I281-L323 HydrophobicContact CG1-CD2 4.15Å
282	T	95.8	Very high	91.2	Very high	89 Å²	89	55.8 Å²	55.8	55%	0.546	32%	0.323	S	S	.	.	H	α-helix	trans	-60.6	-40.1	176.9	-55.5	0	0	0	0	111.5	S278 F279 L285 G286	S278-T282 PolarHBondContact O-N 3.3Å; S278-T282 PolarHBondContact O-OG1 3.39Å; S278-T282 VanDerWaalsContact O-OG1 3.11Å; F279-T282 PolarHBondContact O-N 3.09Å; T282-L285 PolarHBondContact O-N 3.05Å; T282-G286 PolarHBondContact O-N 3.23Å
283	L	95.6	Very high	91.7	Very high	17 Å²	17	56.1 Å²	56.1	9%	0.089	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-44.8	176.6	-171.7	69.1	0	0	0	112.2	L259 M262 D263 F279 K280 I281 L285 G286 Y287 L319	L259-L283 HydrophobicContact CB-CD1 4.36Å; L259-L283 HydrophobicContact CD2-CD1 3.64Å; M262-L283 HydrophobicContact CB-CD1 3.92Å; M262-L283 HydrophobicContact CB-CD2 4.49Å; D263-L283 VanDerWaalsContact CA-CD2 3.41Å; D263-L283 HydrophobicContact CB-CD2 3.47Å; D263-L283 VanDerWaalsContact CB-CD2 3.47Å; F279-L283 WeakPolarHBondContact O-CB 3.43Å; F279-L283 PolarHBondContact O-N 2.94Å; K280-L283 PolarHBondContact O-N 2.97Å; I281-L283 VanDerWaalsContact C-N 3.28Å; I281-L283 PolarHBondContact O-N 2.99Å; L283-L285 VanDerWaalsContact C-N 3.34Å; L283-L285 PolarHBondContact O-N 3.01Å; L283-G286 PolarHBondContact O-N 3.49Å; L283-Y287 PolarHBondContact O-N 3.13Å; L283-L319 HydrophobicContact CD2-CD2 4.1Å
284	L	95.7	Very high	92.3	Very high	32 Å²	32	52.8 Å²	52.8	17%	0.168	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-41.8	176.7	-173.4	69.7	0	0	0	111.9	K280 I281 Y287 S288 M316 L319 V320 L323	K280-L284 WeakPolarHBondContact O-CB 3.18Å; K280-L284 PolarHBondContact O-N 3.46Å; I281-L284 PolarHBondContact O-N 3.11Å; L284-Y287 PolarHBondContact O-N 2.97Å; L284-S288 WeakPolarHBondContact O-CB 3.31Å; L284-S288 PolarHBondContact O-N 2.85Å; L284-S288 PolarHBondContact O-OG 2.68Å; L284-M316 HydrophobicContact CD1-CE 3.44Å; L284-M316 VanDerWaalsContact CD1-CE 3.44Å; L284-M316 HydrophobicContact CD1-SD 3.58Å; L284-M316 VanDerWaalsContact CD1-SD 3.58Å; L284-M316 HydrophobicContact CG-CE 4Å; L284-L319 HydrophobicContact CD1-CB 3.87Å; L284-V320 HydrophobicContact CD1-CG2 3.87Å; L284-V320 HydrophobicContact CD2-CG2 4.37Å; L284-L323 HydrophobicContact CD2-CD2 3.88Å
285	L	96	Very high	92.7	Very high	113 Å²	113	55 Å²	55	59%	0.592	31%	0.31	S	S	*	.	H	α-helix	trans	-62	-47.6	174.2	-179.6	64.5	0	0	0	111.1	I281 T282 L283 Y287 S288 V289	I281-L285 PolarHBondContact O-N 3.45Å; T282-L285 PolarHBondContact O-N 3.05Å; L283-L285 VanDerWaalsContact C-N 3.34Å; L283-L285 PolarHBondContact O-N 3.01Å; L285-Y287 VanDerWaalsContact C-N 3.31Å; L285-Y287 PolarHBondContact O-N 2.79Å; L285-S288 WeakPolarHBondContact O-CB 3.32Å; L285-S288 PolarHBondContact O-N 3.27Å; L285-S288 VanDerWaalsContact O-N 3.14Å; L285-V289 WeakPolarHBondContact O-CG2 3.32Å; L285-V289 PolarHBondContact O-N 3.11Å
286	G	95.6	Very high	92.5	Very high	34 Å²	34	55.7 Å²	55.7	35%	0.351	32%	0.318	S	S	.	.	H	α-helix	trans	-58.7	-41.9	177	0	0	0	0	0	112.7	T282 L283 V289 F290	T282-G286 PolarHBondContact O-N 3.23Å; L283-G286 PolarHBondContact O-N 3.49Å; G286-V289 PolarHBondContact O-N 3.29Å; G286-F290 WeakPolarHBondContact O-CB 3.38Å; G286-F290 PolarHBondContact O-N 2.85Å
287	Y	95.3	Very high	92.1	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-64.7	-39.6	175	-165.9	-89.7	0	0	0	112.4	L259 L283 L284 L285 F290 L291 F312 C315 M316 L319	L259-Y287 HydrophobicContact CB-CD2 4.2Å; L259-Y287 HydrophobicContact CD1-CD2 3.66Å; L259-Y287 HydrophobicContact CD1-CE2 4.46Å; L259-Y287 HydrophobicContact CD1-CG 4.43Å; L283-Y287 PolarHBondContact O-N 3.13Å; L284-Y287 PolarHBondContact O-N 2.97Å; L285-Y287 VanDerWaalsContact C-N 3.31Å; L285-Y287 PolarHBondContact O-N 2.79Å; Y287-F290 WeakPolarHBondContact O-CB 3.41Å; Y287-F290 PolarHBondContact O-N 3.47Å; Y287-L291 WeakPolarHBondContact O-CB 3.19Å; Y287-L291 PolarHBondContact O-N 3.35Å; Y287-F312 WeakPolarHBondContact OH-CA 3.37Å; Y287-F312 WeakPolarHBondContact OH-CD1 3.4Å; Y287-F312 PolarHBondContact OH-O 2.94Å; Y287-C315 HydrophobicContact CE1-CB 4.41Å; Y287-C315 HydrophobicContact CE2-CB 4.27Å; Y287-C315 WeakPolarHBondContact OH-CB 3.5Å; Y287-M316 HydrophobicContact CD1-CB 4.26Å; Y287-M316 HydrophobicContact CD1-SD 3.59Å; Y287-M316 VanDerWaalsContact CD1-SD 3.59Å; Y287-M316 HydrophobicContact CE1-CB 3.91Å; Y287-M316 HydrophobicContact CE1-SD 4.21Å; Y287-L319 HydrophobicContact CD1-CD1 3.99Å; Y287-L319 HydrophobicContact CD2-CD1 3.69Å; Y287-L319 HydrophobicContact CE2-CD1 4.38Å; Y287-L319 HydrophobicContact CG-CD1 3.48Å; Y287-L319 VanDerWaalsContact CG-CD1 3.48Å
288	S	94.3	Very high	91.7	Very high	36 Å²	36	59.4 Å²	59.4	25%	0.252	34%	0.34	S	S	.	.	H	α-helix	trans	-64.7	-42.1	178	-56.8	0	0	0	0	111.6	L284 L285 L291 I292 M316	L284-S288 WeakPolarHBondContact O-CB 3.31Å; L284-S288 PolarHBondContact O-N 2.85Å; L284-S288 PolarHBondContact O-OG 2.68Å; L285-S288 WeakPolarHBondContact O-CB 3.32Å; L285-S288 PolarHBondContact O-N 3.27Å; L285-S288 VanDerWaalsContact O-N 3.14Å; S288-L291 PolarHBondContact O-N 3.44Å; S288-I292 WeakPolarHBondContact O-CG1 3.14Å; S288-I292 PolarHBondContact O-N 2.87Å; S288-I292 VanDerWaalsContact O-N 3.1Å; S288-M316 WeakPolarHBondContact OG-CE 3.21Å
289	V	94.1	Very high	90.9	Very high	73 Å²	73	57.9 Å²	57.9	44%	0.442	33%	0.328	S	S	.	.	H	α-helix	trans	-64.3	-44.5	174.8	173.3	0	0	0	0	111	L285 G286 L291 I292 I293	L285-V289 WeakPolarHBondContact O-CG2 3.32Å; L285-V289 PolarHBondContact O-N 3.11Å; G286-V289 PolarHBondContact O-N 3.29Å; V289-L291 VanDerWaalsContact C-N 3.31Å; V289-L291 PolarHBondContact O-N 2.99Å; V289-I292 PolarHBondContact O-N 2.99Å; V289-I293 HydrophobicContact CG1-CD1 4.11Å; V289-I293 WeakPolarHBondContact O-CG1 3.49Å; V289-I293 PolarHBondContact O-N 2.83Å; V289-I293 VanDerWaalsContact O-N 3.11Å
290	F	92.6	Very high	89.8	Confident	30 Å²	30	58.6 Å²	58.6	13%	0.132	35%	0.347	C	S	.	.	H	α-helix	trans	-56.2	-46	174.4	170.5	-103	0	0	0	111.5	L252 P255 G286 Y287 I292 I293 V294 F312	L252-F290 WeakPolarHBondContact O-CZ 3.4Å; P255-F290 HydrophobicContact CB-CD2 4.27Å; P255-F290 HydrophobicContact CB-CE2 3.77Å; P255-F290 HydrophobicContact CB-CZ 4.18Å; P255-F290 HydrophobicContact CG-CE2 4.11Å; G286-F290 WeakPolarHBondContact O-CB 3.38Å; G286-F290 PolarHBondContact O-N 2.85Å; Y287-F290 WeakPolarHBondContact O-CB 3.41Å; Y287-F290 PolarHBondContact O-N 3.47Å; F290-I292 VanDerWaalsContact C-N 3.33Å; F290-I292 PolarHBondContact O-N 3.5Å; F290-I293 PolarHBondContact O-N 2.85Å; F290-V294 HydrophobicContact CD1-CG2 4.34Å; F290-V294 HydrophobicContact CD2-CG2 4.16Å; F290-V294 HydrophobicContact CE1-CG2 3.89Å; F290-V294 HydrophobicContact CE2-CG2 3.68Å; F290-V294 HydrophobicContact CG-CG2 4.47Å; F290-V294 HydrophobicContact CZ-CG2 3.54Å; F290-V294 WeakPolarHBondContact O-CG2 3.41Å; F290-V294 PolarHBondContact O-N 2.78Å; F290-F312 HydrophobicContact CE1-CD1 4.45Å; F290-F312 HydrophobicContact CE1-CE1 4.05Å; F290-F312 HydrophobicContact CE1-CZ 4.38Å
291	L	91	Very high	88.9	Confident	51 Å²	51	59.5 Å²	59.5	27%	0.267	35%	0.353	S	S	.	.	H	α-helix	trans	-62.9	-37.4	179.7	-170.4	62.4	0	0	0	112.8	Y287 S288 V289 V294 S295 F312	Y287-L291 WeakPolarHBondContact O-CB 3.19Å; Y287-L291 PolarHBondContact O-N 3.35Å; S288-L291 PolarHBondContact O-N 3.44Å; V289-L291 VanDerWaalsContact C-N 3.31Å; V289-L291 PolarHBondContact O-N 2.99Å; L291-V294 PolarHBondContact O-N 3.47Å; L291-S295 WeakPolarHBondContact O-CB 3.36Å; L291-S295 PolarHBondContact O-N 2.84Å; L291-F312 HydrophobicContact CD1-CB 3.59Å; L291-F312 HydrophobicContact CD1-CD2 4.08Å; L291-F312 HydrophobicContact CD1-CG 4.05Å
292	I	91	Very high	87.5	Confident	108 Å²	108	60.6 Å²	60.6	55%	0.554	38%	0.375	S	S	*	.	H	α-helix	trans	-62.2	-48.8	175	-68.7	165.4	0	0	0	110.3	S288 V289 F290 V294 S295 D296	S288-I292 WeakPolarHBondContact O-CG1 3.14Å; S288-I292 PolarHBondContact O-N 2.87Å; S288-I292 VanDerWaalsContact O-N 3.1Å; V289-I292 PolarHBondContact O-N 2.99Å; F290-I292 VanDerWaalsContact C-N 3.33Å; F290-I292 PolarHBondContact O-N 3.5Å; I292-V294 VanDerWaalsContact C-N 3.28Å; I292-V294 PolarHBondContact O-N 2.88Å; I292-S295 WeakPolarHBondContact O-CB 3.43Å; I292-S295 PolarHBondContact O-N 3.48Å; I292-S295 VanDerWaalsContact O-N 3.14Å; I292-D296 PolarHBondContact O-N 3.11Å
293	I	89.3	Confident	86.2	Confident	104 Å²	104	62.5 Å²	62.5	53%	0.533	38%	0.381	S	S	.	.	H	α-helix	trans	-58.9	-43	178.1	-65	166.5	0	0	0	110.5	V289 F290 D296 T297	V289-I293 HydrophobicContact CG1-CD1 4.11Å; V289-I293 WeakPolarHBondContact O-CG1 3.49Å; V289-I293 PolarHBondContact O-N 2.83Å; V289-I293 VanDerWaalsContact O-N 3.11Å; F290-I293 PolarHBondContact O-N 2.85Å; I293-D296 PolarHBondContact O-N 3Å; I293-T297 PolarHBondContact O-N 3.47Å
294	V	88.3	Confident	85	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.024	40%	0.395	C	S	.	.	H	α-helix	trans	-65.7	-39.9	178.2	171.8	0	0	0	0	111.6	L252 F290 L291 I292 D296 T297 L298 F312	L252-V294 HydrophobicContact CD2-CB 4.33Å; L252-V294 HydrophobicContact CD2-CG1 3.92Å; L252-V294 HydrophobicContact CD2-CG2 3.6Å; F290-V294 HydrophobicContact CD1-CG2 4.34Å; F290-V294 HydrophobicContact CD2-CG2 4.16Å; F290-V294 HydrophobicContact CE1-CG2 3.89Å; F290-V294 HydrophobicContact CE2-CG2 3.68Å; F290-V294 HydrophobicContact CG-CG2 4.47Å; F290-V294 HydrophobicContact CZ-CG2 3.54Å; F290-V294 WeakPolarHBondContact O-CG2 3.41Å; F290-V294 PolarHBondContact O-N 2.78Å; L291-V294 PolarHBondContact O-N 3.47Å; I292-V294 VanDerWaalsContact C-N 3.28Å; I292-V294 PolarHBondContact O-N 2.88Å; V294-D296 PolarHBondContact O-N 2.73Å; V294-T297 PolarHBondContact O-N 2.79Å; V294-T297 PolarHBondContact O-OG1 3.36Å; V294-L298 HydrophobicContact CG1-CD1 3.53Å; V294-L298 HydrophobicContact CG1-CG 3.9Å; V294-L298 WeakPolarHBondContact O-CG 3.45Å; V294-L298 PolarHBondContact O-N 2.87Å; V294-F312 HydrophobicContact CG1-CD2 4.24Å; V294-F312 HydrophobicContact CG1-CE2 3.7Å; V294-F312 HydrophobicContact CG1-CZ 4.46Å
295	S	84.9	Confident	84.3	Confident	81 Å²	81	66.8 Å²	66.8	57%	0.566	42%	0.417	S	S	*	.	H	α-helix	trans	-60.7	-30	177.7	-172.3	0	0	0	0	113.1	L291 I292 T297	L291-S295 WeakPolarHBondContact O-CB 3.36Å; L291-S295 PolarHBondContact O-N 2.84Å; I292-S295 WeakPolarHBondContact O-CB 3.43Å; I292-S295 PolarHBondContact O-N 3.48Å; I292-S295 VanDerWaalsContact O-N 3.14Å; S295-T297 VanDerWaalsContact C-N 3.32Å
296	D	82.9	Confident	84	Confident	138 Å²	138	62 Å²	62	74%	0.738	39%	0.393	S	S	*	.	H	α-helix	trans	-74.7	-26	175.6	-72.3	-19.9	0	0	0	112.2	I292 I293 V294	I292-D296 PolarHBondContact O-N 3.11Å; I293-D296 PolarHBondContact O-N 3Å; V294-D296 PolarHBondContact O-N 2.73Å
297	T	81.1	Confident	83.5	Confident	86 Å²	86	63.6 Å²	63.6	53%	0.528	39%	0.392	S	S	.	.	H	α-helix	trans	-91.1	-25.6	-179.5	63.1	0	0	0	0	114.1	I293 V294 S295	I293-T297 PolarHBondContact O-N 3.47Å; V294-T297 PolarHBondContact O-N 2.79Å; V294-T297 PolarHBondContact O-OG1 3.36Å; S295-T297 VanDerWaalsContact C-N 3.32Å
298	L	83.2	Confident	83.1	Confident	24 Å²	24	64.1 Å²	64.1	13%	0.126	40%	0.395	C	S	.	.	S	Bend	trans	-85.2	128.3	178.5	-69.1	177.4	0	0	0	109.8	F167 L252 V294 A300 I308	F167-L298 HydrophobicContact CD1-CD2 3.71Å; F167-L298 HydrophobicContact CE1-CD2 3.2Å; F167-L298 HydrophobicContact CE2-CD2 4.45Å; F167-L298 HydrophobicContact CZ-CD2 3.62Å; L252-L298 HydrophobicContact CD1-CD2 4.27Å; V294-L298 HydrophobicContact CG1-CD1 3.53Å; V294-L298 HydrophobicContact CG1-CG 3.9Å; V294-L298 WeakPolarHBondContact O-CG 3.45Å; V294-L298 PolarHBondContact O-N 2.87Å; L298-A300 PolarHBondContact O-N 3.39Å; L298-I308 HydrophobicContact CD1-CG2 4.25Å
299	P	76.8	Confident	82.8	Confident	30 Å²	30	63.3 Å²	63.3	20%	0.195	39%	0.393	C	S	.	.			trans	-66.2	122.9	178.3	26.1	-32.6	0	0	0	110.5	E78 T301	E78-P299 HydrophobicContact CB-CB 3.79Å; E78-P299 HydrophobicContact CB-CG 3.82Å; E78-P299 HydrophobicContact CG-CG 4.07Å; P299-T301 PolarHBondContact O-N 2.91Å
300	A	73.2	Confident	82.5	Confident	84 Å²	84	63.4 Å²	63.4	69%	0.694	39%	0.393	S	S	*	.			trans	-78.1	110.6	171.4	0	0	0	0	0	109.6	L298	L298-A300 PolarHBondContact O-N 3.39Å
301	T	74	Confident	82.3	Confident	25 Å²	25	62.9 Å²	62.9	15%	0.153	39%	0.391	C	S	.	.			trans	-109.5	148.7	174.3	76	0	0	0	0	110.9	E78 I164 P299 I303 G304	E78-T301 HydrophobicContact CB-CG2 4.21Å; E78-T301 WeakPolarHBondContact O-CG2 3.42Å; I164-T301 HydrophobicContact CD1-CG2 3.57Å; I164-T301 HydrophobicContact CG1-CG2 4.12Å; P299-T301 PolarHBondContact O-N 2.91Å; T301-I303 VanDerWaalsContact C-N 3.29Å; T301-I303 PolarHBondContact O-N 3.41Å; T301-G304 PolarHBondContact OG1-O 3.35Å
302	A	66.3	Low	82.3	Confident	113 Å²	113	60.5 Å²	60.5	93%	0.934	38%	0.378	S	S	*	.	S	Bend	trans	-74.7	-18.5	178.6	0	0	0	0	0	113.5
303	I	69.1	Low	82.3	Confident	130 Å²	130	60 Å²	60	67%	0.667	38%	0.379	S	S	*	.	S	Bend	trans	-79.6	-27.7	-171.4	-59.3	167.4	0	0	0	111.2	T301	T301-I303 VanDerWaalsContact C-N 3.29Å; T301-I303 PolarHBondContact O-N 3.41Å
304	G	70.3	Confident	82.5	Confident	37 Å²	37	57.6 Å²	57.6	38%	0.381	37%	0.37	S	S	.	.			trans	169.5	160.3	175.5	0	0	0	0	0	113.1	T301	T301-G304 PolarHBondContact OG1-O 3.35Å
305	T	81.9	Confident	82.7	Confident	101 Å²	101	57.4 Å²	57.4	62%	0.62	37%	0.369	S	S	*	.			trans	-83.5	141	172.2	49.6	0	0	0	0	110.2
306	P	87.8	Confident	83.1	Confident	14 Å²	14	55.8 Å²	55.8	9%	0.091	35%	0.353	C	S	.	.			trans	-66.5	152.5	177	29.4	-35.4	0	0	0	110.7	I164 F167 I308 G309	I164-P306 WeakPolarHBondContact O-CB 3.48Å; F167-P306 HydrophobicContact CB-CB 3.9Å; P306-I308 HydrophobicContact CB-CG2 4.14Å; P306-I308 HydrophobicContact CG-CG2 4.09Å; P306-I308 PolarHBondContact O-N 3.44Å; P306-I308 VanDerWaalsContact O-N 3.16Å; P306-G309 WeakPolarHBondContact O-CA 3.05Å; P306-G309 PolarHBondContact O-N 2.97Å
307	L	85.6	Confident	83.7	Confident	66 Å²	66	51.4 Å²	51.4	35%	0.346	34%	0.336	S	S	.	.	H	α-helix	trans	-56	-34.8	179.9	-172.1	70.4	0	0	0	112.2	Y165 G309 V310 Y311	Y165-L307 WeakPolarHBondContact O-CB 3Å; Y165-L307 PolarHBondContact O-N 3.34Å; L307-G309 PolarHBondContact O-N 2.89Å; L307-V310 WeakPolarHBondContact O-CB 3.32Å; L307-V310 PolarHBondContact O-N 3.14Å; L307-Y311 PolarHBondContact O-N 3.48Å
308	I	87.3	Confident	84.3	Confident	12 Å²	12	48.4 Å²	48.4	6%	0.062	32%	0.317	C	S	.	.	H	α-helix	trans	-62.9	-30.2	176	-160.3	166.2	0	0	0	112.8	F167 L252 L253 L298 P306 Y311 F312	F167-I308 HydrophobicContact CD1-CG2 3.94Å; L252-I308 HydrophobicContact CB-CD1 4.34Å; L252-I308 HydrophobicContact CD1-CD1 4.32Å; L253-I308 HydrophobicContact CD2-CD1 3.79Å; L253-I308 HydrophobicContact CD2-CG1 4.24Å; L253-I308 HydrophobicContact CG-CD1 4.3Å; L298-I308 HydrophobicContact CD1-CG2 4.25Å; P306-I308 HydrophobicContact CB-CG2 4.14Å; P306-I308 HydrophobicContact CG-CG2 4.09Å; P306-I308 PolarHBondContact O-N 3.44Å; P306-I308 VanDerWaalsContact O-N 3.16Å; I308-Y311 WeakPolarHBondContact O-CB 3.33Å; I308-Y311 PolarHBondContact O-N 3.43Å; I308-F312 HydrophobicContact CD1-CE2 4.2Å; I308-F312 HydrophobicContact CD1-CZ 3.99Å; I308-F312 HydrophobicContact CG1-CD2 4.42Å; I308-F312 HydrophobicContact CG1-CE2 3.74Å; I308-F312 HydrophobicContact CG1-CZ 3.79Å; I308-F312 VanDerWaalsContact O-CD2 3.27Å; I308-F312 WeakPolarHBondContact O-CD2 3.49Å; I308-F312 WeakPolarHBondContact O-CG 3.33Å; I308-F312 PolarHBondContact O-N 3.4Å
309	G	88.4	Confident	84.8	Confident	19 Å²	19	47.5 Å²	47.5	20%	0.196	31%	0.312	C	S	.	.	H	α-helix	trans	-67.3	-42.8	175.2	0	0	0	0	0	111.4	P306 L307 Y311 F312 V313	P306-G309 WeakPolarHBondContact O-CA 3.05Å; P306-G309 PolarHBondContact O-N 2.97Å; L307-G309 PolarHBondContact O-N 2.89Å; G309-Y311 PolarHBondContact O-N 3.1Å; G309-F312 PolarHBondContact O-N 3.36Å; G309-V313 WeakPolarHBondContact O-CG2 3.33Å; G309-V313 PolarHBondContact O-N 2.98Å; G309-V313 VanDerWaalsContact O-N 3.09Å
310	V	87.7	Confident	85.7	Confident	75 Å²	75	49 Å²	49	46%	0.455	32%	0.32	S	S	.	.	H	α-helix	trans	-59.9	-40.7	172.3	-177.1	0	0	0	0	110.2	L307 F312 V313 V314	L307-V310 WeakPolarHBondContact O-CB 3.32Å; L307-V310 PolarHBondContact O-N 3.14Å; V310-F312 PolarHBondContact O-N 3.26Å; V310-V313 PolarHBondContact O-N 2.93Å; V310-V314 HydrophobicContact CG1-CG2 4.42Å; V310-V314 WeakPolarHBondContact O-CG2 3.49Å; V310-V314 PolarHBondContact O-N 2.72Å
311	Y	88.6	Confident	86.7	Confident	19 Å²	19	49.8 Å²	49.8	8%	0.075	31%	0.312	C	S	.	.	H	α-helix	trans	-57.8	-46.6	176.3	166.3	-88.7	0	0	0	112.3	L253 S256 L307 I308 G309 V313 V314 C315 Y460 L464	L253-Y311 HydrophobicContact CD2-CD1 4.49Å; L253-Y311 HydrophobicContact CD2-CE1 4.22Å; S256-Y311 WeakPolarHBondContact OG-CE1 3.34Å; L307-Y311 PolarHBondContact O-N 3.48Å; I308-Y311 WeakPolarHBondContact O-CB 3.33Å; I308-Y311 PolarHBondContact O-N 3.43Å; G309-Y311 PolarHBondContact O-N 3.1Å; Y311-V313 PolarHBondContact O-N 3.11Å; Y311-V314 PolarHBondContact O-N 2.97Å; Y311-C315 VanDerWaalsContact CZ-SG 3.51Å; Y311-C315 WeakPolarHBondContact O-CB 3.46Å; Y311-C315 PolarHBondContact O-N 3.2Å; Y311-C315 PolarHBondContact O-SG 2.96Å; Y311-Y460 WeakPolarHBondContact CA-OH 3.43Å; Y311-Y460 AromaticContact CD2-CE1 3.57Å; Y311-Y460 HydrophobicContact CD2-CE1 3.57Å; Y311-Y460 HydrophobicContact CD2-CE2 4.38Å; Y311-Y460 AromaticContact CD2-CZ 3.34Å; Y311-Y460 WeakPolarHBondContact CD2-OH 3.3Å; Y311-Y460 HydrophobicContact CE2-CD1 4.33Å; Y311-Y460 AromaticContact CE2-CE1 3.31Å; Y311-Y460 HydrophobicContact CE2-CE1 3.31Å; Y311-Y460 AromaticContact CE2-CZ 3.65Å; Y311-Y460 WeakPolarHBondContact CE2-OH 3.39Å; Y311-Y460 PolarHBondContact O-OH 3.28Å; Y311-L464 HydrophobicContact CD2-CD1 3.81Å; Y311-L464 HydrophobicContact CD2-CD2 4.09Å; Y311-L464 HydrophobicContact CE2-CD1 4.22Å; Y311-L464 HydrophobicContact CE2-CD2 3.61Å; Y311-L464 HydrophobicContact CE2-CG 4.44Å
312	F	91.4	Very high	87.7	Confident	1 Å²	1	48.6 Å²	48.6	0%	0.004	30%	0.304	C	S	.	.	H	α-helix	trans	-67.1	-34.9	178.8	-64.3	-43.4	0	0	0	113.5	L252 Y287 F290 L291 V294 I308 G309 V310 C315 M316	L252-F312 HydrophobicContact CB-CZ 4.17Å; Y287-F312 WeakPolarHBondContact OH-CA 3.37Å; Y287-F312 WeakPolarHBondContact OH-CD1 3.4Å; Y287-F312 PolarHBondContact OH-O 2.94Å; F290-F312 HydrophobicContact CE1-CD1 4.45Å; F290-F312 HydrophobicContact CE1-CE1 4.05Å; F290-F312 HydrophobicContact CE1-CZ 4.38Å; L291-F312 HydrophobicContact CD1-CB 3.59Å; L291-F312 HydrophobicContact CD1-CD2 4.08Å; L291-F312 HydrophobicContact CD1-CG 4.05Å; V294-F312 HydrophobicContact CG1-CD2 4.24Å; V294-F312 HydrophobicContact CG1-CE2 3.7Å; V294-F312 HydrophobicContact CG1-CZ 4.46Å; I308-F312 HydrophobicContact CD1-CE2 4.2Å; I308-F312 HydrophobicContact CD1-CZ 3.99Å; I308-F312 HydrophobicContact CG1-CD2 4.42Å; I308-F312 HydrophobicContact CG1-CE2 3.74Å; I308-F312 HydrophobicContact CG1-CZ 3.79Å; I308-F312 VanDerWaalsContact O-CD2 3.27Å; I308-F312 WeakPolarHBondContact O-CD2 3.49Å; I308-F312 WeakPolarHBondContact O-CG 3.33Å; I308-F312 PolarHBondContact O-N 3.4Å; G309-F312 PolarHBondContact O-N 3.36Å; V310-F312 PolarHBondContact O-N 3.26Å; F312-C315 WeakPolarHBondContact O-CB 3.5Å; F312-C315 PolarHBondContact O-N 3.43Å; F312-M316 WeakPolarHBondContact O-CB 3.47Å; F312-M316 PolarHBondContact O-N 3.47Å
313	V	90.9	Very high	89	Confident	96 Å²	96	44.4 Å²	44.4	58%	0.582	27%	0.266	S	S	*	.	H	α-helix	trans	-67.8	-41.6	176.4	174.5	0	0	0	0	111.4	G309 V310 Y311 C315 M316 A317	G309-V313 WeakPolarHBondContact O-CG2 3.33Å; G309-V313 PolarHBondContact O-N 2.98Å; G309-V313 VanDerWaalsContact O-N 3.09Å; V310-V313 PolarHBondContact O-N 2.93Å; Y311-V313 PolarHBondContact O-N 3.11Å; V313-C315 VanDerWaalsContact C-N 3.33Å; V313-M316 WeakPolarHBondContact O-CB 3.44Å; V313-M316 PolarHBondContact O-N 2.89Å; V313-A317 PolarHBondContact O-N 3.28Å
314	V	92.1	Very high	90.1	Very high	55 Å²	55	41.8 Å²	41.8	33%	0.333	26%	0.256	S	S	.	.	H	α-helix	trans	-63.6	-42.3	175	172.2	0	0	0	0	110.7	V310 Y311 M316 A317 L318 Y460	V310-V314 HydrophobicContact CG1-CG2 4.42Å; V310-V314 WeakPolarHBondContact O-CG2 3.49Å; V310-V314 PolarHBondContact O-N 2.72Å; Y311-V314 PolarHBondContact O-N 2.97Å; V314-M316 PolarHBondContact O-N 3.1Å; V314-A317 WeakPolarHBondContact O-CB 3.32Å; V314-A317 PolarHBondContact O-N 2.89Å; V314-L318 HydrophobicContact CG1-CD1 4.45Å; V314-L318 WeakPolarHBondContact O-CG 3.3Å; V314-L318 PolarHBondContact O-N 2.86Å; V314-Y460 HydrophobicContact CB-CE2 4.22Å; V314-Y460 HydrophobicContact CG1-CD2 4.2Å; V314-Y460 HydrophobicContact CG1-CE1 4.45Å; V314-Y460 HydrophobicContact CG1-CE2 3.66Å
315	C	92.8	Very high	91.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-57.2	-47.6	173.1	-76.2	0	0	0	0	112	M260 Y287 Y311 F312 V313 A317 L318 L319	M260-C315 VanDerWaalsContact CE-C 3.48Å; M260-C315 HydrophobicContact CE-CB 3.21Å; M260-C315 WeakPolarHBondContact CE-O 3.31Å; M260-C315 VanDerWaalsContact CE-SG 3.59Å; Y287-C315 HydrophobicContact CE1-CB 4.41Å; Y287-C315 HydrophobicContact CE2-CB 4.27Å; Y287-C315 WeakPolarHBondContact OH-CB 3.5Å; Y311-C315 VanDerWaalsContact CZ-SG 3.51Å; Y311-C315 WeakPolarHBondContact O-CB 3.46Å; Y311-C315 PolarHBondContact O-N 3.2Å; Y311-C315 PolarHBondContact O-SG 2.96Å; F312-C315 WeakPolarHBondContact O-CB 3.5Å; F312-C315 PolarHBondContact O-N 3.43Å; V313-C315 VanDerWaalsContact C-N 3.33Å; C315-A317 VanDerWaalsContact C-N 3.31Å; C315-A317 PolarHBondContact O-N 2.87Å; C315-L318 PolarHBondContact O-N 3.22Å; C315-L319 WeakPolarHBondContact O-CG 3.28Å; C315-L319 PolarHBondContact O-N 3.35Å; C315-L319 VanDerWaalsContact O-N 3.09Å
316	M	93.9	Very high	91.6	Very high	46 Å²	46	36 Å²	36	23%	0.227	21%	0.212	C	C	.	.	H	α-helix	trans	-58	-44.1	175.2	-173.6	62.9	177	0	0	111.8	L284 Y287 S288 F312 V313 V314 L318 L319 V320	L284-M316 HydrophobicContact CD1-CE 3.44Å; L284-M316 VanDerWaalsContact CD1-CE 3.44Å; L284-M316 HydrophobicContact CD1-SD 3.58Å; L284-M316 VanDerWaalsContact CD1-SD 3.58Å; L284-M316 HydrophobicContact CG-CE 4Å; Y287-M316 HydrophobicContact CD1-CB 4.26Å; Y287-M316 HydrophobicContact CD1-SD 3.59Å; Y287-M316 VanDerWaalsContact CD1-SD 3.59Å; Y287-M316 HydrophobicContact CE1-CB 3.91Å; Y287-M316 HydrophobicContact CE1-SD 4.21Å; S288-M316 WeakPolarHBondContact OG-CE 3.21Å; F312-M316 WeakPolarHBondContact O-CB 3.47Å; F312-M316 PolarHBondContact O-N 3.47Å; V313-M316 WeakPolarHBondContact O-CB 3.44Å; V313-M316 PolarHBondContact O-N 2.89Å; V314-M316 PolarHBondContact O-N 3.1Å; M316-L318 PolarHBondContact O-N 3.48Å; M316-L319 PolarHBondContact O-N 2.75Å; M316-V320 HydrophobicContact CE-CG2 4.5Å; M316-V320 WeakPolarHBondContact O-CG2 3.25Å; M316-V320 PolarHBondContact O-N 3.05Å
317	A	94.6	Very high	91.7	Very high	47 Å²	47	38.7 Å²	38.7	39%	0.388	23%	0.228	S	C	.	.	H	α-helix	trans	-61.6	-41.7	177.9	0	0	0	0	0	112.2	V313 V314 C315 L319 V320 I321	V313-A317 PolarHBondContact O-N 3.28Å; V314-A317 WeakPolarHBondContact O-CB 3.32Å; V314-A317 PolarHBondContact O-N 2.89Å; C315-A317 VanDerWaalsContact C-N 3.31Å; C315-A317 PolarHBondContact O-N 2.87Å; A317-L319 PolarHBondContact O-N 2.87Å; A317-V320 PolarHBondContact O-N 3.34Å; A317-I321 VanDerWaalsContact O-CG1 3.27Å; A317-I321 WeakPolarHBondContact O-CG1 3.29Å; A317-I321 PolarHBondContact O-N 2.86Å
318	L	93.5	Very high	91.9	Very high	23 Å²	23	40.6 Å²	40.6	12%	0.12	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-42.3	175.7	-70.7	175.5	0	0	0	112.1	M260 V314 C315 M316 V320 I321 S322 Y453 V457 Y460	M260-L318 HydrophobicContact CE-CB 4.39Å; V314-L318 HydrophobicContact CG1-CD1 4.45Å; V314-L318 WeakPolarHBondContact O-CG 3.3Å; V314-L318 PolarHBondContact O-N 2.86Å; C315-L318 PolarHBondContact O-N 3.22Å; M316-L318 PolarHBondContact O-N 3.48Å; L318-V320 PolarHBondContact O-N 2.87Å; L318-I321 PolarHBondContact O-N 2.83Å; L318-S322 WeakPolarHBondContact O-CB 3.5Å; L318-S322 PolarHBondContact O-N 3.04Å; L318-Y453 HydrophobicContact CB-CE2 4.13Å; L318-Y453 HydrophobicContact CD2-CE2 4.4Å; L318-V457 HydrophobicContact CD1-CG2 4.44Å; L318-Y460 HydrophobicContact CD1-CD1 4.49Å
319	L	95.3	Very high	91.9	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-41.6	175.3	-66.3	176.7	0	0	0	112	M260 D263 L283 L284 Y287 C315 M316 A317 S322 L323	M260-L319 HydrophobicContact CE-CD2 4.36Å; M260-L319 HydrophobicContact CE-CG 4.06Å; M260-L319 HydrophobicContact SD-CD2 4.24Å; D263-L319 HydrophobicContact CB-CD2 3.56Å; L283-L319 HydrophobicContact CD2-CD2 4.1Å; L284-L319 HydrophobicContact CD1-CB 3.87Å; Y287-L319 HydrophobicContact CD1-CD1 3.99Å; Y287-L319 HydrophobicContact CD2-CD1 3.69Å; Y287-L319 HydrophobicContact CE2-CD1 4.38Å; Y287-L319 HydrophobicContact CG-CD1 3.48Å; Y287-L319 VanDerWaalsContact CG-CD1 3.48Å; C315-L319 WeakPolarHBondContact O-CG 3.28Å; C315-L319 PolarHBondContact O-N 3.35Å; C315-L319 VanDerWaalsContact O-N 3.09Å; M316-L319 PolarHBondContact O-N 2.75Å; A317-L319 PolarHBondContact O-N 2.87Å; L319-S322 WeakPolarHBondContact O-CB 3.44Å; L319-S322 PolarHBondContact O-N 2.87Å; L319-L323 PolarHBondContact O-N 2.97Å
320	V	96.1	Very high	91.8	Very high	61 Å²	61	40.6 Å²	40.6	37%	0.37	24%	0.235	S	C	.	.	H	α-helix	trans	-65.8	-41	176.9	172.7	0	0	0	0	111.5	L284 M316 A317 L318 S322 L323 T324	L284-V320 HydrophobicContact CD1-CG2 3.87Å; L284-V320 HydrophobicContact CD2-CG2 4.37Å; M316-V320 HydrophobicContact CE-CG2 4.5Å; M316-V320 WeakPolarHBondContact O-CG2 3.25Å; M316-V320 PolarHBondContact O-N 3.05Å; A317-V320 PolarHBondContact O-N 3.34Å; L318-V320 PolarHBondContact O-N 2.87Å; V320-S322 VanDerWaalsContact C-N 3.34Å; V320-L323 PolarHBondContact O-N 3.08Å; V320-T324 WeakPolarHBondContact O-CB 3.3Å; V320-T324 PolarHBondContact O-N 2.91Å; V320-T324 PolarHBondContact O-OG1 2.77Å
321	I	94.1	Very high	91.7	Very high	100 Å²	100	44.9 Å²	44.9	51%	0.513	24%	0.243	S	C	.	.	H	α-helix	trans	-61.5	-45.7	175.2	-70.1	165.2	0	0	0	109.7	A317 L318 L323 T324 E325	A317-I321 VanDerWaalsContact O-CG1 3.27Å; A317-I321 WeakPolarHBondContact O-CG1 3.29Å; A317-I321 PolarHBondContact O-N 2.86Å; L318-I321 PolarHBondContact O-N 2.83Å; I321-L323 PolarHBondContact O-N 3.47Å; I321-T324 PolarHBondContact O-N 2.99Å; I321-E325 PolarHBondContact O-N 3.42Å
322	S	93.8	Very high	91.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.2	-40.8	178.4	-174.5	0	0	0	0	113.7	D263 F267 K280 L318 L319 V320 T326	D263-S322 PolarHBondContact OD2-OG 3.16Å; F267-S322 WeakPolarHBondContact CE2-OG 3.49Å; F267-S322 WeakPolarHBondContact CZ-OG 3.41Å; K280-S322 WeakPolarHBondContact CE-OG 3.28Å; K280-S322 PolarHBondContact NZ-OG 2.84Å; L318-S322 WeakPolarHBondContact O-CB 3.5Å; L318-S322 PolarHBondContact O-N 3.04Å; L319-S322 WeakPolarHBondContact O-CB 3.44Å; L319-S322 PolarHBondContact O-N 2.87Å; V320-S322 VanDerWaalsContact C-N 3.34Å; S322-T326 PolarHBondContact O-N 2.86Å; S322-T326 VanDerWaalsContact O-N 3.12Å; S322-T326 PolarHBondContact O-OG1 2.88Å
323	L	94.1	Very high	90.8	Very high	26 Å²	26	46.2 Å²	46.2	14%	0.136	25%	0.252	C	S	.	.	H	α-helix	trans	-64.7	-45.4	173.6	176.1	62.5	0	0	0	110.9	K280 I281 L284 L319 V320 I321 E325 T326 V327	K280-L323 HydrophobicContact CB-CD1 3.79Å; I281-L323 HydrophobicContact CG1-CD1 3.85Å; I281-L323 HydrophobicContact CG1-CD2 4.15Å; L284-L323 HydrophobicContact CD2-CD2 3.88Å; L319-L323 PolarHBondContact O-N 2.97Å; V320-L323 PolarHBondContact O-N 3.08Å; I321-L323 PolarHBondContact O-N 3.47Å; L323-E325 PolarHBondContact O-N 3.19Å; L323-T326 PolarHBondContact O-N 2.82Å; L323-T326 VanDerWaalsContact O-N 3.13Å; L323-V327 HydrophobicContact CD1-CG2 4.32Å; L323-V327 WeakPolarHBondContact O-CG2 3.3Å; L323-V327 PolarHBondContact O-N 2.03Å
324	T	92.6	Very high	90.1	Very high	74 Å²	74	48.9 Å²	48.9	45%	0.454	26%	0.257	S	S	.	.	H	α-helix	trans	-61.2	-44.9	-179.7	-57.3	0	0	0	0	111.2	V320 I321 T326 V327 L328	V320-T324 WeakPolarHBondContact O-CB 3.3Å; V320-T324 PolarHBondContact O-N 2.91Å; V320-T324 PolarHBondContact O-OG1 2.77Å; I321-T324 PolarHBondContact O-N 2.99Å; T324-T326 VanDerWaalsContact C-N 3.34Å; T324-T326 PolarHBondContact O-N 2.76Å; T324-V327 PolarHBondContact O-N 3.22Å; T324-L328 HydrophobicContact CG2-CD1 4.31Å; T324-L328 VanDerWaalsContact O-CG 3.32Å; T324-L328 WeakPolarHBondContact O-CG 3.36Å; T324-L328 PolarHBondContact O-N 2.71Å
325	E	91.3	Very high	89	Confident	15 Å²	15	51.6 Å²	51.6	7%	0.07	27%	0.265	C	S	.	.	H	α-helix	trans	-53.2	-51.5	171.3	169.9	-171.7	171.2	0	0	111.3	F267 I321 L323 V327 L328 I329 L449	F267-E325 WeakPolarHBondContact CE1-OE1 3.42Å; F267-E325 VanDerWaalsContact CE1-OE2 3.31Å; F267-E325 WeakPolarHBondContact CE1-OE2 3.37Å; F267-E325 WeakPolarHBondContact CZ-OE2 3.25Å; I321-E325 PolarHBondContact O-N 3.42Å; L323-E325 PolarHBondContact O-N 3.19Å; E325-V327 VanDerWaalsContact C-N 3.3Å; E325-V327 PolarHBondContact O-N 2.93Å; E325-L328 WeakPolarHBondContact O-CB 3.33Å; E325-L328 PolarHBondContact O-N 2.83Å; E325-L328 VanDerWaalsContact O-N 3.08Å; E325-I329 HydrophobicContact CG-CG1 4.35Å; E325-I329 WeakPolarHBondContact O-CG1 3.39Å; E325-I329 PolarHBondContact O-N 3.03Å; E325-L449 HydrophobicContact CG-CB 4.01Å; E325-L449 HydrophobicContact CG-CD1 3.72Å; E325-L449 HydrophobicContact CG-CG 4.48Å; E325-L449 WeakPolarHBondContact OE1-CB 3.21Å
326	T	91.1	Very high	87.6	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-41.6	-176.5	-61.8	0	0	0	0	110.7	R276 V277 K280 S322 L323 T324 L328 I329 V330	R276-T326 HydrophobicContact CB-CG2 4.26Å; R276-T326 HydrophobicContact CG-CG2 3.66Å; R276-T326 PolarHBondContact NE-OG1 3.36Å; V277-T326 HydrophobicContact CG2-CG2 3.82Å; K280-T326 HydrophobicContact CD-CG2 4.38Å; K280-T326 VanDerWaalsContact CD-OG1 3.25Å; K280-T326 WeakPolarHBondContact CD-OG1 3.32Å; K280-T326 VanDerWaalsContact CE-OG1 3.28Å; K280-T326 WeakPolarHBondContact CE-OG1 3.42Å; S322-T326 PolarHBondContact O-N 2.86Å; S322-T326 VanDerWaalsContact O-N 3.12Å; S322-T326 PolarHBondContact O-OG1 2.88Å; L323-T326 PolarHBondContact O-N 2.82Å; L323-T326 VanDerWaalsContact O-N 3.13Å; T324-T326 VanDerWaalsContact C-N 3.34Å; T324-T326 PolarHBondContact O-N 2.76Å; T326-L328 VanDerWaalsContact C-N 3.34Å; T326-L328 PolarHBondContact O-N 3.46Å; T326-I329 PolarHBondContact O-N 2.91Å; T326-V330 HydrophobicContact CG2-CG2 4.37Å; T326-V330 WeakPolarHBondContact O-CB 3.38Å; T326-V330 VanDerWaalsContact O-CG2 3.26Å; T326-V330 WeakPolarHBondContact O-CG2 3.5Å; T326-V330 PolarHBondContact O-N 2.81Å
327	V	90.9	Very high	85.9	Confident	71 Å²	71	56.5 Å²	56.5	43%	0.43	29%	0.291	S	S	.	.	H	α-helix	trans	-62.9	-40	175.1	172.6	0	0	0	0	111.7	V277 L323 T324 E325 R331	V277-V327 HydrophobicContact CG1-CG2 4.33Å; L323-V327 HydrophobicContact CD1-CG2 4.32Å; L323-V327 WeakPolarHBondContact O-CG2 3.3Å; L323-V327 PolarHBondContact O-N 2.03Å; T324-V327 PolarHBondContact O-N 3.22Å; E325-V327 VanDerWaalsContact C-N 3.3Å; E325-V327 PolarHBondContact O-N 2.93Å; V327-R331 VanDerWaalsContact O-CB 3.25Å; V327-R331 WeakPolarHBondContact O-CB 3.34Å; V327-R331 PolarHBondContact O-N 2.66Å
328	L	88.6	Confident	84.3	Confident	106 Å²	106	61.5 Å²	61.5	56%	0.555	31%	0.311	S	S	*	.	H	α-helix	trans	-64.2	-45.8	175.9	-71.5	171.5	0	0	0	111.8	T324 E325 T326 R331 L332	T324-L328 HydrophobicContact CG2-CD1 4.31Å; T324-L328 VanDerWaalsContact O-CG 3.32Å; T324-L328 WeakPolarHBondContact O-CG 3.36Å; T324-L328 PolarHBondContact O-N 2.71Å; E325-L328 WeakPolarHBondContact O-CB 3.33Å; E325-L328 PolarHBondContact O-N 2.83Å; E325-L328 VanDerWaalsContact O-N 3.08Å; T326-L328 VanDerWaalsContact C-N 3.34Å; T326-L328 PolarHBondContact O-N 3.46Å; L328-R331 PolarHBondContact O-N 2.86Å; L328-L332 WeakPolarHBondContact O-CB 3.07Å; L328-L332 PolarHBondContact O-N 2.9Å
329	I	87.8	Confident	83.1	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-62.5	-49.6	177.3	-65.4	-62.7	0	0	0	110.6	P271 E325 T326 R331 L332 V333 L445 D446 L449	P271-I329 HydrophobicContact CB-CG2 3.85Å; P271-I329 HydrophobicContact CG-CG2 4.24Å; E325-I329 HydrophobicContact CG-CG1 4.35Å; E325-I329 WeakPolarHBondContact O-CG1 3.39Å; E325-I329 PolarHBondContact O-N 3.03Å; T326-I329 PolarHBondContact O-N 2.91Å; I329-R331 VanDerWaalsContact C-N 3.31Å; I329-R331 PolarHBondContact O-N 3.42Å; I329-L332 PolarHBondContact O-N 2.95Å; I329-L332 VanDerWaalsContact O-N 3.11Å; I329-V333 HydrophobicContact CG2-CG2 4.21Å; I329-V333 WeakPolarHBondContact O-CB 3.29Å; I329-V333 VanDerWaalsContact O-CG2 3.3Å; I329-V333 WeakPolarHBondContact O-CG2 3.45Å; I329-V333 PolarHBondContact O-N 3Å; I329-L445 HydrophobicContact CD1-CB 4.03Å; I329-L445 HydrophobicContact CD1-CD2 3.78Å; I329-L445 HydrophobicContact CD1-CG 3.81Å; I329-D446 HydrophobicContact CD1-CB 4.23Å; I329-D446 HydrophobicContact CG1-CB 4.39Å; I329-D446 HydrophobicContact CG2-CB 4.32Å; I329-L449 HydrophobicContact CD1-CD1 4.39Å
330	V	87.1	Confident	81.9	Confident	29 Å²	29	67.1 Å²	67.1	18%	0.176	34%	0.344	C	S	.	.	H	α-helix	trans	-59.9	-42.9	178.5	171	0	0	0	0	110.9	P271 V277 T326 L332 V333 H334	P271-V330 HydrophobicContact CB-CG2 4.34Å; V277-V330 HydrophobicContact CG2-CB 4.39Å; V277-V330 HydrophobicContact CG2-CG2 3.83Å; T326-V330 HydrophobicContact CG2-CG2 4.37Å; T326-V330 WeakPolarHBondContact O-CB 3.38Å; T326-V330 VanDerWaalsContact O-CG2 3.26Å; T326-V330 WeakPolarHBondContact O-CG2 3.5Å; T326-V330 PolarHBondContact O-N 2.81Å; V330-L332 VanDerWaalsContact C-N 3.32Å; V330-L332 PolarHBondContact O-N 2.76Å; V330-V333 PolarHBondContact O-N 3.48Å; V330-H334 VanDerWaalsContact O-CB 3.27Å; V330-H334 WeakPolarHBondContact O-CB 3.26Å; V330-H334 PolarHBondContact O-N 3.28Å
331	R	85.4	Confident	80.8	Confident	165 Å²	165	68.4 Å²	68.4	62%	0.623	35%	0.354	S	S	*	.	H	α-helix	trans	-62.9	-39.1	176.4	-176.4	178.6	176.9	178.5	-0	112.2	V327 L328 I329 K335	V327-R331 VanDerWaalsContact O-CB 3.25Å; V327-R331 WeakPolarHBondContact O-CB 3.34Å; V327-R331 PolarHBondContact O-N 2.66Å; L328-R331 PolarHBondContact O-N 2.86Å; I329-R331 VanDerWaalsContact C-N 3.31Å; I329-R331 PolarHBondContact O-N 3.42Å; R331-K335 WeakPolarHBondContact O-CB 3.13Å; R331-K335 PolarHBondContact O-N 3.21Å
332	L	81.7	Confident	80	Confident	36 Å²	36	64.2 Å²	64.2	19%	0.188	33%	0.333	C	S	.	.	H	α-helix	trans	-69.3	-39	179.1	-170.7	144.2	0	0	0	111.3	L328 I329 V330 W438 L445	L328-L332 WeakPolarHBondContact O-CB 3.07Å; L328-L332 PolarHBondContact O-N 2.9Å; I329-L332 PolarHBondContact O-N 2.95Å; I329-L332 VanDerWaalsContact O-N 3.11Å; V330-L332 VanDerWaalsContact C-N 3.32Å; V330-L332 PolarHBondContact O-N 2.76Å; L332-W438 HydrophobicContact CD1-CE3 4.46Å; L332-W438 HydrophobicContact CD1-CZ3 4.13Å; L332-W438 HydrophobicContact CD2-CE3 3.95Å; L332-W438 HydrophobicContact CD2-CZ3 4.42Å; L332-W438 HydrophobicContact CG-CE3 4.13Å; L332-W438 HydrophobicContact CG-CZ3 4.24Å; L332-L445 HydrophobicContact CD1-CD2 4.49Å
333	V	78.7	Confident	79.5	Confident	13 Å²	13	66.4 Å²	66.4	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-75.4	-39.4	178.7	172.9	0	0	0	0	112.3	D272 I329 V330 Q336	D272-V333 VanDerWaalsContact OD1-CG1 3.24Å; D272-V333 WeakPolarHBondContact OD1-CG1 3.42Å; I329-V333 HydrophobicContact CG2-CG2 4.21Å; I329-V333 WeakPolarHBondContact O-CB 3.29Å; I329-V333 VanDerWaalsContact O-CG2 3.3Å; I329-V333 WeakPolarHBondContact O-CG2 3.45Å; I329-V333 PolarHBondContact O-N 3Å; V330-V333 PolarHBondContact O-N 3.48Å; V333-Q336 WeakPolarHBondContact O-CG 3.48Å; V333-Q336 PolarHBondContact O-NE2 3.34Å
334	H	76.1	Confident	78.8	Confident	151 Å²	151	73.2 Å²	73.2	70%	0.699	38%	0.378	S	S	*	.	H	α-helix	trans	-83.1	-18.5	-175.8	-141.7	77.3	0	0	0	113.7	V330	V330-H334 VanDerWaalsContact O-CB 3.27Å; V330-H334 WeakPolarHBondContact O-CB 3.26Å; V330-H334 PolarHBondContact O-N 3.28Å
335	K	69.5	Low	78.3	Confident	112 Å²	112	78.6 Å²	78.6	49%	0.487	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	16.5	176.6	-70.9	-145.1	175	-162.8	0	114.6	R331 D337 L338 Q339	R331-K335 WeakPolarHBondContact O-CB 3.13Å; R331-K335 PolarHBondContact O-N 3.21Å; K335-D337 PolarHBondContact O-N 3.34Å; K335-L338 PolarHBondContact O-N 3.24Å; K335-Q339 WeakPolarHBondContact O-CG 3.44Å
336	Q	64.1	Low	77.8	Confident	26 Å²	26	78.4 Å²	78.4	12%	0.121	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-53.2	-37.7	-178.4	-78.7	167.8	13.4	0	0	114	V333 L338 Q339 A435 W438 L439	V333-Q336 WeakPolarHBondContact O-CG 3.48Å; V333-Q336 PolarHBondContact O-NE2 3.34Å; Q336-L338 VanDerWaalsContact C-N 3.3Å; Q336-L338 PolarHBondContact O-N 3.14Å; Q336-Q339 PolarHBondContact O-N 2.96Å; Q336-A435 HydrophobicContact CB-CB 3.8Å; Q336-A435 HydrophobicContact CG-CB 4.44Å; Q336-A435 PolarHBondContact OE1-O 2.99Å; Q336-W438 HydrophobicContact CG-CB 3.84Å; Q336-L439 VanDerWaalsContact NE2-CB 3.32Å
337	D	57.6	Low	77.2	Confident	123 Å²	123	81.8 Å²	81.8	66%	0.658	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-74.4	-15.7	-173.8	-63.9	-34.7	0	0	0	114.5	K335	K335-D337 PolarHBondContact O-N 3.34Å
338	L	61.3	Low	76.7	Confident	153 Å²	153	84.7 Å²	84.7	80%	0.801	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-108.7	-0.2	-179.4	-90.8	85	0	0	0	113.6	K335 Q336	K335-L338 PolarHBondContact O-N 3.24Å; Q336-L338 VanDerWaalsContact C-N 3.3Å; Q336-L338 PolarHBondContact O-N 3.14Å
339	Q	67.3	Low	76.2	Confident	52 Å²	52	84.7 Å²	84.7	24%	0.243	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-89.9	141.2	-172.8	-78.2	174.9	-7.4	0	0	112.5	K335 Q336 W438	K335-Q339 WeakPolarHBondContact O-CG 3.44Å; Q336-Q339 PolarHBondContact O-N 2.96Å; Q339-W438 HydrophobicContact CB-CZ2 4.42Å; Q339-W438 VanDerWaalsContact OE1-CE2 3.23Å
340	P	71.9	Confident	75.8	Confident	93 Å²	93	85.9 Å²	85.9	60%	0.604	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-62	164.2	168	27.6	-33	0	0	0	110.6	W438	P340-W438 PolarHBondContact O-NE1 2.95Å
341	P	72.4	Confident	75.1	Confident	88 Å²	88	86 Å²	86	57%	0.571	41%	0.414	S	S	*	.	S	Bend	trans	-53.1	145.4	175.6	23	-34.4	0	0	0	111.2	P343	P341-P343 WeakPolarHBondContact O-CD 3.29Å
342	V	77.8	Confident	74.5	Confident	12 Å²	12	83.6 Å²	83.6	7%	0.073	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-56.5	123.8	-176.7	-177.3	0	0	0	0	109.3	H344 V346 E437 W438 V441	V342-H344 PolarHBondContact O-N 3.11Å; V342-V346 HydrophobicContact CG1-CB 3.86Å; V342-V346 HydrophobicContact CG1-CG1 3.85Å; V342-E437 HydrophobicContact CG2-CB 4.01Å; V342-W438 HydrophobicContact CG2-CD2 3.79Å; V342-W438 HydrophobicContact CG2-CE3 4.44Å; V342-W438 HydrophobicContact CG2-CG 3.93Å; V342-W438 HydrophobicContact CG2-CZ2 4.2Å; V342-V441 HydrophobicContact CG1-CG2 4.1Å; V342-V441 HydrophobicContact CG2-CG2 4.34Å
343	P	82.3	Confident	74.2	Confident	47 Å²	47	89.4 Å²	89.4	31%	0.305	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-58.4	141.3	178.8	-22.5	31	0	0	0	111.7	P341 W345 V346 K347	P341-P343 WeakPolarHBondContact O-CD 3.29Å; P343-W345 VanDerWaalsContact CB-CD1 3.49Å; P343-W345 HydrophobicContact CB-CG 4.31Å; P343-W345 VanDerWaalsContact CB-NE1 3.25Å; P343-W345 PolarHBondContact O-N 3.39Å; P343-W345 VanDerWaalsContact O-N 3.13Å; P343-V346 HydrophobicContact CB-CG2 4.06Å; P343-V346 HydrophobicContact CG-CG2 4.08Å; P343-V346 WeakPolarHBondContact O-CB 3.33Å; P343-V346 PolarHBondContact O-N 3.25Å; P343-K347 PolarHBondContact O-N 2.67Å; P343-K347 VanDerWaalsContact O-N 3.11Å
344	H	78.7	Confident	74	Confident	169 Å²	169	89.1 Å²	89.1	78%	0.782	43%	0.429	S	S	*	.	H	α-helix	trans	-56.6	-34.1	-176.9	-72.7	-67.4	0	0	0	113.8	V342 K347 Y348	V342-H344 PolarHBondContact O-N 3.11Å; H344-K347 PolarHBondContact O-N 3.45Å; H344-Y348 PolarHBondContact O-N 2.9Å
345	W	83.4	Confident	73.7	Confident	186 Å²	186	82.6 Å²	82.6	71%	0.705	40%	0.399	S	S	*	.	H	α-helix	trans	-66.2	-36.6	176.4	66.1	-94.4	0	0	0	112.6	P343 L349	P343-W345 VanDerWaalsContact CB-CD1 3.49Å; P343-W345 HydrophobicContact CB-CG 4.31Å; P343-W345 VanDerWaalsContact CB-NE1 3.25Å; P343-W345 PolarHBondContact O-N 3.39Å; P343-W345 VanDerWaalsContact O-N 3.13Å; W345-L349 VanDerWaalsContact O-CB 3.25Å; W345-L349 WeakPolarHBondContact O-CB 3.19Å; W345-L349 PolarHBondContact O-N 3.13Å
346	V	81.4	Confident	73.8	Confident	11 Å²	11	82.8 Å²	82.8	7%	0.067	41%	0.41	C	S	.	.	H	α-helix	trans	-67.4	-42.7	175.3	-179.8	0	0	0	0	109.8	V342 P343 L349 I350 V441	V342-V346 HydrophobicContact CG1-CB 3.86Å; V342-V346 HydrophobicContact CG1-CG1 3.85Å; P343-V346 HydrophobicContact CB-CG2 4.06Å; P343-V346 HydrophobicContact CG-CG2 4.08Å; P343-V346 WeakPolarHBondContact O-CB 3.33Å; P343-V346 PolarHBondContact O-N 3.25Å; V346-L349 PolarHBondContact O-N 3.2Å; V346-I350 HydrophobicContact CG1-CD1 3.72Å; V346-I350 HydrophobicContact CG1-CG1 4.2Å; V346-I350 WeakPolarHBondContact O-CB 3.43Å; V346-I350 PolarHBondContact O-N 3.29Å; V346-V441 HydrophobicContact CG1-CG1 4.15Å
347	K	78.6	Confident	74	Confident	73 Å²	73	87.5 Å²	87.5	32%	0.317	44%	0.435	S	S	.	.	I	π-helix	trans	-60.3	-48.4	178.8	-150.2	171.9	-169.6	155.9	0	111	P343 H344 L351 E352 E437	P343-K347 PolarHBondContact O-N 2.67Å; P343-K347 VanDerWaalsContact O-N 3.11Å; H344-K347 PolarHBondContact O-N 3.45Å; K347-L351 HydrophobicContact CG-CD1 4.08Å; K347-L351 WeakPolarHBondContact O-CA 3.24Å; K347-L351 VanDerWaalsContact O-CB 3.31Å; K347-L351 WeakPolarHBondContact O-CB 3.49Å; K347-L351 PolarHBondContact O-N 3.12Å; K347-E352 PolarHBondContact O-N 3.24Å; K347-E437 IonicContact NZ-OE1 2.69Å; K347-E437 PolarHBondContact NZ-OE1 3.2Å; K347-E437 IonicContact NZ-OE2 3.4Å; K347-E437 PolarHBondContact NZ-OE2 2.93Å
348	Y	79.3	Confident	74.4	Confident	131 Å²	131	85.1 Å²	85.1	51%	0.514	42%	0.419	S	S	.	.	I	π-helix	trans	-64.4	-46.3	177.9	-174.6	-101.3	0	0	0	112.6	H344 E352 R353	H344-Y348 PolarHBondContact O-N 2.9Å; Y348-E352 WeakPolarHBondContact CD2-OE2 3.48Å; Y348-E352 WeakPolarHBondContact CE2-OE2 3.49Å; Y348-E352 WeakPolarHBondContact O-CB 3.29Å; Y348-E352 PolarHBondContact O-N 3.39Å; Y348-R353 HydrophobicContact CE1-CG 4.36Å; Y348-R353 PolarHBondContact O-N 3.22Å; Y348-R353 VanDerWaalsContact O-N 3.08Å
349	L	79.2	Confident	74.5	Confident	106 Å²	106	82.6 Å²	82.6	56%	0.555	41%	0.413	S	S	*	.	I	π-helix	trans	-74.5	-44.3	-173.8	-159.1	148.8	0	0	0	112.3	W345 V346 A354	W345-L349 VanDerWaalsContact O-CB 3.25Å; W345-L349 WeakPolarHBondContact O-CB 3.19Å; W345-L349 PolarHBondContact O-N 3.13Å; V346-L349 PolarHBondContact O-N 3.2Å; L349-A354 PolarHBondContact O-N 3.12Å; L349-A354 VanDerWaalsContact O-N 3.09Å
350	I	78.8	Confident	74.4	Confident	27 Å²	27	81.2 Å²	81.2	14%	0.138	41%	0.407	C	S	.	.	I	π-helix	trans	-90.6	-40.6	-174.1	-56	-173.5	0	0	0	112.6	V346 P355 V441 V444	V346-I350 HydrophobicContact CG1-CD1 3.72Å; V346-I350 HydrophobicContact CG1-CG1 4.2Å; V346-I350 WeakPolarHBondContact O-CB 3.43Å; V346-I350 PolarHBondContact O-N 3.29Å; I350-P355 VanDerWaalsContact O-CD 3.26Å; I350-P355 WeakPolarHBondContact O-CD 3.22Å; I350-V441 HydrophobicContact CD1-CG1 4.04Å; I350-V441 HydrophobicContact CG2-CG1 4.24Å; I350-V444 HydrophobicContact CG2-CB 4.11Å; I350-V444 HydrophobicContact CG2-CG1 3.87Å; I350-V444 VanDerWaalsContact O-CG1 3.32Å; I350-V444 WeakPolarHBondContact O-CG1 3.31Å
351	L	71.5	Confident	73.3	Confident	31 Å²	31	85.1 Å²	85.1	16%	0.162	42%	0.417	C	S	.	.	I	π-helix	trans	-89.2	-27.7	-178.1	-75.2	99.3	0	0	0	114.3	K347 P355 Q440 V441	K347-L351 HydrophobicContact CG-CD1 4.08Å; K347-L351 WeakPolarHBondContact O-CA 3.24Å; K347-L351 VanDerWaalsContact O-CB 3.31Å; K347-L351 WeakPolarHBondContact O-CB 3.49Å; K347-L351 PolarHBondContact O-N 3.12Å; L351-P355 WeakPolarHBondContact O-CG 3.45Å; L351-Q440 HydrophobicContact CD2-CG 3.98Å; L351-V441 HydrophobicContact CD1-CG2 3.54Å
352	E	73.9	Confident	72.1	Confident	115 Å²	115	88.2 Å²	88.2	54%	0.537	42%	0.421	S	S	.	.	I	π-helix	trans	-102.3	-49.7	-176.9	-62.2	-175.7	172.8	0	0	112.7	K347 Y348 V356	K347-E352 PolarHBondContact O-N 3.24Å; Y348-E352 WeakPolarHBondContact CD2-OE2 3.48Å; Y348-E352 WeakPolarHBondContact CE2-OE2 3.49Å; Y348-E352 WeakPolarHBondContact O-CB 3.29Å; Y348-E352 PolarHBondContact O-N 3.39Å; E352-V356 VanDerWaalsContact O-CG2 3.26Å; E352-V356 WeakPolarHBondContact O-CG2 3.4Å
353	R	74.3	Confident	70.5	Confident	158 Å²	158	95.3 Å²	95.3	60%	0.596	45%	0.452	S	S	*	.	I	π-helix	trans	-79.8	-50.3	-177.1	-91.1	-133.4	173.5	-178.5	-2.2	114.4	Y348 V356 L357	Y348-R353 HydrophobicContact CE1-CG 4.36Å; Y348-R353 PolarHBondContact O-N 3.22Å; Y348-R353 VanDerWaalsContact O-N 3.08Å; R353-V356 PolarHBondContact O-N 3.32Å; R353-L357 WeakPolarHBondContact O-CB 3.48Å; R353-L357 PolarHBondContact O-N 3.49Å
354	A	74.4	Confident	68.6	Low	8 Å²	8	100.2 Å²	100.2	7%	0.066	47%	0.47	C	S	.	.	H	α-helix	trans	-59.8	-43.1	-174.1	0	0	0	0	0	114.6	L349 V356 L357 F358 L448	L349-A354 PolarHBondContact O-N 3.12Å; L349-A354 VanDerWaalsContact O-N 3.09Å; A354-V356 VanDerWaalsContact C-N 3.3Å; A354-V356 PolarHBondContact O-N 3.24Å; A354-L357 PolarHBondContact O-N 2.85Å; A354-F358 WeakPolarHBondContact O-CB 3.34Å; A354-F358 WeakPolarHBondContact O-CD2 3.42Å; A354-F358 PolarHBondContact O-N 2.81Å; A354-L448 HydrophobicContact CB-CD1 3.63Å
355	P	71.3	Confident	66.5	Low	13 Å²	13	101.1 Å²	101.1	8%	0.084	47%	0.466	C	S	.	.	H	α-helix	trans	-68.5	-30.7	-179.2	-22.9	37	0	0	0	113	I350 L351 C359 I360 V444	I350-P355 VanDerWaalsContact O-CD 3.26Å; I350-P355 WeakPolarHBondContact O-CD 3.22Å; L351-P355 WeakPolarHBondContact O-CG 3.45Å; P355-C359 CarbonylContact O-C 3.55Å; P355-C359 WeakPolarHBondContact O-CA 3.49Å; P355-C359 PolarHBondContact O-N 2.91Å; P355-C359 VanDerWaalsContact O-N 3.11Å; P355-I360 HydrophobicContact CB-CB 4.11Å; P355-I360 PolarHBondContact O-N 2.74Å; P355-V444 HydrophobicContact CG-CG1 3.98Å
356	V	70.3	Confident	64.1	Low	117 Å²	117	99.8 Å²	99.8	71%	0.709	47%	0.466	S	S	*	.	H	α-helix	trans	-73.8	-46	176.8	176.9	0	0	0	0	110.2	E352 R353 A354 C359	E352-V356 VanDerWaalsContact O-CG2 3.26Å; E352-V356 WeakPolarHBondContact O-CG2 3.4Å; R353-V356 PolarHBondContact O-N 3.32Å; A354-V356 VanDerWaalsContact C-N 3.3Å; A354-V356 PolarHBondContact O-N 3.24Å; V356-C359 PolarHBondContact O-N 2.8Å
357	L	69.6	Low	61.9	Low	124 Å²	124	104.3 Å²	104.3	65%	0.649	50%	0.497	S	S	*	.	H	α-helix	trans	-66.1	-40.2	-179.1	-153.9	105.8	0	0	0	112.2	R353 A354	R353-L357 WeakPolarHBondContact O-CB 3.48Å; R353-L357 PolarHBondContact O-N 3.49Å; A354-L357 PolarHBondContact O-N 2.85Å
358	F	64.5	Low	59.7	Low	73 Å²	73	103.5 Å²	103.5	32%	0.32	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	11.1	-177.7	-69.7	-81.8	0	0	0	113.2	A354 I360 L448 R451	A354-F358 WeakPolarHBondContact O-CB 3.34Å; A354-F358 WeakPolarHBondContact O-CD2 3.42Å; A354-F358 PolarHBondContact O-N 2.81Å; F358-I360 HydrophobicContact CB-CG1 4.27Å; F358-I360 PolarHBondContact O-N 2.9Å; F358-L448 HydrophobicContact CD2-CD1 3.75Å; F358-L448 HydrophobicContact CD2-CG 4.32Å; F358-L448 HydrophobicContact CE2-CD1 3.69Å; F358-L448 HydrophobicContact CE2-CG 4.22Å; F358-R451 PolarHBondContact O-NH1 3.27Å; F358-R451 PolarHBondContact O-NH2 2.84Å
359	C	64.6	Low	57.4	Low	100 Å²	100	106 Å²	106	68%	0.676	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	46	-178.7	-65	0	0	0	0	112.9	P355 V356 H361 R451	P355-C359 CarbonylContact O-C 3.55Å; P355-C359 WeakPolarHBondContact O-CA 3.49Å; P355-C359 PolarHBondContact O-N 2.91Å; P355-C359 VanDerWaalsContact O-N 3.11Å; V356-C359 PolarHBondContact O-N 2.8Å; C359-H361 VanDerWaalsContact C-N 3.32Å; C359-H361 PolarHBondContact O-N 3.37Å; C359-R451 PolarHBondContact O-NH2 3.24Å; C359-R451 VanDerWaalsContact O-NH2 3.16Å
360	I	64.6	Low	55.1	Low	24 Å²	24	106.7 Å²	106.7	12%	0.123	52%	0.516	C	S	.	.			trans	-77.3	94	169.9	-58.4	173.9	0	0	0	105.1	P355 F358 K362 V444 V447	P355-I360 HydrophobicContact CB-CB 4.11Å; P355-I360 PolarHBondContact O-N 2.74Å; F358-I360 HydrophobicContact CB-CG1 4.27Å; F358-I360 PolarHBondContact O-N 2.9Å; I360-K362 PolarHBondContact O-N 2.82Å; I360-V444 HydrophobicContact CD1-CG1 4.27Å; I360-V447 HydrophobicContact CD1-CB 4.22Å; I360-V447 HydrophobicContact CD1-CG1 3.76Å; I360-V447 HydrophobicContact CG1-CG1 3.93Å; I360-V447 HydrophobicContact CG2-CG1 4.32Å
361	H	48.4	Very low	53	Low	174 Å²	174	109.1 Å²	109.1	81%	0.806	54%	0.535	S	S	*	.			trans	-56.9	113.6	-179.8	-162.3	81.9	0	0	0	108	C359 K363	C359-H361 VanDerWaalsContact C-N 3.32Å; C359-H361 PolarHBondContact O-N 3.37Å; H361-K363 VanDerWaalsContact C-N 3.26Å; H361-K363 PolarHBondContact O-N 3.49Å
362	K	48.4	Very low	51.2	Low	153 Å²	153	109.9 Å²	109.9	67%	0.665	54%	0.543	S	S	*	.			trans	-58.6	89.7	177.1	-82.3	-178.7	174.9	177.4	0	108.3	I360 H364	I360-K362 PolarHBondContact O-N 2.82Å; K362-H364 PolarHBondContact O-N 3.05Å
363	K	44	Very low	49.2	Very low	162 Å²	162	111.5 Å²	111.5	70%	0.704	55%	0.551	S	S	*	*			trans	-76.8	73.5	161.3	-155.5	176	-172.4	178.4	0	106.7	H361 R365	H361-K363 VanDerWaalsContact C-N 3.26Å; H361-K363 PolarHBondContact O-N 3.49Å; K363-R365 HydrophobicContact CG-CB 4.02Å; K363-R365 PolarHBondContact O-N 3.15Å
364	H	41.5	Very low	47.1	Very low	149 Å²	149	107 Å²	107	69%	0.69	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	25.5	171.1	-149	-74.7	0	0	0	112.2	K362	K362-H364 PolarHBondContact O-N 3.05Å
365	R	34.9	Very low	45.2	Very low	188 Å²	188	109 Å²	109	71%	0.709	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	0.4	-167.9	-143	-175.9	-72.5	-175.9	-1.9	113.7	K363	K363-R365 HydrophobicContact CG-CB 4.02Å; K363-R365 PolarHBondContact O-N 3.15Å
366	F	32.9	Very low	43.3	Very low	158 Å²	158	113.7 Å²	113.7	69%	0.693	58%	0.582	S	S	*	*	S	Bend	trans	-94.1	-37.3	177.7	-134	-95.6	0	0	0	113.3	A368 R369	F366-A368 VanDerWaalsContact C-N 3.35Å; F366-A368 PolarHBondContact O-N 3.05Å; F366-R369 PolarHBondContact O-N 2.8Å
367	C	35.5	Very low	41.5	Very low	106 Å²	106	115.2 Å²	115.2	72%	0.716	59%	0.585	S	S	*	*	H	α-helix	trans	-71.5	-25.5	173.1	-83	0	0	0	0	114	R369 S371	C367-R369 VanDerWaalsContact C-N 3.27Å; C367-R369 PolarHBondContact O-N 3.2Å; C367-S371 PolarHBondContact O-N 2.87Å
368	A	32.8	Very low	39.8	Very low	56 Å²	56	115.2 Å²	115.2	46%	0.463	59%	0.586	S	S	.	*	H	α-helix	trans	-69.6	-23.1	175.8	0	0	0	0	0	113.1	F366 S372	F366-A368 VanDerWaalsContact C-N 3.35Å; F366-A368 PolarHBondContact O-N 3.05Å; A368-S372 WeakPolarHBondContact O-CB 3.46Å; A368-S372 PolarHBondContact O-N 3.27Å; A368-S372 PolarHBondContact O-OG 2.78Å
369	R	29.5	Very low	38.1	Very low	184 Å²	184	119.2 Å²	119.2	69%	0.694	60%	0.599	S	S	*	*	H	α-helix	trans	-87.4	-33.4	178.6	-93.2	-177.1	174.8	176.1	-3	113.8	F366 C367 S372 Q373	F366-R369 PolarHBondContact O-N 2.8Å; C367-R369 VanDerWaalsContact C-N 3.27Å; C367-R369 PolarHBondContact O-N 3.2Å; R369-S372 WeakPolarHBondContact CA-OG 3.3Å; R369-S372 PolarHBondContact O-N 3.08Å; R369-S372 PolarHBondContact O-OG 2.86Å; R369-Q373 PolarHBondContact O-N 3.04Å; R369-Q373 VanDerWaalsContact O-N 3.11Å
370	L	32.4	Very low	36.4	Very low	121 Å²	121	119.5 Å²	119.5	63%	0.634	60%	0.602	S	S	*	*	H	α-helix	trans	-71.8	-34.7	172.1	-105.4	89.8	0	0	0	111.8	Q373 A374	L370-Q373 PolarHBondContact O-N 2.91Å; L370-A374 PolarHBondContact O-N 2.92Å; L370-A374 VanDerWaalsContact O-N 3.13Å
371	S	34.6	Very low	35	Very low	77 Å²	77	127.8 Å²	127.8	54%	0.538	64%	0.637	S	S	.	*	H	α-helix	trans	-71.2	-31.1	173.1	94	0	0	0	0	112	C367 S375	C367-S371 PolarHBondContact O-N 2.87Å; S371-S375 VanDerWaalsContact O-CB 3.24Å; S371-S375 WeakPolarHBondContact O-CB 3.45Å; S371-S375 PolarHBondContact O-N 3Å; S371-S375 PolarHBondContact O-OG 2.98Å
372	S	33	Very low	34.2	Very low	47 Å²	47	127 Å²	127	33%	0.329	63%	0.634	S	S	.	*	H	α-helix	trans	-69.9	-33.8	174.8	72.9	0	0	0	0	112.6	A368 R369 S375 E376	A368-S372 WeakPolarHBondContact O-CB 3.46Å; A368-S372 PolarHBondContact O-N 3.27Å; A368-S372 PolarHBondContact O-OG 2.78Å; R369-S372 WeakPolarHBondContact CA-OG 3.3Å; R369-S372 PolarHBondContact O-N 3.08Å; R369-S372 PolarHBondContact O-OG 2.86Å; S372-S375 WeakPolarHBondContact CA-OG 3.34Å; S372-S375 PolarHBondContact O-OG 3.02Å; S372-E376 WeakPolarHBondContact O-CB 3.48Å; S372-E376 WeakPolarHBondContact O-CG 3.24Å; S372-E376 PolarHBondContact O-N 3.35Å
373	Q	31.1	Very low	33.2	Very low	149 Å²	149	126.6 Å²	126.6	70%	0.696	64%	0.639	S	S	*	*	H	α-helix	trans	-81.8	-28.8	-179.1	-151.4	168.2	15.1	0	0	113.2	R369 L370	R369-Q373 PolarHBondContact O-N 3.04Å; R369-Q373 VanDerWaalsContact O-N 3.11Å; L370-Q373 PolarHBondContact O-N 2.91Å
374	A	31.5	Very low	32.8	Very low	65 Å²	65	125.9 Å²	125.9	54%	0.537	64%	0.643	S	S	.	*	H	α-helix	trans	-74.8	-35.9	168.7	0	0	0	0	0	112.1	L370	L370-A374 PolarHBondContact O-N 2.92Å; L370-A374 VanDerWaalsContact O-N 3.13Å
375	S	33.9	Very low	32.3	Very low	49 Å²	49	129.8 Å²	129.8	34%	0.343	65%	0.653	S	S	.	*	H	α-helix	trans	-76.7	-21.5	175.4	57.1	0	0	0	0	113.9	S371 S372 L377 D378 R379	S371-S375 VanDerWaalsContact O-CB 3.24Å; S371-S375 WeakPolarHBondContact O-CB 3.45Å; S371-S375 PolarHBondContact O-N 3Å; S371-S375 PolarHBondContact O-OG 2.98Å; S372-S375 WeakPolarHBondContact CA-OG 3.34Å; S372-S375 PolarHBondContact O-OG 3.02Å; S375-L377 VanDerWaalsContact C-N 3.32Å; S375-D378 PolarHBondContact O-N 2.84Å; S375-R379 WeakPolarHBondContact O-CB 3.48Å; S375-R379 PolarHBondContact O-N 2.86Å
376	E	30.3	Very low	32	Very low	111 Å²	111	124.2 Å²	124.2	52%	0.519	65%	0.654	S	S	.	*	H	α-helix	trans	-73.3	-21	173.3	-86.5	179.7	169	0	0	113.7	S372	S372-E376 WeakPolarHBondContact O-CB 3.48Å; S372-E376 WeakPolarHBondContact O-CG 3.24Å; S372-E376 PolarHBondContact O-N 3.35Å
377	L	34.3	Very low	32	Very low	149 Å²	149	123.4 Å²	123.4	78%	0.78	66%	0.662	S	S	*	*	H	α-helix	trans	-81	-28.4	172	-151.3	78.2	0	0	0	112.4	S375	S375-L377 VanDerWaalsContact C-N 3.32Å
378	D	32.2	Very low	31.8	Very low	124 Å²	124	127.4 Å²	127.4	66%	0.663	67%	0.671	S	S	*	*	H	α-helix	trans	-87.1	-28.5	175.4	-81	-26.4	0	0	0	113.2	S375 S380 K381	S375-D378 PolarHBondContact O-N 2.84Å; D378-S380 PolarHBondContact O-N 3.17Å; D378-S380 VanDerWaalsContact O-N 3.14Å; D378-K381 PolarHBondContact O-N 3.41Å
379	R	29.5	Very low	31.8	Very low	157 Å²	157	130.7 Å²	130.7	59%	0.592	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-1	-178.9	-151.5	170.5	78.2	-149	0.5	114.7	S375	S375-R379 WeakPolarHBondContact O-CB 3.48Å; S375-R379 PolarHBondContact O-N 2.86Å
380	S	28.8	Very low	32.1	Very low	107 Å²	107	129.3 Å²	129.3	75%	0.748	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-1.5	171.1	-64.1	0	0	0	0	113.7	D378	D378-S380 PolarHBondContact O-N 3.17Å; D378-S380 VanDerWaalsContact O-N 3.14Å
381	K	34.8	Very low	32.4	Very low	198 Å²	198	129.8 Å²	129.8	86%	0.861	69%	0.69	S	S	*	*	S	Bend	trans	-114	-1.2	177.4	-84	-173.5	176.2	179	0	115.9	D378	D378-K381 PolarHBondContact O-N 3.41Å
382	E	31.4	Very low	32.9	Very low	158 Å²	158	132.2 Å²	132.2	74%	0.738	70%	0.697	S	S	*	*			trans	-114.9	11.9	-171.1	-112.9	173.5	-179	0	0	115.8	N384	E382-N384 VanDerWaalsContact C-N 3.34Å; E382-N384 PolarHBondContact O-N 3.12Å
383	N	29.2	Very low	33.6	Very low	143 Å²	143	134.4 Å²	134.4	77%	0.765	71%	0.708	S	S	*	*			trans	-95	43.8	175.4	-80.3	-4.9	0	0	0	113.6
384	N	33.8	Very low	34.2	Very low	148 Å²	148	135.5 Å²	135.5	79%	0.791	71%	0.711	S	S	*	*	S	Bend	trans	-154.8	86.7	159.4	-105	-8.3	0	0	0	107.7	E382	E382-N384 VanDerWaalsContact C-N 3.34Å; E382-N384 PolarHBondContact O-N 3.12Å
385	Y	31.2	Very low	34.9	Very low	231 Å²	231	134.4 Å²	134.4	91%	0.906	71%	0.706	S	S	*	*			trans	172.1	113.5	136.4	-97.3	-74.3	0	0	0	107.4
386	G	29	Very low	35.6	Very low	71 Å²	71	137.6 Å²	137.6	73%	0.732	72%	0.719	S	S	*	*			trans	-66.7	135.1	175.9	0	0	0	0	0	111.7
387	T	33	Very low	36.8	Very low	141 Å²	141	137.1 Å²	137.1	87%	0.865	72%	0.719	S	S	*	*			trans	0.5	113.7	143.8	-34.8	0	0	0	0	117.3
388	E	31.5	Very low	37.4	Very low	190 Å²	190	138.1 Å²	138.1	89%	0.888	72%	0.717	S	S	*	*			trans	-154	128.4	144.6	-111.8	171.5	-163.9	0	0	111
389	D	33.1	Very low	38.1	Very low	124 Å²	124	140.5 Å²	140.5	66%	0.663	72%	0.718	S	S	*	*			trans	23.7	119.9	169.8	-82.2	-28.5	0	0	0	124.3	N391	D389-N391 PolarHBondContact O-N 2.64Å; D389-N391 VanDerWaalsContact O-N 3.17Å
390	N	36.3	Very low	39.1	Very low	155 Å²	155	138.3 Å²	138.3	83%	0.829	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	14.9	171.6	-95.2	-30.3	0	0	0	115.3
391	N	38.8	Very low	39.9	Very low	132 Å²	132	143.3 Å²	143.3	71%	0.706	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-12.8	-179.2	-77.4	-26.4	0	0	0	114.4	D389	D389-N391 PolarHBondContact O-N 2.64Å; D389-N391 VanDerWaalsContact O-N 3.17Å
392	D	44.7	Very low	40.4	Very low	128 Å²	128	138.9 Å²	138.9	68%	0.684	71%	0.714	S	S	*	*	H	α-helix	trans	-88.9	-19.6	-174.6	-79.4	-19.5	0	0	0	115	F394 G395 L396	D392-F394 PolarHBondContact O-N 3.43Å; D392-G395 PolarHBondContact O-N 3.41Å; D392-L396 PolarHBondContact O-N 3.14Å; D392-L396 VanDerWaalsContact O-N 3.16Å
393	V	46.7	Very low	41	Very low	93 Å²	93	138.2 Å²	138.2	56%	0.564	71%	0.71	S	S	*	*	H	α-helix	trans	-72.7	-32.5	-177.1	-178	0	0	0	0	112.1	G395 L396 I397	V393-G395 VanDerWaalsContact C-N 3.34Å; V393-L396 PolarHBondContact O-N 3.26Å; V393-I397 HydrophobicContact CG1-CD1 4.4Å; V393-I397 WeakPolarHBondContact O-CG1 3.26Å; V393-I397 PolarHBondContact O-N 3.33Å
394	F	43.9	Very low	41.7	Very low	171 Å²	171	137.7 Å²	137.7	75%	0.75	70%	0.704	S	S	*	*	H	α-helix	trans	-74.8	-26.9	177.3	-151.2	-96	0	0	0	112.2	D392 K398	D392-F394 PolarHBondContact O-N 3.43Å; F394-K398 PolarHBondContact O-N 3.07Å
395	G	47	Very low	42.2	Very low	43 Å²	43	137.7 Å²	137.7	44%	0.443	70%	0.704	S	S	.	*	H	α-helix	trans	-70.2	-40.8	171.7	0	0	0	0	0	112.7	D392 V393 I397 K398 Y399	D392-G395 PolarHBondContact O-N 3.41Å; V393-G395 VanDerWaalsContact C-N 3.34Å; G395-I397 PolarHBondContact O-N 2.72Å; G395-K398 PolarHBondContact O-N 2.75Å; G395-Y399 PolarHBondContact O-N 3.18Å
396	L	49.2	Very low	43.2	Very low	116 Å²	116	134.4 Å²	134.4	61%	0.607	70%	0.702	S	S	*	*	H	α-helix	trans	-64.8	-38.1	178.6	-148.7	86.5	0	0	0	112.6	D392 V393 K398 Y399 L400	D392-L396 PolarHBondContact O-N 3.14Å; D392-L396 VanDerWaalsContact O-N 3.16Å; V393-L396 PolarHBondContact O-N 3.26Å; L396-K398 VanDerWaalsContact C-N 3.33Å; L396-K398 PolarHBondContact O-N 2.95Å; L396-Y399 PolarHBondContact O-N 2.79Å; L396-L400 HydrophobicContact CD2-CD1 4.45Å; L396-L400 WeakPolarHBondContact O-CB 3.34Å; L396-L400 WeakPolarHBondContact O-CG 3.49Å; L396-L400 PolarHBondContact O-N 3.08Å
397	I	53.7	Low	44.2	Very low	101 Å²	101	134.6 Å²	134.6	52%	0.518	69%	0.689	S	S	.	*	H	α-helix	trans	-67.8	-33.7	176.6	-66.4	169	0	0	0	111.4	V393 G395 R401	V393-I397 HydrophobicContact CG1-CD1 4.4Å; V393-I397 WeakPolarHBondContact O-CG1 3.26Å; V393-I397 PolarHBondContact O-N 3.33Å; G395-I397 PolarHBondContact O-N 2.72Å; I397-R401 PolarHBondContact O-N 3.19Å
398	K	48	Very low	45.3	Very low	169 Å²	169	131.9 Å²	131.9	74%	0.735	67%	0.673	S	S	*	*	H	α-helix	trans	-74.4	-32.6	176	-162.2	175.7	-176.8	-179.8	0	112	F394 G395 L396	F394-K398 PolarHBondContact O-N 3.07Å; G395-K398 PolarHBondContact O-N 2.75Å; L396-K398 VanDerWaalsContact C-N 3.33Å; L396-K398 PolarHBondContact O-N 2.95Å
399	Y	46.7	Very low	46.8	Very low	174 Å²	174	127.6 Å²	127.6	68%	0.682	66%	0.662	S	S	*	*	H	α-helix	trans	-72.1	-42.2	175	-159.9	-94.1	0	0	0	112	G395 L396 R401 S402	G395-Y399 PolarHBondContact O-N 3.18Å; L396-Y399 PolarHBondContact O-N 2.79Å; Y399-R401 VanDerWaalsContact C-N 3.27Å; Y399-R401 PolarHBondContact O-N 2.84Å; Y399-S402 WeakPolarHBondContact O-CB 3.26Å; Y399-S402 PolarHBondContact O-N 2.89Å; Y399-S402 VanDerWaalsContact O-N 3.15Å
400	L	49.9	Very low	48.2	Very low	112 Å²	112	126 Å²	126	59%	0.586	66%	0.657	S	S	*	*	H	α-helix	trans	-64.7	-28	176.5	-75.5	165	0	0	0	113.3	L396 S402	L396-L400 HydrophobicContact CD2-CD1 4.45Å; L396-L400 WeakPolarHBondContact O-CB 3.34Å; L396-L400 WeakPolarHBondContact O-CG 3.49Å; L396-L400 PolarHBondContact O-N 3.08Å; L400-S402 VanDerWaalsContact C-N 3.33Å
401	R	47	Very low	49.5	Very low	211 Å²	211	123.9 Å²	123.9	80%	0.796	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-17.5	176.2	-152.3	175.2	-152.2	161.8	6.5	113.9	I397 Y399 Q403	I397-R401 PolarHBondContact O-N 3.19Å; Y399-R401 VanDerWaalsContact C-N 3.27Å; Y399-R401 PolarHBondContact O-N 2.84Å; R401-Q403 VanDerWaalsContact C-N 3.34Å
402	S	44.1	Very low	50.9	Low	105 Å²	105	121.5 Å²	121.5	73%	0.734	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-8.7	178.8	-177.6	0	0	0	0	113.3	Y399 L400	Y399-S402 WeakPolarHBondContact O-CB 3.26Å; Y399-S402 PolarHBondContact O-N 2.89Å; Y399-S402 VanDerWaalsContact O-N 3.15Å; L400-S402 VanDerWaalsContact C-N 3.33Å
403	Q	44.5	Very low	52.1	Low	144 Å²	144	120 Å²	120	67%	0.673	62%	0.623	S	S	*	*			trans	-114.2	32.8	-174.1	-139.7	-178.7	-5.5	0	0	112	R401 D405	R401-Q403 VanDerWaalsContact C-N 3.34Å; Q403-D405 VanDerWaalsContact C-N 3.26Å; Q403-D405 PolarHBondContact O-N 2.96Å; Q403-D405 VanDerWaalsContact O-N 3.16Å
404	Q	43.9	Very low	53.6	Low	133 Å²	133	119.9 Å²	119.9	62%	0.621	62%	0.618	S	S	*	*			trans	-86.4	64.8	174.8	-165.2	97.2	21.3	0	0	109.9
405	D	45	Very low	55.2	Low	148 Å²	148	116.9 Å²	116.9	79%	0.791	61%	0.609	S	S	*	*	S	Bend	trans	-145.1	107.8	159.9	-93.2	-31.2	0	0	0	107.4	Q403	Q403-D405 VanDerWaalsContact C-N 3.26Å; Q403-D405 PolarHBondContact O-N 2.96Å; Q403-D405 VanDerWaalsContact O-N 3.16Å
406	N	52.2	Low	56.7	Low	162 Å²	162	120.9 Å²	120.9	87%	0.866	62%	0.616	S	S	*	*			trans	82.7	72.4	177.4	-51.9	-32.4	0	0	0	117.4
407	T	48.1	Very low	58.3	Low	75 Å²	75	121.4 Å²	121.4	46%	0.46	62%	0.615	S	S	.	*			trans	-108.1	138.9	158.6	43.2	0	0	0	0	111.3
408	P	57.4	Low	59.8	Low	83 Å²	83	120.7 Å²	120.7	54%	0.539	62%	0.615	S	S	.	*			trans	-70.1	151.8	177.2	27.8	-32.5	0	0	0	111.5	V410 M411	P408-V410 PolarHBondContact O-N 2.72Å; P408-M411 PolarHBondContact O-N 3.09Å
409	P	61.8	Low	61.5	Low	100 Å²	100	116.1 Å²	116.1	65%	0.649	60%	0.602	S	S	*	*	H	α-helix	trans	-62.2	-6.6	-172.1	25.2	-35.6	0	0	0	115.1	N413	P409-N413 PolarHBondContact O-ND2 2.65Å
410	V	63.8	Low	63.3	Low	92 Å²	92	110.3 Å²	110.3	56%	0.558	59%	0.59	S	S	*	*	H	α-helix	trans	-76.8	-33.2	179.3	-177.4	0	0	0	0	111.9	P408 N413 I414	P408-V410 PolarHBondContact O-N 2.72Å; V410-N413 PolarHBondContact O-N 3.42Å; V410-I414 HydrophobicContact CG1-CD1 4.15Å; V410-I414 WeakPolarHBondContact O-CG1 3.32Å; V410-I414 PolarHBondContact O-N 2.86Å
411	M	62.8	Low	65.1	Low	110 Å²	110	109.6 Å²	109.6	54%	0.542	59%	0.586	S	S	.	*	H	α-helix	trans	-73.8	-36.1	-176.5	-160.3	58.9	58.1	0	0	112.1	P408 I414 L415	P408-M411 PolarHBondContact O-N 3.09Å; M411-I414 PolarHBondContact O-N 3.22Å; M411-L415 WeakPolarHBondContact O-CB 3.12Å; M411-L415 PolarHBondContact O-N 3.4Å
412	D	68.5	Low	67	Low	81 Å²	81	108 Å²	108	43%	0.433	58%	0.58	S	S	.	*	H	α-helix	trans	-67.7	-37.2	175.3	-71.4	-28.6	0	0	0	111.8	L415 Q416	D412-L415 PolarHBondContact O-N 2.91Å; D412-Q416 WeakPolarHBondContact O-CB 3.35Å; D412-Q416 PolarHBondContact O-N 3.03Å
413	N	71	Confident	68.8	Low	98 Å²	98	108.8 Å²	108.8	52%	0.524	57%	0.571	S	S	.	*	H	α-helix	trans	-64.2	-41.8	174.2	-78.4	-15.7	0	0	0	112.1	P409 V410 Q416 E417	P409-N413 PolarHBondContact O-ND2 2.65Å; V410-N413 PolarHBondContact O-N 3.42Å; N413-Q416 PolarHBondContact O-N 2.82Å; N413-E417 WeakPolarHBondContact O-CG 3.09Å; N413-E417 PolarHBondContact O-N 3.19Å
414	I	77.4	Confident	70.8	Confident	90 Å²	90	108.7 Å²	108.7	46%	0.462	57%	0.569	S	S	.	*	H	α-helix	trans	-65.5	-41.6	176.3	-66.6	167.9	0	0	0	110.5	V410 M411 Q416 E417 V418	V410-I414 HydrophobicContact CG1-CD1 4.15Å; V410-I414 WeakPolarHBondContact O-CG1 3.32Å; V410-I414 PolarHBondContact O-N 2.86Å; M411-I414 PolarHBondContact O-N 3.22Å; I414-Q416 VanDerWaalsContact C-N 3.31Å; I414-Q416 PolarHBondContact O-N 3.42Å; I414-E417 PolarHBondContact O-N 2.87Å; I414-V418 HydrophobicContact CG2-CG2 4.35Å; I414-V418 WeakPolarHBondContact O-CB 3.17Å; I414-V418 VanDerWaalsContact O-CG2 3.29Å; I414-V418 WeakPolarHBondContact O-CG2 3.19Å; I414-V418 PolarHBondContact O-N 2.93Å
415	L	77.3	Confident	72.8	Confident	107 Å²	107	105.7 Å²	105.7	56%	0.56	56%	0.557	S	S	*	*	H	α-helix	trans	-62.9	-38.9	175.7	-173.6	68	0	0	0	111.7	M411 D412 T419	M411-L415 WeakPolarHBondContact O-CB 3.12Å; M411-L415 PolarHBondContact O-N 3.4Å; D412-L415 PolarHBondContact O-N 2.91Å; L415-T419 WeakPolarHBondContact O-CB 3.48Å; L415-T419 VanDerWaalsContact O-CG2 3.31Å; L415-T419 WeakPolarHBondContact O-CG2 3.48Å; L415-T419 PolarHBondContact O-N 2.93Å; L415-T419 PolarHBondContact O-OG1 2.83Å
416	Q	78.6	Confident	74.7	Confident	128 Å²	128	102.4 Å²	102.4	60%	0.598	54%	0.537	S	S	*	.	H	α-helix	trans	-65.5	-41.1	176.1	-167.7	172.9	-1.8	0	0	112.1	D412 N413 I414 T419 A420	D412-Q416 WeakPolarHBondContact O-CB 3.35Å; D412-Q416 PolarHBondContact O-N 3.03Å; N413-Q416 PolarHBondContact O-N 2.82Å; I414-Q416 VanDerWaalsContact C-N 3.31Å; I414-Q416 PolarHBondContact O-N 3.42Å; Q416-T419 WeakPolarHBondContact CA-OG1 3.45Å; Q416-T419 PolarHBondContact O-OG1 2.65Å; Q416-A420 WeakPolarHBondContact O-CB 3.37Å; Q416-A420 PolarHBondContact O-N 2.94Å
417	E	83.3	Confident	76.2	Confident	126 Å²	126	101.2 Å²	101.2	59%	0.589	52%	0.524	S	S	*	.	H	α-helix	trans	-67.3	-43.7	175	-72	-64.6	161.9	0	0	112.2	N413 I414 T419 A420 I421	N413-E417 WeakPolarHBondContact O-CG 3.09Å; N413-E417 PolarHBondContact O-N 3.19Å; I414-E417 PolarHBondContact O-N 2.87Å; E417-T419 VanDerWaalsContact C-N 3.34Å; E417-T419 PolarHBondContact O-N 2.82Å; E417-A420 PolarHBondContact O-N 2.89Å; E417-I421 VanDerWaalsContact O-CG1 3.28Å; E417-I421 WeakPolarHBondContact O-CG1 3.3Å; E417-I421 PolarHBondContact O-N 2.81Å
418	V	84.9	Confident	77.8	Confident	86 Å²	86	104.6 Å²	104.6	52%	0.521	53%	0.528	S	S	.	.	H	α-helix	trans	-65.4	-38.6	177.9	172.2	0	0	0	0	111.4	I414 I421 R422	I414-V418 HydrophobicContact CG2-CG2 4.35Å; I414-V418 WeakPolarHBondContact O-CB 3.17Å; I414-V418 VanDerWaalsContact O-CG2 3.29Å; I414-V418 WeakPolarHBondContact O-CG2 3.19Å; I414-V418 PolarHBondContact O-N 2.93Å; V418-I421 PolarHBondContact O-N 2.86Å; V418-R422 WeakPolarHBondContact O-CB 3.4Å; V418-R422 PolarHBondContact O-N 3.04Å
419	T	83.1	Confident	79	Confident	73 Å²	73	104.6 Å²	104.6	45%	0.448	52%	0.524	S	S	.	.	H	α-helix	trans	-69.7	-34.9	174.6	49.6	0	0	0	0	112.2	L415 Q416 E417 R422 H423	L415-T419 WeakPolarHBondContact O-CB 3.48Å; L415-T419 VanDerWaalsContact O-CG2 3.31Å; L415-T419 WeakPolarHBondContact O-CG2 3.48Å; L415-T419 PolarHBondContact O-N 2.93Å; L415-T419 PolarHBondContact O-OG1 2.83Å; Q416-T419 WeakPolarHBondContact CA-OG1 3.45Å; Q416-T419 PolarHBondContact O-OG1 2.65Å; E417-T419 VanDerWaalsContact C-N 3.34Å; E417-T419 PolarHBondContact O-N 2.82Å; T419-R422 PolarHBondContact O-N 3.37Å; T419-H423 WeakPolarHBondContact O-CB 3.4Å; T419-H423 PolarHBondContact O-N 2.84Å
420	A	84.1	Confident	79.9	Confident	52 Å²	52	107 Å²	107	43%	0.43	52%	0.52	S	S	.	.	H	α-helix	trans	-64.5	-43.9	171.9	0	0	0	0	0	112.2	Q416 E417 H423 F424	Q416-A420 WeakPolarHBondContact O-CB 3.37Å; Q416-A420 PolarHBondContact O-N 2.94Å; E417-A420 PolarHBondContact O-N 2.89Å; A420-H423 PolarHBondContact O-N 2.83Å; A420-F424 WeakPolarHBondContact O-CB 3.37Å; A420-F424 PolarHBondContact O-N 3.16Å
421	I	87.4	Confident	80.4	Confident	98 Å²	98	105.2 Å²	105.2	50%	0.503	51%	0.51	S	S	.	.	H	α-helix	trans	-63.1	-45.3	174.9	-67	164.8	0	0	0	110.7	E417 V418 H423 F424 L425	E417-I421 VanDerWaalsContact O-CG1 3.28Å; E417-I421 WeakPolarHBondContact O-CG1 3.3Å; E417-I421 PolarHBondContact O-N 2.81Å; V418-I421 PolarHBondContact O-N 2.86Å; I421-H423 VanDerWaalsContact C-N 3.34Å; I421-H423 PolarHBondContact O-N 3.25Å; I421-F424 PolarHBondContact O-N 2.88Å; I421-L425 HydrophobicContact CG2-CD1 4.01Å; I421-L425 HydrophobicContact CG2-CG 4.43Å; I421-L425 WeakPolarHBondContact O-CG 3.39Å; I421-L425 PolarHBondContact O-N 2.9Å
422	R	87.4	Confident	81.2	Confident	178 Å²	178	107.7 Å²	107.7	67%	0.672	51%	0.514	S	S	*	.	H	α-helix	trans	-58.6	-46.4	175.5	-178.7	-179.9	177.8	164.7	2.7	111.1	V418 T419 F424 L425 E426	V418-R422 WeakPolarHBondContact O-CB 3.4Å; V418-R422 PolarHBondContact O-N 3.04Å; T419-R422 PolarHBondContact O-N 3.37Å; R422-F424 VanDerWaalsContact C-N 3.32Å; R422-F424 PolarHBondContact O-N 2.85Å; R422-L425 PolarHBondContact O-N 3.18Å; R422-E426 VanDerWaalsContact O-CB 3.32Å; R422-E426 WeakPolarHBondContact O-CB 3.28Å; R422-E426 PolarHBondContact O-N 2.96Å
423	H	83.1	Confident	81.7	Confident	121 Å²	121	108.8 Å²	108.8	56%	0.56	52%	0.516	S	S	*	.	H	α-helix	trans	-64.4	-37.7	179.4	-166.9	57	0	0	0	112.1	T419 A420 I421 K427	T419-H423 WeakPolarHBondContact O-CB 3.4Å; T419-H423 PolarHBondContact O-N 2.84Å; A420-H423 PolarHBondContact O-N 2.83Å; I421-H423 VanDerWaalsContact C-N 3.34Å; I421-H423 PolarHBondContact O-N 3.25Å; H423-K427 VanDerWaalsContact O-CB 3.29Å; H423-K427 WeakPolarHBondContact O-CB 3.46Å; H423-K427 PolarHBondContact O-N 2.94Å
424	F	86.4	Confident	82.1	Confident	141 Å²	141	106.3 Å²	106.3	62%	0.618	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-45.9	174.1	-177.1	-95.3	0	0	0	112.3	A420 I421 R422 K427 R428	A420-F424 WeakPolarHBondContact O-CB 3.37Å; A420-F424 PolarHBondContact O-N 3.16Å; I421-F424 PolarHBondContact O-N 2.88Å; R422-F424 VanDerWaalsContact C-N 3.32Å; R422-F424 PolarHBondContact O-N 2.85Å; F424-K427 PolarHBondContact O-N 2.83Å; F424-R428 WeakPolarHBondContact O-CB 3.37Å; F424-R428 PolarHBondContact O-N 2.89Å
425	L	85.6	Confident	82.2	Confident	71 Å²	71	102.6 Å²	102.6	37%	0.372	49%	0.485	S	S	.	.	H	α-helix	trans	-63	-44.5	176.3	-71.6	172.6	0	0	0	111.5	I421 R422 K427 R428 D429	I421-L425 HydrophobicContact CG2-CD1 4.01Å; I421-L425 HydrophobicContact CG2-CG 4.43Å; I421-L425 WeakPolarHBondContact O-CG 3.39Å; I421-L425 PolarHBondContact O-N 2.9Å; R422-L425 PolarHBondContact O-N 3.18Å; L425-K427 PolarHBondContact O-N 3.24Å; L425-R428 WeakPolarHBondContact O-CB 3.43Å; L425-R428 PolarHBondContact O-N 3.06Å; L425-R428 VanDerWaalsContact O-N 3.16Å; L425-D429 PolarHBondContact O-N 3.34Å
426	E	85.3	Confident	82.3	Confident	79 Å²	79	102.6 Å²	102.6	37%	0.369	48%	0.481	S	S	.	.	H	α-helix	trans	-66.4	-37.4	180	-159	-173.7	152.7	0	0	112.1	R422 D429 R430	R422-E426 VanDerWaalsContact O-CB 3.32Å; R422-E426 WeakPolarHBondContact O-CB 3.28Å; R422-E426 PolarHBondContact O-N 2.96Å; E426-D429 PolarHBondContact O-N 2.89Å; E426-R430 PolarHBondContact O-N 3.18Å; E426-R430 IonicContact OE1-CZ 3.77Å; E426-R430 IonicContact OE1-NE 3.95Å; E426-R430 IonicContact OE1-NH2 2.78Å; E426-R430 PolarHBondContact OE1-NH2 3.21Å
427	K	82.5	Confident	82.4	Confident	137 Å²	137	99.7 Å²	99.7	60%	0.596	47%	0.467	S	S	*	.	H	α-helix	trans	-64.1	-42.4	172.2	-174.3	176.7	-179.5	179.5	0	111.2	H423 F424 L425 R430 C431	H423-K427 VanDerWaalsContact O-CB 3.29Å; H423-K427 WeakPolarHBondContact O-CB 3.46Å; H423-K427 PolarHBondContact O-N 2.94Å; F424-K427 PolarHBondContact O-N 2.83Å; L425-K427 PolarHBondContact O-N 3.24Å; K427-R430 PolarHBondContact O-N 3.2Å; K427-C431 PolarHBondContact O-N 2.85Å; K427-C431 PolarHBondContact O-SG 2.86Å; K427-C431 VanDerWaalsContact O-SG 3.32Å
428	R	81.6	Confident	82.4	Confident	146 Å²	146	95 Å²	95	55%	0.551	44%	0.444	S	S	*	.	H	α-helix	trans	-65.1	-41	177.7	-168.9	174.9	69.7	152.1	0	112	F424 L425 C431 R432	F424-R428 WeakPolarHBondContact O-CB 3.37Å; F424-R428 PolarHBondContact O-N 2.89Å; L425-R428 WeakPolarHBondContact O-CB 3.43Å; L425-R428 PolarHBondContact O-N 3.06Å; L425-R428 VanDerWaalsContact O-N 3.16Å; R428-C431 PolarHBondContact O-N 2.94Å; R428-R432 WeakPolarHBondContact O-CB 3.46Å; R428-R432 PolarHBondContact O-N 2.93Å
429	D	84.1	Confident	82.2	Confident	83 Å²	83	94.5 Å²	94.5	44%	0.444	44%	0.438	S	S	.	.	H	α-helix	trans	-66.8	-41	176.2	-74.2	-20.4	0	0	0	111.6	L425 E426 C431 R432 E433	L425-D429 PolarHBondContact O-N 3.34Å; E426-D429 PolarHBondContact O-N 2.89Å; D429-C431 PolarHBondContact O-N 3.06Å; D429-R432 WeakPolarHBondContact O-CB 3.42Å; D429-R432 PolarHBondContact O-N 3.24Å; D429-E433 PolarHBondContact O-N 3.04Å
430	R	78.8	Confident	82.2	Confident	151 Å²	151	95.8 Å²	95.8	57%	0.57	44%	0.439	S	S	*	.	H	α-helix	trans	-60.6	-44.9	172.2	-78.9	-173.8	-146	166.8	6.6	112.8	E426 K427 R432 E433 I434	E426-R430 PolarHBondContact O-N 3.18Å; E426-R430 IonicContact OE1-CZ 3.77Å; E426-R430 IonicContact OE1-NE 3.95Å; E426-R430 IonicContact OE1-NH2 2.78Å; E426-R430 PolarHBondContact OE1-NH2 3.21Å; K427-R430 PolarHBondContact O-N 3.2Å; R430-R432 VanDerWaalsContact C-N 3.27Å; R430-R432 PolarHBondContact O-N 2.82Å; R430-E433 PolarHBondContact O-N 2.79Å; R430-I434 WeakPolarHBondContact O-CG1 3.32Å; R430-I434 PolarHBondContact O-N 2.91Å
431	C	74.9	Confident	82.2	Confident	53 Å²	53	93.4 Å²	93.4	36%	0.358	42%	0.419	S	S	.	.	H	α-helix	trans	-59.7	-41	175.8	-69.9	0	0	0	0	111.3	K427 R428 D429 I434 A435	K427-C431 PolarHBondContact O-N 2.85Å; K427-C431 PolarHBondContact O-SG 2.86Å; K427-C431 VanDerWaalsContact O-SG 3.32Å; R428-C431 PolarHBondContact O-N 2.94Å; D429-C431 PolarHBondContact O-N 3.06Å; C431-I434 PolarHBondContact O-N 3.21Å; C431-A435 WeakPolarHBondContact O-CB 3.43Å; C431-A435 PolarHBondContact O-N 3.12Å
432	R	79.5	Confident	82	Confident	163 Å²	163	88.8 Å²	88.8	62%	0.615	40%	0.395	S	S	*	.	H	α-helix	trans	-64.6	-40.2	177.5	-174.7	-178.3	-108	-175.8	-5.9	112.6	R428 D429 R430 A435 K436	R428-R432 WeakPolarHBondContact O-CB 3.46Å; R428-R432 PolarHBondContact O-N 2.93Å; D429-R432 WeakPolarHBondContact O-CB 3.42Å; D429-R432 PolarHBondContact O-N 3.24Å; R430-R432 VanDerWaalsContact C-N 3.27Å; R430-R432 PolarHBondContact O-N 2.82Å; R432-A435 PolarHBondContact O-N 3.43Å; R432-K436 WeakPolarHBondContact O-CG 3.21Å; R432-K436 PolarHBondContact O-N 3.22Å; R432-K436 VanDerWaalsContact O-N 3.08Å
433	E	80.4	Confident	81.8	Confident	103 Å²	103	87.4 Å²	87.4	48%	0.481	39%	0.391	S	S	.	.	H	α-helix	trans	-68.2	-41	175.9	-70	-54.1	135.6	0	0	112.2	D429 R430 A435 K436 E437	D429-E433 PolarHBondContact O-N 3.04Å; R430-E433 PolarHBondContact O-N 2.79Å; E433-A435 VanDerWaalsContact C-N 3.32Å; E433-A435 PolarHBondContact O-N 2.63Å; E433-K436 PolarHBondContact O-N 3.49Å; E433-K436 IonicContact OE1-NZ 2.7Å; E433-K436 PolarHBondContact OE1-NZ 2.76Å; E433-K436 IonicContact OE2-NZ 3.82Å; E433-E437 PolarHBondContact O-N 3.33Å; E433-E437 VanDerWaalsContact O-N 3.1Å
434	I	79.3	Confident	81.9	Confident	47 Å²	47	82.3 Å²	82.3	24%	0.241	37%	0.369	C	S	.	.	H	α-helix	trans	-62.1	-42	174.7	-66.9	166.1	0	0	0	110.8	R430 C431 K436 E437 W438	R430-I434 WeakPolarHBondContact O-CG1 3.32Å; R430-I434 PolarHBondContact O-N 2.91Å; C431-I434 PolarHBondContact O-N 3.21Å; I434-K436 PolarHBondContact O-N 2.93Å; I434-E437 PolarHBondContact O-N 2.95Å; I434-W438 PolarHBondContact O-N 2.91Å; I434-W438 VanDerWaalsContact O-N 3.11Å
435	A	78.5	Confident	81.8	Confident	11 Å²	11	77.6 Å²	77.6	9%	0.091	35%	0.35	C	S	.	.	H	α-helix	trans	-61.1	-42.7	176.4	0	0	0	0	0	112.2	Q336 C431 R432 E433 E437 W438 L439	Q336-A435 HydrophobicContact CB-CB 3.8Å; Q336-A435 HydrophobicContact CG-CB 4.44Å; Q336-A435 PolarHBondContact OE1-O 2.99Å; C431-A435 WeakPolarHBondContact O-CB 3.43Å; C431-A435 PolarHBondContact O-N 3.12Å; R432-A435 PolarHBondContact O-N 3.43Å; E433-A435 VanDerWaalsContact C-N 3.32Å; E433-A435 PolarHBondContact O-N 2.63Å; A435-E437 PolarHBondContact O-N 3.17Å; A435-W438 PolarHBondContact O-N 2.86Å; A435-L439 WeakPolarHBondContact O-CB 3.35Å; A435-L439 PolarHBondContact O-N 2.9Å
436	K	79.7	Confident	81.9	Confident	107 Å²	107	75 Å²	75	47%	0.465	34%	0.336	S	S	.	.	H	α-helix	trans	-60.4	-41.6	174.7	-73.6	173.2	-173.5	169.5	0	112.4	R432 E433 I434 L439 Q440	R432-K436 WeakPolarHBondContact O-CG 3.21Å; R432-K436 PolarHBondContact O-N 3.22Å; R432-K436 VanDerWaalsContact O-N 3.08Å; E433-K436 PolarHBondContact O-N 3.49Å; E433-K436 IonicContact OE1-NZ 2.7Å; E433-K436 PolarHBondContact OE1-NZ 2.76Å; E433-K436 IonicContact OE2-NZ 3.82Å; I434-K436 PolarHBondContact O-N 2.93Å; K436-L439 PolarHBondContact O-N 3.05Å; K436-Q440 PolarHBondContact O-N 3.27Å
437	E	80.6	Confident	82	Confident	68 Å²	68	72.4 Å²	72.4	32%	0.318	33%	0.326	S	S	.	.	H	α-helix	trans	-63.2	-45.8	177.7	-69.9	-160.4	152	0	0	111.5	V342 K347 E433 I434 A435 L439 Q440 V441	V342-E437 HydrophobicContact CG2-CB 4.01Å; K347-E437 IonicContact NZ-OE1 2.69Å; K347-E437 PolarHBondContact NZ-OE1 3.2Å; K347-E437 IonicContact NZ-OE2 3.4Å; K347-E437 PolarHBondContact NZ-OE2 2.93Å; E433-E437 PolarHBondContact O-N 3.33Å; E433-E437 VanDerWaalsContact O-N 3.1Å; I434-E437 PolarHBondContact O-N 2.95Å; A435-E437 PolarHBondContact O-N 3.17Å; E437-L439 VanDerWaalsContact C-N 3.35Å; E437-L439 PolarHBondContact O-N 3.36Å; E437-Q440 WeakPolarHBondContact O-CB 3.23Å; E437-Q440 PolarHBondContact O-N 3.4Å; E437-V441 WeakPolarHBondContact O-CG2 3.19Å; E437-V441 PolarHBondContact O-N 3.11Å
438	W	82.6	Confident	82.2	Confident	28 Å²	28	67.4 Å²	67.4	11%	0.106	31%	0.306	C	S	.	.	H	α-helix	trans	-65.4	-35.4	176.1	-83.7	110.4	0	0	0	113	L332 Q336 Q339 P340 V342 I434 A435 Q440 V441 G442	L332-W438 HydrophobicContact CD1-CE3 4.46Å; L332-W438 HydrophobicContact CD1-CZ3 4.13Å; L332-W438 HydrophobicContact CD2-CE3 3.95Å; L332-W438 HydrophobicContact CD2-CZ3 4.42Å; L332-W438 HydrophobicContact CG-CE3 4.13Å; L332-W438 HydrophobicContact CG-CZ3 4.24Å; Q336-W438 HydrophobicContact CG-CB 3.84Å; Q339-W438 HydrophobicContact CB-CZ2 4.42Å; Q339-W438 VanDerWaalsContact OE1-CE2 3.23Å; P340-W438 PolarHBondContact O-NE1 2.95Å; V342-W438 HydrophobicContact CG2-CD2 3.79Å; V342-W438 HydrophobicContact CG2-CE3 4.44Å; V342-W438 HydrophobicContact CG2-CG 3.93Å; V342-W438 HydrophobicContact CG2-CZ2 4.2Å; I434-W438 PolarHBondContact O-N 2.91Å; I434-W438 VanDerWaalsContact O-N 3.11Å; A435-W438 PolarHBondContact O-N 2.86Å; W438-Q440 VanDerWaalsContact C-N 3.32Å; W438-V441 HydrophobicContact CE3-CB 4.47Å; W438-V441 HydrophobicContact CE3-CG1 4.44Å; W438-V441 PolarHBondContact O-N 2.84Å; W438-G442 PolarHBondContact O-N 3.23Å
439	L	82.2	Confident	82.5	Confident	75 Å²	75	63.1 Å²	63.1	39%	0.393	29%	0.293	S	S	.	.	H	α-helix	trans	-62.6	-40.8	173	-168.1	127.8	0	0	0	111.3	Q336 A435 K436 E437 G442 Y443	Q336-L439 VanDerWaalsContact NE2-CB 3.32Å; A435-L439 WeakPolarHBondContact O-CB 3.35Å; A435-L439 PolarHBondContact O-N 2.9Å; K436-L439 PolarHBondContact O-N 3.05Å; E437-L439 VanDerWaalsContact C-N 3.35Å; E437-L439 PolarHBondContact O-N 3.36Å; L439-G442 PolarHBondContact O-N 3.24Å; L439-Y443 PolarHBondContact O-N 3.17Å
440	Q	81.4	Confident	82.7	Confident	99 Å²	99	61.1 Å²	61.1	46%	0.463	28%	0.28	S	S	.	.	H	α-helix	trans	-66.1	-41.7	175.4	-170.8	175.1	-1.6	0	0	112.1	L351 K436 E437 W438 Y443 V444	L351-Q440 HydrophobicContact CD2-CG 3.98Å; K436-Q440 PolarHBondContact O-N 3.27Å; E437-Q440 WeakPolarHBondContact O-CB 3.23Å; E437-Q440 PolarHBondContact O-N 3.4Å; W438-Q440 VanDerWaalsContact C-N 3.32Å; Q440-Y443 PolarHBondContact O-N 3.36Å; Q440-V444 WeakPolarHBondContact O-CG2 3.4Å; Q440-V444 PolarHBondContact O-N 2.93Å; Q440-V444 VanDerWaalsContact O-N 3.11Å
441	V	84.1	Confident	83.2	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-58.4	-49.2	172.6	173.5	0	0	0	0	110.5	V342 V346 I350 L351 E437 W438 Y443 V444 L445	V342-V441 HydrophobicContact CG1-CG2 4.1Å; V342-V441 HydrophobicContact CG2-CG2 4.34Å; V346-V441 HydrophobicContact CG1-CG1 4.15Å; I350-V441 HydrophobicContact CD1-CG1 4.04Å; I350-V441 HydrophobicContact CG2-CG1 4.24Å; L351-V441 HydrophobicContact CD1-CG2 3.54Å; E437-V441 WeakPolarHBondContact O-CG2 3.19Å; E437-V441 PolarHBondContact O-N 3.11Å; W438-V441 HydrophobicContact CE3-CB 4.47Å; W438-V441 HydrophobicContact CE3-CG1 4.44Å; W438-V441 PolarHBondContact O-N 2.84Å; V441-Y443 PolarHBondContact O-N 3.35Å; V441-V444 PolarHBondContact O-N 2.97Å; V441-L445 VanDerWaalsContact O-CB 3.31Å; V441-L445 WeakPolarHBondContact O-CB 3.14Å; V441-L445 PolarHBondContact O-N 3.24Å
442	G	84.3	Confident	83.9	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-59.2	-43.9	-179.8	0	0	0	0	0	112.7	W438 L439 L445 D446	W438-G442 PolarHBondContact O-N 3.23Å; L439-G442 PolarHBondContact O-N 3.24Å; G442-L445 PolarHBondContact O-N 3.24Å; G442-D446 WeakPolarHBondContact O-CB 3.29Å; G442-D446 PolarHBondContact O-N 2.8Å
443	Y	83.4	Confident	84.5	Confident	150 Å²	150	51.8 Å²	51.8	59%	0.588	25%	0.246	S	C	*	.	H	α-helix	trans	-64.1	-44.5	177.2	-178.6	-98.8	0	0	0	112.8	L439 Q440 V441 L445 D446 V447	L439-Y443 PolarHBondContact O-N 3.17Å; Q440-Y443 PolarHBondContact O-N 3.36Å; V441-Y443 PolarHBondContact O-N 3.35Å; Y443-L445 VanDerWaalsContact C-N 3.31Å; Y443-L445 PolarHBondContact O-N 3.05Å; Y443-D446 PolarHBondContact O-N 3.13Å; Y443-V447 HydrophobicContact CE1-CG2 4.11Å; Y443-V447 HydrophobicContact CE2-CG2 4.41Å; Y443-V447 WeakPolarHBondContact O-CG2 3.35Å; Y443-V447 PolarHBondContact O-N 3.27Å; Y443-V447 VanDerWaalsContact O-N 3.11Å
444	V	84.3	Confident	85.1	Confident	14 Å²	14	49.6 Å²	49.6	9%	0.085	24%	0.237	C	C	.	.	H	α-helix	trans	-65.7	-39.1	178.2	175.4	0	0	0	0	110.9	I350 P355 I360 Q440 V441 L448	I350-V444 HydrophobicContact CG2-CB 4.11Å; I350-V444 HydrophobicContact CG2-CG1 3.87Å; I350-V444 VanDerWaalsContact O-CG1 3.32Å; I350-V444 WeakPolarHBondContact O-CG1 3.31Å; P355-V444 HydrophobicContact CG-CG1 3.98Å; I360-V444 HydrophobicContact CD1-CG1 4.27Å; Q440-V444 WeakPolarHBondContact O-CG2 3.4Å; Q440-V444 PolarHBondContact O-N 2.93Å; Q440-V444 VanDerWaalsContact O-N 3.11Å; V441-V444 PolarHBondContact O-N 2.97Å; V444-L448 WeakPolarHBondContact O-CB 3.46Å; V444-L448 PolarHBondContact O-N 2.94Å
445	L	85.4	Confident	85.7	Confident	41 Å²	41	52 Å²	52	22%	0.215	25%	0.254	C	S	.	.	H	α-helix	trans	-65.8	-42.9	177.4	-173.7	62.9	0	0	0	111.9	I329 L332 V441 G442 Y443 L448 L449	I329-L445 HydrophobicContact CD1-CB 4.03Å; I329-L445 HydrophobicContact CD1-CD2 3.78Å; I329-L445 HydrophobicContact CD1-CG 3.81Å; L332-L445 HydrophobicContact CD1-CD2 4.49Å; V441-L445 VanDerWaalsContact O-CB 3.31Å; V441-L445 WeakPolarHBondContact O-CB 3.14Å; V441-L445 PolarHBondContact O-N 3.24Å; G442-L445 PolarHBondContact O-N 3.24Å; Y443-L445 VanDerWaalsContact C-N 3.31Å; Y443-L445 PolarHBondContact O-N 3.05Å; L445-L448 PolarHBondContact O-N 2.7Å; L445-L449 HydrophobicContact CD1-CD1 4.05Å; L445-L449 HydrophobicContact CD1-CG 4.15Å; L445-L449 HydrophobicContact CG-CD1 3.86Å; L445-L449 HydrophobicContact CG-CG 4.34Å; L445-L449 WeakPolarHBondContact O-CB 3.45Å; L445-L449 WeakPolarHBondContact O-CG 3.37Å; L445-L449 PolarHBondContact O-N 3.27Å
446	D	87.4	Confident	86.3	Confident	16 Å²	16	53.5 Å²	53.5	9%	0.086	27%	0.266	C	S	.	.	H	α-helix	trans	-59.8	-46.3	176.2	-173.1	55.5	0	0	0	111.6	R276 I329 G442 Y443 L448 L449 F450	R276-D446 IonicContact CZ-OD1 3.23Å; R276-D446 VanDerWaalsContact CZ-OD1 3.24Å; R276-D446 IonicContact NH1-OD1 2.75Å; R276-D446 PolarHBondContact NH1-OD1 3.48Å; R276-D446 IonicContact NH1-OD2 3.2Å; R276-D446 PolarHBondContact NH1-OD2 2.91Å; R276-D446 VanDerWaalsContact NH1-OD2 3.08Å; R276-D446 IonicContact NH2-OD1 2.79Å; R276-D446 PolarHBondContact NH2-OD1 3.49Å; I329-D446 HydrophobicContact CD1-CB 4.23Å; I329-D446 HydrophobicContact CG1-CB 4.39Å; I329-D446 HydrophobicContact CG2-CB 4.32Å; G442-D446 WeakPolarHBondContact O-CB 3.29Å; G442-D446 PolarHBondContact O-N 2.8Å; Y443-D446 PolarHBondContact O-N 3.13Å; D446-L448 VanDerWaalsContact C-N 3.33Å; D446-L448 PolarHBondContact O-N 2.92Å; D446-L449 PolarHBondContact O-N 2.92Å; D446-F450 VanDerWaalsContact O-CB 3.22Å; D446-F450 WeakPolarHBondContact O-CB 3.45Å; D446-F450 PolarHBondContact O-N 3.44Å
447	V	86.2	Confident	86.8	Confident	26 Å²	26	49 Å²	49	16%	0.158	25%	0.248	C	C	.	.	H	α-helix	trans	-64.7	-37	176.5	174.1	0	0	0	0	112	I360 Y443 R451	I360-V447 HydrophobicContact CD1-CB 4.22Å; I360-V447 HydrophobicContact CD1-CG1 3.76Å; I360-V447 HydrophobicContact CG1-CG1 3.93Å; I360-V447 HydrophobicContact CG2-CG1 4.32Å; Y443-V447 HydrophobicContact CE1-CG2 4.11Å; Y443-V447 HydrophobicContact CE2-CG2 4.41Å; Y443-V447 WeakPolarHBondContact O-CG2 3.35Å; Y443-V447 PolarHBondContact O-N 3.27Å; Y443-V447 VanDerWaalsContact O-N 3.11Å; V447-R451 WeakPolarHBondContact O-CG 3.3Å; V447-R451 PolarHBondContact O-N 3.05Å
448	L	86.8	Confident	87.3	Confident	32 Å²	32	49.9 Å²	49.9	17%	0.168	25%	0.254	C	S	.	.	H	α-helix	trans	-67.6	-50.3	178.3	179.9	146.7	0	0	0	111.3	A354 F358 V444 L445 D446 F450 R451 V452	A354-L448 HydrophobicContact CB-CD1 3.63Å; F358-L448 HydrophobicContact CD2-CD1 3.75Å; F358-L448 HydrophobicContact CD2-CG 4.32Å; F358-L448 HydrophobicContact CE2-CD1 3.69Å; F358-L448 HydrophobicContact CE2-CG 4.22Å; V444-L448 WeakPolarHBondContact O-CB 3.46Å; V444-L448 PolarHBondContact O-N 2.94Å; L445-L448 PolarHBondContact O-N 2.7Å; D446-L448 VanDerWaalsContact C-N 3.33Å; D446-L448 PolarHBondContact O-N 2.92Å; L448-F450 VanDerWaalsContact C-N 3.34Å; L448-R451 PolarHBondContact O-N 2.97Å; L448-V452 HydrophobicContact CD2-CG2 4.35Å; L448-V452 WeakPolarHBondContact O-CG2 3.41Å; L448-V452 PolarHBondContact O-N 3.14Å
449	L	88	Confident	87.7	Confident	55 Å²	55	50.9 Å²	50.9	29%	0.288	27%	0.268	S	S	.	.	H	α-helix	trans	-65.8	-39	-178.6	-68.7	174.8	0	0	0	111	E325 I329 L445 D446 R451 V452 Y453	E325-L449 HydrophobicContact CG-CB 4.01Å; E325-L449 HydrophobicContact CG-CD1 3.72Å; E325-L449 HydrophobicContact CG-CG 4.48Å; E325-L449 WeakPolarHBondContact OE1-CB 3.21Å; I329-L449 HydrophobicContact CD1-CD1 4.39Å; L445-L449 HydrophobicContact CD1-CD1 4.05Å; L445-L449 HydrophobicContact CD1-CG 4.15Å; L445-L449 HydrophobicContact CG-CD1 3.86Å; L445-L449 HydrophobicContact CG-CG 4.34Å; L445-L449 WeakPolarHBondContact O-CB 3.45Å; L445-L449 WeakPolarHBondContact O-CG 3.37Å; L445-L449 PolarHBondContact O-N 3.27Å; D446-L449 PolarHBondContact O-N 2.92Å; L449-R451 VanDerWaalsContact C-N 3.34Å; L449-R451 PolarHBondContact O-N 3.4Å; L449-V452 PolarHBondContact O-N 3.4Å; L449-Y453 WeakPolarHBondContact O-CB 3.29Å; L449-Y453 PolarHBondContact O-N 3.44Å
450	F	89.8	Confident	88.1	Confident	41 Å²	41	49.4 Å²	49.4	18%	0.18	26%	0.258	C	S	.	.	H	α-helix	trans	-56.4	-43.7	170.4	174.4	-114.8	0	0	0	113	I264 F267 F268 D446 L448 Y453 L454	I264-F450 HydrophobicContact CG2-CE2 4.1Å; I264-F450 HydrophobicContact CG2-CZ 4.32Å; F267-F450 HydrophobicContact CB-CD2 3.46Å; F267-F450 VanDerWaalsContact CB-CD2 3.46Å; F267-F450 HydrophobicContact CB-CE2 3.62Å; F267-F450 HydrophobicContact CB-CG 4.32Å; F267-F450 HydrophobicContact CD1-CB 4.04Å; F267-F450 AromaticContact CD1-CD2 3.61Å; F267-F450 HydrophobicContact CD1-CD2 3.61Å; F267-F450 HydrophobicContact CD1-CG 4.23Å; F267-F450 AromaticContact CD2-CD2 3.89Å; F267-F450 HydrophobicContact CD2-CD2 3.89Å; F267-F450 HydrophobicContact CD2-CE2 4.15Å; F267-F450 HydrophobicContact CE1-CB 4.41Å; F267-F450 HydrophobicContact CE1-CD2 4.25Å; F267-F450 HydrophobicContact CE2-CD2 4.48Å; F267-F450 AromaticContact CG-CD2 3.39Å; F267-F450 HydrophobicContact CG-CD2 3.39Å; F267-F450 AromaticContact CG-CE2 3.89Å; F267-F450 HydrophobicContact CG-CE2 3.89Å; F267-F450 HydrophobicContact CG-CG 4.37Å; F268-F450 HydrophobicContact CZ-CZ 4.32Å; D446-F450 VanDerWaalsContact O-CB 3.22Å; D446-F450 WeakPolarHBondContact O-CB 3.45Å; D446-F450 PolarHBondContact O-N 3.44Å; L448-F450 VanDerWaalsContact C-N 3.34Å; F450-Y453 PolarHBondContact O-N 3.39Å; F450-L454 HydrophobicContact CZ-CD1 4.38Å; F450-L454 WeakPolarHBondContact O-CB 3.3Å; F450-L454 PolarHBondContact O-N 3.4Å
451	R	89	Confident	88.3	Confident	88 Å²	88	48 Å²	48	33%	0.332	26%	0.259	S	S	.	.	H	α-helix	trans	-66.8	-41.1	178.1	-75.1	177	-176.2	-138.9	20.2	112.3	F358 C359 V447 L448 L449 Y453 L454 V455	F358-R451 PolarHBondContact O-NH1 3.27Å; F358-R451 PolarHBondContact O-NH2 2.84Å; C359-R451 PolarHBondContact O-NH2 3.24Å; C359-R451 VanDerWaalsContact O-NH2 3.16Å; V447-R451 WeakPolarHBondContact O-CG 3.3Å; V447-R451 PolarHBondContact O-N 3.05Å; L448-R451 PolarHBondContact O-N 2.97Å; L449-R451 VanDerWaalsContact C-N 3.34Å; L449-R451 PolarHBondContact O-N 3.4Å; R451-Y453 VanDerWaalsContact C-N 3.33Å; R451-L454 PolarHBondContact O-N 3.28Å; R451-V455 WeakPolarHBondContact O-CG2 3.49Å; R451-V455 PolarHBondContact O-N 2.88Å
452	V	89.4	Confident	88.6	Confident	74 Å²	74	52.8 Å²	52.8	45%	0.448	28%	0.283	S	S	.	.	H	α-helix	trans	-62.1	-44.8	175.4	173.1	0	0	0	0	110.1	L448 L449 V455 A456	L448-V452 HydrophobicContact CD2-CG2 4.35Å; L448-V452 WeakPolarHBondContact O-CG2 3.41Å; L448-V452 PolarHBondContact O-N 3.14Å; L449-V452 PolarHBondContact O-N 3.4Å; V452-V455 PolarHBondContact O-N 3.47Å; V452-A456 PolarHBondContact O-N 2.9Å
453	Y	91.9	Very high	88.6	Confident	9 Å²	9	56.1 Å²	56.1	4%	0.035	30%	0.303	C	S	.	.	H	α-helix	trans	-60.1	-46.9	175.7	-177	-104.5	0	0	0	112.1	D263 I264 F267 L318 L449 F450 R451 V455 A456 V457	D263-Y453 VanDerWaalsContact OD2-CE1 3.28Å; D263-Y453 WeakPolarHBondContact OD2-CE1 3.32Å; D263-Y453 PolarHBondContact OD2-OH 3.34Å; I264-Y453 HydrophobicContact CG1-CE1 4.37Å; F267-Y453 HydrophobicContact CD2-CD1 4.37Å; F267-Y453 HydrophobicContact CD2-CE1 4.47Å; F267-Y453 AromaticContact CE2-CD1 3.5Å; F267-Y453 HydrophobicContact CE2-CD1 3.5Å; F267-Y453 AromaticContact CE2-CE1 3.59Å; F267-Y453 HydrophobicContact CE2-CE1 3.59Å; F267-Y453 HydrophobicContact CE2-CG 4.19Å; F267-Y453 AromaticContact CZ-CD1 3.83Å; F267-Y453 HydrophobicContact CZ-CD1 3.83Å; F267-Y453 HydrophobicContact CZ-CE1 4.25Å; F267-Y453 HydrophobicContact CZ-CG 4.06Å; L318-Y453 HydrophobicContact CB-CE2 4.13Å; L318-Y453 HydrophobicContact CD2-CE2 4.4Å; L449-Y453 WeakPolarHBondContact O-CB 3.29Å; L449-Y453 PolarHBondContact O-N 3.44Å; F450-Y453 PolarHBondContact O-N 3.39Å; R451-Y453 VanDerWaalsContact C-N 3.33Å; Y453-V455 VanDerWaalsContact C-N 3.34Å; Y453-V455 PolarHBondContact O-N 3Å; Y453-A456 WeakPolarHBondContact O-CB 3.31Å; Y453-A456 PolarHBondContact O-N 3.07Å; Y453-A456 VanDerWaalsContact O-N 3.15Å; Y453-V457 HydrophobicContact CD1-CG2 4.18Å; Y453-V457 HydrophobicContact CE1-CG2 3.76Å; Y453-V457 HydrophobicContact CE2-CG2 4.13Å; Y453-V457 WeakPolarHBondContact O-CG2 3.4Å; Y453-V457 PolarHBondContact O-N 2.99Å
454	L	92.1	Very high	88.5	Confident	58 Å²	58	51.6 Å²	51.6	30%	0.304	29%	0.289	S	S	.	.	H	α-helix	trans	-58.6	-44.5	176.9	-170.3	86.3	0	0	0	111.7	I264 F450 R451 A456 V457 I458	I264-L454 HydrophobicContact CG2-CD1 4.4Å; F450-L454 HydrophobicContact CZ-CD1 4.38Å; F450-L454 WeakPolarHBondContact O-CB 3.3Å; F450-L454 PolarHBondContact O-N 3.4Å; R451-L454 PolarHBondContact O-N 3.28Å; L454-A456 VanDerWaalsContact C-N 3.33Å; L454-A456 PolarHBondContact O-N 3.28Å; L454-V457 PolarHBondContact O-N 2.89Å; L454-I458 HydrophobicContact CD2-CD1 4.03Å; L454-I458 HydrophobicContact CG-CD1 3.81Å; L454-I458 HydrophobicContact CG-CG1 4.47Å; L454-I458 WeakPolarHBondContact O-CB 3.32Å; L454-I458 VanDerWaalsContact O-CG1 3.25Å; L454-I458 WeakPolarHBondContact O-CG1 3.21Å; L454-I458 PolarHBondContact O-N 3.12Å
455	V	91.8	Very high	88.4	Confident	97 Å²	97	52.7 Å²	52.7	59%	0.588	30%	0.303	S	S	*	.	H	α-helix	trans	-62.4	-42.3	176.6	170.7	0	0	0	0	110.9	R451 V452 Y453 I458 A459	R451-V455 WeakPolarHBondContact O-CG2 3.49Å; R451-V455 PolarHBondContact O-N 2.88Å; V452-V455 PolarHBondContact O-N 3.47Å; Y453-V455 VanDerWaalsContact C-N 3.34Å; Y453-V455 PolarHBondContact O-N 3Å; V455-I458 PolarHBondContact O-N 3.49Å; V455-A459 VanDerWaalsContact O-CB 3.23Å; V455-A459 WeakPolarHBondContact O-CB 3.12Å; V455-A459 PolarHBondContact O-N 2.86Å
456	A	91.2	Very high	88.4	Confident	43 Å²	43	54.3 Å²	54.3	36%	0.355	32%	0.315	S	S	.	.	H	α-helix	trans	-61.9	-45.8	176.9	0	0	0	0	0	111.9	V452 Y453 L454 Y460	V452-A456 PolarHBondContact O-N 2.9Å; Y453-A456 WeakPolarHBondContact O-CB 3.31Å; Y453-A456 PolarHBondContact O-N 3.07Å; Y453-A456 VanDerWaalsContact O-N 3.15Å; L454-A456 VanDerWaalsContact C-N 3.33Å; L454-A456 PolarHBondContact O-N 3.28Å; A456-Y460 VanDerWaalsContact O-CB 3.26Å; A456-Y460 WeakPolarHBondContact O-CB 3.2Å; A456-Y460 PolarHBondContact O-N 2.98Å
457	V	91.2	Very high	87.9	Confident	13 Å²	13	58.3 Å²	58.3	8%	0.079	34%	0.336	C	S	.	.	H	α-helix	trans	-64.6	-44.6	177.6	175.4	0	0	0	0	111.4	I264 L318 Y453 L454 Y460 S461	I264-V457 HydrophobicContact CD1-CG1 4.27Å; L318-V457 HydrophobicContact CD1-CG2 4.44Å; Y453-V457 HydrophobicContact CD1-CG2 4.18Å; Y453-V457 HydrophobicContact CE1-CG2 3.76Å; Y453-V457 HydrophobicContact CE2-CG2 4.13Å; Y453-V457 WeakPolarHBondContact O-CG2 3.4Å; Y453-V457 PolarHBondContact O-N 2.99Å; L454-V457 PolarHBondContact O-N 2.89Å; V457-Y460 WeakPolarHBondContact O-CB 3.23Å; V457-Y460 PolarHBondContact O-N 3.25Å; V457-S461 PolarHBondContact O-N 3.45Å; V457-S461 PolarHBondContact O-OG 3.45Å; V457-S461 VanDerWaalsContact O-OG 3.09Å
458	I	91.3	Very high	87.4	Confident	85 Å²	85	62.9 Å²	62.9	44%	0.436	35%	0.35	S	S	.	.	H	α-helix	trans	-63.9	-47.6	178.4	-70.4	169.4	0	0	0	110.9	L454 V455 Y460 S461 I462	L454-I458 HydrophobicContact CD2-CD1 4.03Å; L454-I458 HydrophobicContact CG-CD1 3.81Å; L454-I458 HydrophobicContact CG-CG1 4.47Å; L454-I458 WeakPolarHBondContact O-CB 3.32Å; L454-I458 VanDerWaalsContact O-CG1 3.25Å; L454-I458 WeakPolarHBondContact O-CG1 3.21Å; L454-I458 PolarHBondContact O-N 3.12Å; V455-I458 PolarHBondContact O-N 3.49Å; I458-Y460 PolarHBondContact O-N 3.14Å; I458-S461 PolarHBondContact O-N 3.16Å; I458-I462 HydrophobicContact CG2-CD1 3.67Å; I458-I462 HydrophobicContact CG2-CG1 4.33Å; I458-I462 VanDerWaalsContact O-CG1 3.28Å; I458-I462 WeakPolarHBondContact O-CG1 3.45Å; I458-I462 PolarHBondContact O-N 3.07Å
459	A	90.8	Very high	86.9	Confident	49 Å²	49	64.6 Å²	64.6	41%	0.405	37%	0.365	S	S	.	.	H	α-helix	trans	-56.9	-44.3	177.1	0	0	0	0	0	110.5	V455 I462 T463	V455-A459 VanDerWaalsContact O-CB 3.23Å; V455-A459 WeakPolarHBondContact O-CB 3.12Å; V455-A459 PolarHBondContact O-N 2.86Å; A459-I462 PolarHBondContact O-N 2.98Å; A459-T463 WeakPolarHBondContact O-CG2 3.35Å; A459-T463 PolarHBondContact O-N 3.01Å; A459-T463 PolarHBondContact O-OG1 2.85Å
460	Y	89.5	Confident	86.3	Confident	45 Å²	45	67 Å²	67	18%	0.176	38%	0.382	C	S	.	.	H	α-helix	trans	-62.6	-46.9	176.5	-176.3	-115.8	0	0	0	112.9	Y311 V314 L318 A456 V457 I458 I462 T463 L464	Y311-Y460 WeakPolarHBondContact CA-OH 3.43Å; Y311-Y460 AromaticContact CD2-CE1 3.57Å; Y311-Y460 HydrophobicContact CD2-CE1 3.57Å; Y311-Y460 HydrophobicContact CD2-CE2 4.38Å; Y311-Y460 AromaticContact CD2-CZ 3.34Å; Y311-Y460 WeakPolarHBondContact CD2-OH 3.3Å; Y311-Y460 HydrophobicContact CE2-CD1 4.33Å; Y311-Y460 AromaticContact CE2-CE1 3.31Å; Y311-Y460 HydrophobicContact CE2-CE1 3.31Å; Y311-Y460 AromaticContact CE2-CZ 3.65Å; Y311-Y460 WeakPolarHBondContact CE2-OH 3.39Å; Y311-Y460 PolarHBondContact O-OH 3.28Å; V314-Y460 HydrophobicContact CB-CE2 4.22Å; V314-Y460 HydrophobicContact CG1-CD2 4.2Å; V314-Y460 HydrophobicContact CG1-CE1 4.45Å; V314-Y460 HydrophobicContact CG1-CE2 3.66Å; L318-Y460 HydrophobicContact CD1-CD1 4.49Å; A456-Y460 VanDerWaalsContact O-CB 3.26Å; A456-Y460 WeakPolarHBondContact O-CB 3.2Å; A456-Y460 PolarHBondContact O-N 2.98Å; V457-Y460 WeakPolarHBondContact O-CB 3.23Å; V457-Y460 PolarHBondContact O-N 3.25Å; I458-Y460 PolarHBondContact O-N 3.14Å; Y460-I462 VanDerWaalsContact C-N 3.31Å; Y460-I462 PolarHBondContact O-N 3.03Å; Y460-T463 WeakPolarHBondContact CA-OG1 3.38Å; Y460-T463 PolarHBondContact O-N 3.39Å; Y460-T463 PolarHBondContact O-OG1 3.42Å; Y460-L464 PolarHBondContact O-N 2.95Å
461	S	87.4	Confident	85.1	Confident	70 Å²	70	68 Å²	68	49%	0.49	38%	0.384	S	S	.	.	H	α-helix	trans	-60.4	-38.1	175.4	-61.2	0	0	0	0	112.7	V457 I458 L464 G465	V457-S461 PolarHBondContact O-N 3.45Å; V457-S461 PolarHBondContact O-OG 3.45Å; V457-S461 VanDerWaalsContact O-OG 3.09Å; I458-S461 PolarHBondContact O-N 3.16Å; S461-L464 PolarHBondContact O-N 3.46Å; S461-G465 PolarHBondContact O-N 3.37Å
462	I	88.7	Confident	84	Confident	101 Å²	101	70.1 Å²	70.1	52%	0.518	40%	0.398	S	S	.	.	H	α-helix	trans	-66.9	-43.9	175.7	-66.9	166.6	0	0	0	110.6	I458 A459 Y460 L464 G465 T466	I458-I462 HydrophobicContact CG2-CD1 3.67Å; I458-I462 HydrophobicContact CG2-CG1 4.33Å; I458-I462 VanDerWaalsContact O-CG1 3.28Å; I458-I462 WeakPolarHBondContact O-CG1 3.45Å; I458-I462 PolarHBondContact O-N 3.07Å; A459-I462 PolarHBondContact O-N 2.98Å; Y460-I462 VanDerWaalsContact C-N 3.31Å; Y460-I462 PolarHBondContact O-N 3.03Å; I462-L464 VanDerWaalsContact C-N 3.27Å; I462-L464 PolarHBondContact O-N 3.33Å; I462-G465 PolarHBondContact O-N 2.93Å; I462-T466 HydrophobicContact CG2-CG2 4.27Å; I462-T466 WeakPolarHBondContact O-CB 3.2Å; I462-T466 WeakPolarHBondContact O-CG2 3.47Å; I462-T466 PolarHBondContact O-N 2.88Å; I462-T466 PolarHBondContact O-OG1 2.95Å
463	T	85.9	Confident	82.5	Confident	71 Å²	71	72.7 Å²	72.7	44%	0.436	41%	0.413	S	S	.	.	H	α-helix	trans	-60.6	-39.1	176.4	57.5	0	0	0	0	111.7	A459 Y460 T466 L467	A459-T463 WeakPolarHBondContact O-CG2 3.35Å; A459-T463 PolarHBondContact O-N 3.01Å; A459-T463 PolarHBondContact O-OG1 2.85Å; Y460-T463 WeakPolarHBondContact CA-OG1 3.38Å; Y460-T463 PolarHBondContact O-N 3.39Å; Y460-T463 PolarHBondContact O-OG1 3.42Å; T463-T466 WeakPolarHBondContact CA-OG1 3.26Å; T463-T466 PolarHBondContact O-OG1 3.39Å; T463-L467 WeakPolarHBondContact O-CB 3.48Å; T463-L467 WeakPolarHBondContact O-CD1 3.04Å; T463-L467 VanDerWaalsContact O-CG 3.27Å; T463-L467 WeakPolarHBondContact O-CG 3.46Å; T463-L467 PolarHBondContact O-N 3.06Å
464	L	81.3	Confident	80.3	Confident	56 Å²	56	78 Å²	78	29%	0.293	46%	0.459	S	S	.	.	H	α-helix	trans	-66.5	-46.3	175.3	-171.1	74.8	0	0	0	111.9	Y311 Y460 S461 I462 T466 L467 W468	Y311-L464 HydrophobicContact CD2-CD1 3.81Å; Y311-L464 HydrophobicContact CD2-CD2 4.09Å; Y311-L464 HydrophobicContact CE2-CD1 4.22Å; Y311-L464 HydrophobicContact CE2-CD2 3.61Å; Y311-L464 HydrophobicContact CE2-CG 4.44Å; Y460-L464 PolarHBondContact O-N 2.95Å; S461-L464 PolarHBondContact O-N 3.46Å; I462-L464 VanDerWaalsContact C-N 3.27Å; I462-L464 PolarHBondContact O-N 3.33Å; L464-T466 VanDerWaalsContact C-N 3.32Å; L464-T466 PolarHBondContact O-N 2.96Å; L464-L467 PolarHBondContact O-N 3.03Å; L464-W468 WeakPolarHBondContact O-CB 2.94Å; L464-W468 PolarHBondContact O-N 2.91Å
465	G	82.3	Confident	79.7	Confident	37 Å²	37	79 Å²	79	38%	0.381	47%	0.467	S	S	.	.	H	α-helix	trans	-63.4	-37.5	179.4	0	0	0	0	0	112.9	S461 I462 W468 S469	S461-G465 PolarHBondContact O-N 3.37Å; I462-G465 PolarHBondContact O-N 2.93Å; G465-W468 PolarHBondContact O-N 3.5Å; G465-S469 WeakPolarHBondContact O-CB 3.27Å; G465-S469 PolarHBondContact O-N 2.94Å
466	T	83.9	Confident	79.1	Confident	74 Å²	74	78 Å²	78	45%	0.454	46%	0.46	S	S	.	.	H	α-helix	trans	-69.6	-43.4	175.4	50.2	0	0	0	0	111.9	I462 T463 L464 W468 S469 V470	I462-T466 HydrophobicContact CG2-CG2 4.27Å; I462-T466 WeakPolarHBondContact O-CB 3.2Å; I462-T466 WeakPolarHBondContact O-CG2 3.47Å; I462-T466 PolarHBondContact O-N 2.88Å; I462-T466 PolarHBondContact O-OG1 2.95Å; T463-T466 WeakPolarHBondContact CA-OG1 3.26Å; T463-T466 PolarHBondContact O-OG1 3.39Å; L464-T466 VanDerWaalsContact C-N 3.32Å; L464-T466 PolarHBondContact O-N 2.96Å; T466-W468 VanDerWaalsContact C-N 3.28Å; T466-W468 PolarHBondContact O-N 3.37Å; T466-S469 PolarHBondContact O-N 3.47Å; T466-V470 WeakPolarHBondContact O-CB 3.46Å; T466-V470 VanDerWaalsContact O-CG2 3.3Å; T466-V470 WeakPolarHBondContact O-CG2 3.25Å; T466-V470 PolarHBondContact O-N 3.09Å
467	L	77.6	Confident	78.4	Confident	100 Å²	100	79.9 Å²	79.9	52%	0.524	47%	0.466	S	S	.	.	H	α-helix	trans	-57.4	-42.8	172.3	-76.4	166.6	0	0	0	111.6	T463 L464 W471	T463-L467 WeakPolarHBondContact O-CB 3.48Å; T463-L467 WeakPolarHBondContact O-CD1 3.04Å; T463-L467 VanDerWaalsContact O-CG 3.27Å; T463-L467 WeakPolarHBondContact O-CG 3.46Å; T463-L467 PolarHBondContact O-N 3.06Å; L464-L467 PolarHBondContact O-N 3.03Å; L467-W471 WeakPolarHBondContact O-CB 3.44Å; L467-W471 PolarHBondContact O-N 3.46Å; L467-W471 VanDerWaalsContact O-N 3.12Å
468	W	75.2	Confident	77.7	Confident	123 Å²	123	83.9 Å²	83.9	47%	0.466	49%	0.489	S	S	.	.	H	α-helix	trans	-66.2	-42.4	177.6	-169.4	60.1	0	0	0	112.7	F169 L464 G465 T466 W471 Q472	F169-W468 AromaticContact CE1-NE1 3.51Å; F169-W468 AromaticContact CE2-CD1 3.61Å; F169-W468 AromaticContact CE2-NE1 3.75Å; F169-W468 AromaticContact CZ-CD1 3.45Å; F169-W468 VanDerWaalsContact CZ-CD1 3.45Å; F169-W468 AromaticContact CZ-NE1 3.06Å; L464-W468 WeakPolarHBondContact O-CB 2.94Å; L464-W468 PolarHBondContact O-N 2.91Å; G465-W468 PolarHBondContact O-N 3.5Å; T466-W468 VanDerWaalsContact C-N 3.28Å; T466-W468 PolarHBondContact O-N 3.37Å; W468-W471 PolarHBondContact O-N 3.23Å; W468-Q472 PolarHBondContact O-N 3.47Å
469	S	76	Confident	76.8	Confident	67 Å²	67	83.8 Å²	83.8	47%	0.469	49%	0.492	S	S	.	.	H	α-helix	trans	-68.1	-40.7	178.6	-178	0	0	0	0	112.9	G465 T466 W471 Q472 V473	G465-S469 WeakPolarHBondContact O-CB 3.27Å; G465-S469 PolarHBondContact O-N 2.94Å; T466-S469 PolarHBondContact O-N 3.47Å; S469-W471 PolarHBondContact O-N 3.38Å; S469-Q472 PolarHBondContact O-N 3.37Å; S469-V473 WeakPolarHBondContact O-CG2 3.28Å
470	V	75.8	Confident	75.9	Confident	107 Å²	107	86.1 Å²	86.1	65%	0.648	50%	0.498	S	S	*	.	H	α-helix	trans	-61.5	-37.8	174.7	169.5	0	0	0	0	109.7	T466 A474	T466-V470 WeakPolarHBondContact O-CB 3.46Å; T466-V470 VanDerWaalsContact O-CG2 3.3Å; T466-V470 WeakPolarHBondContact O-CG2 3.25Å; T466-V470 PolarHBondContact O-N 3.09Å; V470-A474 PolarHBondContact O-N 3.24Å
471	W	65.3	Low	74.9	Confident	61 Å²	61	89.1 Å²	89.1	23%	0.231	52%	0.521	C	S	.	.	H	α-helix	trans	-72.7	-39.6	-179.3	-174.9	86.4	0	0	0	113.7	F169 L467 W468 S469 V473 A474	F169-W471 VanDerWaalsContact C-CZ2 3.46Å; F169-W471 HydrophobicContact CB-CD2 3.64Å; F169-W471 HydrophobicContact CB-CE3 3.88Å; F169-W471 HydrophobicContact CB-CG 4.35Å; F169-W471 HydrophobicContact CB-CH2 3.62Å; F169-W471 HydrophobicContact CB-CZ2 3.37Å; F169-W471 HydrophobicContact CB-CZ3 3.88Å; F169-W471 HydrophobicContact CD1-CD2 4.21Å; F169-W471 AromaticContact CD1-CE3 3.53Å; F169-W471 HydrophobicContact CD1-CE3 3.53Å; F169-W471 AromaticContact CD1-CH2 3.41Å; F169-W471 HydrophobicContact CD1-CH2 3.41Å; F169-W471 VanDerWaalsContact CD1-CH2 3.41Å; F169-W471 HydrophobicContact CD1-CZ2 4.12Å; F169-W471 AromaticContact CD1-CZ3 3.08Å; F169-W471 HydrophobicContact CD1-CZ3 3.08Å; F169-W471 HydrophobicContact CE1-CE3 4.19Å; F169-W471 HydrophobicContact CE1-CH2 4.45Å; F169-W471 AromaticContact CE1-CZ3 3.8Å; F169-W471 HydrophobicContact CE1-CZ3 3.8Å; F169-W471 HydrophobicContact CG-CD2 4.01Å; F169-W471 AromaticContact CG-CE3 3.77Å; F169-W471 HydrophobicContact CG-CE3 3.77Å; F169-W471 AromaticContact CG-CH2 3.92Å; F169-W471 HydrophobicContact CG-CH2 3.92Å; F169-W471 HydrophobicContact CG-CZ2 4.17Å; F169-W471 AromaticContact CG-CZ3 3.73Å; F169-W471 HydrophobicContact CG-CZ3 3.73Å; F169-W471 WeakPolarHBondContact O-CZ2 3.36Å; F169-W471 PolarHBondContact O-NE1 3.47Å; L467-W471 WeakPolarHBondContact O-CB 3.44Å; L467-W471 PolarHBondContact O-N 3.46Å; L467-W471 VanDerWaalsContact O-N 3.12Å; W468-W471 PolarHBondContact O-N 3.23Å; S469-W471 PolarHBondContact O-N 3.38Å; W471-V473 PolarHBondContact O-N 3.24Å; W471-V473 VanDerWaalsContact O-N 3.13Å; W471-A474 PolarHBondContact O-N 3.41Å; W471-A474 VanDerWaalsContact O-OXT 3.09Å
472	Q	65	Low	74	Confident	133 Å²	133	90.5 Å²	90.5	62%	0.621	52%	0.523	S	S	*	.	H	α-helix	trans	-62.2	-23.5	177.8	-170.4	178.4	-14.8	0	0	112.9	W468 S469	W468-Q472 PolarHBondContact O-N 3.47Å; S469-Q472 PolarHBondContact O-N 3.37Å
473	V	58.9	Low	72.8	Confident	127 Å²	127	89.7 Å²	89.7	77%	0.77	52%	0.524	S	S	*	.	H	α-helix	trans	-90.7	-21	-179.2	177.2	0	0	0	0	112.6	S469 W471	S469-V473 WeakPolarHBondContact O-CG2 3.28Å; W471-V473 PolarHBondContact O-N 3.24Å; W471-V473 VanDerWaalsContact O-N 3.13Å
474	A	45.9	Very low	71.6	Confident	120 Å²	120	91.4 Å²	91.4	99%	0.992	53%	0.532	S	S	*	.			trans	-90.9	0	179.2	0	0	0	0	0	111.7	V470 W471	V470-A474 PolarHBondContact O-N 3.24Å; W471-A474 PolarHBondContact O-N 3.41Å; W471-A474 VanDerWaalsContact O-OXT 3.09Å

Retrieved 474 of 474 residues in 207.6 ms (Link to these results)

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