A0A077Z677_TRITR Loading...

Poly(A) RNA polymerase mitochondrial-like central palm domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z677, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 691 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.6	Very low	28.5	Very low	226 Å²	226	149 Å²	149	100%	1.113	83%	0.833	S	S	*	*				0	50.5	0	-59.2	-162.2	-175.6	0	0	106.6
2	D	31.5	Very low	28.6	Very low	147 Å²	147	145.8 Å²	145.8	79%	0.786	82%	0.823	S	S	*	*				74.4	122.6	82.6	-61.9	1.9	0	0	0	107.7
3	T	27.4	Very low	28.2	Very low	117 Å²	117	147.9 Å²	147.9	72%	0.718	83%	0.831	S	S	*	*			cis	-165.9	172.3	1.2	15.4	0	0	0	0	105.4
4	D	27.2	Very low	28.2	Very low	149 Å²	149	142.9 Å²	142.9	80%	0.797	83%	0.829	S	S	*	*			trans	88.5	101.3	163.3	-54	-29.1	0	0	0	118.9
5	S	28.6	Very low	28.1	Very low	109 Å²	109	139.4 Å²	139.4	76%	0.762	82%	0.824	S	S	*	*				170.5	94.2	115.2	44.3	0	0	0	0	110.2	Q7	S5-Q7 PolarHBondContact O-N 2.99Å
6	N	30	Very low	27.9	Very low	175 Å²	175	141.5 Å²	141.5	94%	0.936	83%	0.83	S	S	*	*			trans	-75.5	113.1	166.7	-102.5	-17.7	0	0	0	109.5	S8	N6-S8 PolarHBondContact O-N 3.33Å
7	Q	29.1	Very low	27.9	Very low	186 Å²	186	140 Å²	140	87%	0.869	83%	0.829	S	S	*	*			trans	-65	116.8	176.2	-68.7	173.3	-7.7	0	0	110.6	S5	S5-Q7 PolarHBondContact O-N 2.99Å
8	S	28.6	Very low	27.7	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	83%	0.834	S	S	*	*			trans	-85.6	124.9	160.4	169	0	0	0	0	109	N6	N6-S8 PolarHBondContact O-N 3.33Å
9	T	29.1	Very low	27.6	Very low	134 Å²	134	134.9 Å²	134.9	82%	0.822	83%	0.829	S	S	*	*			trans	-23.4	128.1	171.7	-2.1	0	0	0	0	117.2
10	I	25.8	Very low	27.7	Very low	153 Å²	153	133.5 Å²	133.5	79%	0.785	83%	0.831	S	S	*	*			trans	-68.1	128.2	173	-64.1	161.6	0	0	0	110.6
11	V	28	Very low	27.7	Very low	134 Å²	134	132.1 Å²	132.1	81%	0.812	83%	0.827	S	S	*	*			trans	-134.2	126.8	147.5	-178.7	0	0	0	0	107.3
12	P	29.5	Very low	27.7	Very low	110 Å²	110	130.7 Å²	130.7	71%	0.714	81%	0.814	S	S	*	*			trans	-83.7	144.8	-166.1	6.3	10.4	0	0	0	113.1	G14	P12-G14 PolarHBondContact O-N 2.98Å
13	N	24	Very low	28	Very low	174 Å²	174	135.2 Å²	135.2	93%	0.93	82%	0.82	S	S	*	*			trans	-57	113.7	164.2	-84.1	-31.4	0	0	0	110.8
14	G	27.4	Very low	28.8	Very low	77 Å²	77	135.8 Å²	135.8	79%	0.794	82%	0.824	S	S	*	*			trans	-103.6	120.4	170.8	0	0	0	0	0	110.9	P12	P12-G14 PolarHBondContact O-N 2.98Å
15	A	27.4	Very low	30.5	Very low	91 Å²	91	136.1 Å²	136.1	75%	0.752	82%	0.818	S	S	*	*			trans	-66.4	155	-176.9	0	0	0	0	0	114.4	S17	A15-S17 PolarHBondContact O-N 3.31Å
16	N	24	Very low	32.6	Very low	173 Å²	173	134 Å²	134	93%	0.925	80%	0.798	S	S	*	*			trans	-3.6	110.9	151.1	-66.9	-29.7	0	0	0	116.3
17	S	28.9	Very low	35	Very low	116 Å²	116	126.6 Å²	126.6	81%	0.811	76%	0.759	S	S	*	*			trans	-138.4	120.3	150.7	52.6	0	0	0	0	110.5	A15	A15-S17 PolarHBondContact O-N 3.31Å
18	A	24.6	Very low	37.6	Very low	112 Å²	112	118.9 Å²	118.9	93%	0.926	73%	0.725	S	S	*	*			trans	-61.5	137.1	168.9	0	0	0	0	0	110
19	G	25.3	Very low	40.2	Very low	71 Å²	71	113.7 Å²	113.7	73%	0.732	69%	0.689	S	S	*	*			trans	155.7	41.1	174.1	0	0	0	0	0	116.6	S21	G19-S21 PolarHBondContact O-N 3.35Å
20	A	28.4	Very low	42.9	Very low	106 Å²	106	108.7 Å²	108.7	88%	0.876	66%	0.657	S	S	*	*			trans	-71.2	83	164.1	0	0	0	0	0	109	K22	A20-K22 PolarHBondContact O-N 2.83Å; A20-K22 VanDerWaalsContact O-N 3.11Å
21	S	27.8	Very low	45.7	Very low	105 Å²	105	101.4 Å²	101.4	73%	0.734	62%	0.62	S	S	*	*			trans	-49.5	116.5	169.5	175	0	0	0	0	109.1	G19 R23	G19-S21 PolarHBondContact O-N 3.35Å; S21-R23 VanDerWaalsContact C-N 3.3Å; S21-R23 PolarHBondContact O-N 3.4Å
22	K	29.8	Very low	48.3	Very low	196 Å²	196	96.6 Å²	96.6	85%	0.852	59%	0.59	S	S	*	*			trans	-58.1	94.6	169.3	-77.8	174.6	177.7	169.3	0	107.4	A20 T24	A20-K22 PolarHBondContact O-N 2.83Å; A20-K22 VanDerWaalsContact O-N 3.11Å; K22-T24 PolarHBondContact O-N 3.3Å
23	R	36.3	Very low	50.8	Low	242 Å²	242	91.6 Å²	91.6	91%	0.913	56%	0.558	S	S	*	*			trans	-55.5	101.4	166.8	-92.3	-177.5	171.4	171.7	-2.2	107.9	S21 K25	S21-R23 VanDerWaalsContact C-N 3.3Å; S21-R23 PolarHBondContact O-N 3.4Å; R23-K25 PolarHBondContact O-N 3.23Å; R23-K25 VanDerWaalsContact O-N 3.11Å
24	T	44.7	Very low	53.1	Low	130 Å²	130	90.2 Å²	90.2	80%	0.798	54%	0.54	S	S	*	.			trans	-57.7	113.4	170.8	17.4	0	0	0	0	107.5	K22 L26	K22-T24 PolarHBondContact O-N 3.3Å; T24-L26 PolarHBondContact O-N 3.48Å; T24-L26 VanDerWaalsContact O-N 3.16Å
25	K	62.5	Low	55.1	Low	156 Å²	156	93.8 Å²	93.8	68%	0.678	53%	0.534	S	S	*	.			trans	-67.6	113.7	-174.9	-159.4	-179.9	-173.6	-172.1	0	108.6	R23	R23-K25 PolarHBondContact O-N 3.23Å; R23-K25 VanDerWaalsContact O-N 3.11Å
26	L	74.4	Confident	56.7	Low	64 Å²	64	98.5 Å²	98.5	34%	0.335	53%	0.532	S	S	.	.			trans	-62.5	139.1	-178.1	-71.8	167.3	0	0	0	111.5	T24 T28 V57 Q72	T24-L26 PolarHBondContact O-N 3.48Å; T24-L26 VanDerWaalsContact O-N 3.16Å; L26-T28 PolarHBondContact O-N 2.8Å; L26-T28 PolarHBondContact O-OG1 3.03Å; L26-V57 HydrophobicContact CD1-CB 4.04Å; L26-V57 HydrophobicContact CD1-CG1 3.68Å; L26-V57 HydrophobicContact CD1-CG2 4.17Å; L26-V57 HydrophobicContact CD2-CG2 4.46Å; L26-Q72 HydrophobicContact CB-CB 4.34Å
27	P	79.8	Confident	58.4	Low	19 Å²	19	97 Å²	97	12%	0.123	52%	0.524	C	S	.	.			trans	-62.5	122.8	179.8	23.4	-31.1	0	0	0	110.6	Q72 F73 S75 L79	P27-Q72 WeakPolarHBondContact O-CA 3.38Å; P27-F73 VanDerWaalsContact CD-O 3.29Å; P27-F73 WeakPolarHBondContact CD-O 3.22Å; P27-F73 HydrophobicContact CG-CB 4.18Å; P27-F73 WeakPolarHBondContact CG-O 3.36Å; P27-F73 PolarHBondContact O-N 3.23Å; P27-S75 WeakPolarHBondContact CG-O 3.32Å; P27-L79 HydrophobicContact CB-CB 4.02Å; P27-L79 HydrophobicContact CB-CD2 3.55Å; P27-L79 HydrophobicContact CB-CG 4.45Å
28	T	82.8	Confident	60.4	Low	25 Å²	25	92.6 Å²	92.6	15%	0.153	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	134.4	-171.5	-48.5	0	0	0	0	112.2	L26 R70 L71 Q72 A100	L26-T28 PolarHBondContact O-N 2.8Å; L26-T28 PolarHBondContact O-OG1 3.03Å; T28-R70 HydrophobicContact CG2-CB 4.18Å; T28-L71 CarbonylContact C-O 3.58Å; T28-L71 VanDerWaalsContact CA-O 3.23Å; T28-L71 WeakPolarHBondContact CA-O 3.31Å; T28-L71 WeakPolarHBondContact CG2-O 3.36Å; T28-Q72 HydrophobicContact CG2-CG 4.03Å; T28-A100 HydrophobicContact CG2-CB 3.49Å; T28-A100 VanDerWaalsContact CG2-CB 3.49Å; T28-A100 VanDerWaalsContact O-CB 3.24Å; T28-A100 WeakPolarHBondContact O-CB 3.46Å; T28-A100 PolarHBondContact O-N 2.74Å
29	A	84.6	Confident	62.8	Low	0 Å²	0	91.2 Å²	91.2	0%	0	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	146.6	166.7	0	0	0	0	0	111.6	L31 R70 L71 F73 L79 V97 L98	A29-L31 HydrophobicContact CB-CD2 4.45Å; A29-R70 CarbonylContact O-C 3.36Å; A29-R70 WeakPolarHBondContact O-CA 3.26Å; A29-L71 HydrophobicContact CB-CB 4.3Å; A29-L71 PolarHBondContact N-O 3.03Å; A29-L71 PolarHBondContact O-N 3.01Å; A29-F73 HydrophobicContact CB-CE2 3.96Å; A29-L79 HydrophobicContact CB-CD1 3.59Å; A29-V97 HydrophobicContact CB-CG1 4.29Å; A29-L98 CarbonylContact C-O 3.52Å; A29-L98 WeakPolarHBondContact CA-O 3.2Å
30	L	84.1	Confident	65.5	Low	29 Å²	29	88.2 Å²	88.2	15%	0.152	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	118.4	169.9	175.5	70.7	0	0	0	108.2	V32 R70 L98 A100	L30-V32 HydrophobicContact CD2-CG2 4.47Å; L30-V32 HydrophobicContact CG-CG2 4.25Å; L30-R70 HydrophobicContact CD1-CG 4.1Å; L30-L98 HydrophobicContact CB-CB 4.24Å; L30-L98 HydrophobicContact CD2-CD1 4.21Å; L30-L98 PolarHBondContact N-O 3.04Å; L30-L98 WeakPolarHBondContact O-CB 3.37Å; L30-L98 PolarHBondContact O-N 2.84Å; L30-A100 HydrophobicContact CB-CB 3.9Å
31	L	85.3	Confident	68.2	Low	0 Å²	0	87.9 Å²	87.9	0%	0	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	134.8	179.5	-56.3	-174.2	0	0	0	109.8	A29 I45 F49 K68 M69 L71 I95 R96 V97	A29-L31 HydrophobicContact CB-CD2 4.45Å; L31-I45 HydrophobicContact CD1-CG2 3.5Å; L31-F49 HydrophobicContact CD1-CD2 4.36Å; L31-F49 HydrophobicContact CD1-CE1 4.35Å; L31-F49 HydrophobicContact CD1-CE2 3.75Å; L31-F49 HydrophobicContact CD1-CZ 3.72Å; L31-F49 HydrophobicContact CD2-CE1 3.89Å; L31-F49 HydrophobicContact CD2-CE2 4.41Å; L31-F49 HydrophobicContact CD2-CZ 3.55Å; L31-F49 HydrophobicContact CG-CZ 4.32Å; L31-K68 VanDerWaalsContact O-CA 3.32Å; L31-K68 WeakPolarHBondContact O-CA 3.48Å; L31-M69 HydrophobicContact CB-CB 4.25Å; L31-M69 HydrophobicContact CD1-CE 3.72Å; L31-M69 PolarHBondContact N-O 3.31Å; L31-M69 PolarHBondContact O-N 3.37Å; L31-L71 HydrophobicContact CD1-CB 4.41Å; L31-L71 HydrophobicContact CD1-CD1 3.99Å; L31-I95 HydrophobicContact CB-CG2 3.71Å; L31-I95 HydrophobicContact CD1-CG2 4.46Å; L31-I95 HydrophobicContact CD2-CG2 4.06Å; L31-I95 HydrophobicContact CG-CG2 4.29Å; L31-R96 WeakPolarHBondContact CA-O 3.24Å; L31-V97 HydrophobicContact CD2-CB 4.07Å; L31-V97 HydrophobicContact CD2-CG1 3.8Å; L31-V97 HydrophobicContact CD2-CG2 3.86Å
32	V	82.9	Confident	71	Confident	32 Å²	32	86.8 Å²	86.8	19%	0.194	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	118.4	179.4	-172.1	0	0	0	0	110	L30 Y67 K68 R96 L98	L30-V32 HydrophobicContact CD2-CG2 4.47Å; L30-V32 HydrophobicContact CG-CG2 4.25Å; V32-Y67 WeakPolarHBondContact CA-O 3.36Å; V32-Y67 HydrophobicContact CG1-CD2 4.47Å; V32-K68 HydrophobicContact CG1-CG 4.35Å; V32-K68 HydrophobicContact CG2-CG 4.34Å; V32-R96 PolarHBondContact N-O 2.92Å; V32-R96 PolarHBondContact O-N 2.84Å; V32-L98 HydrophobicContact CG2-CD1 4.11Å
33	A	81.7	Confident	73.8	Confident	5 Å²	5	86.9 Å²	86.9	4%	0.041	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	138.9	173.1	0	0	0	0	0	110.6	L40 Y67 V93	A33-L40 HydrophobicContact CB-CD2 3.9Å; A33-L40 HydrophobicContact CB-CG 4.27Å; A33-Y67 PolarHBondContact N-O 3.11Å; A33-V93 HydrophobicContact CB-CG1 4.01Å
34	R	72.6	Confident	76.3	Confident	145 Å²	145	77.1 Å²	77.1	55%	0.547	38%	0.376	S	S	.	.	S	Bend	trans	-71.2	-36.3	178.8	-92	-167.8	171	-164	-0.5	113.3	K94	R34-K94 HydrophobicContact CB-CB 4.41Å; R34-K94 PolarHBondContact N-O 2.94Å
35	K	70.1	Confident	78.5	Confident	152 Å²	152	71.1 Å²	71.1	66%	0.661	34%	0.339	S	S	*	.	S	Bend	trans	-94	128.8	171	-74	-175.3	177	-179.9	0	108.3	D37 A38	K35-D37 PolarHBondContact O-N 2.95Å; K35-A38 HydrophobicContact CB-CB 4.19Å; K35-A38 PolarHBondContact O-N 2.97Å
36	R	59.3	Low	79.9	Confident	190 Å²	190	67.1 Å²	67.1	72%	0.717	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-18	-179.6	-74.4	-176.3	-179.7	171.5	3.8	112.7	Y67	R36-Y67 HydrophobicContact CG-CE1 4.47Å
37	D	59.9	Low	80.7	Confident	143 Å²	143	69.4 Å²	69.4	77%	0.765	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-1.4	-172	-8.7	-47.8	0	0	0	111.6	K35 P39	K35-D37 PolarHBondContact O-N 2.95Å; D37-P39 VanDerWaalsContact O-CD 3.3Å; D37-P39 WeakPolarHBondContact O-CD 3.38Å
38	A	70.7	Confident	81.4	Confident	23 Å²	23	71.6 Å²	71.6	19%	0.19	34%	0.339	C	S	.	.	S	Bend	trans	-100.5	99.1	172.9	0	0	0	0	0	109.2	K35 V93	K35-A38 HydrophobicContact CB-CB 4.19Å; K35-A38 PolarHBondContact O-N 2.97Å; A38-V93 HydrophobicContact CB-CG1 4.14Å; A38-V93 HydrophobicContact CB-CG2 4.16Å
39	P	75.2	Confident	82	Confident	83 Å²	83	70.4 Å²	70.4	54%	0.539	33%	0.332	S	S	.	.			trans	-63.7	144.9	178.6	26.9	-33	0	0	0	110.8	D37 N66	D37-P39 VanDerWaalsContact O-CD 3.3Å; D37-P39 WeakPolarHBondContact O-CD 3.38Å; P39-N66 HydrophobicContact CB-CB 4.11Å
40	L	82.2	Confident	82.3	Confident	8 Å²	8	71.6 Å²	71.6	4%	0.042	34%	0.344	C	S	.	.			trans	-80.4	118.5	173.5	-67.4	177.3	0	0	0	108.8	A33 I45 L61 N66 Y67 M69 V93 I95	A33-L40 HydrophobicContact CB-CD2 3.9Å; A33-L40 HydrophobicContact CB-CG 4.27Å; L40-I45 HydrophobicContact CB-CD1 3.57Å; L40-I45 HydrophobicContact CD2-CD1 3.68Å; L40-I45 HydrophobicContact CG-CD1 4.1Å; L40-L61 HydrophobicContact CB-CD1 3.93Å; L40-N66 WeakPolarHBondContact CB-O 3.32Å; L40-N66 PolarHBondContact N-O 3.38Å; L40-Y67 VanDerWaalsContact CD1-C 3.42Å; L40-Y67 WeakPolarHBondContact CD1-O 3.27Å; L40-M69 HydrophobicContact CB-SD 4.4Å; L40-M69 HydrophobicContact CD1-CB 3.66Å; L40-V93 HydrophobicContact CD2-CG1 4.22Å; L40-I95 HydrophobicContact CD2-CD1 3.62Å; L40-I95 HydrophobicContact CD2-CG1 3.73Å
41	D	86	Confident	82.7	Confident	98 Å²	98	76.9 Å²	76.9	52%	0.524	37%	0.368	S	S	.	.			trans	-80.5	114.7	172.3	-176.5	-39	0	0	0	109.6	R43 A44 I45	D41-R43 VanDerWaalsContact C-N 3.33Å; D41-R43 PolarHBondContact O-N 3.49Å; D41-R43 WeakPolarHBondContact OD1-CB 3.48Å; D41-R43 PolarHBondContact OD1-N 2.98Å; D41-A44 HydrophobicContact CB-CB 3.95Å; D41-A44 PolarHBondContact OD1-N 3.39Å; D41-I45 WeakPolarHBondContact O-CB 3.13Å; D41-I45 VanDerWaalsContact O-CD1 3.28Å; D41-I45 WeakPolarHBondContact O-CD1 3.45Å; D41-I45 WeakPolarHBondContact O-CG1 3.5Å; D41-I45 PolarHBondContact O-N 3.34Å
42	E	86.9	Confident	83.1	Confident	83 Å²	83	81 Å²	81	39%	0.388	39%	0.391	S	S	.	.	H	α-helix	trans	-59.4	-41.4	-178	173.3	161.6	-163.7	0	0	112.8	M46 C59	E42-M46 WeakPolarHBondContact O-CB 3.29Å; E42-M46 WeakPolarHBondContact O-CG 3.47Å; E42-M46 PolarHBondContact O-N 2.95Å; E42-C59 HydrophobicContact CG-CB 4.18Å
43	R	87.6	Confident	83.7	Confident	197 Å²	197	80.3 Å²	80.3	74%	0.743	39%	0.385	S	S	*	.	H	α-helix	trans	-71.2	-49.7	-176.5	-170.2	178	-178.4	175.7	0.9	110.6	D41 I45 M46 E47	D41-R43 VanDerWaalsContact C-N 3.33Å; D41-R43 PolarHBondContact O-N 3.49Å; D41-R43 WeakPolarHBondContact OD1-CB 3.48Å; D41-R43 PolarHBondContact OD1-N 2.98Å; R43-I45 PolarHBondContact O-N 3.5Å; R43-M46 PolarHBondContact O-N 3.04Å; R43-E47 WeakPolarHBondContact O-CB 3.48Å; R43-E47 PolarHBondContact O-N 3.36Å
44	A	89.1	Confident	84.1	Confident	38 Å²	38	80.8 Å²	80.8	31%	0.314	39%	0.39	S	S	.	.	H	α-helix	trans	-60.1	-37.1	178.9	0	0	0	0	0	111.8	D41 Y48 V90	D41-A44 HydrophobicContact CB-CB 3.95Å; D41-A44 PolarHBondContact OD1-N 3.39Å; A44-Y48 VanDerWaalsContact O-CB 3.27Å; A44-Y48 WeakPolarHBondContact O-CB 3.47Å; A44-Y48 PolarHBondContact O-N 3.44Å; A44-V90 HydrophobicContact CB-CG1 4.12Å
45	I	91.3	Very high	85	Confident	3 Å²	3	78 Å²	78	2%	0.015	39%	0.391	C	S	.	.	H	α-helix	trans	-75.7	-41.8	179.6	-64.1	166	0	0	0	112	L31 L40 D41 R43 E47 Y48 F49 M69 L71 V90 I95	L31-I45 HydrophobicContact CD1-CG2 3.5Å; L40-I45 HydrophobicContact CB-CD1 3.57Å; L40-I45 HydrophobicContact CD2-CD1 3.68Å; L40-I45 HydrophobicContact CG-CD1 4.1Å; D41-I45 WeakPolarHBondContact O-CB 3.13Å; D41-I45 VanDerWaalsContact O-CD1 3.28Å; D41-I45 WeakPolarHBondContact O-CD1 3.45Å; D41-I45 WeakPolarHBondContact O-CG1 3.5Å; D41-I45 PolarHBondContact O-N 3.34Å; R43-I45 PolarHBondContact O-N 3.5Å; I45-E47 VanDerWaalsContact C-N 3.29Å; I45-E47 PolarHBondContact O-N 2.97Å; I45-Y48 PolarHBondContact O-N 2.95Å; I45-F49 HydrophobicContact CG2-CD2 3.46Å; I45-F49 VanDerWaalsContact CG2-CD2 3.46Å; I45-F49 HydrophobicContact CG2-CE2 3.6Å; I45-F49 HydrophobicContact CG2-CG 4.47Å; I45-F49 WeakPolarHBondContact O-CB 3.23Å; I45-F49 VanDerWaalsContact O-CD2 3.29Å; I45-F49 WeakPolarHBondContact O-CD2 3.47Å; I45-F49 PolarHBondContact O-N 3.06Å; I45-M69 HydrophobicContact CB-CE 3.51Å; I45-M69 HydrophobicContact CD1-CE 3.53Å; I45-M69 HydrophobicContact CD1-SD 3.92Å; I45-M69 HydrophobicContact CG1-CE 4.12Å; I45-M69 HydrophobicContact CG2-CE 3.15Å; I45-L71 HydrophobicContact CG2-CD1 3.97Å; I45-V90 HydrophobicContact CG1-CB 4.47Å; I45-V90 HydrophobicContact CG1-CG1 4.06Å; I45-I95 HydrophobicContact CD1-CD1 3.74Å; I45-I95 HydrophobicContact CG1-CD1 3.84Å
46	M	90.8	Very high	85.9	Confident	73 Å²	73	72.4 Å²	72.4	36%	0.36	37%	0.369	S	S	.	.	H	α-helix	trans	-60.4	-42.7	175.9	-76.6	-149.9	-57.5	0	0	111.6	E42 R43 G50 V56 C59	E42-M46 WeakPolarHBondContact O-CB 3.29Å; E42-M46 WeakPolarHBondContact O-CG 3.47Å; E42-M46 PolarHBondContact O-N 2.95Å; R43-M46 PolarHBondContact O-N 3.04Å; M46-G50 WeakPolarHBondContact O-CA 3.34Å; M46-G50 PolarHBondContact O-N 3.32Å; M46-V56 HydrophobicContact CG-CG1 4.41Å; M46-V56 HydrophobicContact SD-CG1 4.42Å; M46-C59 HydrophobicContact CG-CB 3.6Å; M46-C59 HydrophobicContact SD-CB 3.54Å; M46-C59 VanDerWaalsContact SD-CB 3.54Å
47	E	91.3	Very high	87.3	Confident	111 Å²	111	67.1 Å²	67.1	52%	0.519	36%	0.358	S	S	.	.	H	α-helix	trans	-63.3	-52.5	177.3	-174.7	171.4	-173.2	0	0	111.5	R43 I45 F49 G50 Q51	R43-E47 WeakPolarHBondContact O-CB 3.48Å; R43-E47 PolarHBondContact O-N 3.36Å; I45-E47 VanDerWaalsContact C-N 3.29Å; I45-E47 PolarHBondContact O-N 2.97Å; E47-F49 PolarHBondContact O-N 3.46Å; E47-G50 PolarHBondContact O-N 3.24Å; E47-Q51 WeakPolarHBondContact O-CB 3.33Å; E47-Q51 WeakPolarHBondContact O-CG 3.45Å; E47-Q51 PolarHBondContact O-N 3.03Å; E47-Q51 PolarHBondContact OE1-NE2 3.3Å
48	Y	95.1	Very high	88.5	Confident	65 Å²	65	61.5 Å²	61.5	26%	0.255	33%	0.33	S	S	.	.	H	α-helix	trans	-57	-48.7	179.5	-179.8	-86.7	0	0	0	112.1	A44 I45 N52 F53 V88 N89 V90	A44-Y48 VanDerWaalsContact O-CB 3.27Å; A44-Y48 WeakPolarHBondContact O-CB 3.47Å; A44-Y48 PolarHBondContact O-N 3.44Å; I45-Y48 PolarHBondContact O-N 2.95Å; Y48-N52 VanDerWaalsContact O-CB 3.32Å; Y48-N52 WeakPolarHBondContact O-CB 3.5Å; Y48-N52 PolarHBondContact O-N 2.95Å; Y48-N52 PolarHBondContact O-ND2 3.3Å; Y48-F53 HydrophobicContact CD1-CE2 4.2Å; Y48-F53 AromaticContact CE1-CE2 3.76Å; Y48-F53 HydrophobicContact CE1-CE2 3.76Å; Y48-F53 HydrophobicContact CE1-CZ 4.09Å; Y48-V88 HydrophobicContact CE1-CB 3.91Å; Y48-V88 HydrophobicContact CE1-CG1 4.22Å; Y48-V88 HydrophobicContact CE1-CG2 4.14Å; Y48-N89 WeakPolarHBondContact CE2-O 3.38Å; Y48-V90 HydrophobicContact CD1-CG2 3.65Å; Y48-V90 HydrophobicContact CD2-CG2 4.13Å; Y48-V90 HydrophobicContact CE1-CG2 4.08Å; Y48-V90 HydrophobicContact CG-CG1 4.41Å; Y48-V90 HydrophobicContact CG-CG2 3.68Å
49	F	94.6	Very high	89.2	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-74.7	-33.3	-177	-80.5	-102.6	0	0	0	112.6	L31 I45 E47 F53 G54 V56 L71 F73 A82 V88 V90 V97	L31-F49 HydrophobicContact CD1-CD2 4.36Å; L31-F49 HydrophobicContact CD1-CE1 4.35Å; L31-F49 HydrophobicContact CD1-CE2 3.75Å; L31-F49 HydrophobicContact CD1-CZ 3.72Å; L31-F49 HydrophobicContact CD2-CE1 3.89Å; L31-F49 HydrophobicContact CD2-CE2 4.41Å; L31-F49 HydrophobicContact CD2-CZ 3.55Å; L31-F49 HydrophobicContact CG-CZ 4.32Å; I45-F49 HydrophobicContact CG2-CD2 3.46Å; I45-F49 VanDerWaalsContact CG2-CD2 3.46Å; I45-F49 HydrophobicContact CG2-CE2 3.6Å; I45-F49 HydrophobicContact CG2-CG 4.47Å; I45-F49 WeakPolarHBondContact O-CB 3.23Å; I45-F49 VanDerWaalsContact O-CD2 3.29Å; I45-F49 WeakPolarHBondContact O-CD2 3.47Å; I45-F49 PolarHBondContact O-N 3.06Å; E47-F49 PolarHBondContact O-N 3.46Å; F49-F53 HydrophobicContact CB-CD2 4.04Å; F49-F53 AromaticContact CD1-CD2 3.3Å; F49-F53 HydrophobicContact CD1-CD2 3.3Å; F49-F53 AromaticContact CD1-CE2 3.47Å; F49-F53 HydrophobicContact CD1-CE2 3.47Å; F49-F53 VanDerWaalsContact CD1-CE2 3.47Å; F49-F53 HydrophobicContact CD1-CG 4.48Å; F49-F53 AromaticContact CE1-CD2 3.99Å; F49-F53 HydrophobicContact CE1-CD2 3.99Å; F49-F53 AromaticContact CE1-CE2 3.75Å; F49-F53 HydrophobicContact CE1-CE2 3.75Å; F49-F53 AromaticContact CG-CD2 3.84Å; F49-F53 HydrophobicContact CG-CD2 3.84Å; F49-F53 AromaticContact CG-CE2 3.98Å; F49-F53 HydrophobicContact CG-CE2 3.98Å; F49-F53 HydrophobicContact CZ-CE2 4.43Å; F49-F53 PolarHBondContact O-N 2.89Å; F49-G54 PolarHBondContact O-N 3.01Å; F49-V56 HydrophobicContact CB-CG2 4.02Å; F49-L71 HydrophobicContact CB-CD2 3.47Å; F49-L71 VanDerWaalsContact CB-CD2 3.47Å; F49-L71 HydrophobicContact CD1-CD2 3.98Å; F49-L71 HydrophobicContact CD2-CD2 4.36Å; F49-L71 HydrophobicContact CG-CD2 3.69Å; F49-F73 HydrophobicContact CB-CE1 4.41Å; F49-F73 HydrophobicContact CB-CZ 4.27Å; F49-F73 AromaticContact CD1-CZ 3.85Å; F49-F73 HydrophobicContact CD1-CZ 3.85Å; F49-A82 HydrophobicContact CD1-CB 4.09Å; F49-A82 HydrophobicContact CE1-CB 4.13Å; F49-V88 HydrophobicContact CE2-CG2 3.9Å; F49-V88 HydrophobicContact CZ-CG2 3.57Å; F49-V90 HydrophobicContact CE2-CG2 4.23Å; F49-V97 HydrophobicContact CE1-CG1 4.23Å; F49-V97 HydrophobicContact CE1-CG2 3.85Å; F49-V97 HydrophobicContact CZ-CG2 3.75Å
50	G	92	Very high	89.5	Confident	26 Å²	26	62.6 Å²	62.6	27%	0.268	33%	0.325	S	S	.	.	H	α-helix	trans	-58.5	-48	173.2	0	0	0	0	0	112	M46 E47 G54	M46-G50 WeakPolarHBondContact O-CA 3.34Å; M46-G50 PolarHBondContact O-N 3.32Å; E47-G50 PolarHBondContact O-N 3.24Å; G50-G54 WeakPolarHBondContact CA-O 3.36Å; G50-G54 CarbonylContact O-C 3.4Å; G50-G54 WeakPolarHBondContact O-CA 3.5Å; G50-G54 PolarHBondContact O-N 3.44Å
51	Q	93.2	Very high	89.3	Confident	140 Å²	140	65.1 Å²	65.1	65%	0.654	34%	0.338	S	S	*	.	H	α-helix	trans	-71.5	-43.8	-179.5	-70.5	173.9	0.1	0	0	112.7	E47	E47-Q51 WeakPolarHBondContact O-CB 3.33Å; E47-Q51 WeakPolarHBondContact O-CG 3.45Å; E47-Q51 PolarHBondContact O-N 3.03Å; E47-Q51 PolarHBondContact OE1-NE2 3.3Å
52	N	93.3	Very high	88.4	Confident	87 Å²	87	61.9 Å²	61.9	47%	0.465	33%	0.328	S	S	.	.	H	α-helix	trans	-88.8	-26.1	-169.4	-71.2	-75.7	0	0	0	114.6	Y48	Y48-N52 VanDerWaalsContact O-CB 3.32Å; Y48-N52 WeakPolarHBondContact O-CB 3.5Å; Y48-N52 PolarHBondContact O-N 2.95Å; Y48-N52 PolarHBondContact O-ND2 3.3Å
53	F	94.1	Very high	86.6	Confident	17 Å²	17	63.8 Å²	63.8	8%	0.075	35%	0.35	C	S	.	.	H	α-helix	trans	-125	-21.4	-173.8	-48.6	-63.6	0	0	0	113.5	Y48 F49 F73 S78 K81 A82 Q85 V88	Y48-F53 HydrophobicContact CD1-CE2 4.2Å; Y48-F53 AromaticContact CE1-CE2 3.76Å; Y48-F53 HydrophobicContact CE1-CE2 3.76Å; Y48-F53 HydrophobicContact CE1-CZ 4.09Å; F49-F53 HydrophobicContact CB-CD2 4.04Å; F49-F53 AromaticContact CD1-CD2 3.3Å; F49-F53 HydrophobicContact CD1-CD2 3.3Å; F49-F53 AromaticContact CD1-CE2 3.47Å; F49-F53 HydrophobicContact CD1-CE2 3.47Å; F49-F53 VanDerWaalsContact CD1-CE2 3.47Å; F49-F53 HydrophobicContact CD1-CG 4.48Å; F49-F53 AromaticContact CE1-CD2 3.99Å; F49-F53 HydrophobicContact CE1-CD2 3.99Å; F49-F53 AromaticContact CE1-CE2 3.75Å; F49-F53 HydrophobicContact CE1-CE2 3.75Å; F49-F53 AromaticContact CG-CD2 3.84Å; F49-F53 HydrophobicContact CG-CD2 3.84Å; F49-F53 AromaticContact CG-CE2 3.98Å; F49-F53 HydrophobicContact CG-CE2 3.98Å; F49-F53 HydrophobicContact CZ-CE2 4.43Å; F49-F53 PolarHBondContact O-N 2.89Å; F53-F73 HydrophobicContact CB-CE1 4.13Å; F53-S78 VanDerWaalsContact O-CA 3.23Å; F53-S78 WeakPolarHBondContact O-CA 3.42Å; F53-S78 WeakPolarHBondContact O-CB 3.29Å; F53-S78 PolarHBondContact O-OG 2.9Å; F53-K81 HydrophobicContact CB-CB 4.38Å; F53-K81 HydrophobicContact CD1-CB 4.12Å; F53-A82 HydrophobicContact CB-CB 3.94Å; F53-A82 HydrophobicContact CD1-CB 4.15Å; F53-A82 HydrophobicContact CD2-CB 3.78Å; F53-A82 HydrophobicContact CE2-CB 4.33Å; F53-A82 HydrophobicContact CG-CB 3.66Å; F53-Q85 HydrophobicContact CE1-CG 3.58Å; F53-Q85 HydrophobicContact CZ-CG 3.89Å; F53-V88 HydrophobicContact CE2-CG1 4.37Å; F53-V88 HydrophobicContact CZ-CG1 3.9Å
54	G	90.8	Very high	85.1	Confident	15 Å²	15	64.6 Å²	64.6	16%	0.155	35%	0.354	C	S	.	.			trans	123.3	178.6	175.7	0	0	0	0	0	112.7	F49 G50 V56	F49-G54 PolarHBondContact O-N 3.01Å; G50-G54 WeakPolarHBondContact CA-O 3.36Å; G50-G54 CarbonylContact O-C 3.4Å; G50-G54 WeakPolarHBondContact O-CA 3.5Å; G50-G54 PolarHBondContact O-N 3.44Å; G54-V56 PolarHBondContact O-N 2.85Å
55	P	91.4	Very high	83.7	Confident	87 Å²	87	67.1 Å²	67.1	57%	0.565	36%	0.357	S	S	*	.			trans	-57.8	129.4	-163.7	-24.9	32.8	0	0	0	113.6	F73 A74	P55-F73 WeakPolarHBondContact O-CA 3.38Å; P55-A74 HydrophobicContact CB-CB 3.95Å; P55-A74 PolarHBondContact O-N 3.49Å
56	V	89.9	Confident	82.7	Confident	33 Å²	33	71.2 Å²	71.2	20%	0.2	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	124.1	175.3	178.6	0	0	0	0	108.2	M46 F49 G54 L71 Q72 F73	M46-V56 HydrophobicContact CG-CG1 4.41Å; M46-V56 HydrophobicContact SD-CG1 4.42Å; F49-V56 HydrophobicContact CB-CG2 4.02Å; G54-V56 PolarHBondContact O-N 2.85Å; V56-L71 HydrophobicContact CB-CD2 4.38Å; V56-L71 HydrophobicContact CG1-CD1 4.39Å; V56-L71 HydrophobicContact CG1-CD2 3.84Å; V56-L71 HydrophobicContact CG1-CG 3.69Å; V56-L71 HydrophobicContact CG2-CD2 3.55Å; V56-L71 HydrophobicContact CG2-CG 4.35Å; V56-Q72 CarbonylContact C-O 3.51Å; V56-Q72 WeakPolarHBondContact CA-O 3.47Å; V56-Q72 WeakPolarHBondContact CG1-O 3.35Å; V56-F73 HydrophobicContact CG2-CD1 4.15Å; V56-F73 HydrophobicContact CG2-CE1 3.83Å; V56-F73 HydrophobicContact CG2-CZ 4.45Å
57	V	87.6	Confident	82.3	Confident	79 Å²	79	69.3 Å²	69.3	48%	0.479	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-39.9	-177.7	-179	0	0	0	0	111.3	L26 Q72 A74	L26-V57 HydrophobicContact CD1-CB 4.04Å; L26-V57 HydrophobicContact CD1-CG1 3.68Å; L26-V57 HydrophobicContact CD1-CG2 4.17Å; L26-V57 HydrophobicContact CD2-CG2 4.46Å; V57-Q72 HydrophobicContact CB-CB 4.49Å; V57-Q72 PolarHBondContact N-O 3.47Å; V57-A74 HydrophobicContact CG2-CB 3.85Å
58	S	85.5	Confident	81.9	Confident	26 Å²	26	68 Å²	68	18%	0.182	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	154.9	178.9	69.5	0	0	0	0	111.9	Q72	S58-Q72 PolarHBondContact O-N 3.41Å; S58-Q72 WeakPolarHBondContact OG-CB 3.44Å; S58-Q72 WeakPolarHBondContact OG-CG 3.48Å; S58-Q72 PolarHBondContact OG-OE1 2.83Å
59	C	86.4	Confident	81.4	Confident	12 Å²	12	65 Å²	65	8%	0.081	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	138.4	175.4	-178.2	0	0	0	0	109.1	E42 M46 M69 R70 L71	E42-C59 HydrophobicContact CG-CB 4.18Å; M46-C59 HydrophobicContact CG-CB 3.6Å; M46-C59 HydrophobicContact SD-CB 3.54Å; M46-C59 VanDerWaalsContact SD-CB 3.54Å; C59-M69 WeakPolarHBondContact SG-CE 3.13Å; C59-M69 WeakPolarHBondContact SG-CG 3.42Å; C59-M69 PolarHBondContact SG-SD 3.22Å; C59-R70 CarbonylContact C-O 3.43Å; C59-R70 WeakPolarHBondContact CA-O 3.49Å; C59-L71 HydrophobicContact CB-CD1 4.15Å
60	H	80.2	Confident	81.1	Confident	116 Å²	116	71.7 Å²	71.7	54%	0.537	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	110.2	178	-67.2	32.1	0	0	0	109.7	M69 R70	H60-M69 CarbonylContact O-C 3.59Å; H60-M69 WeakPolarHBondContact O-CA 3.11Å; H60-M69 WeakPolarHBondContact O-CG 3.35Å; H60-R70 HydrophobicContact CB-CB 4.38Å; H60-R70 PolarHBondContact N-O 2.88Å; H60-R70 PolarHBondContact O-N 3.4Å
61	L	78.4	Confident	80.9	Confident	62 Å²	62	70.5 Å²	70.5	33%	0.325	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	138.4	173.7	-164.3	70	0	0	0	111.1	L40 S63 M69	L40-L61 HydrophobicContact CB-CD1 3.93Å; L61-S63 PolarHBondContact O-N 2.75Å; L61-M69 HydrophobicContact CD1-CB 4.14Å; L61-M69 HydrophobicContact CD1-CG 4.01Å; L61-M69 HydrophobicContact CD1-SD 4.01Å
62	G	66.3	Low	80.7	Confident	30 Å²	30	66.5 Å²	66.5	31%	0.309	34%	0.343	S	S	.	.			trans	-70.6	115.6	-179	0	0	0	0	0	112.9	R64 K65 K68	G62-R64 PolarHBondContact O-N 2.9Å; G62-K65 CarbonylContact O-C 3.34Å; G62-K65 PolarHBondContact O-N 3.16Å; G62-K68 PolarHBondContact N-O 3.38Å
63	S	50.8	Low	80.5	Confident	123 Å²	123	62.3 Å²	62.3	86%	0.86	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-8.5	-172.8	61.2	0	0	0	0	118.5	L61	L61-S63 PolarHBondContact O-N 2.75Å
64	R	55.8	Low	80.2	Confident	214 Å²	214	64.2 Å²	64.2	81%	0.808	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126	-6.5	178.1	-69.3	-173.2	175.8	175.5	-0.3	113.8	G62	G62-R64 PolarHBondContact O-N 2.9Å
65	K	59.8	Low	80.1	Confident	90 Å²	90	65.6 Å²	65.6	39%	0.391	35%	0.347	S	S	.	.			trans	-152.7	86	-165.9	-72.3	178.6	167	-164.2	0	108.7	G62 Y67 K68	G62-K65 CarbonylContact O-C 3.34Å; G62-K65 PolarHBondContact O-N 3.16Å; K65-Y67 HydrophobicContact CB-CD1 3.94Å; K65-Y67 HydrophobicContact CB-CE1 3.51Å; K65-Y67 HydrophobicContact CB-CE2 4.45Å; K65-Y67 HydrophobicContact CD-CE1 4Å; K65-Y67 HydrophobicContact CD-CE2 4.46Å; K65-Y67 WeakPolarHBondContact CD-OH 3.23Å; K65-Y67 VanDerWaalsContact CE-OH 3.26Å; K65-Y67 WeakPolarHBondContact CE-OH 3.28Å; K65-Y67 HydrophobicContact CG-CE1 3.62Å; K65-Y67 PolarHBondContact NZ-OH 2.82Å; K65-Y67 PolarHBondContact O-N 2.83Å; K65-K68 PolarHBondContact O-N 3.11Å
66	N	69.1	Low	79.7	Confident	90 Å²	90	66 Å²	66	48%	0.481	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	3.1	-178.6	-61.1	-1.7	0	0	0	114.5	P39 L40	P39-N66 HydrophobicContact CB-CB 4.11Å; L40-N66 WeakPolarHBondContact CB-O 3.32Å; L40-N66 PolarHBondContact N-O 3.38Å
67	Y	82.6	Confident	79.5	Confident	32 Å²	32	67.4 Å²	67.4	13%	0.125	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	6.9	174.3	62.1	-94.8	0	0	0	113.4	V32 A33 R36 L40 K65	V32-Y67 WeakPolarHBondContact CA-O 3.36Å; V32-Y67 HydrophobicContact CG1-CD2 4.47Å; A33-Y67 PolarHBondContact N-O 3.11Å; R36-Y67 HydrophobicContact CG-CE1 4.47Å; L40-Y67 VanDerWaalsContact CD1-C 3.42Å; L40-Y67 WeakPolarHBondContact CD1-O 3.27Å; K65-Y67 HydrophobicContact CB-CD1 3.94Å; K65-Y67 HydrophobicContact CB-CE1 3.51Å; K65-Y67 HydrophobicContact CB-CE2 4.45Å; K65-Y67 HydrophobicContact CD-CE1 4Å; K65-Y67 HydrophobicContact CD-CE2 4.46Å; K65-Y67 WeakPolarHBondContact CD-OH 3.23Å; K65-Y67 VanDerWaalsContact CE-OH 3.26Å; K65-Y67 WeakPolarHBondContact CE-OH 3.28Å; K65-Y67 HydrophobicContact CG-CE1 3.62Å; K65-Y67 PolarHBondContact NZ-OH 2.82Å; K65-Y67 PolarHBondContact O-N 2.83Å
68	K	82.4	Confident	79.6	Confident	84 Å²	84	64.1 Å²	64.1	37%	0.365	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	137.4	175.6	-67	-169.9	179.7	-171.2	0	111.8	L31 V32 G62 K65	L31-K68 VanDerWaalsContact O-CA 3.32Å; L31-K68 WeakPolarHBondContact O-CA 3.48Å; V32-K68 HydrophobicContact CG1-CG 4.35Å; V32-K68 HydrophobicContact CG2-CG 4.34Å; G62-K68 PolarHBondContact N-O 3.38Å; K65-K68 PolarHBondContact O-N 3.11Å
69	M	85.9	Confident	79.7	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	145.4	-178.3	-158	169.8	79.9	0	0	111.3	L31 L40 I45 C59 H60 L61 L71	L31-M69 HydrophobicContact CB-CB 4.25Å; L31-M69 HydrophobicContact CD1-CE 3.72Å; L31-M69 PolarHBondContact N-O 3.31Å; L31-M69 PolarHBondContact O-N 3.37Å; L40-M69 HydrophobicContact CB-SD 4.4Å; L40-M69 HydrophobicContact CD1-CB 3.66Å; I45-M69 HydrophobicContact CB-CE 3.51Å; I45-M69 HydrophobicContact CD1-CE 3.53Å; I45-M69 HydrophobicContact CD1-SD 3.92Å; I45-M69 HydrophobicContact CG1-CE 4.12Å; I45-M69 HydrophobicContact CG2-CE 3.15Å; C59-M69 WeakPolarHBondContact SG-CE 3.13Å; C59-M69 WeakPolarHBondContact SG-CG 3.42Å; C59-M69 PolarHBondContact SG-SD 3.22Å; H60-M69 CarbonylContact O-C 3.59Å; H60-M69 WeakPolarHBondContact O-CA 3.11Å; H60-M69 WeakPolarHBondContact O-CG 3.35Å; L61-M69 HydrophobicContact CD1-CB 4.14Å; L61-M69 HydrophobicContact CD1-CG 4.01Å; L61-M69 HydrophobicContact CD1-SD 4.01Å; M69-L71 HydrophobicContact CE-CD1 3.34Å
70	R	87.2	Confident	79.5	Confident	142 Å²	142	64.9 Å²	64.9	54%	0.536	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	130.3	171.5	-75.8	-180	172.7	172.1	-2.7	109.5	T28 A29 L30 C59 H60	T28-R70 HydrophobicContact CG2-CB 4.18Å; A29-R70 CarbonylContact O-C 3.36Å; A29-R70 WeakPolarHBondContact O-CA 3.26Å; L30-R70 HydrophobicContact CD1-CG 4.1Å; C59-R70 CarbonylContact C-O 3.43Å; C59-R70 WeakPolarHBondContact CA-O 3.49Å; H60-R70 HydrophobicContact CB-CB 4.38Å; H60-R70 PolarHBondContact N-O 2.88Å; H60-R70 PolarHBondContact O-N 3.4Å
71	L	88.1	Confident	80	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.5	179.1	-135.6	88.9	0	0	0	109.4	T28 A29 L31 I45 F49 V56 C59 M69 F73	T28-L71 CarbonylContact C-O 3.58Å; T28-L71 VanDerWaalsContact CA-O 3.23Å; T28-L71 WeakPolarHBondContact CA-O 3.31Å; T28-L71 WeakPolarHBondContact CG2-O 3.36Å; A29-L71 HydrophobicContact CB-CB 4.3Å; A29-L71 PolarHBondContact N-O 3.03Å; A29-L71 PolarHBondContact O-N 3.01Å; L31-L71 HydrophobicContact CD1-CB 4.41Å; L31-L71 HydrophobicContact CD1-CD1 3.99Å; I45-L71 HydrophobicContact CG2-CD1 3.97Å; F49-L71 HydrophobicContact CB-CD2 3.47Å; F49-L71 VanDerWaalsContact CB-CD2 3.47Å; F49-L71 HydrophobicContact CD1-CD2 3.98Å; F49-L71 HydrophobicContact CD2-CD2 4.36Å; F49-L71 HydrophobicContact CG-CD2 3.69Å; V56-L71 HydrophobicContact CB-CD2 4.38Å; V56-L71 HydrophobicContact CG1-CD1 4.39Å; V56-L71 HydrophobicContact CG1-CD2 3.84Å; V56-L71 HydrophobicContact CG1-CG 3.69Å; V56-L71 HydrophobicContact CG2-CD2 3.55Å; V56-L71 HydrophobicContact CG2-CG 4.35Å; C59-L71 HydrophobicContact CB-CD1 4.15Å; M69-L71 HydrophobicContact CE-CD1 3.34Å; L71-F73 HydrophobicContact CD2-CE1 4.34Å; L71-F73 HydrophobicContact CD2-CE2 4.12Å; L71-F73 HydrophobicContact CD2-CZ 3.74Å
72	Q	88.2	Confident	80.4	Confident	56 Å²	56	62.7 Å²	62.7	26%	0.262	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	127.6	174.5	-65.8	-175.8	-5	0	0	110	L26 P27 T28 V56 V57 S58	L26-Q72 HydrophobicContact CB-CB 4.34Å; P27-Q72 WeakPolarHBondContact O-CA 3.38Å; T28-Q72 HydrophobicContact CG2-CG 4.03Å; V56-Q72 CarbonylContact C-O 3.51Å; V56-Q72 WeakPolarHBondContact CA-O 3.47Å; V56-Q72 WeakPolarHBondContact CG1-O 3.35Å; V57-Q72 HydrophobicContact CB-CB 4.49Å; V57-Q72 PolarHBondContact N-O 3.47Å; S58-Q72 PolarHBondContact O-N 3.41Å; S58-Q72 WeakPolarHBondContact OG-CB 3.44Å; S58-Q72 WeakPolarHBondContact OG-CG 3.48Å; S58-Q72 PolarHBondContact OG-OE1 2.83Å
73	F	89.2	Confident	81.2	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	154.7	175.5	-71.6	-83.7	0	0	0	111.4	P27 A29 F49 F53 P55 V56 L71 S75 S78 L79 A82	P27-F73 VanDerWaalsContact CD-O 3.29Å; P27-F73 WeakPolarHBondContact CD-O 3.22Å; P27-F73 HydrophobicContact CG-CB 4.18Å; P27-F73 WeakPolarHBondContact CG-O 3.36Å; P27-F73 PolarHBondContact O-N 3.23Å; A29-F73 HydrophobicContact CB-CE2 3.96Å; F49-F73 HydrophobicContact CB-CE1 4.41Å; F49-F73 HydrophobicContact CB-CZ 4.27Å; F49-F73 AromaticContact CD1-CZ 3.85Å; F49-F73 HydrophobicContact CD1-CZ 3.85Å; F53-F73 HydrophobicContact CB-CE1 4.13Å; P55-F73 WeakPolarHBondContact O-CA 3.38Å; V56-F73 HydrophobicContact CG2-CD1 4.15Å; V56-F73 HydrophobicContact CG2-CE1 3.83Å; V56-F73 HydrophobicContact CG2-CZ 4.45Å; L71-F73 HydrophobicContact CD2-CE1 4.34Å; L71-F73 HydrophobicContact CD2-CE2 4.12Å; L71-F73 HydrophobicContact CD2-CZ 3.74Å; F73-S75 VanDerWaalsContact C-N 3.25Å; F73-S75 WeakPolarHBondContact CB-O 3.23Å; F73-S75 PolarHBondContact O-N 3.11Å; F73-S78 VanDerWaalsContact CD1-CB 3.45Å; F73-L79 HydrophobicContact CD2-CB 3.92Å; F73-L79 HydrophobicContact CD2-CD1 4.04Å; F73-L79 HydrophobicContact CE2-CD1 4.11Å; F73-L79 HydrophobicContact CG-CB 4.43Å; F73-A82 HydrophobicContact CE2-CB 4.11Å; F73-A82 HydrophobicContact CZ-CB 3.78Å
74	A	88.1	Confident	82.9	Confident	56 Å²	56	60.3 Å²	60.3	46%	0.463	31%	0.312	S	S	.	.	S	Bend	trans	-70.7	-23.9	172.2	0	0	0	0	0	112.1	P55 V57	P55-A74 HydrophobicContact CB-CB 3.95Å; P55-A74 PolarHBondContact O-N 3.49Å; V57-A74 HydrophobicContact CG2-CB 3.85Å
75	S	88.1	Confident	84.3	Confident	44 Å²	44	55.3 Å²	55.3	31%	0.308	30%	0.298	S	S	.	.	S	Bend	trans	-137.5	150.5	-177.4	84.4	0	0	0	0	113.3	P27 F73 A77 S78 L79	P27-S75 WeakPolarHBondContact CG-O 3.32Å; F73-S75 VanDerWaalsContact C-N 3.25Å; F73-S75 WeakPolarHBondContact CB-O 3.23Å; F73-S75 PolarHBondContact O-N 3.11Å; S75-A77 PolarHBondContact O-N 2.84Å; S75-S78 PolarHBondContact O-N 2.74Å; S75-S78 WeakPolarHBondContact OG-CB 3.5Å; S75-S78 PolarHBondContact OG-N 3.27Å; S75-S78 PolarHBondContact OG-OG 2.86Å; S75-L79 PolarHBondContact O-N 3.02Å
76	Q	84	Confident	85.4	Confident	96 Å²	96	58.3 Å²	58.3	45%	0.449	31%	0.311	S	S	.	.	H	α-helix	trans	-67.1	-29.3	175.3	-176.7	63.5	41.8	0	0	111.2	L79 A80 H99	Q76-L79 PolarHBondContact O-N 3.29Å; Q76-A80 WeakPolarHBondContact O-CB 3.43Å; Q76-A80 PolarHBondContact O-N 3.42Å; Q76-H99 PolarHBondContact NE2-NE2 3.05Å
77	A	85.5	Confident	86.3	Confident	63 Å²	63	56.7 Å²	56.7	52%	0.521	30%	0.302	S	S	.	.	H	α-helix	trans	-63.9	-42.4	175.3	0	0	0	0	0	111.9	S75 L79 A80 K81	S75-A77 PolarHBondContact O-N 2.84Å; A77-L79 PolarHBondContact O-N 3.25Å; A77-A80 PolarHBondContact O-N 3.33Å; A77-K81 PolarHBondContact O-N 3.05Å
78	S	90.3	Very high	86.7	Confident	10 Å²	10	55.5 Å²	55.5	7%	0.07	30%	0.297	C	S	.	.	H	α-helix	trans	-62.7	-42.1	175.4	-61.8	0	0	0	0	112.1	F53 F73 S75 A80 K81 A82	F53-S78 VanDerWaalsContact O-CA 3.23Å; F53-S78 WeakPolarHBondContact O-CA 3.42Å; F53-S78 WeakPolarHBondContact O-CB 3.29Å; F53-S78 PolarHBondContact O-OG 2.9Å; F73-S78 VanDerWaalsContact CD1-CB 3.45Å; S75-S78 PolarHBondContact O-N 2.74Å; S75-S78 WeakPolarHBondContact OG-CB 3.5Å; S75-S78 PolarHBondContact OG-N 3.27Å; S75-S78 PolarHBondContact OG-OG 2.86Å; S78-A80 PolarHBondContact O-N 3.16Å; S78-K81 PolarHBondContact O-N 2.82Å; S78-A82 WeakPolarHBondContact O-CB 3.4Å; S78-A82 PolarHBondContact O-N 2.82Å
79	L	86.9	Confident	87.1	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.8	-41.8	174	177.3	58.1	0	0	0	112.2	P27 A29 F73 S75 Q76 A77 A82 A83 H99	P27-L79 HydrophobicContact CB-CB 4.02Å; P27-L79 HydrophobicContact CB-CD2 3.55Å; P27-L79 HydrophobicContact CB-CG 4.45Å; A29-L79 HydrophobicContact CB-CD1 3.59Å; F73-L79 HydrophobicContact CD2-CB 3.92Å; F73-L79 HydrophobicContact CD2-CD1 4.04Å; F73-L79 HydrophobicContact CE2-CD1 4.11Å; F73-L79 HydrophobicContact CG-CB 4.43Å; S75-L79 PolarHBondContact O-N 3.02Å; Q76-L79 PolarHBondContact O-N 3.29Å; A77-L79 PolarHBondContact O-N 3.25Å; L79-A82 PolarHBondContact O-N 3.32Å; L79-A83 VanDerWaalsContact O-CB 3.23Å; L79-A83 WeakPolarHBondContact O-CB 3.01Å; L79-A83 PolarHBondContact O-N 2.95Å; L79-H99 WeakPolarHBondContact CD2-CE1 3.31Å; L79-H99 WeakPolarHBondContact CD2-NE2 3.48Å; L79-H99 WeakPolarHBondContact CG-NE2 3.25Å
80	A	83.4	Confident	87.1	Confident	53 Å²	53	56.4 Å²	56.4	44%	0.438	31%	0.307	S	S	.	.	H	α-helix	trans	-62.8	-43	177.7	0	0	0	0	0	111.9	Q76 A77 S78 A83 S84	Q76-A80 WeakPolarHBondContact O-CB 3.43Å; Q76-A80 PolarHBondContact O-N 3.42Å; A77-A80 PolarHBondContact O-N 3.33Å; S78-A80 PolarHBondContact O-N 3.16Å; A80-A83 PolarHBondContact O-N 3.31Å; A80-S84 WeakPolarHBondContact O-CB 3.44Å; A80-S84 PolarHBondContact O-N 3.16Å
81	K	89.3	Confident	87	Confident	133 Å²	133	53 Å²	53	58%	0.578	32%	0.315	S	S	*	.	H	α-helix	trans	-61.4	-43.3	173.7	-74.7	-176.2	178.3	-176.7	0	112.3	F53 A77 S78 S84	F53-K81 HydrophobicContact CB-CB 4.38Å; F53-K81 HydrophobicContact CD1-CB 4.12Å; A77-K81 PolarHBondContact O-N 3.05Å; S78-K81 PolarHBondContact O-N 2.82Å; K81-S84 PolarHBondContact O-OG 2.89Å
82	A	88.1	Confident	86.8	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-67.5	-44.8	177.9	0	0	0	0	0	112	F49 F53 F73 S78 L79 S84 Q85 V97	F49-A82 HydrophobicContact CD1-CB 4.09Å; F49-A82 HydrophobicContact CE1-CB 4.13Å; F53-A82 HydrophobicContact CB-CB 3.94Å; F53-A82 HydrophobicContact CD1-CB 4.15Å; F53-A82 HydrophobicContact CD2-CB 3.78Å; F53-A82 HydrophobicContact CE2-CB 4.33Å; F53-A82 HydrophobicContact CG-CB 3.66Å; F73-A82 HydrophobicContact CE2-CB 4.11Å; F73-A82 HydrophobicContact CZ-CB 3.78Å; S78-A82 WeakPolarHBondContact O-CB 3.4Å; S78-A82 PolarHBondContact O-N 2.82Å; L79-A82 PolarHBondContact O-N 3.32Å; A82-S84 VanDerWaalsContact C-N 3.33Å; A82-S84 PolarHBondContact O-N 3.09Å; A82-Q85 PolarHBondContact O-N 2.7Å; A82-V97 HydrophobicContact CB-CG1 4.32Å
83	A	82.3	Confident	86.6	Confident	25 Å²	25	60.3 Å²	60.3	21%	0.207	36%	0.357	C	S	.	.	H	α-helix	trans	-69.4	-29	-177.4	0	0	0	0	0	112.9	L79 A80 Q85 K86	L79-A83 VanDerWaalsContact O-CB 3.23Å; L79-A83 WeakPolarHBondContact O-CB 3.01Å; L79-A83 PolarHBondContact O-N 2.95Å; A80-A83 PolarHBondContact O-N 3.31Å; A83-Q85 VanDerWaalsContact C-N 3.25Å; A83-Q85 PolarHBondContact O-N 3.35Å; A83-K86 PolarHBondContact O-N 3.26Å
84	S	85.7	Confident	86.5	Confident	78 Å²	78	65.5 Å²	65.5	55%	0.545	38%	0.38	S	S	.	.	H	α-helix	trans	-65.4	-28.4	178.3	69.4	0	0	0	0	112.8	A80 K81 A82 K86	A80-S84 WeakPolarHBondContact O-CB 3.44Å; A80-S84 PolarHBondContact O-N 3.16Å; K81-S84 PolarHBondContact O-OG 2.89Å; A82-S84 VanDerWaalsContact C-N 3.33Å; A82-S84 PolarHBondContact O-N 3.09Å; S84-K86 VanDerWaalsContact C-N 3.26Å; S84-K86 PolarHBondContact O-N 3.37Å
85	Q	87.1	Confident	86.6	Confident	109 Å²	109	62.9 Å²	62.9	51%	0.509	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-27.5	177.6	-64.6	-60.1	-33.3	0	0	112.9	F53 A82 A83 I87 V88	F53-Q85 HydrophobicContact CE1-CG 3.58Å; F53-Q85 HydrophobicContact CZ-CG 3.89Å; A82-Q85 PolarHBondContact O-N 2.7Å; A83-Q85 VanDerWaalsContact C-N 3.25Å; A83-Q85 PolarHBondContact O-N 3.35Å; Q85-I87 PolarHBondContact O-N 3.4Å; Q85-V88 HydrophobicContact CB-CG1 3.76Å; Q85-V88 HydrophobicContact CG-CG1 4.26Å
86	K	82.2	Confident	86.5	Confident	153 Å²	153	67.1 Å²	67.1	67%	0.665	37%	0.367	S	S	*	.	S	Bend	trans	59.8	-42.5	-175.2	-58.7	174.9	-177.9	170.3	0	115.3	A83 S84 R96 V97	A83-K86 PolarHBondContact O-N 3.26Å; S84-K86 VanDerWaalsContact C-N 3.26Å; S84-K86 PolarHBondContact O-N 3.37Å; K86-R96 WeakPolarHBondContact O-CA 3.38Å; K86-V97 PolarHBondContact O-N 2.99Å
87	I	88.5	Confident	86.6	Confident	56 Å²	56	62.8 Å²	62.8	29%	0.287	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	129.7	178.8	-57.2	177.1	0	0	0	107.7	Q85 K94 I95 R96	Q85-I87 PolarHBondContact O-N 3.4Å; I87-K94 HydrophobicContact CG2-CD 4.36Å; I87-K94 HydrophobicContact CG2-CG 4.04Å; I87-I95 CarbonylContact C-O 3.57Å; I87-I95 VanDerWaalsContact CA-O 3.25Å; I87-I95 WeakPolarHBondContact CA-O 3.38Å; I87-R96 HydrophobicContact CG1-CG 4.02Å
88	V	89.9	Confident	86.2	Confident	6 Å²	6	63.5 Å²	63.5	4%	0.036	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	153.6	173.1	-61.5	0	0	0	0	109.7	Y48 F49 F53 Q85 V90 I95 V97	Y48-V88 HydrophobicContact CE1-CB 3.91Å; Y48-V88 HydrophobicContact CE1-CG1 4.22Å; Y48-V88 HydrophobicContact CE1-CG2 4.14Å; F49-V88 HydrophobicContact CE2-CG2 3.9Å; F49-V88 HydrophobicContact CZ-CG2 3.57Å; F53-V88 HydrophobicContact CE2-CG1 4.37Å; F53-V88 HydrophobicContact CZ-CG1 3.9Å; Q85-V88 HydrophobicContact CB-CG1 3.76Å; Q85-V88 HydrophobicContact CG-CG1 4.26Å; V88-V90 HydrophobicContact CG2-CG2 4.25Å; V88-I95 HydrophobicContact CG2-CB 3.99Å; V88-I95 HydrophobicContact CG2-CG2 4.48Å; V88-I95 PolarHBondContact N-O 3.45Å; V88-I95 PolarHBondContact O-N 3.41Å; V88-V97 HydrophobicContact CG1-CG2 4.09Å; V88-V97 HydrophobicContact CG2-CG2 3.87Å
89	N	90.3	Very high	85.3	Confident	91 Å²	91	66 Å²	66	49%	0.487	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123	172.1	-57.1	-34.3	0	0	0	107.5	Y48 K94	Y48-N89 WeakPolarHBondContact CE2-O 3.38Å; N89-K94 WeakPolarHBondContact OD1-CE 3.32Å; N89-K94 WeakPolarHBondContact OD1-CG 3.49Å
90	V	87.7	Confident	84	Confident	14 Å²	14	66.7 Å²	66.7	9%	0.085	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	104.4	172.1	-176.9	0	0	0	0	106.1	A44 I45 Y48 F49 V88 D92 V93 I95	A44-V90 HydrophobicContact CB-CG1 4.12Å; I45-V90 HydrophobicContact CG1-CB 4.47Å; I45-V90 HydrophobicContact CG1-CG1 4.06Å; Y48-V90 HydrophobicContact CD1-CG2 3.65Å; Y48-V90 HydrophobicContact CD2-CG2 4.13Å; Y48-V90 HydrophobicContact CE1-CG2 4.08Å; Y48-V90 HydrophobicContact CG-CG1 4.41Å; Y48-V90 HydrophobicContact CG-CG2 3.68Å; F49-V90 HydrophobicContact CE2-CG2 4.23Å; V88-V90 HydrophobicContact CG2-CG2 4.25Å; V90-D92 PolarHBondContact O-N 3.05Å; V90-V93 PolarHBondContact N-O 3.44Å; V90-V93 PolarHBondContact O-N 2.98Å; V90-V93 VanDerWaalsContact O-N 3.11Å; V90-I95 HydrophobicContact CB-CD1 3.89Å; V90-I95 HydrophobicContact CG2-CD1 3.68Å
91	G	85.1	Confident	82.2	Confident	69 Å²	69	66.5 Å²	66.5	71%	0.711	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	-131.1	-162.6	0	0	0	0	0	111	V93	G91-V93 VanDerWaalsContact C-N 3.27Å; G91-V93 PolarHBondContact O-N 3.15Å
92	D	83.1	Confident	79.7	Confident	179 Å²	179	65 Å²	65	96%	0.957	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-0.1	178.9	-60.6	-39	0	0	0	114	V90	V90-D92 PolarHBondContact O-N 3.05Å
93	V	83.9	Confident	76.9	Confident	31 Å²	31	66.8 Å²	66.8	19%	0.188	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	116.3	-174.2	-170.6	0	0	0	0	111.1	A33 A38 L40 V90 G91 I95	A33-V93 HydrophobicContact CB-CG1 4.01Å; A38-V93 HydrophobicContact CB-CG1 4.14Å; A38-V93 HydrophobicContact CB-CG2 4.16Å; L40-V93 HydrophobicContact CD2-CG1 4.22Å; V90-V93 PolarHBondContact N-O 3.44Å; V90-V93 PolarHBondContact O-N 2.98Å; V90-V93 VanDerWaalsContact O-N 3.11Å; G91-V93 VanDerWaalsContact C-N 3.27Å; G91-V93 PolarHBondContact O-N 3.15Å; V93-I95 HydrophobicContact CG1-CG1 3.98Å; V93-I95 PolarHBondContact O-N 3Å
94	K	88.1	Confident	74.4	Confident	109 Å²	109	67.8 Å²	67.8	47%	0.474	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	112.7	167.6	-108	179.5	-179.5	160.1	0	111	R34 I87 N89	R34-K94 HydrophobicContact CB-CB 4.41Å; R34-K94 PolarHBondContact N-O 2.94Å; I87-K94 HydrophobicContact CG2-CD 4.36Å; I87-K94 HydrophobicContact CG2-CG 4.04Å; N89-K94 WeakPolarHBondContact OD1-CE 3.32Å; N89-K94 WeakPolarHBondContact OD1-CG 3.49Å
95	I	89.4	Confident	71.9	Confident	1 Å²	1	67 Å²	67	1%	0.005	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.9	-177.9	-57.3	178.4	0	0	0	109.6	L31 L40 I45 I87 V88 V90 V93	L31-I95 HydrophobicContact CB-CG2 3.71Å; L31-I95 HydrophobicContact CD1-CG2 4.46Å; L31-I95 HydrophobicContact CD2-CG2 4.06Å; L31-I95 HydrophobicContact CG-CG2 4.29Å; L40-I95 HydrophobicContact CD2-CD1 3.62Å; L40-I95 HydrophobicContact CD2-CG1 3.73Å; I45-I95 HydrophobicContact CD1-CD1 3.74Å; I45-I95 HydrophobicContact CG1-CD1 3.84Å; I87-I95 CarbonylContact C-O 3.57Å; I87-I95 VanDerWaalsContact CA-O 3.25Å; I87-I95 WeakPolarHBondContact CA-O 3.38Å; V88-I95 HydrophobicContact CG2-CB 3.99Å; V88-I95 HydrophobicContact CG2-CG2 4.48Å; V88-I95 PolarHBondContact N-O 3.45Å; V88-I95 PolarHBondContact O-N 3.41Å; V90-I95 HydrophobicContact CB-CD1 3.89Å; V90-I95 HydrophobicContact CG2-CD1 3.68Å; V93-I95 HydrophobicContact CG1-CG1 3.98Å; V93-I95 PolarHBondContact O-N 3Å
96	R	86.2	Confident	69.2	Low	133 Å²	133	67.7 Å²	67.7	50%	0.502	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	128.1	165	-103.9	-178.1	164.3	179.2	-4	109.9	L31 V32 K86 I87	L31-R96 WeakPolarHBondContact CA-O 3.24Å; V32-R96 PolarHBondContact N-O 2.92Å; V32-R96 PolarHBondContact O-N 2.84Å; K86-R96 WeakPolarHBondContact O-CA 3.38Å; I87-R96 HydrophobicContact CG1-CG 4.02Å
97	V	85.9	Confident	67	Low	6 Å²	6	66 Å²	66	4%	0.036	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117.4	174.3	-169	0	0	0	0	108.6	A29 L31 F49 A82 K86 V88	A29-V97 HydrophobicContact CB-CG1 4.29Å; L31-V97 HydrophobicContact CD2-CB 4.07Å; L31-V97 HydrophobicContact CD2-CG1 3.8Å; L31-V97 HydrophobicContact CD2-CG2 3.86Å; F49-V97 HydrophobicContact CE1-CG1 4.23Å; F49-V97 HydrophobicContact CE1-CG2 3.85Å; F49-V97 HydrophobicContact CZ-CG2 3.75Å; A82-V97 HydrophobicContact CB-CG1 4.32Å; K86-V97 PolarHBondContact O-N 2.99Å; V88-V97 HydrophobicContact CG1-CG2 4.09Å; V88-V97 HydrophobicContact CG2-CG2 3.87Å
98	L	76.4	Confident	64.4	Low	77 Å²	77	70 Å²	70	40%	0.403	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	148.8	175.2	-57.3	170.3	0	0	0	108.1	A29 L30 V32 A100	A29-L98 CarbonylContact C-O 3.52Å; A29-L98 WeakPolarHBondContact CA-O 3.2Å; L30-L98 HydrophobicContact CB-CB 4.24Å; L30-L98 HydrophobicContact CD2-CD1 4.21Å; L30-L98 PolarHBondContact N-O 3.04Å; L30-L98 WeakPolarHBondContact O-CB 3.37Å; L30-L98 PolarHBondContact O-N 2.84Å; V32-L98 HydrophobicContact CG2-CD1 4.11Å; L98-A100 PolarHBondContact O-N 3.02Å
99	H	71.5	Confident	61.9	Low	64 Å²	64	77.3 Å²	77.3	30%	0.296	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	124.9	163.9	-139.9	-89.4	0	0	0	107.1	Q76 L79 D101	Q76-H99 PolarHBondContact NE2-NE2 3.05Å; L79-H99 WeakPolarHBondContact CD2-CE1 3.31Å; L79-H99 WeakPolarHBondContact CD2-NE2 3.48Å; L79-H99 WeakPolarHBondContact CG-NE2 3.25Å; H99-D101 IonicContact CE1-OD2 3.66Å; H99-D101 IonicContact ND1-OD2 3.49Å; H99-D101 PolarHBondContact ND1-OD2 2.77Å; H99-D101 PolarHBondContact O-N 2.97Å
100	A	59.2	Low	59.6	Low	13 Å²	13	75.9 Å²	75.9	11%	0.107	42%	0.415	C	S	.	.	S	Bend	trans	-70.2	1.8	-180	0	0	0	0	0	113.2	T28 L30 L98 T102	T28-A100 HydrophobicContact CG2-CB 3.49Å; T28-A100 VanDerWaalsContact CG2-CB 3.49Å; T28-A100 VanDerWaalsContact O-CB 3.24Å; T28-A100 WeakPolarHBondContact O-CB 3.46Å; T28-A100 PolarHBondContact O-N 2.74Å; L30-A100 HydrophobicContact CB-CB 3.9Å; L98-A100 PolarHBondContact O-N 3.02Å; A100-T102 PolarHBondContact O-N 2.83Å; A100-T102 PolarHBondContact O-OG1 3.49Å
101	D	46.5	Very low	57.4	Low	50 Å²	50	79 Å²	79	27%	0.267	43%	0.431	S	S	.	.			trans	-76.1	54.9	161.4	-72.7	-43.6	0	0	0	111.1	H99 G103 R255	H99-D101 IonicContact CE1-OD2 3.66Å; H99-D101 IonicContact ND1-OD2 3.49Å; H99-D101 PolarHBondContact ND1-OD2 2.77Å; H99-D101 PolarHBondContact O-N 2.97Å; D101-G103 PolarHBondContact O-N 3.29Å; D101-R255 IonicContact OD1-NH1 3.42Å; D101-R255 PolarHBondContact OD1-NH1 3.13Å; D101-R255 IonicContact OD2-CZ 3.19Å; D101-R255 IonicContact OD2-NH1 2.74Å; D101-R255 PolarHBondContact OD2-NH1 3.13Å; D101-R255 IonicContact OD2-NH2 3.31Å; D101-R255 PolarHBondContact OD2-NH2 2.86Å
102	T	36.9	Very low	55.5	Low	101 Å²	101	80.8 Å²	80.8	62%	0.62	42%	0.423	S	S	*	.	S	Bend		-59.1	97	128.1	50.8	0	0	0	0	103.3	A100	A100-T102 PolarHBondContact O-N 2.83Å; A100-T102 PolarHBondContact O-OG1 3.49Å
103	G	29.2	Very low	53.5	Low	37 Å²	37	81.6 Å²	81.6	38%	0.381	41%	0.413	S	S	.	.			trans	-45.3	150.9	-159.5	0	0	0	0	0	112.2	D101 A105	D101-G103 PolarHBondContact O-N 3.29Å; G103-A105 VanDerWaalsContact C-N 3.3Å; G103-A105 PolarHBondContact O-N 2.82Å
104	P	30.4	Very low	51.8	Low	47 Å²	47	84.3 Å²	84.3	31%	0.305	42%	0.424	S	S	.	.			trans	-56.5	112.6	163.5	27.7	-30	0	0	0	104.8	V106 R270	P104-V106 HydrophobicContact CB-CG2 4.31Å; P104-V106 PolarHBondContact O-N 2.82Å; P104-R270 PolarHBondContact O-NH2 3.14Å
105	A	32	Very low	50.2	Low	62 Å²	62	80.5 Å²	80.5	51%	0.512	41%	0.411	S	S	.	.			trans	-52.8	87.3	140.9	0	0	0	0	0	104.8	G103 K107	G103-A105 VanDerWaalsContact C-N 3.3Å; G103-A105 PolarHBondContact O-N 2.82Å; A105-K107 VanDerWaalsContact CA-N 3.34Å; A105-K107 HydrophobicContact CB-CB 4.11Å; A105-K107 HydrophobicContact CB-CD 4.19Å; A105-K107 HydrophobicContact CB-CG 4.05Å; A105-K107 PolarHBondContact O-N 2.96Å; A105-K107 VanDerWaalsContact O-N 3.15Å
106	V	30.8	Very low	48.2	Very low	123 Å²	123	87.3 Å²	87.3	75%	0.745	44%	0.441	S	S	*	.			trans	-74.8	57.5	134	-167.5	0	0	0	0	104.8	P104 K108	P104-V106 HydrophobicContact CB-CG2 4.31Å; P104-V106 PolarHBondContact O-N 2.82Å; V106-K108 PolarHBondContact O-N 2.97Å
107	K	35.3	Very low	46.7	Very low	118 Å²	118	88.5 Å²	88.5	51%	0.513	45%	0.445	S	S	.	.			trans	-70.9	117	145.3	-76.6	172.5	175.7	162.5	0	100	A105 H109 K328	A105-K107 VanDerWaalsContact CA-N 3.34Å; A105-K107 HydrophobicContact CB-CB 4.11Å; A105-K107 HydrophobicContact CB-CD 4.19Å; A105-K107 HydrophobicContact CB-CG 4.05Å; A105-K107 PolarHBondContact O-N 2.96Å; A105-K107 VanDerWaalsContact O-N 3.15Å; K107-H109 VanDerWaalsContact C-N 3.34Å; K107-H109 PolarHBondContact O-N 2.85Å; K107-K328 VanDerWaalsContact NZ-CE 3.28Å
108	K	35.7	Very low	45.5	Very low	139 Å²	139	89 Å²	89	60%	0.604	45%	0.447	S	S	*	.			trans	-36.6	114.9	157.9	-94.6	-172.3	167.9	-162.9	0	104.7	V106 F110 E114	V106-K108 PolarHBondContact O-N 2.97Å; K108-F110 PolarHBondContact O-N 3.31Å; K108-E114 IonicContact NZ-OE1 3.9Å; K108-E114 PolarHBondContact NZ-OE1 3.16Å
109	H	36.2	Very low	44.8	Very low	160 Å²	160	92.1 Å²	92.1	74%	0.741	46%	0.457	S	S	*	.			trans	-53.1	124.8	164.1	-119.1	-64.8	0	0	0	102.7	K107 D111	K107-H109 VanDerWaalsContact C-N 3.34Å; K107-H109 PolarHBondContact O-N 2.85Å; H109-D111 PolarHBondContact O-N 3.42Å
110	F	41.5	Very low	44.7	Very low	61 Å²	61	96.3 Å²	96.3	27%	0.268	48%	0.477	S	S	.	.			trans	-58.2	95.6	173.1	-156.5	-87.2	0	0	0	104.5	K108 I112 Y313 F317	K108-F110 PolarHBondContact O-N 3.31Å; F110-I112 PolarHBondContact O-N 2.74Å; F110-Y313 HydrophobicContact CE1-CD2 4.38Å; F110-Y313 HydrophobicContact CE1-CE1 4.18Å; F110-Y313 AromaticContact CE1-CE2 3.66Å; F110-Y313 HydrophobicContact CE1-CE2 3.66Å; F110-Y313 AromaticContact CE1-CZ 3.5Å; F110-Y313 WeakPolarHBondContact CE1-OH 3.48Å; F110-Y313 AromaticContact CE2-CD2 3.74Å; F110-Y313 HydrophobicContact CE2-CD2 3.74Å; F110-Y313 AromaticContact CE2-CE2 3.7Å; F110-Y313 HydrophobicContact CE2-CE2 3.7Å; F110-Y313 HydrophobicContact CE2-CG 4.45Å; F110-Y313 HydrophobicContact CZ-CD1 4.11Å; F110-Y313 AromaticContact CZ-CD2 3.32Å; F110-Y313 HydrophobicContact CZ-CD2 3.32Å; F110-Y313 AromaticContact CZ-CE1 3.82Å; F110-Y313 HydrophobicContact CZ-CE1 3.82Å; F110-Y313 AromaticContact CZ-CE2 2.98Å; F110-Y313 HydrophobicContact CZ-CE2 2.98Å; F110-Y313 AromaticContact CZ-CG 3.87Å; F110-Y313 HydrophobicContact CZ-CG 3.87Å; F110-Y313 AromaticContact CZ-CZ 3.23Å; F110-F317 HydrophobicContact CD1-CD2 4.1Å; F110-F317 AromaticContact CE1-CD2 3.71Å; F110-F317 HydrophobicContact CE1-CD2 3.71Å
111	D	43.2	Very low	45.5	Very low	78 Å²	78	96.2 Å²	96.2	42%	0.417	48%	0.476	S	S	.	.			trans	-78.8	115.7	-172	-166.4	-15	0	0	0	104.1	H109 R113 E114	H109-D111 PolarHBondContact O-N 3.42Å; D111-R113 PolarHBondContact O-N 2.89Å; D111-R113 WeakPolarHBondContact OD1-CB 3.34Å; D111-R113 WeakPolarHBondContact OD1-CG 3.5Å; D111-R113 PolarHBondContact OD1-N 3.41Å; D111-E114 PolarHBondContact O-N 3Å
112	I	44.3	Very low	47	Very low	107 Å²	107	102.1 Å²	102.1	55%	0.549	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-54.4	-18.9	174.7	-67.8	169.1	0	0	0	109.8	F110 S115 F317	F110-I112 PolarHBondContact O-N 2.74Å; I112-S115 WeakPolarHBondContact O-CB 3.42Å; I112-S115 PolarHBondContact O-N 3.02Å; I112-S115 PolarHBondContact O-OG 3.03Å; I112-F317 HydrophobicContact CG1-CE2 4.38Å
113	R	40.7	Very low	49	Very low	197 Å²	197	99.2 Å²	99.2	74%	0.743	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-74.5	-19.9	172.9	-59.9	178.8	-173.7	-155.1	1.8	115.3	D111 S115	D111-R113 PolarHBondContact O-N 2.89Å; D111-R113 WeakPolarHBondContact OD1-CB 3.34Å; D111-R113 WeakPolarHBondContact OD1-CG 3.5Å; D111-R113 PolarHBondContact OD1-N 3.41Å; R113-S115 PolarHBondContact O-N 3.17Å; R113-S115 VanDerWaalsContact O-N 3.09Å
114	E	49.2	Very low	51.7	Low	87 Å²	87	97.8 Å²	97.8	41%	0.407	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-67.1	-4.5	169.2	-78.4	-176.5	164.3	0	0	111.2	K108 D111 F116	K108-E114 IonicContact NZ-OE1 3.9Å; K108-E114 PolarHBondContact NZ-OE1 3.16Å; D111-E114 PolarHBondContact O-N 3Å; E114-F116 PolarHBondContact O-N 3.28Å
115	S	53	Low	54.4	Low	30 Å²	30	97 Å²	97	21%	0.21	46%	0.46	C	S	.	.	G	3₁₀ helix	trans	-67	-8.2	176.3	68	0	0	0	0	116.6	I112 R113 R117 F118 K119	I112-S115 WeakPolarHBondContact O-CB 3.42Å; I112-S115 PolarHBondContact O-N 3.02Å; I112-S115 PolarHBondContact O-OG 3.03Å; R113-S115 PolarHBondContact O-N 3.17Å; R113-S115 VanDerWaalsContact O-N 3.09Å; S115-R117 PolarHBondContact O-N 2.97Å; S115-F118 PolarHBondContact O-N 3.43Å; S115-K119 WeakPolarHBondContact O-CG 3.44Å; S115-K119 PolarHBondContact O-N 3.5Å
116	F	47.1	Very low	57	Low	143 Å²	143	98.1 Å²	98.1	63%	0.627	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-63.1	-41.8	-174.4	-97.8	-85.7	0	0	0	113.3	E114 K119	E114-F116 PolarHBondContact O-N 3.28Å; F116-K119 PolarHBondContact O-N 3.37Å
117	R	55.1	Low	59.6	Low	159 Å²	159	92.5 Å²	92.5	60%	0.6	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-72.9	-30.7	179.7	-73.5	179.5	179	176.4	-1.9	113.8	S115 K119 E120 V130 E134	S115-R117 PolarHBondContact O-N 2.97Å; R117-K119 PolarHBondContact O-N 2.74Å; R117-E120 PolarHBondContact O-N 3.14Å; R117-V130 HydrophobicContact CB-CG1 4.28Å; R117-E134 VanDerWaalsContact CD-OE1 3.23Å; R117-E134 WeakPolarHBondContact CD-OE1 3.39Å; R117-E134 IonicContact CZ-OE1 3.87Å; R117-E134 IonicContact NH1-OE1 3.01Å; R117-E134 PolarHBondContact NH1-OE1 3.4Å; R117-E134 VanDerWaalsContact NH1-OE1 3.1Å
118	F	61.8	Low	62.2	Low	16 Å²	16	86.9 Å²	86.9	7%	0.07	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-68	-24.8	175.6	-55.6	-53.9	0	0	0	112.8	S115 E120 Q127 V130 I131 Y313	S115-F118 PolarHBondContact O-N 3.43Å; F118-E120 VanDerWaalsContact C-N 3.28Å; F118-Q127 PolarHBondContact O-NE2 2.89Å; F118-V130 HydrophobicContact CD1-CB 4.07Å; F118-V130 HydrophobicContact CD1-CG1 3.85Å; F118-V130 HydrophobicContact CE1-CB 3.86Å; F118-V130 HydrophobicContact CE1-CG1 3.46Å; F118-V130 VanDerWaalsContact CE1-CG1 3.46Å; F118-V130 HydrophobicContact CZ-CG1 4.34Å; F118-I131 HydrophobicContact CD1-CG1 3.9Å; F118-I131 HydrophobicContact CE1-CB 4.22Å; F118-I131 HydrophobicContact CE1-CD1 4.32Å; F118-I131 HydrophobicContact CE1-CG1 3.26Å; F118-I131 HydrophobicContact CZ-CG1 3.76Å; F118-Y313 AromaticContact CE2-CE2 3.84Å; F118-Y313 HydrophobicContact CE2-CE2 3.84Å; F118-Y313 AromaticContact CE2-CZ 3.72Å; F118-Y313 VanDerWaalsContact CE2-OH 3.24Å; F118-Y313 WeakPolarHBondContact CE2-OH 3.3Å; F118-Y313 AromaticContact CZ-CE2 3.98Å; F118-Y313 HydrophobicContact CZ-CE2 3.98Å
119	K	61.9	Low	64.8	Low	142 Å²	142	82.4 Å²	82.4	62%	0.617	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-72	-22.7	176.4	-70	176.9	-176.7	-179.8	0	113	S115 F116 R117	S115-K119 WeakPolarHBondContact O-CG 3.44Å; S115-K119 PolarHBondContact O-N 3.5Å; F116-K119 PolarHBondContact O-N 3.37Å; R117-K119 PolarHBondContact O-N 2.74Å
120	E	69.3	Low	67.2	Low	153 Å²	153	76.4 Å²	76.4	72%	0.715	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-24.7	178.4	-64.6	177.7	175.1	0	0	112.3	R117 F118	R117-E120 PolarHBondContact O-N 3.14Å; F118-E120 VanDerWaalsContact C-N 3.28Å
121	A	74.8	Confident	69.4	Low	10 Å²	10	73.5 Å²	73.5	8%	0.083	34%	0.342	C	S	.	.			trans	-69.4	128.5	175.6	0	0	0	0	0	111.1	E126 Q127	A121-E126 WeakPolarHBondContact CA-OE2 3.39Å; A121-E126 HydrophobicContact CB-CB 3.77Å; A121-Q127 HydrophobicContact CB-CB 4.41Å; A121-Q127 HydrophobicContact CB-CG 3.48Å; A121-Q127 VanDerWaalsContact CB-CG 3.48Å
122	K	77.9	Confident	71.7	Confident	175 Å²	175	70.8 Å²	70.8	76%	0.761	33%	0.326	S	S	*	.	S	Bend	trans	-84.7	-16.6	-173.8	-62.7	179.2	-177.5	177	0	113.5	E126	K122-E126 PolarHBondContact N-OE2 3.43Å
123	S	80	Confident	73.8	Confident	40 Å²	40	68.3 Å²	68.3	28%	0.28	32%	0.315	S	S	.	.	S	Bend	trans	-139.8	162.5	-177.5	67.4	0	0	0	0	111.7	D125 E126 Q127	S123-D125 VanDerWaalsContact C-N 3.26Å; S123-D125 PolarHBondContact O-N 3.03Å; S123-E126 PolarHBondContact O-N 3.01Å; S123-E126 WeakPolarHBondContact OG-CG 3.26Å; S123-E126 PolarHBondContact OG-N 3.18Å; S123-E126 VanDerWaalsContact OG-N 3.15Å; S123-Q127 WeakPolarHBondContact O-CG 3.03Å; S123-Q127 PolarHBondContact O-N 2.84Å
124	L	85	Confident	75.9	Confident	6 Å²	6	61.4 Å²	61.4	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-64.8	-33.2	173.5	-177.4	70	0	0	0	111.5	Q127 A128 T310 T374 F377 P466 L467	L124-Q127 PolarHBondContact O-N 2.94Å; L124-A128 VanDerWaalsContact O-CB 3.3Å; L124-A128 WeakPolarHBondContact O-CB 3.36Å; L124-A128 PolarHBondContact O-N 3.31Å; L124-T310 HydrophobicContact CD1-CG2 3.88Å; L124-T310 HydrophobicContact CG-CG2 4.4Å; L124-T374 WeakPolarHBondContact CB-OG1 3.28Å; L124-F377 HydrophobicContact CD2-CB 3.71Å; L124-F377 HydrophobicContact CD2-CD1 3.77Å; L124-F377 HydrophobicContact CD2-CD2 4.5Å; L124-F377 HydrophobicContact CD2-CG 3.74Å; L124-P466 HydrophobicContact CB-CG 4.34Å; L124-P466 HydrophobicContact CD1-CB 4.28Å; L124-P466 HydrophobicContact CD1-CG 3.95Å; L124-P466 HydrophobicContact CD2-CG 3.82Å; L124-P466 HydrophobicContact CG-CG 4.24Å; L124-L467 HydrophobicContact CD1-CD1 4.01Å; L124-L467 HydrophobicContact CD1-CD2 4.5Å; L124-L467 HydrophobicContact CD1-CG 3.95Å
125	D	88.2	Confident	77.7	Confident	31 Å²	31	58.4 Å²	58.4	17%	0.166	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-43.9	175.1	-73.2	-109.1	0	0	0	111.4	S123 A128 V129 G371 I373 T374	S123-D125 VanDerWaalsContact C-N 3.26Å; S123-D125 PolarHBondContact O-N 3.03Å; D125-A128 WeakPolarHBondContact O-CB 3.49Å; D125-A128 PolarHBondContact O-N 2.9Å; D125-V129 WeakPolarHBondContact O-CG2 2.92Å; D125-V129 PolarHBondContact O-N 3.02Å; D125-V129 VanDerWaalsContact O-N 3.13Å; D125-G371 WeakPolarHBondContact OD2-CA 3.13Å; D125-I373 WeakPolarHBondContact OD1-CB 3.48Å; D125-I373 PolarHBondContact OD1-N 3.31Å; D125-T374 WeakPolarHBondContact OD2-CB 3.42Å; D125-T374 PolarHBondContact OD2-N 3.06Å; D125-T374 PolarHBondContact OD2-OG1 3.37Å
126	E	86.4	Confident	79.4	Confident	86 Å²	86	62 Å²	62	40%	0.402	29%	0.286	S	S	.	.	H	α-helix	trans	-64.1	-43.7	173.1	-74.5	175.1	-158.4	0	0	111.7	A121 K122 S123 A128 V129 V130	A121-E126 WeakPolarHBondContact CA-OE2 3.39Å; A121-E126 HydrophobicContact CB-CB 3.77Å; K122-E126 PolarHBondContact N-OE2 3.43Å; S123-E126 PolarHBondContact O-N 3.01Å; S123-E126 WeakPolarHBondContact OG-CG 3.26Å; S123-E126 PolarHBondContact OG-N 3.18Å; S123-E126 VanDerWaalsContact OG-N 3.15Å; E126-A128 VanDerWaalsContact C-N 3.29Å; E126-A128 PolarHBondContact O-N 3.23Å; E126-V129 WeakPolarHBondContact O-CB 3.3Å; E126-V129 PolarHBondContact O-N 2.86Å; E126-V130 WeakPolarHBondContact O-CG2 3.46Å; E126-V130 PolarHBondContact O-N 3.18Å; E126-V130 VanDerWaalsContact O-N 3.11Å
127	Q	85.9	Confident	81.2	Confident	5 Å²	5	56.7 Å²	56.7	2%	0.023	26%	0.264	C	S	.	.	H	α-helix	trans	-59.6	-41.1	174.8	-72.9	-178.2	-3.6	0	0	111.8	F118 A121 S123 L124 V129 V130 I131 L467	F118-Q127 PolarHBondContact O-NE2 2.89Å; A121-Q127 HydrophobicContact CB-CB 4.41Å; A121-Q127 HydrophobicContact CB-CG 3.48Å; A121-Q127 VanDerWaalsContact CB-CG 3.48Å; S123-Q127 WeakPolarHBondContact O-CG 3.03Å; S123-Q127 PolarHBondContact O-N 2.84Å; L124-Q127 PolarHBondContact O-N 2.94Å; Q127-V129 VanDerWaalsContact C-N 3.29Å; Q127-V129 PolarHBondContact O-N 3.21Å; Q127-V130 PolarHBondContact O-N 2.94Å; Q127-V130 VanDerWaalsContact O-N 3.15Å; Q127-I131 WeakPolarHBondContact O-CB 3.29Å; Q127-I131 VanDerWaalsContact O-CG1 3.22Å; Q127-I131 WeakPolarHBondContact O-CG1 3.36Å; Q127-I131 PolarHBondContact O-N 3.28Å; Q127-L467 HydrophobicContact CB-CD1 4.44Å
128	A	89.3	Confident	82.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.2	-38	178.9	0	0	0	0	0	111.9	L124 D125 E126 H132 R306 T310 I373	L124-A128 VanDerWaalsContact O-CB 3.3Å; L124-A128 WeakPolarHBondContact O-CB 3.36Å; L124-A128 PolarHBondContact O-N 3.31Å; D125-A128 WeakPolarHBondContact O-CB 3.49Å; D125-A128 PolarHBondContact O-N 2.9Å; E126-A128 VanDerWaalsContact C-N 3.29Å; E126-A128 PolarHBondContact O-N 3.23Å; A128-H132 WeakPolarHBondContact O-CB 3.29Å; A128-H132 PolarHBondContact O-N 3.37Å; A128-R306 HydrophobicContact CB-CB 4.39Å; A128-T310 VanDerWaalsContact CA-OG1 3.31Å; A128-T310 WeakPolarHBondContact CA-OG1 3.31Å; A128-T310 WeakPolarHBondContact CB-OG1 3.05Å; A128-I373 HydrophobicContact CB-CD1 3.71Å; A128-I373 HydrophobicContact CB-CG2 3.76Å
129	V	89.5	Confident	83	Confident	45 Å²	45	57.8 Å²	57.8	27%	0.273	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-47.7	173	174.4	0	0	0	0	110.6	D125 E126 Q127 N133	D125-V129 WeakPolarHBondContact O-CG2 2.92Å; D125-V129 PolarHBondContact O-N 3.02Å; D125-V129 VanDerWaalsContact O-N 3.13Å; E126-V129 WeakPolarHBondContact O-CB 3.3Å; E126-V129 PolarHBondContact O-N 2.86Å; Q127-V129 VanDerWaalsContact C-N 3.29Å; Q127-V129 PolarHBondContact O-N 3.21Å; V129-N133 WeakPolarHBondContact CG1-ND2 3.47Å; V129-N133 VanDerWaalsContact O-CB 3.25Å; V129-N133 WeakPolarHBondContact O-CB 3.43Å; V129-N133 VanDerWaalsContact O-CG 3.22Å; V129-N133 PolarHBondContact O-N 2.99Å; V129-N133 PolarHBondContact O-ND2 2.88Å
130	V	87.3	Confident	84	Confident	34 Å²	34	53.7 Å²	53.7	21%	0.206	27%	0.271	C	S	.	.	H	α-helix	trans	-62.5	-51.3	178.5	-178	0	0	0	0	110.6	R117 F118 E126 Q127 H132 N133 E134	R117-V130 HydrophobicContact CB-CG1 4.28Å; F118-V130 HydrophobicContact CD1-CB 4.07Å; F118-V130 HydrophobicContact CD1-CG1 3.85Å; F118-V130 HydrophobicContact CE1-CB 3.86Å; F118-V130 HydrophobicContact CE1-CG1 3.46Å; F118-V130 VanDerWaalsContact CE1-CG1 3.46Å; F118-V130 HydrophobicContact CZ-CG1 4.34Å; E126-V130 WeakPolarHBondContact O-CG2 3.46Å; E126-V130 PolarHBondContact O-N 3.18Å; E126-V130 VanDerWaalsContact O-N 3.11Å; Q127-V130 PolarHBondContact O-N 2.94Å; Q127-V130 VanDerWaalsContact O-N 3.15Å; V130-H132 VanDerWaalsContact C-N 3.33Å; V130-H132 PolarHBondContact O-N 3.03Å; V130-N133 PolarHBondContact O-N 2.85Å; V130-E134 HydrophobicContact CG1-CG 4.18Å; V130-E134 WeakPolarHBondContact O-CB 3.47Å; V130-E134 WeakPolarHBondContact O-CG 3.33Å; V130-E134 PolarHBondContact O-N 3.22Å
131	I	87.5	Confident	84.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-56	-49.5	-179.8	-68.8	166.6	0	0	0	110.1	F118 Q127 N135 Y313 L467	F118-I131 HydrophobicContact CD1-CG1 3.9Å; F118-I131 HydrophobicContact CE1-CB 4.22Å; F118-I131 HydrophobicContact CE1-CD1 4.32Å; F118-I131 HydrophobicContact CE1-CG1 3.26Å; F118-I131 HydrophobicContact CZ-CG1 3.76Å; Q127-I131 WeakPolarHBondContact O-CB 3.29Å; Q127-I131 VanDerWaalsContact O-CG1 3.22Å; Q127-I131 WeakPolarHBondContact O-CG1 3.36Å; Q127-I131 PolarHBondContact O-N 3.28Å; I131-N135 VanDerWaalsContact O-CB 3.3Å; I131-N135 WeakPolarHBondContact O-CB 3.31Å; I131-N135 PolarHBondContact O-N 2.95Å; I131-N135 VanDerWaalsContact O-N 3.11Å; I131-N135 PolarHBondContact O-ND2 3.33Å; I131-Y313 HydrophobicContact CD1-CD1 3.92Å; I131-Y313 HydrophobicContact CD1-CD2 4.4Å; I131-Y313 HydrophobicContact CD1-CE1 4.35Å; I131-Y313 HydrophobicContact CD1-CG 3.98Å; I131-Y313 HydrophobicContact CG1-CD2 4.17Å; I131-Y313 HydrophobicContact CG1-CE2 4.41Å; I131-Y313 HydrophobicContact CG1-CG 4.24Å; I131-Y313 HydrophobicContact CG2-CD2 3.85Å; I131-Y313 HydrophobicContact CG2-CG 3.93Å; I131-L467 HydrophobicContact CD1-CD1 3.34Å
132	H	90.7	Very high	85.2	Confident	20 Å²	20	55.9 Å²	55.9	9%	0.093	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-48.2	179.6	178.8	67.2	0	0	0	111.5	A128 V130 E134 N135 R136 P305 R306 S309	A128-H132 WeakPolarHBondContact O-CB 3.29Å; A128-H132 PolarHBondContact O-N 3.37Å; V130-H132 VanDerWaalsContact C-N 3.33Å; V130-H132 PolarHBondContact O-N 3.03Å; H132-E134 PolarHBondContact O-N 2.83Å; H132-N135 PolarHBondContact O-N 3.3Å; H132-R136 WeakPolarHBondContact O-CB 3.42Å; H132-R136 WeakPolarHBondContact O-CG 3.36Å; H132-R136 PolarHBondContact O-N 3.12Å; H132-P305 PolarHBondContact ND1-O 2.95Å; H132-R306 HydrophobicContact CB-CB 4.36Å; H132-R306 HydrophobicContact CB-CG 3.84Å; H132-S309 PolarHBondContact ND1-OG 3.06Å; H132-S309 VanDerWaalsContact ND1-OG 3.12Å
133	N	88.7	Confident	85.7	Confident	56 Å²	56	48.5 Å²	48.5	30%	0.299	26%	0.255	S	S	.	.	H	α-helix	trans	-66.4	-35.3	-176.8	-75.7	-22.8	0	0	0	113	V129 V130 H138	V129-N133 WeakPolarHBondContact CG1-ND2 3.47Å; V129-N133 VanDerWaalsContact O-CB 3.25Å; V129-N133 WeakPolarHBondContact O-CB 3.43Å; V129-N133 VanDerWaalsContact O-CG 3.22Å; V129-N133 PolarHBondContact O-N 2.99Å; V129-N133 PolarHBondContact O-ND2 2.88Å; V130-N133 PolarHBondContact O-N 2.85Å; N133-H138 PolarHBondContact O-CE1 2.77Å; N133-H138 PolarHBondContact O-NE2 3.23Å; N133-H138 VanDerWaalsContact O-NE2 3.11Å
134	E	85.8	Confident	86.1	Confident	52 Å²	52	50.6 Å²	50.6	24%	0.243	26%	0.263	C	S	.	.	H	α-helix	trans	-77.3	-28.3	179.1	-70	-173.4	159.3	0	0	113.1	R117 V130 H132 N177	R117-E134 VanDerWaalsContact CD-OE1 3.23Å; R117-E134 WeakPolarHBondContact CD-OE1 3.39Å; R117-E134 IonicContact CZ-OE1 3.87Å; R117-E134 IonicContact NH1-OE1 3.01Å; R117-E134 PolarHBondContact NH1-OE1 3.4Å; R117-E134 VanDerWaalsContact NH1-OE1 3.1Å; V130-E134 HydrophobicContact CG1-CG 4.18Å; V130-E134 WeakPolarHBondContact O-CB 3.47Å; V130-E134 WeakPolarHBondContact O-CG 3.33Å; V130-E134 PolarHBondContact O-N 3.22Å; H132-E134 PolarHBondContact O-N 2.83Å; E134-N177 PolarHBondContact O-ND2 2.89Å
135	N	86.8	Confident	86.4	Confident	24 Å²	24	52.5 Å²	52.5	13%	0.128	28%	0.277	C	S	.	.	H	α-helix	trans	-99.7	-24.3	-175.8	-70	-81.6	0	0	0	113.5	I131 H132 W176 N177	I131-N135 VanDerWaalsContact O-CB 3.3Å; I131-N135 WeakPolarHBondContact O-CB 3.31Å; I131-N135 PolarHBondContact O-N 2.95Å; I131-N135 VanDerWaalsContact O-N 3.11Å; I131-N135 PolarHBondContact O-ND2 3.33Å; H132-N135 PolarHBondContact O-N 3.3Å; N135-W176 HydrophobicContact CB-CB 4.48Å; N135-W176 HydrophobicContact CB-CD2 3.67Å; N135-W176 HydrophobicContact CB-CE3 4.16Å; N135-W176 HydrophobicContact CB-CG 3.82Å; N135-W176 HydrophobicContact CB-CZ2 4.23Å; N135-W176 CarbonylContact O-C 3.6Å; N135-W176 VanDerWaalsContact O-C 3.3Å; N135-W176 WeakPolarHBondContact O-CA 3.22Å; N135-W176 WeakPolarHBondContact O-CB 3.39Å; N135-N177 PolarHBondContact O-N 2.9Å
136	R	87.9	Confident	86.6	Confident	104 Å²	104	51.8 Å²	51.8	39%	0.392	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-59.7	157.1	-176.1	68.2	-177.3	-177.3	168.3	0.6	113.1	H132 H138	H132-R136 WeakPolarHBondContact O-CB 3.42Å; H132-R136 WeakPolarHBondContact O-CG 3.36Å; H132-R136 PolarHBondContact O-N 3.12Å; R136-H138 PolarHBondContact O-CD2 3.39Å; R136-H138 VanDerWaalsContact O-CD2 3.32Å; R136-H138 PolarHBondContact O-N 3.47Å
137	I	85.2	Confident	86.9	Confident	32 Å²	32	47.9 Å²	47.9	16%	0.164	26%	0.255	C	S	.	.			trans	-71.3	109.5	169.9	-60.8	172.3	0	0	0	108.5	V140 G175 W176	I137-V140 HydrophobicContact CG2-CG2 4.05Å; I137-G175 PolarHBondContact N-O 2.78Å; I137-W176 WeakPolarHBondContact CG1-O 3.26Å
138	H	77.4	Confident	87.4	Confident	126 Å²	126	53.5 Å²	53.5	58%	0.583	28%	0.281	S	S	*	.	S	Bend	trans	-77	-23.7	-177.2	-68.9	-81.4	0	0	0	114.4	N133 R136	N133-H138 PolarHBondContact O-CE1 2.77Å; N133-H138 PolarHBondContact O-NE2 3.23Å; N133-H138 VanDerWaalsContact O-NE2 3.11Å; R136-H138 PolarHBondContact O-CD2 3.39Å; R136-H138 VanDerWaalsContact O-CD2 3.32Å; R136-H138 PolarHBondContact O-N 3.47Å
139	S	77.1	Confident	87.7	Confident	73 Å²	73	58.9 Å²	58.9	51%	0.51	30%	0.304	S	S	.	.			trans	-148.6	111.6	179.9	-178.8	0	0	0	0	111	K141	S139-K141 VanDerWaalsContact C-N 3.33Å
140	V	83.1	Confident	88	Confident	56 Å²	56	56.7 Å²	56.7	34%	0.339	29%	0.291	S	S	.	.	S	Bend	trans	-82.1	-17.5	172.8	-175.3	0	0	0	0	110.9	I137 G142 H143 L144 M166	I137-V140 HydrophobicContact CG2-CG2 4.05Å; V140-G142 VanDerWaalsContact C-N 3.28Å; V140-G142 PolarHBondContact O-N 2.91Å; V140-H143 WeakPolarHBondContact O-CB 3.33Å; V140-H143 PolarHBondContact O-N 2.97Å; V140-L144 HydrophobicContact CG1-CD1 4.17Å; V140-L144 HydrophobicContact CG1-CG 4.14Å; V140-L144 PolarHBondContact O-N 2.98Å; V140-M166 HydrophobicContact CG1-CE 3.6Å
141	K	85.2	Confident	88.4	Confident	169 Å²	169	57 Å²	57	74%	0.735	29%	0.29	S	S	*	.	H	α-helix	trans	-57.6	-38.9	-178.2	-169.8	176.1	-178	177	0	112.5	S139 L144 S145	S139-K141 VanDerWaalsContact C-N 3.33Å; K141-L144 PolarHBondContact O-N 3.01Å; K141-S145 WeakPolarHBondContact O-CB 3.3Å; K141-S145 PolarHBondContact O-N 2.86Å
142	G	84.1	Confident	88.9	Confident	39 Å²	39	61.5 Å²	61.5	40%	0.402	32%	0.318	S	S	.	.	H	α-helix	trans	-64.4	-40.1	175.4	0	0	0	0	0	112.8	V140 F146	V140-G142 VanDerWaalsContact C-N 3.28Å; V140-G142 PolarHBondContact O-N 2.91Å; G142-F146 PolarHBondContact O-N 2.81Å; G142-F146 VanDerWaalsContact O-N 3.09Å
143	H	87.8	Confident	89.1	Confident	20 Å²	20	61.7 Å²	61.7	9%	0.093	32%	0.319	C	S	.	.	H	α-helix	trans	-68.4	-42.5	177.3	-58.8	177.9	0	0	0	111.1	V140 F146 C147 M166 I181	V140-H143 WeakPolarHBondContact O-CB 3.33Å; V140-H143 PolarHBondContact O-N 2.97Å; H143-F146 WeakPolarHBondContact O-CB 3.4Å; H143-F146 PolarHBondContact O-N 3.06Å; H143-C147 PolarHBondContact O-N 3.09Å; H143-C147 PolarHBondContact O-SG 2.84Å; H143-M166 HydrophobicContact CB-CE 4.44Å; H143-M166 HydrophobicContact CB-SD 3.53Å; H143-M166 VanDerWaalsContact CB-SD 3.53Å; H143-I181 HydrophobicContact CB-CD1 4.44Å
144	L	89.9	Confident	89.5	Confident	85 Å²	85	59 Å²	59	45%	0.445	31%	0.305	S	S	.	.	H	α-helix	trans	-61.9	-46.4	175.9	-72.6	168.2	0	0	0	112.2	V140 K141 F146 C147 Q148 M166	V140-L144 HydrophobicContact CG1-CD1 4.17Å; V140-L144 HydrophobicContact CG1-CG 4.14Å; V140-L144 PolarHBondContact O-N 2.98Å; K141-L144 PolarHBondContact O-N 3.01Å; L144-F146 VanDerWaalsContact C-N 3.28Å; L144-F146 PolarHBondContact O-N 3.37Å; L144-C147 PolarHBondContact O-N 3.07Å; L144-C147 VanDerWaalsContact O-N 3.14Å; L144-Q148 WeakPolarHBondContact O-CG 3.23Å; L144-Q148 PolarHBondContact O-N 3.5Å; L144-M166 HydrophobicContact CD2-CE 3.38Å; L144-M166 HydrophobicContact CD2-SD 4.32Å; L144-M166 HydrophobicContact CG-CE 3.71Å
145	S	90.9	Very high	89.9	Confident	46 Å²	46	58.9 Å²	58.9	32%	0.322	30%	0.304	S	S	.	.	H	α-helix	trans	-61.6	-38.2	177.3	-175.9	0	0	0	0	111.9	K141 K149	K141-S145 WeakPolarHBondContact O-CB 3.3Å; K141-S145 PolarHBondContact O-N 2.86Å; S145-K149 WeakPolarHBondContact O-CG 3.46Å; S145-K149 PolarHBondContact O-N 2.97Å; S145-K149 VanDerWaalsContact O-N 3.12Å
146	F	91.6	Very high	90.3	Very high	15 Å²	15	64.5 Å²	64.5	7%	0.066	33%	0.327	C	S	.	.	H	α-helix	trans	-62.1	-47.3	172.7	172.1	-102.8	0	0	0	111.8	G142 H143 L144 Q148 K149 L150 F250 L252 V253 F269 N271	G142-F146 PolarHBondContact O-N 2.81Å; G142-F146 VanDerWaalsContact O-N 3.09Å; H143-F146 WeakPolarHBondContact O-CB 3.4Å; H143-F146 PolarHBondContact O-N 3.06Å; L144-F146 VanDerWaalsContact C-N 3.28Å; L144-F146 PolarHBondContact O-N 3.37Å; F146-Q148 PolarHBondContact O-N 3.3Å; F146-K149 PolarHBondContact O-N 2.77Å; F146-L150 HydrophobicContact CE1-CD2 4Å; F146-L150 HydrophobicContact CZ-CD2 4.06Å; F146-L150 WeakPolarHBondContact O-CB 3.43Å; F146-L150 PolarHBondContact O-N 3.18Å; F146-F250 HydrophobicContact CE2-CE1 4.39Å; F146-L252 HydrophobicContact CD2-CB 4.4Å; F146-L252 HydrophobicContact CE2-CB 4.08Å; F146-V253 HydrophobicContact CE2-CG2 4.25Å; F146-V253 HydrophobicContact CZ-CG2 4.04Å; F146-F269 HydrophobicContact CE1-CE2 4.04Å; F146-F269 HydrophobicContact CE1-CZ 4.49Å; F146-F269 AromaticContact CZ-CE2 3.69Å; F146-F269 HydrophobicContact CZ-CE2 3.69Å; F146-F269 HydrophobicContact CZ-CZ 4.4Å; F146-N271 HydrophobicContact CD2-CB 4Å; F146-N271 HydrophobicContact CE1-CB 4.33Å; F146-N271 HydrophobicContact CE2-CB 3.73Å; F146-N271 HydrophobicContact CG-CB 4.43Å; F146-N271 HydrophobicContact CZ-CB 3.93Å
147	C	93.9	Very high	90.7	Very high	5 Å²	5	61.6 Å²	61.6	3%	0.034	32%	0.317	C	S	.	.	H	α-helix	trans	-62.4	-41.5	179.6	-64.2	0	0	0	0	112.3	H143 L144 L150 E151 I164 M166	H143-C147 PolarHBondContact O-N 3.09Å; H143-C147 PolarHBondContact O-SG 2.84Å; L144-C147 PolarHBondContact O-N 3.07Å; L144-C147 VanDerWaalsContact O-N 3.14Å; C147-L150 PolarHBondContact O-N 2.85Å; C147-E151 WeakPolarHBondContact O-CB 3.48Å; C147-E151 PolarHBondContact O-N 3.21Å; C147-I164 HydrophobicContact CB-CG2 4.14Å; C147-M166 HydrophobicContact CB-CG 4.49Å; C147-M166 WeakPolarHBondContact SG-CG 3.32Å
148	Q	95.2	Very high	91.1	Very high	123 Å²	123	60.1 Å²	60.1	58%	0.575	31%	0.309	S	S	*	.	H	α-helix	trans	-60.9	-47.4	175.7	-74.6	172.5	-24.2	0	0	111.9	L144 F146 L150 E151 T152	L144-Q148 WeakPolarHBondContact O-CG 3.23Å; L144-Q148 PolarHBondContact O-N 3.5Å; F146-Q148 PolarHBondContact O-N 3.3Å; Q148-L150 VanDerWaalsContact C-N 3.29Å; Q148-L150 PolarHBondContact O-N 2.95Å; Q148-E151 WeakPolarHBondContact O-CB 3.46Å; Q148-E151 PolarHBondContact O-N 3.11Å; Q148-T152 PolarHBondContact O-N 2.76Å; Q148-T152 PolarHBondContact O-OG1 3.15Å; Q148-T152 VanDerWaalsContact O-OG1 3.06Å
149	K	95.6	Very high	91.9	Very high	112 Å²	112	56.7 Å²	56.7	49%	0.487	30%	0.295	S	S	.	.	H	α-helix	trans	-63.2	-38.1	177.5	-69.4	175.8	-174.4	-179.2	0	112	S145 F146 H153 F250 L252	S145-K149 WeakPolarHBondContact O-CG 3.46Å; S145-K149 PolarHBondContact O-N 2.97Å; S145-K149 VanDerWaalsContact O-N 3.12Å; F146-K149 PolarHBondContact O-N 2.77Å; K149-H153 WeakPolarHBondContact O-CB 3.46Å; K149-H153 PolarHBondContact O-N 2.84Å; K149-F250 HydrophobicContact CB-CZ 4.17Å; K149-L252 HydrophobicContact CB-CD1 4.12Å; K149-L252 HydrophobicContact CD-CD1 3.65Å
150	L	95.8	Very high	92.6	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.3	-40.4	176	-174.9	66	0	0	0	111.5	F146 C147 Q148 H153 L154 I164 I183 L247 F250 V253 F269 M279	F146-L150 HydrophobicContact CE1-CD2 4Å; F146-L150 HydrophobicContact CZ-CD2 4.06Å; F146-L150 WeakPolarHBondContact O-CB 3.43Å; F146-L150 PolarHBondContact O-N 3.18Å; C147-L150 PolarHBondContact O-N 2.85Å; Q148-L150 VanDerWaalsContact C-N 3.29Å; Q148-L150 PolarHBondContact O-N 2.95Å; L150-H153 PolarHBondContact O-N 3.44Å; L150-L154 HydrophobicContact CD1-CD1 4.38Å; L150-L154 HydrophobicContact CG-CD1 4.31Å; L150-L154 WeakPolarHBondContact O-CB 3.36Å; L150-L154 WeakPolarHBondContact O-CG 3.48Å; L150-L154 PolarHBondContact O-N 3.49Å; L150-I164 HydrophobicContact CB-CD1 3.87Å; L150-I164 HydrophobicContact CD2-CD1 3.74Å; L150-I164 HydrophobicContact CG-CD1 3.5Å; L150-I164 VanDerWaalsContact CG-CD1 3.5Å; L150-I183 HydrophobicContact CD2-CD1 3.47Å; L150-I183 VanDerWaalsContact CD2-CD1 3.47Å; L150-L247 HydrophobicContact CD1-CD1 4.48Å; L150-L247 HydrophobicContact CD1-CD2 3.42Å; L150-L247 VanDerWaalsContact CD1-CD2 3.42Å; L150-F250 HydrophobicContact CB-CE1 4.24Å; L150-F250 HydrophobicContact CD1-CD1 3.83Å; L150-F250 HydrophobicContact CD1-CE1 3.63Å; L150-V253 HydrophobicContact CD1-CG2 4.21Å; L150-F269 HydrophobicContact CD2-CZ 3.95Å; L150-M279 HydrophobicContact CD2-CE 3.69Å; L150-M279 HydrophobicContact CG-CE 4.36Å
151	E	96.8	Very high	93.2	Very high	39 Å²	39	53.7 Å²	53.7	18%	0.182	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-51.8	175.7	-175.6	176.9	113.4	0	0	110.4	C147 Q148 H153 L154 Q155 R163 I164	C147-E151 WeakPolarHBondContact O-CB 3.48Å; C147-E151 PolarHBondContact O-N 3.21Å; Q148-E151 WeakPolarHBondContact O-CB 3.46Å; Q148-E151 PolarHBondContact O-N 3.11Å; E151-H153 VanDerWaalsContact C-N 3.27Å; E151-H153 PolarHBondContact O-N 3.23Å; E151-L154 PolarHBondContact O-N 2.71Å; E151-Q155 WeakPolarHBondContact O-CB 3.49Å; E151-Q155 PolarHBondContact O-N 3.48Å; E151-R163 IonicContact OE1-NE 2.84Å; E151-R163 PolarHBondContact OE1-NE 2.99Å; E151-R163 VanDerWaalsContact OE2-CA 3.31Å; E151-R163 WeakPolarHBondContact OE2-CA 3.37Å; E151-R163 IonicContact OE2-NE 3.41Å; E151-I164 HydrophobicContact CB-CB 4.23Å; E151-I164 HydrophobicContact CB-CD1 4.02Å; E151-I164 HydrophobicContact CB-CG1 3.96Å; E151-I164 HydrophobicContact CG-CG1 4.35Å; E151-I164 PolarHBondContact OE2-N 2.83Å
152	T	96.5	Very high	93.7	Very high	95 Å²	95	45.6 Å²	45.6	58%	0.583	24%	0.238	S	C	*	.	H	α-helix	trans	-58.5	-37.8	176.5	-52.6	0	0	0	0	112.5	Q148	Q148-T152 PolarHBondContact O-N 2.76Å; Q148-T152 PolarHBondContact O-OG1 3.15Å; Q148-T152 VanDerWaalsContact O-OG1 3.06Å
153	H	96	Very high	94.3	Very high	24 Å²	24	48.9 Å²	48.9	11%	0.111	24%	0.239	C	C	.	.	H	α-helix	trans	-66.8	-47.6	176.5	-178.2	80.3	0	0	0	111.7	K149 L150 E151 Y157 F246 F250	K149-H153 WeakPolarHBondContact O-CB 3.46Å; K149-H153 PolarHBondContact O-N 2.84Å; L150-H153 PolarHBondContact O-N 3.44Å; E151-H153 VanDerWaalsContact C-N 3.27Å; E151-H153 PolarHBondContact O-N 3.23Å; H153-Y157 AromaticContact NE2-CE2 3.84Å; H153-Y157 WeakPolarHBondContact O-CE2 3.36Å; H153-F246 PolarHBondContact NE2-O 3.09Å; H153-F250 HydrophobicContact CB-CD2 3.85Å; H153-F250 HydrophobicContact CB-CE2 3.79Å; H153-F250 HydrophobicContact CB-CG 4.37Å; H153-F250 HydrophobicContact CB-CZ 4.24Å; H153-F250 AromaticContact CD2-CG 3.94Å; H153-F250 AromaticContact CE1-CD2 4Å; H153-F250 AromaticContact CG-CD2 3.51Å; H153-F250 AromaticContact CG-CE2 4Å; H153-F250 AromaticContact CG-CG 3.86Å; H153-F250 AromaticContact ND1-CD2 3.48Å; H153-F250 WeakPolarHBondContact ND1-CD2 3.44Å
154	L	96.2	Very high	94.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-72.3	-31.5	-176.9	-73.3	-179.6	0	0	0	112.9	L150 E151 K156 Y157 F158 I162 I164 L185 I243 F246 L247 M279	L150-L154 HydrophobicContact CD1-CD1 4.38Å; L150-L154 HydrophobicContact CG-CD1 4.31Å; L150-L154 WeakPolarHBondContact O-CB 3.36Å; L150-L154 WeakPolarHBondContact O-CG 3.48Å; L150-L154 PolarHBondContact O-N 3.49Å; E151-L154 PolarHBondContact O-N 2.71Å; L154-K156 PolarHBondContact O-N 3.05Å; L154-Y157 PolarHBondContact O-N 2.97Å; L154-F158 HydrophobicContact CB-CE2 4.47Å; L154-F158 VanDerWaalsContact O-CD2 3.29Å; L154-F158 WeakPolarHBondContact O-CD2 3.32Å; L154-I162 HydrophobicContact CB-CD1 3.63Å; L154-I164 HydrophobicContact CD1-CD1 4.07Å; L154-L185 HydrophobicContact CD1-CD1 4.16Å; L154-I243 HydrophobicContact CD1-CG2 4Å; L154-I243 HydrophobicContact CD2-CG2 3.99Å; L154-F246 HydrophobicContact CD2-CB 4.14Å; L154-L247 HydrophobicContact CD2-CD2 3.85Å; L154-L247 HydrophobicContact CD2-CG 4.34Å; L154-L247 HydrophobicContact CG-CD2 4.23Å; L154-M279 HydrophobicContact CD1-CE 3.85Å; L154-M279 HydrophobicContact CD1-SD 4.42Å
155	Q	95.8	Very high	94.9	Very high	49 Å²	49	49.2 Å²	49.2	23%	0.229	24%	0.237	C	C	.	.	H	α-helix	trans	-54.6	-28.3	-178.8	-176	58.2	72.3	0	0	113.1	E151 Y157 F158 V160 I162	E151-Q155 WeakPolarHBondContact O-CB 3.49Å; E151-Q155 PolarHBondContact O-N 3.48Å; Q155-Y157 PolarHBondContact O-N 3.49Å; Q155-F158 PolarHBondContact O-N 2.92Å; Q155-V160 PolarHBondContact NE2-O 2.85Å; Q155-I162 HydrophobicContact CB-CG1 4.32Å; Q155-I162 VanDerWaalsContact OE1-CG1 3.31Å
156	K	94.9	Very high	95.1	Very high	142 Å²	142	48.3 Å²	48.3	62%	0.617	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.9	176.5	-59	178	-176.2	-178.6	0	113.2	L154 K220	L154-K156 PolarHBondContact O-N 3.05Å; K156-K220 WeakPolarHBondContact O-CE 3.46Å
157	Y	95.2	Very high	95.3	Very high	44 Å²	44	48.9 Å²	48.9	17%	0.173	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	13.2	-175.7	-53.8	-82.3	0	0	0	113.5	H153 L154 Q155 F246	H153-Y157 AromaticContact NE2-CE2 3.84Å; H153-Y157 WeakPolarHBondContact O-CE2 3.36Å; L154-Y157 PolarHBondContact O-N 2.97Å; Q155-Y157 PolarHBondContact O-N 3.49Å; Y157-F246 AromaticContact CD1-CD1 3.76Å; Y157-F246 HydrophobicContact CD1-CD1 3.76Å; Y157-F246 HydrophobicContact CD1-CD2 4.28Å; Y157-F246 AromaticContact CD1-CE1 3.91Å; Y157-F246 HydrophobicContact CD1-CE1 3.91Å; Y157-F246 HydrophobicContact CD1-CE2 4.42Å; Y157-F246 AromaticContact CD1-CG 3.96Å; Y157-F246 HydrophobicContact CD1-CG 3.96Å; Y157-F246 HydrophobicContact CD1-CZ 4.23Å; Y157-F246 HydrophobicContact CD2-CB 3.98Å; Y157-F246 HydrophobicContact CD2-CD2 4.2Å; Y157-F246 HydrophobicContact CD2-CG 4.06Å; Y157-F246 AromaticContact CE1-CD1 4Å; Y157-F246 HydrophobicContact CE1-CD1 4Å; Y157-F246 HydrophobicContact CE1-CE1 4.46Å; Y157-F246 HydrophobicContact CE1-CG 4.32Å; Y157-F246 HydrophobicContact CE2-CB 4Å; Y157-F246 HydrophobicContact CE2-CG 4.42Å; Y157-F246 HydrophobicContact CG-CB 4.24Å; Y157-F246 HydrophobicContact CG-CD1 4.1Å; Y157-F246 AromaticContact CG-CD2 3.8Å; Y157-F246 HydrophobicContact CG-CD2 3.8Å; Y157-F246 HydrophobicContact CG-CE1 4.38Å; Y157-F246 HydrophobicContact CG-CE2 4.1Å; Y157-F246 AromaticContact CG-CG 3.81Å; Y157-F246 HydrophobicContact CG-CG 3.81Å; Y157-F246 HydrophobicContact CG-CZ 4.36Å
158	F	94.9	Very high	95.3	Very high	1 Å²	1	49.3 Å²	49.3	0%	0.004	24%	0.236	C	C	.	.			trans	-131.4	140.9	175.2	-65.9	-87.8	0	0	0	111.5	L154 Q155 V160 I162 L185 K220 A223 L227 L239 I243	L154-F158 HydrophobicContact CB-CE2 4.47Å; L154-F158 VanDerWaalsContact O-CD2 3.29Å; L154-F158 WeakPolarHBondContact O-CD2 3.32Å; Q155-F158 PolarHBondContact O-N 2.92Å; F158-V160 VanDerWaalsContact C-N 3.28Å; F158-V160 HydrophobicContact CB-CG2 4.43Å; F158-I162 HydrophobicContact CB-CG2 3.93Å; F158-I162 HydrophobicContact CD1-CG2 4.2Å; F158-I162 HydrophobicContact CD2-CD1 3.77Å; F158-I162 HydrophobicContact CD2-CG1 4.4Å; F158-I162 HydrophobicContact CD2-CG2 4.01Å; F158-I162 HydrophobicContact CE2-CD1 4.04Å; F158-I162 HydrophobicContact CG-CG2 3.77Å; F158-L185 HydrophobicContact CE2-CD1 4.15Å; F158-L185 HydrophobicContact CZ-CD1 4.18Å; F158-K220 WeakPolarHBondContact O-CE 3.31Å; F158-A223 HydrophobicContact CD1-CB 4.18Å; F158-A223 HydrophobicContact CE1-CB 3.82Å; F158-A223 HydrophobicContact CZ-CB 4.28Å; F158-L227 HydrophobicContact CD1-CD2 3.98Å; F158-L227 HydrophobicContact CE1-CB 4.25Å; F158-L227 HydrophobicContact CE1-CD2 4.02Å; F158-L239 HydrophobicContact CE1-CD1 3.99Å; F158-L239 HydrophobicContact CZ-CD1 4.09Å; F158-I243 HydrophobicContact CZ-CD1 4.41Å; F158-I243 HydrophobicContact CZ-CG1 4.24Å
159	N	93.2	Very high	95.1	Very high	53 Å²	53	45.2 Å²	45.2	28%	0.283	22%	0.221	S	C	.	.	S	Bend	trans	-84.4	-5.3	174.3	-74.5	-26.3	0	0	0	112.9	K220 T224	N159-K220 WeakPolarHBondContact OD1-CD 3.34Å; N159-K220 WeakPolarHBondContact OD1-CE 3.47Å; N159-K220 WeakPolarHBondContact OD1-CG 3.45Å; N159-K220 PolarHBondContact OD1-NZ 3.39Å; N159-T224 HydrophobicContact CB-CG2 4.19Å; N159-T224 PolarHBondContact N-OG1 3.06Å
160	V	92.3	Very high	94.9	Very high	28 Å²	28	40.1 Å²	40.1	17%	0.17	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	155.5	174.2	-64.1	0	0	0	0	109.7	Q155 F158 I162 R187 T224 L227	Q155-V160 PolarHBondContact NE2-O 2.85Å; F158-V160 VanDerWaalsContact C-N 3.28Å; F158-V160 HydrophobicContact CB-CG2 4.43Å; V160-I162 HydrophobicContact CG2-CG2 4.32Å; V160-I162 PolarHBondContact O-N 3.22Å; V160-R187 HydrophobicContact CB-CG 4.39Å; V160-R187 HydrophobicContact CG2-CG 4.1Å; V160-T224 HydrophobicContact CG1-CG2 3.79Å; V160-T224 HydrophobicContact CG2-CG2 4.1Å; V160-L227 HydrophobicContact CG2-CD2 4.09Å
161	T	94.9	Very high	94.8	Very high	38 Å²	38	41.5 Å²	41.5	23%	0.233	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	128.7	169.8	-54.2	0	0	0	0	109.5	D188	T161-D188 HydrophobicContact CG2-CB 3.68Å; T161-D188 PolarHBondContact O-N 3.06Å
162	I	96.2	Very high	94.6	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	151.7	175.4	61.6	157.5	0	0	0	109.9	L154 Q155 F158 V160 L185 I186 L227	L154-I162 HydrophobicContact CB-CD1 3.63Å; Q155-I162 HydrophobicContact CB-CG1 4.32Å; Q155-I162 VanDerWaalsContact OE1-CG1 3.31Å; F158-I162 HydrophobicContact CB-CG2 3.93Å; F158-I162 HydrophobicContact CD1-CG2 4.2Å; F158-I162 HydrophobicContact CD2-CD1 3.77Å; F158-I162 HydrophobicContact CD2-CG1 4.4Å; F158-I162 HydrophobicContact CD2-CG2 4.01Å; F158-I162 HydrophobicContact CE2-CD1 4.04Å; F158-I162 HydrophobicContact CG-CG2 3.77Å; V160-I162 HydrophobicContact CG2-CG2 4.32Å; V160-I162 PolarHBondContact O-N 3.22Å; I162-L185 HydrophobicContact CB-CD2 4.49Å; I162-L185 HydrophobicContact CB-CG 4.46Å; I162-L185 HydrophobicContact CD1-CD1 3.85Å; I162-L185 HydrophobicContact CD1-CG 4.41Å; I162-L185 HydrophobicContact CG2-CD2 4.25Å; I162-I186 CarbonylContact C-O 3.49Å; I162-I186 WeakPolarHBondContact CA-O 3.47Å; I162-L227 HydrophobicContact CG2-CD2 3.82Å
163	R	96.1	Very high	94.5	Very high	108 Å²	108	37.2 Å²	37.2	41%	0.408	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	146.7	170	-54.7	-63.6	-69.7	-105.9	2.1	110.9	E151 L185 I186 D188	E151-R163 IonicContact OE1-NE 2.84Å; E151-R163 PolarHBondContact OE1-NE 2.99Å; E151-R163 VanDerWaalsContact OE2-CA 3.31Å; E151-R163 WeakPolarHBondContact OE2-CA 3.37Å; E151-R163 IonicContact OE2-NE 3.41Å; R163-L185 WeakPolarHBondContact O-CA 3.41Å; R163-I186 HydrophobicContact CB-CD1 4.06Å; R163-I186 HydrophobicContact CB-CG1 3.7Å; R163-I186 PolarHBondContact N-O 2.85Å; R163-I186 WeakPolarHBondContact O-CG1 3.48Å; R163-I186 PolarHBondContact O-N 3.43Å; R163-D188 VanDerWaalsContact CD-OD2 3.31Å; R163-D188 WeakPolarHBondContact CD-OD2 3.42Å; R163-D188 HydrophobicContact CG-CB 3.97Å; R163-D188 WeakPolarHBondContact CG-OD2 3.48Å; R163-D188 IonicContact NH1-OD2 3.91Å; R163-D188 PolarHBondContact NH1-OD2 3.22Å
164	I	96.2	Very high	94.4	Very high	11 Å²	11	36.3 Å²	36.3	6%	0.056	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	110.9	171.5	-60.8	-173.5	0	0	0	108.2	C147 L150 E151 L154 I183 T184 M279	C147-I164 HydrophobicContact CB-CG2 4.14Å; L150-I164 HydrophobicContact CB-CD1 3.87Å; L150-I164 HydrophobicContact CD2-CD1 3.74Å; L150-I164 HydrophobicContact CG-CD1 3.5Å; L150-I164 VanDerWaalsContact CG-CD1 3.5Å; E151-I164 HydrophobicContact CB-CB 4.23Å; E151-I164 HydrophobicContact CB-CD1 4.02Å; E151-I164 HydrophobicContact CB-CG1 3.96Å; E151-I164 HydrophobicContact CG-CG1 4.35Å; E151-I164 PolarHBondContact OE2-N 2.83Å; L154-I164 HydrophobicContact CD1-CD1 4.07Å; I164-I183 HydrophobicContact CG2-CB 3.9Å; I164-I183 HydrophobicContact CG2-CD1 3.96Å; I164-I183 HydrophobicContact CG2-CG1 4.39Å; I164-I183 HydrophobicContact CG2-CG2 4.26Å; I164-T184 WeakPolarHBondContact CA-O 3.33Å; I164-M279 HydrophobicContact CD1-CE 4.18Å
165	K	95.7	Very high	94.2	Very high	101 Å²	101	36.6 Å²	36.6	44%	0.439	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.8	177.3	-67.6	-169	176.4	168.7	0	110.6	I183 T184 I186 L287	K165-I183 CarbonylContact O-C 3.53Å; K165-I183 VanDerWaalsContact O-CA 3.32Å; K165-I183 WeakPolarHBondContact O-CA 3.46Å; K165-T184 HydrophobicContact CB-CG2 4.26Å; K165-T184 PolarHBondContact N-O 2.87Å; K165-T184 PolarHBondContact O-N 3.26Å; K165-I186 HydrophobicContact CD-CD1 3.64Å; K165-I186 VanDerWaalsContact CE-CD1 3.48Å; K165-I186 HydrophobicContact CG-CD1 4.04Å; K165-L287 HydrophobicContact CB-CD2 3.69Å; K165-L287 HydrophobicContact CD-CD1 4.19Å; K165-L287 HydrophobicContact CD-CD2 4.32Å
166	M	94.9	Very high	93.9	Very high	26 Å²	26	35 Å²	35	13%	0.128	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	144.4	170.3	-62.7	-173	-47.1	0	0	110.1	V140 H143 L144 C147 D182 I183	V140-M166 HydrophobicContact CG1-CE 3.6Å; H143-M166 HydrophobicContact CB-CE 4.44Å; H143-M166 HydrophobicContact CB-SD 3.53Å; H143-M166 VanDerWaalsContact CB-SD 3.53Å; L144-M166 HydrophobicContact CD2-CE 3.38Å; L144-M166 HydrophobicContact CD2-SD 4.32Å; L144-M166 HydrophobicContact CG-CE 3.71Å; C147-M166 HydrophobicContact CB-CG 4.49Å; C147-M166 WeakPolarHBondContact SG-CG 3.32Å; M166-D182 WeakPolarHBondContact CA-O 3.49Å; M166-I183 HydrophobicContact CG-CG2 4.11Å
167	F	94.9	Very high	93.3	Very high	27 Å²	27	31.5 Å²	31.5	12%	0.118	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	-174.8	170.3	73.6	-87.1	0	0	0	110	D182 I183 T184 N283 L287 T290	F167-D182 HydrophobicContact CD1-CB 4.08Å; F167-D182 HydrophobicContact CD2-CB 3.99Å; F167-D182 HydrophobicContact CE1-CB 3.88Å; F167-D182 HydrophobicContact CE2-CB 3.76Å; F167-D182 HydrophobicContact CG-CB 4.13Å; F167-D182 HydrophobicContact CZ-CB 3.69Å; F167-D182 PolarHBondContact N-O 2.94Å; F167-I183 VanDerWaalsContact CE1-C 3.45Å; F167-I183 WeakPolarHBondContact CE1-O 3.32Å; F167-T184 HydrophobicContact CD1-CG2 4.26Å; F167-N283 WeakPolarHBondContact CE2-ND2 3.45Å; F167-N283 VanDerWaalsContact CZ-ND2 3.26Å; F167-N283 WeakPolarHBondContact CZ-ND2 3.42Å; F167-L287 HydrophobicContact CB-CD2 4.06Å; F167-T290 HydrophobicContact CB-CG2 4.46Å; F167-T290 WeakPolarHBondContact CB-OG1 3.31Å
168	G	93.3	Very high	92.6	Very high	15 Å²	15	32.8 Å²	32.8	16%	0.155	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	67.5	-152.1	175.2	0	0	0	0	0	112.9	S170 A171 T172 T290	G168-S170 PolarHBondContact O-N 2.91Å; G168-A171 PolarHBondContact O-N 3.36Å; G168-T172 VanDerWaalsContact O-CG2 3.22Å; G168-T172 WeakPolarHBondContact O-CG2 3.37Å; G168-T172 PolarHBondContact O-N 3.27Å; G168-T172 VanDerWaalsContact O-N 3.16Å; G168-T290 PolarHBondContact N-OG1 3.11Å
169	S	91.2	Very high	92.1	Very high	37 Å²	37	33.2 Å²	33.2	26%	0.259	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-52.7	-33.1	-169.9	-50.5	0	0	0	0	113.3	A171 G175 S179	S169-A171 PolarHBondContact O-N 2.8Å; S169-G175 WeakPolarHBondContact O-CA 3.46Å; S169-G175 PolarHBondContact O-N 3.27Å; S169-S179 VanDerWaalsContact CB-CB 3.48Å
170	S	91.8	Very high	91.9	Very high	4 Å²	4	33.6 Å²	33.6	3%	0.028	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-68.9	-15.8	-178.8	-74.1	0	0	0	0	114.6	G168 D180	G168-S170 PolarHBondContact O-N 2.91Å; S170-D180 PolarHBondContact OG-O 2.95Å
171	A	92.9	Very high	91.9	Very high	29 Å²	29	32.2 Å²	32.2	24%	0.24	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.8	-7.5	-172.8	0	0	0	0	0	114.5	G168 S169 T290 N294	G168-A171 PolarHBondContact O-N 3.36Å; S169-A171 PolarHBondContact O-N 2.8Å; A171-T290 HydrophobicContact CB-CG2 3.49Å; A171-T290 VanDerWaalsContact CB-CG2 3.49Å; A171-N294 PolarHBondContact O-ND2 2.78Å
172	T	94.3	Very high	91.9	Very high	7 Å²	7	31.5 Å²	31.5	4%	0.043	18%	0.18	C	C	.	.	S	Bend	trans	-82	-14	-176.3	57.5	0	0	0	0	115.1	G168 F174 T290 L293 N294 S297	G168-T172 VanDerWaalsContact O-CG2 3.22Å; G168-T172 WeakPolarHBondContact O-CG2 3.37Å; G168-T172 PolarHBondContact O-N 3.27Å; G168-T172 VanDerWaalsContact O-N 3.16Å; T172-F174 WeakPolarHBondContact O-CD2 3.44Å; T172-F174 PolarHBondContact O-N 2.8Å; T172-F174 PolarHBondContact OG1-N 2.85Å; T172-T290 HydrophobicContact CG2-CG2 4.02Å; T172-L293 HydrophobicContact CG2-CB 3.83Å; T172-L293 HydrophobicContact CG2-CD1 3.74Å; T172-L293 HydrophobicContact CG2-CG 4.46Å; T172-L293 CarbonylContact O-C 3.31Å; T172-N294 WeakPolarHBondContact O-CA 3.42Å; T172-S297 WeakPolarHBondContact O-CB 3.4Å; T172-S297 PolarHBondContact O-OG 2.99Å
173	G	92.7	Very high	91.9	Very high	38 Å²	38	31.5 Å²	31.5	39%	0.392	18%	0.18	S	C	.	.	S	Bend	trans	81	-6.1	-168.6	0	0	0	0	0	114.8
174	F	95.2	Very high	91.9	Very high	5 Å²	5	26.3 Å²	26.3	2%	0.022	16%	0.161	C	C	.	.			trans	-104.6	2.2	177.9	-64	-76.4	0	0	0	113.8	T172 L293 L304 P305 F308 L335	T172-F174 WeakPolarHBondContact O-CD2 3.44Å; T172-F174 PolarHBondContact O-N 2.8Å; T172-F174 PolarHBondContact OG1-N 2.85Å; F174-L293 HydrophobicContact CD2-CB 4.28Å; F174-L293 HydrophobicContact CE2-CB 4.21Å; F174-L293 HydrophobicContact CE2-CD2 4.46Å; F174-L293 VanDerWaalsContact CE2-O 3.3Å; F174-L293 WeakPolarHBondContact CE2-O 3.36Å; F174-L304 HydrophobicContact CE1-CD2 4.39Å; F174-L304 HydrophobicContact CE1-CG 3.86Å; F174-L304 HydrophobicContact CZ-CD2 3.86Å; F174-L304 HydrophobicContact CZ-CG 3.84Å; F174-P305 HydrophobicContact CD1-CB 4.43Å; F174-P305 HydrophobicContact CE1-CB 4.4Å; F174-P305 HydrophobicContact CE1-CG 4.2Å; F174-F308 HydrophobicContact CB-CD1 3.83Å; F174-F308 HydrophobicContact CB-CE1 3.97Å; F174-F308 HydrophobicContact CD1-CB 3.92Å; F174-F308 AromaticContact CD1-CD1 3.66Å; F174-F308 HydrophobicContact CD1-CD1 3.66Å; F174-F308 HydrophobicContact CD1-CG 4.05Å; F174-F308 HydrophobicContact CE1-CB 4.17Å; F174-F308 HydrophobicContact CG-CD1 4.11Å; F174-L335 HydrophobicContact CB-CD2 4.24Å; F174-L335 HydrophobicContact CD1-CD1 4.25Å; F174-L335 HydrophobicContact CD1-CD2 4.43Å; F174-L335 HydrophobicContact CD2-CD2 3.73Å; F174-L335 HydrophobicContact CE1-CD1 4.15Å; F174-L335 HydrophobicContact CE2-CD2 4.14Å; F174-L335 HydrophobicContact CG-CD2 3.89Å; F174-L335 HydrophobicContact CZ-CD1 4.33Å
175	G	91.1	Very high	92	Very high	6 Å²	6	25.8 Å²	25.8	6%	0.062	16%	0.158	C	C	.	.			trans	-70	146	-176.2	0	0	0	0	0	114.2	I137 S169	I137-G175 PolarHBondContact N-O 2.78Å; S169-G175 WeakPolarHBondContact O-CA 3.46Å; S169-G175 PolarHBondContact O-N 3.27Å
176	W	89.5	Confident	91.9	Very high	16 Å²	16	21.7 Å²	21.7	6%	0.061	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-96.4	153.5	166.9	-72.1	9.6	0	0	0	111.3	N135 I137 S178 S179 R312 Y313	N135-W176 HydrophobicContact CB-CB 4.48Å; N135-W176 HydrophobicContact CB-CD2 3.67Å; N135-W176 HydrophobicContact CB-CE3 4.16Å; N135-W176 HydrophobicContact CB-CG 3.82Å; N135-W176 HydrophobicContact CB-CZ2 4.23Å; N135-W176 CarbonylContact O-C 3.6Å; N135-W176 VanDerWaalsContact O-C 3.3Å; N135-W176 WeakPolarHBondContact O-CA 3.22Å; N135-W176 WeakPolarHBondContact O-CB 3.39Å; I137-W176 WeakPolarHBondContact CG1-O 3.26Å; W176-S178 PolarHBondContact O-N 2.98Å; W176-S179 WeakPolarHBondContact CA-OG 3.47Å; W176-S179 PolarHBondContact N-OG 3.14Å; W176-S179 WeakPolarHBondContact O-CB 3.15Å; W176-S179 PolarHBondContact O-N 3.18Å; W176-S179 PolarHBondContact O-OG 2.96Å; W176-R312 HydrophobicContact CH2-CG 4.25Å; W176-R312 HydrophobicContact CZ2-CB 4.11Å; W176-R312 HydrophobicContact CZ2-CG 3.88Å; W176-Y313 HydrophobicContact CH2-CD2 4.33Å
177	N	83.1	Confident	91.8	Very high	67 Å²	67	25.9 Å²	25.9	36%	0.358	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-22.2	178.4	60.5	13.3	0	0	0	114.6	E134 N135	E134-N177 PolarHBondContact O-ND2 2.89Å; N135-N177 PolarHBondContact O-N 2.9Å
178	S	79.9	Confident	91.4	Very high	72 Å²	72	27.4 Å²	27.4	50%	0.503	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	6.9	177.6	56.7	0	0	0	0	113.5	W176	W176-S178 PolarHBondContact O-N 2.98Å
179	S	85.2	Confident	90	Very high	10 Å²	10	29.2 Å²	29.2	7%	0.07	18%	0.183	C	C	.	.			trans	-73.7	153.6	178.5	-48.9	0	0	0	0	110.8	S169 W176	S169-S179 VanDerWaalsContact CB-CB 3.48Å; W176-S179 WeakPolarHBondContact CA-OG 3.47Å; W176-S179 PolarHBondContact N-OG 3.14Å; W176-S179 WeakPolarHBondContact O-CB 3.15Å; W176-S179 PolarHBondContact O-N 3.18Å; W176-S179 PolarHBondContact O-OG 2.96Å
180	D	88.5	Confident	87.5	Confident	60 Å²	60	35.7 Å²	35.7	32%	0.321	22%	0.215	S	C	.	.			trans	-68.9	158	175.3	-54.1	-36.5	0	0	0	110.2	S170 Q276	S170-D180 PolarHBondContact OG-O 2.95Å; D180-Q276 WeakPolarHBondContact CA-O 3.48Å; D180-Q276 HydrophobicContact CB-CB 4.49Å; D180-Q276 WeakPolarHBondContact OD1-CB 3.41Å
181	I	91.8	Very high	84.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	99.4	174.6	-53.1	177.7	0	0	0	108.1	H143 I183 L275 Q276 C277 E278	H143-I181 HydrophobicContact CB-CD1 4.44Å; I181-I183 HydrophobicContact CG2-CG2 3.97Å; I181-L275 HydrophobicContact CD1-CB 4.18Å; I181-L275 HydrophobicContact CD1-CD1 3.89Å; I181-L275 HydrophobicContact CG1-CB 4.5Å; I181-L275 HydrophobicContact CG1-CD1 4.47Å; I181-Q276 PolarHBondContact N-O 3.14Å; I181-C277 CarbonylContact O-C 3.6Å; I181-C277 VanDerWaalsContact O-CA 3.22Å; I181-C277 WeakPolarHBondContact O-CA 3.24Å; I181-E278 PolarHBondContact O-N 3.46Å
182	D	94.8	Very high	81.5	Confident	22 Å²	22	41.4 Å²	41.4	12%	0.118	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126.6	176.9	-49.5	-56.6	0	0	0	109.8	M166 F167	M166-D182 WeakPolarHBondContact CA-O 3.49Å; F167-D182 HydrophobicContact CD1-CB 4.08Å; F167-D182 HydrophobicContact CD2-CB 3.99Å; F167-D182 HydrophobicContact CE1-CB 3.88Å; F167-D182 HydrophobicContact CE2-CB 3.76Å; F167-D182 HydrophobicContact CG-CB 4.13Å; F167-D182 HydrophobicContact CZ-CB 3.69Å; F167-D182 PolarHBondContact N-O 2.94Å
183	I	96.8	Very high	78.8	Confident	0 Å²	0	46 Å²	46	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	151.2	-179.6	63.9	178.3	0	0	0	111.5	L150 I164 K165 M166 F167 I181 F269 E278 M279 S280	L150-I183 HydrophobicContact CD2-CD1 3.47Å; L150-I183 VanDerWaalsContact CD2-CD1 3.47Å; I164-I183 HydrophobicContact CG2-CB 3.9Å; I164-I183 HydrophobicContact CG2-CD1 3.96Å; I164-I183 HydrophobicContact CG2-CG1 4.39Å; I164-I183 HydrophobicContact CG2-CG2 4.26Å; K165-I183 CarbonylContact O-C 3.53Å; K165-I183 VanDerWaalsContact O-CA 3.32Å; K165-I183 WeakPolarHBondContact O-CA 3.46Å; M166-I183 HydrophobicContact CG-CG2 4.11Å; F167-I183 VanDerWaalsContact CE1-C 3.45Å; F167-I183 WeakPolarHBondContact CE1-O 3.32Å; I181-I183 HydrophobicContact CG2-CG2 3.97Å; I183-F269 HydrophobicContact CD1-CE1 4.41Å; I183-F269 HydrophobicContact CD1-CZ 3.82Å; I183-E278 PolarHBondContact N-O 2.83Å; I183-E278 VanDerWaalsContact O-O 3.1Å; I183-M279 HydrophobicContact CD1-CB 4.11Å; I183-M279 HydrophobicContact CD1-CE 3.54Å; I183-M279 HydrophobicContact CD1-CG 4.45Å; I183-M279 HydrophobicContact CG1-CB 3.8Å; I183-M279 HydrophobicContact CG1-CE 4.26Å; I183-M279 HydrophobicContact CG1-CG 4.21Å; I183-M279 CarbonylContact O-C 3.6Å; I183-M279 VanDerWaalsContact O-CA 3.29Å; I183-M279 WeakPolarHBondContact O-CA 3.22Å; I183-S280 PolarHBondContact O-N 3.2Å; I183-S280 PolarHBondContact O-OG 3.47Å
184	T	96.9	Very high	75.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	133.8	173.7	-168.6	0	0	0	0	110.8	I164 K165 F167 I186 S280 E282 N283 L287	I164-T184 WeakPolarHBondContact CA-O 3.33Å; K165-T184 HydrophobicContact CB-CG2 4.26Å; K165-T184 PolarHBondContact N-O 2.87Å; K165-T184 PolarHBondContact O-N 3.26Å; F167-T184 HydrophobicContact CD1-CG2 4.26Å; T184-I186 HydrophobicContact CG2-CG2 4.09Å; T184-S280 CarbonylContact C-O 3.57Å; T184-S280 VanDerWaalsContact CA-O 3.26Å; T184-S280 WeakPolarHBondContact CA-O 3.48Å; T184-S280 WeakPolarHBondContact CB-OG 3.16Å; T184-S280 PolarHBondContact OG1-O 2.91Å; T184-S280 PolarHBondContact OG1-OG 3Å; T184-E282 PolarHBondContact OG1-N 2.92Å; T184-N283 PolarHBondContact OG1-N 2.8Å; T184-L287 HydrophobicContact CG2-CD1 3.9Å; T184-L287 HydrophobicContact CG2-CD2 3.97Å; T184-L287 HydrophobicContact CG2-CG 3.94Å
185	L	97.2	Very high	72.6	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	125	169.3	-175.1	152.6	0	0	0	108.1	L154 F158 I162 R163 L227 I243 S280 I281 E282	L154-L185 HydrophobicContact CD1-CD1 4.16Å; F158-L185 HydrophobicContact CE2-CD1 4.15Å; F158-L185 HydrophobicContact CZ-CD1 4.18Å; I162-L185 HydrophobicContact CB-CD2 4.49Å; I162-L185 HydrophobicContact CB-CG 4.46Å; I162-L185 HydrophobicContact CD1-CD1 3.85Å; I162-L185 HydrophobicContact CD1-CG 4.41Å; I162-L185 HydrophobicContact CG2-CD2 4.25Å; R163-L185 WeakPolarHBondContact O-CA 3.41Å; L185-L227 HydrophobicContact CD2-CD1 3.56Å; L185-L227 HydrophobicContact CD2-CD2 3.78Å; L185-L227 HydrophobicContact CD2-CG 4.33Å; L185-I243 HydrophobicContact CD1-CD1 4.09Å; L185-S280 PolarHBondContact N-O 3.35Å; L185-I281 HydrophobicContact CB-CD1 4.08Å; L185-I281 HydrophobicContact CD2-CD1 4.49Å; L185-E282 PolarHBondContact O-N 3.25Å
186	I	94.2	Very high	69.6	Low	15 Å²	15	57.3 Å²	57.3	8%	0.077	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	149.7	176.1	61.4	171.8	0	0	0	109.8	I162 R163 K165 T184 E282 L287	I162-I186 CarbonylContact C-O 3.49Å; I162-I186 WeakPolarHBondContact CA-O 3.47Å; R163-I186 HydrophobicContact CB-CD1 4.06Å; R163-I186 HydrophobicContact CB-CG1 3.7Å; R163-I186 PolarHBondContact N-O 2.85Å; R163-I186 WeakPolarHBondContact O-CG1 3.48Å; R163-I186 PolarHBondContact O-N 3.43Å; K165-I186 HydrophobicContact CD-CD1 3.64Å; K165-I186 VanDerWaalsContact CE-CD1 3.48Å; K165-I186 HydrophobicContact CG-CD1 4.04Å; T184-I186 HydrophobicContact CG2-CG2 4.09Å; I186-E282 HydrophobicContact CG2-CG 4.47Å; I186-L287 HydrophobicContact CG2-CD1 4.5Å
187	R	92.6	Very high	66.6	Low	114 Å²	114	66.1 Å²	66.1	43%	0.43	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	128.5	165.9	-176.2	179	64.1	165.7	3.2	108.8	V160 L227	V160-R187 HydrophobicContact CB-CG 4.39Å; V160-R187 HydrophobicContact CG2-CG 4.1Å; R187-L227 HydrophobicContact CB-CD2 4.23Å; R187-L227 HydrophobicContact CB-CG 4.46Å
188	D	85.5	Confident	64	Low	58 Å²	58	66.3 Å²	66.3	31%	0.31	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	119.9	169.4	-133.2	-4.6	0	0	0	107.5	T161 R163	T161-D188 HydrophobicContact CG2-CB 3.68Å; T161-D188 PolarHBondContact O-N 3.06Å; R163-D188 VanDerWaalsContact CD-OD2 3.31Å; R163-D188 WeakPolarHBondContact CD-OD2 3.42Å; R163-D188 HydrophobicContact CG-CB 3.97Å; R163-D188 WeakPolarHBondContact CG-OD2 3.48Å; R163-D188 IonicContact NH1-OD2 3.91Å; R163-D188 PolarHBondContact NH1-OD2 3.22Å
189	G	64.6	Low	61.4	Low	53 Å²	53	74.5 Å²	74.5	55%	0.546	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	145.6	176	0	0	0	0	0	111
190	D	38.3	Very low	58.6	Low	173 Å²	173	80.1 Å²	80.1	93%	0.925	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	87.7	36.7	173.2	-51.7	-23.6	0	0	0	120.1
191	A	28.1	Very low	55.8	Low	50 Å²	50	84.4 Å²	84.4	41%	0.413	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	119.5	145	0	0	0	0	0	111.9
192	P	31.7	Very low	52.8	Low	103 Å²	103	87.3 Å²	87.3	67%	0.669	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.6	139.3	147.2	6.5	7.8	0	0	0	107	S194	P192-S194 PolarHBondContact O-N 2.7Å
193	N	37.6	Very low	49.8	Very low	103 Å²	103	92.4 Å²	92.4	55%	0.551	58%	0.58	S	S	*	*			trans	-66.9	73	169.2	-79.9	-37.6	0	0	0	109.8	G195	N193-G195 PolarHBondContact O-N 2.75Å; N193-G195 VanDerWaalsContact O-N 3.14Å
194	S	28.7	Very low	46.5	Very low	117 Å²	117	97.8 Å²	97.8	82%	0.818	62%	0.618	S	S	*	*			trans	-80	78.7	162.1	49.3	0	0	0	0	107.3	P192	P192-S194 PolarHBondContact O-N 2.7Å
195	G	27.4	Very low	43.5	Very low	71 Å²	71	103.7 Å²	103.7	73%	0.732	66%	0.656	S	S	*	*			trans	-170.8	51.9	-173.6	0	0	0	0	0	112.2	N193	N193-G195 PolarHBondContact O-N 2.75Å; N193-G195 VanDerWaalsContact O-N 3.14Å
196	A	28.4	Very low	40.3	Very low	100 Å²	100	111.6 Å²	111.6	83%	0.826	69%	0.693	S	S	*	*			trans	-143.6	42.5	165.3	0	0	0	0	0	111
197	E	28	Very low	37.3	Very low	200 Å²	200	118.8 Å²	118.8	94%	0.935	73%	0.732	S	S	*	*			trans	-134.1	101.5	161.3	-72.5	-171.2	172.9	0	0	107.1
198	G	27.3	Very low	34.4	Very low	72 Å²	72	117 Å²	117	74%	0.742	75%	0.748	S	S	*	*	S	Bend	trans	159.9	78	179.8	0	0	0	0	0	115.4
199	R	25.9	Very low	31.8	Very low	243 Å²	243	122 Å²	122	92%	0.917	78%	0.775	S	S	*	*			trans	53.7	101.5	151.4	-70.2	178	170.7	-178.7	-3.4	118.2
200	S	26.9	Very low	30.3	Very low	129 Å²	129	123.8 Å²	123.8	90%	0.902	79%	0.794	S	S	*	*			trans	-136.7	100	135.7	-99.7	0	0	0	0	109.1	G202	S200-G202 PolarHBondContact O-N 3.03Å
201	T	28.1	Very low	30.1	Very low	149 Å²	149	124 Å²	124	91%	0.914	79%	0.789	S	S	*	*			trans	-79.1	103	159.6	43.6	0	0	0	0	107.7
202	G	29.3	Very low	30.7	Very low	61 Å²	61	125.2 Å²	125.2	63%	0.629	80%	0.795	S	S	*	*			trans	-154.1	139.4	170.6	0	0	0	0	0	108.7	S200	S200-G202 PolarHBondContact O-N 3.03Å
203	P	32.6	Very low	31.6	Very low	130 Å²	130	126.4 Å²	126.4	84%	0.844	80%	0.8	S	S	*	*			trans	-75.1	140.2	-155.6	29.6	-34	0	0	0	113.2
204	S	27	Very low	32	Very low	113 Å²	113	130 Å²	130	79%	0.79	81%	0.813	S	S	*	*			trans	-50.6	134.3	167.7	-96	0	0	0	0	112.3
205	P	33.9	Very low	33.4	Very low	123 Å²	123	130.5 Å²	130.5	80%	0.799	81%	0.807	S	S	*	*			trans	-94.9	111.8	144.4	26.7	-12.1	0	0	0	108.6
206	E	31.2	Very low	34.9	Very low	166 Å²	166	131.1 Å²	131.1	78%	0.776	79%	0.794	S	S	*	*			trans	-59.5	147.2	162.3	-67.6	177.2	151.6	0	0	110.3
207	N	31.1	Very low	36.9	Very low	167 Å²	167	131.8 Å²	131.8	89%	0.893	78%	0.779	S	S	*	*			trans	106.9	101.5	169	-55.6	-40.3	0	0	0	116.4
208	G	30.6	Very low	39.7	Very low	76 Å²	76	125.8 Å²	125.8	78%	0.784	76%	0.759	S	S	*	*	S	Bend	trans	158.3	93.5	160	0	0	0	0	0	115
209	D	31	Very low	42.7	Very low	162 Å²	162	125.2 Å²	125.2	87%	0.866	74%	0.739	S	S	*	*			trans	44.8	100.2	160.1	-68.6	-17.1	0	0	0	120.6	Q211	D209-Q211 VanDerWaalsContact C-N 3.29Å; D209-Q211 PolarHBondContact O-N 2.84Å
210	G	33.4	Very low	45.8	Very low	92 Å²	92	116.4 Å²	116.4	95%	0.948	71%	0.707	S	S	*	*			trans	-75.5	53.1	174.3	0	0	0	0	0	116.2
211	Q	33.1	Very low	49	Very low	177 Å²	177	115.3 Å²	115.3	83%	0.827	69%	0.688	S	S	*	*			trans	-123	121.3	165.4	-82.2	175	-13	0	0	110	D209	D209-Q211 VanDerWaalsContact C-N 3.29Å; D209-Q211 PolarHBondContact O-N 2.84Å
212	S	42.3	Very low	52.2	Low	76 Å²	76	113.4 Å²	113.4	53%	0.531	67%	0.667	S	S	.	*			trans	121.5	16.1	156.3	77.5	0	0	0	0	121.5	N216	S212-N216 PolarHBondContact O-ND2 2.94Å
213	V	49.1	Very low	55.3	Low	128 Å²	128	110.5 Å²	110.5	78%	0.776	64%	0.637	S	S	*	*	H	α-helix	trans	-75.1	-41	176.1	-175.9	0	0	0	0	112.8
214	E	47.6	Very low	58.3	Low	178 Å²	178	105 Å²	105	83%	0.832	60%	0.602	S	S	*	*	H	α-helix	trans	-71.8	-40.2	-177.4	-72.2	-174.5	157	0	0	113.7	N216 H217	E214-N216 VanDerWaalsContact C-N 3.28Å; E214-N216 PolarHBondContact O-N 3.09Å; E214-H217 PolarHBondContact O-N 3.48Å
215	D	56.4	Low	61.5	Low	128 Å²	128	103.9 Å²	103.9	68%	0.684	59%	0.585	S	S	*	*	H	α-helix	trans	-62.5	-34.6	179.7	-91.6	-19.9	0	0	0	112.4	D219	D215-D219 PolarHBondContact O-N 3.42Å
216	N	60.4	Low	64.5	Low	84 Å²	84	98.3 Å²	98.3	45%	0.449	55%	0.548	S	S	.	.	H	α-helix	trans	-70.7	-33.3	-179.4	-88	-37.3	0	0	0	113	S212 E214 K220	S212-N216 PolarHBondContact O-ND2 2.94Å; E214-N216 VanDerWaalsContact C-N 3.28Å; E214-N216 PolarHBondContact O-N 3.09Å; N216-K220 VanDerWaalsContact O-CB 3.22Å; N216-K220 WeakPolarHBondContact O-CB 3.42Å; N216-K220 PolarHBondContact O-N 3.05Å; N216-K220 VanDerWaalsContact O-N 3.16Å
217	H	70.6	Confident	67.5	Low	114 Å²	114	90.4 Å²	90.4	53%	0.528	51%	0.511	S	S	.	.	H	α-helix	trans	-68.8	-43.9	179.9	-128.8	-77.4	0	0	0	111.3	E214 K220 E221	E214-H217 PolarHBondContact O-N 3.48Å; H217-K220 PolarHBondContact O-N 2.91Å; H217-E221 IonicContact CE1-OE1 3.07Å; H217-E221 IonicContact ND1-OE1 3.67Å; H217-E221 PolarHBondContact ND1-OE1 3.43Å; H217-E221 VanDerWaalsContact ND1-OE1 3.16Å; H217-E221 PolarHBondContact O-N 2.84Å
218	S	85.5	Confident	70.4	Confident	73 Å²	73	86 Å²	86	51%	0.51	49%	0.491	S	S	.	.	H	α-helix	trans	-62.6	-46.7	178.2	-179.2	0	0	0	0	112.7	K220 E221 K222	S218-K220 VanDerWaalsContact C-N 3.33Å; S218-K220 PolarHBondContact O-N 3.31Å; S218-E221 PolarHBondContact O-N 3.2Å; S218-K222 VanDerWaalsContact O-CB 3.28Å; S218-K222 WeakPolarHBondContact O-CB 3.46Å; S218-K222 PolarHBondContact O-N 3.45Å
219	D	89.9	Confident	73.3	Confident	60 Å²	60	87.1 Å²	87.1	32%	0.321	48%	0.475	S	S	.	.	H	α-helix	trans	-66.1	-35.8	179.1	-96.8	-7.5	0	0	0	112.2	D215 A223 M242 F246	D215-D219 PolarHBondContact O-N 3.42Å; D219-A223 VanDerWaalsContact O-CB 3.26Å; D219-A223 WeakPolarHBondContact O-CB 3.49Å; D219-A223 PolarHBondContact O-N 3.05Å; D219-M242 HydrophobicContact CB-CE 4.29Å; D219-M242 VanDerWaalsContact O-CE 3.3Å; D219-M242 WeakPolarHBondContact O-CE 3.11Å; D219-F246 HydrophobicContact CB-CE1 4.34Å; D219-F246 HydrophobicContact CB-CZ 4.35Å
220	K	92.9	Very high	76.1	Confident	58 Å²	58	80.5 Å²	80.5	25%	0.252	44%	0.439	S	S	.	.	H	α-helix	trans	-68	-45.1	178.2	-172	175.5	-171.4	-152.3	0	112.5	K156 F158 N159 N216 H217 S218 T224	K156-K220 WeakPolarHBondContact O-CE 3.46Å; F158-K220 WeakPolarHBondContact O-CE 3.31Å; N159-K220 WeakPolarHBondContact OD1-CD 3.34Å; N159-K220 WeakPolarHBondContact OD1-CE 3.47Å; N159-K220 WeakPolarHBondContact OD1-CG 3.45Å; N159-K220 PolarHBondContact OD1-NZ 3.39Å; N216-K220 VanDerWaalsContact O-CB 3.22Å; N216-K220 WeakPolarHBondContact O-CB 3.42Å; N216-K220 PolarHBondContact O-N 3.05Å; N216-K220 VanDerWaalsContact O-N 3.16Å; H217-K220 PolarHBondContact O-N 2.91Å; S218-K220 VanDerWaalsContact C-N 3.33Å; S218-K220 PolarHBondContact O-N 3.31Å; K220-T224 WeakPolarHBondContact O-CB 3.49Å; K220-T224 PolarHBondContact O-N 3.15Å; K220-T224 PolarHBondContact O-OG1 3.36Å
221	E	93.6	Very high	78.6	Confident	106 Å²	106	86.8 Å²	86.8	50%	0.495	43%	0.434	S	S	.	.	H	α-helix	trans	-61.9	-46.6	174.7	-78.6	170.1	-162	0	0	111.2	H217 S218 A223 T224 M225	H217-E221 IonicContact CE1-OE1 3.07Å; H217-E221 IonicContact ND1-OE1 3.67Å; H217-E221 PolarHBondContact ND1-OE1 3.43Å; H217-E221 VanDerWaalsContact ND1-OE1 3.16Å; H217-E221 PolarHBondContact O-N 2.84Å; S218-E221 PolarHBondContact O-N 3.2Å; E221-A223 PolarHBondContact O-N 3.17Å; E221-T224 WeakPolarHBondContact O-CB 3.18Å; E221-T224 PolarHBondContact O-N 2.98Å; E221-M225 WeakPolarHBondContact O-CB 3.28Å; E221-M225 PolarHBondContact O-N 3.37Å
222	K	95.4	Very high	81.3	Confident	109 Å²	109	84.8 Å²	84.8	47%	0.474	43%	0.425	S	S	.	.	H	α-helix	trans	-64.2	-41.9	178.9	-174.8	176.7	-173.1	168.8	0	113.1	S218 T224 M225 L226 M242	S218-K222 VanDerWaalsContact O-CB 3.28Å; S218-K222 WeakPolarHBondContact O-CB 3.46Å; S218-K222 PolarHBondContact O-N 3.45Å; K222-T224 VanDerWaalsContact C-N 3.3Å; K222-T224 PolarHBondContact O-N 3.15Å; K222-M225 PolarHBondContact O-N 2.91Å; K222-L226 HydrophobicContact CG-CD1 4.32Å; K222-L226 WeakPolarHBondContact O-CB 3.49Å; K222-L226 WeakPolarHBondContact O-CG 3.17Å; K222-L226 PolarHBondContact O-N 3.25Å; K222-M242 HydrophobicContact CB-CE 4.16Å; K222-M242 HydrophobicContact CD-CE 4.18Å; K222-M242 HydrophobicContact CD-SD 4.13Å; K222-M242 HydrophobicContact CG-CE 4.16Å; K222-M242 HydrophobicContact CG-SD 4.04Å
223	A	95	Very high	83.5	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-62	-41.5	175.2	0	0	0	0	0	111.1	F158 D219 E221 L226 L227 L239 M242 F246	F158-A223 HydrophobicContact CD1-CB 4.18Å; F158-A223 HydrophobicContact CE1-CB 3.82Å; F158-A223 HydrophobicContact CZ-CB 4.28Å; D219-A223 VanDerWaalsContact O-CB 3.26Å; D219-A223 WeakPolarHBondContact O-CB 3.49Å; D219-A223 PolarHBondContact O-N 3.05Å; E221-A223 PolarHBondContact O-N 3.17Å; A223-L226 PolarHBondContact O-N 3.43Å; A223-L227 WeakPolarHBondContact O-CB 3.39Å; A223-L227 PolarHBondContact O-N 3.01Å; A223-L239 HydrophobicContact CB-CD1 4.32Å; A223-M242 HydrophobicContact CB-CE 4.02Å; A223-F246 HydrophobicContact CB-CE2 3.97Å; A223-F246 HydrophobicContact CB-CZ 4.25Å
224	T	94.8	Very high	85.5	Confident	16 Å²	16	79.3 Å²	79.3	10%	0.098	40%	0.396	C	S	.	.	H	α-helix	trans	-63.5	-48.8	176.4	-55.7	0	0	0	0	111.4	N159 V160 K220 E221 K222 L226 L227 V228	N159-T224 HydrophobicContact CB-CG2 4.19Å; N159-T224 PolarHBondContact N-OG1 3.06Å; V160-T224 HydrophobicContact CG1-CG2 3.79Å; V160-T224 HydrophobicContact CG2-CG2 4.1Å; K220-T224 WeakPolarHBondContact O-CB 3.49Å; K220-T224 PolarHBondContact O-N 3.15Å; K220-T224 PolarHBondContact O-OG1 3.36Å; E221-T224 WeakPolarHBondContact O-CB 3.18Å; E221-T224 PolarHBondContact O-N 2.98Å; K222-T224 VanDerWaalsContact C-N 3.3Å; K222-T224 PolarHBondContact O-N 3.15Å; T224-L226 PolarHBondContact O-N 3.12Å; T224-L227 WeakPolarHBondContact O-CB 3.45Å; T224-L227 PolarHBondContact O-N 3.23Å; T224-L227 VanDerWaalsContact O-N 3.15Å; T224-V228 WeakPolarHBondContact O-CG2 3.26Å; T224-V228 PolarHBondContact O-N 2.88Å
225	M	94.9	Very high	87.7	Confident	89 Å²	89	71.5 Å²	71.5	44%	0.438	36%	0.36	S	S	.	.	H	α-helix	trans	-56.4	-48.3	176.2	-177.3	-161.2	75.9	0	0	111.5	E221 K222 L227 V228 E229	E221-M225 WeakPolarHBondContact O-CB 3.28Å; E221-M225 PolarHBondContact O-N 3.37Å; K222-M225 PolarHBondContact O-N 2.91Å; M225-L227 VanDerWaalsContact C-N 3.27Å; M225-L227 PolarHBondContact O-N 2.85Å; M225-V228 PolarHBondContact O-N 3.34Å; M225-E229 WeakPolarHBondContact O-CB 3.42Å; M225-E229 WeakPolarHBondContact O-CG 3.41Å; M225-E229 PolarHBondContact O-N 2.95Å
226	L	95.8	Very high	89.5	Confident	5 Å²	5	67.4 Å²	67.4	3%	0.026	34%	0.335	C	S	.	.	H	α-helix	trans	-64.6	-29.5	179.1	-71.9	171.7	0	0	0	113.5	K222 A223 T224 Q230 N235 K238 L239 M242	K222-L226 HydrophobicContact CG-CD1 4.32Å; K222-L226 WeakPolarHBondContact O-CB 3.49Å; K222-L226 WeakPolarHBondContact O-CG 3.17Å; K222-L226 PolarHBondContact O-N 3.25Å; A223-L226 PolarHBondContact O-N 3.43Å; T224-L226 PolarHBondContact O-N 3.12Å; L226-Q230 WeakPolarHBondContact O-CA 3.31Å; L226-Q230 PolarHBondContact O-N 3.47Å; L226-N235 HydrophobicContact CD2-CB 3.88Å; L226-K238 HydrophobicContact CD1-CB 3.88Å; L226-K238 HydrophobicContact CD2-CB 4.17Å; L226-K238 HydrophobicContact CD2-CD 4.22Å; L226-L239 HydrophobicContact CB-CB 4.04Å; L226-L239 HydrophobicContact CB-CD1 4.31Å; L226-L239 HydrophobicContact CD1-CB 4.48Å; L226-M242 HydrophobicContact CD1-SD 3.65Å
227	L	94.2	Very high	91.2	Very high	1 Å²	1	64.9 Å²	64.9	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-71.8	-42.2	174.2	179.7	60.1	0	0	0	111.3	F158 V160 I162 L185 R187 A223 T224 M225 E229 Q230 L239 I281	F158-L227 HydrophobicContact CD1-CD2 3.98Å; F158-L227 HydrophobicContact CE1-CB 4.25Å; F158-L227 HydrophobicContact CE1-CD2 4.02Å; V160-L227 HydrophobicContact CG2-CD2 4.09Å; I162-L227 HydrophobicContact CG2-CD2 3.82Å; L185-L227 HydrophobicContact CD2-CD1 3.56Å; L185-L227 HydrophobicContact CD2-CD2 3.78Å; L185-L227 HydrophobicContact CD2-CG 4.33Å; R187-L227 HydrophobicContact CB-CD2 4.23Å; R187-L227 HydrophobicContact CB-CG 4.46Å; A223-L227 WeakPolarHBondContact O-CB 3.39Å; A223-L227 PolarHBondContact O-N 3.01Å; T224-L227 WeakPolarHBondContact O-CB 3.45Å; T224-L227 PolarHBondContact O-N 3.23Å; T224-L227 VanDerWaalsContact O-N 3.15Å; M225-L227 VanDerWaalsContact C-N 3.27Å; M225-L227 PolarHBondContact O-N 2.85Å; L227-E229 VanDerWaalsContact C-N 3.33Å; L227-Q230 VanDerWaalsContact O-CB 3.31Å; L227-Q230 WeakPolarHBondContact O-CB 3.29Å; L227-Q230 WeakPolarHBondContact O-CG 3.41Å; L227-Q230 PolarHBondContact O-N 2.94Å; L227-L239 HydrophobicContact CB-CD2 3.89Å; L227-L239 HydrophobicContact CD1-CD2 3.97Å; L227-I281 HydrophobicContact CD1-CG2 3.77Å
228	V	92	Very high	92.3	Very high	75 Å²	75	65.1 Å²	65.1	46%	0.455	32%	0.321	S	S	.	.	H	α-helix	trans	-64.2	-40.3	175.4	175.5	0	0	0	0	111	T224 M225 Q230	T224-V228 WeakPolarHBondContact O-CG2 3.26Å; T224-V228 PolarHBondContact O-N 2.88Å; M225-V228 PolarHBondContact O-N 3.34Å; V228-Q230 VanDerWaalsContact C-N 3.33Å; V228-Q230 PolarHBondContact O-N 2.9Å
229	E	91.6	Very high	92.8	Very high	98 Å²	98	61.7 Å²	61.7	46%	0.458	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	23.6	-178.2	-60.8	-179.5	176.8	0	0	113.8	M225 L227 R231 N235	M225-E229 WeakPolarHBondContact O-CB 3.42Å; M225-E229 WeakPolarHBondContact O-CG 3.41Å; M225-E229 PolarHBondContact O-N 2.95Å; L227-E229 VanDerWaalsContact C-N 3.33Å; E229-R231 PolarHBondContact O-N 2.84Å; E229-R231 VanDerWaalsContact O-N 3.09Å; E229-N235 WeakPolarHBondContact CB-ND2 3.32Å; E229-N235 WeakPolarHBondContact O-CB 3.25Å; E229-N235 PolarHBondContact O-ND2 3.11Å; E229-N235 PolarHBondContact OE2-ND2 3.25Å
230	Q	89.6	Confident	93.1	Very high	24 Å²	24	58.8 Å²	58.8	11%	0.112	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-15.7	-171.1	68.5	81.3	11.4	0	0	114.5	L226 L227 V228 Q232 R236 I281 E282	L226-Q230 WeakPolarHBondContact O-CA 3.31Å; L226-Q230 PolarHBondContact O-N 3.47Å; L227-Q230 VanDerWaalsContact O-CB 3.31Å; L227-Q230 WeakPolarHBondContact O-CB 3.29Å; L227-Q230 WeakPolarHBondContact O-CG 3.41Å; L227-Q230 PolarHBondContact O-N 2.94Å; V228-Q230 VanDerWaalsContact C-N 3.33Å; V228-Q230 PolarHBondContact O-N 2.9Å; Q230-Q232 CarbonylContact O-C 3.49Å; Q230-Q232 PolarHBondContact O-N 2.84Å; Q230-Q232 VanDerWaalsContact O-O 3.08Å; Q230-R236 HydrophobicContact CB-CG 3.96Å; Q230-R236 WeakPolarHBondContact O-CD 3.48Å; Q230-R236 VanDerWaalsContact O-CG 3.28Å; Q230-R236 WeakPolarHBondContact O-CG 3.47Å; Q230-R236 PolarHBondContact O-NE 2.94Å; Q230-I281 HydrophobicContact CB-CG2 4.05Å; Q230-I281 HydrophobicContact CG-CG2 4.19Å; Q230-E282 HydrophobicContact CG-CG 4.35Å; Q230-E282 PolarHBondContact NE2-OE2 2.93Å
231	R	87.2	Confident	93.3	Very high	224 Å²	224	62 Å²	62	85%	0.845	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-39.4	-179.8	-67.7	-173.3	178.7	-172.1	0.2	112	E229 R236	E229-R231 PolarHBondContact O-N 2.84Å; E229-R231 VanDerWaalsContact O-N 3.09Å; R231-R236 PolarHBondContact O-NH2 3.33Å
232	Q	88.6	Confident	93.4	Very high	134 Å²	134	57.8 Å²	57.8	63%	0.626	28%	0.275	S	S	*	.	S	Bend	trans	-73.9	126.5	173	-61.9	-170.4	8.2	0	0	111.9	Q230 G234 N235 R236	Q230-Q232 CarbonylContact O-C 3.49Å; Q230-Q232 PolarHBondContact O-N 2.84Å; Q230-Q232 VanDerWaalsContact O-O 3.08Å; Q232-G234 PolarHBondContact O-N 2.67Å; Q232-G234 VanDerWaalsContact O-N 3.15Å; Q232-N235 HydrophobicContact CB-CB 4.41Å; Q232-N235 WeakPolarHBondContact O-CB 3.29Å; Q232-N235 PolarHBondContact O-N 3.05Å; Q232-R236 PolarHBondContact O-N 2.88Å
233	V	89	Confident	93.4	Very high	51 Å²	51	52.6 Å²	52.6	31%	0.309	25%	0.253	S	S	.	.	H	α-helix	trans	-54.3	-37.4	178.8	176.4	0	0	0	0	112.2	N235 R236 I237 P265	V233-N235 VanDerWaalsContact C-N 3.32Å; V233-N235 PolarHBondContact O-N 2.72Å; V233-R236 PolarHBondContact O-N 3.27Å; V233-I237 HydrophobicContact CG1-CD1 3.92Å; V233-I237 WeakPolarHBondContact O-CG1 3.16Å; V233-I237 PolarHBondContact O-N 3.11Å; V233-P265 HydrophobicContact CG1-CG 3.9Å
234	G	91.6	Very high	93.4	Very high	39 Å²	39	52.9 Å²	52.9	40%	0.402	26%	0.256	S	S	.	.	H	α-helix	trans	-60.5	-39.7	177.3	0	0	0	0	0	113.1	Q232 I237 K238	Q232-G234 PolarHBondContact O-N 2.67Å; Q232-G234 VanDerWaalsContact O-N 3.15Å; G234-I237 PolarHBondContact O-N 2.97Å; G234-K238 WeakPolarHBondContact O-CG 3.39Å; G234-K238 PolarHBondContact O-N 2.87Å
235	N	93.7	Very high	93.3	Very high	13 Å²	13	58.6 Å²	58.6	7%	0.07	28%	0.279	C	S	.	.	H	α-helix	trans	-69.5	-43	178.2	-73.6	-5.7	0	0	0	111.3	L226 E229 Q232 V233 I237 K238 L239	L226-N235 HydrophobicContact CD2-CB 3.88Å; E229-N235 WeakPolarHBondContact CB-ND2 3.32Å; E229-N235 WeakPolarHBondContact O-CB 3.25Å; E229-N235 PolarHBondContact O-ND2 3.11Å; E229-N235 PolarHBondContact OE2-ND2 3.25Å; Q232-N235 HydrophobicContact CB-CB 4.41Å; Q232-N235 WeakPolarHBondContact O-CB 3.29Å; Q232-N235 PolarHBondContact O-N 3.05Å; V233-N235 VanDerWaalsContact C-N 3.32Å; V233-N235 PolarHBondContact O-N 2.72Å; N235-I237 VanDerWaalsContact C-N 3.33Å; N235-I237 PolarHBondContact O-N 3.32Å; N235-K238 PolarHBondContact O-N 3.18Å; N235-L239 WeakPolarHBondContact O-CB 3.39Å; N235-L239 PolarHBondContact O-N 2.83Å
236	R	94.3	Very high	93.3	Very high	43 Å²	43	55 Å²	55	16%	0.162	26%	0.261	C	S	.	.	H	α-helix	trans	-54.6	-46	171.4	-83.6	179	-78.9	164.8	-3	112.7	Q230 R231 Q232 V233 L239 L240 P265 I281	Q230-R236 HydrophobicContact CB-CG 3.96Å; Q230-R236 WeakPolarHBondContact O-CD 3.48Å; Q230-R236 VanDerWaalsContact O-CG 3.28Å; Q230-R236 WeakPolarHBondContact O-CG 3.47Å; Q230-R236 PolarHBondContact O-NE 2.94Å; R231-R236 PolarHBondContact O-NH2 3.33Å; Q232-R236 PolarHBondContact O-N 2.88Å; V233-R236 PolarHBondContact O-N 3.27Å; R236-L239 PolarHBondContact O-N 3.37Å; R236-L240 WeakPolarHBondContact O-CB 3.39Å; R236-L240 VanDerWaalsContact O-CG 3.28Å; R236-L240 WeakPolarHBondContact O-CG 3.48Å; R236-L240 PolarHBondContact O-N 3.11Å; R236-P265 HydrophobicContact CB-CB 4.48Å; R236-P265 HydrophobicContact CB-CG 4.15Å; R236-I281 HydrophobicContact CG-CB 4.14Å; R236-I281 HydrophobicContact CG-CG2 4.45Å
237	I	94.3	Very high	93.2	Very high	31 Å²	31	54.8 Å²	54.8	16%	0.159	26%	0.26	C	S	.	.	H	α-helix	trans	-64.3	-42.7	178.7	-67.3	165	0	0	0	111.2	V233 G234 N235 K241 V258 P260 P265	V233-I237 HydrophobicContact CG1-CD1 3.92Å; V233-I237 WeakPolarHBondContact O-CG1 3.16Å; V233-I237 PolarHBondContact O-N 3.11Å; G234-I237 PolarHBondContact O-N 2.97Å; N235-I237 VanDerWaalsContact C-N 3.33Å; N235-I237 PolarHBondContact O-N 3.32Å; I237-K241 HydrophobicContact CG2-CD 4.49Å; I237-K241 WeakPolarHBondContact O-CG 3.44Å; I237-K241 PolarHBondContact O-N 3.43Å; I237-K241 VanDerWaalsContact O-N 3.11Å; I237-V258 HydrophobicContact CG2-CG1 4.38Å; I237-P260 HydrophobicContact CD1-CB 3.7Å; I237-P260 HydrophobicContact CG1-CB 4.08Å; I237-P260 HydrophobicContact CG2-CB 4.29Å; I237-P265 HydrophobicContact CD1-CG 4.41Å; I237-P265 HydrophobicContact CG1-CB 3.8Å; I237-P265 HydrophobicContact CG1-CG 3.82Å
238	K	95.2	Very high	92.9	Very high	119 Å²	119	60.2 Å²	60.2	52%	0.517	29%	0.289	S	S	.	.	H	α-helix	trans	-61.8	-45.4	176.3	-72.5	172.3	-175.5	173.1	0	110.9	L226 G234 N235 K241 M242	L226-K238 HydrophobicContact CD1-CB 3.88Å; L226-K238 HydrophobicContact CD2-CB 4.17Å; L226-K238 HydrophobicContact CD2-CD 4.22Å; G234-K238 WeakPolarHBondContact O-CG 3.39Å; G234-K238 PolarHBondContact O-N 2.87Å; N235-K238 PolarHBondContact O-N 3.18Å; K238-K241 WeakPolarHBondContact O-CB 3.03Å; K238-K241 PolarHBondContact O-N 2.89Å; K238-M242 PolarHBondContact O-N 2.61Å
239	L	96.3	Very high	92.5	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.6	-47.7	178.2	-179.1	56.1	0	0	0	111.8	F158 A223 L226 L227 N235 R236 K241 M242 I243 I281	F158-L239 HydrophobicContact CE1-CD1 3.99Å; F158-L239 HydrophobicContact CZ-CD1 4.09Å; A223-L239 HydrophobicContact CB-CD1 4.32Å; L226-L239 HydrophobicContact CB-CB 4.04Å; L226-L239 HydrophobicContact CB-CD1 4.31Å; L226-L239 HydrophobicContact CD1-CB 4.48Å; L227-L239 HydrophobicContact CB-CD2 3.89Å; L227-L239 HydrophobicContact CD1-CD2 3.97Å; N235-L239 WeakPolarHBondContact O-CB 3.39Å; N235-L239 PolarHBondContact O-N 2.83Å; R236-L239 PolarHBondContact O-N 3.37Å; L239-K241 PolarHBondContact O-N 2.93Å; L239-M242 WeakPolarHBondContact O-CA 3.45Å; L239-M242 WeakPolarHBondContact O-CB 3.23Å; L239-M242 PolarHBondContact O-N 3.33Å; L239-I243 HydrophobicContact CD1-CD1 4.13Å; L239-I243 HydrophobicContact CD1-CG1 4.23Å; L239-I243 HydrophobicContact CG-CD1 3.88Å; L239-I243 HydrophobicContact CG-CG1 4.44Å; L239-I243 WeakPolarHBondContact O-CG1 3.47Å; L239-I243 PolarHBondContact O-N 3.38Å; L239-I281 HydrophobicContact CD2-CD1 3.97Å; L239-I281 HydrophobicContact CD2-CG1 4.1Å; L239-I281 HydrophobicContact CD2-CG2 4.13Å; L239-I281 HydrophobicContact CG-CD1 4.33Å
240	L	96.2	Very high	92.5	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.7	-33.6	177.1	-70.4	167.8	0	0	0	112.4	R236 G244 V258 P265 L267 I281	R236-L240 WeakPolarHBondContact O-CB 3.39Å; R236-L240 VanDerWaalsContact O-CG 3.28Å; R236-L240 WeakPolarHBondContact O-CG 3.48Å; R236-L240 PolarHBondContact O-N 3.11Å; L240-G244 PolarHBondContact O-N 3.4Å; L240-V258 HydrophobicContact CB-CG1 4.24Å; L240-V258 HydrophobicContact CB-CG2 3.99Å; L240-P265 VanDerWaalsContact CD1-C 3.47Å; L240-P265 HydrophobicContact CD1-CB 3.59Å; L240-P265 WeakPolarHBondContact CD1-O 3.3Å; L240-L267 HydrophobicContact CB-CB 4.41Å; L240-L267 HydrophobicContact CD2-CB 3.77Å; L240-I281 HydrophobicContact CD2-CD1 3.82Å; L240-I281 HydrophobicContact CD2-CG1 3.85Å; L240-I281 HydrophobicContact CG-CD1 4.42Å; L240-I281 HydrophobicContact CG-CG1 4.04Å
241	K	95.2	Very high	92.6	Very high	124 Å²	124	63.4 Å²	63.4	54%	0.539	31%	0.313	S	S	.	.	H	α-helix	trans	-66.7	-40.5	172.7	-72.8	174.4	-179.7	176.7	0	111.8	I237 K238 L239 G244 K245 V258	I237-K241 HydrophobicContact CG2-CD 4.49Å; I237-K241 WeakPolarHBondContact O-CG 3.44Å; I237-K241 PolarHBondContact O-N 3.43Å; I237-K241 VanDerWaalsContact O-N 3.11Å; K238-K241 WeakPolarHBondContact O-CB 3.03Å; K238-K241 PolarHBondContact O-N 2.89Å; L239-K241 PolarHBondContact O-N 2.93Å; K241-G244 PolarHBondContact O-N 3.18Å; K241-K245 PolarHBondContact O-N 3.1Å; K241-V258 HydrophobicContact CB-CG2 4.47Å; K241-V258 HydrophobicContact CG-CB 4.36Å; K241-V258 HydrophobicContact CG-CG2 3.83Å
242	M	95.7	Very high	92.7	Very high	18 Å²	18	55 Å²	55	9%	0.089	28%	0.284	C	S	.	.	H	α-helix	trans	-65.1	-47.9	175.2	-70.9	-179	69.9	0	0	111.1	D219 K222 A223 L226 K238 L239 G244 K245 F246	D219-M242 HydrophobicContact CB-CE 4.29Å; D219-M242 VanDerWaalsContact O-CE 3.3Å; D219-M242 WeakPolarHBondContact O-CE 3.11Å; K222-M242 HydrophobicContact CB-CE 4.16Å; K222-M242 HydrophobicContact CD-CE 4.18Å; K222-M242 HydrophobicContact CD-SD 4.13Å; K222-M242 HydrophobicContact CG-CE 4.16Å; K222-M242 HydrophobicContact CG-SD 4.04Å; A223-M242 HydrophobicContact CB-CE 4.02Å; L226-M242 HydrophobicContact CD1-SD 3.65Å; K238-M242 PolarHBondContact O-N 2.61Å; L239-M242 WeakPolarHBondContact O-CA 3.45Å; L239-M242 WeakPolarHBondContact O-CB 3.23Å; L239-M242 PolarHBondContact O-N 3.33Å; M242-G244 VanDerWaalsContact C-N 3.27Å; M242-G244 PolarHBondContact O-N 3.44Å; M242-K245 WeakPolarHBondContact O-CA 3.49Å; M242-K245 WeakPolarHBondContact O-CB 3.28Å; M242-K245 PolarHBondContact O-N 3.35Å; M242-F246 HydrophobicContact CB-CE2 4.15Å; M242-F246 HydrophobicContact CB-CZ 4.17Å; M242-F246 HydrophobicContact CE-CZ 3.87Å; M242-F246 WeakPolarHBondContact O-CG 3.31Å; M242-F246 PolarHBondContact O-N 3.3Å
243	I	96.4	Very high	92.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-57.4	-43.3	174.7	-64.3	164.8	0	0	0	110.5	L154 F158 L185 L239 K245 F246 L247 L267 M279 I281	L154-I243 HydrophobicContact CD1-CG2 4Å; L154-I243 HydrophobicContact CD2-CG2 3.99Å; F158-I243 HydrophobicContact CZ-CD1 4.41Å; F158-I243 HydrophobicContact CZ-CG1 4.24Å; L185-I243 HydrophobicContact CD1-CD1 4.09Å; L239-I243 HydrophobicContact CD1-CD1 4.13Å; L239-I243 HydrophobicContact CD1-CG1 4.23Å; L239-I243 HydrophobicContact CG-CD1 3.88Å; L239-I243 HydrophobicContact CG-CG1 4.44Å; L239-I243 WeakPolarHBondContact O-CG1 3.47Å; L239-I243 PolarHBondContact O-N 3.38Å; I243-K245 PolarHBondContact O-N 3.04Å; I243-F246 PolarHBondContact O-N 3.03Å; I243-F246 VanDerWaalsContact O-N 3.09Å; I243-L247 HydrophobicContact CG2-CD1 3.98Å; I243-L247 HydrophobicContact CG2-CG 4.23Å; I243-L247 VanDerWaalsContact O-CG 3.29Å; I243-L247 WeakPolarHBondContact O-CG 3.44Å; I243-L247 PolarHBondContact O-N 3.42Å; I243-L267 HydrophobicContact CB-CD2 4.38Å; I243-L267 HydrophobicContact CG2-CD2 3.85Å; I243-M279 HydrophobicContact CD1-SD 4.33Å; I243-M279 HydrophobicContact CG2-SD 3.8Å; I243-I281 HydrophobicContact CD1-CD1 3.73Å
244	G	94.9	Very high	92.7	Very high	6 Å²	6	51 Å²	51	6%	0.062	26%	0.264	C	S	.	.	H	α-helix	trans	-54.6	-36.5	174.2	0	0	0	0	0	113.8	L240 K241 M242 N248 S256	L240-G244 PolarHBondContact O-N 3.4Å; K241-G244 PolarHBondContact O-N 3.18Å; M242-G244 VanDerWaalsContact C-N 3.27Å; M242-G244 PolarHBondContact O-N 3.44Å; G244-N248 PolarHBondContact O-OD1 3.18Å; G244-S256 PolarHBondContact O-OG 3.23Å; G244-S256 VanDerWaalsContact O-OG 3.05Å
245	K	93.4	Very high	92.1	Very high	136 Å²	136	55.8 Å²	55.8	59%	0.591	27%	0.269	S	S	*	.	H	α-helix	trans	-72.1	-45.6	173.3	-66.4	177.4	176.5	-172.7	0	112.1	K241 M242 I243 L247 N248	K241-K245 PolarHBondContact O-N 3.1Å; M242-K245 WeakPolarHBondContact O-CA 3.49Å; M242-K245 WeakPolarHBondContact O-CB 3.28Å; M242-K245 PolarHBondContact O-N 3.35Å; I243-K245 PolarHBondContact O-N 3.04Å; K245-L247 PolarHBondContact O-N 2.73Å; K245-L247 VanDerWaalsContact O-N 3.15Å; K245-N248 VanDerWaalsContact O-CB 3.31Å; K245-N248 WeakPolarHBondContact O-CB 3.24Å; K245-N248 PolarHBondContact O-N 3.47Å
246	F	94.4	Very high	91.8	Very high	13 Å²	13	56.8 Å²	56.8	6%	0.057	28%	0.277	C	S	.	.	H	α-helix	trans	-59.6	-26.4	178.8	-58	-26.8	0	0	0	112.8	H153 L154 Y157 D219 A223 M242 I243	H153-F246 PolarHBondContact NE2-O 3.09Å; L154-F246 HydrophobicContact CD2-CB 4.14Å; Y157-F246 AromaticContact CD1-CD1 3.76Å; Y157-F246 HydrophobicContact CD1-CD1 3.76Å; Y157-F246 HydrophobicContact CD1-CD2 4.28Å; Y157-F246 AromaticContact CD1-CE1 3.91Å; Y157-F246 HydrophobicContact CD1-CE1 3.91Å; Y157-F246 HydrophobicContact CD1-CE2 4.42Å; Y157-F246 AromaticContact CD1-CG 3.96Å; Y157-F246 HydrophobicContact CD1-CG 3.96Å; Y157-F246 HydrophobicContact CD1-CZ 4.23Å; Y157-F246 HydrophobicContact CD2-CB 3.98Å; Y157-F246 HydrophobicContact CD2-CD2 4.2Å; Y157-F246 HydrophobicContact CD2-CG 4.06Å; Y157-F246 AromaticContact CE1-CD1 4Å; Y157-F246 HydrophobicContact CE1-CD1 4Å; Y157-F246 HydrophobicContact CE1-CE1 4.46Å; Y157-F246 HydrophobicContact CE1-CG 4.32Å; Y157-F246 HydrophobicContact CE2-CB 4Å; Y157-F246 HydrophobicContact CE2-CG 4.42Å; Y157-F246 HydrophobicContact CG-CB 4.24Å; Y157-F246 HydrophobicContact CG-CD1 4.1Å; Y157-F246 AromaticContact CG-CD2 3.8Å; Y157-F246 HydrophobicContact CG-CD2 3.8Å; Y157-F246 HydrophobicContact CG-CE1 4.38Å; Y157-F246 HydrophobicContact CG-CE2 4.1Å; Y157-F246 AromaticContact CG-CG 3.81Å; Y157-F246 HydrophobicContact CG-CG 3.81Å; Y157-F246 HydrophobicContact CG-CZ 4.36Å; D219-F246 HydrophobicContact CB-CE1 4.34Å; D219-F246 HydrophobicContact CB-CZ 4.35Å; A223-F246 HydrophobicContact CB-CE2 3.97Å; A223-F246 HydrophobicContact CB-CZ 4.25Å; M242-F246 HydrophobicContact CB-CE2 4.15Å; M242-F246 HydrophobicContact CB-CZ 4.17Å; M242-F246 HydrophobicContact CE-CZ 3.87Å; M242-F246 WeakPolarHBondContact O-CG 3.31Å; M242-F246 PolarHBondContact O-N 3.3Å; I243-F246 PolarHBondContact O-N 3.03Å; I243-F246 VanDerWaalsContact O-N 3.09Å
247	L	94.5	Very high	91.7	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.01	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-10	176.5	-64	178.6	0	0	0	114.6	L150 L154 I243 K245 N249 F250 V253 L267 F269	L150-L247 HydrophobicContact CD1-CD1 4.48Å; L150-L247 HydrophobicContact CD1-CD2 3.42Å; L150-L247 VanDerWaalsContact CD1-CD2 3.42Å; L154-L247 HydrophobicContact CD2-CD2 3.85Å; L154-L247 HydrophobicContact CD2-CG 4.34Å; L154-L247 HydrophobicContact CG-CD2 4.23Å; I243-L247 HydrophobicContact CG2-CD1 3.98Å; I243-L247 HydrophobicContact CG2-CG 4.23Å; I243-L247 VanDerWaalsContact O-CG 3.29Å; I243-L247 WeakPolarHBondContact O-CG 3.44Å; I243-L247 PolarHBondContact O-N 3.42Å; K245-L247 PolarHBondContact O-N 2.73Å; K245-L247 VanDerWaalsContact O-N 3.15Å; L247-N249 PolarHBondContact O-N 2.97Å; L247-F250 HydrophobicContact CD2-CB 4.28Å; L247-F250 HydrophobicContact CD2-CD1 4.14Å; L247-F250 PolarHBondContact O-N 3.47Å; L247-V253 HydrophobicContact CB-CB 4.48Å; L247-V253 HydrophobicContact CB-CG1 4.02Å; L247-V253 HydrophobicContact CD1-CG1 4.27Å; L247-L267 HydrophobicContact CD1-CD2 3.89Å; L247-F269 HydrophobicContact CD1-CD1 4.33Å; L247-F269 HydrophobicContact CD1-CE1 4.32Å
248	N	87.6	Confident	91.5	Very high	114 Å²	114	59 Å²	59	61%	0.61	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-31.6	179.7	-77	-20.4	0	0	0	112.6	G244 K245	G244-N248 PolarHBondContact O-OD1 3.18Å; K245-N248 VanDerWaalsContact O-CB 3.31Å; K245-N248 WeakPolarHBondContact O-CB 3.24Å; K245-N248 PolarHBondContact O-N 3.47Å
249	N	82.8	Confident	91.3	Very high	137 Å²	137	56.6 Å²	56.6	73%	0.733	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	5.9	178.8	-63.6	-18.1	0	0	0	112.8	L247 P251	L247-N249 PolarHBondContact O-N 2.97Å; N249-P251 WeakPolarHBondContact O-CD 3.26Å
250	F	92	Very high	90.9	Very high	19 Å²	19	60.7 Å²	60.7	8%	0.083	32%	0.315	C	S	.	.			trans	-93.2	109.3	179.4	-171.8	-133.2	0	0	0	110.5	F146 K149 L150 H153 L247 L252 V253	F146-F250 HydrophobicContact CE2-CE1 4.39Å; K149-F250 HydrophobicContact CB-CZ 4.17Å; L150-F250 HydrophobicContact CB-CE1 4.24Å; L150-F250 HydrophobicContact CD1-CD1 3.83Å; L150-F250 HydrophobicContact CD1-CE1 3.63Å; H153-F250 HydrophobicContact CB-CD2 3.85Å; H153-F250 HydrophobicContact CB-CE2 3.79Å; H153-F250 HydrophobicContact CB-CG 4.37Å; H153-F250 HydrophobicContact CB-CZ 4.24Å; H153-F250 AromaticContact CD2-CG 3.94Å; H153-F250 AromaticContact CE1-CD2 4Å; H153-F250 AromaticContact CG-CD2 3.51Å; H153-F250 AromaticContact CG-CE2 4Å; H153-F250 AromaticContact CG-CG 3.86Å; H153-F250 AromaticContact ND1-CD2 3.48Å; H153-F250 WeakPolarHBondContact ND1-CD2 3.44Å; L247-F250 HydrophobicContact CD2-CB 4.28Å; L247-F250 HydrophobicContact CD2-CD1 4.14Å; L247-F250 PolarHBondContact O-N 3.47Å; F250-L252 HydrophobicContact CD1-CB 4.2Å; F250-L252 HydrophobicContact CE1-CB 3.7Å; F250-L252 HydrophobicContact CE1-CD1 4.39Å; F250-L252 HydrophobicContact CE1-CG 4.4Å; F250-L252 HydrophobicContact CE2-CB 4.46Å; F250-L252 HydrophobicContact CE2-CD1 4.35Å; F250-L252 HydrophobicContact CE2-CG 4.39Å; F250-L252 HydrophobicContact CZ-CB 3.85Å; F250-L252 HydrophobicContact CZ-CD1 3.77Å; F250-L252 HydrophobicContact CZ-CG 4.04Å; F250-L252 PolarHBondContact O-N 2.89Å; F250-V253 HydrophobicContact CD1-CB 3.99Å; F250-V253 HydrophobicContact CD1-CG2 3.54Å; F250-V253 HydrophobicContact CE1-CG2 4.03Å; F250-V253 PolarHBondContact O-N 3.28Å
251	P	90.6	Very high	90.2	Very high	108 Å²	108	63.1 Å²	63.1	70%	0.701	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.5	-169.6	23.8	-34.4	0	0	0	114.3	N249 V253	N249-P251 WeakPolarHBondContact O-CD 3.26Å; P251-V253 VanDerWaalsContact C-N 3.33Å
252	L	91	Very high	88.9	Confident	47 Å²	47	66.3 Å²	66.3	25%	0.246	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-6.1	177.8	-58	-177	0	0	0	113.6	F146 K149 F250 N271 A272	F146-L252 HydrophobicContact CD2-CB 4.4Å; F146-L252 HydrophobicContact CE2-CB 4.08Å; K149-L252 HydrophobicContact CB-CD1 4.12Å; K149-L252 HydrophobicContact CD-CD1 3.65Å; F250-L252 HydrophobicContact CD1-CB 4.2Å; F250-L252 HydrophobicContact CE1-CB 3.7Å; F250-L252 HydrophobicContact CE1-CD1 4.39Å; F250-L252 HydrophobicContact CE1-CG 4.4Å; F250-L252 HydrophobicContact CE2-CB 4.46Å; F250-L252 HydrophobicContact CE2-CD1 4.35Å; F250-L252 HydrophobicContact CE2-CG 4.39Å; F250-L252 HydrophobicContact CZ-CB 3.85Å; F250-L252 HydrophobicContact CZ-CD1 3.77Å; F250-L252 HydrophobicContact CZ-CG 4.04Å; F250-L252 PolarHBondContact O-N 2.89Å; L252-N271 CarbonylContact O-C 3.58Å; L252-N271 VanDerWaalsContact O-C 3.31Å; L252-N271 WeakPolarHBondContact O-CA 3.43Å; L252-A272 HydrophobicContact CD2-CB 4.01Å; L252-A272 PolarHBondContact O-N 2.79Å
253	V	89.6	Confident	88	Confident	15 Å²	15	70 Å²	70	9%	0.091	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	137.9	179.7	168	0	0	0	0	110.2	F146 L150 L247 F250 P251 F269 R270	F146-V253 HydrophobicContact CE2-CG2 4.25Å; F146-V253 HydrophobicContact CZ-CG2 4.04Å; L150-V253 HydrophobicContact CD1-CG2 4.21Å; L247-V253 HydrophobicContact CB-CB 4.48Å; L247-V253 HydrophobicContact CB-CG1 4.02Å; L247-V253 HydrophobicContact CD1-CG1 4.27Å; F250-V253 HydrophobicContact CD1-CB 3.99Å; F250-V253 HydrophobicContact CD1-CG2 3.54Å; F250-V253 HydrophobicContact CE1-CG2 4.03Å; F250-V253 PolarHBondContact O-N 3.28Å; P251-V253 VanDerWaalsContact C-N 3.33Å; V253-F269 HydrophobicContact CB-CD2 4.37Å; V253-F269 HydrophobicContact CG1-CB 3.84Å; V253-F269 HydrophobicContact CG1-CD2 3.78Å; V253-F269 HydrophobicContact CG1-CG 3.9Å; V253-F269 HydrophobicContact CG2-CD2 3.75Å; V253-F269 HydrophobicContact CG2-CE2 3.81Å; V253-R270 CarbonylContact C-O 3.49Å; V253-R270 WeakPolarHBondContact CA-O 3.43Å
254	Q	86.6	Confident	87.6	Confident	88 Å²	88	71.6 Å²	71.6	41%	0.411	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	138	174.3	-62	-179.9	4.6	0	0	109.1	R270	Q254-R270 PolarHBondContact N-O 3.37Å; Q254-R270 PolarHBondContact O-N 3.26Å
255	R	79.3	Confident	87.4	Confident	139 Å²	139	71.4 Å²	71.4	53%	0.525	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60	72.9	164.4	-56.3	170.5	179.6	-160.3	-11.7	113.6	D101 F269	D101-R255 IonicContact OD1-NH1 3.42Å; D101-R255 PolarHBondContact OD1-NH1 3.13Å; D101-R255 IonicContact OD2-CZ 3.19Å; D101-R255 IonicContact OD2-NH1 2.74Å; D101-R255 PolarHBondContact OD2-NH1 3.13Å; D101-R255 IonicContact OD2-NH2 3.31Å; D101-R255 PolarHBondContact OD2-NH2 2.86Å; R255-F269 WeakPolarHBondContact O-CA 3.39Å
256	S	88.4	Confident	87.5	Confident	34 Å²	34	66.2 Å²	66.2	24%	0.238	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	130.4	175.8	62	0	0	0	0	111.8	G244 L268	G244-S256 PolarHBondContact O-OG 3.23Å; G244-S256 VanDerWaalsContact O-OG 3.05Å; S256-L268 CarbonylContact C-O 3.55Å; S256-L268 VanDerWaalsContact CA-O 3.31Å; S256-L268 WeakPolarHBondContact CA-O 3.46Å
257	V	91.4	Very high	87.6	Confident	86 Å²	86	65.6 Å²	65.6	52%	0.521	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	125.7	179.2	178.4	0	0	0	0	110	L268	V257-L268 PolarHBondContact N-O 3.29Å; V257-L268 PolarHBondContact O-N 3.16Å
258	V	91	Very high	87.6	Confident	33 Å²	33	67.2 Å²	67.2	20%	0.2	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	128.7	174.7	178.5	0	0	0	0	110.3	I237 L240 K241 P260 I266 L267	I237-V258 HydrophobicContact CG2-CG1 4.38Å; L240-V258 HydrophobicContact CB-CG1 4.24Å; L240-V258 HydrophobicContact CB-CG2 3.99Å; K241-V258 HydrophobicContact CB-CG2 4.47Å; K241-V258 HydrophobicContact CG-CB 4.36Å; K241-V258 HydrophobicContact CG-CG2 3.83Å; V258-P260 WeakPolarHBondContact O-CD 3.22Å; V258-I266 WeakPolarHBondContact CA-O 3.12Å; V258-L267 HydrophobicContact CG2-CD1 3.58Å
259	I	90.1	Very high	87.9	Confident	69 Å²	69	61.9 Å²	61.9	35%	0.354	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	106.8	167.4	-60.6	-171.4	0	0	0	108.4	S261 P265 I266 L268	I259-S261 PolarHBondContact O-N 2.97Å; I259-P265 WeakPolarHBondContact O-CA 3.21Å; I259-I266 HydrophobicContact CB-CD1 4.49Å; I259-I266 HydrophobicContact CB-CG1 3.8Å; I259-I266 HydrophobicContact CD1-CD1 4.3Å; I259-I266 HydrophobicContact CD1-CG1 4.45Å; I259-I266 HydrophobicContact CG1-CG1 4.38Å; I259-I266 HydrophobicContact CG2-CG1 4.5Å; I259-I266 PolarHBondContact N-O 3.29Å; I259-I266 PolarHBondContact O-N 2.92Å; I259-I266 VanDerWaalsContact O-N 3.12Å; I259-L268 HydrophobicContact CD1-CD1 3.28Å; I259-L268 HydrophobicContact CD1-CG 3.81Å; I259-L268 HydrophobicContact CG1-CD1 4.06Å; I259-L268 HydrophobicContact CG1-CG 4.24Å
260	P	87.5	Confident	88.2	Confident	86 Å²	86	57.9 Å²	57.9	56%	0.558	30%	0.302	S	S	*	.			trans	-83.1	63.5	-177.1	35.2	-36.2	0	0	0	111.5	I237 V258	I237-P260 HydrophobicContact CD1-CB 3.7Å; I237-P260 HydrophobicContact CG1-CB 4.08Å; I237-P260 HydrophobicContact CG2-CB 4.29Å; V258-P260 WeakPolarHBondContact O-CD 3.22Å
261	S	81.2	Confident	87.9	Confident	51 Å²	51	57.2 Å²	57.2	36%	0.357	30%	0.299	S	S	.	.			trans	-70.1	142.2	173	178.8	0	0	0	0	110.8	I259 H263 C264 P265	I259-S261 PolarHBondContact O-N 2.97Å; S261-H263 VanDerWaalsContact C-N 3.31Å; S261-H263 PolarHBondContact O-N 3.42Å; S261-H263 PolarHBondContact OG-N 3.37Å; S261-C264 WeakPolarHBondContact CB-O 3.16Å; S261-P265 VanDerWaalsContact O-CD 3.31Å; S261-P265 WeakPolarHBondContact O-CD 3.15Å; S261-P265 VanDerWaalsContact O-CG 3.29Å; S261-P265 WeakPolarHBondContact O-CG 3.19Å
262	K	69.6	Low	87.5	Confident	192 Å²	192	54.7 Å²	54.7	84%	0.835	29%	0.287	S	S	*	.	S	Bend	trans	-65.3	-34.1	176.3	-71.9	-169.3	177.1	-171.8	0	112.7
263	H	76.6	Confident	87	Confident	94 Å²	94	58.7 Å²	58.7	44%	0.435	31%	0.308	S	S	.	.	S	Bend	trans	-80	-52.6	-175.7	-171.8	-70.2	0	0	0	111.8	S261 E430 H433	S261-H263 VanDerWaalsContact C-N 3.31Å; S261-H263 PolarHBondContact O-N 3.42Å; S261-H263 PolarHBondContact OG-N 3.37Å; H263-E430 IonicContact CE1-OE1 3.6Å; H263-E430 PolarHBondContact CE1-OE1 3.26Å; H263-E430 IonicContact CE1-OE2 3.16Å; H263-E430 IonicContact NE2-OE1 3.58Å; H263-E430 PolarHBondContact NE2-OE1 2.95Å; H263-H433 AromaticContact CD2-ND1 3.79Å; H263-H433 AromaticContact CE1-ND1 3.69Å; H263-H433 AromaticContact NE2-CE1 3.7Å; H263-H433 AromaticContact NE2-CG 3.84Å; H263-H433 AromaticContact NE2-ND1 2.99Å; H263-H433 PolarHBondContact NE2-ND1 3.15Å
264	C	86.4	Confident	86.6	Confident	35 Å²	35	64.8 Å²	64.8	24%	0.236	33%	0.334	C	S	.	.			trans	-146.2	94.2	-179.8	-172.5	0	0	0	0	108.9	S261 I266	S261-C264 WeakPolarHBondContact CB-O 3.16Å; C264-I266 PolarHBondContact O-N 3.04Å
265	P	92.5	Very high	86.4	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.013	32%	0.324	C	S	.	.			trans	-56.6	135.3	169.1	-22.1	31.8	0	0	0	110.4	V233 R236 I237 L240 I259 S261	V233-P265 HydrophobicContact CG1-CG 3.9Å; R236-P265 HydrophobicContact CB-CB 4.48Å; R236-P265 HydrophobicContact CB-CG 4.15Å; I237-P265 HydrophobicContact CD1-CG 4.41Å; I237-P265 HydrophobicContact CG1-CB 3.8Å; I237-P265 HydrophobicContact CG1-CG 3.82Å; L240-P265 VanDerWaalsContact CD1-C 3.47Å; L240-P265 HydrophobicContact CD1-CB 3.59Å; L240-P265 WeakPolarHBondContact CD1-O 3.3Å; I259-P265 WeakPolarHBondContact O-CA 3.21Å; S261-P265 VanDerWaalsContact O-CD 3.31Å; S261-P265 WeakPolarHBondContact O-CD 3.15Å; S261-P265 VanDerWaalsContact O-CG 3.29Å; S261-P265 WeakPolarHBondContact O-CG 3.19Å
266	I	95	Very high	86.9	Confident	27 Å²	27	58.9 Å²	58.9	14%	0.138	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	153	178.7	61.6	175.2	0	0	0	111.6	V258 I259 C264 L268 E278 M279	V258-I266 WeakPolarHBondContact CA-O 3.12Å; I259-I266 HydrophobicContact CB-CD1 4.49Å; I259-I266 HydrophobicContact CB-CG1 3.8Å; I259-I266 HydrophobicContact CD1-CD1 4.3Å; I259-I266 HydrophobicContact CD1-CG1 4.45Å; I259-I266 HydrophobicContact CG1-CG1 4.38Å; I259-I266 HydrophobicContact CG2-CG1 4.5Å; I259-I266 PolarHBondContact N-O 3.29Å; I259-I266 PolarHBondContact O-N 2.92Å; I259-I266 VanDerWaalsContact O-N 3.12Å; C264-I266 PolarHBondContact O-N 3.04Å; I266-L268 HydrophobicContact CD1-CD2 3.85Å; I266-L268 HydrophobicContact CD1-CG 4.23Å; I266-E278 HydrophobicContact CD1-CB 4.46Å; I266-E278 WeakPolarHBondContact CD1-OE2 3.42Å; I266-M279 CarbonylContact C-O 3.44Å; I266-M279 VanDerWaalsContact CA-O 3.25Å; I266-M279 WeakPolarHBondContact CA-O 3.35Å
267	L	95.8	Very high	87.1	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	111.9	166	179.9	73.7	0	0	0	108.3	L240 I243 L247 V258 F269 M279	L240-L267 HydrophobicContact CB-CB 4.41Å; L240-L267 HydrophobicContact CD2-CB 3.77Å; I243-L267 HydrophobicContact CB-CD2 4.38Å; I243-L267 HydrophobicContact CG2-CD2 3.85Å; L247-L267 HydrophobicContact CD1-CD2 3.89Å; V258-L267 HydrophobicContact CG2-CD1 3.58Å; L267-F269 HydrophobicContact CD2-CD1 4.16Å; L267-F269 HydrophobicContact CD2-CE1 4.47Å; L267-F269 HydrophobicContact CG-CD1 4.14Å; L267-M279 HydrophobicContact CB-CB 4.27Å; L267-M279 PolarHBondContact N-O 2.72Å; L267-M279 PolarHBondContact O-N 3.41Å
268	L	94.5	Very high	87.3	Confident	35 Å²	35	55.4 Å²	55.4	18%	0.183	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	136.2	170.9	-69.1	-174.8	0	0	0	110.1	S256 V257 I259 I266 Q276 C277 E278	S256-L268 CarbonylContact C-O 3.55Å; S256-L268 VanDerWaalsContact CA-O 3.31Å; S256-L268 WeakPolarHBondContact CA-O 3.46Å; V257-L268 PolarHBondContact N-O 3.29Å; V257-L268 PolarHBondContact O-N 3.16Å; I259-L268 HydrophobicContact CD1-CD1 3.28Å; I259-L268 HydrophobicContact CD1-CG 3.81Å; I259-L268 HydrophobicContact CG1-CD1 4.06Å; I259-L268 HydrophobicContact CG1-CG 4.24Å; I266-L268 HydrophobicContact CD1-CD2 3.85Å; I266-L268 HydrophobicContact CD1-CG 4.23Å; L268-Q276 HydrophobicContact CD2-CG 4.48Å; L268-C277 WeakPolarHBondContact CA-O 3.4Å; L268-E278 HydrophobicContact CD2-CB 4.03Å; L268-E278 HydrophobicContact CD2-CG 3.46Å; L268-E278 VanDerWaalsContact CD2-CG 3.46Å; L268-E278 WeakPolarHBondContact CD2-OE1 3.2Å
269	F	93.9	Very high	87.6	Confident	3 Å²	3	53.8 Å²	53.8	1%	0.013	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	178.8	167.2	57.7	-92.8	0	0	0	110.7	F146 L150 I183 L247 V253 R255 L267 C277 M279	F146-F269 HydrophobicContact CE1-CE2 4.04Å; F146-F269 HydrophobicContact CE1-CZ 4.49Å; F146-F269 AromaticContact CZ-CE2 3.69Å; F146-F269 HydrophobicContact CZ-CE2 3.69Å; F146-F269 HydrophobicContact CZ-CZ 4.4Å; L150-F269 HydrophobicContact CD2-CZ 3.95Å; I183-F269 HydrophobicContact CD1-CE1 4.41Å; I183-F269 HydrophobicContact CD1-CZ 3.82Å; L247-F269 HydrophobicContact CD1-CD1 4.33Å; L247-F269 HydrophobicContact CD1-CE1 4.32Å; V253-F269 HydrophobicContact CB-CD2 4.37Å; V253-F269 HydrophobicContact CG1-CB 3.84Å; V253-F269 HydrophobicContact CG1-CD2 3.78Å; V253-F269 HydrophobicContact CG1-CG 3.9Å; V253-F269 HydrophobicContact CG2-CD2 3.75Å; V253-F269 HydrophobicContact CG2-CE2 3.81Å; R255-F269 WeakPolarHBondContact O-CA 3.39Å; L267-F269 HydrophobicContact CD2-CD1 4.16Å; L267-F269 HydrophobicContact CD2-CE1 4.47Å; L267-F269 HydrophobicContact CG-CD1 4.14Å; F269-C277 HydrophobicContact CD1-CB 4.47Å; F269-C277 HydrophobicContact CD2-CB 3.65Å; F269-C277 HydrophobicContact CE1-CB 4.16Å; F269-C277 HydrophobicContact CE2-CB 3.21Å; F269-C277 HydrophobicContact CG-CB 4.26Å; F269-C277 HydrophobicContact CZ-CB 3.52Å; F269-C277 PolarHBondContact N-O 3.42Å; F269-C277 PolarHBondContact O-N 3.04Å; F269-M279 HydrophobicContact CE1-CB 3.85Å; F269-M279 HydrophobicContact CE1-CE 4.34Å
270	R	89	Confident	87.9	Confident	52 Å²	52	50.6 Å²	50.6	20%	0.196	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	143.7	171.3	-71.1	-171.3	176.3	-133.7	5	111.3	P104 V253 Q254 K274 L275	P104-R270 PolarHBondContact O-NH2 3.14Å; V253-R270 CarbonylContact C-O 3.49Å; V253-R270 WeakPolarHBondContact CA-O 3.43Å; Q254-R270 PolarHBondContact N-O 3.37Å; Q254-R270 PolarHBondContact O-N 3.26Å; R270-K274 PolarHBondContact NH1-O 2.73Å; R270-L275 VanDerWaalsContact CA-O 3.23Å; R270-L275 WeakPolarHBondContact CA-O 3.4Å
271	N	87	Confident	88.3	Confident	6 Å²	6	46.8 Å²	46.8	3%	0.032	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	176.5	170	74.7	1.9	0	0	0	111.7	F146 L252 L273 K274 L275	F146-N271 HydrophobicContact CD2-CB 4Å; F146-N271 HydrophobicContact CE1-CB 4.33Å; F146-N271 HydrophobicContact CE2-CB 3.73Å; F146-N271 HydrophobicContact CG-CB 4.43Å; F146-N271 HydrophobicContact CZ-CB 3.93Å; L252-N271 CarbonylContact O-C 3.58Å; L252-N271 VanDerWaalsContact O-C 3.31Å; L252-N271 WeakPolarHBondContact O-CA 3.43Å; N271-L273 PolarHBondContact O-N 3.42Å; N271-L273 VanDerWaalsContact O-N 3.17Å; N271-L273 WeakPolarHBondContact OD1-CA 3.16Å; N271-L273 WeakPolarHBondContact OD1-CB 3.37Å; N271-L273 PolarHBondContact OD1-N 3.12Å; N271-K274 WeakPolarHBondContact O-CA 3.45Å; N271-K274 PolarHBondContact O-N 3.48Å; N271-K274 PolarHBondContact OD1-N 3.47Å; N271-K274 VanDerWaalsContact OD1-N 3.11Å; N271-L275 PolarHBondContact N-O 3.21Å; N271-L275 WeakPolarHBondContact OD1-CB 3.25Å; N271-L275 PolarHBondContact OD1-N 3.32Å
272	A	81.6	Confident	88.8	Confident	54 Å²	54	46.8 Å²	46.8	45%	0.446	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-27.6	176.3	0	0	0	0	0	114	L252 K274	L252-A272 HydrophobicContact CD2-CB 4.01Å; L252-A272 PolarHBondContact O-N 2.79Å; A272-K274 PolarHBondContact O-N 2.7Å
273	L	79.2	Confident	89.9	Confident	132 Å²	132	39.2 Å²	39.2	69%	0.691	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	6.8	175.6	-58.9	178.3	0	0	0	113.1	N271 L275	N271-L273 PolarHBondContact O-N 3.42Å; N271-L273 VanDerWaalsContact O-N 3.17Å; N271-L273 WeakPolarHBondContact OD1-CA 3.16Å; N271-L273 WeakPolarHBondContact OD1-CB 3.37Å; N271-L273 PolarHBondContact OD1-N 3.12Å; L273-L275 HydrophobicContact CB-CG 4.36Å; L273-L275 PolarHBondContact O-N 3.24Å
274	K	82	Confident	90.6	Very high	143 Å²	143	39.7 Å²	39.7	62%	0.622	20%	0.204	S	C	*	.			trans	63.6	13.9	-178.2	-53.2	177.7	178.9	173.1	0	114.6	R270 N271 A272	R270-K274 PolarHBondContact NH1-O 2.73Å; N271-K274 WeakPolarHBondContact O-CA 3.45Å; N271-K274 PolarHBondContact O-N 3.48Å; N271-K274 PolarHBondContact OD1-N 3.47Å; N271-K274 VanDerWaalsContact OD1-N 3.11Å; A272-K274 PolarHBondContact O-N 2.7Å
275	L	82.6	Confident	90.9	Very high	42 Å²	42	43.5 Å²	43.5	22%	0.22	22%	0.215	C	C	.	.			trans	-70.1	141.8	169.2	-61.3	174.4	0	0	0	108.9	I181 R270 N271 L273	I181-L275 HydrophobicContact CD1-CB 4.18Å; I181-L275 HydrophobicContact CD1-CD1 3.89Å; I181-L275 HydrophobicContact CG1-CB 4.5Å; I181-L275 HydrophobicContact CG1-CD1 4.47Å; R270-L275 VanDerWaalsContact CA-O 3.23Å; R270-L275 WeakPolarHBondContact CA-O 3.4Å; N271-L275 PolarHBondContact N-O 3.21Å; N271-L275 WeakPolarHBondContact OD1-CB 3.25Å; N271-L275 PolarHBondContact OD1-N 3.32Å; L273-L275 HydrophobicContact CB-CG 4.36Å; L273-L275 PolarHBondContact O-N 3.24Å
276	Q	90	Very high	91	Very high	60 Å²	60	43.7 Å²	43.7	28%	0.28	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	136	173.7	174	171.5	-49.5	0	0	108.8	D180 I181 L268 E278	D180-Q276 WeakPolarHBondContact CA-O 3.48Å; D180-Q276 HydrophobicContact CB-CB 4.49Å; D180-Q276 WeakPolarHBondContact OD1-CB 3.41Å; I181-Q276 PolarHBondContact N-O 3.14Å; L268-Q276 HydrophobicContact CD2-CG 4.48Å; Q276-E278 PolarHBondContact NE2-OE1 2.95Å
277	C	93.3	Very high	90.9	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137	176.2	-56.9	0	0	0	0	109	I181 L268 F269	I181-C277 CarbonylContact O-C 3.6Å; I181-C277 VanDerWaalsContact O-CA 3.22Å; I181-C277 WeakPolarHBondContact O-CA 3.24Å; L268-C277 WeakPolarHBondContact CA-O 3.4Å; F269-C277 HydrophobicContact CD1-CB 4.47Å; F269-C277 HydrophobicContact CD2-CB 3.65Å; F269-C277 HydrophobicContact CE1-CB 4.16Å; F269-C277 HydrophobicContact CE2-CB 3.21Å; F269-C277 HydrophobicContact CG-CB 4.26Å; F269-C277 HydrophobicContact CZ-CB 3.52Å; F269-C277 PolarHBondContact N-O 3.42Å; F269-C277 PolarHBondContact O-N 3.04Å
278	E	94.6	Very high	90.9	Very high	47 Å²	47	45.1 Å²	45.1	22%	0.22	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	111.2	176.9	-44.8	-154.1	158.7	0	0	108.9	I181 I183 I266 L268 Q276	I181-E278 PolarHBondContact O-N 3.46Å; I183-E278 PolarHBondContact N-O 2.83Å; I183-E278 VanDerWaalsContact O-O 3.1Å; I266-E278 HydrophobicContact CD1-CB 4.46Å; I266-E278 WeakPolarHBondContact CD1-OE2 3.42Å; L268-E278 HydrophobicContact CD2-CB 4.03Å; L268-E278 HydrophobicContact CD2-CG 3.46Å; L268-E278 VanDerWaalsContact CD2-CG 3.46Å; L268-E278 WeakPolarHBondContact CD2-OE1 3.2Å; Q276-E278 PolarHBondContact NE2-OE1 2.95Å
279	M	97	Very high	90.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	125.7	176.7	177.7	-178.6	-72.5	0	0	111.1	L150 L154 I164 I183 I243 I266 L267 F269	L150-M279 HydrophobicContact CD2-CE 3.69Å; L150-M279 HydrophobicContact CG-CE 4.36Å; L154-M279 HydrophobicContact CD1-CE 3.85Å; L154-M279 HydrophobicContact CD1-SD 4.42Å; I164-M279 HydrophobicContact CD1-CE 4.18Å; I183-M279 HydrophobicContact CD1-CB 4.11Å; I183-M279 HydrophobicContact CD1-CE 3.54Å; I183-M279 HydrophobicContact CD1-CG 4.45Å; I183-M279 HydrophobicContact CG1-CB 3.8Å; I183-M279 HydrophobicContact CG1-CE 4.26Å; I183-M279 HydrophobicContact CG1-CG 4.21Å; I183-M279 CarbonylContact O-C 3.6Å; I183-M279 VanDerWaalsContact O-CA 3.29Å; I183-M279 WeakPolarHBondContact O-CA 3.22Å; I243-M279 HydrophobicContact CD1-SD 4.33Å; I243-M279 HydrophobicContact CG2-SD 3.8Å; I266-M279 CarbonylContact C-O 3.44Å; I266-M279 VanDerWaalsContact CA-O 3.25Å; I266-M279 WeakPolarHBondContact CA-O 3.35Å; L267-M279 HydrophobicContact CB-CB 4.27Å; L267-M279 PolarHBondContact N-O 2.72Å; L267-M279 PolarHBondContact O-N 3.41Å; F269-M279 HydrophobicContact CE1-CB 3.85Å; F269-M279 HydrophobicContact CE1-CE 4.34Å
280	S	96.1	Very high	91	Very high	1 Å²	1	45 Å²	45	1%	0.007	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	166.4	170.4	55.8	0	0	0	0	110.8	I183 T184 L185 N283	I183-S280 PolarHBondContact O-N 3.2Å; I183-S280 PolarHBondContact O-OG 3.47Å; T184-S280 CarbonylContact C-O 3.57Å; T184-S280 VanDerWaalsContact CA-O 3.26Å; T184-S280 WeakPolarHBondContact CA-O 3.48Å; T184-S280 WeakPolarHBondContact CB-OG 3.16Å; T184-S280 PolarHBondContact OG1-O 2.91Å; T184-S280 PolarHBondContact OG1-OG 3Å; L185-S280 PolarHBondContact N-O 3.35Å; S280-N283 VanDerWaalsContact OG-CB 3.24Å; S280-N283 WeakPolarHBondContact OG-CB 3.19Å
281	I	95.5	Very high	91.3	Very high	6 Å²	6	44.4 Å²	44.4	3%	0.031	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.9	174.1	-52.5	-57.5	0	0	0	108.5	L185 L227 Q230 R236 L239 L240 I243 N283	L185-I281 HydrophobicContact CB-CD1 4.08Å; L185-I281 HydrophobicContact CD2-CD1 4.49Å; L227-I281 HydrophobicContact CD1-CG2 3.77Å; Q230-I281 HydrophobicContact CB-CG2 4.05Å; Q230-I281 HydrophobicContact CG-CG2 4.19Å; R236-I281 HydrophobicContact CG-CB 4.14Å; R236-I281 HydrophobicContact CG-CG2 4.45Å; L239-I281 HydrophobicContact CD2-CD1 3.97Å; L239-I281 HydrophobicContact CD2-CG1 4.1Å; L239-I281 HydrophobicContact CD2-CG2 4.13Å; L239-I281 HydrophobicContact CG-CD1 4.33Å; L240-I281 HydrophobicContact CD2-CD1 3.82Å; L240-I281 HydrophobicContact CD2-CG1 3.85Å; L240-I281 HydrophobicContact CG-CD1 4.42Å; L240-I281 HydrophobicContact CG-CG1 4.04Å; I243-I281 HydrophobicContact CD1-CD1 3.73Å; I281-N283 VanDerWaalsContact C-N 3.29Å; I281-N283 PolarHBondContact O-N 3.15Å
282	E	92.8	Very high	91.7	Very high	51 Å²	51	44.3 Å²	44.3	24%	0.238	23%	0.23	C	C	.	.	S	Bend	trans	44.5	46.9	176.8	-62.5	-157.6	163.9	0	0	115	T184 L185 I186 Q230 L284	T184-E282 PolarHBondContact OG1-N 2.92Å; L185-E282 PolarHBondContact O-N 3.25Å; I186-E282 HydrophobicContact CG2-CG 4.47Å; Q230-E282 HydrophobicContact CG-CG 4.35Å; Q230-E282 PolarHBondContact NE2-OE2 2.93Å; E282-L284 PolarHBondContact O-N 3.29Å
283	N	92.4	Very high	92.5	Very high	34 Å²	34	42 Å²	42	18%	0.182	21%	0.21	C	C	.	.			trans	-79.9	68.8	177.3	-172.8	7.6	0	0	0	111.5	F167 T184 S280 I281 Y285 G286 L287	F167-N283 WeakPolarHBondContact CE2-ND2 3.45Å; F167-N283 VanDerWaalsContact CZ-ND2 3.26Å; F167-N283 WeakPolarHBondContact CZ-ND2 3.42Å; T184-N283 PolarHBondContact OG1-N 2.8Å; S280-N283 VanDerWaalsContact OG-CB 3.24Å; S280-N283 WeakPolarHBondContact OG-CB 3.19Å; I281-N283 VanDerWaalsContact C-N 3.29Å; I281-N283 PolarHBondContact O-N 3.15Å; N283-Y285 VanDerWaalsContact C-N 3.26Å; N283-Y285 PolarHBondContact O-N 3.25Å; N283-G286 PolarHBondContact O-N 3.11Å; N283-G286 VanDerWaalsContact O-N 3.13Å; N283-G286 PolarHBondContact OD1-N 2.95Å; N283-L287 PolarHBondContact O-N 3.35Å; N283-L287 VanDerWaalsContact O-N 3.13Å
284	L	91.8	Very high	93.2	Very high	104 Å²	104	38.5 Å²	38.5	55%	0.545	19%	0.192	S	C	.	.	H	α-helix	trans	-63.5	-31.5	-178	-59.3	-175.5	0	0	0	112.9	E282 L287 T288	E282-L284 PolarHBondContact O-N 3.29Å; L284-L287 HydrophobicContact CD2-CD1 4.21Å; L284-L287 PolarHBondContact O-N 2.91Å; L284-T288 WeakPolarHBondContact O-CB 3.47Å; L284-T288 PolarHBondContact O-N 2.94Å; L284-T288 PolarHBondContact O-OG1 2.96Å
285	Y	92	Very high	93.9	Very high	115 Å²	115	33.7 Å²	33.7	45%	0.451	17%	0.17	S	C	.	.	H	α-helix	trans	-64	-46.4	172.1	-80.4	-56.1	0	0	0	111.4	N283 L287 T288 K289 F429 E430	N283-Y285 VanDerWaalsContact C-N 3.26Å; N283-Y285 PolarHBondContact O-N 3.25Å; Y285-L287 VanDerWaalsContact C-N 3.28Å; Y285-L287 PolarHBondContact O-N 3.29Å; Y285-T288 PolarHBondContact O-N 3.35Å; Y285-K289 WeakPolarHBondContact O-CB 3.48Å; Y285-K289 WeakPolarHBondContact O-CD 3.32Å; Y285-K289 WeakPolarHBondContact O-CG 3.41Å; Y285-K289 PolarHBondContact O-N 2.99Å; Y285-F429 HydrophobicContact CD1-CB 4.33Å; Y285-F429 WeakPolarHBondContact CE1-O 3.29Å; Y285-E430 HydrophobicContact CD1-CB 3.94Å; Y285-E430 HydrophobicContact CD1-CG 4.48Å; Y285-E430 HydrophobicContact CD2-CB 4.49Å; Y285-E430 HydrophobicContact CD2-CG 4.19Å; Y285-E430 HydrophobicContact CE1-CB 4.05Å; Y285-E430 HydrophobicContact CE1-CG 4.43Å; Y285-E430 HydrophobicContact CE2-CG 4.13Å; Y285-E430 HydrophobicContact CG-CB 4.19Å; Y285-E430 HydrophobicContact CG-CG 4.38Å
286	G	94.2	Very high	94.5	Very high	6 Å²	6	31.9 Å²	31.9	6%	0.062	16%	0.161	C	C	.	.	H	α-helix	trans	-56.4	-42.1	174.2	0	0	0	0	0	112.5	N283 T290	N283-G286 PolarHBondContact O-N 3.11Å; N283-G286 VanDerWaalsContact O-N 3.13Å; N283-G286 PolarHBondContact OD1-N 2.95Å; G286-T290 VanDerWaalsContact O-CB 3.29Å; G286-T290 WeakPolarHBondContact O-CB 3.35Å; G286-T290 PolarHBondContact O-N 2.92Å; G286-T290 PolarHBondContact O-OG1 3.48Å
287	L	94.7	Very high	94.7	Very high	34 Å²	34	29.6 Å²	29.6	18%	0.178	15%	0.151	C	C	.	.	H	α-helix	trans	-65.2	-46	175.8	-66.5	173.5	0	0	0	112.4	K165 F167 T184 I186 N283 L284 Y285 T290 A291	K165-L287 HydrophobicContact CB-CD2 3.69Å; K165-L287 HydrophobicContact CD-CD1 4.19Å; K165-L287 HydrophobicContact CD-CD2 4.32Å; F167-L287 HydrophobicContact CB-CD2 4.06Å; T184-L287 HydrophobicContact CG2-CD1 3.9Å; T184-L287 HydrophobicContact CG2-CD2 3.97Å; T184-L287 HydrophobicContact CG2-CG 3.94Å; I186-L287 HydrophobicContact CG2-CD1 4.5Å; N283-L287 PolarHBondContact O-N 3.35Å; N283-L287 VanDerWaalsContact O-N 3.13Å; L284-L287 HydrophobicContact CD2-CD1 4.21Å; L284-L287 PolarHBondContact O-N 2.91Å; Y285-L287 VanDerWaalsContact C-N 3.28Å; Y285-L287 PolarHBondContact O-N 3.29Å; L287-T290 WeakPolarHBondContact O-CB 3.3Å; L287-T290 PolarHBondContact O-N 3.22Å; L287-A291 PolarHBondContact O-N 3.35Å
288	T	94.6	Very high	94.7	Very high	22 Å²	22	33.4 Å²	33.4	14%	0.135	17%	0.171	C	C	.	.	H	α-helix	trans	-65.6	-45.7	-178.4	-58	0	0	0	0	111.6	L284 Y285 T290 A291 W292 K356 F429	L284-T288 WeakPolarHBondContact O-CB 3.47Å; L284-T288 PolarHBondContact O-N 2.94Å; L284-T288 PolarHBondContact O-OG1 2.96Å; Y285-T288 PolarHBondContact O-N 3.35Å; T288-T290 VanDerWaalsContact C-N 3.26Å; T288-T290 PolarHBondContact O-N 3.22Å; T288-A291 PolarHBondContact O-N 2.66Å; T288-W292 PolarHBondContact O-N 3.26Å; T288-K356 PolarHBondContact OG1-NZ 2.99Å; T288-K356 VanDerWaalsContact OG1-NZ 3.09Å; T288-F429 HydrophobicContact CG2-CB 4.5Å; T288-F429 HydrophobicContact CG2-CD1 3.98Å; T288-F429 HydrophobicContact CG2-CD2 4.18Å; T288-F429 HydrophobicContact CG2-CE1 4.26Å; T288-F429 HydrophobicContact CG2-CE2 4.44Å; T288-F429 HydrophobicContact CG2-CG 3.94Å; T288-F429 HydrophobicContact CG2-CZ 4.49Å
289	K	95.1	Very high	94.7	Very high	23 Å²	23	31.6 Å²	31.6	10%	0.1	16%	0.164	C	C	.	.	H	α-helix	trans	-58.3	-41	174.2	-66.2	165	-160.7	-168.6	0	111.3	Y285 L293 D427 F429 E430	Y285-K289 WeakPolarHBondContact O-CB 3.48Å; Y285-K289 WeakPolarHBondContact O-CD 3.32Å; Y285-K289 WeakPolarHBondContact O-CG 3.41Å; Y285-K289 PolarHBondContact O-N 2.99Å; K289-L293 WeakPolarHBondContact O-CB 3.47Å; K289-L293 VanDerWaalsContact O-CG 3.3Å; K289-L293 WeakPolarHBondContact O-CG 3.43Å; K289-L293 PolarHBondContact O-N 2.92Å; K289-D427 WeakPolarHBondContact CD-OD2 3.39Å; K289-D427 VanDerWaalsContact CE-CG 3.4Å; K289-D427 WeakPolarHBondContact CE-OD1 3.13Å; K289-D427 WeakPolarHBondContact CE-OD2 3.48Å; K289-D427 VanDerWaalsContact NZ-CG 3.27Å; K289-D427 IonicContact NZ-OD1 3.46Å; K289-D427 PolarHBondContact NZ-OD1 2.95Å; K289-D427 IonicContact NZ-OD2 3.27Å; K289-D427 PolarHBondContact NZ-OD2 3.4Å; K289-F429 HydrophobicContact CG-CD2 3.84Å; K289-E430 IonicContact NZ-OE2 3.64Å; K289-E430 PolarHBondContact NZ-OE2 3.48Å
290	T	95.6	Very high	94.5	Very high	13 Å²	13	32.1 Å²	32.1	8%	0.08	17%	0.166	C	C	.	.	H	α-helix	trans	-65.5	-45.5	178.6	-61.6	0	0	0	0	111.8	F167 G168 A171 T172 G286 L287 T288 L293 N294	F167-T290 HydrophobicContact CB-CG2 4.46Å; F167-T290 WeakPolarHBondContact CB-OG1 3.31Å; G168-T290 PolarHBondContact N-OG1 3.11Å; A171-T290 HydrophobicContact CB-CG2 3.49Å; A171-T290 VanDerWaalsContact CB-CG2 3.49Å; T172-T290 HydrophobicContact CG2-CG2 4.02Å; G286-T290 VanDerWaalsContact O-CB 3.29Å; G286-T290 WeakPolarHBondContact O-CB 3.35Å; G286-T290 PolarHBondContact O-N 2.92Å; G286-T290 PolarHBondContact O-OG1 3.48Å; L287-T290 WeakPolarHBondContact O-CB 3.3Å; L287-T290 PolarHBondContact O-N 3.22Å; T288-T290 VanDerWaalsContact C-N 3.26Å; T288-T290 PolarHBondContact O-N 3.22Å; T290-L293 PolarHBondContact O-N 3.18Å; T290-N294 WeakPolarHBondContact O-CB 3.48Å; T290-N294 PolarHBondContact O-N 2.95Å
291	A	95.1	Very high	94.2	Very high	39 Å²	39	33 Å²	33	32%	0.322	18%	0.175	S	C	.	.	H	α-helix	trans	-61.4	-46.1	178.8	0	0	0	0	0	111.5	L287 T288 N294 Y295	L287-A291 PolarHBondContact O-N 3.35Å; T288-A291 PolarHBondContact O-N 2.66Å; A291-N294 PolarHBondContact O-N 3.42Å; A291-Y295 WeakPolarHBondContact O-CB 3.46Å; A291-Y295 PolarHBondContact O-N 2.86Å
292	W	96.3	Very high	93.9	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.015	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-47.5	176.1	172.5	61.2	0	0	0	112.7	T288 N294 Y295 L296 L336 V339 A351 Y354 P398 P428 F429	T288-W292 PolarHBondContact O-N 3.26Å; W292-N294 VanDerWaalsContact C-N 3.31Å; W292-N294 PolarHBondContact O-N 3.35Å; W292-Y295 WeakPolarHBondContact O-CB 3.4Å; W292-Y295 PolarHBondContact O-N 2.91Å; W292-L296 HydrophobicContact CD2-CD1 4.27Å; W292-L296 HydrophobicContact CH2-CD1 4.2Å; W292-L296 HydrophobicContact CZ2-CD1 3.65Å; W292-L296 WeakPolarHBondContact O-CG 3.31Å; W292-L296 PolarHBondContact O-N 3.33Å; W292-L336 HydrophobicContact CH2-CD2 4.15Å; W292-L336 HydrophobicContact CZ3-CD2 3.77Å; W292-V339 HydrophobicContact CH2-CG1 3.92Å; W292-V339 HydrophobicContact CZ2-CG1 4.05Å; W292-A351 HydrophobicContact CD2-CB 4.41Å; W292-A351 HydrophobicContact CH2-CB 4.09Å; W292-A351 HydrophobicContact CZ2-CB 3.47Å; W292-A351 VanDerWaalsContact CZ2-CB 3.47Å; W292-Y354 HydrophobicContact CB-CD1 3.96Å; W292-Y354 HydrophobicContact CB-CD2 4.49Å; W292-Y354 HydrophobicContact CB-CE1 3.85Å; W292-Y354 HydrophobicContact CB-CE2 4.41Å; W292-Y354 HydrophobicContact CB-CG 4.27Å; W292-Y354 AromaticContact CD1-CD1 3.98Å; W292-Y354 AromaticContact CD1-CD2 3.65Å; W292-Y354 AromaticContact CD1-CG 3.47Å; W292-Y354 VanDerWaalsContact CD1-CG 3.47Å; W292-Y354 HydrophobicContact CG-CD1 4.25Å; W292-Y354 HydrophobicContact CG-CD2 4.47Å; W292-Y354 HydrophobicContact CG-CG 4.18Å; W292-P398 HydrophobicContact CH2-CB 4.35Å; W292-P428 HydrophobicContact CE3-CG 4.08Å; W292-P428 HydrophobicContact CH2-CG 4.02Å; W292-P428 HydrophobicContact CZ3-CG 3.61Å; W292-F429 HydrophobicContact CB-CE2 3.58Å; W292-F429 HydrophobicContact CB-CZ 3.63Å; W292-F429 AromaticContact CD2-CE2 3.77Å; W292-F429 HydrophobicContact CD2-CE2 3.77Å; W292-F429 AromaticContact CD2-CZ 3.96Å; W292-F429 HydrophobicContact CD2-CZ 3.96Å; W292-F429 AromaticContact CE3-CE2 3.75Å; W292-F429 HydrophobicContact CE3-CE2 3.75Å; W292-F429 HydrophobicContact CE3-CZ 4.4Å; W292-F429 AromaticContact CG-CE2 3.73Å; W292-F429 HydrophobicContact CG-CE2 3.73Å; W292-F429 AromaticContact CG-CZ 3.62Å; W292-F429 HydrophobicContact CG-CZ 3.62Å
293	L	96.9	Very high	94	Very high	6 Å²	6	33.4 Å²	33.4	3%	0.031	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-37.9	177	-71	179.1	0	0	0	112	T172 F174 K289 T290 L296 S297 Y332 L335	T172-L293 HydrophobicContact CG2-CB 3.83Å; T172-L293 HydrophobicContact CG2-CD1 3.74Å; T172-L293 HydrophobicContact CG2-CG 4.46Å; T172-L293 CarbonylContact O-C 3.31Å; F174-L293 HydrophobicContact CD2-CB 4.28Å; F174-L293 HydrophobicContact CE2-CB 4.21Å; F174-L293 HydrophobicContact CE2-CD2 4.46Å; F174-L293 VanDerWaalsContact CE2-O 3.3Å; F174-L293 WeakPolarHBondContact CE2-O 3.36Å; K289-L293 WeakPolarHBondContact O-CB 3.47Å; K289-L293 VanDerWaalsContact O-CG 3.3Å; K289-L293 WeakPolarHBondContact O-CG 3.43Å; K289-L293 PolarHBondContact O-N 2.92Å; T290-L293 PolarHBondContact O-N 3.18Å; L293-L296 HydrophobicContact CD2-CD1 4.44Å; L293-L296 PolarHBondContact O-N 3.42Å; L293-S297 PolarHBondContact O-N 3.06Å; L293-Y332 HydrophobicContact CD1-CD2 4.09Å; L293-Y332 HydrophobicContact CD1-CE2 3.95Å; L293-L335 HydrophobicContact CD1-CD2 3.83Å; L293-L335 HydrophobicContact CD2-CD2 3.69Å; L293-L335 HydrophobicContact CD2-CG 4.19Å; L293-L335 HydrophobicContact CG-CD2 4.34Å
294	N	95.3	Very high	94.1	Very high	58 Å²	58	31.8 Å²	31.8	31%	0.31	17%	0.173	S	C	.	.	H	α-helix	trans	-63	-44.8	174.7	-176.1	-111.9	0	0	0	111.4	A171 T172 T290 A291 W292 L296 S297 L298	A171-N294 PolarHBondContact O-ND2 2.78Å; T172-N294 WeakPolarHBondContact O-CA 3.42Å; T290-N294 WeakPolarHBondContact O-CB 3.48Å; T290-N294 PolarHBondContact O-N 2.95Å; A291-N294 PolarHBondContact O-N 3.42Å; W292-N294 VanDerWaalsContact C-N 3.31Å; W292-N294 PolarHBondContact O-N 3.35Å; N294-L296 VanDerWaalsContact C-N 3.35Å; N294-L296 PolarHBondContact O-N 3.04Å; N294-S297 WeakPolarHBondContact O-CB 3.47Å; N294-S297 PolarHBondContact O-N 3.25Å; N294-S297 VanDerWaalsContact O-N 3.1Å; N294-S297 PolarHBondContact O-OG 2.92Å; N294-L298 WeakPolarHBondContact O-CG 3.42Å; N294-L298 PolarHBondContact O-N 3.22Å; N294-L298 WeakPolarHBondContact OD1-CD1 3.41Å
295	Y	95.7	Very high	94.3	Very high	42 Å²	42	27.3 Å²	27.3	17%	0.165	15%	0.15	C	C	.	.	H	α-helix	trans	-52.7	-51.4	172.3	171.1	-91.7	0	0	0	111.2	A291 W292 S297 L298 V299 Y354 K358 P360	A291-Y295 WeakPolarHBondContact O-CB 3.46Å; A291-Y295 PolarHBondContact O-N 2.86Å; W292-Y295 WeakPolarHBondContact O-CB 3.4Å; W292-Y295 PolarHBondContact O-N 2.91Å; Y295-S297 VanDerWaalsContact C-N 3.31Å; Y295-S297 PolarHBondContact O-N 3.36Å; Y295-L298 PolarHBondContact O-N 3.29Å; Y295-L298 VanDerWaalsContact O-N 3.11Å; Y295-V299 HydrophobicContact CD1-CG2 4.23Å; Y295-V299 HydrophobicContact CD2-CG2 4.05Å; Y295-V299 HydrophobicContact CE1-CG2 3.87Å; Y295-V299 HydrophobicContact CE2-CG2 3.68Å; Y295-V299 HydrophobicContact CG-CG2 4.3Å; Y295-V299 WeakPolarHBondContact O-CG2 3.49Å; Y295-V299 PolarHBondContact O-N 3.43Å; Y295-Y354 HydrophobicContact CD1-CD2 4.17Å; Y295-Y354 HydrophobicContact CD1-CE2 4.3Å; Y295-Y354 HydrophobicContact CD2-CE2 4.43Å; Y295-Y354 HydrophobicContact CG-CD2 4.33Å; Y295-Y354 AromaticContact CG-CE2 3.99Å; Y295-Y354 HydrophobicContact CG-CE2 3.99Å; Y295-K358 HydrophobicContact CE2-CB 4.12Å; Y295-P360 HydrophobicContact CD2-CB 3.95Å; Y295-P360 HydrophobicContact CE2-CB 4.21Å
296	L	95.6	Very high	94.4	Very high	5 Å²	5	25.2 Å²	25.2	3%	0.026	14%	0.141	C	C	.	.	H	α-helix	trans	-58.7	-41.5	176.8	-67.1	-176.7	0	0	0	112.5	W292 L293 N294 L298 H300 L304 V339 I348	W292-L296 HydrophobicContact CD2-CD1 4.27Å; W292-L296 HydrophobicContact CH2-CD1 4.2Å; W292-L296 HydrophobicContact CZ2-CD1 3.65Å; W292-L296 WeakPolarHBondContact O-CG 3.31Å; W292-L296 PolarHBondContact O-N 3.33Å; L293-L296 HydrophobicContact CD2-CD1 4.44Å; L293-L296 PolarHBondContact O-N 3.42Å; N294-L296 VanDerWaalsContact C-N 3.35Å; N294-L296 PolarHBondContact O-N 3.04Å; L296-L298 VanDerWaalsContact C-N 3.26Å; L296-L298 PolarHBondContact O-N 2.68Å; L296-H300 WeakPolarHBondContact O-CB 3.43Å; L296-H300 PolarHBondContact O-CD2 3.01Å; L296-H300 PolarHBondContact O-N 3.21Å; L296-L304 HydrophobicContact CB-CD2 4.07Å; L296-V339 HydrophobicContact CD1-CG1 4.43Å; L296-V339 HydrophobicContact CD1-CG2 4.21Å; L296-I348 HydrophobicContact CD1-CG2 4.37Å; L296-I348 HydrophobicContact CD2-CG2 3.69Å
297	S	94.7	Very high	94.5	Very high	12 Å²	12	24.9 Å²	24.9	8%	0.084	14%	0.138	C	C	.	.	H	α-helix	trans	-63.4	-32.2	178.9	82.4	0	0	0	0	113	T172 L293 N294 Y295 G301	T172-S297 WeakPolarHBondContact O-CB 3.4Å; T172-S297 PolarHBondContact O-OG 2.99Å; L293-S297 PolarHBondContact O-N 3.06Å; N294-S297 WeakPolarHBondContact O-CB 3.47Å; N294-S297 PolarHBondContact O-N 3.25Å; N294-S297 VanDerWaalsContact O-N 3.1Å; N294-S297 PolarHBondContact O-OG 2.92Å; Y295-S297 VanDerWaalsContact C-N 3.31Å; Y295-S297 PolarHBondContact O-N 3.36Å; S297-G301 VanDerWaalsContact O-CA 3.26Å; S297-G301 WeakPolarHBondContact O-CA 3.3Å; S297-G301 PolarHBondContact O-N 3.1Å
298	L	93.4	Very high	94.6	Very high	79 Å²	79	23.5 Å²	23.5	41%	0.414	13%	0.131	S	C	.	.	H	α-helix	trans	-81.5	-47.6	-180	-68.2	173.3	0	0	0	111.2	N294 Y295 L296 G301 P360	N294-L298 WeakPolarHBondContact O-CG 3.42Å; N294-L298 PolarHBondContact O-N 3.22Å; N294-L298 WeakPolarHBondContact OD1-CD1 3.41Å; Y295-L298 PolarHBondContact O-N 3.29Å; Y295-L298 VanDerWaalsContact O-N 3.11Å; L296-L298 VanDerWaalsContact C-N 3.26Å; L296-L298 PolarHBondContact O-N 2.68Å; L298-G301 PolarHBondContact O-N 3.41Å; L298-P360 HydrophobicContact CB-CB 3.9Å; L298-P360 HydrophobicContact CB-CG 4.43Å; L298-P360 HydrophobicContact CD1-CB 4.26Å; L298-P360 HydrophobicContact CD1-CG 3.96Å
299	V	93.2	Very high	94.5	Very high	10 Å²	10	22.5 Å²	22.5	6%	0.061	13%	0.125	C	C	.	.	H	α-helix	trans	-64	-44.4	-179.5	170.2	0	0	0	0	111.6	Y295 P360 V361 N363	Y295-V299 HydrophobicContact CD1-CG2 4.23Å; Y295-V299 HydrophobicContact CD2-CG2 4.05Å; Y295-V299 HydrophobicContact CE1-CG2 3.87Å; Y295-V299 HydrophobicContact CE2-CG2 3.68Å; Y295-V299 HydrophobicContact CG-CG2 4.3Å; Y295-V299 WeakPolarHBondContact O-CG2 3.49Å; Y295-V299 PolarHBondContact O-N 3.43Å; V299-P360 HydrophobicContact CG2-CB 3.84Å; V299-V361 WeakPolarHBondContact CG1-O 3.45Å; V299-N363 HydrophobicContact CG1-CB 4.23Å; V299-N363 PolarHBondContact O-N 3.49Å
300	H	93.1	Very high	94.3	Very high	10 Å²	10	21.4 Å²	21.4	5%	0.046	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	19.6	-177.8	-54.9	-75.7	0	0	0	112.7	L296 W303 L304 L347	L296-H300 WeakPolarHBondContact O-CB 3.43Å; L296-H300 PolarHBondContact O-CD2 3.01Å; L296-H300 PolarHBondContact O-N 3.21Å; H300-W303 HydrophobicContact CB-CH2 4.49Å; H300-W303 HydrophobicContact CB-CZ2 3.69Å; H300-W303 AromaticContact CG-CZ2 3.97Å; H300-W303 AromaticContact ND1-CZ2 3.85Å; H300-W303 VanDerWaalsContact O-CD1 3.25Å; H300-W303 PolarHBondContact O-N 3.49Å; H300-W303 PolarHBondContact O-NE1 2.92Å; H300-L304 HydrophobicContact CB-CB 3.72Å; H300-L304 HydrophobicContact CB-CD2 3.8Å; H300-L304 HydrophobicContact CB-CG 4.41Å; H300-L304 WeakPolarHBondContact O-CB 3.41Å; H300-L304 PolarHBondContact O-N 2.85Å; H300-L304 VanDerWaalsContact O-N 3.14Å; H300-L347 PolarHBondContact CE1-O 3.29Å
301	G	89.6	Confident	94.2	Very high	19 Å²	19	20.8 Å²	20.8	20%	0.196	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	139.9	176	0	0	0	0	0	111.9	S297 L298	S297-G301 VanDerWaalsContact O-CA 3.26Å; S297-G301 WeakPolarHBondContact O-CA 3.3Å; S297-G301 PolarHBondContact O-N 3.1Å; L298-G301 PolarHBondContact O-N 3.41Å
302	P	91	Very high	94	Very high	58 Å²	58	20.5 Å²	20.5	38%	0.377	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	cis	-99.3	-4.9	8	38.4	-36.2	0	0	0	114.5	L304 R306	P302-L304 PolarHBondContact O-N 2.96Å; P302-R306 WeakPolarHBondContact O-CD 3.45Å; P302-R306 VanDerWaalsContact O-CG 3.22Å; P302-R306 WeakPolarHBondContact O-CG 3.21Å; P302-R306 PolarHBondContact O-N 3.39Å
303	W	93.6	Very high	93.5	Very high	8 Å²	8	21.5 Å²	21.5	3%	0.03	11%	0.111	C	C	.	.	H	α-helix	trans	-67.8	-38.5	-168.6	68.5	-99.2	0	0	0	112.4	H300 R306 L307 L342 V366 L372 L376	H300-W303 HydrophobicContact CB-CH2 4.49Å; H300-W303 HydrophobicContact CB-CZ2 3.69Å; H300-W303 AromaticContact CG-CZ2 3.97Å; H300-W303 AromaticContact ND1-CZ2 3.85Å; H300-W303 VanDerWaalsContact O-CD1 3.25Å; H300-W303 PolarHBondContact O-N 3.49Å; H300-W303 PolarHBondContact O-NE1 2.92Å; W303-R306 PolarHBondContact O-N 3.33Å; W303-L307 HydrophobicContact CE3-CD2 4.35Å; W303-L307 HydrophobicContact CZ3-CD2 4.02Å; W303-L307 WeakPolarHBondContact O-CB 3.35Å; W303-L307 PolarHBondContact O-N 2.95Å; W303-L342 HydrophobicContact CH2-CD1 4.1Å; W303-L342 HydrophobicContact CH2-CD2 4.24Å; W303-L342 HydrophobicContact CZ3-CD1 4.02Å; W303-L342 HydrophobicContact CZ3-CD2 4.13Å; W303-V366 HydrophobicContact CZ2-CG1 4.5Å; W303-L372 HydrophobicContact CB-CD2 3.85Å; W303-L372 HydrophobicContact CD2-CD2 3.94Å; W303-L372 HydrophobicContact CE3-CD2 4.38Å; W303-L372 HydrophobicContact CG-CD2 3.69Å; W303-L376 HydrophobicContact CE3-CD1 3.69Å; W303-L376 HydrophobicContact CH2-CD1 4.22Å; W303-L376 HydrophobicContact CZ3-CD1 3.46Å; W303-L376 VanDerWaalsContact CZ3-CD1 3.46Å
304	L	95.6	Very high	93	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-67.3	-49.3	-176.4	175.1	61.4	0	0	0	112.5	F174 L296 H300 P302 R306 L307 F308 L342 I348	F174-L304 HydrophobicContact CE1-CD2 4.39Å; F174-L304 HydrophobicContact CE1-CG 3.86Å; F174-L304 HydrophobicContact CZ-CD2 3.86Å; F174-L304 HydrophobicContact CZ-CG 3.84Å; L296-L304 HydrophobicContact CB-CD2 4.07Å; H300-L304 HydrophobicContact CB-CB 3.72Å; H300-L304 HydrophobicContact CB-CD2 3.8Å; H300-L304 HydrophobicContact CB-CG 4.41Å; H300-L304 WeakPolarHBondContact O-CB 3.41Å; H300-L304 PolarHBondContact O-N 2.85Å; H300-L304 VanDerWaalsContact O-N 3.14Å; P302-L304 PolarHBondContact O-N 2.96Å; L304-R306 VanDerWaalsContact C-N 3.25Å; L304-R306 PolarHBondContact O-N 3.01Å; L304-L307 PolarHBondContact O-N 3.26Å; L304-F308 PolarHBondContact O-N 3.44Å; L304-L342 HydrophobicContact CD1-CD1 3.45Å; L304-L342 VanDerWaalsContact CD1-CD1 3.45Å; L304-I348 HydrophobicContact CD1-CD1 4.18Å; L304-I348 HydrophobicContact CD2-CD1 3.75Å
305	P	95.6	Very high	92.6	Very high	10 Å²	10	18.8 Å²	18.8	7%	0.065	10%	0.096	C	C	.	.	H	α-helix	trans	-58.3	-35	172	-27.7	35.8	0	0	0	113.9	H132 F174 S309	H132-P305 PolarHBondContact ND1-O 2.95Å; F174-P305 HydrophobicContact CD1-CB 4.43Å; F174-P305 HydrophobicContact CE1-CB 4.4Å; F174-P305 HydrophobicContact CE1-CG 4.2Å; P305-S309 WeakPolarHBondContact O-CB 3.22Å; P305-S309 PolarHBondContact O-N 3.49Å; P305-S309 PolarHBondContact O-OG 3.48Å
306	R	94.3	Very high	91.8	Very high	71 Å²	71	18.6 Å²	18.6	27%	0.268	10%	0.101	S	C	.	.	H	α-helix	trans	-68.2	-50.1	176.6	-69.9	170.6	-175.8	175.3	2.7	111.4	A128 H132 P302 W303 L304 F308 S309 T310 I373	A128-R306 HydrophobicContact CB-CB 4.39Å; H132-R306 HydrophobicContact CB-CB 4.36Å; H132-R306 HydrophobicContact CB-CG 3.84Å; P302-R306 WeakPolarHBondContact O-CD 3.45Å; P302-R306 VanDerWaalsContact O-CG 3.22Å; P302-R306 WeakPolarHBondContact O-CG 3.21Å; P302-R306 PolarHBondContact O-N 3.39Å; W303-R306 PolarHBondContact O-N 3.33Å; L304-R306 VanDerWaalsContact C-N 3.25Å; L304-R306 PolarHBondContact O-N 3.01Å; R306-F308 PolarHBondContact O-N 3.41Å; R306-S309 WeakPolarHBondContact O-CB 3.31Å; R306-S309 PolarHBondContact O-N 2.85Å; R306-S309 VanDerWaalsContact O-N 3.13Å; R306-T310 PolarHBondContact O-N 2.93Å; R306-T310 PolarHBondContact O-OG1 3.13Å; R306-T310 VanDerWaalsContact O-OG1 3.09Å; R306-I373 HydrophobicContact CB-CD1 3.61Å; R306-I373 HydrophobicContact CG-CD1 4.5Å
307	L	95.4	Very high	90.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-55.5	-49.4	176.2	176.2	63	0	0	0	111.2	W303 L304 S309 T310 V311 L338 L342 I373 L376 F377	W303-L307 HydrophobicContact CE3-CD2 4.35Å; W303-L307 HydrophobicContact CZ3-CD2 4.02Å; W303-L307 WeakPolarHBondContact O-CB 3.35Å; W303-L307 PolarHBondContact O-N 2.95Å; L304-L307 PolarHBondContact O-N 3.26Å; L307-S309 VanDerWaalsContact C-N 3.31Å; L307-S309 PolarHBondContact O-N 3.48Å; L307-T310 WeakPolarHBondContact O-CB 3.45Å; L307-T310 PolarHBondContact O-N 3.39Å; L307-V311 HydrophobicContact CD1-CG2 4.3Å; L307-V311 WeakPolarHBondContact O-CG2 3.31Å; L307-V311 PolarHBondContact O-N 3.03Å; L307-L338 HydrophobicContact CD2-CD1 4.15Å; L307-L338 HydrophobicContact CD2-CD2 4.46Å; L307-L338 HydrophobicContact CG-CD1 4.47Å; L307-L338 HydrophobicContact CG-CD2 4.32Å; L307-L342 HydrophobicContact CD2-CD1 4.31Å; L307-L342 HydrophobicContact CD2-CD2 4.18Å; L307-I373 HydrophobicContact CB-CG2 4.5Å; L307-I373 HydrophobicContact CD1-CG2 4.09Å; L307-L376 HydrophobicContact CD1-CB 4.11Å; L307-L376 HydrophobicContact CD2-CB 3.71Å; L307-L376 HydrophobicContact CD2-CD1 3.89Å; L307-L376 HydrophobicContact CD2-CG 4.47Å; L307-F377 HydrophobicContact CD1-CB 4.05Å
308	F	96.2	Very high	90	Very high	4 Å²	4	19.5 Å²	19.5	2%	0.018	10%	0.103	C	C	.	.	H	α-helix	trans	-62.9	-38.8	178.5	179.2	-114.4	0	0	0	112.4	F174 L304 R306 T310 V311 R312 S331 L334 L335 L338	F174-F308 HydrophobicContact CB-CD1 3.83Å; F174-F308 HydrophobicContact CB-CE1 3.97Å; F174-F308 HydrophobicContact CD1-CB 3.92Å; F174-F308 AromaticContact CD1-CD1 3.66Å; F174-F308 HydrophobicContact CD1-CD1 3.66Å; F174-F308 HydrophobicContact CD1-CG 4.05Å; F174-F308 HydrophobicContact CE1-CB 4.17Å; F174-F308 HydrophobicContact CG-CD1 4.11Å; L304-F308 PolarHBondContact O-N 3.44Å; R306-F308 PolarHBondContact O-N 3.41Å; F308-T310 VanDerWaalsContact C-N 3.33Å; F308-T310 PolarHBondContact O-N 2.92Å; F308-V311 PolarHBondContact O-N 3.44Å; F308-R312 WeakPolarHBondContact O-CB 3.43Å; F308-R312 PolarHBondContact O-N 3.31Å; F308-S331 WeakPolarHBondContact CZ-O 3.08Å; F308-L334 HydrophobicContact CE2-CB 4.41Å; F308-L334 HydrophobicContact CE2-CD2 4.39Å; F308-L334 HydrophobicContact CE2-CG 4.22Å; F308-L335 HydrophobicContact CB-CD1 4.28Å; F308-L335 HydrophobicContact CD1-CD1 4.28Å; F308-L335 HydrophobicContact CD2-CB 4.13Å; F308-L335 HydrophobicContact CD2-CD1 3.61Å; F308-L335 HydrophobicContact CD2-CG 4.42Å; F308-L335 HydrophobicContact CE2-CB 3.55Å; F308-L335 HydrophobicContact CE2-CD1 3.95Å; F308-L335 HydrophobicContact CE2-CG 4.27Å; F308-L335 HydrophobicContact CG-CD1 3.78Å; F308-L335 HydrophobicContact CZ-CB 3.77Å; F308-L335 HydrophobicContact CZ-CD1 4.4Å; F308-L335 HydrophobicContact CZ-CG 4.46Å; F308-L338 HydrophobicContact CB-CD2 3.92Å; F308-L338 HydrophobicContact CD2-CD2 3.87Å; F308-L338 HydrophobicContact CG-CD2 4.4Å
309	S	93	Very high	89	Confident	2 Å²	2	16 Å²	16	1%	0.014	9%	0.085	C	C	.	.	H	α-helix	trans	-61.8	-42.7	176	-60	0	0	0	0	111.3	H132 P305 R306 L307 R312 Y313	H132-S309 PolarHBondContact ND1-OG 3.06Å; H132-S309 VanDerWaalsContact ND1-OG 3.12Å; P305-S309 WeakPolarHBondContact O-CB 3.22Å; P305-S309 PolarHBondContact O-N 3.49Å; P305-S309 PolarHBondContact O-OG 3.48Å; R306-S309 WeakPolarHBondContact O-CB 3.31Å; R306-S309 PolarHBondContact O-N 2.85Å; R306-S309 VanDerWaalsContact O-N 3.13Å; L307-S309 VanDerWaalsContact C-N 3.31Å; L307-S309 PolarHBondContact O-N 3.48Å; S309-R312 PolarHBondContact O-N 3.27Å; S309-Y313 WeakPolarHBondContact O-CB 3.46Å; S309-Y313 PolarHBondContact O-N 3.48Å
310	T	91.6	Very high	87.7	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-61.8	-50	175	-57.3	0	0	0	0	111.9	L124 A128 R306 L307 F308 R312 Y313 W314 F377 L467	L124-T310 HydrophobicContact CD1-CG2 3.88Å; L124-T310 HydrophobicContact CG-CG2 4.4Å; A128-T310 VanDerWaalsContact CA-OG1 3.31Å; A128-T310 WeakPolarHBondContact CA-OG1 3.31Å; A128-T310 WeakPolarHBondContact CB-OG1 3.05Å; R306-T310 PolarHBondContact O-N 2.93Å; R306-T310 PolarHBondContact O-OG1 3.13Å; R306-T310 VanDerWaalsContact O-OG1 3.09Å; L307-T310 WeakPolarHBondContact O-CB 3.45Å; L307-T310 PolarHBondContact O-N 3.39Å; F308-T310 VanDerWaalsContact C-N 3.33Å; F308-T310 PolarHBondContact O-N 2.92Å; T310-R312 PolarHBondContact O-N 3.33Å; T310-Y313 PolarHBondContact O-N 2.85Å; T310-W314 VanDerWaalsContact O-CB 3.31Å; T310-W314 WeakPolarHBondContact O-CB 3.46Å; T310-W314 PolarHBondContact O-N 3.26Å; T310-F377 HydrophobicContact CG2-CD2 3.95Å; T310-F377 HydrophobicContact CG2-CE2 4.11Å; T310-L467 HydrophobicContact CG2-CD1 4.45Å; T310-L467 HydrophobicContact CG2-CD2 4.44Å
311	V	92.7	Very high	86	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59	-46.8	177.6	167.6	0	0	0	0	111.1	L307 F308 Y313 W314 L315 L334 F377 F380	L307-V311 HydrophobicContact CD1-CG2 4.3Å; L307-V311 WeakPolarHBondContact O-CG2 3.31Å; L307-V311 PolarHBondContact O-N 3.03Å; F308-V311 PolarHBondContact O-N 3.44Å; V311-Y313 PolarHBondContact O-N 3.4Å; V311-W314 PolarHBondContact O-N 3.48Å; V311-L315 VanDerWaalsContact O-CB 3.3Å; V311-L315 WeakPolarHBondContact O-CB 3.43Å; V311-L315 PolarHBondContact O-N 2.69Å; V311-L334 HydrophobicContact CG1-CD1 4.06Å; V311-L334 HydrophobicContact CG1-CD2 3.97Å; V311-L334 HydrophobicContact CG1-CG 4.1Å; V311-F377 HydrophobicContact CG2-CD2 3.83Å; V311-F377 HydrophobicContact CG2-CE2 4.14Å; V311-F380 HydrophobicContact CB-CE1 4.46Å; V311-F380 HydrophobicContact CG1-CD1 4.02Å; V311-F380 HydrophobicContact CG1-CE1 3.44Å; V311-F380 VanDerWaalsContact CG1-CE1 3.44Å; V311-F380 HydrophobicContact CG1-CZ 4.23Å; V311-F380 HydrophobicContact CG2-CD1 3.82Å; V311-F380 HydrophobicContact CG2-CE1 4.12Å
312	R	90.8	Very high	84.2	Confident	32 Å²	32	22.7 Å²	22.7	12%	0.121	13%	0.126	C	C	.	.	H	α-helix	trans	-63.6	-41.4	178.8	-178.7	177.2	176.3	173.4	2.7	111.9	W176 F308 S309 T310 S316 S331	W176-R312 HydrophobicContact CH2-CG 4.25Å; W176-R312 HydrophobicContact CZ2-CB 4.11Å; W176-R312 HydrophobicContact CZ2-CG 3.88Å; F308-R312 WeakPolarHBondContact O-CB 3.43Å; F308-R312 PolarHBondContact O-N 3.31Å; S309-R312 PolarHBondContact O-N 3.27Å; T310-R312 PolarHBondContact O-N 3.33Å; R312-S316 WeakPolarHBondContact O-CB 3.44Å; R312-S316 PolarHBondContact O-N 2.88Å; R312-S316 PolarHBondContact O-OG 3.2Å; R312-S331 PolarHBondContact NE-OG 2.73Å
313	Y	86.7	Confident	82.3	Confident	25 Å²	25	21 Å²	21	10%	0.098	12%	0.115	C	C	.	.	H	α-helix	trans	-62.5	-54.1	176.7	179.6	-81	0	0	0	110.7	F110 F118 I131 W176 S309 T310 V311 L315 S316 F317 L467	F110-Y313 HydrophobicContact CE1-CD2 4.38Å; F110-Y313 HydrophobicContact CE1-CE1 4.18Å; F110-Y313 AromaticContact CE1-CE2 3.66Å; F110-Y313 HydrophobicContact CE1-CE2 3.66Å; F110-Y313 AromaticContact CE1-CZ 3.5Å; F110-Y313 WeakPolarHBondContact CE1-OH 3.48Å; F110-Y313 AromaticContact CE2-CD2 3.74Å; F110-Y313 HydrophobicContact CE2-CD2 3.74Å; F110-Y313 AromaticContact CE2-CE2 3.7Å; F110-Y313 HydrophobicContact CE2-CE2 3.7Å; F110-Y313 HydrophobicContact CE2-CG 4.45Å; F110-Y313 HydrophobicContact CZ-CD1 4.11Å; F110-Y313 AromaticContact CZ-CD2 3.32Å; F110-Y313 HydrophobicContact CZ-CD2 3.32Å; F110-Y313 AromaticContact CZ-CE1 3.82Å; F110-Y313 HydrophobicContact CZ-CE1 3.82Å; F110-Y313 AromaticContact CZ-CE2 2.98Å; F110-Y313 HydrophobicContact CZ-CE2 2.98Å; F110-Y313 AromaticContact CZ-CG 3.87Å; F110-Y313 HydrophobicContact CZ-CG 3.87Å; F110-Y313 AromaticContact CZ-CZ 3.23Å; F118-Y313 AromaticContact CE2-CE2 3.84Å; F118-Y313 HydrophobicContact CE2-CE2 3.84Å; F118-Y313 AromaticContact CE2-CZ 3.72Å; F118-Y313 VanDerWaalsContact CE2-OH 3.24Å; F118-Y313 WeakPolarHBondContact CE2-OH 3.3Å; F118-Y313 AromaticContact CZ-CE2 3.98Å; F118-Y313 HydrophobicContact CZ-CE2 3.98Å; I131-Y313 HydrophobicContact CD1-CD1 3.92Å; I131-Y313 HydrophobicContact CD1-CD2 4.4Å; I131-Y313 HydrophobicContact CD1-CE1 4.35Å; I131-Y313 HydrophobicContact CD1-CG 3.98Å; I131-Y313 HydrophobicContact CG1-CD2 4.17Å; I131-Y313 HydrophobicContact CG1-CE2 4.41Å; I131-Y313 HydrophobicContact CG1-CG 4.24Å; I131-Y313 HydrophobicContact CG2-CD2 3.85Å; I131-Y313 HydrophobicContact CG2-CG 3.93Å; W176-Y313 HydrophobicContact CH2-CD2 4.33Å; S309-Y313 WeakPolarHBondContact O-CB 3.46Å; S309-Y313 PolarHBondContact O-N 3.48Å; T310-Y313 PolarHBondContact O-N 2.85Å; V311-Y313 PolarHBondContact O-N 3.4Å; Y313-L315 PolarHBondContact O-N 3.15Å; Y313-S316 PolarHBondContact O-N 2.91Å; Y313-F317 WeakPolarHBondContact O-CB 3.47Å; Y313-F317 PolarHBondContact O-N 2.95Å; Y313-L467 HydrophobicContact CD1-CD1 4.22Å; Y313-L467 HydrophobicContact CE1-CD1 4.34Å
314	W	86.4	Confident	80.1	Confident	4 Å²	4	31.5 Å²	31.5	2%	0.015	16%	0.155	C	C	.	.	H	α-helix	trans	-54.3	-54.4	178.4	175.2	74	0	0	0	111.8	T310 V311 S316 F317 H318 F377 V381 I450 L451 A454 L467	T310-W314 VanDerWaalsContact O-CB 3.31Å; T310-W314 WeakPolarHBondContact O-CB 3.46Å; T310-W314 PolarHBondContact O-N 3.26Å; V311-W314 PolarHBondContact O-N 3.48Å; W314-S316 VanDerWaalsContact C-N 3.35Å; W314-S316 PolarHBondContact O-N 3.09Å; W314-F317 WeakPolarHBondContact O-CB 3.44Å; W314-F317 PolarHBondContact O-N 3.1Å; W314-F317 VanDerWaalsContact O-N 3.14Å; W314-H318 AromaticContact CD1-CD2 3.44Å; W314-H318 VanDerWaalsContact CD1-CD2 3.44Å; W314-H318 AromaticContact CD1-NE2 3.33Å; W314-H318 VanDerWaalsContact CD1-NE2 3.33Å; W314-H318 AromaticContact CE2-CD2 3.67Å; W314-H318 AromaticContact CG-CD2 3.97Å; W314-H318 AromaticContact NE1-CD2 3.26Å; W314-H318 PolarHBondContact NE1-CD2 3.4Å; W314-H318 VanDerWaalsContact NE1-CD2 3.26Å; W314-H318 AromaticContact NE1-NE2 3.14Å; W314-H318 PolarHBondContact NE1-NE2 3.2Å; W314-H318 VanDerWaalsContact NE1-NE2 3.14Å; W314-H318 PolarHBondContact O-CD2 3.05Å; W314-H318 PolarHBondContact O-N 3.14Å; W314-H318 VanDerWaalsContact O-N 3.11Å; W314-F377 HydrophobicContact CB-CE2 4.1Å; W314-F377 HydrophobicContact CB-CZ 4.16Å; W314-F377 AromaticContact CD1-CZ 3.96Å; W314-F377 HydrophobicContact CD2-CE2 4.24Å; W314-F377 AromaticContact CD2-CZ 3.79Å; W314-F377 HydrophobicContact CD2-CZ 3.79Å; W314-F377 HydrophobicContact CE3-CE2 4.43Å; W314-F377 HydrophobicContact CE3-CZ 4.28Å; W314-F377 HydrophobicContact CG-CE2 4.1Å; W314-F377 AromaticContact CG-CZ 3.71Å; W314-F377 HydrophobicContact CG-CZ 3.71Å; W314-V381 HydrophobicContact CH2-CG2 4.3Å; W314-I450 HydrophobicContact CH2-CG2 3.91Å; W314-I450 HydrophobicContact CZ2-CG2 3.68Å; W314-L451 HydrophobicContact CH2-CD2 3.97Å; W314-A454 HydrophobicContact CZ2-CB 3.85Å; W314-L467 HydrophobicContact CB-CD2 3.57Å; W314-L467 HydrophobicContact CG-CD2 3.95Å
315	L	86.1	Confident	77.9	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-40.7	-176.9	-165	76.8	0	0	0	111.8	V311 Y313 F317 H318 L319 F329 L334 L447	V311-L315 VanDerWaalsContact O-CB 3.3Å; V311-L315 WeakPolarHBondContact O-CB 3.43Å; V311-L315 PolarHBondContact O-N 2.69Å; Y313-L315 PolarHBondContact O-N 3.15Å; L315-F317 VanDerWaalsContact C-N 3.28Å; L315-F317 PolarHBondContact O-N 3.11Å; L315-H318 PolarHBondContact O-N 2.87Å; L315-L319 HydrophobicContact CD1-CD1 4.06Å; L315-L319 HydrophobicContact CD1-CG 4.32Å; L315-L319 HydrophobicContact CD2-CD1 3.95Å; L315-L319 HydrophobicContact CG-CD1 3.65Å; L315-L319 HydrophobicContact CG-CG 4.16Å; L315-L319 VanDerWaalsContact O-CB 3.31Å; L315-L319 WeakPolarHBondContact O-CB 3.18Å; L315-L319 WeakPolarHBondContact O-CG 3.45Å; L315-L319 PolarHBondContact O-N 3.27Å; L315-F329 HydrophobicContact CD2-CB 3.95Å; L315-F329 HydrophobicContact CD2-CD1 4.07Å; L315-F329 HydrophobicContact CD2-CD2 3.93Å; L315-F329 HydrophobicContact CD2-CE2 4.44Å; L315-F329 HydrophobicContact CD2-CG 3.71Å; L315-L334 HydrophobicContact CB-CD2 4.44Å; L315-L334 HydrophobicContact CD2-CD1 3.85Å; L315-L334 HydrophobicContact CD2-CD2 3.64Å; L315-L334 HydrophobicContact CD2-CG 4.34Å; L315-L447 HydrophobicContact CD1-CD1 3.38Å; L315-L447 HydrophobicContact CD1-CD2 4.4Å
316	S	80.1	Confident	75.9	Confident	37 Å²	37	49.3 Å²	49.3	26%	0.259	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-38.9	176.1	-65.1	0	0	0	0	111.4	R312 Y313 W314 N320	R312-S316 WeakPolarHBondContact O-CB 3.44Å; R312-S316 PolarHBondContact O-N 2.88Å; R312-S316 PolarHBondContact O-OG 3.2Å; Y313-S316 PolarHBondContact O-N 2.91Å; W314-S316 VanDerWaalsContact C-N 3.35Å; W314-S316 PolarHBondContact O-N 3.09Å; S316-N320 WeakPolarHBondContact O-CB 3.35Å; S316-N320 PolarHBondContact O-N 2.77Å; S316-N320 VanDerWaalsContact O-N 3.14Å; S316-N320 PolarHBondContact O-ND2 3.28Å
317	F	75.9	Confident	74	Confident	28 Å²	28	48.6 Å²	48.6	12%	0.123	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-52.9	177.9	-175.8	-89.6	0	0	0	111.2	F110 I112 Y313 W314 L315 A321 P469	F110-F317 HydrophobicContact CD1-CD2 4.1Å; F110-F317 AromaticContact CE1-CD2 3.71Å; F110-F317 HydrophobicContact CE1-CD2 3.71Å; I112-F317 HydrophobicContact CG1-CE2 4.38Å; Y313-F317 WeakPolarHBondContact O-CB 3.47Å; Y313-F317 PolarHBondContact O-N 2.95Å; W314-F317 WeakPolarHBondContact O-CB 3.44Å; W314-F317 PolarHBondContact O-N 3.1Å; W314-F317 VanDerWaalsContact O-N 3.14Å; L315-F317 VanDerWaalsContact C-N 3.28Å; L315-F317 PolarHBondContact O-N 3.11Å; F317-A321 WeakPolarHBondContact O-CB 3.37Å; F317-A321 PolarHBondContact O-N 3Å; F317-P469 HydrophobicContact CE1-CB 3.6Å; F317-P469 HydrophobicContact CE1-CG 3.89Å; F317-P469 HydrophobicContact CZ-CB 3.66Å; F317-P469 HydrophobicContact CZ-CG 3.57Å
318	H	75.2	Confident	72.6	Confident	8 Å²	8	54.3 Å²	54.3	4%	0.037	25%	0.249	C	C	.	.	H	α-helix	trans	-73.2	-36.8	-175.8	-65.7	-72.3	0	0	0	114	W314 L315 T322 I450	W314-H318 AromaticContact CD1-CD2 3.44Å; W314-H318 VanDerWaalsContact CD1-CD2 3.44Å; W314-H318 AromaticContact CD1-NE2 3.33Å; W314-H318 VanDerWaalsContact CD1-NE2 3.33Å; W314-H318 AromaticContact CE2-CD2 3.67Å; W314-H318 AromaticContact CG-CD2 3.97Å; W314-H318 AromaticContact NE1-CD2 3.26Å; W314-H318 PolarHBondContact NE1-CD2 3.4Å; W314-H318 VanDerWaalsContact NE1-CD2 3.26Å; W314-H318 AromaticContact NE1-NE2 3.14Å; W314-H318 PolarHBondContact NE1-NE2 3.2Å; W314-H318 VanDerWaalsContact NE1-NE2 3.14Å; W314-H318 PolarHBondContact O-CD2 3.05Å; W314-H318 PolarHBondContact O-N 3.14Å; W314-H318 VanDerWaalsContact O-N 3.11Å; L315-H318 PolarHBondContact O-N 2.87Å; H318-T322 VanDerWaalsContact O-CG2 3.31Å; H318-T322 WeakPolarHBondContact O-CG2 3.22Å; H318-T322 PolarHBondContact O-N 2.8Å; H318-T322 PolarHBondContact O-OG1 2.79Å; H318-I450 HydrophobicContact CB-CD1 3.65Å; H318-I450 HydrophobicContact CB-CG1 4.04Å; H318-I450 HydrophobicContact CB-CG2 3.87Å
319	L	74.1	Confident	71.7	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.031	25%	0.254	C	S	.	.	H	α-helix	trans	-73.9	-36.9	178.9	-70.4	-179.6	0	0	0	112.7	L315 A321 T322 T323 F329 V443 L447 I450	L315-L319 HydrophobicContact CD1-CD1 4.06Å; L315-L319 HydrophobicContact CD1-CG 4.32Å; L315-L319 HydrophobicContact CD2-CD1 3.95Å; L315-L319 HydrophobicContact CG-CD1 3.65Å; L315-L319 HydrophobicContact CG-CG 4.16Å; L315-L319 VanDerWaalsContact O-CB 3.31Å; L315-L319 WeakPolarHBondContact O-CB 3.18Å; L315-L319 WeakPolarHBondContact O-CG 3.45Å; L315-L319 PolarHBondContact O-N 3.27Å; L319-A321 VanDerWaalsContact C-N 3.3Å; L319-A321 PolarHBondContact O-N 3.13Å; L319-T322 PolarHBondContact O-N 3.38Å; L319-T322 PolarHBondContact O-OG1 3.31Å; L319-T323 PolarHBondContact O-N 3.33Å; L319-T323 PolarHBondContact O-OG1 3.15Å; L319-F329 HydrophobicContact CD1-CB 3.82Å; L319-F329 HydrophobicContact CD1-CD2 3.91Å; L319-F329 HydrophobicContact CD1-CG 4.29Å; L319-V443 HydrophobicContact CD1-CG1 4.18Å; L319-V443 HydrophobicContact CD2-CG1 4.2Å; L319-L447 HydrophobicContact CD2-CB 4.43Å; L319-I450 HydrophobicContact CD2-CD1 3.79Å; L319-I450 HydrophobicContact CG-CD1 4.42Å
320	N	65.6	Low	71.3	Confident	77 Å²	77	58 Å²	58	41%	0.412	27%	0.268	S	S	.	.	H	α-helix	trans	-70.4	-28.6	176.5	-70.7	-40	0	0	0	112.1	S316	S316-N320 WeakPolarHBondContact O-CB 3.35Å; S316-N320 PolarHBondContact O-N 2.77Å; S316-N320 VanDerWaalsContact O-N 3.14Å; S316-N320 PolarHBondContact O-ND2 3.28Å
321	A	57.4	Low	71.2	Confident	63 Å²	63	59.6 Å²	59.6	52%	0.521	28%	0.279	S	S	.	.	H	α-helix	trans	-72.3	-31.8	176.4	0	0	0	0	0	112.9	F317 L319	F317-A321 WeakPolarHBondContact O-CB 3.37Å; F317-A321 PolarHBondContact O-N 3Å; L319-A321 VanDerWaalsContact C-N 3.3Å; L319-A321 PolarHBondContact O-N 3.13Å
322	T	52	Low	71.3	Confident	40 Å²	40	61.9 Å²	61.9	25%	0.245	29%	0.288	C	S	.	.	H	α-helix	trans	-94.7	-25.4	-169.8	48.5	0	0	0	0	114	H318 L319 I450 L474	H318-T322 VanDerWaalsContact O-CG2 3.31Å; H318-T322 WeakPolarHBondContact O-CG2 3.22Å; H318-T322 PolarHBondContact O-N 2.8Å; H318-T322 PolarHBondContact O-OG1 2.79Å; L319-T322 PolarHBondContact O-N 3.38Å; L319-T322 PolarHBondContact O-OG1 3.31Å; T322-I450 HydrophobicContact CG2-CD1 4.47Å; T322-L474 HydrophobicContact CG2-CD1 3.81Å
323	T	50.1	Low	71.5	Confident	23 Å²	23	60.4 Å²	60.4	14%	0.141	28%	0.282	C	S	.	.			trans	-105.4	112.1	-171.1	57.2	0	0	0	0	112	L319 W325	L319-T323 PolarHBondContact O-N 3.33Å; L319-T323 PolarHBondContact O-OG1 3.15Å; T323-W325 WeakPolarHBondContact CB-O 3.45Å; T323-W325 PolarHBondContact O-N 2.78Å; T323-W325 PolarHBondContact OG1-O 3.12Å; T323-W325 VanDerWaalsContact OG1-O 3.04Å
324	R	48.3	Very low	71.9	Confident	228 Å²	228	59.4 Å²	59.4	86%	0.86	28%	0.279	S	S	*	.	S	Bend	trans	-55.8	-19.2	165.5	-86.9	-176.2	179.4	164.2	1.3	112.4
325	W	48.5	Very low	72.5	Confident	185 Å²	185	59.5 Å²	59.5	70%	0.701	28%	0.279	S	S	*	.	S	Bend	trans	-103.3	109.8	177.2	-52	98.6	0	0	0	106.9	T323 T327	T323-W325 WeakPolarHBondContact CB-O 3.45Å; T323-W325 PolarHBondContact O-N 2.78Å; T323-W325 PolarHBondContact OG1-O 3.12Å; T323-W325 VanDerWaalsContact OG1-O 3.04Å; W325-T327 PolarHBondContact O-N 3.05Å; W325-T327 PolarHBondContact O-OG1 3.34Å
326	R	54.5	Low	73	Confident	198 Å²	198	59.3 Å²	59.3	75%	0.747	28%	0.278	S	S	*	.			trans	-67.5	37	-179.3	-61.3	179.2	176.3	177.6	-4.5	113.3	K328	R326-K328 PolarHBondContact O-N 3.07Å; R326-K328 VanDerWaalsContact O-N 3.11Å
327	T	54	Low	73.9	Confident	56 Å²	56	57.6 Å²	57.6	34%	0.344	27%	0.266	S	S	.	.			trans	-66.9	106.4	172	23	0	0	0	0	107.8	W325 V440	W325-T327 PolarHBondContact O-N 3.05Å; W325-T327 PolarHBondContact O-OG1 3.34Å; T327-V440 HydrophobicContact CG2-CG2 4.45Å
328	K	65.8	Low	75	Confident	120 Å²	120	56.3 Å²	56.3	52%	0.522	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-77.9	136.7	179.4	-71.4	-172.6	159.6	-148.8	0	109.7	K107 R326 N330	K107-K328 VanDerWaalsContact NZ-CE 3.28Å; R326-K328 PolarHBondContact O-N 3.07Å; R326-K328 VanDerWaalsContact O-N 3.11Å; K328-N330 PolarHBondContact O-N 3.09Å
329	F	77.2	Confident	76.1	Confident	27 Å²	27	55.9 Å²	55.9	12%	0.118	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-64.7	126.2	163.9	-154.2	-73.1	0	0	0	108.3	L315 L319 S331 L334 I337 L423 I439 V443 L447	L315-F329 HydrophobicContact CD2-CB 3.95Å; L315-F329 HydrophobicContact CD2-CD1 4.07Å; L315-F329 HydrophobicContact CD2-CD2 3.93Å; L315-F329 HydrophobicContact CD2-CE2 4.44Å; L315-F329 HydrophobicContact CD2-CG 3.71Å; L319-F329 HydrophobicContact CD1-CB 3.82Å; L319-F329 HydrophobicContact CD1-CD2 3.91Å; L319-F329 HydrophobicContact CD1-CG 4.29Å; F329-S331 PolarHBondContact O-N 3.45Å; F329-L334 HydrophobicContact CD1-CB 3.86Å; F329-L334 HydrophobicContact CD1-CD1 4.5Å; F329-L334 HydrophobicContact CE1-CB 3.81Å; F329-L334 HydrophobicContact CE1-CD1 4.13Å; F329-I337 HydrophobicContact CE1-CD1 4.41Å; F329-I337 HydrophobicContact CZ-CD1 4.18Å; F329-L423 HydrophobicContact CE2-CD2 4.41Å; F329-L423 HydrophobicContact CZ-CD2 3.82Å; F329-I439 HydrophobicContact CD1-CD1 4Å; F329-I439 HydrophobicContact CD2-CD1 4.09Å; F329-I439 HydrophobicContact CE1-CD1 3.67Å; F329-I439 HydrophobicContact CE2-CD1 3.79Å; F329-I439 HydrophobicContact CG-CD1 4.21Å; F329-I439 HydrophobicContact CZ-CD1 3.57Å; F329-V443 HydrophobicContact CD2-CG1 4.32Å; F329-L447 HydrophobicContact CE2-CD2 3.95Å
330	N	84.4	Confident	77.2	Confident	58 Å²	58	55.6 Å²	55.6	31%	0.31	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-64.8	121.5	-179	178.3	-17.1	0	0	0	109.6	K328 Y332 C333 L334	K328-N330 PolarHBondContact O-N 3.09Å; N330-Y332 VanDerWaalsContact C-N 3.3Å; N330-Y332 PolarHBondContact O-N 2.76Å; N330-Y332 WeakPolarHBondContact OD1-CB 3.23Å; N330-Y332 PolarHBondContact OD1-N 2.9Å; N330-C333 HydrophobicContact CB-CB 3.89Å; N330-C333 WeakPolarHBondContact O-CB 3.25Å; N330-C333 PolarHBondContact O-N 2.66Å; N330-L334 PolarHBondContact O-N 3.14Å
331	S	90.2	Very high	78.8	Confident	32 Å²	32	52.2 Å²	52.2	22%	0.224	24%	0.238	C	C	.	.	H	α-helix	trans	-63.5	-32.8	-177.4	-59.7	0	0	0	0	113.2	F308 R312 F329 L334 L335	F308-S331 WeakPolarHBondContact CZ-O 3.08Å; R312-S331 PolarHBondContact NE-OG 2.73Å; F329-S331 PolarHBondContact O-N 3.45Å; S331-L334 PolarHBondContact O-N 3.43Å; S331-L335 WeakPolarHBondContact O-CB 3.04Å; S331-L335 PolarHBondContact O-N 3.13Å
332	Y	94.8	Very high	80.7	Confident	49 Å²	49	49.2 Å²	49.2	19%	0.192	21%	0.214	C	C	.	.	H	α-helix	trans	-66.5	-46.9	174.2	177.4	-120.1	0	0	0	111	L293 N330 L334 L335 L336 D427 P435	L293-Y332 HydrophobicContact CD1-CD2 4.09Å; L293-Y332 HydrophobicContact CD1-CE2 3.95Å; N330-Y332 VanDerWaalsContact C-N 3.3Å; N330-Y332 PolarHBondContact O-N 2.76Å; N330-Y332 WeakPolarHBondContact OD1-CB 3.23Å; N330-Y332 PolarHBondContact OD1-N 2.9Å; Y332-L334 VanDerWaalsContact C-N 3.32Å; Y332-L334 PolarHBondContact O-N 2.94Å; Y332-L335 WeakPolarHBondContact O-CB 3.22Å; Y332-L335 PolarHBondContact O-N 3.42Å; Y332-L335 VanDerWaalsContact O-N 3.13Å; Y332-L336 HydrophobicContact CD1-CD1 4.29Å; Y332-L336 HydrophobicContact CD2-CG 4.36Å; Y332-L336 HydrophobicContact CE1-CD1 3.69Å; Y332-L336 HydrophobicContact CE1-CG 4.27Å; Y332-L336 HydrophobicContact CE2-CD1 4.21Å; Y332-L336 HydrophobicContact CE2-CD2 3.8Å; Y332-L336 HydrophobicContact CE2-CG 3.95Å; Y332-L336 WeakPolarHBondContact O-CG 3.45Å; Y332-L336 PolarHBondContact O-N 3.05Å; Y332-D427 WeakPolarHBondContact CE1-OD2 3.45Å; Y332-D427 PolarHBondContact OH-OD2 2.95Å; Y332-D427 VanDerWaalsContact OH-OD2 3.08Å; Y332-P435 HydrophobicContact CD1-CB 4.12Å; Y332-P435 HydrophobicContact CD1-CG 4.05Å; Y332-P435 HydrophobicContact CE1-CB 4.36Å; Y332-P435 HydrophobicContact CE1-CG 3.78Å
333	C	95.2	Very high	82.9	Confident	0 Å²	0	48 Å²	48	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.4	-44.6	174.7	178.1	0	0	0	0	111.8	N330 L335 L336 I337 P435	N330-C333 HydrophobicContact CB-CB 3.89Å; N330-C333 WeakPolarHBondContact O-CB 3.25Å; N330-C333 PolarHBondContact O-N 2.66Å; C333-L335 VanDerWaalsContact C-N 3.34Å; C333-L335 PolarHBondContact O-N 3.14Å; C333-L336 PolarHBondContact O-N 2.96Å; C333-I337 WeakPolarHBondContact O-CG1 3.41Å; C333-I337 PolarHBondContact O-N 3.15Å; C333-I337 VanDerWaalsContact O-N 3.1Å; C333-P435 HydrophobicContact CB-CB 4Å
334	L	95.3	Very high	85.1	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-61.5	-41.5	176	-176.6	59.2	0	0	0	112.4	F308 V311 L315 F329 N330 S331 Y332 I337 L338 F380	F308-L334 HydrophobicContact CE2-CB 4.41Å; F308-L334 HydrophobicContact CE2-CD2 4.39Å; F308-L334 HydrophobicContact CE2-CG 4.22Å; V311-L334 HydrophobicContact CG1-CD1 4.06Å; V311-L334 HydrophobicContact CG1-CD2 3.97Å; V311-L334 HydrophobicContact CG1-CG 4.1Å; L315-L334 HydrophobicContact CB-CD2 4.44Å; L315-L334 HydrophobicContact CD2-CD1 3.85Å; L315-L334 HydrophobicContact CD2-CD2 3.64Å; L315-L334 HydrophobicContact CD2-CG 4.34Å; F329-L334 HydrophobicContact CD1-CB 3.86Å; F329-L334 HydrophobicContact CD1-CD1 4.5Å; F329-L334 HydrophobicContact CE1-CB 3.81Å; F329-L334 HydrophobicContact CE1-CD1 4.13Å; N330-L334 PolarHBondContact O-N 3.14Å; S331-L334 PolarHBondContact O-N 3.43Å; Y332-L334 VanDerWaalsContact C-N 3.32Å; Y332-L334 PolarHBondContact O-N 2.94Å; L334-I337 PolarHBondContact O-N 2.68Å; L334-L338 PolarHBondContact O-N 2.73Å; L334-F380 HydrophobicContact CD1-CE1 4.39Å; L334-F380 HydrophobicContact CD1-CZ 4.1Å
335	L	97.3	Very high	87.3	Confident	5 Å²	5	43.9 Å²	43.9	3%	0.026	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-41.9	177.9	-177.6	55.4	0	0	0	111.3	F174 L293 F308 S331 Y332 C333 I337 L338 V339	F174-L335 HydrophobicContact CB-CD2 4.24Å; F174-L335 HydrophobicContact CD1-CD1 4.25Å; F174-L335 HydrophobicContact CD1-CD2 4.43Å; F174-L335 HydrophobicContact CD2-CD2 3.73Å; F174-L335 HydrophobicContact CE1-CD1 4.15Å; F174-L335 HydrophobicContact CE2-CD2 4.14Å; F174-L335 HydrophobicContact CG-CD2 3.89Å; F174-L335 HydrophobicContact CZ-CD1 4.33Å; L293-L335 HydrophobicContact CD1-CD2 3.83Å; L293-L335 HydrophobicContact CD2-CD2 3.69Å; L293-L335 HydrophobicContact CD2-CG 4.19Å; L293-L335 HydrophobicContact CG-CD2 4.34Å; F308-L335 HydrophobicContact CB-CD1 4.28Å; F308-L335 HydrophobicContact CD1-CD1 4.28Å; F308-L335 HydrophobicContact CD2-CB 4.13Å; F308-L335 HydrophobicContact CD2-CD1 3.61Å; F308-L335 HydrophobicContact CD2-CG 4.42Å; F308-L335 HydrophobicContact CE2-CB 3.55Å; F308-L335 HydrophobicContact CE2-CD1 3.95Å; F308-L335 HydrophobicContact CE2-CG 4.27Å; F308-L335 HydrophobicContact CG-CD1 3.78Å; F308-L335 HydrophobicContact CZ-CB 3.77Å; F308-L335 HydrophobicContact CZ-CD1 4.4Å; F308-L335 HydrophobicContact CZ-CG 4.46Å; S331-L335 WeakPolarHBondContact O-CB 3.04Å; S331-L335 PolarHBondContact O-N 3.13Å; Y332-L335 WeakPolarHBondContact O-CB 3.22Å; Y332-L335 PolarHBondContact O-N 3.42Å; Y332-L335 VanDerWaalsContact O-N 3.13Å; C333-L335 VanDerWaalsContact C-N 3.34Å; C333-L335 PolarHBondContact O-N 3.14Å; L335-I337 VanDerWaalsContact C-N 3.35Å; L335-I337 PolarHBondContact O-N 3.41Å; L335-L338 PolarHBondContact O-N 3.05Å; L335-V339 HydrophobicContact CD1-CG2 4.23Å; L335-V339 HydrophobicContact CG-CG2 4.45Å; L335-V339 WeakPolarHBondContact O-CB 3.28Å; L335-V339 VanDerWaalsContact O-CG2 3.31Å; L335-V339 WeakPolarHBondContact O-CG2 3.33Å; L335-V339 PolarHBondContact O-N 2.71Å
336	L	98.2	Very high	89.4	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63	-39.8	176.6	-68.5	-172.9	0	0	0	112.6	W292 Y332 C333 V339 T340 P398 V425 P428 P435	W292-L336 HydrophobicContact CH2-CD2 4.15Å; W292-L336 HydrophobicContact CZ3-CD2 3.77Å; Y332-L336 HydrophobicContact CD1-CD1 4.29Å; Y332-L336 HydrophobicContact CD2-CG 4.36Å; Y332-L336 HydrophobicContact CE1-CD1 3.69Å; Y332-L336 HydrophobicContact CE1-CG 4.27Å; Y332-L336 HydrophobicContact CE2-CD1 4.21Å; Y332-L336 HydrophobicContact CE2-CD2 3.8Å; Y332-L336 HydrophobicContact CE2-CG 3.95Å; Y332-L336 WeakPolarHBondContact O-CG 3.45Å; Y332-L336 PolarHBondContact O-N 3.05Å; C333-L336 PolarHBondContact O-N 2.96Å; L336-V339 PolarHBondContact O-N 3.12Å; L336-T340 WeakPolarHBondContact O-CB 3.14Å; L336-T340 PolarHBondContact O-N 3.44Å; L336-T340 PolarHBondContact O-OG1 3.28Å; L336-P398 HydrophobicContact CB-CG 4.28Å; L336-P398 HydrophobicContact CD1-CG 4.46Å; L336-P398 HydrophobicContact CD2-CG 4.11Å; L336-V425 HydrophobicContact CB-CG1 3.68Å; L336-V425 HydrophobicContact CD1-CG1 3.76Å; L336-V425 HydrophobicContact CG-CG1 4.41Å; L336-P428 HydrophobicContact CD2-CG 4.26Å; L336-P435 HydrophobicContact CD1-CG 3.97Å
337	I	98	Very high	91.3	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-66	-42.3	175.7	-62.6	164.6	0	0	0	110.4	F329 C333 L334 L335 T340 Y341 F380 F383 L384 F396 L423 V425	F329-I337 HydrophobicContact CE1-CD1 4.41Å; F329-I337 HydrophobicContact CZ-CD1 4.18Å; C333-I337 WeakPolarHBondContact O-CG1 3.41Å; C333-I337 PolarHBondContact O-N 3.15Å; C333-I337 VanDerWaalsContact O-N 3.1Å; L334-I337 PolarHBondContact O-N 2.68Å; L335-I337 VanDerWaalsContact C-N 3.35Å; L335-I337 PolarHBondContact O-N 3.41Å; I337-T340 PolarHBondContact O-N 2.89Å; I337-Y341 PolarHBondContact O-N 3.16Å; I337-F380 HydrophobicContact CG2-CE2 4.13Å; I337-F380 HydrophobicContact CG2-CZ 4.41Å; I337-F383 HydrophobicContact CG2-CE1 4.16Å; I337-L384 HydrophobicContact CG2-CD2 3.69Å; I337-F396 HydrophobicContact CG1-CB 4.49Å; I337-F396 HydrophobicContact CG1-CD1 4.43Å; I337-F396 HydrophobicContact CG1-CD2 4.22Å; I337-F396 HydrophobicContact CG1-CG 4.13Å; I337-F396 HydrophobicContact CG2-CD1 3.98Å; I337-F396 HydrophobicContact CG2-CE1 3.89Å; I337-F396 HydrophobicContact CG2-CG 4.49Å; I337-F396 HydrophobicContact CG2-CZ 4.32Å; I337-L423 HydrophobicContact CD1-CD1 4.49Å; I337-L423 HydrophobicContact CD1-CD2 3.82Å; I337-V425 HydrophobicContact CD1-CG2 3.93Å; I337-V425 HydrophobicContact CG1-CG2 3.74Å
338	L	98.3	Very high	93.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.9	-44.1	174.5	178.7	65	0	0	0	111.9	L307 F308 L334 L335 T340 Y341 L342 F380	L307-L338 HydrophobicContact CD2-CD1 4.15Å; L307-L338 HydrophobicContact CD2-CD2 4.46Å; L307-L338 HydrophobicContact CG-CD1 4.47Å; L307-L338 HydrophobicContact CG-CD2 4.32Å; F308-L338 HydrophobicContact CB-CD2 3.92Å; F308-L338 HydrophobicContact CD2-CD2 3.87Å; F308-L338 HydrophobicContact CG-CD2 4.4Å; L334-L338 PolarHBondContact O-N 2.73Å; L335-L338 PolarHBondContact O-N 3.05Å; L338-T340 VanDerWaalsContact C-N 3.32Å; L338-T340 PolarHBondContact O-N 2.87Å; L338-Y341 HydrophobicContact CD1-CD1 4.09Å; L338-Y341 WeakPolarHBondContact O-CB 3.47Å; L338-Y341 PolarHBondContact O-N 3.22Å; L338-L342 HydrophobicContact CD1-CD1 4.36Å; L338-L342 HydrophobicContact CD1-CG 4.43Å; L338-L342 HydrophobicContact CG-CD1 4.09Å; L338-L342 VanDerWaalsContact O-CG 3.3Å; L338-L342 WeakPolarHBondContact O-CG 3.19Å; L338-L342 PolarHBondContact O-N 3.03Å; L338-F380 HydrophobicContact CB-CD2 4.47Å; L338-F380 HydrophobicContact CB-CE2 3.94Å; L338-F380 HydrophobicContact CB-CZ 4.2Å; L338-F380 HydrophobicContact CD1-CB 4.24Å; L338-F380 HydrophobicContact CD1-CD1 4.28Å; L338-F380 HydrophobicContact CD1-CD2 3.51Å; L338-F380 HydrophobicContact CD1-CE2 3.84Å; L338-F380 HydrophobicContact CD1-CG 3.74Å; L338-F380 HydrophobicContact CD1-CZ 4.34Å
339	V	98.4	Very high	94.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.7	-42.2	175.8	168.2	0	0	0	0	110.7	W292 L296 L335 L336 Y341 L342 Q343 I348 P398	W292-V339 HydrophobicContact CH2-CG1 3.92Å; W292-V339 HydrophobicContact CZ2-CG1 4.05Å; L296-V339 HydrophobicContact CD1-CG1 4.43Å; L296-V339 HydrophobicContact CD1-CG2 4.21Å; L335-V339 HydrophobicContact CD1-CG2 4.23Å; L335-V339 HydrophobicContact CG-CG2 4.45Å; L335-V339 WeakPolarHBondContact O-CB 3.28Å; L335-V339 VanDerWaalsContact O-CG2 3.31Å; L335-V339 WeakPolarHBondContact O-CG2 3.33Å; L335-V339 PolarHBondContact O-N 2.71Å; L336-V339 PolarHBondContact O-N 3.12Å; V339-Y341 VanDerWaalsContact C-N 3.34Å; V339-Y341 PolarHBondContact O-N 3.38Å; V339-L342 PolarHBondContact O-N 3.08Å; V339-L342 VanDerWaalsContact O-N 3.15Å; V339-Q343 HydrophobicContact CG1-CG 4.27Å; V339-Q343 VanDerWaalsContact O-CG 3.28Å; V339-Q343 WeakPolarHBondContact O-CG 3.48Å; V339-Q343 PolarHBondContact O-N 3.03Å; V339-Q343 PolarHBondContact O-OE1 2.95Å; V339-I348 HydrophobicContact CG1-CG2 4.43Å; V339-P398 HydrophobicContact CG1-CB 4.38Å
340	T	98.5	Very high	95.4	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.8	-44.7	176.2	-51.4	0	0	0	0	111.2	L336 I337 L338 L342 Q343 T344 F396 I402 V403	L336-T340 WeakPolarHBondContact O-CB 3.14Å; L336-T340 PolarHBondContact O-N 3.44Å; L336-T340 PolarHBondContact O-OG1 3.28Å; I337-T340 PolarHBondContact O-N 2.89Å; L338-T340 VanDerWaalsContact C-N 3.32Å; L338-T340 PolarHBondContact O-N 2.87Å; T340-L342 PolarHBondContact O-N 2.87Å; T340-Q343 PolarHBondContact O-N 3.3Å; T340-T344 WeakPolarHBondContact O-CG2 3.44Å; T340-T344 PolarHBondContact O-N 3.33Å; T340-T344 PolarHBondContact O-OG1 3.11Å; T340-F396 HydrophobicContact CG2-CB 4.36Å; T340-F396 HydrophobicContact CG2-CD1 4.28Å; T340-I402 WeakPolarHBondContact CG2-O 3.45Å; T340-V403 HydrophobicContact CG2-CG2 4.1Å
341	Y	98.3	Very high	96	Very high	5 Å²	5	25.4 Å²	25.4	2%	0.02	15%	0.149	C	C	.	.	H	α-helix	trans	-56.8	-49.7	172.5	161.6	-111.7	0	0	0	111.8	I337 L338 V339 Q343 T344 E345 L376 G379 F380 F383	I337-Y341 PolarHBondContact O-N 3.16Å; L338-Y341 HydrophobicContact CD1-CD1 4.09Å; L338-Y341 WeakPolarHBondContact O-CB 3.47Å; L338-Y341 PolarHBondContact O-N 3.22Å; V339-Y341 VanDerWaalsContact C-N 3.34Å; V339-Y341 PolarHBondContact O-N 3.38Å; Y341-Q343 PolarHBondContact O-N 3.13Å; Y341-T344 WeakPolarHBondContact CA-OG1 3.38Å; Y341-T344 PolarHBondContact O-N 2.97Å; Y341-T344 VanDerWaalsContact O-N 3.09Å; Y341-T344 PolarHBondContact O-OG1 3.32Å; Y341-E345 HydrophobicContact CD2-CG 4.02Å; Y341-E345 HydrophobicContact CE1-CG 4.38Å; Y341-E345 HydrophobicContact CE2-CG 3.42Å; Y341-E345 VanDerWaalsContact CE2-CG 3.42Å; Y341-E345 WeakPolarHBondContact CE2-OE1 3.46Å; Y341-E345 WeakPolarHBondContact O-CG 3.36Å; Y341-E345 PolarHBondContact O-N 3.27Å; Y341-L376 WeakPolarHBondContact CE1-O 3.4Å; Y341-G379 WeakPolarHBondContact OH-CA 3.47Å; Y341-F380 HydrophobicContact CD1-CB 3.9Å; Y341-F380 AromaticContact CD1-CD2 3.8Å; Y341-F380 HydrophobicContact CD1-CD2 3.8Å; Y341-F380 HydrophobicContact CD1-CG 4.32Å; Y341-F380 HydrophobicContact CE1-CB 3.9Å; Y341-F380 AromaticContact CG-CD2 3.94Å; Y341-F380 HydrophobicContact CG-CD2 3.94Å; Y341-F383 HydrophobicContact CD2-CB 3.64Å; Y341-F383 HydrophobicContact CD2-CD1 4.22Å; Y341-F383 AromaticContact CD2-CD2 3.89Å; Y341-F383 HydrophobicContact CD2-CD2 3.89Å; Y341-F383 AromaticContact CD2-CG 3.66Å; Y341-F383 HydrophobicContact CD2-CG 3.66Å; Y341-F383 HydrophobicContact CE2-CB 4.16Å; Y341-F383 HydrophobicContact CG-CB 4.33Å; Y341-F383 HydrophobicContact CG-CD1 4.26Å; Y341-F383 HydrophobicContact CG-CG 4.16Å
342	L	98	Very high	96.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-65.5	-29.5	-178.7	-65.1	170.2	0	0	0	112.6	W303 L304 L307 L338 V339 T340 E345 G346 L347 I348 L376	W303-L342 HydrophobicContact CH2-CD1 4.1Å; W303-L342 HydrophobicContact CH2-CD2 4.24Å; W303-L342 HydrophobicContact CZ3-CD1 4.02Å; W303-L342 HydrophobicContact CZ3-CD2 4.13Å; L304-L342 HydrophobicContact CD1-CD1 3.45Å; L304-L342 VanDerWaalsContact CD1-CD1 3.45Å; L307-L342 HydrophobicContact CD2-CD1 4.31Å; L307-L342 HydrophobicContact CD2-CD2 4.18Å; L338-L342 HydrophobicContact CD1-CD1 4.36Å; L338-L342 HydrophobicContact CD1-CG 4.43Å; L338-L342 HydrophobicContact CG-CD1 4.09Å; L338-L342 VanDerWaalsContact O-CG 3.3Å; L338-L342 WeakPolarHBondContact O-CG 3.19Å; L338-L342 PolarHBondContact O-N 3.03Å; V339-L342 PolarHBondContact O-N 3.08Å; V339-L342 VanDerWaalsContact O-N 3.15Å; T340-L342 PolarHBondContact O-N 2.87Å; L342-E345 PolarHBondContact O-N 3.1Å; L342-G346 PolarHBondContact O-N 3.45Å; L342-L347 HydrophobicContact CD2-CD1 3.94Å; L342-L347 WeakPolarHBondContact O-CB 3.44Å; L342-L347 PolarHBondContact O-N 3.25Å; L342-I348 HydrophobicContact CB-CB 4.4Å; L342-I348 HydrophobicContact CB-CD1 3.79Å; L342-I348 HydrophobicContact CB-CG1 3.97Å; L342-I348 HydrophobicContact CD1-CD1 3.62Å; L342-I348 HydrophobicContact CG-CD1 4.36Å; L342-I348 PolarHBondContact O-N 3.08Å; L342-L376 HydrophobicContact CD2-CD1 4.07Å; L342-L376 HydrophobicContact CD2-CD2 4.15Å
343	Q	97.3	Very high	96.1	Very high	15 Å²	15	29.6 Å²	29.6	7%	0.07	17%	0.173	C	C	.	.	H	α-helix	trans	-68.8	-41.6	171.4	-72.4	164.1	-30.2	0	0	111.6	V339 T340 Y341 E345 G346 I348 E349 P350 P398	V339-Q343 HydrophobicContact CG1-CG 4.27Å; V339-Q343 VanDerWaalsContact O-CG 3.28Å; V339-Q343 WeakPolarHBondContact O-CG 3.48Å; V339-Q343 PolarHBondContact O-N 3.03Å; V339-Q343 PolarHBondContact O-OE1 2.95Å; T340-Q343 PolarHBondContact O-N 3.3Å; Y341-Q343 PolarHBondContact O-N 3.13Å; Q343-E345 PolarHBondContact O-N 3.38Å; Q343-G346 PolarHBondContact O-N 2.9Å; Q343-I348 WeakPolarHBondContact CA-O 3.37Å; Q343-I348 HydrophobicContact CG-CB 4.09Å; Q343-I348 HydrophobicContact CG-CG2 4.15Å; Q343-I348 VanDerWaalsContact CG-O 3.25Å; Q343-I348 WeakPolarHBondContact CG-O 3.49Å; Q343-E349 PolarHBondContact NE2-O 3.44Å; Q343-P350 VanDerWaalsContact NE2-CA 3.34Å; Q343-P398 PolarHBondContact NE2-O 2.94Å; Q343-P398 VanDerWaalsContact OE1-CA 3.25Å; Q343-P398 PolarHBondContact OE1-O 3.16Å
344	T	96.1	Very high	96	Very high	67 Å²	67	31.5 Å²	31.5	41%	0.411	18%	0.18	S	C	.	.	H	α-helix	trans	-65.1	-24.5	174.7	56.1	0	0	0	0	113.1	T340 Y341 G346 G401	T340-T344 WeakPolarHBondContact O-CG2 3.44Å; T340-T344 PolarHBondContact O-N 3.33Å; T340-T344 PolarHBondContact O-OG1 3.11Å; Y341-T344 WeakPolarHBondContact CA-OG1 3.38Å; Y341-T344 PolarHBondContact O-N 2.97Å; Y341-T344 VanDerWaalsContact O-N 3.09Å; Y341-T344 PolarHBondContact O-OG1 3.32Å; T344-G346 VanDerWaalsContact C-N 3.3Å; T344-G401 WeakPolarHBondContact CG2-O 3.4Å
345	E	94.6	Very high	95.8	Very high	98 Å²	98	33.5 Å²	33.5	46%	0.458	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-0.5	172.1	-61.6	-70.5	138.9	0	0	113.1	Y341 L342 Q343 L347	Y341-E345 HydrophobicContact CD2-CG 4.02Å; Y341-E345 HydrophobicContact CE1-CG 4.38Å; Y341-E345 HydrophobicContact CE2-CG 3.42Å; Y341-E345 VanDerWaalsContact CE2-CG 3.42Å; Y341-E345 WeakPolarHBondContact CE2-OE1 3.46Å; Y341-E345 WeakPolarHBondContact O-CG 3.36Å; Y341-E345 PolarHBondContact O-N 3.27Å; L342-E345 PolarHBondContact O-N 3.1Å; Q343-E345 PolarHBondContact O-N 3.38Å; E345-L347 VanDerWaalsContact C-N 3.27Å; E345-L347 HydrophobicContact CB-CD1 3.99Å; E345-L347 HydrophobicContact CB-CG 4.05Å; E345-L347 PolarHBondContact O-N 2.93Å
346	G	93.3	Very high	95.1	Very high	68 Å²	68	39.6 Å²	39.6	70%	0.701	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.4	16.7	-178	0	0	0	0	0	114.9	L342 Q343 T344	L342-G346 PolarHBondContact O-N 3.45Å; Q343-G346 PolarHBondContact O-N 2.9Å; T344-G346 VanDerWaalsContact C-N 3.3Å
347	L	93.5	Very high	94.4	Very high	28 Å²	28	46.3 Å²	46.3	15%	0.147	26%	0.257	C	S	.	.	S	Bend	trans	-90.8	-20.9	-176.3	-64	172.1	0	0	0	113.6	H300 L342 E345 V366 L376	H300-L347 PolarHBondContact CE1-O 3.29Å; L342-L347 HydrophobicContact CD2-CD1 3.94Å; L342-L347 WeakPolarHBondContact O-CB 3.44Å; L342-L347 PolarHBondContact O-N 3.25Å; E345-L347 VanDerWaalsContact C-N 3.27Å; E345-L347 HydrophobicContact CB-CD1 3.99Å; E345-L347 HydrophobicContact CB-CG 4.05Å; E345-L347 PolarHBondContact O-N 2.93Å; L347-V366 HydrophobicContact CD2-CG1 4.17Å; L347-V366 HydrophobicContact CD2-CG2 4.19Å; L347-L376 HydrophobicContact CD1-CD1 4.21Å; L347-L376 HydrophobicContact CD1-CD2 3.4Å; L347-L376 HydrophobicContact CD1-CG 4.45Å
348	I	94.1	Very high	93.7	Very high	7 Å²	7	50.2 Å²	50.2	4%	0.036	27%	0.274	C	S	.	.	S	Bend	trans	-134.8	141	179	-61.7	-176.2	0	0	0	107.9	L296 L304 V339 L342 Q343	L296-I348 HydrophobicContact CD1-CG2 4.37Å; L296-I348 HydrophobicContact CD2-CG2 3.69Å; L304-I348 HydrophobicContact CD1-CD1 4.18Å; L304-I348 HydrophobicContact CD2-CD1 3.75Å; V339-I348 HydrophobicContact CG1-CG2 4.43Å; L342-I348 HydrophobicContact CB-CB 4.4Å; L342-I348 HydrophobicContact CB-CD1 3.79Å; L342-I348 HydrophobicContact CB-CG1 3.97Å; L342-I348 HydrophobicContact CD1-CD1 3.62Å; L342-I348 HydrophobicContact CG-CD1 4.36Å; L342-I348 PolarHBondContact O-N 3.08Å; Q343-I348 WeakPolarHBondContact CA-O 3.37Å; Q343-I348 HydrophobicContact CG-CB 4.09Å; Q343-I348 HydrophobicContact CG-CG2 4.15Å; Q343-I348 VanDerWaalsContact CG-O 3.25Å; Q343-I348 WeakPolarHBondContact CG-O 3.49Å
349	E	93.7	Very high	93	Very high	109 Å²	109	57.7 Å²	57.7	51%	0.509	31%	0.309	S	S	.	.			trans	-72.7	152.2	175.9	-65.5	179.5	174.9	0	0	112.1	Q343 E353 K358	Q343-E349 PolarHBondContact NE2-O 3.44Å; E349-E353 HydrophobicContact CB-CB 4.31Å; E349-K358 IonicContact OE2-NZ 3.34Å
350	P	97.1	Very high	92.2	Very high	41 Å²	41	60.2 Å²	60.2	27%	0.266	33%	0.325	S	S	.	.			trans	-51.9	144.7	167.9	-27.1	36.7	0	0	0	112.5	Q343 S352 E353 R399	Q343-P350 VanDerWaalsContact NE2-CA 3.34Å; P350-S352 PolarHBondContact O-N 3.39Å; P350-E353 HydrophobicContact CB-CG 4.41Å; P350-E353 WeakPolarHBondContact O-CB 3.3Å; P350-E353 PolarHBondContact O-N 2.81Å; P350-R399 VanDerWaalsContact CB-O 3.32Å; P350-R399 WeakPolarHBondContact CB-O 3.07Å
351	A	96.5	Very high	91.4	Very high	3 Å²	3	65.6 Å²	65.6	3%	0.025	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-67.1	-17.6	-180	0	0	0	0	0	113	W292 E353 Y354 P398 R399 P428 F429	W292-A351 HydrophobicContact CD2-CB 4.41Å; W292-A351 HydrophobicContact CH2-CB 4.09Å; W292-A351 HydrophobicContact CZ2-CB 3.47Å; W292-A351 VanDerWaalsContact CZ2-CB 3.47Å; A351-E353 PolarHBondContact O-N 2.93Å; A351-Y354 VanDerWaalsContact O-CB 3.31Å; A351-Y354 WeakPolarHBondContact O-CB 3.48Å; A351-Y354 PolarHBondContact O-N 2.98Å; A351-Y354 VanDerWaalsContact O-N 3.16Å; A351-P398 WeakPolarHBondContact CB-O 3.31Å; A351-P398 PolarHBondContact N-O 3.09Å; A351-R399 PolarHBondContact N-O 3.06Å; A351-P428 HydrophobicContact CB-CB 3.51Å; A351-P428 HydrophobicContact CB-CG 4.42Å; A351-F429 HydrophobicContact CB-CZ 4.45Å
352	S	94.6	Very high	90.5	Very high	61 Å²	61	72.7 Å²	72.7	43%	0.427	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-61.6	-25.4	170.1	55.4	0	0	0	0	113.3	P350 Y354 R399	P350-S352 PolarHBondContact O-N 3.39Å; S352-Y354 VanDerWaalsContact C-N 3.27Å; S352-R399 WeakPolarHBondContact CB-O 3.4Å; S352-R399 PolarHBondContact N-O 2.82Å; S352-R399 PolarHBondContact OG-O 3.19Å; S352-R399 VanDerWaalsContact OG-O 3.1Å
353	E	93	Very high	89.4	Confident	107 Å²	107	75.6 Å²	75.6	50%	0.5	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-82.6	-5.5	177.7	-59.3	-57.2	144.9	0	0	112.6	E349 P350 A351 S355 K358	E349-E353 HydrophobicContact CB-CB 4.31Å; P350-E353 HydrophobicContact CB-CG 4.41Å; P350-E353 WeakPolarHBondContact O-CB 3.3Å; P350-E353 PolarHBondContact O-N 2.81Å; A351-E353 PolarHBondContact O-N 2.93Å; E353-S355 PolarHBondContact O-N 3.47Å; E353-K358 WeakPolarHBondContact O-CE 3.26Å; E353-K358 PolarHBondContact O-NZ 3.27Å
354	Y	92.8	Very high	87.7	Confident	40 Å²	40	79 Å²	79	16%	0.157	43%	0.43	C	S	.	.			trans	-75.1	125.1	179.4	175.2	-110.6	0	0	0	111.4	W292 Y295 A351 S352 K356 F429	W292-Y354 HydrophobicContact CB-CD1 3.96Å; W292-Y354 HydrophobicContact CB-CD2 4.49Å; W292-Y354 HydrophobicContact CB-CE1 3.85Å; W292-Y354 HydrophobicContact CB-CE2 4.41Å; W292-Y354 HydrophobicContact CB-CG 4.27Å; W292-Y354 AromaticContact CD1-CD1 3.98Å; W292-Y354 AromaticContact CD1-CD2 3.65Å; W292-Y354 AromaticContact CD1-CG 3.47Å; W292-Y354 VanDerWaalsContact CD1-CG 3.47Å; W292-Y354 HydrophobicContact CG-CD1 4.25Å; W292-Y354 HydrophobicContact CG-CD2 4.47Å; W292-Y354 HydrophobicContact CG-CG 4.18Å; Y295-Y354 HydrophobicContact CD1-CD2 4.17Å; Y295-Y354 HydrophobicContact CD1-CE2 4.3Å; Y295-Y354 HydrophobicContact CD2-CE2 4.43Å; Y295-Y354 HydrophobicContact CG-CD2 4.33Å; Y295-Y354 AromaticContact CG-CE2 3.99Å; Y295-Y354 HydrophobicContact CG-CE2 3.99Å; A351-Y354 VanDerWaalsContact O-CB 3.31Å; A351-Y354 WeakPolarHBondContact O-CB 3.48Å; A351-Y354 PolarHBondContact O-N 2.98Å; A351-Y354 VanDerWaalsContact O-N 3.16Å; S352-Y354 VanDerWaalsContact C-N 3.27Å; Y354-K356 HydrophobicContact CE1-CG 4.06Å; Y354-F429 AromaticContact CD1-CE1 3.93Å; Y354-F429 HydrophobicContact CD1-CE1 3.93Å; Y354-F429 AromaticContact CD1-CZ 3.7Å; Y354-F429 HydrophobicContact CD1-CZ 3.7Å; Y354-F429 HydrophobicContact CE1-CZ 4.36Å; Y354-F429 HydrophobicContact CG-CZ 4.44Å
355	S	90.1	Very high	86.1	Confident	47 Å²	47	81.1 Å²	81.1	33%	0.329	44%	0.443	S	S	.	.			trans	-115.3	143.2	164.5	174.9	0	0	0	0	109.7	E353 D357 K358	E353-S355 PolarHBondContact O-N 3.47Å; S355-D357 PolarHBondContact O-N 3.36Å; S355-D357 PolarHBondContact OG-N 3.21Å; S355-K358 WeakPolarHBondContact O-CB 3.44Å; S355-K358 PolarHBondContact O-N 3.45Å
356	K	82.6	Confident	84.8	Confident	133 Å²	133	77.5 Å²	77.5	58%	0.578	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-22.2	176.2	-72.8	-178.8	178.4	175.2	0	112.8	T288 Y354	T288-K356 PolarHBondContact OG1-NZ 2.99Å; T288-K356 VanDerWaalsContact OG1-NZ 3.09Å; Y354-K356 HydrophobicContact CE1-CG 4.06Å
357	D	84	Confident	83.4	Confident	142 Å²	142	76.3 Å²	76.3	76%	0.759	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-6	-178.9	-49.9	-44.1	0	0	0	112.6	S355 E359	S355-D357 PolarHBondContact O-N 3.36Å; S355-D357 PolarHBondContact OG-N 3.21Å; D357-E359 PolarHBondContact O-N 3.47Å
358	K	83.2	Confident	82	Confident	84 Å²	84	80.8 Å²	80.8	37%	0.365	44%	0.44	S	S	.	.			trans	-71.7	113	175.4	-82.6	-178.9	173.4	-179.2	0	109.7	Y295 E349 E353 S355	Y295-K358 HydrophobicContact CE2-CB 4.12Å; E349-K358 IonicContact OE2-NZ 3.34Å; E353-K358 WeakPolarHBondContact O-CE 3.26Å; E353-K358 PolarHBondContact O-NZ 3.27Å; S355-K358 WeakPolarHBondContact O-CB 3.44Å; S355-K358 PolarHBondContact O-N 3.45Å
359	E	82.9	Confident	81.3	Confident	156 Å²	156	84.5 Å²	84.5	73%	0.729	46%	0.457	S	S	*	.			trans	-64.8	137.7	169	-76.4	-65.9	148.4	0	0	110.9	D357 V361	D357-E359 PolarHBondContact O-N 3.47Å; E359-V361 PolarHBondContact O-N 3.37Å
360	P	83.1	Confident	80.7	Confident	53 Å²	53	85.1 Å²	85.1	34%	0.344	47%	0.473	S	S	.	.			trans	-74.1	98.3	179.7	29	-32.2	0	0	0	111.1	Y295 L298 V299	Y295-P360 HydrophobicContact CD2-CB 3.95Å; Y295-P360 HydrophobicContact CE2-CB 4.21Å; L298-P360 HydrophobicContact CB-CB 3.9Å; L298-P360 HydrophobicContact CB-CG 4.43Å; L298-P360 HydrophobicContact CD1-CB 4.26Å; L298-P360 HydrophobicContact CD1-CG 3.96Å; V299-P360 HydrophobicContact CG2-CB 3.84Å
361	V	81.1	Confident	80.2	Confident	114 Å²	114	84.3 Å²	84.3	69%	0.691	47%	0.473	S	S	*	.			trans	-87.9	123.5	169.1	-176.4	0	0	0	0	109.1	V299 E359 N363	V299-V361 WeakPolarHBondContact CG1-O 3.45Å; E359-V361 PolarHBondContact O-N 3.37Å; V361-N363 PolarHBondContact O-N 2.84Å
362	K	78.8	Confident	79.9	Confident	154 Å²	154	84.4 Å²	84.4	67%	0.67	47%	0.473	S	S	*	.			trans	-62.1	128.2	179.4	-79.4	-176.8	178.6	175.8	0	111.1	S364	K362-S364 PolarHBondContact O-N 3.24Å
363	N	75.2	Confident	79.7	Confident	60 Å²	60	81.8 Å²	81.8	32%	0.321	45%	0.454	S	S	.	.			trans	-82.2	98.4	172.6	-168.1	-6.5	0	0	0	109.7	V299 V361 T365	V299-N363 HydrophobicContact CG1-CB 4.23Å; V299-N363 PolarHBondContact O-N 3.49Å; V361-N363 PolarHBondContact O-N 2.84Å; N363-T365 PolarHBondContact OD1-OG1 3.07Å
364	S	62.1	Low	79.5	Confident	88 Å²	88	78.7 Å²	78.7	62%	0.615	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-20.7	-172.5	43.9	0	0	0	0	114.4	K362	K362-S364 PolarHBondContact O-N 3.24Å
365	T	62.4	Low	79.4	Confident	110 Å²	110	81.3 Å²	81.3	68%	0.675	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-34.7	-172.2	48.1	0	0	0	0	113.4	N363	N363-T365 PolarHBondContact OD1-OG1 3.07Å
366	V	66.1	Low	79.6	Confident	22 Å²	22	79 Å²	79	13%	0.133	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-30.4	-177.6	-177.3	0	0	0	0	111.9	W303 L347 T368 E369 L372	W303-V366 HydrophobicContact CZ2-CG1 4.5Å; L347-V366 HydrophobicContact CD2-CG1 4.17Å; L347-V366 HydrophobicContact CD2-CG2 4.19Å; V366-T368 PolarHBondContact O-N 2.89Å; V366-T368 VanDerWaalsContact O-N 3.11Å; V366-E369 PolarHBondContact O-N 3.41Å; V366-L372 HydrophobicContact CG1-CD1 4.01Å; V366-L372 HydrophobicContact CG1-CD2 3.81Å; V366-L372 WeakPolarHBondContact O-CD2 3.47Å
367	A	63.7	Low	80	Confident	43 Å²	43	72.7 Å²	72.7	36%	0.355	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-11.4	-168.1	0	0	0	0	0	115.3
368	T	65.2	Low	80.3	Confident	123 Å²	123	68.4 Å²	68.4	76%	0.755	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-7.3	-175.3	53.6	0	0	0	0	114	V366 S370	V366-T368 PolarHBondContact O-N 2.89Å; V366-T368 VanDerWaalsContact O-N 3.11Å; T368-S370 PolarHBondContact O-N 2.96Å
369	E	78.4	Confident	80.8	Confident	84 Å²	84	65.3 Å²	65.3	39%	0.393	38%	0.377	S	S	.	.			trans	-69.9	116.3	179.9	-171.8	-171.2	160.6	0	0	110.7	V366 G371 L372 R375	V366-E369 PolarHBondContact O-N 3.41Å; E369-G371 PolarHBondContact O-N 3.34Å; E369-L372 HydrophobicContact CB-CB 4.24Å; E369-L372 VanDerWaalsContact O-CB 3.3Å; E369-L372 WeakPolarHBondContact O-CB 3.41Å; E369-L372 PolarHBondContact O-N 2.82Å; E369-R375 IonicContact OE1-CZ 3.94Å; E369-R375 IonicContact OE1-NE 3.06Å; E369-R375 PolarHBondContact OE1-NE 3.37Å; E369-R375 IonicContact OE1-NH2 3.42Å; E369-R375 PolarHBondContact OE1-NH2 3.09Å; E369-R375 IonicContact OE2-CZ 2.76Å; E369-R375 IonicContact OE2-NE 3.43Å; E369-R375 IonicContact OE2-NH2 2.66Å; E369-R375 PolarHBondContact OE2-NH2 3.47Å
370	S	80.9	Confident	81.4	Confident	122 Å²	122	57.9 Å²	57.9	85%	0.853	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	132.3	173	-175.1	0	0	0	0	110.2	T368 L372	T368-S370 PolarHBondContact O-N 2.96Å; S370-L372 VanDerWaalsContact C-N 3.31Å
371	G	86.8	Confident	81.9	Confident	25 Å²	25	55.3 Å²	55.3	26%	0.258	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	7.7	-178.4	0	0	0	0	0	114.5	D125 E369 I373 T374 R375	D125-G371 WeakPolarHBondContact OD2-CA 3.13Å; E369-G371 PolarHBondContact O-N 3.34Å; G371-I373 VanDerWaalsContact C-N 3.32Å; G371-I373 PolarHBondContact O-N 3.32Å; G371-T374 WeakPolarHBondContact O-CB 3.42Å; G371-T374 PolarHBondContact O-N 3.33Å; G371-R375 PolarHBondContact O-N 3.33Å
372	L	90	Very high	82.4	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-53.2	-47.2	178.9	177.8	68.5	0	0	0	112.2	W303 V366 E369 S370 T374 R375 L376	W303-L372 HydrophobicContact CB-CD2 3.85Å; W303-L372 HydrophobicContact CD2-CD2 3.94Å; W303-L372 HydrophobicContact CE3-CD2 4.38Å; W303-L372 HydrophobicContact CG-CD2 3.69Å; V366-L372 HydrophobicContact CG1-CD1 4.01Å; V366-L372 HydrophobicContact CG1-CD2 3.81Å; V366-L372 WeakPolarHBondContact O-CD2 3.47Å; E369-L372 HydrophobicContact CB-CB 4.24Å; E369-L372 VanDerWaalsContact O-CB 3.3Å; E369-L372 WeakPolarHBondContact O-CB 3.41Å; E369-L372 PolarHBondContact O-N 2.82Å; S370-L372 VanDerWaalsContact C-N 3.31Å; L372-T374 VanDerWaalsContact C-N 3.3Å; L372-T374 PolarHBondContact O-N 3.14Å; L372-R375 VanDerWaalsContact CD1-NH2 3.26Å; L372-R375 PolarHBondContact O-N 3.36Å; L372-L376 HydrophobicContact CD1-CD1 3.73Å; L372-L376 HydrophobicContact CD1-CD2 4.42Å; L372-L376 HydrophobicContact CD1-CG 3.89Å; L372-L376 HydrophobicContact CD2-CD1 4.41Å; L372-L376 HydrophobicContact CG-CD1 3.82Å; L372-L376 HydrophobicContact CG-CG 4.24Å; L372-L376 WeakPolarHBondContact O-CB 3.49Å; L372-L376 VanDerWaalsContact O-CG 3.28Å; L372-L376 WeakPolarHBondContact O-CG 3.37Å; L372-L376 PolarHBondContact O-N 3.08Å
373	I	90.8	Very high	83.2	Confident	7 Å²	7	47.8 Å²	47.8	4%	0.036	29%	0.288	C	S	.	.	H	α-helix	trans	-66.1	-40.1	-177	-63	176.2	0	0	0	109.9	D125 A128 R306 L307 G371 F377	D125-I373 WeakPolarHBondContact OD1-CB 3.48Å; D125-I373 PolarHBondContact OD1-N 3.31Å; A128-I373 HydrophobicContact CB-CD1 3.71Å; A128-I373 HydrophobicContact CB-CG2 3.76Å; R306-I373 HydrophobicContact CB-CD1 3.61Å; R306-I373 HydrophobicContact CG-CD1 4.5Å; L307-I373 HydrophobicContact CB-CG2 4.5Å; L307-I373 HydrophobicContact CD1-CG2 4.09Å; G371-I373 VanDerWaalsContact C-N 3.32Å; G371-I373 PolarHBondContact O-N 3.32Å; I373-F377 WeakPolarHBondContact O-CB 3.33Å; I373-F377 PolarHBondContact O-N 3.42Å
374	T	89.4	Confident	84.2	Confident	42 Å²	42	45.2 Å²	45.2	26%	0.258	27%	0.274	S	S	.	.	H	α-helix	trans	-56.1	-55.1	172.4	-58.3	0	0	0	0	110.8	L124 D125 G371 L372 L376 F377 L378	L124-T374 WeakPolarHBondContact CB-OG1 3.28Å; D125-T374 WeakPolarHBondContact OD2-CB 3.42Å; D125-T374 PolarHBondContact OD2-N 3.06Å; D125-T374 PolarHBondContact OD2-OG1 3.37Å; G371-T374 WeakPolarHBondContact O-CB 3.42Å; G371-T374 PolarHBondContact O-N 3.33Å; L372-T374 VanDerWaalsContact C-N 3.3Å; L372-T374 PolarHBondContact O-N 3.14Å; T374-L376 PolarHBondContact O-N 3.35Å; T374-F377 PolarHBondContact O-N 3.09Å; T374-L378 HydrophobicContact CG2-CD1 4.11Å; T374-L378 HydrophobicContact CG2-CG 4.42Å; T374-L378 VanDerWaalsContact O-CG 3.27Å; T374-L378 WeakPolarHBondContact O-CG 3.47Å; T374-L378 PolarHBondContact O-N 3.35Å
375	R	90.3	Very high	85.6	Confident	94 Å²	94	44.5 Å²	44.5	36%	0.355	26%	0.258	S	S	.	.	H	α-helix	trans	-55.9	-49.8	-179.3	-177.6	172	65.4	77	-5.3	112	E369 G371 L372 L378 G379	E369-R375 IonicContact OE1-CZ 3.94Å; E369-R375 IonicContact OE1-NE 3.06Å; E369-R375 PolarHBondContact OE1-NE 3.37Å; E369-R375 IonicContact OE1-NH2 3.42Å; E369-R375 PolarHBondContact OE1-NH2 3.09Å; E369-R375 IonicContact OE2-CZ 2.76Å; E369-R375 IonicContact OE2-NE 3.43Å; E369-R375 IonicContact OE2-NH2 2.66Å; E369-R375 PolarHBondContact OE2-NH2 3.47Å; G371-R375 PolarHBondContact O-N 3.33Å; L372-R375 VanDerWaalsContact CD1-NH2 3.26Å; L372-R375 PolarHBondContact O-N 3.36Å; R375-L378 PolarHBondContact O-N 3.1Å; R375-G379 PolarHBondContact O-N 2.81Å
376	L	93.7	Very high	87.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-69.1	-34.6	-178.6	-63.5	-178.8	0	0	0	112.8	W303 L307 Y341 L342 L347 L372 T374 F380	W303-L376 HydrophobicContact CE3-CD1 3.69Å; W303-L376 HydrophobicContact CH2-CD1 4.22Å; W303-L376 HydrophobicContact CZ3-CD1 3.46Å; W303-L376 VanDerWaalsContact CZ3-CD1 3.46Å; L307-L376 HydrophobicContact CD1-CB 4.11Å; L307-L376 HydrophobicContact CD2-CB 3.71Å; L307-L376 HydrophobicContact CD2-CD1 3.89Å; L307-L376 HydrophobicContact CD2-CG 4.47Å; Y341-L376 WeakPolarHBondContact CE1-O 3.4Å; L342-L376 HydrophobicContact CD2-CD1 4.07Å; L342-L376 HydrophobicContact CD2-CD2 4.15Å; L347-L376 HydrophobicContact CD1-CD1 4.21Å; L347-L376 HydrophobicContact CD1-CD2 3.4Å; L347-L376 HydrophobicContact CD1-CG 4.45Å; L372-L376 HydrophobicContact CD1-CD1 3.73Å; L372-L376 HydrophobicContact CD1-CD2 4.42Å; L372-L376 HydrophobicContact CD1-CG 3.89Å; L372-L376 HydrophobicContact CD2-CD1 4.41Å; L372-L376 HydrophobicContact CG-CD1 3.82Å; L372-L376 HydrophobicContact CG-CG 4.24Å; L372-L376 WeakPolarHBondContact O-CB 3.49Å; L372-L376 VanDerWaalsContact O-CG 3.28Å; L372-L376 WeakPolarHBondContact O-CG 3.37Å; L372-L376 PolarHBondContact O-N 3.08Å; T374-L376 PolarHBondContact O-N 3.35Å; L376-F380 VanDerWaalsContact O-CB 3.22Å; L376-F380 WeakPolarHBondContact O-CB 3.29Å; L376-F380 PolarHBondContact O-N 2.86Å
377	F	92.5	Very high	88.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.5	-45.7	174.5	179.7	-89.3	0	0	0	111.1	L124 L307 T310 V311 W314 I373 T374 F380 V381 P466	L124-F377 HydrophobicContact CD2-CB 3.71Å; L124-F377 HydrophobicContact CD2-CD1 3.77Å; L124-F377 HydrophobicContact CD2-CD2 4.5Å; L124-F377 HydrophobicContact CD2-CG 3.74Å; L307-F377 HydrophobicContact CD1-CB 4.05Å; T310-F377 HydrophobicContact CG2-CD2 3.95Å; T310-F377 HydrophobicContact CG2-CE2 4.11Å; V311-F377 HydrophobicContact CG2-CD2 3.83Å; V311-F377 HydrophobicContact CG2-CE2 4.14Å; W314-F377 HydrophobicContact CB-CE2 4.1Å; W314-F377 HydrophobicContact CB-CZ 4.16Å; W314-F377 AromaticContact CD1-CZ 3.96Å; W314-F377 HydrophobicContact CD2-CE2 4.24Å; W314-F377 AromaticContact CD2-CZ 3.79Å; W314-F377 HydrophobicContact CD2-CZ 3.79Å; W314-F377 HydrophobicContact CE3-CE2 4.43Å; W314-F377 HydrophobicContact CE3-CZ 4.28Å; W314-F377 HydrophobicContact CG-CE2 4.1Å; W314-F377 AromaticContact CG-CZ 3.71Å; W314-F377 HydrophobicContact CG-CZ 3.71Å; I373-F377 WeakPolarHBondContact O-CB 3.33Å; I373-F377 PolarHBondContact O-N 3.42Å; T374-F377 PolarHBondContact O-N 3.09Å; F377-F380 PolarHBondContact O-N 3.47Å; F377-V381 HydrophobicContact CD1-CG2 4.26Å; F377-V381 HydrophobicContact CE1-CG2 3.81Å; F377-V381 HydrophobicContact CZ-CG2 4.07Å; F377-V381 WeakPolarHBondContact O-CG2 3.36Å; F377-V381 PolarHBondContact O-N 3.02Å; F377-P466 HydrophobicContact CD1-CB 4.23Å; F377-P466 HydrophobicContact CD1-CG 4.49Å; F377-P466 HydrophobicContact CE1-CB 3.65Å; F377-P466 HydrophobicContact CE1-CG 4.38Å; F377-P466 HydrophobicContact CZ-CB 4.35Å
378	L	90.3	Very high	89.7	Confident	51 Å²	51	38.8 Å²	38.8	27%	0.267	23%	0.228	S	C	.	.	H	α-helix	trans	-61.2	-46.9	176.1	-66.5	-179.9	0	0	0	111.4	T374 R375 F380 V381 N382 L458	T374-L378 HydrophobicContact CG2-CD1 4.11Å; T374-L378 HydrophobicContact CG2-CG 4.42Å; T374-L378 VanDerWaalsContact O-CG 3.27Å; T374-L378 WeakPolarHBondContact O-CG 3.47Å; T374-L378 PolarHBondContact O-N 3.35Å; R375-L378 PolarHBondContact O-N 3.1Å; L378-F380 VanDerWaalsContact C-N 3.31Å; L378-F380 PolarHBondContact O-N 2.57Å; L378-V381 PolarHBondContact O-N 3.45Å; L378-N382 PolarHBondContact O-N 3.41Å; L378-N382 PolarHBondContact O-ND2 3.17Å; L378-L458 HydrophobicContact CD2-CB 3.74Å; L378-L458 HydrophobicContact CD2-CD1 3.57Å; L378-L458 HydrophobicContact CD2-CD2 3.3Å; L378-L458 HydrophobicContact CD2-CG 3.68Å
379	G	93.5	Very high	90.7	Very high	19 Å²	19	36.6 Å²	36.6	20%	0.196	22%	0.222	C	C	.	.	H	α-helix	trans	-58.4	-43.3	175	0	0	0	0	0	111.8	Y341 R375 V381 N382 F383	Y341-G379 WeakPolarHBondContact OH-CA 3.47Å; R375-G379 PolarHBondContact O-N 2.81Å; G379-V381 PolarHBondContact O-N 3.32Å; G379-N382 PolarHBondContact O-N 3.38Å; G379-F383 VanDerWaalsContact O-CB 3.28Å; G379-F383 WeakPolarHBondContact O-CB 3.41Å; G379-F383 PolarHBondContact O-N 2.91Å
380	F	95.4	Very high	91.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.6	-40.9	176.5	-177.7	-111.8	0	0	0	113.1	V311 L334 I337 L338 Y341 L376 F377 L378 F383 L384	V311-F380 HydrophobicContact CB-CE1 4.46Å; V311-F380 HydrophobicContact CG1-CD1 4.02Å; V311-F380 HydrophobicContact CG1-CE1 3.44Å; V311-F380 VanDerWaalsContact CG1-CE1 3.44Å; V311-F380 HydrophobicContact CG1-CZ 4.23Å; V311-F380 HydrophobicContact CG2-CD1 3.82Å; V311-F380 HydrophobicContact CG2-CE1 4.12Å; L334-F380 HydrophobicContact CD1-CE1 4.39Å; L334-F380 HydrophobicContact CD1-CZ 4.1Å; I337-F380 HydrophobicContact CG2-CE2 4.13Å; I337-F380 HydrophobicContact CG2-CZ 4.41Å; L338-F380 HydrophobicContact CB-CD2 4.47Å; L338-F380 HydrophobicContact CB-CE2 3.94Å; L338-F380 HydrophobicContact CB-CZ 4.2Å; L338-F380 HydrophobicContact CD1-CB 4.24Å; L338-F380 HydrophobicContact CD1-CD1 4.28Å; L338-F380 HydrophobicContact CD1-CD2 3.51Å; L338-F380 HydrophobicContact CD1-CE2 3.84Å; L338-F380 HydrophobicContact CD1-CG 3.74Å; L338-F380 HydrophobicContact CD1-CZ 4.34Å; Y341-F380 HydrophobicContact CD1-CB 3.9Å; Y341-F380 AromaticContact CD1-CD2 3.8Å; Y341-F380 HydrophobicContact CD1-CD2 3.8Å; Y341-F380 HydrophobicContact CD1-CG 4.32Å; Y341-F380 HydrophobicContact CE1-CB 3.9Å; Y341-F380 AromaticContact CG-CD2 3.94Å; Y341-F380 HydrophobicContact CG-CD2 3.94Å; L376-F380 VanDerWaalsContact O-CB 3.22Å; L376-F380 WeakPolarHBondContact O-CB 3.29Å; L376-F380 PolarHBondContact O-N 2.86Å; F377-F380 PolarHBondContact O-N 3.47Å; L378-F380 VanDerWaalsContact C-N 3.31Å; L378-F380 PolarHBondContact O-N 2.57Å; F380-F383 HydrophobicContact CD2-CD1 4.4Å; F380-F383 PolarHBondContact O-N 3.04Å; F380-L384 HydrophobicContact CD1-CD1 4.06Å; F380-L384 HydrophobicContact CD1-CG 4.48Å; F380-L384 HydrophobicContact CD2-CG 4.48Å; F380-L384 HydrophobicContact CE1-CD1 3.37Å; F380-L384 HydrophobicContact CE1-CG 4Å; F380-L384 HydrophobicContact CE2-CD1 4.25Å; F380-L384 HydrophobicContact CE2-CD2 4.3Å; F380-L384 HydrophobicContact CE2-CG 4.01Å; F380-L384 HydrophobicContact CZ-CD1 3.51Å; F380-L384 HydrophobicContact CZ-CD2 4.11Å; F380-L384 HydrophobicContact CZ-CG 3.77Å; F380-L384 WeakPolarHBondContact O-CB 3.47Å; F380-L384 WeakPolarHBondContact O-CG 3.43Å; F380-L384 PolarHBondContact O-N 3.06Å
381	V	92.5	Very high	91.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.8	-44.8	174.9	171	0	0	0	0	110.6	W314 F377 L378 G379 L384 Y385 L451 A454 L458	W314-V381 HydrophobicContact CH2-CG2 4.3Å; F377-V381 HydrophobicContact CD1-CG2 4.26Å; F377-V381 HydrophobicContact CE1-CG2 3.81Å; F377-V381 HydrophobicContact CZ-CG2 4.07Å; F377-V381 WeakPolarHBondContact O-CG2 3.36Å; F377-V381 PolarHBondContact O-N 3.02Å; L378-V381 PolarHBondContact O-N 3.45Å; G379-V381 PolarHBondContact O-N 3.32Å; V381-L384 PolarHBondContact O-N 3.02Å; V381-Y385 WeakPolarHBondContact O-CB 3.15Å; V381-Y385 PolarHBondContact O-N 2.88Å; V381-L451 HydrophobicContact CG1-CD2 4.23Å; V381-A454 HydrophobicContact CG1-CB 4.03Å; V381-L458 HydrophobicContact CB-CD1 4.22Å; V381-L458 HydrophobicContact CG1-CD1 3.96Å; V381-L458 HydrophobicContact CG2-CD1 4.23Å
382	N	92.6	Very high	91.9	Very high	76 Å²	76	29.5 Å²	29.5	41%	0.406	17%	0.168	S	C	.	.	H	α-helix	trans	-64.1	-41.2	176.7	-74.9	-36	0	0	0	112.1	L378 G379 Y385 G386	L378-N382 PolarHBondContact O-N 3.41Å; L378-N382 PolarHBondContact O-ND2 3.17Å; G379-N382 PolarHBondContact O-N 3.38Å; N382-Y385 PolarHBondContact O-N 3.18Å; N382-G386 PolarHBondContact O-N 2.91Å
383	F	95.8	Very high	92	Very high	34 Å²	34	29.4 Å²	29.4	15%	0.149	17%	0.167	C	C	.	.	H	α-helix	trans	-61.1	-47.8	175.1	172.7	-96.2	0	0	0	111.6	I337 Y341 G379 F380 Y385 G386 T387 F396 V403	I337-F383 HydrophobicContact CG2-CE1 4.16Å; Y341-F383 HydrophobicContact CD2-CB 3.64Å; Y341-F383 HydrophobicContact CD2-CD1 4.22Å; Y341-F383 AromaticContact CD2-CD2 3.89Å; Y341-F383 HydrophobicContact CD2-CD2 3.89Å; Y341-F383 AromaticContact CD2-CG 3.66Å; Y341-F383 HydrophobicContact CD2-CG 3.66Å; Y341-F383 HydrophobicContact CE2-CB 4.16Å; Y341-F383 HydrophobicContact CG-CB 4.33Å; Y341-F383 HydrophobicContact CG-CD1 4.26Å; Y341-F383 HydrophobicContact CG-CG 4.16Å; G379-F383 VanDerWaalsContact O-CB 3.28Å; G379-F383 WeakPolarHBondContact O-CB 3.41Å; G379-F383 PolarHBondContact O-N 2.91Å; F380-F383 HydrophobicContact CD2-CD1 4.4Å; F380-F383 PolarHBondContact O-N 3.04Å; F383-Y385 PolarHBondContact O-N 3.06Å; F383-G386 PolarHBondContact O-N 3.43Å; F383-T387 HydrophobicContact CD2-CG2 4.46Å; F383-T387 HydrophobicContact CE1-CG2 4.44Å; F383-T387 HydrophobicContact CE2-CG2 4.19Å; F383-T387 HydrophobicContact CZ-CG2 4.19Å; F383-T387 WeakPolarHBondContact O-CB 3.39Å; F383-T387 WeakPolarHBondContact O-CG2 3.22Å; F383-T387 PolarHBondContact O-N 3.38Å; F383-T387 PolarHBondContact O-OG1 2.74Å; F383-F396 HydrophobicContact CE1-CD1 4.16Å; F383-F396 AromaticContact CE1-CE1 3.61Å; F383-F396 HydrophobicContact CE1-CE1 3.61Å; F383-F396 HydrophobicContact CZ-CD1 4.07Å; F383-F396 AromaticContact CZ-CE1 3.71Å; F383-F396 HydrophobicContact CZ-CE1 3.71Å; F383-V403 HydrophobicContact CE2-CG2 3.98Å; F383-V403 HydrophobicContact CZ-CG2 3.64Å
384	L	95.2	Very high	92.1	Very high	6 Å²	6	29 Å²	29	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-62.4	-42.3	175.3	-78.5	-176.2	0	0	0	112	I337 F380 V381 T387 S388 W391 L451	I337-L384 HydrophobicContact CG2-CD2 3.69Å; F380-L384 HydrophobicContact CD1-CD1 4.06Å; F380-L384 HydrophobicContact CD1-CG 4.48Å; F380-L384 HydrophobicContact CD2-CG 4.48Å; F380-L384 HydrophobicContact CE1-CD1 3.37Å; F380-L384 HydrophobicContact CE1-CG 4Å; F380-L384 HydrophobicContact CE2-CD1 4.25Å; F380-L384 HydrophobicContact CE2-CD2 4.3Å; F380-L384 HydrophobicContact CE2-CG 4.01Å; F380-L384 HydrophobicContact CZ-CD1 3.51Å; F380-L384 HydrophobicContact CZ-CD2 4.11Å; F380-L384 HydrophobicContact CZ-CG 3.77Å; F380-L384 WeakPolarHBondContact O-CB 3.47Å; F380-L384 WeakPolarHBondContact O-CG 3.43Å; F380-L384 PolarHBondContact O-N 3.06Å; V381-L384 PolarHBondContact O-N 3.02Å; L384-T387 WeakPolarHBondContact CA-OG1 3.22Å; L384-T387 PolarHBondContact O-N 3.14Å; L384-T387 PolarHBondContact O-OG1 2.85Å; L384-T387 VanDerWaalsContact O-OG1 3.12Å; L384-S388 WeakPolarHBondContact O-CB 3.3Å; L384-S388 PolarHBondContact O-N 3.08Å; L384-W391 HydrophobicContact CD2-CZ2 4.48Å; L384-W391 WeakPolarHBondContact O-CZ2 3.26Å; L384-L451 HydrophobicContact CB-CD1 3.82Å; L384-L451 HydrophobicContact CB-CD2 3.6Å; L384-L451 HydrophobicContact CB-CG 4.38Å; L384-L451 HydrophobicContact CD1-CD2 4.05Å
385	Y	93.2	Very high	92.4	Very high	72 Å²	72	27 Å²	27	28%	0.282	15%	0.153	S	C	.	.	H	α-helix	trans	-62.7	-48.5	176.8	-178.1	-94.8	0	0	0	111.2	V381 N382 F383 T387 S388 L451 M452	V381-Y385 WeakPolarHBondContact O-CB 3.15Å; V381-Y385 PolarHBondContact O-N 2.88Å; N382-Y385 PolarHBondContact O-N 3.18Å; F383-Y385 PolarHBondContact O-N 3.06Å; Y385-T387 VanDerWaalsContact C-N 3.27Å; Y385-T387 PolarHBondContact O-N 3.38Å; Y385-S388 WeakPolarHBondContact O-CB 3.26Å; Y385-S388 PolarHBondContact O-N 2.55Å; Y385-S388 VanDerWaalsContact O-N 3.12Å; Y385-S388 PolarHBondContact O-OG 2.91Å; Y385-L451 HydrophobicContact CD2-CB 3.99Å; Y385-M452 HydrophobicContact CD2-CB 4.41Å; Y385-M452 HydrophobicContact CE2-CB 3.81Å; Y385-M452 HydrophobicContact CE2-CG 4.04Å
386	G	92.4	Very high	92.7	Very high	41 Å²	41	22.6 Å²	22.6	42%	0.423	14%	0.136	S	C	.	.	H	α-helix	trans	-63	-30.6	179.1	0	0	0	0	0	113.5	N382 F383 Y390	N382-G386 PolarHBondContact O-N 2.91Å; F383-G386 PolarHBondContact O-N 3.43Å; G386-Y390 WeakPolarHBondContact O-CE1 3.07Å; G386-Y390 PolarHBondContact O-OH 2.74Å
387	T	93.5	Very high	92.9	Very high	3 Å²	3	22.6 Å²	22.6	2%	0.018	14%	0.136	C	C	.	.	H	α-helix	trans	-85.1	-16.8	175.2	55.9	0	0	0	0	114.1	F383 L384 Y385 A389 Y390 W391 F396	F383-T387 HydrophobicContact CD2-CG2 4.46Å; F383-T387 HydrophobicContact CE1-CG2 4.44Å; F383-T387 HydrophobicContact CE2-CG2 4.19Å; F383-T387 HydrophobicContact CZ-CG2 4.19Å; F383-T387 WeakPolarHBondContact O-CB 3.39Å; F383-T387 WeakPolarHBondContact O-CG2 3.22Å; F383-T387 PolarHBondContact O-N 3.38Å; F383-T387 PolarHBondContact O-OG1 2.74Å; L384-T387 WeakPolarHBondContact CA-OG1 3.22Å; L384-T387 PolarHBondContact O-N 3.14Å; L384-T387 PolarHBondContact O-OG1 2.85Å; L384-T387 VanDerWaalsContact O-OG1 3.12Å; Y385-T387 VanDerWaalsContact C-N 3.27Å; Y385-T387 PolarHBondContact O-N 3.38Å; T387-A389 PolarHBondContact O-N 3.17Å; T387-A389 VanDerWaalsContact O-N 3.13Å; T387-Y390 VanDerWaalsContact CA-CZ 3.45Å; T387-Y390 WeakPolarHBondContact CA-OH 3.39Å; T387-Y390 HydrophobicContact CG2-CE2 3.95Å; T387-Y390 WeakPolarHBondContact CG2-OH 2.94Å; T387-Y390 PolarHBondContact O-N 3.19Å; T387-W391 PolarHBondContact O-N 3.15Å; T387-W391 PolarHBondContact O-NE1 3.37Å; T387-W391 PolarHBondContact OG1-NE1 3.32Å; T387-W391 VanDerWaalsContact OG1-NE1 3.07Å; T387-F396 HydrophobicContact CG2-CE1 4.13Å; T387-F396 HydrophobicContact CG2-CZ 4.24Å
388	S	92.2	Very high	93.2	Very high	12 Å²	12	22.6 Å²	22.6	8%	0.084	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-21.9	-172.5	74.4	0	0	0	0	115	L384 Y385 Y390 W391 K448	L384-S388 WeakPolarHBondContact O-CB 3.3Å; L384-S388 PolarHBondContact O-N 3.08Å; Y385-S388 WeakPolarHBondContact O-CB 3.26Å; Y385-S388 PolarHBondContact O-N 2.55Å; Y385-S388 VanDerWaalsContact O-N 3.12Å; Y385-S388 PolarHBondContact O-OG 2.91Å; S388-Y390 PolarHBondContact O-N 3.43Å; S388-W391 VanDerWaalsContact CA-CE2 3.42Å; S388-W391 VanDerWaalsContact CB-CZ2 3.49Å; S388-K448 WeakPolarHBondContact O-CE 3.38Å
389	A	86.7	Confident	93.5	Very high	76 Å²	76	24.9 Å²	24.9	63%	0.628	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-19.4	176	0	0	0	0	0	113.3	T387	T387-A389 PolarHBondContact O-N 3.17Å; T387-A389 VanDerWaalsContact O-N 3.13Å
390	Y	89	Confident	93.6	Very high	22 Å²	22	27.2 Å²	27.2	9%	0.086	15%	0.149	C	C	.	.	S	Bend	trans	-141.6	21.6	-169.6	53.4	-102.3	0	0	0	114.8	G386 T387 S388 E392 H393 C394 V403 R405 I648	G386-Y390 WeakPolarHBondContact O-CE1 3.07Å; G386-Y390 PolarHBondContact O-OH 2.74Å; T387-Y390 VanDerWaalsContact CA-CZ 3.45Å; T387-Y390 WeakPolarHBondContact CA-OH 3.39Å; T387-Y390 HydrophobicContact CG2-CE2 3.95Å; T387-Y390 WeakPolarHBondContact CG2-OH 2.94Å; T387-Y390 PolarHBondContact O-N 3.19Å; S388-Y390 PolarHBondContact O-N 3.43Å; Y390-E392 PolarHBondContact O-N 2.83Å; Y390-E392 VanDerWaalsContact O-N 3.11Å; Y390-H393 CarbonylContact O-C 3.59Å; Y390-H393 WeakPolarHBondContact O-CA 3.49Å; Y390-H393 PolarHBondContact O-N 3.14Å; Y390-C394 HydrophobicContact CD2-CB 3.79Å; Y390-C394 HydrophobicContact CE2-CB 4.26Å; Y390-C394 PolarHBondContact O-N 3.3Å; Y390-C394 PolarHBondContact O-SG 3.43Å; Y390-C394 VanDerWaalsContact O-SG 3.38Å; Y390-V403 HydrophobicContact CE2-CG1 4.34Å; Y390-R405 HydrophobicContact CE2-CG 4.38Å; Y390-R405 VanDerWaalsContact CZ-NH2 3.35Å; Y390-R405 PolarHBondContact OH-NH2 3.12Å; Y390-I648 HydrophobicContact CG-CD1 4.44Å
391	W	91.8	Very high	93.7	Very high	8 Å²	8	27.7 Å²	27.7	3%	0.03	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-31.4	178.1	-73.6	-25.1	0	0	0	115.3	L384 T387 S388 H393 F396 W422 L423 N424 L444 L447 K448 L451	L384-W391 HydrophobicContact CD2-CZ2 4.48Å; L384-W391 WeakPolarHBondContact O-CZ2 3.26Å; T387-W391 PolarHBondContact O-N 3.15Å; T387-W391 PolarHBondContact O-NE1 3.37Å; T387-W391 PolarHBondContact OG1-NE1 3.32Å; T387-W391 VanDerWaalsContact OG1-NE1 3.07Å; S388-W391 VanDerWaalsContact CA-CE2 3.42Å; S388-W391 VanDerWaalsContact CB-CZ2 3.49Å; W391-H393 VanDerWaalsContact C-N 3.3Å; W391-F396 AromaticContact CD1-CE2 3.76Å; W391-F396 AromaticContact CD1-CZ 3.68Å; W391-F396 AromaticContact NE1-CZ 3.81Å; W391-W422 CarbonylContact C-O 3.47Å; W391-L423 HydrophobicContact CB-CD1 3.86Å; W391-L423 HydrophobicContact CD2-CD1 4.2Å; W391-L423 HydrophobicContact CG-CD1 3.75Å; W391-N424 PolarHBondContact O-ND2 2.89Å; W391-L444 HydrophobicContact CE3-CB 3.96Å; W391-L444 HydrophobicContact CE3-CD1 4.22Å; W391-L444 HydrophobicContact CE3-CD2 3.79Å; W391-L444 HydrophobicContact CE3-CG 4.2Å; W391-L444 HydrophobicContact CZ3-CB 3.88Å; W391-L444 HydrophobicContact CZ3-CD2 3.86Å; W391-L444 HydrophobicContact CZ3-CG 4.38Å; W391-L447 HydrophobicContact CH2-CB 4.28Å; W391-L447 HydrophobicContact CH2-CD2 3.72Å; W391-L447 HydrophobicContact CH2-CG 3.85Å; W391-L447 HydrophobicContact CZ2-CD2 4.34Å; W391-L447 HydrophobicContact CZ3-CD2 4.34Å; W391-K448 HydrophobicContact CH2-CG 4.35Å; W391-K448 HydrophobicContact CZ3-CG 3.96Å; W391-L451 HydrophobicContact CH2-CD1 3.64Å; W391-L451 HydrophobicContact CZ2-CD1 3.78Å
392	E	90.5	Very high	93.8	Very high	53 Å²	53	30.9 Å²	30.9	25%	0.248	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-15	176.6	66.3	-166.2	-165.6	0	0	112.9	Y390 W422 N424	Y390-E392 PolarHBondContact O-N 2.83Å; Y390-E392 VanDerWaalsContact O-N 3.11Å; E392-W422 HydrophobicContact CB-CE3 4.41Å; E392-W422 PolarHBondContact N-O 3.48Å; E392-W422 VanDerWaalsContact OE2-CZ3 3.28Å; E392-W422 WeakPolarHBondContact OE2-CZ3 3.37Å; E392-N424 PolarHBondContact O-ND2 3.12Å
393	H	90.5	Very high	94	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	16%	0.159	C	C	.	.	S	Bend	trans	-115.2	11.7	-176.5	-53.6	-56.8	0	0	0	113.4	Y390 W391 L407 K495 P496 Y501 I648	Y390-H393 CarbonylContact O-C 3.59Å; Y390-H393 WeakPolarHBondContact O-CA 3.49Å; Y390-H393 PolarHBondContact O-N 3.14Å; W391-H393 VanDerWaalsContact C-N 3.3Å; H393-L407 VanDerWaalsContact C-CD1 3.44Å; H393-L407 VanDerWaalsContact CA-CD1 3.49Å; H393-L407 HydrophobicContact CB-CD1 4.47Å; H393-L407 WeakPolarHBondContact O-CG 3.4Å; H393-K495 WeakPolarHBondContact NE2-CD 3.33Å; H393-P496 PolarHBondContact CE1-O 2.95Å; H393-P496 VanDerWaalsContact CE1-O 3.25Å; H393-Y501 AromaticContact ND1-CE2 3.81Å; H393-Y501 AromaticContact ND1-CZ 3.82Å; H393-Y501 PolarHBondContact ND1-OH 3.32Å; H393-I648 HydrophobicContact CB-CB 4.49Å; H393-I648 HydrophobicContact CB-CD1 4.43Å; H393-I648 HydrophobicContact CB-CG1 3.98Å; H393-I648 HydrophobicContact CB-CG2 4Å
394	C	93.5	Very high	93.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.16	C	C	.	.			trans	-135.8	166.3	173.4	72.6	0	0	0	0	111	Y390 V403 E404 R405 N424	Y390-C394 HydrophobicContact CD2-CB 3.79Å; Y390-C394 HydrophobicContact CE2-CB 4.26Å; Y390-C394 PolarHBondContact O-N 3.3Å; Y390-C394 PolarHBondContact O-SG 3.43Å; Y390-C394 VanDerWaalsContact O-SG 3.38Å; C394-V403 HydrophobicContact CB-CG1 3.85Å; C394-E404 CarbonylContact C-O 3.55Å; C394-E404 WeakPolarHBondContact CA-O 3.35Å; C394-E404 WeakPolarHBondContact CB-O 3.46Å; C394-R405 HydrophobicContact CB-CG 4.37Å; C394-N424 VanDerWaalsContact O-CB 3.3Å; C394-N424 WeakPolarHBondContact O-CB 3.41Å; C394-N424 PolarHBondContact O-ND2 3.43Å; C394-N424 VanDerWaalsContact O-ND2 3.12Å
395	V	95.6	Very high	93.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	124.7	169.8	-168.1	0	0	0	0	109.4	R397 V403 E404 L407 F410 F418 N424 E426	V395-R397 HydrophobicContact CB-CG 4.13Å; V395-R397 HydrophobicContact CG1-CG 3.97Å; V395-R397 PolarHBondContact O-N 3.08Å; V395-V403 CarbonylContact O-C 3.46Å; V395-E404 HydrophobicContact CB-CB 4.48Å; V395-E404 PolarHBondContact N-O 3.26Å; V395-E404 PolarHBondContact O-N 2.69Å; V395-L407 HydrophobicContact CG2-CD2 3.47Å; V395-L407 VanDerWaalsContact CG2-CD2 3.47Å; V395-F410 HydrophobicContact CB-CD2 4.34Å; V395-F410 HydrophobicContact CB-CE2 4.14Å; V395-F410 HydrophobicContact CB-CZ 4.39Å; V395-F410 HydrophobicContact CG1-CE2 3.96Å; V395-F410 HydrophobicContact CG1-CZ 3.99Å; V395-F410 HydrophobicContact CG2-CD1 3.94Å; V395-F410 HydrophobicContact CG2-CD2 4.07Å; V395-F410 HydrophobicContact CG2-CE1 3.93Å; V395-F410 HydrophobicContact CG2-CE2 4.04Å; V395-F410 HydrophobicContact CG2-CG 4.02Å; V395-F410 HydrophobicContact CG2-CZ 3.98Å; V395-F418 HydrophobicContact CG1-CZ 4.02Å; V395-F418 HydrophobicContact CG2-CE1 4.5Å; V395-N424 WeakPolarHBondContact CA-O 3.17Å; V395-N424 HydrophobicContact CB-CB 4.33Å; V395-N424 HydrophobicContact CG1-CB 4.23Å; V395-N424 HydrophobicContact CG2-CB 3.96Å; V395-E426 HydrophobicContact CG1-CB 3.9Å
396	F	97.6	Very high	93.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	116.6	166.7	-62.8	-90.5	0	0	0	108.4	I337 T340 F383 T387 W391 P398 V403 L423 N424 V425 E426	I337-F396 HydrophobicContact CG1-CB 4.49Å; I337-F396 HydrophobicContact CG1-CD1 4.43Å; I337-F396 HydrophobicContact CG1-CD2 4.22Å; I337-F396 HydrophobicContact CG1-CG 4.13Å; I337-F396 HydrophobicContact CG2-CD1 3.98Å; I337-F396 HydrophobicContact CG2-CE1 3.89Å; I337-F396 HydrophobicContact CG2-CG 4.49Å; I337-F396 HydrophobicContact CG2-CZ 4.32Å; T340-F396 HydrophobicContact CG2-CB 4.36Å; T340-F396 HydrophobicContact CG2-CD1 4.28Å; F383-F396 HydrophobicContact CE1-CD1 4.16Å; F383-F396 AromaticContact CE1-CE1 3.61Å; F383-F396 HydrophobicContact CE1-CE1 3.61Å; F383-F396 HydrophobicContact CZ-CD1 4.07Å; F383-F396 AromaticContact CZ-CE1 3.71Å; F383-F396 HydrophobicContact CZ-CE1 3.71Å; T387-F396 HydrophobicContact CG2-CE1 4.13Å; T387-F396 HydrophobicContact CG2-CZ 4.24Å; W391-F396 AromaticContact CD1-CE2 3.76Å; W391-F396 AromaticContact CD1-CZ 3.68Å; W391-F396 AromaticContact NE1-CZ 3.81Å; F396-P398 WeakPolarHBondContact O-CD 3.5Å; F396-V403 HydrophobicContact CD1-CG2 3.76Å; F396-V403 HydrophobicContact CE1-CG1 4.47Å; F396-V403 HydrophobicContact CE1-CG2 3.95Å; F396-L423 HydrophobicContact CD2-CD1 4.29Å; F396-L423 HydrophobicContact CE2-CD1 3.73Å; F396-N424 WeakPolarHBondContact CD2-O 3.49Å; F396-N424 PolarHBondContact N-O 3.33Å; F396-V425 HydrophobicContact CB-CG1 4.25Å; F396-V425 HydrophobicContact CB-CG2 4.24Å; F396-V425 HydrophobicContact CD2-CG2 4.12Å; F396-E426 PolarHBondContact O-N 3.39Å
397	R	97.2	Very high	93.2	Very high	1 Å²	1	28.7 Å²	28.7	0%	0.004	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	78.5	-172.5	-62.9	-171.8	74.4	174.8	9.1	111.3	V395 R399 L400 G401 I402 E404 F410 E413 H414 E426	V395-R397 HydrophobicContact CB-CG 4.13Å; V395-R397 HydrophobicContact CG1-CG 3.97Å; V395-R397 PolarHBondContact O-N 3.08Å; R397-R399 PolarHBondContact O-N 3.07Å; R397-R399 VanDerWaalsContact O-N 3.07Å; R397-L400 VanDerWaalsContact CZ-CD1 3.43Å; R397-L400 PolarHBondContact O-N 3.29Å; R397-G401 PolarHBondContact O-N 3.37Å; R397-I402 HydrophobicContact CB-CG1 4.11Å; R397-I402 PolarHBondContact N-O 2.73Å; R397-I402 PolarHBondContact O-N 3.17Å; R397-E404 HydrophobicContact CG-CB 4.18Å; R397-F410 HydrophobicContact CG-CE2 4.33Å; R397-E413 IonicContact CZ-OE2 3.19Å; R397-E413 VanDerWaalsContact CZ-OE2 3.24Å; R397-E413 IonicContact NH1-OE1 3.73Å; R397-E413 IonicContact NH1-OE2 3.6Å; R397-E413 PolarHBondContact NH1-OE2 3.04Å; R397-E413 IonicContact NH2-OE2 3.68Å; R397-E413 PolarHBondContact NH2-OE2 3.19Å; R397-H414 PolarHBondContact NH2-CE1 3.49Å; R397-E426 VanDerWaalsContact CB-OE2 3.3Å; R397-E426 WeakPolarHBondContact CB-OE2 3.5Å; R397-E426 HydrophobicContact CG-CB 4.21Å; R397-E426 WeakPolarHBondContact CG-OE2 3.45Å; R397-E426 IonicContact CZ-OE1 3.26Å; R397-E426 IonicContact CZ-OE2 2.81Å; R397-E426 IonicContact NE-OE1 2.84Å; R397-E426 PolarHBondContact NE-OE1 3.04Å; R397-E426 IonicContact NE-OE2 2.76Å; R397-E426 PolarHBondContact NE-OE2 3.25Å; R397-E426 IonicContact NH2-OE1 3.77Å; R397-E426 PolarHBondContact NH2-OE1 2.9Å; R397-E426 IonicContact NH2-OE2 3.07Å
398	P	98	Very high	92.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-17.6	178	26.9	-35.7	0	0	0	113.1	W292 L336 V339 Q343 A351 F396 L400 E426 P428	W292-P398 HydrophobicContact CH2-CB 4.35Å; L336-P398 HydrophobicContact CB-CG 4.28Å; L336-P398 HydrophobicContact CD1-CG 4.46Å; L336-P398 HydrophobicContact CD2-CG 4.11Å; V339-P398 HydrophobicContact CG1-CB 4.38Å; Q343-P398 PolarHBondContact NE2-O 2.94Å; Q343-P398 VanDerWaalsContact OE1-CA 3.25Å; Q343-P398 PolarHBondContact OE1-O 3.16Å; A351-P398 WeakPolarHBondContact CB-O 3.31Å; A351-P398 PolarHBondContact N-O 3.09Å; F396-P398 WeakPolarHBondContact O-CD 3.5Å; P398-L400 VanDerWaalsContact C-N 3.33Å; P398-E426 WeakPolarHBondContact CD-O 3.3Å; P398-E426 WeakPolarHBondContact CG-O 3.43Å; P398-P428 HydrophobicContact CG-CB 4.34Å; P398-P428 HydrophobicContact CG-CG 4.38Å
399	R	96.6	Very high	92.6	Very high	99 Å²	99	29 Å²	29	37%	0.374	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-43.7	170.8	-170.6	173.4	174.6	-138.2	-3.6	112.1	P350 A351 S352 R397 P428	P350-R399 VanDerWaalsContact CB-O 3.32Å; P350-R399 WeakPolarHBondContact CB-O 3.07Å; A351-R399 PolarHBondContact N-O 3.06Å; S352-R399 WeakPolarHBondContact CB-O 3.4Å; S352-R399 PolarHBondContact N-O 2.82Å; S352-R399 PolarHBondContact OG-O 3.19Å; S352-R399 VanDerWaalsContact OG-O 3.1Å; R397-R399 PolarHBondContact O-N 3.07Å; R397-R399 VanDerWaalsContact O-N 3.07Å; R399-P428 HydrophobicContact CB-CB 4.39Å
400	L	96.1	Very high	92.8	Very high	67 Å²	67	25.4 Å²	25.4	35%	0.351	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-10.4	-174.9	-59.8	-175.9	0	0	0	113.2	R397 P398 I402	R397-L400 VanDerWaalsContact CZ-CD1 3.43Å; R397-L400 PolarHBondContact O-N 3.29Å; P398-L400 VanDerWaalsContact C-N 3.33Å; L400-I402 HydrophobicContact CB-CD1 4.32Å; L400-I402 HydrophobicContact CB-CG1 4Å; L400-I402 HydrophobicContact CD1-CD1 4.28Å
401	G	96.9	Very high	92.8	Very high	10 Å²	10	24.3 Å²	24.3	10%	0.103	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.6	25.1	-178.4	0	0	0	0	0	114.6	T344 R397	T344-G401 WeakPolarHBondContact CG2-O 3.4Å; R397-G401 PolarHBondContact O-N 3.37Å
402	I	95.8	Very high	92.7	Very high	67 Å²	67	26.9 Å²	26.9	34%	0.344	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	164.1	-174.6	66.2	173.4	0	0	0	112.8	T340 R397 L400	T340-I402 WeakPolarHBondContact CG2-O 3.45Å; R397-I402 HydrophobicContact CB-CG1 4.11Å; R397-I402 PolarHBondContact N-O 2.73Å; R397-I402 PolarHBondContact O-N 3.17Å; L400-I402 HydrophobicContact CB-CD1 4.32Å; L400-I402 HydrophobicContact CB-CG1 4Å; L400-I402 HydrophobicContact CD1-CD1 4.28Å
403	V	95.8	Very high	92.6	Very high	31 Å²	31	30 Å²	30	19%	0.188	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	102.6	163	-177.6	0	0	0	0	107.7	T340 F383 Y390 C394 V395 F396 R405	T340-V403 HydrophobicContact CG2-CG2 4.1Å; F383-V403 HydrophobicContact CE2-CG2 3.98Å; F383-V403 HydrophobicContact CZ-CG2 3.64Å; Y390-V403 HydrophobicContact CE2-CG1 4.34Å; C394-V403 HydrophobicContact CB-CG1 3.85Å; V395-V403 CarbonylContact O-C 3.46Å; F396-V403 HydrophobicContact CD1-CG2 3.76Å; F396-V403 HydrophobicContact CE1-CG1 4.47Å; F396-V403 HydrophobicContact CE1-CG2 3.95Å; V403-R405 PolarHBondContact O-N 3.4Å
404	E	93.3	Very high	92.4	Very high	36 Å²	36	30.6 Å²	30.6	17%	0.168	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	117.8	-179.9	-178.6	54.1	-94.8	0	0	109.7	C394 V395 R397 N406 F410	C394-E404 CarbonylContact C-O 3.55Å; C394-E404 WeakPolarHBondContact CA-O 3.35Å; C394-E404 WeakPolarHBondContact CB-O 3.46Å; V395-E404 HydrophobicContact CB-CB 4.48Å; V395-E404 PolarHBondContact N-O 3.26Å; V395-E404 PolarHBondContact O-N 2.69Å; R397-E404 HydrophobicContact CG-CB 4.18Å; E404-N406 WeakPolarHBondContact OE1-CA 3.45Å; E404-N406 WeakPolarHBondContact OE1-CB 3.47Å; E404-N406 PolarHBondContact OE1-N 3.42Å; E404-F410 HydrophobicContact CG-CB 3.98Å; E404-F410 HydrophobicContact CG-CD2 4.27Å
405	R	90.4	Very high	91.5	Very high	71 Å²	71	32.1 Å²	32.1	27%	0.268	16%	0.162	S	C	.	.			trans	-100.1	-23.3	176.6	-61.3	-170.7	-174.6	173.8	4.7	112.1	Y390 C394 V403 L407 D646 N647	Y390-R405 HydrophobicContact CE2-CG 4.38Å; Y390-R405 VanDerWaalsContact CZ-NH2 3.35Å; Y390-R405 PolarHBondContact OH-NH2 3.12Å; C394-R405 HydrophobicContact CB-CG 4.37Å; V403-R405 PolarHBondContact O-N 3.4Å; R405-L407 VanDerWaalsContact C-N 3.32Å; R405-L407 PolarHBondContact O-N 3.49Å; R405-D646 WeakPolarHBondContact CB-O 3.4Å; R405-D646 WeakPolarHBondContact CD-O 3.43Å; R405-D646 IonicContact NH1-OD1 3.7Å; R405-D646 PolarHBondContact NH1-OD1 2.79Å; R405-N647 HydrophobicContact CB-CB 3.85Å; R405-N647 WeakPolarHBondContact O-CB 3.38Å
406	N	86.6	Confident	90.7	Very high	41 Å²	41	36 Å²	36	22%	0.219	18%	0.183	C	C	.	.			trans	-79.6	81.8	174.7	-177	0.9	0	0	0	110.1	E404 S408 G409 F410 S518 N647	E404-N406 WeakPolarHBondContact OE1-CA 3.45Å; E404-N406 WeakPolarHBondContact OE1-CB 3.47Å; E404-N406 PolarHBondContact OE1-N 3.42Å; N406-S408 VanDerWaalsContact C-N 3.25Å; N406-S408 PolarHBondContact O-N 3.35Å; N406-S408 PolarHBondContact OD1-N 3.16Å; N406-S408 PolarHBondContact OD1-OG 3.21Å; N406-G409 PolarHBondContact O-N 3.23Å; N406-G409 PolarHBondContact OD1-N 3.27Å; N406-F410 PolarHBondContact O-N 2.99Å; N406-S518 PolarHBondContact OD1-OG 3.02Å; N406-N647 HydrophobicContact CB-CB 4.2Å
407	L	88.9	Confident	90.1	Very high	5 Å²	5	42 Å²	42	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-30.3	178.1	-77.5	-177.4	0	0	0	113.3	H393 V395 R405 F410 M411 Y420 Y501	H393-L407 VanDerWaalsContact C-CD1 3.44Å; H393-L407 VanDerWaalsContact CA-CD1 3.49Å; H393-L407 HydrophobicContact CB-CD1 4.47Å; H393-L407 WeakPolarHBondContact O-CG 3.4Å; V395-L407 HydrophobicContact CG2-CD2 3.47Å; V395-L407 VanDerWaalsContact CG2-CD2 3.47Å; R405-L407 VanDerWaalsContact C-N 3.32Å; R405-L407 PolarHBondContact O-N 3.49Å; L407-F410 HydrophobicContact CD2-CB 4.39Å; L407-F410 HydrophobicContact CD2-CD1 4.43Å; L407-F410 PolarHBondContact O-N 3.32Å; L407-M411 WeakPolarHBondContact O-CB 3.39Å; L407-M411 WeakPolarHBondContact O-CG 3.18Å; L407-M411 PolarHBondContact O-N 2.85Å; L407-Y420 HydrophobicContact CD2-CE1 4.14Å; L407-Y501 HydrophobicContact CB-CE1 4.04Å; L407-Y501 HydrophobicContact CD1-CD1 4.24Å; L407-Y501 HydrophobicContact CD1-CD2 4.45Å; L407-Y501 HydrophobicContact CD1-CE1 3.55Å; L407-Y501 HydrophobicContact CD1-CE2 3.79Å; L407-Y501 WeakPolarHBondContact CD1-OH 3.37Å; L407-Y501 HydrophobicContact CG-CE1 4.47Å
408	S	86.1	Confident	89.8	Confident	5 Å²	5	41.9 Å²	41.9	4%	0.035	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-43.7	173.8	30.6	0	0	0	0	111.9	N406 M411 L412 S518 I521	N406-S408 VanDerWaalsContact C-N 3.25Å; N406-S408 PolarHBondContact O-N 3.35Å; N406-S408 PolarHBondContact OD1-N 3.16Å; N406-S408 PolarHBondContact OD1-OG 3.21Å; S408-M411 PolarHBondContact O-N 3.45Å; S408-L412 WeakPolarHBondContact O-CG 3.3Å; S408-L412 PolarHBondContact O-N 3.48Å; S408-S518 VanDerWaalsContact CB-OG 3.22Å; S408-S518 WeakPolarHBondContact CB-OG 3.48Å; S408-S518 PolarHBondContact OG-OG 3.31Å; S408-I521 WeakPolarHBondContact O-CD1 3.43Å
409	G	86.9	Confident	89.3	Confident	16 Å²	16	47.2 Å²	47.2	17%	0.165	23%	0.232	C	C	.	.	H	α-helix	trans	-61.4	-46.9	172.2	0	0	0	0	0	111.8	N406 M411 L412 E413	N406-G409 PolarHBondContact O-N 3.23Å; N406-G409 PolarHBondContact OD1-N 3.27Å; G409-M411 VanDerWaalsContact C-N 3.29Å; G409-M411 PolarHBondContact O-N 2.87Å; G409-L412 WeakPolarHBondContact O-CB 3.4Å; G409-L412 PolarHBondContact O-N 2.96Å; G409-L412 VanDerWaalsContact O-N 3.1Å; G409-E413 PolarHBondContact O-N 2.89Å
410	F	91.2	Very high	89.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.1	-39.8	176.9	-175.7	-91.5	0	0	0	113	V395 R397 E404 N406 L407 L412 E413 H414 F418 Y420	V395-F410 HydrophobicContact CB-CD2 4.34Å; V395-F410 HydrophobicContact CB-CE2 4.14Å; V395-F410 HydrophobicContact CB-CZ 4.39Å; V395-F410 HydrophobicContact CG1-CE2 3.96Å; V395-F410 HydrophobicContact CG1-CZ 3.99Å; V395-F410 HydrophobicContact CG2-CD1 3.94Å; V395-F410 HydrophobicContact CG2-CD2 4.07Å; V395-F410 HydrophobicContact CG2-CE1 3.93Å; V395-F410 HydrophobicContact CG2-CE2 4.04Å; V395-F410 HydrophobicContact CG2-CG 4.02Å; V395-F410 HydrophobicContact CG2-CZ 3.98Å; R397-F410 HydrophobicContact CG-CE2 4.33Å; E404-F410 HydrophobicContact CG-CB 3.98Å; E404-F410 HydrophobicContact CG-CD2 4.27Å; N406-F410 PolarHBondContact O-N 2.99Å; L407-F410 HydrophobicContact CD2-CB 4.39Å; L407-F410 HydrophobicContact CD2-CD1 4.43Å; L407-F410 PolarHBondContact O-N 3.32Å; F410-L412 VanDerWaalsContact C-N 3.29Å; F410-L412 PolarHBondContact O-N 2.76Å; F410-E413 PolarHBondContact O-N 3.39Å; F410-H414 AromaticContact CD1-ND1 3.94Å; F410-H414 AromaticContact CD2-CE1 3.72Å; F410-H414 AromaticContact CD2-ND1 3.81Å; F410-H414 HydrophobicContact CE1-CB 4.47Å; F410-H414 AromaticContact CE1-CG 3.99Å; F410-H414 AromaticContact CE1-ND1 3.68Å; F410-H414 AromaticContact CE2-CE1 3.23Å; F410-H414 WeakPolarHBondContact CE2-CE1 3.37Å; F410-H414 AromaticContact CE2-ND1 3.56Å; F410-H414 AromaticContact CE2-NE2 3.91Å; F410-H414 AromaticContact CG-ND1 3.99Å; F410-H414 AromaticContact CZ-CE1 3.45Å; F410-H414 VanDerWaalsContact CZ-CE1 3.45Å; F410-H414 WeakPolarHBondContact CZ-CE1 3.47Å; F410-H414 AromaticContact CZ-CG 3.9Å; F410-H414 AromaticContact CZ-ND1 3.48Å; F410-H414 WeakPolarHBondContact CZ-ND1 3.33Å; F410-H414 AromaticContact CZ-NE2 3.85Å; F410-H414 PolarHBondContact O-N 3.32Å; F410-H414 PolarHBondContact O-ND1 3.07Å; F410-F418 AromaticContact CE1-CD1 3.63Å; F410-F418 HydrophobicContact CE1-CD1 3.63Å; F410-F418 HydrophobicContact CE1-CD2 4.22Å; F410-F418 AromaticContact CE1-CE1 3.75Å; F410-F418 HydrophobicContact CE1-CE1 3.75Å; F410-F418 HydrophobicContact CE1-CE2 4.33Å; F410-F418 AromaticContact CE1-CG 3.86Å; F410-F418 HydrophobicContact CE1-CG 3.86Å; F410-F418 HydrophobicContact CE1-CZ 4.1Å; F410-F418 HydrophobicContact CZ-CD1 4.25Å; F410-F418 HydrophobicContact CZ-CD2 4.08Å; F410-F418 HydrophobicContact CZ-CE1 4.15Å; F410-F418 AromaticContact CZ-CE2 3.99Å; F410-F418 HydrophobicContact CZ-CE2 3.99Å; F410-F418 HydrophobicContact CZ-CG 4.2Å; F410-F418 HydrophobicContact CZ-CZ 4.01Å; F410-Y420 HydrophobicContact CD1-CE1 4.05Å; F410-Y420 WeakPolarHBondContact CD1-OH 3.44Å; F410-Y420 HydrophobicContact CE1-CE1 4.18Å
411	M	90.7	Very high	88.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.9	-30.6	178.2	-73.9	169.6	80.4	0	0	112.8	L407 S408 G409 Y420 Y501 I504 Q505 I508 I521	L407-M411 WeakPolarHBondContact O-CB 3.39Å; L407-M411 WeakPolarHBondContact O-CG 3.18Å; L407-M411 PolarHBondContact O-N 2.85Å; S408-M411 PolarHBondContact O-N 3.45Å; G409-M411 VanDerWaalsContact C-N 3.29Å; G409-M411 PolarHBondContact O-N 2.87Å; M411-Y420 HydrophobicContact CG-CE1 4.47Å; M411-Y420 HydrophobicContact CG-CE2 4.37Å; M411-Y420 WeakPolarHBondContact CG-OH 3.28Å; M411-Y501 HydrophobicContact SD-CD1 4.11Å; M411-I504 HydrophobicContact CE-CB 3.71Å; M411-I504 HydrophobicContact CE-CG2 3.51Å; M411-Q505 VanDerWaalsContact CA-OE1 3.31Å; M411-Q505 HydrophobicContact CE-CB 3.84Å; M411-Q505 VanDerWaalsContact CE-N 3.3Å; M411-Q505 VanDerWaalsContact CG-OE1 3.28Å; M411-Q505 PolarHBondContact O-NE2 3.14Å; M411-I508 HydrophobicContact CB-CD1 4.01Å; M411-I508 HydrophobicContact CE-CD1 4.24Å; M411-I521 HydrophobicContact CB-CD1 4.19Å; M411-I521 HydrophobicContact SD-CG2 4.23Å
412	L	88.5	Confident	88.6	Confident	62 Å²	62	42.4 Å²	42.4	33%	0.325	21%	0.206	S	C	.	.	H	α-helix	trans	-73.6	-33.8	175.8	-66.4	168.3	0	0	0	112.2	S408 G409 F410 H414 L516 I521	S408-L412 WeakPolarHBondContact O-CG 3.3Å; S408-L412 PolarHBondContact O-N 3.48Å; G409-L412 WeakPolarHBondContact O-CB 3.4Å; G409-L412 PolarHBondContact O-N 2.96Å; G409-L412 VanDerWaalsContact O-N 3.1Å; F410-L412 VanDerWaalsContact C-N 3.29Å; F410-L412 PolarHBondContact O-N 2.76Å; L412-H414 VanDerWaalsContact C-N 3.29Å; L412-H414 PolarHBondContact O-N 2.76Å; L412-L516 HydrophobicContact CD2-CB 3.62Å; L412-L516 HydrophobicContact CD2-CD1 4.42Å; L412-I521 HydrophobicContact CD1-CD1 4.31Å; L412-I521 HydrophobicContact CD2-CD1 3.67Å; L412-I521 HydrophobicContact CG-CD1 3.67Å
413	E	88.5	Confident	88.6	Confident	117 Å²	117	39.3 Å²	39.3	55%	0.547	19%	0.19	S	C	.	.	H	α-helix	trans	-70.5	-25.7	177.1	-69	178.2	-158.5	0	0	112.7	R397 G409 F410	R397-E413 IonicContact CZ-OE2 3.19Å; R397-E413 VanDerWaalsContact CZ-OE2 3.24Å; R397-E413 IonicContact NH1-OE1 3.73Å; R397-E413 IonicContact NH1-OE2 3.6Å; R397-E413 PolarHBondContact NH1-OE2 3.04Å; R397-E413 IonicContact NH2-OE2 3.68Å; R397-E413 PolarHBondContact NH2-OE2 3.19Å; G409-E413 PolarHBondContact O-N 2.89Å; F410-E413 PolarHBondContact O-N 3.39Å
414	H	85.4	Confident	88.5	Confident	14 Å²	14	37.8 Å²	37.8	7%	0.065	18%	0.181	C	C	.	.	S	Bend	trans	-116.9	155.5	-169.9	-64.8	81.4	0	0	0	113.8	R397 F410 L412 F418 E426 Q505	R397-H414 PolarHBondContact NH2-CE1 3.49Å; F410-H414 AromaticContact CD1-ND1 3.94Å; F410-H414 AromaticContact CD2-CE1 3.72Å; F410-H414 AromaticContact CD2-ND1 3.81Å; F410-H414 HydrophobicContact CE1-CB 4.47Å; F410-H414 AromaticContact CE1-CG 3.99Å; F410-H414 AromaticContact CE1-ND1 3.68Å; F410-H414 AromaticContact CE2-CE1 3.23Å; F410-H414 WeakPolarHBondContact CE2-CE1 3.37Å; F410-H414 AromaticContact CE2-ND1 3.56Å; F410-H414 AromaticContact CE2-NE2 3.91Å; F410-H414 AromaticContact CG-ND1 3.99Å; F410-H414 AromaticContact CZ-CE1 3.45Å; F410-H414 VanDerWaalsContact CZ-CE1 3.45Å; F410-H414 WeakPolarHBondContact CZ-CE1 3.47Å; F410-H414 AromaticContact CZ-CG 3.9Å; F410-H414 AromaticContact CZ-ND1 3.48Å; F410-H414 WeakPolarHBondContact CZ-ND1 3.33Å; F410-H414 AromaticContact CZ-NE2 3.85Å; F410-H414 PolarHBondContact O-N 3.32Å; F410-H414 PolarHBondContact O-ND1 3.07Å; L412-H414 VanDerWaalsContact C-N 3.29Å; L412-H414 PolarHBondContact O-N 2.76Å; H414-F418 HydrophobicContact CB-CB 4.35Å; H414-E426 IonicContact CE1-OE1 3.67Å; H414-E426 IonicContact NE2-OE1 3.27Å; H414-E426 PolarHBondContact NE2-OE1 2.83Å; H414-E426 VanDerWaalsContact NE2-OE1 3.17Å; H414-Q505 PolarHBondContact O-NE2 3.03Å; H414-Q505 VanDerWaalsContact O-NE2 3.1Å
415	S	76.4	Confident	88.7	Confident	33 Å²	33	36.1 Å²	36.1	23%	0.231	17%	0.173	C	C	.	.			trans	-81.7	179.5	173.4	70.2	0	0	0	0	112	K417 F418 E432 N509	S415-K417 PolarHBondContact O-N 3.3Å; S415-F418 PolarHBondContact O-N 3.44Å; S415-E432 PolarHBondContact OG-OE1 2.99Å; S415-N509 VanDerWaalsContact C-ND2 3.26Å
416	D	78.9	Confident	89	Confident	82 Å²	82	32.7 Å²	32.7	44%	0.439	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-3.2	-177.4	59.6	-34	0	0	0	112.8	Q505 R506 N509	D416-Q505 HydrophobicContact CB-CG 4.47Å; D416-R506 HydrophobicContact CB-CG 3.98Å; D416-N509 WeakPolarHBondContact CA-ND2 3.3Å; D416-N509 WeakPolarHBondContact CB-ND2 3.31Å; D416-N509 PolarHBondContact N-ND2 3.14Å
417	K	83.4	Confident	89.5	Confident	124 Å²	124	30.8 Å²	30.8	54%	0.539	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-22.9	-178.6	-61.3	171.8	-170.4	164.5	0	112.2	S415 K419 E432	S415-K417 PolarHBondContact O-N 3.3Å; K417-K419 PolarHBondContact O-N 3.48Å; K417-E432 HydrophobicContact CB-CB 3.89Å; K417-E432 HydrophobicContact CB-CG 4.15Å; K417-E432 HydrophobicContact CD-CG 4.4Å; K417-E432 VanDerWaalsContact CD-OE1 3.3Å; K417-E432 WeakPolarHBondContact CD-OE1 3.42Å; K417-E432 WeakPolarHBondContact CD-OE2 3.49Å; K417-E432 IonicContact NZ-OE1 3.98Å; K417-E432 PolarHBondContact NZ-OE1 2.85Å; K417-E432 IonicContact NZ-OE2 2.75Å; K417-E432 PolarHBondContact NZ-OE2 3.15Å
418	F	90.9	Very high	89.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	-65.9	110.6	171.8	-169.6	-92.5	0	0	0	110.1	V395 F410 H414 S415 Y420 N424 V431 E432 N434	V395-F418 HydrophobicContact CG1-CZ 4.02Å; V395-F418 HydrophobicContact CG2-CE1 4.5Å; F410-F418 AromaticContact CE1-CD1 3.63Å; F410-F418 HydrophobicContact CE1-CD1 3.63Å; F410-F418 HydrophobicContact CE1-CD2 4.22Å; F410-F418 AromaticContact CE1-CE1 3.75Å; F410-F418 HydrophobicContact CE1-CE1 3.75Å; F410-F418 HydrophobicContact CE1-CE2 4.33Å; F410-F418 AromaticContact CE1-CG 3.86Å; F410-F418 HydrophobicContact CE1-CG 3.86Å; F410-F418 HydrophobicContact CE1-CZ 4.1Å; F410-F418 HydrophobicContact CZ-CD1 4.25Å; F410-F418 HydrophobicContact CZ-CD2 4.08Å; F410-F418 HydrophobicContact CZ-CE1 4.15Å; F410-F418 AromaticContact CZ-CE2 3.99Å; F410-F418 HydrophobicContact CZ-CE2 3.99Å; F410-F418 HydrophobicContact CZ-CG 4.2Å; F410-F418 HydrophobicContact CZ-CZ 4.01Å; H414-F418 HydrophobicContact CB-CB 4.35Å; S415-F418 PolarHBondContact O-N 3.44Å; F418-Y420 AromaticContact CD1-CD1 3.97Å; F418-Y420 HydrophobicContact CD1-CD1 3.97Å; F418-Y420 HydrophobicContact CD1-CD2 4.31Å; F418-Y420 AromaticContact CD1-CE1 3.71Å; F418-Y420 HydrophobicContact CD1-CE1 3.71Å; F418-Y420 HydrophobicContact CD1-CE2 4.09Å; F418-Y420 HydrophobicContact CD1-CG 4.24Å; F418-Y420 AromaticContact CD1-CZ 3.77Å; F418-Y420 AromaticContact CE1-CD1 3.91Å; F418-Y420 HydrophobicContact CE1-CD1 3.91Å; F418-Y420 AromaticContact CE1-CE1 3.88Å; F418-Y420 HydrophobicContact CE1-CE1 3.88Å; F418-Y420 HydrophobicContact CE1-CG 4.45Å; F418-Y420 PolarHBondContact O-N 3.29Å; F418-N424 HydrophobicContact CE1-CB 4.27Å; F418-N424 HydrophobicContact CZ-CB 4.23Å; F418-V431 WeakPolarHBondContact CD2-O 3.31Å; F418-E432 WeakPolarHBondContact CA-O 3.49Å; F418-N434 HydrophobicContact CE1-CB 4.47Å; F418-N434 HydrophobicContact CE2-CB 3.92Å; F418-N434 HydrophobicContact CZ-CB 3.87Å
419	K	88.8	Confident	90.2	Very high	111 Å²	111	32.8 Å²	32.8	48%	0.483	16%	0.159	S	C	.	.			trans	-89.2	99.5	-176.9	-171	-179	179.9	-174.3	0	110.4	K417 N434	K417-K419 PolarHBondContact O-N 3.48Å; K419-N434 WeakPolarHBondContact O-CB 3.36Å; K419-N434 PolarHBondContact O-ND2 2.97Å
420	Y	92.1	Very high	90.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.159	C	C	.	.			trans	-57.3	150.9	171.1	-60.7	-81.9	0	0	0	111.1	L407 F410 M411 F418 N424 Q498 Y501 N502 Q505	L407-Y420 HydrophobicContact CD2-CE1 4.14Å; F410-Y420 HydrophobicContact CD1-CE1 4.05Å; F410-Y420 WeakPolarHBondContact CD1-OH 3.44Å; F410-Y420 HydrophobicContact CE1-CE1 4.18Å; M411-Y420 HydrophobicContact CG-CE1 4.47Å; M411-Y420 HydrophobicContact CG-CE2 4.37Å; M411-Y420 WeakPolarHBondContact CG-OH 3.28Å; F418-Y420 AromaticContact CD1-CD1 3.97Å; F418-Y420 HydrophobicContact CD1-CD1 3.97Å; F418-Y420 HydrophobicContact CD1-CD2 4.31Å; F418-Y420 AromaticContact CD1-CE1 3.71Å; F418-Y420 HydrophobicContact CD1-CE1 3.71Å; F418-Y420 HydrophobicContact CD1-CE2 4.09Å; F418-Y420 HydrophobicContact CD1-CG 4.24Å; F418-Y420 AromaticContact CD1-CZ 3.77Å; F418-Y420 AromaticContact CE1-CD1 3.91Å; F418-Y420 HydrophobicContact CE1-CD1 3.91Å; F418-Y420 AromaticContact CE1-CE1 3.88Å; F418-Y420 HydrophobicContact CE1-CE1 3.88Å; F418-Y420 HydrophobicContact CE1-CG 4.45Å; F418-Y420 PolarHBondContact O-N 3.29Å; Y420-N424 WeakPolarHBondContact CA-OD1 3.38Å; Y420-Q498 WeakPolarHBondContact O-CG 3.37Å; Y420-Q498 PolarHBondContact O-NE2 3.16Å; Y420-Y501 HydrophobicContact CD1-CG 4.46Å; Y420-Y501 HydrophobicContact CG-CG 4.38Å; Y420-N502 PolarHBondContact N-OD1 3.07Å; Y420-Q505 HydrophobicContact CE2-CB 4.07Å; Y420-Q505 HydrophobicContact CE2-CG 4.19Å; Y420-Q505 PolarHBondContact OH-OE1 3.36Å
421	S	91.9	Very high	90.5	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.014	17%	0.17	C	C	.	.			trans	-157.5	-174.4	179.7	98.8	0	0	0	0	111.6	L423 N424 G436 S437	S421-L423 PolarHBondContact O-N 3.17Å; S421-L423 PolarHBondContact OG-N 3.34Å; S421-L423 VanDerWaalsContact OG-N 3.12Å; S421-L423 PolarHBondContact OG-O 2.91Å; S421-N424 PolarHBondContact N-OD1 3.4Å; S421-N424 PolarHBondContact O-ND2 2.99Å; S421-N424 PolarHBondContact O-OD1 2.89Å; S421-G436 PolarHBondContact OG-O 3.23Å; S421-S437 WeakPolarHBondContact OG-CA 3.41Å
422	W	91.3	Very high	90.5	Very high	73 Å²	73	39.1 Å²	39.1	28%	0.277	19%	0.187	S	C	.	.	S	Bend	trans	-65.5	-20.8	174.8	-55.3	105.4	0	0	0	113.9	W391 E392 Y441 L444	W391-W422 CarbonylContact C-O 3.47Å; E392-W422 HydrophobicContact CB-CE3 4.41Å; E392-W422 PolarHBondContact N-O 3.48Å; E392-W422 VanDerWaalsContact OE2-CZ3 3.28Å; E392-W422 WeakPolarHBondContact OE2-CZ3 3.37Å; W422-Y441 HydrophobicContact CD2-CD2 4.02Å; W422-Y441 HydrophobicContact CD2-CG 4.38Å; W422-Y441 AromaticContact CE3-CD2 3.79Å; W422-Y441 HydrophobicContact CE3-CD2 3.79Å; W422-Y441 HydrophobicContact CZ3-CD2 4.12Å; W422-L444 HydrophobicContact CB-CD1 3.5Å; W422-L444 WeakPolarHBondContact O-CD1 3.18Å
423	L	94.2	Very high	90.7	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	18%	0.182	C	C	.	.	S	Bend	trans	-135.6	121.1	170.6	-175.3	67.2	0	0	0	108.4	F329 I337 W391 F396 S421 V425 N434 G436 I439 L444	F329-L423 HydrophobicContact CE2-CD2 4.41Å; F329-L423 HydrophobicContact CZ-CD2 3.82Å; I337-L423 HydrophobicContact CD1-CD1 4.49Å; I337-L423 HydrophobicContact CD1-CD2 3.82Å; W391-L423 HydrophobicContact CB-CD1 3.86Å; W391-L423 HydrophobicContact CD2-CD1 4.2Å; W391-L423 HydrophobicContact CG-CD1 3.75Å; F396-L423 HydrophobicContact CD2-CD1 4.29Å; F396-L423 HydrophobicContact CE2-CD1 3.73Å; S421-L423 PolarHBondContact O-N 3.17Å; S421-L423 PolarHBondContact OG-N 3.34Å; S421-L423 VanDerWaalsContact OG-N 3.12Å; S421-L423 PolarHBondContact OG-O 2.91Å; L423-V425 HydrophobicContact CG-CG2 4.31Å; L423-N434 PolarHBondContact O-ND2 2.85Å; L423-N434 PolarHBondContact O-OD1 3.29Å; L423-G436 CarbonylContact O-C 3.59Å; L423-G436 WeakPolarHBondContact O-CA 3.44Å; L423-I439 HydrophobicContact CD2-CD1 3.49Å; L423-I439 VanDerWaalsContact CD2-CD1 3.49Å; L423-L444 HydrophobicContact CB-CD1 4.04Å; L423-L444 HydrophobicContact CB-CD2 4.33Å; L423-L444 HydrophobicContact CD2-CD2 4.3Å
424	N	95.4	Very high	90.9	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.5	179.8	-46.1	-65.8	0	0	0	110.4	W391 E392 C394 V395 F396 F418 Y420 S421 N434	W391-N424 PolarHBondContact O-ND2 2.89Å; E392-N424 PolarHBondContact O-ND2 3.12Å; C394-N424 VanDerWaalsContact O-CB 3.3Å; C394-N424 WeakPolarHBondContact O-CB 3.41Å; C394-N424 PolarHBondContact O-ND2 3.43Å; C394-N424 VanDerWaalsContact O-ND2 3.12Å; V395-N424 WeakPolarHBondContact CA-O 3.17Å; V395-N424 HydrophobicContact CB-CB 4.33Å; V395-N424 HydrophobicContact CG1-CB 4.23Å; V395-N424 HydrophobicContact CG2-CB 3.96Å; F396-N424 WeakPolarHBondContact CD2-O 3.49Å; F396-N424 PolarHBondContact N-O 3.33Å; F418-N424 HydrophobicContact CE1-CB 4.27Å; F418-N424 HydrophobicContact CZ-CB 4.23Å; Y420-N424 WeakPolarHBondContact CA-OD1 3.38Å; S421-N424 PolarHBondContact N-OD1 3.4Å; S421-N424 PolarHBondContact O-ND2 2.99Å; S421-N424 PolarHBondContact O-OD1 2.89Å; N424-N434 PolarHBondContact OD1-ND2 2.98Å
425	V	96.9	Very high	91.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	125.3	173.3	-175.7	0	0	0	0	106.2	L336 I337 F396 L423 N434 P435	L336-V425 HydrophobicContact CB-CG1 3.68Å; L336-V425 HydrophobicContact CD1-CG1 3.76Å; L336-V425 HydrophobicContact CG-CG1 4.41Å; I337-V425 HydrophobicContact CD1-CG2 3.93Å; I337-V425 HydrophobicContact CG1-CG2 3.74Å; F396-V425 HydrophobicContact CB-CG1 4.25Å; F396-V425 HydrophobicContact CB-CG2 4.24Å; F396-V425 HydrophobicContact CD2-CG2 4.12Å; L423-V425 HydrophobicContact CG-CG2 4.31Å; V425-N434 PolarHBondContact N-OD1 2.87Å; V425-N434 WeakPolarHBondContact O-CA 3.46Å; V425-N434 PolarHBondContact O-OD1 3.25Å; V425-P435 WeakPolarHBondContact O-CD 3.33Å
426	E	96.3	Very high	92.1	Very high	0 Å²	0	31 Å²	31	0%	0	14%	0.144	C	C	.	.			trans	-76.9	128.7	173.3	-175.8	-171.6	-138.9	0	0	108.4	V395 F396 R397 P398 H414 V431	V395-E426 HydrophobicContact CG1-CB 3.9Å; F396-E426 PolarHBondContact O-N 3.39Å; R397-E426 VanDerWaalsContact CB-OE2 3.3Å; R397-E426 WeakPolarHBondContact CB-OE2 3.5Å; R397-E426 HydrophobicContact CG-CB 4.21Å; R397-E426 WeakPolarHBondContact CG-OE2 3.45Å; R397-E426 IonicContact CZ-OE1 3.26Å; R397-E426 IonicContact CZ-OE2 2.81Å; R397-E426 IonicContact NE-OE1 2.84Å; R397-E426 PolarHBondContact NE-OE1 3.04Å; R397-E426 IonicContact NE-OE2 2.76Å; R397-E426 PolarHBondContact NE-OE2 3.25Å; R397-E426 IonicContact NH2-OE1 3.77Å; R397-E426 PolarHBondContact NH2-OE1 2.9Å; R397-E426 IonicContact NH2-OE2 3.07Å; P398-E426 WeakPolarHBondContact CD-O 3.3Å; P398-E426 WeakPolarHBondContact CG-O 3.43Å; H414-E426 IonicContact CE1-OE1 3.67Å; H414-E426 IonicContact NE2-OE1 3.27Å; H414-E426 PolarHBondContact NE2-OE1 2.83Å; H414-E426 VanDerWaalsContact NE2-OE1 3.17Å; E426-V431 HydrophobicContact CG-CB 4.4Å
427	D	96.2	Very high	92.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.135	C	C	.	.			trans	-71.4	129.1	167.3	-174.1	-65.6	0	0	0	109.6	K289 Y332 F429 E430 V431 H433 P435	K289-D427 WeakPolarHBondContact CD-OD2 3.39Å; K289-D427 VanDerWaalsContact CE-CG 3.4Å; K289-D427 WeakPolarHBondContact CE-OD1 3.13Å; K289-D427 WeakPolarHBondContact CE-OD2 3.48Å; K289-D427 VanDerWaalsContact NZ-CG 3.27Å; K289-D427 IonicContact NZ-OD1 3.46Å; K289-D427 PolarHBondContact NZ-OD1 2.95Å; K289-D427 IonicContact NZ-OD2 3.27Å; K289-D427 PolarHBondContact NZ-OD2 3.4Å; Y332-D427 WeakPolarHBondContact CE1-OD2 3.45Å; Y332-D427 PolarHBondContact OH-OD2 2.95Å; Y332-D427 VanDerWaalsContact OH-OD2 3.08Å; D427-F429 PolarHBondContact O-N 3.09Å; D427-F429 VanDerWaalsContact O-N 3.14Å; D427-F429 PolarHBondContact OD1-N 3.45Å; D427-E430 HydrophobicContact CB-CB 4.28Å; D427-E430 WeakPolarHBondContact CB-O 3.38Å; D427-E430 PolarHBondContact OD1-N 3.42Å; D427-V431 WeakPolarHBondContact O-CA 3.34Å; D427-H433 HydrophobicContact CB-CB 4.06Å; D427-H433 PolarHBondContact N-O 3.28Å; D427-H433 VanDerWaalsContact N-O 3.13Å; D427-H433 IonicContact OD2-CD2 3.59Å; D427-P435 HydrophobicContact CB-CG 4.29Å
428	P	96.3	Very high	92.7	Very high	4 Å²	4	27.4 Å²	27.4	3%	0.026	14%	0.137	C	C	.	.	S	Bend	trans	-66.2	-21.1	-170.3	22.8	-31.9	0	0	0	114.7	W292 L336 A351 P398 R399	W292-P428 HydrophobicContact CE3-CG 4.08Å; W292-P428 HydrophobicContact CH2-CG 4.02Å; W292-P428 HydrophobicContact CZ3-CG 3.61Å; L336-P428 HydrophobicContact CD2-CG 4.26Å; A351-P428 HydrophobicContact CB-CB 3.51Å; A351-P428 HydrophobicContact CB-CG 4.42Å; P398-P428 HydrophobicContact CG-CB 4.34Å; P398-P428 HydrophobicContact CG-CG 4.38Å; R399-P428 HydrophobicContact CB-CB 4.39Å
429	F	94.9	Very high	92.5	Very high	48 Å²	48	27.8 Å²	27.8	21%	0.211	14%	0.139	C	C	.	.	S	Bend	trans	-117.9	-26.4	-178	-57	-69.4	0	0	0	112.9	Y285 T288 K289 W292 A351 Y354 D427	Y285-F429 HydrophobicContact CD1-CB 4.33Å; Y285-F429 WeakPolarHBondContact CE1-O 3.29Å; T288-F429 HydrophobicContact CG2-CB 4.5Å; T288-F429 HydrophobicContact CG2-CD1 3.98Å; T288-F429 HydrophobicContact CG2-CD2 4.18Å; T288-F429 HydrophobicContact CG2-CE1 4.26Å; T288-F429 HydrophobicContact CG2-CE2 4.44Å; T288-F429 HydrophobicContact CG2-CG 3.94Å; T288-F429 HydrophobicContact CG2-CZ 4.49Å; K289-F429 HydrophobicContact CG-CD2 3.84Å; W292-F429 HydrophobicContact CB-CE2 3.58Å; W292-F429 HydrophobicContact CB-CZ 3.63Å; W292-F429 AromaticContact CD2-CE2 3.77Å; W292-F429 HydrophobicContact CD2-CE2 3.77Å; W292-F429 AromaticContact CD2-CZ 3.96Å; W292-F429 HydrophobicContact CD2-CZ 3.96Å; W292-F429 AromaticContact CE3-CE2 3.75Å; W292-F429 HydrophobicContact CE3-CE2 3.75Å; W292-F429 HydrophobicContact CE3-CZ 4.4Å; W292-F429 AromaticContact CG-CE2 3.73Å; W292-F429 HydrophobicContact CG-CE2 3.73Å; W292-F429 AromaticContact CG-CZ 3.62Å; W292-F429 HydrophobicContact CG-CZ 3.62Å; A351-F429 HydrophobicContact CB-CZ 4.45Å; Y354-F429 AromaticContact CD1-CE1 3.93Å; Y354-F429 HydrophobicContact CD1-CE1 3.93Å; Y354-F429 AromaticContact CD1-CZ 3.7Å; Y354-F429 HydrophobicContact CD1-CZ 3.7Å; Y354-F429 HydrophobicContact CE1-CZ 4.36Å; Y354-F429 HydrophobicContact CG-CZ 4.44Å; D427-F429 PolarHBondContact O-N 3.09Å; D427-F429 VanDerWaalsContact O-N 3.14Å; D427-F429 PolarHBondContact OD1-N 3.45Å
430	E	92.6	Very high	92.3	Very high	37 Å²	37	25.4 Å²	25.4	17%	0.173	13%	0.133	C	C	.	.	S	Bend	trans	-110.6	67.7	174.3	-167.7	177.4	-164.4	0	0	108.9	H263 Y285 K289 D427 E432 H433	H263-E430 IonicContact CE1-OE1 3.6Å; H263-E430 PolarHBondContact CE1-OE1 3.26Å; H263-E430 IonicContact CE1-OE2 3.16Å; H263-E430 IonicContact NE2-OE1 3.58Å; H263-E430 PolarHBondContact NE2-OE1 2.95Å; Y285-E430 HydrophobicContact CD1-CB 3.94Å; Y285-E430 HydrophobicContact CD1-CG 4.48Å; Y285-E430 HydrophobicContact CD2-CB 4.49Å; Y285-E430 HydrophobicContact CD2-CG 4.19Å; Y285-E430 HydrophobicContact CE1-CB 4.05Å; Y285-E430 HydrophobicContact CE1-CG 4.43Å; Y285-E430 HydrophobicContact CE2-CG 4.13Å; Y285-E430 HydrophobicContact CG-CB 4.19Å; Y285-E430 HydrophobicContact CG-CG 4.38Å; K289-E430 IonicContact NZ-OE2 3.64Å; K289-E430 PolarHBondContact NZ-OE2 3.48Å; D427-E430 HydrophobicContact CB-CB 4.28Å; D427-E430 WeakPolarHBondContact CB-O 3.38Å; D427-E430 PolarHBondContact OD1-N 3.42Å; E430-E432 PolarHBondContact O-N 2.87Å; E430-H433 HydrophobicContact CB-CB 4.09Å; E430-H433 HydrophobicContact CG-CB 3.79Å; E430-H433 WeakPolarHBondContact O-CA 3.47Å; E430-H433 WeakPolarHBondContact O-CB 3.46Å; E430-H433 PolarHBondContact O-N 3.44Å
431	V	91.7	Very high	92	Very high	40 Å²	40	30.3 Å²	30.3	24%	0.242	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-21.2	-166.5	-61.6	0	0	0	0	115.6	F418 E426 D427 H433	F418-V431 WeakPolarHBondContact CD2-O 3.31Å; E426-V431 HydrophobicContact CG-CB 4.4Å; D427-V431 WeakPolarHBondContact O-CA 3.34Å; V431-H433 VanDerWaalsContact C-N 3.3Å
432	E	89.9	Confident	91.5	Very high	73 Å²	73	34.1 Å²	34.1	34%	0.341	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-11.7	174.8	-58.7	177.3	154.2	0	0	112.8	S415 K417 F418 E430	S415-E432 PolarHBondContact OG-OE1 2.99Å; K417-E432 HydrophobicContact CB-CB 3.89Å; K417-E432 HydrophobicContact CB-CG 4.15Å; K417-E432 HydrophobicContact CD-CG 4.4Å; K417-E432 VanDerWaalsContact CD-OE1 3.3Å; K417-E432 WeakPolarHBondContact CD-OE1 3.42Å; K417-E432 WeakPolarHBondContact CD-OE2 3.49Å; K417-E432 IonicContact NZ-OE1 3.98Å; K417-E432 PolarHBondContact NZ-OE1 2.85Å; K417-E432 IonicContact NZ-OE2 2.75Å; K417-E432 PolarHBondContact NZ-OE2 3.15Å; F418-E432 WeakPolarHBondContact CA-O 3.49Å; E430-E432 PolarHBondContact O-N 2.87Å
433	H	92.4	Very high	91.2	Very high	50 Å²	50	30.8 Å²	30.8	23%	0.231	16%	0.163	C	C	.	.			trans	-91.7	131	-178.2	-175	74	0	0	0	111.4	H263 D427 E430 V431 P435	H263-H433 AromaticContact CD2-ND1 3.79Å; H263-H433 AromaticContact CE1-ND1 3.69Å; H263-H433 AromaticContact NE2-CE1 3.7Å; H263-H433 AromaticContact NE2-CG 3.84Å; H263-H433 AromaticContact NE2-ND1 2.99Å; H263-H433 PolarHBondContact NE2-ND1 3.15Å; D427-H433 HydrophobicContact CB-CB 4.06Å; D427-H433 PolarHBondContact N-O 3.28Å; D427-H433 VanDerWaalsContact N-O 3.13Å; D427-H433 IonicContact OD2-CD2 3.59Å; E430-H433 HydrophobicContact CB-CB 4.09Å; E430-H433 HydrophobicContact CG-CB 3.79Å; E430-H433 WeakPolarHBondContact O-CA 3.47Å; E430-H433 WeakPolarHBondContact O-CB 3.46Å; E430-H433 PolarHBondContact O-N 3.44Å; V431-H433 VanDerWaalsContact C-N 3.3Å; H433-P435 WeakPolarHBondContact O-CD 3.22Å
434	N	94	Very high	91	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.016	16%	0.164	C	C	.	.			trans	-109.7	97.9	172.6	179.6	3.7	0	0	0	111	F418 K419 L423 N424 V425 G436 S437	F418-N434 HydrophobicContact CE1-CB 4.47Å; F418-N434 HydrophobicContact CE2-CB 3.92Å; F418-N434 HydrophobicContact CZ-CB 3.87Å; K419-N434 WeakPolarHBondContact O-CB 3.36Å; K419-N434 PolarHBondContact O-ND2 2.97Å; L423-N434 PolarHBondContact O-ND2 2.85Å; L423-N434 PolarHBondContact O-OD1 3.29Å; N424-N434 PolarHBondContact OD1-ND2 2.98Å; V425-N434 PolarHBondContact N-OD1 2.87Å; V425-N434 WeakPolarHBondContact O-CA 3.46Å; V425-N434 PolarHBondContact O-OD1 3.25Å; N434-G436 PolarHBondContact O-N 2.9Å; N434-G436 VanDerWaalsContact O-N 3.16Å; N434-G436 VanDerWaalsContact OD1-CA 3.28Å; N434-G436 WeakPolarHBondContact OD1-CA 3.48Å; N434-G436 PolarHBondContact OD1-N 3.38Å; N434-S437 VanDerWaalsContact O-CB 3.25Å; N434-S437 WeakPolarHBondContact O-CB 3.43Å; N434-S437 PolarHBondContact O-N 2.91Å; N434-S437 PolarHBondContact O-OG 3.26Å; N434-S437 PolarHBondContact OD1-N 3.43Å
435	P	93.4	Very high	90.5	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.019	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-58.1	-25	174.1	-27.8	37.2	0	0	0	114.1	Y332 C333 L336 V425 D427 H433 S437	Y332-P435 HydrophobicContact CD1-CB 4.12Å; Y332-P435 HydrophobicContact CD1-CG 4.05Å; Y332-P435 HydrophobicContact CE1-CB 4.36Å; Y332-P435 HydrophobicContact CE1-CG 3.78Å; C333-P435 HydrophobicContact CB-CB 4Å; L336-P435 HydrophobicContact CD1-CG 3.97Å; V425-P435 WeakPolarHBondContact O-CD 3.33Å; D427-P435 HydrophobicContact CB-CG 4.29Å; H433-P435 WeakPolarHBondContact O-CD 3.22Å; P435-S437 VanDerWaalsContact C-N 3.29Å; P435-S437 PolarHBondContact O-N 3.39Å
436	G	93.3	Very high	89.9	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-72.7	-16.8	176.9	0	0	0	0	0	114.1	S421 L423 N434 T438 I439	S421-G436 PolarHBondContact OG-O 3.23Å; L423-G436 CarbonylContact O-C 3.59Å; L423-G436 WeakPolarHBondContact O-CA 3.44Å; N434-G436 PolarHBondContact O-N 2.9Å; N434-G436 VanDerWaalsContact O-N 3.16Å; N434-G436 VanDerWaalsContact OD1-CA 3.28Å; N434-G436 WeakPolarHBondContact OD1-CA 3.48Å; N434-G436 PolarHBondContact OD1-N 3.38Å; G436-T438 PolarHBondContact O-N 3.45Å; G436-I439 WeakPolarHBondContact O-CB 3.46Å; G436-I439 PolarHBondContact O-N 3.11Å
437	S	89.6	Confident	89.5	Confident	37 Å²	37	34.1 Å²	34.1	26%	0.259	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-62.2	-13	-175.5	66.8	0	0	0	0	116	S421 N434 P435	S421-S437 WeakPolarHBondContact OG-CA 3.41Å; N434-S437 VanDerWaalsContact O-CB 3.25Å; N434-S437 WeakPolarHBondContact O-CB 3.43Å; N434-S437 PolarHBondContact O-N 2.91Å; N434-S437 PolarHBondContact O-OG 3.26Å; N434-S437 PolarHBondContact OD1-N 3.43Å; P435-S437 VanDerWaalsContact C-N 3.29Å; P435-S437 PolarHBondContact O-N 3.39Å
438	T	84.7	Confident	89.1	Confident	93 Å²	93	36.9 Å²	36.9	57%	0.571	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-90.2	-11.9	176.2	59.7	0	0	0	0	113.4	G436	G436-T438 PolarHBondContact O-N 3.45Å
439	I	87.6	Confident	88.4	Confident	8 Å²	8	37.3 Å²	37.3	4%	0.041	19%	0.194	C	C	.	.			trans	-84.8	123.6	-178.3	-63.8	165.6	0	0	0	108.9	F329 L423 G436 V443 L444	F329-I439 HydrophobicContact CD1-CD1 4Å; F329-I439 HydrophobicContact CD2-CD1 4.09Å; F329-I439 HydrophobicContact CE1-CD1 3.67Å; F329-I439 HydrophobicContact CE2-CD1 3.79Å; F329-I439 HydrophobicContact CG-CD1 4.21Å; F329-I439 HydrophobicContact CZ-CD1 3.57Å; L423-I439 HydrophobicContact CD2-CD1 3.49Å; L423-I439 VanDerWaalsContact CD2-CD1 3.49Å; G436-I439 WeakPolarHBondContact O-CB 3.46Å; G436-I439 PolarHBondContact O-N 3.11Å; I439-V443 HydrophobicContact CG2-CB 4.28Å; I439-V443 HydrophobicContact CG2-CG1 4.22Å; I439-L444 HydrophobicContact CG2-CD1 4.45Å; I439-L444 HydrophobicContact CG2-CD2 3.65Å; I439-L444 HydrophobicContact CG2-CG 3.83Å
440	V	84.5	Confident	88	Confident	60 Å²	60	35.2 Å²	35.2	36%	0.364	19%	0.186	S	C	.	.			trans	-88.5	148.4	-177.8	-63	0	0	0	0	111.2	T327 T442 V443 L444	T327-V440 HydrophobicContact CG2-CG2 4.45Å; V440-T442 WeakPolarHBondContact CG2-OG1 3.45Å; V440-T442 PolarHBondContact O-N 3.36Å; V440-T442 VanDerWaalsContact O-N 3.09Å; V440-V443 HydrophobicContact CG2-CB 4.29Å; V440-V443 HydrophobicContact CG2-CG2 3.69Å; V440-V443 WeakPolarHBondContact O-CB 3.3Å; V440-V443 PolarHBondContact O-N 3.48Å; V440-L444 PolarHBondContact O-N 2.93Å
441	Y	84.6	Confident	87.8	Confident	104 Å²	104	33.5 Å²	33.5	41%	0.408	18%	0.177	S	C	.	.	H	α-helix	trans	-45.4	-43.8	178.6	177.3	-105.1	0	0	0	113.9	W422 V443 L444 E445	W422-Y441 HydrophobicContact CD2-CD2 4.02Å; W422-Y441 HydrophobicContact CD2-CG 4.38Å; W422-Y441 AromaticContact CE3-CD2 3.79Å; W422-Y441 HydrophobicContact CE3-CD2 3.79Å; W422-Y441 HydrophobicContact CZ3-CD2 4.12Å; Y441-V443 PolarHBondContact O-N 3.44Å; Y441-L444 PolarHBondContact O-N 3.49Å; Y441-L444 VanDerWaalsContact O-N 3.08Å; Y441-E445 HydrophobicContact CD1-CG 4Å; Y441-E445 HydrophobicContact CD2-CG 4.26Å; Y441-E445 HydrophobicContact CE1-CG 3.47Å; Y441-E445 VanDerWaalsContact CE1-CG 3.47Å; Y441-E445 HydrophobicContact CE2-CG 3.75Å; Y441-E445 WeakPolarHBondContact CE2-OE1 3.28Å; Y441-E445 HydrophobicContact CG-CG 4.37Å; Y441-E445 VanDerWaalsContact CZ-CD 3.5Å; Y441-E445 PolarHBondContact O-N 3.38Å; Y441-E445 VanDerWaalsContact OH-CD 3.24Å; Y441-E445 PolarHBondContact OH-OE1 3.09Å
442	T	82.7	Confident	87.4	Confident	81 Å²	81	33.6 Å²	33.6	50%	0.497	18%	0.176	S	C	.	.	H	α-helix	trans	-63.4	-28	-178.8	55.7	0	0	0	0	114.1	V440 S446	V440-T442 WeakPolarHBondContact CG2-OG1 3.45Å; V440-T442 PolarHBondContact O-N 3.36Å; V440-T442 VanDerWaalsContact O-N 3.09Å; T442-S446 PolarHBondContact O-N 3.06Å; T442-S446 PolarHBondContact O-OG 3.17Å
443	V	84.9	Confident	87.1	Confident	3 Å²	3	30.7 Å²	30.7	2%	0.018	16%	0.162	C	C	.	.	H	α-helix	trans	-72.4	-43.6	174.8	171.2	0	0	0	0	109.5	L319 F329 I439 V440 Y441 S446 L447	L319-V443 HydrophobicContact CD1-CG1 4.18Å; L319-V443 HydrophobicContact CD2-CG1 4.2Å; F329-V443 HydrophobicContact CD2-CG1 4.32Å; I439-V443 HydrophobicContact CG2-CB 4.28Å; I439-V443 HydrophobicContact CG2-CG1 4.22Å; V440-V443 HydrophobicContact CG2-CB 4.29Å; V440-V443 HydrophobicContact CG2-CG2 3.69Å; V440-V443 WeakPolarHBondContact O-CB 3.3Å; V440-V443 PolarHBondContact O-N 3.48Å; Y441-V443 PolarHBondContact O-N 3.44Å; V443-S446 WeakPolarHBondContact O-CB 3.26Å; V443-S446 PolarHBondContact O-N 3.35Å; V443-L447 WeakPolarHBondContact O-CB 3.27Å; V443-L447 PolarHBondContact O-N 3.34Å
444	L	88.3	Confident	86.6	Confident	5 Å²	5	28.5 Å²	28.5	3%	0.026	15%	0.153	C	C	.	.	H	α-helix	trans	-64.3	-42.3	177.9	-61.8	179	0	0	0	112.1	W391 W422 L423 I439 V440 Y441 S446 L447 K448	W391-L444 HydrophobicContact CE3-CB 3.96Å; W391-L444 HydrophobicContact CE3-CD1 4.22Å; W391-L444 HydrophobicContact CE3-CD2 3.79Å; W391-L444 HydrophobicContact CE3-CG 4.2Å; W391-L444 HydrophobicContact CZ3-CB 3.88Å; W391-L444 HydrophobicContact CZ3-CD2 3.86Å; W391-L444 HydrophobicContact CZ3-CG 4.38Å; W422-L444 HydrophobicContact CB-CD1 3.5Å; W422-L444 WeakPolarHBondContact O-CD1 3.18Å; L423-L444 HydrophobicContact CB-CD1 4.04Å; L423-L444 HydrophobicContact CB-CD2 4.33Å; L423-L444 HydrophobicContact CD2-CD2 4.3Å; I439-L444 HydrophobicContact CG2-CD1 4.45Å; I439-L444 HydrophobicContact CG2-CD2 3.65Å; I439-L444 HydrophobicContact CG2-CG 3.83Å; V440-L444 PolarHBondContact O-N 2.93Å; Y441-L444 PolarHBondContact O-N 3.49Å; Y441-L444 VanDerWaalsContact O-N 3.08Å; L444-S446 VanDerWaalsContact C-N 3.28Å; L444-S446 PolarHBondContact O-N 2.97Å; L444-L447 CarbonylContact O-C 3.59Å; L444-L447 WeakPolarHBondContact O-CA 3.41Å; L444-L447 WeakPolarHBondContact O-CB 3.5Å; L444-L447 PolarHBondContact O-N 3.24Å; L444-L447 VanDerWaalsContact O-N 3.07Å; L444-K448 WeakPolarHBondContact O-CG 3.41Å; L444-K448 PolarHBondContact O-N 3.11Å
445	E	86.1	Confident	86	Confident	50 Å²	50	32.7 Å²	32.7	23%	0.234	17%	0.169	C	C	.	.	H	α-helix	trans	-62.2	-36.7	174.8	-70.9	-57.8	121.4	0	0	112.4	Y441 L447 K448 I449	Y441-E445 HydrophobicContact CD1-CG 4Å; Y441-E445 HydrophobicContact CD2-CG 4.26Å; Y441-E445 HydrophobicContact CE1-CG 3.47Å; Y441-E445 VanDerWaalsContact CE1-CG 3.47Å; Y441-E445 HydrophobicContact CE2-CG 3.75Å; Y441-E445 WeakPolarHBondContact CE2-OE1 3.28Å; Y441-E445 HydrophobicContact CG-CG 4.37Å; Y441-E445 VanDerWaalsContact CZ-CD 3.5Å; Y441-E445 PolarHBondContact O-N 3.38Å; Y441-E445 VanDerWaalsContact OH-CD 3.24Å; Y441-E445 PolarHBondContact OH-OE1 3.09Å; E445-L447 VanDerWaalsContact C-N 3.34Å; E445-K448 WeakPolarHBondContact OE1-CE 3.34Å; E445-K448 IonicContact OE1-NZ 3.1Å; E445-K448 PolarHBondContact OE1-NZ 3.31Å; E445-I449 PolarHBondContact O-N 2.85Å
446	S	83.6	Confident	85.3	Confident	14 Å²	14	38 Å²	38	10%	0.098	19%	0.193	C	C	.	.	H	α-helix	trans	-67.6	-39.3	173.3	-56.1	0	0	0	0	111	T442 V443 L444 I449 I450	T442-S446 PolarHBondContact O-N 3.06Å; T442-S446 PolarHBondContact O-OG 3.17Å; V443-S446 WeakPolarHBondContact O-CB 3.26Å; V443-S446 PolarHBondContact O-N 3.35Å; L444-S446 VanDerWaalsContact C-N 3.28Å; L444-S446 PolarHBondContact O-N 2.97Å; S446-I449 PolarHBondContact O-N 3.48Å; S446-I450 WeakPolarHBondContact O-CD1 3.27Å; S446-I450 WeakPolarHBondContact O-CG1 3.5Å; S446-I450 PolarHBondContact O-N 2.91Å; S446-I450 VanDerWaalsContact O-N 3.1Å
447	L	87.3	Confident	84.4	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-65.1	-40.4	177.7	-176.5	54.5	0	0	0	112.3	L315 L319 F329 W391 V443 L444 E445 I449 I450 L451	L315-L447 HydrophobicContact CD1-CD1 3.38Å; L315-L447 HydrophobicContact CD1-CD2 4.4Å; L319-L447 HydrophobicContact CD2-CB 4.43Å; F329-L447 HydrophobicContact CE2-CD2 3.95Å; W391-L447 HydrophobicContact CH2-CB 4.28Å; W391-L447 HydrophobicContact CH2-CD2 3.72Å; W391-L447 HydrophobicContact CH2-CG 3.85Å; W391-L447 HydrophobicContact CZ2-CD2 4.34Å; W391-L447 HydrophobicContact CZ3-CD2 4.34Å; V443-L447 WeakPolarHBondContact O-CB 3.27Å; V443-L447 PolarHBondContact O-N 3.34Å; L444-L447 CarbonylContact O-C 3.59Å; L444-L447 WeakPolarHBondContact O-CA 3.41Å; L444-L447 WeakPolarHBondContact O-CB 3.5Å; L444-L447 PolarHBondContact O-N 3.24Å; L444-L447 VanDerWaalsContact O-N 3.07Å; E445-L447 VanDerWaalsContact C-N 3.34Å; L447-I449 VanDerWaalsContact C-N 3.28Å; L447-I449 PolarHBondContact O-N 3.26Å; L447-I450 HydrophobicContact CD1-CB 4.42Å; L447-I450 WeakPolarHBondContact O-CB 2.96Å; L447-I450 PolarHBondContact O-N 2.97Å; L447-I450 VanDerWaalsContact O-N 3.09Å; L447-L451 HydrophobicContact CD1-CD1 4.24Å; L447-L451 HydrophobicContact CD1-CD2 4.5Å; L447-L451 HydrophobicContact CD1-CG 3.99Å; L447-L451 HydrophobicContact CG-CD1 3.85Å; L447-L451 HydrophobicContact CG-CG 4.14Å; L447-L451 WeakPolarHBondContact O-CB 3.03Å; L447-L451 VanDerWaalsContact O-CG 3.29Å; L447-L451 WeakPolarHBondContact O-CG 3.19Å; L447-L451 PolarHBondContact O-N 2.99Å
448	K	88.5	Confident	83.6	Confident	59 Å²	59	41.3 Å²	41.3	26%	0.257	21%	0.206	S	C	.	.	H	α-helix	trans	-53.5	-46.3	174.2	-74.3	175.2	-176.5	175.8	0	111.8	S388 W391 L444 E445 L451 M452	S388-K448 WeakPolarHBondContact O-CE 3.38Å; W391-K448 HydrophobicContact CH2-CG 4.35Å; W391-K448 HydrophobicContact CZ3-CG 3.96Å; L444-K448 WeakPolarHBondContact O-CG 3.41Å; L444-K448 PolarHBondContact O-N 3.11Å; E445-K448 WeakPolarHBondContact OE1-CE 3.34Å; E445-K448 IonicContact OE1-NZ 3.1Å; E445-K448 PolarHBondContact OE1-NZ 3.31Å; K448-L451 PolarHBondContact O-N 3.49Å; K448-M452 WeakPolarHBondContact O-CB 3.27Å; K448-M452 PolarHBondContact O-N 3.14Å
449	I	82.6	Confident	82.8	Confident	12 Å²	12	43 Å²	43	6%	0.062	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-42	178	-59.6	166.5	0	0	0	110.9	E445 S446 L447 M452 N453 L474 C477 R478 L481	E445-I449 PolarHBondContact O-N 2.85Å; S446-I449 PolarHBondContact O-N 3.48Å; L447-I449 VanDerWaalsContact C-N 3.28Å; L447-I449 PolarHBondContact O-N 3.26Å; I449-M452 PolarHBondContact O-N 3.07Å; I449-N453 VanDerWaalsContact O-CG 3.25Å; I449-N453 PolarHBondContact O-N 3.32Å; I449-N453 VanDerWaalsContact O-N 3.08Å; I449-N453 PolarHBondContact O-ND2 3.44Å; I449-L474 HydrophobicContact CB-CD2 4.47Å; I449-L474 HydrophobicContact CD1-CD2 4.39Å; I449-L474 HydrophobicContact CG2-CD2 3.73Å; I449-L474 HydrophobicContact CG2-CG 4.46Å; I449-C477 HydrophobicContact CG2-CB 4.36Å; I449-R478 HydrophobicContact CD1-CG 4.1Å; I449-L481 HydrophobicContact CG1-CD1 4.2Å
450	I	85.1	Confident	81.8	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-61.1	-45.5	176.7	-68	159.3	0	0	0	110.6	W314 H318 L319 T322 S446 L447 N453 A454	W314-I450 HydrophobicContact CH2-CG2 3.91Å; W314-I450 HydrophobicContact CZ2-CG2 3.68Å; H318-I450 HydrophobicContact CB-CD1 3.65Å; H318-I450 HydrophobicContact CB-CG1 4.04Å; H318-I450 HydrophobicContact CB-CG2 3.87Å; L319-I450 HydrophobicContact CD2-CD1 3.79Å; L319-I450 HydrophobicContact CG-CD1 4.42Å; T322-I450 HydrophobicContact CG2-CD1 4.47Å; S446-I450 WeakPolarHBondContact O-CD1 3.27Å; S446-I450 WeakPolarHBondContact O-CG1 3.5Å; S446-I450 PolarHBondContact O-N 2.91Å; S446-I450 VanDerWaalsContact O-N 3.1Å; L447-I450 HydrophobicContact CD1-CB 4.42Å; L447-I450 WeakPolarHBondContact O-CB 2.96Å; L447-I450 PolarHBondContact O-N 2.97Å; L447-I450 VanDerWaalsContact O-N 3.09Å; I450-N453 PolarHBondContact O-N 2.99Å; I450-A454 VanDerWaalsContact O-CB 3.22Å; I450-A454 WeakPolarHBondContact O-CB 3.41Å; I450-A454 PolarHBondContact O-N 3.02Å
451	L	88.6	Confident	80.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.1	-41.9	180	-70.9	167.1	0	0	0	112.1	W314 V381 L384 Y385 W391 L447 K448 A454 R455	W314-L451 HydrophobicContact CH2-CD2 3.97Å; V381-L451 HydrophobicContact CG1-CD2 4.23Å; L384-L451 HydrophobicContact CB-CD1 3.82Å; L384-L451 HydrophobicContact CB-CD2 3.6Å; L384-L451 HydrophobicContact CB-CG 4.38Å; L384-L451 HydrophobicContact CD1-CD2 4.05Å; Y385-L451 HydrophobicContact CD2-CB 3.99Å; W391-L451 HydrophobicContact CH2-CD1 3.64Å; W391-L451 HydrophobicContact CZ2-CD1 3.78Å; L447-L451 HydrophobicContact CD1-CD1 4.24Å; L447-L451 HydrophobicContact CD1-CD2 4.5Å; L447-L451 HydrophobicContact CD1-CG 3.99Å; L447-L451 HydrophobicContact CG-CD1 3.85Å; L447-L451 HydrophobicContact CG-CG 4.14Å; L447-L451 WeakPolarHBondContact O-CB 3.03Å; L447-L451 VanDerWaalsContact O-CG 3.29Å; L447-L451 WeakPolarHBondContact O-CG 3.19Å; L447-L451 PolarHBondContact O-N 2.99Å; K448-L451 PolarHBondContact O-N 3.49Å; L451-A454 PolarHBondContact O-N 2.74Å; L451-R455 WeakPolarHBondContact O-CB 3.46Å; L451-R455 PolarHBondContact O-N 2.96Å
452	M	84.8	Confident	78.6	Confident	42 Å²	42	48.2 Å²	48.2	21%	0.207	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-51.6	176.2	-168.5	-177.9	77.9	0	0	111	Y385 K448 I449 A454 R455 E456 C477	Y385-M452 HydrophobicContact CD2-CB 4.41Å; Y385-M452 HydrophobicContact CE2-CB 3.81Å; Y385-M452 HydrophobicContact CE2-CG 4.04Å; K448-M452 WeakPolarHBondContact O-CB 3.27Å; K448-M452 PolarHBondContact O-N 3.14Å; I449-M452 PolarHBondContact O-N 3.07Å; M452-A454 VanDerWaalsContact C-N 3.35Å; M452-A454 PolarHBondContact O-N 3Å; M452-R455 PolarHBondContact O-N 3.04Å; M452-E456 PolarHBondContact O-N 2.73Å; M452-C477 HydrophobicContact CE-CB 3.83Å; M452-C477 VanDerWaalsContact CE-SG 3.57Å
453	N	81.6	Confident	77.2	Confident	12 Å²	12	45.9 Å²	45.9	6%	0.064	25%	0.246	C	C	.	.	H	α-helix	trans	-63	-41.8	178.5	-66.3	-16.9	0	0	0	111.8	I449 I450 R455 E456 E457 I470	I449-N453 VanDerWaalsContact O-CG 3.25Å; I449-N453 PolarHBondContact O-N 3.32Å; I449-N453 VanDerWaalsContact O-N 3.08Å; I449-N453 PolarHBondContact O-ND2 3.44Å; I450-N453 PolarHBondContact O-N 2.99Å; N453-R455 VanDerWaalsContact C-N 3.33Å; N453-R455 PolarHBondContact O-N 3.48Å; N453-E456 PolarHBondContact O-N 3.13Å; N453-E457 WeakPolarHBondContact O-CB 3.18Å; N453-E457 PolarHBondContact O-N 3.33Å; N453-I470 HydrophobicContact CB-CD1 4.11Å; N453-I470 HydrophobicContact CB-CG2 4.1Å
454	A	82.8	Confident	75.5	Confident	4 Å²	4	52.4 Å²	52.4	3%	0.033	28%	0.28	C	S	.	.	H	α-helix	trans	-62.6	-42.4	177.6	0	0	0	0	0	110.8	W314 V381 I450 L451 M452 E456 E457 L458	W314-A454 HydrophobicContact CZ2-CB 3.85Å; V381-A454 HydrophobicContact CG1-CB 4.03Å; I450-A454 VanDerWaalsContact O-CB 3.22Å; I450-A454 WeakPolarHBondContact O-CB 3.41Å; I450-A454 PolarHBondContact O-N 3.02Å; L451-A454 PolarHBondContact O-N 2.74Å; M452-A454 VanDerWaalsContact C-N 3.35Å; M452-A454 PolarHBondContact O-N 3Å; A454-E456 PolarHBondContact O-N 3.24Å; A454-E457 PolarHBondContact O-N 3.33Å; A454-L458 HydrophobicContact CB-CD1 4.33Å; A454-L458 WeakPolarHBondContact O-CB 3.48Å; A454-L458 VanDerWaalsContact O-CD1 3.27Å; A454-L458 WeakPolarHBondContact O-CD1 3.4Å; A454-L458 WeakPolarHBondContact O-CG 3.18Å; A454-L458 PolarHBondContact O-N 3.35Å
455	R	81	Confident	73.9	Confident	92 Å²	92	53.4 Å²	53.4	35%	0.347	29%	0.285	S	S	.	.	H	α-helix	trans	-61.1	-44.5	176.7	-174.3	177.9	-179.3	-145.4	-1.2	112	L451 M452 N453 Q459	L451-R455 WeakPolarHBondContact O-CB 3.46Å; L451-R455 PolarHBondContact O-N 2.96Å; M452-R455 PolarHBondContact O-N 3.04Å; N453-R455 VanDerWaalsContact C-N 3.33Å; N453-R455 PolarHBondContact O-N 3.48Å; R455-Q459 WeakPolarHBondContact O-CB 3.26Å; R455-Q459 VanDerWaalsContact O-CG 3.26Å; R455-Q459 WeakPolarHBondContact O-CG 3.17Å; R455-Q459 PolarHBondContact O-N 3.07Å; R455-Q459 VanDerWaalsContact O-N 3.11Å
456	E	79	Confident	72.4	Confident	114 Å²	114	51.8 Å²	51.8	53%	0.533	28%	0.279	S	S	.	.	H	α-helix	trans	-62.5	-45.4	176.2	-71.2	173.2	-171.4	0	0	111.9	M452 N453 A454 Q459	M452-E456 PolarHBondContact O-N 2.73Å; N453-E456 PolarHBondContact O-N 3.13Å; A454-E456 PolarHBondContact O-N 3.24Å; E456-Q459 PolarHBondContact O-N 3.48Å
457	E	75.6	Confident	71.4	Confident	66 Å²	66	52.3 Å²	52.3	31%	0.308	28%	0.28	S	S	.	.	H	α-helix	trans	-64.5	-45	178.9	-171.7	170.2	-174	0	0	111.1	N453 A454 Q459 S460 S463	N453-E457 WeakPolarHBondContact O-CB 3.18Å; N453-E457 PolarHBondContact O-N 3.33Å; A454-E457 PolarHBondContact O-N 3.33Å; E457-Q459 VanDerWaalsContact C-N 3.27Å; E457-Q459 PolarHBondContact O-N 3.45Å; E457-S460 WeakPolarHBondContact O-CB 3.44Å; E457-S460 PolarHBondContact O-N 2.91Å; E457-S463 WeakPolarHBondContact O-CB 3.24Å; E457-S463 PolarHBondContact O-OG 3.08Å
458	L	71.6	Confident	70	Confident	41 Å²	41	59.4 Å²	59.4	22%	0.215	31%	0.307	C	S	.	.	H	α-helix	trans	-70.8	-18.9	-177.8	-67.7	166.4	0	0	0	113.8	L378 V381 A454 S460 P466	L378-L458 HydrophobicContact CD2-CB 3.74Å; L378-L458 HydrophobicContact CD2-CD1 3.57Å; L378-L458 HydrophobicContact CD2-CD2 3.3Å; L378-L458 HydrophobicContact CD2-CG 3.68Å; V381-L458 HydrophobicContact CB-CD1 4.22Å; V381-L458 HydrophobicContact CG1-CD1 3.96Å; V381-L458 HydrophobicContact CG2-CD1 4.23Å; A454-L458 HydrophobicContact CB-CD1 4.33Å; A454-L458 WeakPolarHBondContact O-CB 3.48Å; A454-L458 VanDerWaalsContact O-CD1 3.27Å; A454-L458 WeakPolarHBondContact O-CD1 3.4Å; A454-L458 WeakPolarHBondContact O-CG 3.18Å; A454-L458 PolarHBondContact O-N 3.35Å; L458-S460 VanDerWaalsContact C-N 3.34Å; L458-P466 HydrophobicContact CD2-CB 3.75Å; L458-P466 HydrophobicContact CD2-CG 3.73Å
459	Q	68.5	Low	68.2	Low	127 Å²	127	59.7 Å²	59.7	59%	0.593	32%	0.315	S	S	*	.	H	α-helix	trans	-80.8	-15.1	172	-76.3	177.1	-14.8	0	0	112.9	R455 E456 E457	R455-Q459 WeakPolarHBondContact O-CB 3.26Å; R455-Q459 VanDerWaalsContact O-CG 3.26Å; R455-Q459 WeakPolarHBondContact O-CG 3.17Å; R455-Q459 PolarHBondContact O-N 3.07Å; R455-Q459 VanDerWaalsContact O-N 3.11Å; E456-Q459 PolarHBondContact O-N 3.48Å; E457-Q459 VanDerWaalsContact C-N 3.27Å; E457-Q459 PolarHBondContact O-N 3.45Å
460	S	65.8	Low	66.8	Low	48 Å²	48	60.3 Å²	60.3	34%	0.336	32%	0.318	S	S	.	.	S	Bend	trans	-77.3	123.8	178.3	-176.4	0	0	0	0	111	E457 L458 S462 S463	E457-S460 WeakPolarHBondContact O-CB 3.44Å; E457-S460 PolarHBondContact O-N 2.91Å; L458-S460 VanDerWaalsContact C-N 3.34Å; S460-S462 PolarHBondContact O-N 2.92Å; S460-S462 PolarHBondContact OG-OG 3.15Å; S460-S463 WeakPolarHBondContact O-CB 3.45Å; S460-S463 PolarHBondContact O-N 2.77Å
461	P	52	Low	65	Low	141 Å²	141	66.1 Å²	66.1	92%	0.916	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-13.4	178.8	23.6	-32.2	0	0	0	113.8
462	S	50.2	Low	62.9	Low	93 Å²	93	75.4 Å²	75.4	65%	0.65	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-3.1	175.9	55.9	0	0	0	0	114.3	S460 L464	S460-S462 PolarHBondContact O-N 2.92Å; S460-S462 PolarHBondContact OG-OG 3.15Å; S462-L464 VanDerWaalsContact C-N 3.34Å; S462-L464 PolarHBondContact O-N 3.07Å
463	S	54	Low	60.9	Low	32 Å²	32	76.2 Å²	76.2	22%	0.224	39%	0.394	C	S	.	.			trans	-75	85.6	177.9	166	0	0	0	0	110.6	E457 S460 L465	E457-S463 WeakPolarHBondContact O-CB 3.24Å; E457-S463 PolarHBondContact O-OG 3.08Å; S460-S463 WeakPolarHBondContact O-CB 3.45Å; S460-S463 PolarHBondContact O-N 2.77Å; S463-L465 VanDerWaalsContact C-N 3.31Å; S463-L465 PolarHBondContact O-N 3.09Å
464	L	49.4	Very low	59.4	Low	140 Å²	140	77.9 Å²	77.9	73%	0.733	40%	0.403	S	S	*	.			trans	-72.6	-12.8	-175.5	-90.3	160.6	0	0	0	114.9	S462	S462-L464 VanDerWaalsContact C-N 3.34Å; S462-L464 PolarHBondContact O-N 3.07Å
465	L	54.2	Low	57.7	Low	26 Å²	26	82.7 Å²	82.7	14%	0.136	43%	0.434	C	S	.	.			trans	-154.6	115	-176.7	-71.9	175.4	0	0	0	113.8	S463 L467	S463-L465 VanDerWaalsContact C-N 3.31Å; S463-L465 PolarHBondContact O-N 3.09Å; L465-L467 PolarHBondContact O-N 3.33Å
466	P	54.8	Low	56.1	Low	16 Å²	16	81.9 Å²	81.9	10%	0.104	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-9.6	-177.6	-22.1	31.1	0	0	0	117	L124 F377 L458	L124-P466 HydrophobicContact CB-CG 4.34Å; L124-P466 HydrophobicContact CD1-CB 4.28Å; L124-P466 HydrophobicContact CD1-CG 3.95Å; L124-P466 HydrophobicContact CD2-CG 3.82Å; L124-P466 HydrophobicContact CG-CG 4.24Å; F377-P466 HydrophobicContact CD1-CB 4.23Å; F377-P466 HydrophobicContact CD1-CG 4.49Å; F377-P466 HydrophobicContact CE1-CB 3.65Å; F377-P466 HydrophobicContact CE1-CG 4.38Å; F377-P466 HydrophobicContact CZ-CB 4.35Å; L458-P466 HydrophobicContact CD2-CB 3.75Å; L458-P466 HydrophobicContact CD2-CG 3.73Å
467	L	63.1	Low	54.5	Low	25 Å²	25	77.2 Å²	77.2	13%	0.131	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	13.5	-170.7	-58.4	-176.8	0	0	0	113.7	L124 Q127 I131 T310 Y313 W314 L465	L124-L467 HydrophobicContact CD1-CD1 4.01Å; L124-L467 HydrophobicContact CD1-CD2 4.5Å; L124-L467 HydrophobicContact CD1-CG 3.95Å; Q127-L467 HydrophobicContact CB-CD1 4.44Å; I131-L467 HydrophobicContact CD1-CD1 3.34Å; T310-L467 HydrophobicContact CG2-CD1 4.45Å; T310-L467 HydrophobicContact CG2-CD2 4.44Å; Y313-L467 HydrophobicContact CD1-CD1 4.22Å; Y313-L467 HydrophobicContact CE1-CD1 4.34Å; W314-L467 HydrophobicContact CB-CD2 3.57Å; W314-L467 HydrophobicContact CG-CD2 3.95Å; L465-L467 PolarHBondContact O-N 3.33Å
468	R	57.1	Low	53.2	Low	153 Å²	153	81 Å²	81	58%	0.577	43%	0.434	S	S	*	.	S	Bend	trans	-72.9	147.2	176.7	-74.8	-171.7	-177.9	-176.6	3.8	111.5	I470	R468-I470 PolarHBondContact O-N 3.42Å; R468-I470 VanDerWaalsContact O-N 3.1Å
469	P	49.8	Very low	52.2	Low	64 Å²	64	87.5 Å²	87.5	42%	0.416	46%	0.455	S	S	.	.			trans	-63.6	113.4	175.7	-17.9	28.2	0	0	0	112.5	F317 H471	F317-P469 HydrophobicContact CE1-CB 3.6Å; F317-P469 HydrophobicContact CE1-CG 3.89Å; F317-P469 HydrophobicContact CZ-CB 3.66Å; F317-P469 HydrophobicContact CZ-CG 3.57Å; P469-H471 WeakPolarHBondContact CB-CD2 3.21Å; P469-H471 WeakPolarHBondContact CB-NE2 3.46Å; P469-H471 PolarHBondContact O-N 3.13Å
470	I	53.3	Low	51.1	Low	25 Å²	25	86.8 Å²	86.8	13%	0.128	46%	0.455	C	S	.	.			trans	-72.4	71.4	168.4	-53.3	163.9	0	0	0	108	N453 R468	N453-I470 HydrophobicContact CB-CD1 4.11Å; N453-I470 HydrophobicContact CB-CG2 4.1Å; R468-I470 PolarHBondContact O-N 3.42Å; R468-I470 VanDerWaalsContact O-N 3.1Å
471	H	47.3	Very low	50.3	Low	128 Å²	128	88.1 Å²	88.1	59%	0.593	46%	0.458	S	S	*	.			trans	-88.7	-6.8	-179.3	-82.2	-49.1	0	0	0	113.6	P469	P469-H471 WeakPolarHBondContact CB-CD2 3.21Å; P469-H471 WeakPolarHBondContact CB-NE2 3.46Å; P469-H471 PolarHBondContact O-N 3.13Å
472	K	44.6	Very low	50.2	Low	195 Å²	195	89.1 Å²	89.1	85%	0.848	45%	0.448	S	S	*	.	S	Bend	trans	-111.4	-12.9	-165.6	-70	-170.2	175.9	-176.8	0	118.1
473	C	43.6	Very low	49.9	Very low	59 Å²	59	89.9 Å²	89.9	40%	0.399	44%	0.441	S	S	.	.	S	Bend	trans	-110.4	-0.3	-170.7	-68.6	0	0	0	0	117.6	S476 C477	C473-S476 PolarHBondContact O-OG 3.41Å; C473-C477 PolarHBondContact O-SG 2.89Å; C473-C477 VanDerWaalsContact O-SG 3.41Å
474	L	49.1	Very low	49.4	Very low	47 Å²	47	93.4 Å²	93.4	25%	0.246	46%	0.462	C	S	.	.	H	α-helix	trans	-66.8	-33.9	-171.1	-89.3	147.5	0	0	0	117.1	T322 I449	T322-L474 HydrophobicContact CG2-CD1 3.81Å; I449-L474 HydrophobicContact CB-CD2 4.47Å; I449-L474 HydrophobicContact CD1-CD2 4.39Å; I449-L474 HydrophobicContact CG2-CD2 3.73Å; I449-L474 HydrophobicContact CG2-CG 4.46Å
475	P	48.1	Very low	49.1	Very low	104 Å²	104	94.4 Å²	94.4	68%	0.675	46%	0.464	S	S	*	.	H	α-helix	trans	-71.8	-38	-178.1	-20.7	33.3	0	0	0	114.1
476	S	47.2	Very low	48.6	Very low	75 Å²	75	97.2 Å²	97.2	52%	0.524	49%	0.486	S	S	.	.	H	α-helix	trans	-71.2	-43.3	-176.5	45.1	0	0	0	0	112.1	C473 R478 R479 L480	C473-S476 PolarHBondContact O-OG 3.41Å; S476-R478 VanDerWaalsContact C-N 3.33Å; S476-R478 PolarHBondContact O-N 3.16Å; S476-R479 WeakPolarHBondContact O-CB 3.48Å; S476-R479 PolarHBondContact O-N 3.34Å; S476-R479 VanDerWaalsContact O-N 3.09Å; S476-L480 PolarHBondContact O-N 2.9Å; S476-L480 VanDerWaalsContact O-N 3.09Å
477	C	45.3	Very low	47.8	Very low	17 Å²	17	99.9 Å²	99.9	12%	0.115	51%	0.509	C	S	.	.	H	α-helix	trans	-64.4	-34.2	179.6	-58.1	0	0	0	0	113	I449 M452 C473 R479 L480 L481	I449-C477 HydrophobicContact CG2-CB 4.36Å; M452-C477 HydrophobicContact CE-CB 3.83Å; M452-C477 VanDerWaalsContact CE-SG 3.57Å; C473-C477 PolarHBondContact O-SG 2.89Å; C473-C477 VanDerWaalsContact O-SG 3.41Å; C477-R479 VanDerWaalsContact C-N 3.27Å; C477-R479 PolarHBondContact O-N 3.38Å; C477-L480 PolarHBondContact O-N 3.41Å; C477-L481 PolarHBondContact O-N 2.91Å
478	R	48.7	Very low	47.3	Very low	145 Å²	145	109.4 Å²	109.4	55%	0.547	54%	0.544	S	S	.	.	H	α-helix	trans	-66.1	-30.4	174.9	-80.5	-174.1	176.1	177	2.2	112.9	I449 S476 K482	I449-R478 HydrophobicContact CD1-CG 4.1Å; S476-R478 VanDerWaalsContact C-N 3.33Å; S476-R478 PolarHBondContact O-N 3.16Å; R478-K482 PolarHBondContact O-N 3.13Å
479	R	49.8	Very low	47.6	Very low	177 Å²	177	108.1 Å²	108.1	67%	0.668	54%	0.539	S	S	*	.	H	α-helix	trans	-72.8	-46	175.9	-145	-175.8	-157.2	152.6	3.7	109.9	S476 C477 L481 K482 E483	S476-R479 WeakPolarHBondContact O-CB 3.48Å; S476-R479 PolarHBondContact O-N 3.34Å; S476-R479 VanDerWaalsContact O-N 3.09Å; C477-R479 VanDerWaalsContact C-N 3.27Å; C477-R479 PolarHBondContact O-N 3.38Å; R479-L481 PolarHBondContact O-N 3.37Å; R479-K482 WeakPolarHBondContact O-CB 3.23Å; R479-K482 PolarHBondContact O-N 3.08Å; R479-K482 VanDerWaalsContact O-N 3.09Å; R479-E483 WeakPolarHBondContact O-CB 3.47Å; R479-E483 WeakPolarHBondContact O-CG 3.35Å; R479-E483 PolarHBondContact O-N 2.86Å
480	L	46.4	Very low	49	Very low	113 Å²	113	110.6 Å²	110.6	59%	0.592	54%	0.54	S	S	*	.	H	α-helix	trans	-57.9	-48.5	176.2	-147.2	82.1	0	0	0	111.6	S476 C477 K482 E483 T484	S476-L480 PolarHBondContact O-N 2.9Å; S476-L480 VanDerWaalsContact O-N 3.09Å; C477-L480 PolarHBondContact O-N 3.41Å; L480-K482 VanDerWaalsContact C-N 3.28Å; L480-K482 PolarHBondContact O-N 2.93Å; L480-E483 PolarHBondContact O-N 3.1Å; L480-T484 PolarHBondContact O-N 3.5Å; L480-T484 PolarHBondContact O-OG1 3.29Å
481	L	47.9	Very low	50.5	Low	76 Å²	76	113.6 Å²	113.6	40%	0.398	55%	0.553	S	S	.	*	H	α-helix	trans	-58.9	-33.9	175.6	-91.9	154.3	0	0	0	113.6	I449 C477 R479 M485	I449-L481 HydrophobicContact CG1-CD1 4.2Å; C477-L481 PolarHBondContact O-N 2.91Å; R479-L481 PolarHBondContact O-N 3.37Å; L481-M485 WeakPolarHBondContact O-CG 3.29Å
482	K	50.5	Low	52.5	Low	161 Å²	161	108.1 Å²	108.1	70%	0.7	53%	0.528	S	S	*	.	H	α-helix	trans	-75.1	-33.7	174.3	-87.6	-176.1	172.1	-174.5	0	112.6	R478 R479 L480 S486	R478-K482 PolarHBondContact O-N 3.13Å; R479-K482 WeakPolarHBondContact O-CB 3.23Å; R479-K482 PolarHBondContact O-N 3.08Å; R479-K482 VanDerWaalsContact O-N 3.09Å; L480-K482 VanDerWaalsContact C-N 3.28Å; L480-K482 PolarHBondContact O-N 2.93Å; K482-S486 PolarHBondContact O-OG 2.8Å
483	E	43.9	Very low	54.6	Low	110 Å²	110	101.8 Å²	101.8	51%	0.514	51%	0.509	S	S	.	.	H	α-helix	trans	-76.4	-39.6	-178.7	-75.8	167.6	-174.1	0	0	111.4	R479 L480 M485 S486	R479-E483 WeakPolarHBondContact O-CB 3.47Å; R479-E483 WeakPolarHBondContact O-CG 3.35Å; R479-E483 PolarHBondContact O-N 2.86Å; L480-E483 PolarHBondContact O-N 3.1Å; E483-M485 PolarHBondContact O-N 3.41Å; E483-S486 PolarHBondContact O-N 3.31Å
484	T	42.8	Very low	57	Low	106 Å²	106	99.6 Å²	99.6	65%	0.65	49%	0.493	S	S	*	.	H	α-helix	trans	-64.2	-30	173.7	-30.3	0	0	0	0	112.4	L480 S486	L480-T484 PolarHBondContact O-N 3.5Å; L480-T484 PolarHBondContact O-OG1 3.29Å; T484-S486 VanDerWaalsContact C-N 3.25Å; T484-S486 PolarHBondContact O-N 3.08Å
485	M	42.9	Very low	59	Low	161 Å²	161	101.5 Å²	101.5	79%	0.793	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-10.8	174.9	-70.4	-97.9	-166.3	0	0	113.8	L481 E483	L481-M485 WeakPolarHBondContact O-CG 3.29Å; E483-M485 PolarHBondContact O-N 3.41Å
486	S	43.8	Very low	60.9	Low	84 Å²	84	96.6 Å²	96.6	59%	0.587	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-11.7	-173.4	-59.9	0	0	0	0	113.4	K482 E483 T484	K482-S486 PolarHBondContact O-OG 2.8Å; E483-S486 PolarHBondContact O-N 3.31Å; T484-S486 VanDerWaalsContact C-N 3.25Å; T484-S486 PolarHBondContact O-N 3.08Å
487	A	39.1	Very low	62.9	Low	72 Å²	72	95.7 Å²	95.7	60%	0.595	46%	0.457	S	S	*	.	S	Bend	trans	-97.5	130.4	176.7	0	0	0	0	0	110.5
488	R	51.9	Low	65	Low	225 Å²	225	97 Å²	97	85%	0.849	46%	0.461	S	S	*	.			trans	82.9	58.8	-177.6	-52.2	-177.2	180	-175.2	0.1	116.5	R490	R488-R490 PolarHBondContact O-N 3.46Å
489	R	63.6	Low	67	Low	126 Å²	126	95.5 Å²	95.5	48%	0.475	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	4.8	169.9	-84.8	-168.6	-174	-171.3	5.6	116.2	N665 L668	R489-N665 VanDerWaalsContact CB-OD1 3.3Å; R489-N665 WeakPolarHBondContact CB-OD1 3.43Å; R489-N665 PolarHBondContact NH1-O 2.8Å; R489-L668 WeakPolarHBondContact O-CD1 3.17Å
490	R	78.4	Confident	69.1	Low	116 Å²	116	87.3 Å²	87.3	44%	0.438	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	1.2	180	-68.2	-168.6	-178.9	-163.6	-3.1	114.4	R488 F655	R488-R490 PolarHBondContact O-N 3.46Å; R490-F655 WeakPolarHBondContact O-CD2 3.46Å; R490-F655 PolarHBondContact O-N 3.15Å
491	E	86.1	Confident	71.2	Confident	88 Å²	88	82.1 Å²	82.1	41%	0.411	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.8	172.9	-173.5	174.8	179.3	0	0	108.9	K643 S652 V653 R654	E491-K643 IonicContact OE1-NZ 3.39Å; E491-S652 PolarHBondContact OE1-OG 3.24Å; E491-V653 CarbonylContact C-O 3.49Å; E491-V653 VanDerWaalsContact CA-O 3.29Å; E491-V653 WeakPolarHBondContact CA-O 3.33Å; E491-R654 HydrophobicContact CG-CG 4.07Å
492	L	89	Confident	73.3	Confident	13 Å²	13	79.8 Å²	79.8	7%	0.068	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	150.3	166.5	66.8	85.2	0	0	0	109.2	I494 V653 F655 Y671 M672 I675	L492-I494 HydrophobicContact CD1-CD1 4.22Å; L492-I494 HydrophobicContact CD1-CG1 3.71Å; L492-V653 HydrophobicContact CD1-CB 3.71Å; L492-V653 HydrophobicContact CD1-CG2 3.67Å; L492-V653 HydrophobicContact CG-CB 3.85Å; L492-V653 HydrophobicContact CG-CG2 4.37Å; L492-V653 PolarHBondContact N-O 2.89Å; L492-V653 PolarHBondContact O-N 3.35Å; L492-F655 HydrophobicContact CD2-CE2 3.7Å; L492-F655 HydrophobicContact CD2-CZ 3.92Å; L492-F655 HydrophobicContact CG-CE2 4.07Å; L492-Y671 HydrophobicContact CD2-CD1 4.25Å; L492-M672 HydrophobicContact CB-SD 4.5Å; L492-M672 HydrophobicContact CD2-CG 3.91Å; L492-I675 HydrophobicContact CD1-CD1 4.49Å; L492-I675 HydrophobicContact CD2-CD1 4.13Å
493	S	89.6	Confident	75.4	Confident	63 Å²	63	73.8 Å²	73.8	44%	0.441	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	124.2	174	175.7	0	0	0	0	108.5	V651	S493-V651 CarbonylContact C-O 3.43Å; S493-V651 WeakPolarHBondContact CA-O 3.46Å
494	I	92.8	Very high	77.7	Confident	12 Å²	12	68.5 Å²	68.5	6%	0.062	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122.1	172.8	-53.8	177.4	0	0	0	107.4	L492 F525 C529 L533 S650 V651 I675 L679	L492-I494 HydrophobicContact CD1-CD1 4.22Å; L492-I494 HydrophobicContact CD1-CG1 3.71Å; I494-F525 HydrophobicContact CG2-CZ 4.27Å; I494-C529 HydrophobicContact CD1-CB 4.44Å; I494-L533 HydrophobicContact CD1-CD1 4.27Å; I494-L533 HydrophobicContact CD1-CD2 4.05Å; I494-L533 HydrophobicContact CD1-CG 4.26Å; I494-S650 CarbonylContact O-C 3.59Å; I494-S650 WeakPolarHBondContact O-CA 3.5Å; I494-S650 WeakPolarHBondContact O-CB 3.47Å; I494-V651 HydrophobicContact CB-CB 4.31Å; I494-V651 PolarHBondContact N-O 2.94Å; I494-V651 PolarHBondContact O-N 3.35Å; I494-I675 HydrophobicContact CD1-CG2 4.02Å; I494-I675 HydrophobicContact CG1-CG2 4.4Å; I494-L679 HydrophobicContact CG2-CD2 3.49Å; I494-L679 VanDerWaalsContact CG2-CD2 3.49Å
495	K	90.6	Very high	80	Confident	88 Å²	88	63.5 Å²	63.5	38%	0.383	31%	0.308	S	S	.	.			trans	-119.4	148	175.9	-56.7	-168.9	179.3	-173.1	0	110	H393 D497 I648	H393-K495 WeakPolarHBondContact NE2-CD 3.33Å; K495-D497 PolarHBondContact O-N 3.44Å; K495-I648 HydrophobicContact CD-CG2 4.25Å
496	P	89.7	Confident	82.4	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.006	29%	0.294	C	S	.	.			trans	-67.3	130.8	175.8	-2.3	13.8	0	0	0	109.3	H393 L500 Y501 F525 M649	H393-P496 PolarHBondContact CE1-O 2.95Å; H393-P496 VanDerWaalsContact CE1-O 3.25Å; P496-L500 HydrophobicContact CB-CB 4.13Å; P496-Y501 HydrophobicContact CB-CD1 4.19Å; P496-Y501 HydrophobicContact CB-CD2 4.11Å; P496-Y501 HydrophobicContact CB-CE1 3.83Å; P496-Y501 HydrophobicContact CB-CE2 3.76Å; P496-Y501 HydrophobicContact CB-CG 4.31Å; P496-Y501 HydrophobicContact CG-CE1 3.88Å; P496-Y501 HydrophobicContact CG-CE2 4.26Å; P496-Y501 WeakPolarHBondContact O-CE2 3.06Å; P496-F525 HydrophobicContact CB-CD2 4.16Å; P496-F525 HydrophobicContact CB-CE2 3.76Å; P496-F525 HydrophobicContact CB-CZ 4.42Å; P496-F525 HydrophobicContact CG-CD2 3.88Å; P496-F525 HydrophobicContact CG-CE1 4.37Å; P496-F525 HydrophobicContact CG-CE2 3.51Å; P496-F525 HydrophobicContact CG-CG 4.49Å; P496-F525 HydrophobicContact CG-CZ 3.78Å; P496-M649 WeakPolarHBondContact CD-O 3.36Å; P496-M649 HydrophobicContact CG-CE 3.7Å; P496-M649 HydrophobicContact CG-CG 4.42Å
497	D	89.2	Confident	84.7	Confident	56 Å²	56	59.4 Å²	59.4	30%	0.299	27%	0.271	S	S	.	.			trans	-91.6	179.9	168.7	71	17.1	0	0	0	110.9	K495 Q499 L500 Y501	K495-D497 PolarHBondContact O-N 3.44Å; D497-Q499 PolarHBondContact O-N 3.02Å; D497-Q499 WeakPolarHBondContact OD1-CA 3.34Å; D497-Q499 WeakPolarHBondContact OD1-CB 3.38Å; D497-Q499 PolarHBondContact OD1-N 2.86Å; D497-L500 PolarHBondContact O-N 3.13Å; D497-L500 WeakPolarHBondContact OD1-CG 3.5Å; D497-L500 PolarHBondContact OD1-N 2.85Å; D497-Y501 VanDerWaalsContact O-CD2 3.23Å; D497-Y501 WeakPolarHBondContact O-CD2 3.28Å; D497-Y501 PolarHBondContact O-N 3.01Å
498	Q	88.8	Confident	87.2	Confident	45 Å²	45	56 Å²	56	21%	0.21	24%	0.243	C	C	.	.	H	α-helix	trans	-49.6	-41.6	174.8	167.5	174.3	25.8	0	0	113.1	Y420 N502	Y420-Q498 WeakPolarHBondContact O-CG 3.37Å; Y420-Q498 PolarHBondContact O-NE2 3.16Å; Q498-N502 WeakPolarHBondContact CG-ND2 3.48Å; Q498-N502 WeakPolarHBondContact O-CB 3.41Å; Q498-N502 VanDerWaalsContact O-CG 3.31Å; Q498-N502 PolarHBondContact O-N 3.26Å; Q498-N502 VanDerWaalsContact O-N 3.15Å; Q498-N502 PolarHBondContact O-ND2 3.17Å
499	Q	90.9	Very high	88.9	Confident	113 Å²	113	48.2 Å²	48.2	53%	0.528	22%	0.218	S	C	.	.	H	α-helix	trans	-72	-40.4	-175.3	-58.7	-168.1	-48.8	0	0	110.6	D497 N502 R503 F680	D497-Q499 PolarHBondContact O-N 3.02Å; D497-Q499 WeakPolarHBondContact OD1-CA 3.34Å; D497-Q499 WeakPolarHBondContact OD1-CB 3.38Å; D497-Q499 PolarHBondContact OD1-N 2.86Å; Q499-N502 PolarHBondContact O-N 3.21Å; Q499-R503 WeakPolarHBondContact O-CB 3.45Å; Q499-R503 PolarHBondContact O-N 3.41Å; Q499-F680 HydrophobicContact CB-CD2 3.77Å; Q499-F680 HydrophobicContact CB-CE2 3.65Å; Q499-F680 HydrophobicContact CB-CZ 4.49Å
500	L	92.9	Very high	90.1	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-64	-47.9	176.3	-65.1	176.9	0	0	0	111.5	P496 D497 N502 R503 I504 F525 L679 F680 F683	P496-L500 HydrophobicContact CB-CB 4.13Å; D497-L500 PolarHBondContact O-N 3.13Å; D497-L500 WeakPolarHBondContact OD1-CG 3.5Å; D497-L500 PolarHBondContact OD1-N 2.85Å; L500-N502 VanDerWaalsContact C-N 3.33Å; L500-N502 PolarHBondContact O-N 2.98Å; L500-R503 PolarHBondContact O-N 3.41Å; L500-R503 VanDerWaalsContact O-N 3.08Å; L500-I504 VanDerWaalsContact O-CG1 3.28Å; L500-I504 WeakPolarHBondContact O-CG1 3.33Å; L500-I504 PolarHBondContact O-N 3.09Å; L500-F525 HydrophobicContact CD1-CE2 4.45Å; L500-L679 HydrophobicContact CD1-CD2 3.75Å; L500-L679 HydrophobicContact CD1-CG 4.23Å; L500-F680 HydrophobicContact CD2-CD2 3.96Å; L500-F683 HydrophobicContact CD2-CB 3.97Å; L500-F683 HydrophobicContact CD2-CD1 3.78Å; L500-F683 HydrophobicContact CD2-CD2 3.53Å; L500-F683 HydrophobicContact CD2-CE1 4.16Å; L500-F683 HydrophobicContact CD2-CE2 3.89Å; L500-F683 HydrophobicContact CD2-CG 3.47Å; L500-F683 VanDerWaalsContact CD2-CG 3.47Å; L500-F683 HydrophobicContact CD2-CZ 4.21Å
501	Y	91.9	Very high	90.6	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-56.5	-46.8	175.1	-75.8	-60	0	0	0	112.1	H393 L407 M411 Y420 P496 D497 R503 I504 Q505 M649	H393-Y501 AromaticContact ND1-CE2 3.81Å; H393-Y501 AromaticContact ND1-CZ 3.82Å; H393-Y501 PolarHBondContact ND1-OH 3.32Å; L407-Y501 HydrophobicContact CB-CE1 4.04Å; L407-Y501 HydrophobicContact CD1-CD1 4.24Å; L407-Y501 HydrophobicContact CD1-CD2 4.45Å; L407-Y501 HydrophobicContact CD1-CE1 3.55Å; L407-Y501 HydrophobicContact CD1-CE2 3.79Å; L407-Y501 WeakPolarHBondContact CD1-OH 3.37Å; L407-Y501 HydrophobicContact CG-CE1 4.47Å; M411-Y501 HydrophobicContact SD-CD1 4.11Å; Y420-Y501 HydrophobicContact CD1-CG 4.46Å; Y420-Y501 HydrophobicContact CG-CG 4.38Å; P496-Y501 HydrophobicContact CB-CD1 4.19Å; P496-Y501 HydrophobicContact CB-CD2 4.11Å; P496-Y501 HydrophobicContact CB-CE1 3.83Å; P496-Y501 HydrophobicContact CB-CE2 3.76Å; P496-Y501 HydrophobicContact CB-CG 4.31Å; P496-Y501 HydrophobicContact CG-CE1 3.88Å; P496-Y501 HydrophobicContact CG-CE2 4.26Å; P496-Y501 WeakPolarHBondContact O-CE2 3.06Å; D497-Y501 VanDerWaalsContact O-CD2 3.23Å; D497-Y501 WeakPolarHBondContact O-CD2 3.28Å; D497-Y501 PolarHBondContact O-N 3.01Å; Y501-R503 VanDerWaalsContact C-N 3.3Å; Y501-R503 PolarHBondContact O-N 2.84Å; Y501-I504 PolarHBondContact O-N 3.33Å; Y501-Q505 WeakPolarHBondContact O-CB 3.15Å; Y501-Q505 PolarHBondContact O-N 3.21Å; Y501-M649 HydrophobicContact CE1-CE 4.29Å
502	N	91.3	Very high	90.6	Very high	28 Å²	28	42 Å²	42	15%	0.15	22%	0.215	C	C	.	.	H	α-helix	trans	-63.5	-35	177.7	-73.9	-53.6	0	0	0	112.4	Y420 Q498 Q499 L500 R506	Y420-N502 PolarHBondContact N-OD1 3.07Å; Q498-N502 WeakPolarHBondContact CG-ND2 3.48Å; Q498-N502 WeakPolarHBondContact O-CB 3.41Å; Q498-N502 VanDerWaalsContact O-CG 3.31Å; Q498-N502 PolarHBondContact O-N 3.26Å; Q498-N502 VanDerWaalsContact O-N 3.15Å; Q498-N502 PolarHBondContact O-ND2 3.17Å; Q499-N502 PolarHBondContact O-N 3.21Å; L500-N502 VanDerWaalsContact C-N 3.33Å; L500-N502 PolarHBondContact O-N 2.98Å; N502-R506 WeakPolarHBondContact O-CG 3.23Å; N502-R506 PolarHBondContact O-N 2.91Å
503	R	93.3	Very high	90.3	Very high	34 Å²	34	49.3 Å²	49.3	13%	0.128	25%	0.247	C	C	.	.	H	α-helix	trans	-69.1	-47.9	177.9	-177.1	59.1	179	-151.7	4.7	111.2	Q499 L500 Y501 R506 Y507 F680 F683 E684 L687	Q499-R503 WeakPolarHBondContact O-CB 3.45Å; Q499-R503 PolarHBondContact O-N 3.41Å; L500-R503 PolarHBondContact O-N 3.41Å; L500-R503 VanDerWaalsContact O-N 3.08Å; Y501-R503 VanDerWaalsContact C-N 3.3Å; Y501-R503 PolarHBondContact O-N 2.84Å; R503-R506 PolarHBondContact O-N 3.2Å; R503-Y507 PolarHBondContact O-N 2.89Å; R503-F680 HydrophobicContact CB-CE2 4.1Å; R503-F683 HydrophobicContact CG-CB 4.25Å; R503-E684 PolarHBondContact NH2-O 3.3Å; R503-L687 VanDerWaalsContact CZ-O 3.23Å; R503-L687 PolarHBondContact NE-O 2.92Å; R503-L687 PolarHBondContact NH2-O 3.27Å
504	I	93.1	Very high	89.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.7	-47.3	177.7	-60.8	162.7	0	0	0	109.7	M411 L500 Y501 R506 Y507 I508 I521 F525 M649 F683 L687	M411-I504 HydrophobicContact CE-CB 3.71Å; M411-I504 HydrophobicContact CE-CG2 3.51Å; L500-I504 VanDerWaalsContact O-CG1 3.28Å; L500-I504 WeakPolarHBondContact O-CG1 3.33Å; L500-I504 PolarHBondContact O-N 3.09Å; Y501-I504 PolarHBondContact O-N 3.33Å; I504-R506 VanDerWaalsContact C-N 3.34Å; I504-R506 PolarHBondContact O-N 3.41Å; I504-Y507 WeakPolarHBondContact O-CB 3.39Å; I504-Y507 PolarHBondContact O-N 3.11Å; I504-Y507 VanDerWaalsContact O-N 3.14Å; I504-I508 HydrophobicContact CG2-CG2 4.26Å; I504-I508 WeakPolarHBondContact O-CG1 3.23Å; I504-I508 WeakPolarHBondContact O-CG2 3.39Å; I504-I508 PolarHBondContact O-N 3.47Å; I504-I521 HydrophobicContact CG2-CG2 3.89Å; I504-F525 HydrophobicContact CD1-CB 4.39Å; I504-F525 HydrophobicContact CD1-CD2 4.35Å; I504-M649 HydrophobicContact CD1-CE 4.45Å; I504-F683 HydrophobicContact CD1-CD1 4.44Å; I504-F683 HydrophobicContact CD1-CE1 3.82Å; I504-F683 HydrophobicContact CG1-CD1 4.01Å; I504-F683 HydrophobicContact CG1-CE1 3.83Å; I504-L687 HydrophobicContact CG1-CD1 4.03Å
505	Q	91.8	Very high	89.2	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-55.6	-47.3	178.9	-175.1	72.7	70.1	0	0	112	M411 H414 D416 Y420 Y501 Y507 I508 N509	M411-Q505 VanDerWaalsContact CA-OE1 3.31Å; M411-Q505 HydrophobicContact CE-CB 3.84Å; M411-Q505 VanDerWaalsContact CE-N 3.3Å; M411-Q505 VanDerWaalsContact CG-OE1 3.28Å; M411-Q505 PolarHBondContact O-NE2 3.14Å; H414-Q505 PolarHBondContact O-NE2 3.03Å; H414-Q505 VanDerWaalsContact O-NE2 3.1Å; D416-Q505 HydrophobicContact CB-CG 4.47Å; Y420-Q505 HydrophobicContact CE2-CB 4.07Å; Y420-Q505 HydrophobicContact CE2-CG 4.19Å; Y420-Q505 PolarHBondContact OH-OE1 3.36Å; Y501-Q505 WeakPolarHBondContact O-CB 3.15Å; Y501-Q505 PolarHBondContact O-N 3.21Å; Q505-Y507 VanDerWaalsContact C-N 3.33Å; Q505-Y507 PolarHBondContact O-N 3.2Å; Q505-I508 VanDerWaalsContact O-CG1 3.23Å; Q505-I508 WeakPolarHBondContact O-CG1 3.33Å; Q505-N509 PolarHBondContact NE2-ND2 2.87Å; Q505-N509 PolarHBondContact NE2-OD1 3.44Å; Q505-N509 WeakPolarHBondContact O-CB 3.39Å; Q505-N509 PolarHBondContact O-N 2.94Å; Q505-N509 VanDerWaalsContact O-N 3.13Å; Q505-N509 PolarHBondContact O-ND2 3.46Å
506	R	91.8	Very high	89	Confident	133 Å²	133	51.3 Å²	51.3	50%	0.502	27%	0.267	S	S	.	.	H	α-helix	trans	-65.4	-38.8	179.4	-74.2	177.8	-175.7	178.7	0.7	112.3	D416 N502 R503 I504 L689	D416-R506 HydrophobicContact CB-CG 3.98Å; N502-R506 WeakPolarHBondContact O-CG 3.23Å; N502-R506 PolarHBondContact O-N 2.91Å; R503-R506 PolarHBondContact O-N 3.2Å; I504-R506 VanDerWaalsContact C-N 3.34Å; I504-R506 PolarHBondContact O-N 3.41Å; R506-L689 HydrophobicContact CB-CD1 4.13Å; R506-L689 HydrophobicContact CB-CD2 3.47Å; R506-L689 VanDerWaalsContact CB-CD2 3.47Å; R506-L689 HydrophobicContact CB-CG 4.45Å
507	Y	92.2	Very high	89	Confident	25 Å²	25	55.1 Å²	55.1	10%	0.098	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-51.9	177.3	176.3	-102.5	0	0	0	111.1	R503 I504 Q505 N509 G510 L511 L524 R572 L687 P688	R503-Y507 PolarHBondContact O-N 2.89Å; I504-Y507 WeakPolarHBondContact O-CB 3.39Å; I504-Y507 PolarHBondContact O-N 3.11Å; I504-Y507 VanDerWaalsContact O-N 3.14Å; Q505-Y507 VanDerWaalsContact C-N 3.33Å; Q505-Y507 PolarHBondContact O-N 3.2Å; Y507-N509 PolarHBondContact O-N 3.44Å; Y507-G510 PolarHBondContact O-N 3.25Å; Y507-L511 HydrophobicContact CD1-CD1 4.1Å; Y507-L511 HydrophobicContact CE1-CD1 3.57Å; Y507-L511 HydrophobicContact CE1-CG 4.3Å; Y507-L524 HydrophobicContact CD1-CD1 3.86Å; Y507-L524 HydrophobicContact CE1-CD1 3.81Å; Y507-L524 HydrophobicContact CE1-CD2 4.22Å; Y507-R572 PolarHBondContact OH-NH2 2.78Å; Y507-L687 HydrophobicContact CD1-CB 4.21Å; Y507-L687 HydrophobicContact CD1-CD2 3.79Å; Y507-L687 HydrophobicContact CD1-CG 4.43Å; Y507-L687 HydrophobicContact CD2-CB 3.7Å; Y507-L687 HydrophobicContact CD2-CD2 4.47Å; Y507-L687 HydrophobicContact CE1-CD2 3.73Å; Y507-L687 HydrophobicContact CE2-CB 4.24Å; Y507-L687 HydrophobicContact CE2-CD2 4.44Å; Y507-L687 HydrophobicContact CG-CB 3.69Å; Y507-L687 HydrophobicContact CG-CD2 4.16Å; Y507-L687 HydrophobicContact CG-CG 4.38Å; Y507-P688 VanDerWaalsContact CD2-O 3.27Å; Y507-P688 WeakPolarHBondContact CD2-O 3.41Å
508	I	91.9	Very high	88.9	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-64.9	-28	-177.5	66.6	174.8	0	0	0	112.6	M411 I504 Q505 G510 L511 L516 I521 L524	M411-I508 HydrophobicContact CB-CD1 4.01Å; M411-I508 HydrophobicContact CE-CD1 4.24Å; I504-I508 HydrophobicContact CG2-CG2 4.26Å; I504-I508 WeakPolarHBondContact O-CG1 3.23Å; I504-I508 WeakPolarHBondContact O-CG2 3.39Å; I504-I508 PolarHBondContact O-N 3.47Å; Q505-I508 VanDerWaalsContact O-CG1 3.23Å; Q505-I508 WeakPolarHBondContact O-CG1 3.33Å; I508-G510 PolarHBondContact O-N 3.01Å; I508-L511 WeakPolarHBondContact O-CB 3.39Å; I508-L511 PolarHBondContact O-N 3Å; I508-L516 HydrophobicContact CB-CD1 4.09Å; I508-L516 HydrophobicContact CB-CD2 4.3Å; I508-L516 HydrophobicContact CG2-CD2 4.38Å; I508-L516 WeakPolarHBondContact O-CD1 3.32Å; I508-I521 HydrophobicContact CD1-CD1 3.68Å; I508-I521 HydrophobicContact CD1-CG1 4.28Å; I508-I521 HydrophobicContact CG2-CG1 4.3Å; I508-L524 HydrophobicContact CG2-CD1 4Å
509	N	89.2	Confident	88.8	Confident	61 Å²	61	58 Å²	58	33%	0.326	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-14.7	176	-69	-21.4	0	0	0	114	S415 D416 Q505 Y507 L511	S415-N509 VanDerWaalsContact C-ND2 3.26Å; D416-N509 WeakPolarHBondContact CA-ND2 3.3Å; D416-N509 WeakPolarHBondContact CB-ND2 3.31Å; D416-N509 PolarHBondContact N-ND2 3.14Å; Q505-N509 PolarHBondContact NE2-ND2 2.87Å; Q505-N509 PolarHBondContact NE2-OD1 3.44Å; Q505-N509 WeakPolarHBondContact O-CB 3.39Å; Q505-N509 PolarHBondContact O-N 2.94Å; Q505-N509 VanDerWaalsContact O-N 3.13Å; Q505-N509 PolarHBondContact O-ND2 3.46Å; Y507-N509 PolarHBondContact O-N 3.44Å; N509-L511 VanDerWaalsContact C-N 3.34Å
510	G	88.3	Confident	88.8	Confident	43 Å²	43	55.3 Å²	55.3	44%	0.443	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-6.1	168.6	0	0	0	0	0	113.8	Y507 I508	Y507-G510 PolarHBondContact O-N 3.25Å; I508-G510 PolarHBondContact O-N 3.01Å
511	L	88.3	Confident	88.6	Confident	52 Å²	52	55.1 Å²	55.1	27%	0.272	29%	0.287	S	S	.	.	S	Bend	trans	-97.7	160.7	-178.8	-59.5	-178.4	0	0	0	111.8	Y507 I508 N509 K513 L516 Y520	Y507-L511 HydrophobicContact CD1-CD1 4.1Å; Y507-L511 HydrophobicContact CE1-CD1 3.57Å; Y507-L511 HydrophobicContact CE1-CG 4.3Å; I508-L511 WeakPolarHBondContact O-CB 3.39Å; I508-L511 PolarHBondContact O-N 3Å; N509-L511 VanDerWaalsContact C-N 3.34Å; L511-K513 PolarHBondContact O-N 3.1Å; L511-L516 HydrophobicContact CB-CD1 4.34Å; L511-L516 HydrophobicContact CB-CD2 4.24Å; L511-L516 HydrophobicContact CB-CG 4.49Å; L511-L516 HydrophobicContact CD1-CD2 3.92Å; L511-Y520 HydrophobicContact CD1-CE1 3.91Å
512	D	85.3	Confident	88.5	Confident	103 Å²	103	55.4 Å²	55.4	55%	0.551	29%	0.29	S	S	*	.			trans	-68.3	123.2	171.1	-177.8	3.5	0	0	0	110.5	S514 T515	D512-S514 PolarHBondContact O-N 3.02Å; D512-S514 VanDerWaalsContact O-N 3.16Å; D512-S514 PolarHBondContact OD1-N 2.97Å; D512-S514 PolarHBondContact OD1-OG 3.24Å; D512-S514 PolarHBondContact OD2-OG 3.07Å; D512-T515 PolarHBondContact O-N 3.17Å; D512-T515 VanDerWaalsContact O-N 3.13Å; D512-T515 PolarHBondContact O-OG1 2.76Å
513	K	82.7	Confident	88.4	Confident	168 Å²	168	55 Å²	55	73%	0.73	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-57.7	-27.9	179.3	-67.2	-171.5	177.1	-170.6	0	113.4	L511 T515 L516	L511-K513 PolarHBondContact O-N 3.1Å; K513-T515 PolarHBondContact O-N 2.94Å; K513-L516 PolarHBondContact O-N 3.04Å
514	S	82.2	Confident	88.2	Confident	96 Å²	96	53.5 Å²	53.5	67%	0.671	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-61.4	-25	179.4	73.1	0	0	0	0	113.2	D512	D512-S514 PolarHBondContact O-N 3.02Å; D512-S514 VanDerWaalsContact O-N 3.16Å; D512-S514 PolarHBondContact OD1-N 2.97Å; D512-S514 PolarHBondContact OD1-OG 3.24Å; D512-S514 PolarHBondContact OD2-OG 3.07Å
515	T	77.4	Confident	88.2	Confident	83 Å²	83	53.5 Å²	53.5	51%	0.509	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-94.1	-9.8	-178.2	66	0	0	0	0	113.5	D512 K513	D512-T515 PolarHBondContact O-N 3.17Å; D512-T515 VanDerWaalsContact O-N 3.13Å; D512-T515 PolarHBondContact O-OG1 2.76Å; K513-T515 PolarHBondContact O-N 2.94Å
516	L	87.2	Confident	88.2	Confident	25 Å²	25	53.6 Å²	53.6	13%	0.131	28%	0.283	C	S	.	.			trans	-95.3	126.5	-170.1	-64.3	176.9	0	0	0	111.3	L412 I508 L511 K513 Y520	L412-L516 HydrophobicContact CD2-CB 3.62Å; L412-L516 HydrophobicContact CD2-CD1 4.42Å; I508-L516 HydrophobicContact CB-CD1 4.09Å; I508-L516 HydrophobicContact CB-CD2 4.3Å; I508-L516 HydrophobicContact CG2-CD2 4.38Å; I508-L516 WeakPolarHBondContact O-CD1 3.32Å; L511-L516 HydrophobicContact CB-CD1 4.34Å; L511-L516 HydrophobicContact CB-CD2 4.24Å; L511-L516 HydrophobicContact CB-CG 4.49Å; L511-L516 HydrophobicContact CD1-CD2 3.92Å; K513-L516 PolarHBondContact O-N 3.04Å; L516-Y520 HydrophobicContact CD2-CD1 3.55Å; L516-Y520 HydrophobicContact CD2-CE1 3.61Å
517	N	89.3	Confident	88.2	Confident	81 Å²	81	47.4 Å²	47.4	43%	0.433	26%	0.26	S	S	.	.			trans	-136.4	172.7	166.4	67.7	28.6	0	0	0	110.2	E519 Y520 I521	N517-E519 PolarHBondContact O-N 2.86Å; N517-E519 WeakPolarHBondContact OD1-CB 3.4Å; N517-E519 PolarHBondContact OD1-N 3.12Å; N517-Y520 PolarHBondContact O-N 2.9Å; N517-Y520 WeakPolarHBondContact OD1-CB 3.12Å; N517-Y520 PolarHBondContact OD1-N 3.11Å; N517-I521 PolarHBondContact O-N 3.44Å
518	S	87.5	Confident	88.2	Confident	35 Å²	35	46.2 Å²	46.2	25%	0.245	26%	0.256	C	S	.	.	H	α-helix	trans	-61.1	-37.6	-175.8	-169.2	0	0	0	0	111.5	N406 S408 I521 V522	N406-S518 PolarHBondContact OD1-OG 3.02Å; S408-S518 VanDerWaalsContact CB-OG 3.22Å; S408-S518 WeakPolarHBondContact CB-OG 3.48Å; S408-S518 PolarHBondContact OG-OG 3.31Å; S518-I521 PolarHBondContact O-N 2.79Å; S518-V522 WeakPolarHBondContact O-CG2 3.39Å; S518-V522 PolarHBondContact O-N 2.82Å
519	E	87.2	Confident	88.4	Confident	126 Å²	126	46.1 Å²	46.1	59%	0.589	26%	0.255	S	S	*	.	H	α-helix	trans	-65.8	-43.1	-179.7	-173	173.7	-169.8	0	0	111.4	N517 I521 V522 C523	N517-E519 PolarHBondContact O-N 2.86Å; N517-E519 WeakPolarHBondContact OD1-CB 3.4Å; N517-E519 PolarHBondContact OD1-N 3.12Å; E519-I521 VanDerWaalsContact C-N 3.33Å; E519-I521 PolarHBondContact O-N 3.03Å; E519-V522 CarbonylContact O-C 3.44Å; E519-V522 WeakPolarHBondContact O-CA 3.34Å; E519-V522 WeakPolarHBondContact O-CB 3.44Å; E519-V522 PolarHBondContact O-N 3.11Å; E519-C523 PolarHBondContact O-N 3.38Å; E519-C523 PolarHBondContact O-SG 2.86Å
520	Y	89.1	Confident	88.5	Confident	58 Å²	58	43.3 Å²	43.3	23%	0.227	24%	0.24	C	C	.	.	H	α-helix	trans	-57.3	-44.3	176.8	-179.2	-101.8	0	0	0	112.1	L511 L516 N517 V522 C523 L524	L511-Y520 HydrophobicContact CD1-CE1 3.91Å; L516-Y520 HydrophobicContact CD2-CD1 3.55Å; L516-Y520 HydrophobicContact CD2-CE1 3.61Å; N517-Y520 PolarHBondContact O-N 2.9Å; N517-Y520 WeakPolarHBondContact OD1-CB 3.12Å; N517-Y520 PolarHBondContact OD1-N 3.11Å; Y520-V522 VanDerWaalsContact C-N 3.25Å; Y520-V522 PolarHBondContact O-N 3.28Å; Y520-C523 WeakPolarHBondContact O-CB 3.5Å; Y520-C523 PolarHBondContact O-N 3.46Å; Y520-L524 HydrophobicContact CD1-CD1 4.1Å; Y520-L524 HydrophobicContact CD1-CG 4.34Å; Y520-L524 HydrophobicContact CE1-CD1 3.68Å; Y520-L524 HydrophobicContact CE1-CD2 4.24Å; Y520-L524 HydrophobicContact CE1-CG 4.03Å; Y520-L524 WeakPolarHBondContact O-CG 3.46Å; Y520-L524 PolarHBondContact O-N 2.94Å
521	I	90	Very high	88.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.8	-41	176.1	-64.9	176.1	0	0	0	110.8	S408 M411 L412 I504 I508 N517 S518 E519 L524 F525	S408-I521 WeakPolarHBondContact O-CD1 3.43Å; M411-I521 HydrophobicContact CB-CD1 4.19Å; M411-I521 HydrophobicContact SD-CG2 4.23Å; L412-I521 HydrophobicContact CD1-CD1 4.31Å; L412-I521 HydrophobicContact CD2-CD1 3.67Å; L412-I521 HydrophobicContact CG-CD1 3.67Å; I504-I521 HydrophobicContact CG2-CG2 3.89Å; I508-I521 HydrophobicContact CD1-CD1 3.68Å; I508-I521 HydrophobicContact CD1-CG1 4.28Å; I508-I521 HydrophobicContact CG2-CG1 4.3Å; N517-I521 PolarHBondContact O-N 3.44Å; S518-I521 PolarHBondContact O-N 2.79Å; E519-I521 VanDerWaalsContact C-N 3.33Å; E519-I521 PolarHBondContact O-N 3.03Å; I521-L524 PolarHBondContact O-N 3.38Å; I521-F525 PolarHBondContact O-N 2.85Å
522	V	89.1	Confident	89	Confident	10 Å²	10	39 Å²	39	6%	0.061	21%	0.207	C	C	.	.	H	α-helix	trans	-69	-38.6	179.8	178.8	0	0	0	0	111.5	S518 E519 Y520 F525 Y526 L642 M649	S518-V522 WeakPolarHBondContact O-CG2 3.39Å; S518-V522 PolarHBondContact O-N 2.82Å; E519-V522 CarbonylContact O-C 3.44Å; E519-V522 WeakPolarHBondContact O-CA 3.34Å; E519-V522 WeakPolarHBondContact O-CB 3.44Å; E519-V522 PolarHBondContact O-N 3.11Å; Y520-V522 VanDerWaalsContact C-N 3.25Å; Y520-V522 PolarHBondContact O-N 3.28Å; V522-F525 PolarHBondContact O-N 2.87Å; V522-Y526 PolarHBondContact O-N 3.49Å; V522-L642 HydrophobicContact CG1-CD1 3.49Å; V522-L642 VanDerWaalsContact CG1-CD1 3.49Å; V522-L642 HydrophobicContact CG1-CD2 3.28Å; V522-L642 HydrophobicContact CG1-CG 3.96Å; V522-M649 VanDerWaalsContact CA-SD 3.56Å; V522-M649 HydrophobicContact CB-SD 4.01Å; V522-M649 HydrophobicContact CG1-CG 4.17Å; V522-M649 HydrophobicContact CG1-SD 3.95Å; V522-M649 HydrophobicContact CG2-SD 3.87Å
523	C	88.6	Confident	89.4	Confident	19 Å²	19	34 Å²	34	13%	0.128	18%	0.18	C	C	.	.	H	α-helix	trans	-59.4	-45.8	171.8	-62.6	0	0	0	0	111.5	E519 Y520 F525 Y526 E527	E519-C523 PolarHBondContact O-N 3.38Å; E519-C523 PolarHBondContact O-SG 2.86Å; Y520-C523 WeakPolarHBondContact O-CB 3.5Å; Y520-C523 PolarHBondContact O-N 3.46Å; C523-F525 VanDerWaalsContact C-N 3.27Å; C523-F525 PolarHBondContact O-N 3.39Å; C523-Y526 PolarHBondContact O-N 2.86Å; C523-Y526 VanDerWaalsContact O-N 3.17Å; C523-E527 VanDerWaalsContact O-CB 3.25Å; C523-E527 WeakPolarHBondContact O-CB 3.38Å; C523-E527 PolarHBondContact O-N 3.33Å
524	L	90.7	Very high	89.9	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-56.6	-42.1	178	-68.5	177.5	0	0	0	112.2	Y507 I508 Y520 I521 C528 L687	Y507-L524 HydrophobicContact CD1-CD1 3.86Å; Y507-L524 HydrophobicContact CE1-CD1 3.81Å; Y507-L524 HydrophobicContact CE1-CD2 4.22Å; I508-L524 HydrophobicContact CG2-CD1 4Å; Y520-L524 HydrophobicContact CD1-CD1 4.1Å; Y520-L524 HydrophobicContact CD1-CG 4.34Å; Y520-L524 HydrophobicContact CE1-CD1 3.68Å; Y520-L524 HydrophobicContact CE1-CD2 4.24Å; Y520-L524 HydrophobicContact CE1-CG 4.03Å; Y520-L524 WeakPolarHBondContact O-CG 3.46Å; Y520-L524 PolarHBondContact O-N 2.94Å; I521-L524 PolarHBondContact O-N 3.38Å; L524-C528 WeakPolarHBondContact O-CB 3.2Å; L524-C528 PolarHBondContact O-N 3.26Å; L524-C528 VanDerWaalsContact O-N 3.17Å; L524-C528 PolarHBondContact O-SG 3.05Å; L524-L687 HydrophobicContact CB-CD2 4.33Å; L524-L687 HydrophobicContact CD1-CD2 4.35Å; L524-L687 HydrophobicContact CD2-CD2 3.89Å; L524-L687 HydrophobicContact CG-CD2 4.43Å
525	F	92.8	Very high	90.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-66.8	-47.2	176.9	173.1	-99.5	0	0	0	111.9	I494 P496 L500 I504 I521 V522 C523 E527 C528 C529 M649 V651 F683	I494-F525 HydrophobicContact CG2-CZ 4.27Å; P496-F525 HydrophobicContact CB-CD2 4.16Å; P496-F525 HydrophobicContact CB-CE2 3.76Å; P496-F525 HydrophobicContact CB-CZ 4.42Å; P496-F525 HydrophobicContact CG-CD2 3.88Å; P496-F525 HydrophobicContact CG-CE1 4.37Å; P496-F525 HydrophobicContact CG-CE2 3.51Å; P496-F525 HydrophobicContact CG-CG 4.49Å; P496-F525 HydrophobicContact CG-CZ 3.78Å; L500-F525 HydrophobicContact CD1-CE2 4.45Å; I504-F525 HydrophobicContact CD1-CB 4.39Å; I504-F525 HydrophobicContact CD1-CD2 4.35Å; I521-F525 PolarHBondContact O-N 2.85Å; V522-F525 PolarHBondContact O-N 2.87Å; C523-F525 VanDerWaalsContact C-N 3.27Å; C523-F525 PolarHBondContact O-N 3.39Å; F525-E527 VanDerWaalsContact C-N 3.34Å; F525-E527 PolarHBondContact O-N 2.85Å; F525-C528 PolarHBondContact O-N 3.33Å; F525-C529 VanDerWaalsContact CZ-SG 3.6Å; F525-C529 WeakPolarHBondContact O-CB 3.43Å; F525-C529 PolarHBondContact O-N 3.33Å; F525-C529 PolarHBondContact O-SG 2.88Å; F525-M649 HydrophobicContact CB-CE 3.8Å; F525-M649 HydrophobicContact CB-CG 4.21Å; F525-M649 HydrophobicContact CB-SD 3.24Å; F525-M649 WeakPolarHBondContact CB-SD 3.42Å; F525-M649 HydrophobicContact CD1-CE 4.31Å; F525-M649 HydrophobicContact CD1-CG 3.24Å; F525-M649 HydrophobicContact CD1-SD 3.51Å; F525-M649 VanDerWaalsContact CD1-SD 3.51Å; F525-M649 HydrophobicContact CD2-CE 4.22Å; F525-M649 HydrophobicContact CD2-SD 4.38Å; F525-M649 HydrophobicContact CE1-CG 3.69Å; F525-M649 HydrophobicContact CE1-SD 4.45Å; F525-M649 HydrophobicContact CG-CE 3.85Å; F525-M649 HydrophobicContact CG-CG 3.81Å; F525-M649 HydrophobicContact CG-SD 3.46Å; F525-M649 WeakPolarHBondContact CG-SD 3.39Å; F525-V651 HydrophobicContact CD1-CG2 4.24Å; F525-V651 HydrophobicContact CE1-CG2 3.8Å; F525-F683 HydrophobicContact CB-CZ 4.48Å; F525-F683 AromaticContact CD2-CE1 3.97Å; F525-F683 HydrophobicContact CD2-CE1 3.97Å; F525-F683 AromaticContact CD2-CZ 3.47Å; F525-F683 HydrophobicContact CD2-CZ 3.47Å; F525-F683 VanDerWaalsContact CD2-CZ 3.47Å; F525-F683 HydrophobicContact CE2-CZ 4.02Å; F525-F683 HydrophobicContact CG-CZ 4.27Å
526	Y	92.5	Very high	91.3	Very high	3 Å²	3	17.6 Å²	17.6	1%	0.012	9%	0.09	C	C	.	.	H	α-helix	trans	-57.3	-49.5	177.8	-179.8	-100.3	0	0	0	111	V522 C523 C528 C529 V530 F573 P575 W576 A640 L642 V651	V522-Y526 PolarHBondContact O-N 3.49Å; C523-Y526 PolarHBondContact O-N 2.86Å; C523-Y526 VanDerWaalsContact O-N 3.17Å; Y526-C528 PolarHBondContact O-N 3.31Å; Y526-C529 WeakPolarHBondContact O-CB 3.08Å; Y526-C529 PolarHBondContact O-N 3.13Å; Y526-C529 VanDerWaalsContact O-N 3.12Å; Y526-V530 HydrophobicContact CD1-CG2 4.05Å; Y526-V530 HydrophobicContact CD2-CG2 4.35Å; Y526-V530 HydrophobicContact CE1-CG2 3.49Å; Y526-V530 VanDerWaalsContact CE1-CG2 3.49Å; Y526-V530 HydrophobicContact CE2-CG2 3.83Å; Y526-V530 HydrophobicContact CG-CG2 4.44Å; Y526-V530 PolarHBondContact O-N 2.66Å; Y526-V530 WeakPolarHBondContact OH-CG2 3.28Å; Y526-F573 HydrophobicContact CD1-CD2 4.38Å; Y526-F573 AromaticContact CD1-CE2 3.99Å; Y526-F573 HydrophobicContact CD1-CE2 3.99Å; Y526-F573 HydrophobicContact CE1-CD2 4.34Å; Y526-F573 AromaticContact CE1-CE2 3.92Å; Y526-F573 HydrophobicContact CE1-CE2 3.92Å; Y526-P575 HydrophobicContact CD1-CB 4.42Å; Y526-P575 HydrophobicContact CG-CB 4.31Å; Y526-W576 VanDerWaalsContact CZ-O 3.3Å; Y526-W576 PolarHBondContact OH-O 2.76Å; Y526-A640 PolarHBondContact OH-O 3.18Å; Y526-A640 VanDerWaalsContact OH-O 3.06Å; Y526-L642 HydrophobicContact CD2-CB 3.72Å; Y526-L642 HydrophobicContact CD2-CD1 4.42Å; Y526-L642 HydrophobicContact CE2-CB 4.2Å; Y526-L642 HydrophobicContact CG-CB 4.41Å; Y526-V651 HydrophobicContact CD2-CG1 4.47Å; Y526-V651 HydrophobicContact CD2-CG2 3.76Å; Y526-V651 HydrophobicContact CE2-CG1 4.3Å; Y526-V651 HydrophobicContact CE2-CG2 4.39Å
527	E	91.1	Very high	91.7	Very high	4 Å²	4	16.4 Å²	16.4	2%	0.019	8%	0.084	C	C	.	.	H	α-helix	trans	-55	-53.1	-179.6	-162.6	-155.7	142	0	0	111.4	C523 F525 C529 V530 R531 R572 F573	C523-E527 VanDerWaalsContact O-CB 3.25Å; C523-E527 WeakPolarHBondContact O-CB 3.38Å; C523-E527 PolarHBondContact O-N 3.33Å; F525-E527 VanDerWaalsContact C-N 3.34Å; F525-E527 PolarHBondContact O-N 2.85Å; E527-C529 VanDerWaalsContact C-N 3.27Å; E527-C529 PolarHBondContact O-N 3.45Å; E527-V530 PolarHBondContact O-N 2.99Å; E527-R531 WeakPolarHBondContact O-CG 3.46Å; E527-R531 PolarHBondContact O-N 3.29Å; E527-R531 IonicContact OE1-CZ 2.85Å; E527-R531 VanDerWaalsContact OE1-CZ 3.26Å; E527-R531 IonicContact OE1-NE 2.74Å; E527-R531 PolarHBondContact OE1-NE 3.49Å; E527-R531 IonicContact OE1-NH2 3.73Å; E527-R531 PolarHBondContact OE1-NH2 3.47Å; E527-R572 IonicContact OE1-NH1 3.88Å; E527-R572 PolarHBondContact OE1-NH1 3.16Å; E527-R572 WeakPolarHBondContact OE2-CD 3.33Å; E527-R572 IonicContact OE2-CZ 3.14Å; E527-R572 IonicContact OE2-NE 3.43Å; E527-R572 IonicContact OE2-NH1 2.82Å; E527-R572 PolarHBondContact OE2-NH1 3.41Å; E527-F573 HydrophobicContact CB-CE1 4.29Å; E527-F573 HydrophobicContact CB-CE2 4.29Å; E527-F573 HydrophobicContact CB-CZ 4.05Å; E527-F573 HydrophobicContact CG-CD1 3.63Å; E527-F573 HydrophobicContact CG-CD2 4.37Å; E527-F573 HydrophobicContact CG-CE1 3.18Å; E527-F573 HydrophobicContact CG-CE2 3.99Å; E527-F573 HydrophobicContact CG-CG 4.2Å; E527-F573 HydrophobicContact CG-CZ 3.39Å
528	C	92.9	Very high	91.9	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-62.9	-35.3	179.6	-67.8	0	0	0	0	112.2	L524 F525 Y526 C532 F683	L524-C528 WeakPolarHBondContact O-CB 3.2Å; L524-C528 PolarHBondContact O-N 3.26Å; L524-C528 VanDerWaalsContact O-N 3.17Å; L524-C528 PolarHBondContact O-SG 3.05Å; F525-C528 PolarHBondContact O-N 3.33Å; Y526-C528 PolarHBondContact O-N 3.31Å; C528-C532 WeakPolarHBondContact O-CB 3.27Å; C528-C532 PolarHBondContact O-N 2.9Å; C528-C532 VanDerWaalsContact O-N 3.1Å; C528-F683 HydrophobicContact CB-CD1 4.18Å; C528-F683 HydrophobicContact CB-CD2 3.52Å; C528-F683 HydrophobicContact CB-CE1 3.9Å; C528-F683 HydrophobicContact CB-CE2 3.24Å; C528-F683 HydrophobicContact CB-CG 3.99Å; C528-F683 HydrophobicContact CB-CZ 3.43Å; C528-F683 VanDerWaalsContact CB-CZ 3.43Å
529	C	94.3	Very high	92	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-67	-48.8	175.3	-69.3	0	0	0	0	111.5	I494 F525 Y526 E527 R531 C532 L533 V651	I494-C529 HydrophobicContact CD1-CB 4.44Å; F525-C529 VanDerWaalsContact CZ-SG 3.6Å; F525-C529 WeakPolarHBondContact O-CB 3.43Å; F525-C529 PolarHBondContact O-N 3.33Å; F525-C529 PolarHBondContact O-SG 2.88Å; Y526-C529 WeakPolarHBondContact O-CB 3.08Å; Y526-C529 PolarHBondContact O-N 3.13Å; Y526-C529 VanDerWaalsContact O-N 3.12Å; E527-C529 VanDerWaalsContact C-N 3.27Å; E527-C529 PolarHBondContact O-N 3.45Å; C529-R531 PolarHBondContact O-N 3.3Å; C529-C532 WeakPolarHBondContact O-CB 3.33Å; C529-C532 PolarHBondContact O-N 3.36Å; C529-L533 VanDerWaalsContact O-CG 3.27Å; C529-L533 WeakPolarHBondContact O-CG 3.34Å; C529-L533 PolarHBondContact O-N 3.43Å; C529-V651 HydrophobicContact CB-CB 4.32Å; C529-V651 HydrophobicContact CB-CG2 3.77Å
530	V	92	Very high	92.3	Very high	1 Å²	1	7.8 Å²	7.8	1%	0.006	5%	0.045	C	C	.	.	H	α-helix	trans	-60.2	-46.9	178.7	164.6	0	0	0	0	111.3	Y526 E527 C532 L533 L534 F573 L578	Y526-V530 HydrophobicContact CD1-CG2 4.05Å; Y526-V530 HydrophobicContact CD2-CG2 4.35Å; Y526-V530 HydrophobicContact CE1-CG2 3.49Å; Y526-V530 VanDerWaalsContact CE1-CG2 3.49Å; Y526-V530 HydrophobicContact CE2-CG2 3.83Å; Y526-V530 HydrophobicContact CG-CG2 4.44Å; Y526-V530 PolarHBondContact O-N 2.66Å; Y526-V530 WeakPolarHBondContact OH-CG2 3.28Å; E527-V530 PolarHBondContact O-N 2.99Å; V530-C532 VanDerWaalsContact C-N 3.29Å; V530-C532 PolarHBondContact O-N 3.34Å; V530-L533 WeakPolarHBondContact O-CB 3.25Å; V530-L533 PolarHBondContact O-N 3.09Å; V530-L533 VanDerWaalsContact O-N 3.1Å; V530-L534 HydrophobicContact CG1-CD1 3.83Å; V530-L534 HydrophobicContact CG1-CG 4.29Å; V530-L534 PolarHBondContact O-N 3.35Å; V530-F573 HydrophobicContact CB-CE2 4.21Å; V530-F573 HydrophobicContact CB-CZ 4.1Å; V530-F573 HydrophobicContact CG1-CE2 4.18Å; V530-F573 HydrophobicContact CG1-CZ 3.94Å; V530-L578 HydrophobicContact CG1-CD2 3.86Å; V530-L578 HydrophobicContact CG2-CD2 4.36Å
531	R	92.2	Very high	92.5	Very high	4 Å²	4	5 Å²	5	2%	0.015	3%	0.034	C	C	.	.	H	α-helix	trans	-60	-41.3	176.8	-68.2	-177.5	-172.5	-100.3	6.9	111.6	E527 C529 T535 L562 P566 A569 F573 F686	E527-R531 WeakPolarHBondContact O-CG 3.46Å; E527-R531 PolarHBondContact O-N 3.29Å; E527-R531 IonicContact OE1-CZ 2.85Å; E527-R531 VanDerWaalsContact OE1-CZ 3.26Å; E527-R531 IonicContact OE1-NE 2.74Å; E527-R531 PolarHBondContact OE1-NE 3.49Å; E527-R531 IonicContact OE1-NH2 3.73Å; E527-R531 PolarHBondContact OE1-NH2 3.47Å; C529-R531 PolarHBondContact O-N 3.3Å; R531-T535 VanDerWaalsContact O-CB 3.23Å; R531-T535 WeakPolarHBondContact O-CB 3.45Å; R531-T535 PolarHBondContact O-N 3.12Å; R531-T535 PolarHBondContact O-OG1 2.93Å; R531-L562 HydrophobicContact CG-CD2 4.21Å; R531-P566 PolarHBondContact NH1-O 3.05Å; R531-A569 PolarHBondContact NH1-O 3.32Å; R531-A569 PolarHBondContact NH2-O 3.3Å; R531-F573 HydrophobicContact CG-CE1 4.45Å; R531-F573 HydrophobicContact CG-CZ 4.46Å; R531-F686 HydrophobicContact CB-CD2 4.36Å; R531-F686 HydrophobicContact CB-CE2 3.74Å; R531-F686 HydrophobicContact CB-CZ 4.09Å; R531-F686 VanDerWaalsContact CD-CE1 3.42Å; R531-F686 VanDerWaalsContact CD-CE2 3.47Å; R531-F686 HydrophobicContact CG-CE2 4.28Å; R531-F686 HydrophobicContact CG-CZ 4.27Å
532	C	94.1	Very high	92.6	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-59.6	-47.9	173.4	-172.4	0	0	0	0	111.7	C528 C529 V530 T535 L536 L679 C682	C528-C532 WeakPolarHBondContact O-CB 3.27Å; C528-C532 PolarHBondContact O-N 2.9Å; C528-C532 VanDerWaalsContact O-N 3.1Å; C529-C532 WeakPolarHBondContact O-CB 3.33Å; C529-C532 PolarHBondContact O-N 3.36Å; V530-C532 VanDerWaalsContact C-N 3.29Å; V530-C532 PolarHBondContact O-N 3.34Å; C532-T535 PolarHBondContact O-N 3.33Å; C532-L536 WeakPolarHBondContact O-CB 3.32Å; C532-L536 VanDerWaalsContact O-CG 3.24Å; C532-L536 WeakPolarHBondContact O-CG 3.46Å; C532-L536 PolarHBondContact O-N 3.4Å; C532-L679 HydrophobicContact CB-CD1 3.87Å; C532-C682 VanDerWaalsContact CA-SG 3.55Å; C532-C682 HydrophobicContact CB-CB 4.09Å; C532-C682 VanDerWaalsContact CB-SG 3.54Å
533	L	95	Very high	92.8	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-58.9	-53.2	179.4	-69.5	167.3	0	0	0	111.4	I494 C529 V530 T535 L536 L537 A640 V651 V653 Y671 I675	I494-L533 HydrophobicContact CD1-CD1 4.27Å; I494-L533 HydrophobicContact CD1-CD2 4.05Å; I494-L533 HydrophobicContact CD1-CG 4.26Å; C529-L533 VanDerWaalsContact O-CG 3.27Å; C529-L533 WeakPolarHBondContact O-CG 3.34Å; C529-L533 PolarHBondContact O-N 3.43Å; V530-L533 WeakPolarHBondContact O-CB 3.25Å; V530-L533 PolarHBondContact O-N 3.09Å; V530-L533 VanDerWaalsContact O-N 3.1Å; L533-T535 PolarHBondContact O-N 2.86Å; L533-L536 PolarHBondContact O-N 2.81Å; L533-L537 PolarHBondContact O-N 2.95Å; L533-A640 HydrophobicContact CD1-CB 4.23Å; L533-V651 HydrophobicContact CD1-CG1 4.47Å; L533-V653 HydrophobicContact CD1-CG2 3.7Å; L533-V653 HydrophobicContact CD2-CG2 4.34Å; L533-Y671 VanDerWaalsContact C-OH 3.32Å; L533-Y671 WeakPolarHBondContact CA-OH 3.31Å; L533-Y671 WeakPolarHBondContact CB-OH 3.34Å; L533-Y671 HydrophobicContact CD2-CE1 3.68Å; L533-Y671 WeakPolarHBondContact CD2-OH 3.5Å; L533-Y671 PolarHBondContact O-OH 3.04Å; L533-I675 HydrophobicContact CD2-CD1 3.66Å; L533-I675 HydrophobicContact CD2-CG1 4.27Å
534	L	93.8	Very high	93	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-65.1	-40.3	-178.8	-66.7	176.3	0	0	0	112.4	V530 L536 L537 G538 I545 L562 P566 L578	V530-L534 HydrophobicContact CG1-CD1 3.83Å; V530-L534 HydrophobicContact CG1-CG 4.29Å; V530-L534 PolarHBondContact O-N 3.35Å; L534-L536 VanDerWaalsContact C-N 3.28Å; L534-L536 PolarHBondContact O-N 3.06Å; L534-L537 PolarHBondContact O-N 2.69Å; L534-G538 PolarHBondContact O-N 3.4Å; L534-I545 HydrophobicContact CD2-CD1 4.17Å; L534-L562 HydrophobicContact CD1-CB 4.13Å; L534-P566 HydrophobicContact CB-CB 4.15Å; L534-P566 HydrophobicContact CB-CG 3.67Å; L534-L578 HydrophobicContact CD1-CD2 4.4Å; L534-L578 HydrophobicContact CD2-CD2 4.19Å; L534-L578 HydrophobicContact CG-CD2 4.34Å
535	T	93.8	Very high	93.1	Very high	1 Å²	1	13.2 Å²	13.2	1%	0.006	7%	0.071	C	C	.	.	H	α-helix	trans	-61.3	-40.4	175.6	-54.5	0	0	0	0	111.1	R531 C532 L533 P539 V540 P566 Y607 P608 F609	R531-T535 VanDerWaalsContact O-CB 3.23Å; R531-T535 WeakPolarHBondContact O-CB 3.45Å; R531-T535 PolarHBondContact O-N 3.12Å; R531-T535 PolarHBondContact O-OG1 2.93Å; C532-T535 PolarHBondContact O-N 3.33Å; L533-T535 PolarHBondContact O-N 2.86Å; T535-P539 HydrophobicContact CG2-CG 4.44Å; T535-P539 VanDerWaalsContact O-CD 3.26Å; T535-P539 WeakPolarHBondContact O-CD 3.4Å; T535-V540 PolarHBondContact O-N 3.31Å; T535-V540 VanDerWaalsContact O-N 3.11Å; T535-P566 WeakPolarHBondContact OG1-CB 3.23Å; T535-Y607 HydrophobicContact CG2-CE2 3.74Å; T535-Y607 WeakPolarHBondContact OG1-CE2 3.39Å; T535-Y607 PolarHBondContact OG1-OH 3.44Å; T535-P608 HydrophobicContact CG2-CB 3.85Å; T535-F609 HydrophobicContact CG2-CD2 3.88Å; T535-F609 HydrophobicContact CG2-CE2 4.01Å
536	L	95.2	Very high	92.9	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.092	C	C	.	.	I	π-helix	trans	-68.9	-43.1	177.4	-71	177.3	0	0	0	111	C532 L533 L534 V540 F541 F609 Y671 L674 I675 Y678	C532-L536 WeakPolarHBondContact O-CB 3.32Å; C532-L536 VanDerWaalsContact O-CG 3.24Å; C532-L536 WeakPolarHBondContact O-CG 3.46Å; C532-L536 PolarHBondContact O-N 3.4Å; L533-L536 PolarHBondContact O-N 2.81Å; L534-L536 VanDerWaalsContact C-N 3.28Å; L534-L536 PolarHBondContact O-N 3.06Å; L536-V540 HydrophobicContact CD2-CB 4.3Å; L536-V540 HydrophobicContact CD2-CG1 4.39Å; L536-V540 HydrophobicContact CD2-CG2 4.14Å; L536-V540 CarbonylContact O-C 3.58Å; L536-V540 WeakPolarHBondContact O-CB 3.49Å; L536-F541 WeakPolarHBondContact O-CB 3.1Å; L536-F541 WeakPolarHBondContact O-CD2 3.28Å; L536-F541 PolarHBondContact O-N 2.79Å; L536-F609 HydrophobicContact CD2-CD2 4.16Å; L536-F609 HydrophobicContact CD2-CE2 4.34Å; L536-Y671 HydrophobicContact CB-CD2 4.21Å; L536-Y671 HydrophobicContact CB-CE2 3.53Å; L536-Y671 HydrophobicContact CD1-CE2 4.31Å; L536-L674 HydrophobicContact CD1-CB 4.1Å; L536-L674 HydrophobicContact CD2-CB 4Å; L536-L674 HydrophobicContact CD2-CD1 4.3Å; L536-I675 HydrophobicContact CD1-CB 4.37Å; L536-I675 HydrophobicContact CD1-CG1 3.64Å; L536-Y678 HydrophobicContact CD2-CD2 4.26Å
537	L	94.7	Very high	92.2	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.101	C	C	.	.	I	π-helix	trans	-65	-57.9	179.5	-78.1	165.4	0	0	0	112.7	L533 L534 F541 L542 F543 I545 F636 M638 F667 Y671	L533-L537 PolarHBondContact O-N 2.95Å; L534-L537 PolarHBondContact O-N 2.69Å; L537-F541 CarbonylContact O-C 3.59Å; L537-F541 PolarHBondContact O-N 3.28Å; L537-L542 PolarHBondContact O-N 2.76Å; L537-F543 HydrophobicContact CD2-CD2 4.04Å; L537-F543 HydrophobicContact CD2-CE2 4.43Å; L537-F543 HydrophobicContact CD2-CG 4.24Å; L537-F543 WeakPolarHBondContact O-CB 3.4Å; L537-F543 PolarHBondContact O-N 2.87Å; L537-I545 HydrophobicContact CB-CD1 3.73Å; L537-I545 HydrophobicContact CB-CG1 4.47Å; L537-F636 HydrophobicContact CD2-CE2 4.44Å; L537-F636 HydrophobicContact CD2-CZ 3.95Å; L537-M638 HydrophobicContact CD1-CE 3.74Å; L537-M638 HydrophobicContact CD1-SD 3.62Å; L537-F667 HydrophobicContact CD2-CE1 4.4Å; L537-F667 HydrophobicContact CD2-CE2 4.46Å; L537-F667 HydrophobicContact CD2-CZ 3.63Å; L537-Y671 HydrophobicContact CD2-CE2 4.2Å; L537-Y671 HydrophobicContact CG-CE2 3.91Å; L537-Y671 WeakPolarHBondContact CG-OH 3.48Å
538	G	93.1	Very high	90.8	Very high	15 Å²	15	20.9 Å²	20.9	16%	0.155	12%	0.117	C	C	.	.	I	π-helix	trans	-77.1	-80.7	-173	0	0	0	0	0	111.5	L534 V540 L542	L534-G538 PolarHBondContact O-N 3.4Å; G538-V540 VanDerWaalsContact C-N 3.33Å; G538-V540 PolarHBondContact O-N 2.88Å; G538-L542 WeakPolarHBondContact O-CA 3.47Å; G538-L542 PolarHBondContact O-N 3.02Å
539	P	90.3	Very high	89.2	Confident	45 Å²	45	30 Å²	30	29%	0.292	16%	0.159	S	C	.	.	I	π-helix	trans	-56	-38	-176.9	-27.7	32.3	0	0	0	115.5	T535 T613	T535-P539 HydrophobicContact CG2-CG 4.44Å; T535-P539 VanDerWaalsContact O-CD 3.26Å; T535-P539 WeakPolarHBondContact O-CD 3.4Å; P539-T613 WeakPolarHBondContact O-CB 3.46Å; P539-T613 WeakPolarHBondContact O-CG2 3.4Å; P539-T613 PolarHBondContact O-OG1 2.73Å
540	V	92.5	Very high	87.8	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.	I	π-helix	trans	-88.1	-55	-176.9	175.6	0	0	0	0	111.8	T535 L536 G538 F609 E612 S616 L674	T535-V540 PolarHBondContact O-N 3.31Å; T535-V540 VanDerWaalsContact O-N 3.11Å; L536-V540 HydrophobicContact CD2-CB 4.3Å; L536-V540 HydrophobicContact CD2-CG1 4.39Å; L536-V540 HydrophobicContact CD2-CG2 4.14Å; L536-V540 CarbonylContact O-C 3.58Å; L536-V540 WeakPolarHBondContact O-CB 3.49Å; G538-V540 VanDerWaalsContact C-N 3.33Å; G538-V540 PolarHBondContact O-N 2.88Å; V540-F609 HydrophobicContact CG2-CB 4.17Å; V540-F609 HydrophobicContact CG2-CD2 4.27Å; V540-E612 HydrophobicContact CG1-CB 3.74Å; V540-E612 HydrophobicContact CG2-CB 4.17Å; V540-S616 WeakPolarHBondContact O-CB 3.49Å; V540-S616 PolarHBondContact O-OG 2.83Å; V540-L674 HydrophobicContact CG1-CD1 4.04Å
541	F	93.4	Very high	86.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-4.1	-175.7	-76.1	-68.5	0	0	0	114.2	L536 L537 F543 T588 W589 F667 C670 Y671 L674	L536-F541 WeakPolarHBondContact O-CB 3.1Å; L536-F541 WeakPolarHBondContact O-CD2 3.28Å; L536-F541 PolarHBondContact O-N 2.79Å; L537-F541 CarbonylContact O-C 3.59Å; L537-F541 PolarHBondContact O-N 3.28Å; F541-F543 VanDerWaalsContact C-N 3.3Å; F541-F543 HydrophobicContact CB-CD2 3.61Å; F541-F543 HydrophobicContact CB-CE2 3.81Å; F541-F543 PolarHBondContact O-N 3.46Å; F541-T588 WeakPolarHBondContact CA-OG1 3.36Å; F541-T588 WeakPolarHBondContact CD1-OG1 3.27Å; F541-T588 PolarHBondContact O-OG1 2.84Å; F541-W589 HydrophobicContact CD1-CB 4.32Å; F541-W589 HydrophobicContact CE1-CB 3.92Å; F541-F667 HydrophobicContact CB-CE2 4.43Å; F541-F667 HydrophobicContact CD1-CE2 4.38Å; F541-F667 AromaticContact CD2-CE2 3.94Å; F541-F667 HydrophobicContact CD2-CE2 3.94Å; F541-F667 HydrophobicContact CE2-CE2 4.32Å; F541-F667 HydrophobicContact CG-CE2 4Å; F541-C670 HydrophobicContact CZ-CB 4.39Å; F541-Y671 AromaticContact CD2-CD2 3.91Å; F541-Y671 HydrophobicContact CD2-CD2 3.91Å; F541-Y671 HydrophobicContact CD2-CE2 4.41Å; F541-Y671 AromaticContact CE2-CD2 3.66Å; F541-Y671 HydrophobicContact CE2-CD2 3.66Å; F541-Y671 HydrophobicContact CE2-CE2 4.46Å; F541-L674 HydrophobicContact CE1-CD1 4.26Å; F541-L674 HydrophobicContact CE2-CD1 3.6Å; F541-L674 HydrophobicContact CE2-CG 4.34Å; F541-L674 HydrophobicContact CZ-CD1 3.35Å; F541-L674 HydrophobicContact CZ-CG 4.03Å
542	L	92.9	Very high	85.8	Confident	55 Å²	55	41 Å²	41	29%	0.288	24%	0.236	S	C	.	.			trans	58.9	43.1	-179.6	-47.3	179.2	0	0	0	111.3	L537 G538 S584 T588 R617 A620	L537-L542 PolarHBondContact O-N 2.76Å; G538-L542 WeakPolarHBondContact O-CA 3.47Å; G538-L542 PolarHBondContact O-N 3.02Å; L542-S584 PolarHBondContact O-OG 3.32Å; L542-S584 VanDerWaalsContact O-OG 3.08Å; L542-T588 HydrophobicContact CD1-CG2 4.14Å; L542-T588 HydrophobicContact CG-CG2 4.44Å; L542-R617 HydrophobicContact CD1-CG 4.33Å; L542-A620 HydrophobicContact CD1-CB 4.08Å
543	F	93.4	Very high	84.9	Confident	11 Å²	11	49.1 Å²	49.1	5%	0.048	27%	0.274	C	S	.	.			trans	-80.8	134.7	164.8	-80.5	-96	0	0	0	109.8	L537 F541 I545 C582 R583 W589 L634 F636 F667	L537-F543 HydrophobicContact CD2-CD2 4.04Å; L537-F543 HydrophobicContact CD2-CE2 4.43Å; L537-F543 HydrophobicContact CD2-CG 4.24Å; L537-F543 WeakPolarHBondContact O-CB 3.4Å; L537-F543 PolarHBondContact O-N 2.87Å; F541-F543 VanDerWaalsContact C-N 3.3Å; F541-F543 HydrophobicContact CB-CD2 3.61Å; F541-F543 HydrophobicContact CB-CE2 3.81Å; F541-F543 PolarHBondContact O-N 3.46Å; F543-I545 HydrophobicContact CB-CG1 4.3Å; F543-C582 HydrophobicContact CB-CB 4.47Å; F543-C582 HydrophobicContact CD1-CB 3.63Å; F543-C582 HydrophobicContact CE1-CB 4.24Å; F543-C582 HydrophobicContact CG-CB 4.29Å; F543-R583 CarbonylContact C-O 3.56Å; F543-R583 WeakPolarHBondContact CA-O 3.45Å; F543-R583 VanDerWaalsContact CD1-C 3.44Å; F543-W589 HydrophobicContact CE2-CE3 4.13Å; F543-W589 AromaticContact CE2-CZ3 3.76Å; F543-W589 HydrophobicContact CE2-CZ3 3.76Å; F543-W589 HydrophobicContact CZ-CE3 4.23Å; F543-W589 HydrophobicContact CZ-CH2 4.19Å; F543-W589 AromaticContact CZ-CZ3 3.56Å; F543-W589 HydrophobicContact CZ-CZ3 3.56Å; F543-L634 HydrophobicContact CZ-CD2 4.12Å; F543-F636 HydrophobicContact CD1-CE1 4.31Å; F543-F636 HydrophobicContact CD1-CZ 4.4Å; F543-F636 HydrophobicContact CE1-CD1 4.33Å; F543-F636 AromaticContact CE1-CE1 3.44Å; F543-F636 HydrophobicContact CE1-CE1 3.44Å; F543-F636 VanDerWaalsContact CE1-CE1 3.44Å; F543-F636 AromaticContact CE1-CZ 3.9Å; F543-F636 HydrophobicContact CE1-CZ 3.9Å; F543-F636 AromaticContact CZ-CE1 3.67Å; F543-F636 HydrophobicContact CZ-CE1 3.67Å; F543-F636 HydrophobicContact CZ-CZ 4.11Å; F543-F667 HydrophobicContact CD2-CE2 4.44Å; F543-F667 AromaticContact CE2-CD2 3.92Å; F543-F667 HydrophobicContact CE2-CD2 3.92Å; F543-F667 AromaticContact CE2-CE2 3.51Å; F543-F667 HydrophobicContact CE2-CE2 3.51Å; F543-F667 AromaticContact CE2-CZ 3.97Å; F543-F667 HydrophobicContact CE2-CZ 3.97Å; F543-F667 HydrophobicContact CZ-CD2 4.11Å; F543-F667 HydrophobicContact CZ-CE2 4.01Å; F543-F667 HydrophobicContact CZ-CG 4.44Å; F543-F667 HydrophobicContact CZ-CZ 4.24Å
544	E	93	Very high	84	Confident	118 Å²	118	53.2 Å²	53.2	55%	0.551	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	125.6	156.8	-173.4	-178.7	-171.8	0	0	107.6	C582 R583	E544-C582 CarbonylContact O-C 3.53Å; E544-C582 WeakPolarHBondContact O-CA 3.37Å; E544-R583 PolarHBondContact N-O 2.89Å; E544-R583 PolarHBondContact O-N 3.38Å
545	I	92.6	Very high	83	Confident	20 Å²	20	54.8 Å²	54.8	10%	0.103	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	122.5	-177	-54.6	175.3	0	0	0	107.4	L534 L537 F543 V563 V580 T581	L534-I545 HydrophobicContact CD2-CD1 4.17Å; L537-I545 HydrophobicContact CB-CD1 3.73Å; L537-I545 HydrophobicContact CB-CG1 4.47Å; F543-I545 HydrophobicContact CB-CG1 4.3Å; I545-V563 HydrophobicContact CB-CG1 3.83Å; I545-V563 HydrophobicContact CG2-CG1 3.86Å; I545-V563 HydrophobicContact CG2-CG2 4.09Å; I545-V563 WeakPolarHBondContact O-CG1 3.41Å; I545-V580 HydrophobicContact CG2-CB 3.7Å; I545-V580 HydrophobicContact CG2-CG1 3.91Å; I545-V580 HydrophobicContact CG2-CG2 4.06Å; I545-T581 CarbonylContact C-O 3.59Å; I545-T581 WeakPolarHBondContact CA-O 3.42Å
546	T	88.8	Confident	82.4	Confident	71 Å²	71	56.4 Å²	56.4	44%	0.436	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.6	174.8	53.9	0	0	0	0	109.8	T581	T546-T581 PolarHBondContact N-O 2.92Å; T546-T581 PolarHBondContact O-N 3.05Å
547	Q	76.3	Confident	81.7	Confident	42 Å²	42	62.4 Å²	62.4	20%	0.196	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-102.5	138.2	-177.9	-160.4	-176.6	4.4	0	0	110.9	V550 K579 V580	Q547-V550 HydrophobicContact CG-CG2 4.45Å; Q547-K579 WeakPolarHBondContact CG-O 3.24Å; Q547-V580 HydrophobicContact CG-CG1 4.41Å
548	P	62.7	Low	81.1	Confident	54 Å²	54	63.3 Å²	63.3	35%	0.351	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-70.8	147.6	162.9	26.5	-25.4	0	0	0	111	V550 K579	P548-V550 PolarHBondContact O-N 2.54Å; P548-K579 WeakPolarHBondContact CD-O 3.06Å; P548-K579 HydrophobicContact CG-CB 4.18Å; P548-K579 HydrophobicContact CG-CD 4.18Å; P548-K579 HydrophobicContact CG-CG 3.88Å
549	Q	59.4	Low	80.5	Confident	192 Å²	192	63 Å²	63	90%	0.897	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-52	125.4	-179.2	-78.1	-177.6	-17.6	0	0	112
550	V	65.9	Low	80.2	Confident	41 Å²	41	65.5 Å²	65.5	25%	0.248	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-96	139.9	174.6	-161.8	0	0	0	0	108.7	Q547 P548 N552 M555 Q556	Q547-V550 HydrophobicContact CG-CG2 4.45Å; P548-V550 PolarHBondContact O-N 2.54Å; V550-N552 PolarHBondContact O-N 2.99Å; V550-N552 VanDerWaalsContact O-N 3.1Å; V550-M555 HydrophobicContact CB-CE 4.43Å; V550-M555 HydrophobicContact CG1-CE 3.05Å; V550-M555 HydrophobicContact CG1-CG 4.04Å; V550-M555 HydrophobicContact CG1-SD 4.07Å; V550-Q556 VanDerWaalsContact CB-OE1 3.25Å; V550-Q556 VanDerWaalsContact CG2-OE1 3.28Å
551	A	64.5	Low	79.8	Confident	114 Å²	114	68.8 Å²	68.8	94%	0.942	37%	0.368	S	S	*	.	S	Bend	trans	-66.4	-13.3	-172.3	0	0	0	0	0	115.4
552	N	76.3	Confident	79.4	Confident	80 Å²	80	68.8 Å²	68.8	43%	0.428	37%	0.368	S	S	.	.			trans	-117.4	119.7	-176.7	-178.3	-9.9	0	0	0	110.1	V550 S554 M555 Q556	V550-N552 PolarHBondContact O-N 2.99Å; V550-N552 VanDerWaalsContact O-N 3.1Å; N552-S554 PolarHBondContact O-N 3.07Å; N552-S554 PolarHBondContact OD1-N 2.95Å; N552-S554 PolarHBondContact OD1-OG 2.95Å; N552-M555 HydrophobicContact CB-CB 4.04Å; N552-M555 HydrophobicContact CB-CE 4.18Å; N552-M555 WeakPolarHBondContact O-CB 3.4Å; N552-M555 PolarHBondContact O-N 2.93Å; N552-M555 VanDerWaalsContact O-N 3.15Å; N552-Q556 PolarHBondContact O-N 2.72Å
553	E	76.4	Confident	79.1	Confident	172 Å²	172	67.6 Å²	67.6	80%	0.804	36%	0.363	S	S	*	.	H	α-helix	trans	-60	-38.7	-176.1	-68.7	-177.4	165.5	0	0	113.6	M555 Q556 H557	E553-M555 VanDerWaalsContact C-N 3.3Å; E553-M555 PolarHBondContact O-N 3.47Å; E553-Q556 WeakPolarHBondContact O-CB 3.22Å; E553-Q556 PolarHBondContact O-N 3.5Å; E553-H557 PolarHBondContact O-N 3.29Å
554	S	74.6	Confident	78.8	Confident	85 Å²	85	73 Å²	73	59%	0.594	40%	0.397	S	S	*	.	H	α-helix	trans	-68.6	-33.9	178.2	57.1	0	0	0	0	111.9	N552 L558	N552-S554 PolarHBondContact O-N 3.07Å; N552-S554 PolarHBondContact OD1-N 2.95Å; N552-S554 PolarHBondContact OD1-OG 2.95Å; S554-L558 PolarHBondContact O-N 3.1Å
555	M	74.4	Confident	78.4	Confident	35 Å²	35	69.3 Å²	69.3	17%	0.172	38%	0.38	C	S	.	.	H	α-helix	trans	-72.3	-38.5	173.6	-179.5	160.8	61.9	0	0	111.7	V550 N552 E553 L558 M559 W576	V550-M555 HydrophobicContact CB-CE 4.43Å; V550-M555 HydrophobicContact CG1-CE 3.05Å; V550-M555 HydrophobicContact CG1-CG 4.04Å; V550-M555 HydrophobicContact CG1-SD 4.07Å; N552-M555 HydrophobicContact CB-CB 4.04Å; N552-M555 HydrophobicContact CB-CE 4.18Å; N552-M555 WeakPolarHBondContact O-CB 3.4Å; N552-M555 PolarHBondContact O-N 2.93Å; N552-M555 VanDerWaalsContact O-N 3.15Å; E553-M555 VanDerWaalsContact C-N 3.3Å; E553-M555 PolarHBondContact O-N 3.47Å; M555-L558 PolarHBondContact O-N 3.3Å; M555-M559 HydrophobicContact CG-CG 4.29Å; M555-M559 WeakPolarHBondContact O-CB 3.3Å; M555-M559 WeakPolarHBondContact O-CG 3.44Å; M555-M559 PolarHBondContact O-N 2.52Å; M555-W576 HydrophobicContact CB-CE3 4.39Å; M555-W576 HydrophobicContact CB-CZ3 4.22Å; M555-W576 HydrophobicContact CG-CD2 4.14Å; M555-W576 HydrophobicContact CG-CE3 3.53Å; M555-W576 HydrophobicContact CG-CZ3 3.79Å; M555-W576 HydrophobicContact SD-CB 3.62Å; M555-W576 HydrophobicContact SD-CD2 3.32Å; M555-W576 HydrophobicContact SD-CE3 3.35Å; M555-W576 HydrophobicContact SD-CG 3.44Å; M555-W576 HydrophobicContact SD-CZ3 4.1Å
556	Q	79.8	Confident	78	Confident	34 Å²	34	68.5 Å²	68.5	16%	0.159	38%	0.376	C	S	.	.	H	α-helix	trans	-57.1	-51.4	175.7	-174.5	73.3	27.2	0	0	110.5	V550 N552 E553 L558 M559 E560	V550-Q556 VanDerWaalsContact CB-OE1 3.25Å; V550-Q556 VanDerWaalsContact CG2-OE1 3.28Å; N552-Q556 PolarHBondContact O-N 2.72Å; E553-Q556 WeakPolarHBondContact O-CB 3.22Å; E553-Q556 PolarHBondContact O-N 3.5Å; Q556-L558 PolarHBondContact O-N 3.19Å; Q556-M559 PolarHBondContact O-N 3.26Å; Q556-E560 WeakPolarHBondContact CG-OE1 3.46Å; Q556-E560 PolarHBondContact NE2-OE1 2.86Å; Q556-E560 WeakPolarHBondContact O-CG 3.43Å; Q556-E560 PolarHBondContact O-N 3.24Å
557	H	81.8	Confident	77.5	Confident	127 Å²	127	67 Å²	67	59%	0.588	37%	0.369	S	S	*	.	H	α-helix	trans	-60	-46	-179.9	-174.5	-79.2	0	0	0	112.5	E553 M559 E560 E561	E553-H557 PolarHBondContact O-N 3.29Å; H557-M559 VanDerWaalsContact C-N 3.32Å; H557-M559 PolarHBondContact O-N 3.42Å; H557-E560 PolarHBondContact O-N 3.11Å; H557-E561 PolarHBondContact O-N 2.97Å
558	L	80.8	Confident	77.3	Confident	18 Å²	18	71.9 Å²	71.9	9%	0.094	39%	0.389	C	S	.	.	H	α-helix	trans	-64.3	-37.5	179.4	-173.7	64.8	0	0	0	112.4	S554 M555 Q556 E561 L562 A569 D571 F573 W576	S554-L558 PolarHBondContact O-N 3.1Å; M555-L558 PolarHBondContact O-N 3.3Å; Q556-L558 PolarHBondContact O-N 3.19Å; L558-E561 PolarHBondContact O-N 3.38Å; L558-L562 HydrophobicContact CG-CD1 4.38Å; L558-L562 WeakPolarHBondContact O-CB 3.44Å; L558-L562 WeakPolarHBondContact O-CG 3.39Å; L558-L562 PolarHBondContact O-N 2.61Å; L558-A569 HydrophobicContact CD1-CB 4.23Å; L558-D571 HydrophobicContact CD1-CB 4.34Å; L558-F573 HydrophobicContact CD2-CB 3.48Å; L558-F573 VanDerWaalsContact CD2-CB 3.48Å; L558-F573 HydrophobicContact CD2-CG 4.34Å; L558-W576 HydrophobicContact CD2-CH2 4.16Å; L558-W576 HydrophobicContact CD2-CZ3 3.75Å
559	M	80	Confident	77.4	Confident	10 Å²	10	69.6 Å²	69.6	5%	0.049	38%	0.375	C	S	.	.	H	α-helix	trans	-71.3	-39.4	177.2	-69.5	-67.4	118.3	0	0	112.2	M555 Q556 H557 E561 L562 V563 F573 W576 L578	M555-M559 HydrophobicContact CG-CG 4.29Å; M555-M559 WeakPolarHBondContact O-CB 3.3Å; M555-M559 WeakPolarHBondContact O-CG 3.44Å; M555-M559 PolarHBondContact O-N 2.52Å; Q556-M559 PolarHBondContact O-N 3.26Å; H557-M559 VanDerWaalsContact C-N 3.32Å; H557-M559 PolarHBondContact O-N 3.42Å; M559-E561 VanDerWaalsContact C-N 3.3Å; M559-E561 PolarHBondContact O-N 3.22Å; M559-L562 HydrophobicContact CE-CD1 3.42Å; M559-L562 VanDerWaalsContact CE-CD1 3.42Å; M559-L562 PolarHBondContact O-N 3.48Å; M559-L562 HydrophobicContact SD-CD1 4.21Å; M559-V563 WeakPolarHBondContact O-CB 3.47Å; M559-V563 WeakPolarHBondContact O-CG2 3.33Å; M559-V563 PolarHBondContact O-N 3.47Å; M559-F573 HydrophobicContact CE-CD2 4.23Å; M559-F573 HydrophobicContact CE-CG 4.45Å; M559-W576 HydrophobicContact CE-CE3 4.08Å; M559-W576 HydrophobicContact CE-CZ3 4.35Å; M559-L578 HydrophobicContact SD-CD1 3.81Å
560	E	84	Confident	77.5	Confident	96 Å²	96	64 Å²	64	45%	0.449	37%	0.369	S	S	.	.	H	α-helix	trans	-58.7	-43.8	172.5	-75.1	172.3	-171.9	0	0	110.9	Q556 H557 V563 V564	Q556-E560 WeakPolarHBondContact CG-OE1 3.46Å; Q556-E560 PolarHBondContact NE2-OE1 2.86Å; Q556-E560 WeakPolarHBondContact O-CG 3.43Å; Q556-E560 PolarHBondContact O-N 3.24Å; H557-E560 PolarHBondContact O-N 3.11Å; E560-V563 PolarHBondContact O-N 2.92Å; E560-V564 VanDerWaalsContact O-CG2 3.31Å; E560-V564 WeakPolarHBondContact O-CG2 3.37Å; E560-V564 PolarHBondContact O-N 3.21Å
561	E	85.4	Confident	77.6	Confident	69 Å²	69	67.5 Å²	67.5	32%	0.322	39%	0.386	S	S	.	.	H	α-helix	trans	-61.9	-45.9	174.9	-167.7	-177.1	162.6	0	0	112.1	H557 L558 M559 V563 V564 D565	H557-E561 PolarHBondContact O-N 2.97Å; L558-E561 PolarHBondContact O-N 3.38Å; M559-E561 VanDerWaalsContact C-N 3.3Å; M559-E561 PolarHBondContact O-N 3.22Å; E561-V563 VanDerWaalsContact C-N 3.31Å; E561-V563 PolarHBondContact O-N 3.35Å; E561-V564 PolarHBondContact O-N 3.1Å; E561-D565 PolarHBondContact O-N 3.32Å
562	L	85.1	Confident	78.2	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-33.3	177.7	-78.3	165.9	0	0	0	113.4	R531 L534 L558 M559 P566 A569 F573	R531-L562 HydrophobicContact CG-CD2 4.21Å; L534-L562 HydrophobicContact CD1-CB 4.13Å; L558-L562 HydrophobicContact CG-CD1 4.38Å; L558-L562 WeakPolarHBondContact O-CB 3.44Å; L558-L562 WeakPolarHBondContact O-CG 3.39Å; L558-L562 PolarHBondContact O-N 2.61Å; M559-L562 HydrophobicContact CE-CD1 3.42Å; M559-L562 VanDerWaalsContact CE-CD1 3.42Å; M559-L562 PolarHBondContact O-N 3.48Å; M559-L562 HydrophobicContact SD-CD1 4.21Å; L562-P566 WeakPolarHBondContact O-CA 3.26Å; L562-P566 VanDerWaalsContact O-CD 3.25Å; L562-P566 WeakPolarHBondContact O-CD 3.4Å; L562-P566 WeakPolarHBondContact O-CG 3.24Å; L562-P566 VanDerWaalsContact O-N 3.16Å; L562-A569 HydrophobicContact CD2-CB 3.61Å; L562-A569 HydrophobicContact CG-CB 3.96Å; L562-F573 HydrophobicContact CD1-CD1 3.74Å; L562-F573 HydrophobicContact CD1-CE1 3.43Å; L562-F573 VanDerWaalsContact CD1-CE1 3.43Å; L562-F573 HydrophobicContact CD1-CE2 4.36Å; L562-F573 HydrophobicContact CD1-CG 4.31Å; L562-F573 HydrophobicContact CD1-CZ 3.78Å; L562-F573 HydrophobicContact CD2-CE1 3.74Å; L562-F573 HydrophobicContact CD2-CZ 4.35Å; L562-F573 HydrophobicContact CG-CE1 4.22Å
563	V	86.2	Confident	78.4	Confident	30 Å²	30	63.1 Å²	63.1	18%	0.182	34%	0.339	C	S	.	.	H	α-helix	trans	-70.9	-41.5	176.5	166.2	0	0	0	0	110.9	I545 M559 E560 E561 V580	I545-V563 HydrophobicContact CB-CG1 3.83Å; I545-V563 HydrophobicContact CG2-CG1 3.86Å; I545-V563 HydrophobicContact CG2-CG2 4.09Å; I545-V563 WeakPolarHBondContact O-CG1 3.41Å; M559-V563 WeakPolarHBondContact O-CB 3.47Å; M559-V563 WeakPolarHBondContact O-CG2 3.33Å; M559-V563 PolarHBondContact O-N 3.47Å; E560-V563 PolarHBondContact O-N 2.92Å; E561-V563 VanDerWaalsContact C-N 3.31Å; E561-V563 PolarHBondContact O-N 3.35Å; V563-V580 HydrophobicContact CG2-CG1 4.39Å
564	V	86.1	Confident	78.1	Confident	126 Å²	126	55.6 Å²	55.6	76%	0.764	31%	0.308	S	S	*	.	H	α-helix	trans	-68.4	-48.5	178.9	171.2	0	0	0	0	111	E560 E561	E560-V564 VanDerWaalsContact O-CG2 3.31Å; E560-V564 WeakPolarHBondContact O-CG2 3.37Å; E560-V564 PolarHBondContact O-N 3.21Å; E561-V564 PolarHBondContact O-N 3.1Å
565	D	84.9	Confident	78	Confident	39 Å²	39	53.4 Å²	53.4	21%	0.209	29%	0.292	C	S	.	.			trans	-147.8	92.3	-179.4	-165.5	-16.4	0	0	0	111.2	E561 S567 K568	E561-D565 PolarHBondContact O-N 3.32Å; D565-S567 PolarHBondContact O-N 3.47Å; D565-S567 VanDerWaalsContact OD1-CB 3.3Å; D565-S567 WeakPolarHBondContact OD1-CB 3.35Å; D565-S567 PolarHBondContact OD1-N 3.12Å; D565-S567 PolarHBondContact OD1-OG 3.49Å; D565-K568 HydrophobicContact CB-CB 4.14Å; D565-K568 HydrophobicContact CB-CD 4.11Å; D565-K568 HydrophobicContact CB-CG 4.22Å; D565-K568 PolarHBondContact O-N 3.17Å; D565-K568 WeakPolarHBondContact OD2-CD 2.9Å; D565-K568 WeakPolarHBondContact OD2-CE 3.16Å; D565-K568 VanDerWaalsContact OD2-CG 3.27Å; D565-K568 WeakPolarHBondContact OD2-CG 3.47Å; D565-K568 IonicContact OD2-NZ 3.02Å; D565-K568 PolarHBondContact OD2-NZ 2.83Å
566	P	83.8	Confident	78.3	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.019	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-14.6	178.6	-18.8	26.3	0	0	0	113.8	R531 L534 T535 L562 Y607	R531-P566 PolarHBondContact NH1-O 3.05Å; L534-P566 HydrophobicContact CB-CB 4.15Å; L534-P566 HydrophobicContact CB-CG 3.67Å; T535-P566 WeakPolarHBondContact OG1-CB 3.23Å; L562-P566 WeakPolarHBondContact O-CA 3.26Å; L562-P566 VanDerWaalsContact O-CD 3.25Å; L562-P566 WeakPolarHBondContact O-CD 3.4Å; L562-P566 WeakPolarHBondContact O-CG 3.24Å; L562-P566 VanDerWaalsContact O-N 3.16Å; P566-Y607 PolarHBondContact O-OH 3.09Å
567	S	79.7	Confident	78.2	Confident	40 Å²	40	59.4 Å²	59.4	28%	0.28	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-20.2	178.4	77.6	0	0	0	0	114.1	D565 Y607	D565-S567 PolarHBondContact O-N 3.47Å; D565-S567 VanDerWaalsContact OD1-CB 3.3Å; D565-S567 WeakPolarHBondContact OD1-CB 3.35Å; D565-S567 PolarHBondContact OD1-N 3.12Å; D565-S567 PolarHBondContact OD1-OG 3.49Å; S567-Y607 PolarHBondContact N-OH 3.13Å
568	K	72.5	Confident	78.4	Confident	144 Å²	144	53.5 Å²	53.5	63%	0.626	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-19.6	-167.3	-80.3	-176.5	-174.3	159.6	0	116.8	D565 G570	D565-K568 HydrophobicContact CB-CB 4.14Å; D565-K568 HydrophobicContact CB-CD 4.11Å; D565-K568 HydrophobicContact CB-CG 4.22Å; D565-K568 PolarHBondContact O-N 3.17Å; D565-K568 WeakPolarHBondContact OD2-CD 2.9Å; D565-K568 WeakPolarHBondContact OD2-CE 3.16Å; D565-K568 VanDerWaalsContact OD2-CG 3.27Å; D565-K568 WeakPolarHBondContact OD2-CG 3.47Å; D565-K568 IonicContact OD2-NZ 3.02Å; D565-K568 PolarHBondContact OD2-NZ 2.83Å; K568-G570 PolarHBondContact O-N 3.36Å
569	A	63.3	Low	78.8	Confident	7 Å²	7	56.2 Å²	56.2	6%	0.058	31%	0.308	C	S	.	.			trans	-63.2	108	-177.1	0	0	0	0	0	110.3	R531 L558 L562 D571	R531-A569 PolarHBondContact NH1-O 3.32Å; R531-A569 PolarHBondContact NH2-O 3.3Å; L558-A569 HydrophobicContact CD1-CB 4.23Å; L562-A569 HydrophobicContact CD2-CB 3.61Å; L562-A569 HydrophobicContact CG-CB 3.96Å; A569-D571 VanDerWaalsContact C-N 3.31Å
570	G	62.8	Low	79.4	Confident	73 Å²	73	55.7 Å²	55.7	75%	0.753	31%	0.306	S	S	*	.			trans	-73.9	-24.7	179.7	0	0	0	0	0	112.7	K568	K568-G570 PolarHBondContact O-N 3.36Å
571	D	66.9	Low	79.7	Confident	116 Å²	116	52.6 Å²	52.6	62%	0.62	29%	0.293	S	S	*	.	S	Bend	trans	-84.9	133.5	-176.9	-66.6	-27	0	0	0	111.8	L558 A569	L558-D571 HydrophobicContact CD1-CB 4.34Å; A569-D571 VanDerWaalsContact C-N 3.31Å
572	R	77.8	Confident	80.1	Confident	95 Å²	95	49.3 Å²	49.3	36%	0.358	28%	0.278	S	S	.	.			trans	-65.6	136.6	170	-64.3	-65.8	-176.6	-172	-5.7	108.4	Y507 E527 F686	Y507-R572 PolarHBondContact OH-NH2 2.78Å; E527-R572 IonicContact OE1-NH1 3.88Å; E527-R572 PolarHBondContact OE1-NH1 3.16Å; E527-R572 WeakPolarHBondContact OE2-CD 3.33Å; E527-R572 IonicContact OE2-CZ 3.14Å; E527-R572 IonicContact OE2-NE 3.43Å; E527-R572 IonicContact OE2-NH1 2.82Å; E527-R572 PolarHBondContact OE2-NH1 3.41Å; R572-F686 PolarHBondContact NH2-O 3.38Å
573	F	79.8	Confident	80.4	Confident	6 Å²	6	54.9 Å²	54.9	3%	0.026	30%	0.299	C	S	.	.			trans	-119.7	151.6	178.3	59.9	-94.4	0	0	0	112.8	Y526 E527 V530 R531 L558 M559 L562 W576	Y526-F573 HydrophobicContact CD1-CD2 4.38Å; Y526-F573 AromaticContact CD1-CE2 3.99Å; Y526-F573 HydrophobicContact CD1-CE2 3.99Å; Y526-F573 HydrophobicContact CE1-CD2 4.34Å; Y526-F573 AromaticContact CE1-CE2 3.92Å; Y526-F573 HydrophobicContact CE1-CE2 3.92Å; E527-F573 HydrophobicContact CB-CE1 4.29Å; E527-F573 HydrophobicContact CB-CE2 4.29Å; E527-F573 HydrophobicContact CB-CZ 4.05Å; E527-F573 HydrophobicContact CG-CD1 3.63Å; E527-F573 HydrophobicContact CG-CD2 4.37Å; E527-F573 HydrophobicContact CG-CE1 3.18Å; E527-F573 HydrophobicContact CG-CE2 3.99Å; E527-F573 HydrophobicContact CG-CG 4.2Å; E527-F573 HydrophobicContact CG-CZ 3.39Å; V530-F573 HydrophobicContact CB-CE2 4.21Å; V530-F573 HydrophobicContact CB-CZ 4.1Å; V530-F573 HydrophobicContact CG1-CE2 4.18Å; V530-F573 HydrophobicContact CG1-CZ 3.94Å; R531-F573 HydrophobicContact CG-CE1 4.45Å; R531-F573 HydrophobicContact CG-CZ 4.46Å; L558-F573 HydrophobicContact CD2-CB 3.48Å; L558-F573 VanDerWaalsContact CD2-CB 3.48Å; L558-F573 HydrophobicContact CD2-CG 4.34Å; M559-F573 HydrophobicContact CE-CD2 4.23Å; M559-F573 HydrophobicContact CE-CG 4.45Å; L562-F573 HydrophobicContact CD1-CD1 3.74Å; L562-F573 HydrophobicContact CD1-CE1 3.43Å; L562-F573 VanDerWaalsContact CD1-CE1 3.43Å; L562-F573 HydrophobicContact CD1-CE2 4.36Å; L562-F573 HydrophobicContact CD1-CG 4.31Å; L562-F573 HydrophobicContact CD1-CZ 3.78Å; L562-F573 HydrophobicContact CD2-CE1 3.74Å; L562-F573 HydrophobicContact CD2-CZ 4.35Å; L562-F573 HydrophobicContact CG-CE1 4.22Å; F573-W576 HydrophobicContact CB-CE3 4.42Å; F573-W576 HydrophobicContact CB-CH2 4.32Å; F573-W576 HydrophobicContact CB-CZ3 3.96Å
574	G	70.3	Confident	80.6	Confident	14 Å²	14	53.6 Å²	53.6	14%	0.144	29%	0.291	C	S	.	.			trans	-75.9	173.9	-179.5	0	0	0	0	0	113	W576	G574-W576 PolarHBondContact O-N 2.98Å
575	P	73.4	Confident	80.5	Confident	40 Å²	40	52 Å²	52	26%	0.26	28%	0.282	S	S	.	.			trans	-82.2	59	-176.5	35.7	-31	0	0	0	110.6	Y526 L642	Y526-P575 HydrophobicContact CD1-CB 4.42Å; Y526-P575 HydrophobicContact CG-CB 4.31Å; P575-L642 HydrophobicContact CB-CB 3.81Å; P575-L642 HydrophobicContact CB-CD2 3.35Å; P575-L642 HydrophobicContact CB-CG 4.18Å; P575-L642 HydrophobicContact CG-CD2 3.93Å
576	W	79.5	Confident	80.4	Confident	95 Å²	95	51.1 Å²	51.1	36%	0.36	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-81.3	139.1	-179.2	-51.6	-40.7	0	0	0	110.1	Y526 M555 L558 M559 F573 G574 L578	Y526-W576 VanDerWaalsContact CZ-O 3.3Å; Y526-W576 PolarHBondContact OH-O 2.76Å; M555-W576 HydrophobicContact CB-CE3 4.39Å; M555-W576 HydrophobicContact CB-CZ3 4.22Å; M555-W576 HydrophobicContact CG-CD2 4.14Å; M555-W576 HydrophobicContact CG-CE3 3.53Å; M555-W576 HydrophobicContact CG-CZ3 3.79Å; M555-W576 HydrophobicContact SD-CB 3.62Å; M555-W576 HydrophobicContact SD-CD2 3.32Å; M555-W576 HydrophobicContact SD-CE3 3.35Å; M555-W576 HydrophobicContact SD-CG 3.44Å; M555-W576 HydrophobicContact SD-CZ3 4.1Å; L558-W576 HydrophobicContact CD2-CH2 4.16Å; L558-W576 HydrophobicContact CD2-CZ3 3.75Å; M559-W576 HydrophobicContact CE-CE3 4.08Å; M559-W576 HydrophobicContact CE-CZ3 4.35Å; F573-W576 HydrophobicContact CB-CE3 4.42Å; F573-W576 HydrophobicContact CB-CH2 4.32Å; F573-W576 HydrophobicContact CB-CZ3 3.96Å; G574-W576 PolarHBondContact O-N 2.98Å; W576-L578 PolarHBondContact O-N 2.74Å
577	P	78.6	Confident	80.5	Confident	100 Å²	100	51.2 Å²	51.2	65%	0.649	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-57.8	116.7	175.1	-21.7	31.9	0	0	0	110.5
578	L	86.3	Confident	80.9	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.016	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	124.1	174.4	173.9	71.5	0	0	0	108.1	V530 L534 M559 W576 V580 M638 E639 A640	V530-L578 HydrophobicContact CG1-CD2 3.86Å; V530-L578 HydrophobicContact CG2-CD2 4.36Å; L534-L578 HydrophobicContact CD1-CD2 4.4Å; L534-L578 HydrophobicContact CD2-CD2 4.19Å; L534-L578 HydrophobicContact CG-CD2 4.34Å; M559-L578 HydrophobicContact SD-CD1 3.81Å; W576-L578 PolarHBondContact O-N 2.74Å; L578-V580 HydrophobicContact CD1-CG1 3.79Å; L578-V580 HydrophobicContact CG-CG1 4.22Å; L578-M638 HydrophobicContact CD2-CE 3.98Å; L578-E639 CarbonylContact O-C 3.3Å; L578-E639 VanDerWaalsContact O-CA 3.23Å; L578-E639 WeakPolarHBondContact O-CA 3.5Å; L578-A640 HydrophobicContact CB-CB 4.24Å; L578-A640 HydrophobicContact CD2-CB 4.35Å; L578-A640 PolarHBondContact N-O 3.08Å; L578-A640 PolarHBondContact O-N 3.27Å
579	K	89.5	Confident	81.7	Confident	74 Å²	74	43.1 Å²	43.1	32%	0.322	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127.3	169.1	-176.6	168.4	177.6	146.8	0	108.8	Q547 P548 E637 M638 E639	Q547-K579 WeakPolarHBondContact CG-O 3.24Å; P548-K579 WeakPolarHBondContact CD-O 3.06Å; P548-K579 HydrophobicContact CG-CB 4.18Å; P548-K579 HydrophobicContact CG-CD 4.18Å; P548-K579 HydrophobicContact CG-CG 3.88Å; K579-E637 WeakPolarHBondContact CE-OE2 3.43Å; K579-E637 IonicContact NZ-OE2 3.17Å; K579-E637 PolarHBondContact NZ-OE2 3.49Å; K579-M638 CarbonylContact C-O 3.6Å; K579-M638 WeakPolarHBondContact CA-O 3.49Å; K579-E639 HydrophobicContact CB-CG 4.09Å; K579-E639 HydrophobicContact CD-CG 3.88Å; K579-E639 WeakPolarHBondContact CD-OE1 3.35Å; K579-E639 WeakPolarHBondContact CE-OE1 3.43Å; K579-E639 HydrophobicContact CG-CG 3.71Å; K579-E639 IonicContact NZ-OE1 3.62Å; K579-E639 PolarHBondContact NZ-OE1 2.81Å
580	V	91	Very high	82.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	146.5	179.5	-65.5	0	0	0	0	111.2	I545 Q547 V563 L578 E637 M638	I545-V580 HydrophobicContact CG2-CB 3.7Å; I545-V580 HydrophobicContact CG2-CG1 3.91Å; I545-V580 HydrophobicContact CG2-CG2 4.06Å; Q547-V580 HydrophobicContact CG-CG1 4.41Å; V563-V580 HydrophobicContact CG2-CG1 4.39Å; L578-V580 HydrophobicContact CD1-CG1 3.79Å; L578-V580 HydrophobicContact CG-CG1 4.22Å; V580-E637 CarbonylContact O-C 3.45Å; V580-E637 WeakPolarHBondContact O-CA 3.35Å; V580-M638 HydrophobicContact CG2-CB 4.01Å; V580-M638 HydrophobicContact CG2-CE 3.76Å; V580-M638 PolarHBondContact N-O 3.41Å; V580-M638 PolarHBondContact O-N 2.84Å
581	T	91.5	Very high	83.3	Confident	30 Å²	30	44.9 Å²	44.9	18%	0.184	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	128.3	169.6	-61.3	0	0	0	0	108.6	I545 T546 Q635	I545-T581 CarbonylContact C-O 3.59Å; I545-T581 WeakPolarHBondContact CA-O 3.42Å; T546-T581 PolarHBondContact N-O 2.92Å; T546-T581 PolarHBondContact O-N 3.05Å; T581-Q635 HydrophobicContact CG2-CG 4.45Å
582	C	92.7	Very high	84.1	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.8	-178.5	-62	0	0	0	0	109.2	F543 E544 Q635 F636	F543-C582 HydrophobicContact CB-CB 4.47Å; F543-C582 HydrophobicContact CD1-CB 3.63Å; F543-C582 HydrophobicContact CE1-CB 4.24Å; F543-C582 HydrophobicContact CG-CB 4.29Å; E544-C582 CarbonylContact O-C 3.53Å; E544-C582 WeakPolarHBondContact O-CA 3.37Å; C582-Q635 VanDerWaalsContact O-CA 3.31Å; C582-Q635 WeakPolarHBondContact O-CA 3.1Å; C582-F636 HydrophobicContact CB-CD2 4.05Å; C582-F636 HydrophobicContact CB-CE1 4.24Å; C582-F636 HydrophobicContact CB-CE2 3.58Å; C582-F636 HydrophobicContact CB-CZ 3.68Å; C582-F636 PolarHBondContact N-O 3.27Å; C582-F636 PolarHBondContact O-N 2.91Å
583	R	91.2	Very high	84	Confident	117 Å²	117	41.6 Å²	41.6	44%	0.442	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	134.4	173.7	-174.6	-177.8	178.2	-166.1	0.8	111	F543 E544 T633 L634	F543-R583 CarbonylContact C-O 3.56Å; F543-R583 WeakPolarHBondContact CA-O 3.45Å; F543-R583 VanDerWaalsContact CD1-C 3.44Å; E544-R583 PolarHBondContact N-O 2.89Å; E544-R583 PolarHBondContact O-N 3.38Å; R583-T633 HydrophobicContact CG-CG2 4.07Å; R583-L634 WeakPolarHBondContact CA-O 3.25Å
584	S	90.3	Very high	83.6	Confident	4 Å²	4	44.3 Å²	44.3	3%	0.028	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	138.4	170.3	-170.7	0	0	0	0	111.4	L542 A586 L634	L542-S584 PolarHBondContact O-OG 3.32Å; L542-S584 VanDerWaalsContact O-OG 3.08Å; S584-A586 PolarHBondContact OG-N 3.32Å; S584-L634 PolarHBondContact N-O 3.02Å; S584-L634 PolarHBondContact O-N 2.92Å
585	T	84.4	Confident	83.6	Confident	92 Å²	92	54.1 Å²	54.1	56%	0.564	27%	0.27	S	S	*	.	S	Bend	trans	-101.6	-10.5	172.9	55.3	0	0	0	0	112.5	T633	T585-T633 HydrophobicContact CG2-CG2 4.17Å
586	A	83.2	Confident	82.9	Confident	20 Å²	20	55.1 Å²	55.1	17%	0.165	28%	0.282	C	S	.	.	S	Bend	trans	-90.2	-2.2	-166.2	0	0	0	0	0	115.2	S584 T588 A620	S584-A586 PolarHBondContact OG-N 3.32Å; A586-T588 HydrophobicContact CB-CG2 3.73Å; A586-T588 WeakPolarHBondContact O-CG2 3.15Å; A586-T588 PolarHBondContact O-N 3Å; A586-A620 HydrophobicContact CB-CB 3.81Å
587	C	85.5	Confident	82.2	Confident	6 Å²	6	51.9 Å²	51.9	4%	0.041	27%	0.27	C	S	.	.			trans	44.9	29.8	174.6	-85.2	0	0	0	0	116.1	W589 Q590 E623 G632	C587-W589 HydrophobicContact CB-CH2 4.46Å; C587-W589 HydrophobicContact CB-CZ2 4.26Å; C587-W589 PolarHBondContact O-N 2.97Å; C587-Q590 HydrophobicContact CB-CG 4.38Å; C587-Q590 WeakPolarHBondContact O-CB 3.47Å; C587-Q590 WeakPolarHBondContact O-CG 3.32Å; C587-Q590 PolarHBondContact O-N 3.23Å; C587-Q590 PolarHBondContact SG-NE2 2.84Å; C587-E623 WeakPolarHBondContact CB-OE2 2.99Å; C587-G632 PolarHBondContact SG-O 2.77Å; C587-G632 VanDerWaalsContact SG-O 3.38Å
588	T	89.3	Confident	81.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-6.4	-167.5	60.5	0	0	0	0	115.9	F541 L542 A586 Q590 R592 A620	F541-T588 WeakPolarHBondContact CA-OG1 3.36Å; F541-T588 WeakPolarHBondContact CD1-OG1 3.27Å; F541-T588 PolarHBondContact O-OG1 2.84Å; L542-T588 HydrophobicContact CD1-CG2 4.14Å; L542-T588 HydrophobicContact CG-CG2 4.44Å; A586-T588 HydrophobicContact CB-CG2 3.73Å; A586-T588 WeakPolarHBondContact O-CG2 3.15Å; A586-T588 PolarHBondContact O-N 3Å; T588-Q590 VanDerWaalsContact C-N 3.33Å; T588-R592 WeakPolarHBondContact O-CD 3.12Å; T588-R592 VanDerWaalsContact O-CG 3.31Å; T588-R592 WeakPolarHBondContact O-CG 3.46Å; T588-R592 PolarHBondContact O-NH1 3.34Å; T588-A620 HydrophobicContact CG2-CB 4.16Å
589	W	88.8	Confident	80.1	Confident	13 Å²	13	63.1 Å²	63.1	5%	0.049	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-16.7	169.9	55.5	89.8	0	0	0	113.1	F541 F543 C587 L634 Q663 F667 C670	F541-W589 HydrophobicContact CD1-CB 4.32Å; F541-W589 HydrophobicContact CE1-CB 3.92Å; F543-W589 HydrophobicContact CE2-CE3 4.13Å; F543-W589 AromaticContact CE2-CZ3 3.76Å; F543-W589 HydrophobicContact CE2-CZ3 3.76Å; F543-W589 HydrophobicContact CZ-CE3 4.23Å; F543-W589 HydrophobicContact CZ-CH2 4.19Å; F543-W589 AromaticContact CZ-CZ3 3.56Å; F543-W589 HydrophobicContact CZ-CZ3 3.56Å; C587-W589 HydrophobicContact CB-CH2 4.46Å; C587-W589 HydrophobicContact CB-CZ2 4.26Å; C587-W589 PolarHBondContact O-N 2.97Å; W589-L634 HydrophobicContact CH2-CB 3.6Å; W589-L634 HydrophobicContact CH2-CD2 3.61Å; W589-L634 HydrophobicContact CH2-CG 4.24Å; W589-L634 HydrophobicContact CZ2-CB 3.97Å; W589-L634 HydrophobicContact CZ2-CD2 3.63Å; W589-L634 HydrophobicContact CZ2-CG 4.44Å; W589-L634 HydrophobicContact CZ3-CD2 4.25Å; W589-Q663 VanDerWaalsContact NE1-OE1 3.09Å; W589-F667 HydrophobicContact CB-CB 4.46Å; W589-F667 HydrophobicContact CB-CD2 4.19Å; W589-F667 HydrophobicContact CD2-CB 3.75Å; W589-F667 AromaticContact CD2-CD2 3.94Å; W589-F667 HydrophobicContact CD2-CD2 3.94Å; W589-F667 HydrophobicContact CD2-CG 4.28Å; W589-F667 HydrophobicContact CE3-CB 4.26Å; W589-F667 AromaticContact CE3-CD2 3.71Å; W589-F667 HydrophobicContact CE3-CD2 3.71Å; W589-F667 HydrophobicContact CE3-CG 4.33Å; W589-F667 HydrophobicContact CG-CB 3.83Å; W589-F667 HydrophobicContact CG-CD2 4.17Å; W589-F667 HydrophobicContact CZ3-CD2 4.41Å; W589-C670 HydrophobicContact CB-CB 3.92Å
590	Q	82.3	Confident	78.1	Confident	39 Å²	39	63.6 Å²	63.6	18%	0.182	33%	0.328	C	S	.	.	S	Bend	trans	-78	151	174.2	-57.5	-173.7	41.8	0	0	110	C587 T588 R592 Q663	C587-Q590 HydrophobicContact CB-CG 4.38Å; C587-Q590 WeakPolarHBondContact O-CB 3.47Å; C587-Q590 WeakPolarHBondContact O-CG 3.32Å; C587-Q590 PolarHBondContact O-N 3.23Å; C587-Q590 PolarHBondContact SG-NE2 2.84Å; T588-Q590 VanDerWaalsContact C-N 3.33Å; Q590-R592 PolarHBondContact O-N 2.86Å; Q590-Q663 VanDerWaalsContact NE2-OE1 3.1Å
591	D	76.8	Confident	75.9	Confident	78 Å²	78	67 Å²	67	42%	0.417	36%	0.364	S	S	.	.	S	Bend	trans	54.2	13.6	173.1	-61.5	-19.2	0	0	0	119.3	T593 N594 Y597	D591-T593 PolarHBondContact O-N 3.38Å; D591-N594 HydrophobicContact CB-CB 4.19Å; D591-N594 WeakPolarHBondContact O-CB 3.06Å; D591-N594 PolarHBondContact O-N 3.3Å; D591-Y597 HydrophobicContact CB-CD2 4.28Å; D591-Y597 HydrophobicContact CB-CE2 3.72Å
592	R	83.7	Confident	73.9	Confident	20 Å²	20	70.1 Å²	70.1	8%	0.075	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.2	176.4	-58.8	-170.4	79.8	80.3	-4.3	114.5	T588 Q590 K598 E612 S616 I619 C670	T588-R592 WeakPolarHBondContact O-CD 3.12Å; T588-R592 VanDerWaalsContact O-CG 3.31Å; T588-R592 WeakPolarHBondContact O-CG 3.46Å; T588-R592 PolarHBondContact O-NH1 3.34Å; Q590-R592 PolarHBondContact O-N 2.86Å; R592-K598 VanDerWaalsContact O-CE 3.22Å; R592-K598 WeakPolarHBondContact O-CE 3.44Å; R592-E612 IonicContact CZ-OE2 3.24Å; R592-E612 IonicContact NE-OE2 2.76Å; R592-E612 PolarHBondContact NH2-O 3.06Å; R592-E612 IonicContact NH2-OE2 3.65Å; R592-E612 PolarHBondContact NH2-OE2 3.18Å; R592-S616 PolarHBondContact NH1-OG 3.35Å; R592-S616 PolarHBondContact NH2-OG 3.44Å; R592-I619 HydrophobicContact CG-CD1 3.82Å; R592-C670 WeakPolarHBondContact CD-SG 3.49Å
593	T	76.6	Confident	72.1	Confident	123 Å²	123	73.9 Å²	73.9	76%	0.755	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-14	175.3	55	0	0	0	0	113.1	D591 R595	D591-T593 PolarHBondContact O-N 3.38Å; T593-R595 PolarHBondContact O-N 2.95Å
594	N	71.6	Confident	70.4	Confident	63 Å²	63	76.7 Å²	76.7	34%	0.337	42%	0.421	S	S	.	.			trans	-67.7	121.3	-177.3	-174.3	-20.5	0	0	0	109.8	D591 A596 Y597	D591-N594 HydrophobicContact CB-CB 4.19Å; D591-N594 WeakPolarHBondContact O-CB 3.06Å; D591-N594 PolarHBondContact O-N 3.3Å; N594-A596 PolarHBondContact O-N 3.12Å; N594-A596 VanDerWaalsContact O-N 3.15Å; N594-A596 VanDerWaalsContact OD1-CB 3.23Å; N594-A596 WeakPolarHBondContact OD1-CB 3.46Å; N594-A596 PolarHBondContact OD1-N 3.35Å; N594-Y597 HydrophobicContact CB-CD2 3.73Å; N594-Y597 HydrophobicContact CB-CE2 3.84Å; N594-Y597 PolarHBondContact O-N 2.82Å; N594-Y597 VanDerWaalsContact O-N 3.14Å
595	R	68.9	Low	69.4	Low	220 Å²	220	82 Å²	82	83%	0.83	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-24.7	-178.3	-69.5	-173.9	-176.2	-177.8	2	112.4	T593 Y597 K598	T593-R595 PolarHBondContact O-N 2.95Å; R595-Y597 PolarHBondContact O-N 3.32Å; R595-K598 PolarHBondContact O-N 2.84Å
596	A	59.7	Low	69.3	Low	61 Å²	61	83.6 Å²	83.6	50%	0.504	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-32.1	177.2	0	0	0	0	0	112.7	N594	N594-A596 PolarHBondContact O-N 3.12Å; N594-A596 VanDerWaalsContact O-N 3.15Å; N594-A596 VanDerWaalsContact OD1-CB 3.23Å; N594-A596 WeakPolarHBondContact OD1-CB 3.46Å; N594-A596 PolarHBondContact OD1-N 3.35Å
597	Y	64.9	Low	69.4	Low	26 Å²	26	83.2 Å²	83.2	10%	0.102	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-22.7	179.6	-52.6	-62.3	0	0	0	113.2	D591 N594 R595 R599 I619 K622	D591-Y597 HydrophobicContact CB-CD2 4.28Å; D591-Y597 HydrophobicContact CB-CE2 3.72Å; N594-Y597 HydrophobicContact CB-CD2 3.73Å; N594-Y597 HydrophobicContact CB-CE2 3.84Å; N594-Y597 PolarHBondContact O-N 2.82Å; N594-Y597 VanDerWaalsContact O-N 3.14Å; R595-Y597 PolarHBondContact O-N 3.32Å; Y597-R599 PolarHBondContact O-N 3.31Å; Y597-R599 VanDerWaalsContact O-N 3.14Å; Y597-I619 HydrophobicContact CD1-CG1 4.48Å; Y597-I619 HydrophobicContact CD2-CG1 4.23Å; Y597-I619 HydrophobicContact CG-CG1 4.19Å; Y597-K622 HydrophobicContact CE1-CB 4.45Å; Y597-K622 HydrophobicContact CE1-CD 3.55Å; Y597-K622 WeakPolarHBondContact OH-CD 3.27Å; Y597-K622 PolarHBondContact OH-NZ 3Å
598	K	64.4	Low	69.5	Low	132 Å²	132	85.5 Å²	85.5	57%	0.574	45%	0.454	S	S	*	.			trans	-86.1	74	176.6	-71.6	-174.8	176.8	173.1	0	111.3	R592 R595	R592-K598 VanDerWaalsContact O-CE 3.22Å; R592-K598 WeakPolarHBondContact O-CE 3.44Å; R595-K598 PolarHBondContact O-N 2.84Å
599	R	55.6	Low	69.5	Low	207 Å²	207	85.5 Å²	85.5	78%	0.781	45%	0.454	S	S	*	.			trans	-99.8	115.8	165.4	-76.8	-168.8	-177.3	-166.9	1.9	111	Y597 R618	Y597-R599 PolarHBondContact O-N 3.31Å; Y597-R599 VanDerWaalsContact O-N 3.14Å; R599-R618 PolarHBondContact O-NH1 3.24Å
600	G	47	Very low	69.5	Low	84 Å²	84	88.3 Å²	88.3	87%	0.866	47%	0.474	S	S	*	.	S	Bend	trans	77.6	126	153.6	0	0	0	0	0	117.4
601	G	45.5	Very low	69.7	Low	72 Å²	72	88.7 Å²	88.7	74%	0.742	48%	0.481	S	S	*	.			trans	117.2	133.8	164	0	0	0	0	0	115	V603	G601-V603 PolarHBondContact O-N 2.93Å
602	S	49.1	Very low	70.3	Confident	96 Å²	96	85.7 Å²	85.7	67%	0.671	47%	0.465	S	S	*	.			trans	-50	125.4	161.4	170.8	0	0	0	0	108.6	Y604	S602-Y604 PolarHBondContact O-N 3.28Å
603	V	54.7	Low	70.6	Confident	78 Å²	78	85.3 Å²	85.3	47%	0.473	47%	0.465	S	S	.	.			trans	-69.6	84.5	175.1	-176.4	0	0	0	0	107.4	G601 K605	G601-V603 PolarHBondContact O-N 2.93Å; V603-K605 PolarHBondContact O-N 3.48Å; V603-K605 VanDerWaalsContact O-N 3.12Å
604	Y	56	Low	71.2	Confident	176 Å²	176	82.8 Å²	82.8	69%	0.69	44%	0.444	S	S	*	.			trans	-63.5	113	166.3	-93.9	-92.8	0	0	0	107	S602 Q606	S602-Y604 PolarHBondContact O-N 3.28Å; Y604-Q606 PolarHBondContact O-N 2.94Å
605	K	70.1	Confident	72.1	Confident	115 Å²	115	80.5 Å²	80.5	50%	0.5	43%	0.432	S	S	.	.			trans	-74.9	66	171.6	-63.6	-173	178.2	-165.6	0	108.5	V603 K677 Y678 T681	V603-K605 PolarHBondContact O-N 3.48Å; V603-K605 VanDerWaalsContact O-N 3.12Å; K605-K677 PolarHBondContact NZ-O 3.2Å; K605-Y678 HydrophobicContact CG-CE1 4.32Å; K605-T681 HydrophobicContact CB-CG2 4.23Å; K605-T681 WeakPolarHBondContact O-CG2 3.32Å
606	Q	81.8	Confident	73.1	Confident	127 Å²	127	70 Å²	70	59%	0.593	39%	0.393	S	S	*	.			trans	-99.7	126.4	173.8	-170.5	174.4	4.7	0	0	107.8	Y604 F609 P610	Y604-Q606 PolarHBondContact O-N 2.94Å; Q606-F609 WeakPolarHBondContact O-CA 3.18Å; Q606-F609 PolarHBondContact O-N 3.06Å; Q606-P610 VanDerWaalsContact O-CD 3.26Å; Q606-P610 WeakPolarHBondContact O-CD 3.34Å
607	Y	84.7	Confident	74.5	Confident	11 Å²	11	74 Å²	74	4%	0.043	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	137.9	168.9	-177.6	-93	0	0	0	109.3	T535 P566 S567 F609 C682 H685 F686	T535-Y607 HydrophobicContact CG2-CE2 3.74Å; T535-Y607 WeakPolarHBondContact OG1-CE2 3.39Å; T535-Y607 PolarHBondContact OG1-OH 3.44Å; P566-Y607 PolarHBondContact O-OH 3.09Å; S567-Y607 PolarHBondContact N-OH 3.13Å; Y607-F609 HydrophobicContact CD2-CE1 4.06Å; Y607-F609 AromaticContact CD2-CE2 3.84Å; Y607-F609 HydrophobicContact CD2-CE2 3.84Å; Y607-F609 AromaticContact CD2-CZ 3.55Å; Y607-F609 HydrophobicContact CD2-CZ 3.55Å; Y607-F609 HydrophobicContact CE2-CE2 4.15Å; Y607-F609 HydrophobicContact CE2-CZ 4.26Å; Y607-C682 WeakPolarHBondContact CD2-SG 3.35Å; Y607-C682 WeakPolarHBondContact CE2-SG 3.4Å; Y607-H685 HydrophobicContact CD1-CB 4.27Å; Y607-H685 AromaticContact CD1-CD2 3.22Å; Y607-H685 WeakPolarHBondContact CD1-CD2 3.32Å; Y607-H685 AromaticContact CD1-CE1 3.92Å; Y607-H685 AromaticContact CD1-CG 3.58Å; Y607-H685 AromaticContact CD1-NE2 3.44Å; Y607-H685 WeakPolarHBondContact CD1-NE2 3.38Å; Y607-H685 AromaticContact CE1-CD2 3.67Å; Y607-H685 AromaticContact CE1-NE2 3.84Å; Y607-H685 HydrophobicContact CG-CB 4.16Å; Y607-H685 AromaticContact CG-CD2 3.96Å; Y607-H685 AromaticContact CG-CG 3.94Å; Y607-F686 HydrophobicContact CD1-CE2 4.37Å; Y607-F686 HydrophobicContact CD1-CZ 4.2Å; Y607-F686 HydrophobicContact CD2-CE2 4.41Å; Y607-F686 HydrophobicContact CE1-CE1 4.34Å; Y607-F686 AromaticContact CE1-CE2 3.81Å; Y607-F686 HydrophobicContact CE1-CE2 3.81Å; Y607-F686 AromaticContact CE1-CZ 3.38Å; Y607-F686 HydrophobicContact CE1-CZ 3.38Å; Y607-F686 AromaticContact CE2-CE2 3.91Å; Y607-F686 HydrophobicContact CE2-CE2 3.91Å; Y607-F686 HydrophobicContact CE2-CZ 4.24Å; Y607-F686 AromaticContact CZ-CE2 3.58Å; Y607-F686 AromaticContact CZ-CZ 3.43Å; Y607-F686 VanDerWaalsContact CZ-CZ 3.43Å; Y607-F686 WeakPolarHBondContact OH-CZ 3.39Å
608	P	87.8	Confident	75.6	Confident	54 Å²	54	77.5 Å²	77.5	35%	0.351	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	cis	-92.9	37.2	10.3	37.9	-37.1	0	0	0	115.1	T535	T535-P608 HydrophobicContact CG2-CB 3.85Å
609	F	90.2	Very high	76.7	Confident	1 Å²	1	71.2 Å²	71.2	0%	0.004	38%	0.38	C	S	.	.			trans	68.8	52.4	174.7	-37.1	-54.7	0	0	0	115.4	T535 L536 V540 Q606 Y607 S611 E612 T613 Y678 T681	T535-F609 HydrophobicContact CG2-CD2 3.88Å; T535-F609 HydrophobicContact CG2-CE2 4.01Å; L536-F609 HydrophobicContact CD2-CD2 4.16Å; L536-F609 HydrophobicContact CD2-CE2 4.34Å; V540-F609 HydrophobicContact CG2-CB 4.17Å; V540-F609 HydrophobicContact CG2-CD2 4.27Å; Q606-F609 WeakPolarHBondContact O-CA 3.18Å; Q606-F609 PolarHBondContact O-N 3.06Å; Y607-F609 HydrophobicContact CD2-CE1 4.06Å; Y607-F609 AromaticContact CD2-CE2 3.84Å; Y607-F609 HydrophobicContact CD2-CE2 3.84Å; Y607-F609 AromaticContact CD2-CZ 3.55Å; Y607-F609 HydrophobicContact CD2-CZ 3.55Å; Y607-F609 HydrophobicContact CE2-CE2 4.15Å; Y607-F609 HydrophobicContact CE2-CZ 4.26Å; F609-S611 PolarHBondContact O-N 3Å; F609-S611 VanDerWaalsContact O-N 3.08Å; F609-E612 HydrophobicContact CB-CB 4.27Å; F609-E612 HydrophobicContact CB-CG 4.41Å; F609-E612 PolarHBondContact O-N 2.7Å; F609-T613 PolarHBondContact O-N 3.35Å; F609-T613 VanDerWaalsContact O-N 3.15Å; F609-Y678 AromaticContact CD1-CD1 3.4Å; F609-Y678 HydrophobicContact CD1-CD1 3.4Å; F609-Y678 AromaticContact CD1-CE1 3.83Å; F609-Y678 HydrophobicContact CD1-CE1 3.83Å; F609-Y678 AromaticContact CD1-CG 3.92Å; F609-Y678 HydrophobicContact CD1-CG 3.92Å; F609-Y678 HydrophobicContact CD2-CG 4.39Å; F609-Y678 AromaticContact CE1-CD1 3.45Å; F609-Y678 HydrophobicContact CE1-CD1 3.45Å; F609-Y678 VanDerWaalsContact CE1-CD1 3.45Å; F609-Y678 HydrophobicContact CE1-CE1 4.31Å; F609-Y678 AromaticContact CE1-CG 3.83Å; F609-Y678 HydrophobicContact CE1-CG 3.83Å; F609-Y678 HydrophobicContact CE2-CG 4.3Å; F609-Y678 HydrophobicContact CG-CD1 4.04Å; F609-Y678 HydrophobicContact CG-CE1 4.36Å; F609-Y678 HydrophobicContact CG-CG 4.2Å; F609-Y678 HydrophobicContact CZ-CD1 4.12Å; F609-Y678 HydrophobicContact CZ-CG 4.02Å; F609-T681 HydrophobicContact CE1-CG2 3.78Å
610	P	87.4	Confident	78.2	Confident	71 Å²	71	62.4 Å²	62.4	46%	0.461	35%	0.351	S	S	.	.	H	α-helix	trans	-58.5	-32.6	-173.7	24.6	-34.3	0	0	0	113.4	Q606 E612 T613 E614	Q606-P610 VanDerWaalsContact O-CD 3.26Å; Q606-P610 WeakPolarHBondContact O-CD 3.34Å; P610-E612 VanDerWaalsContact C-N 3.33Å; P610-E612 PolarHBondContact O-N 3.04Å; P610-T613 PolarHBondContact O-N 3.16Å; P610-E614 VanDerWaalsContact O-CB 3.26Å; P610-E614 WeakPolarHBondContact O-CB 3.04Å; P610-E614 PolarHBondContact O-N 3.27Å
611	S	86.4	Confident	79.9	Confident	48 Å²	48	61.1 Å²	61.1	34%	0.336	33%	0.333	S	S	.	.	H	α-helix	trans	-65.9	-32.1	176.7	59	0	0	0	0	113.5	F609 L615	F609-S611 PolarHBondContact O-N 3Å; F609-S611 VanDerWaalsContact O-N 3.08Å; S611-L615 WeakPolarHBondContact O-CB 3.14Å; S611-L615 PolarHBondContact O-N 3.2Å
612	E	90.4	Very high	81.3	Confident	14 Å²	14	62.3 Å²	62.3	7%	0.065	32%	0.317	C	S	.	.	H	α-helix	trans	-81.9	-36.5	177.5	-65.2	-73.9	174.1	0	0	111.8	V540 R592 F609 P610 L615 S616 K677 Y678	V540-E612 HydrophobicContact CG1-CB 3.74Å; V540-E612 HydrophobicContact CG2-CB 4.17Å; R592-E612 IonicContact CZ-OE2 3.24Å; R592-E612 IonicContact NE-OE2 2.76Å; R592-E612 PolarHBondContact NH2-O 3.06Å; R592-E612 IonicContact NH2-OE2 3.65Å; R592-E612 PolarHBondContact NH2-OE2 3.18Å; F609-E612 HydrophobicContact CB-CB 4.27Å; F609-E612 HydrophobicContact CB-CG 4.41Å; F609-E612 PolarHBondContact O-N 2.7Å; P610-E612 VanDerWaalsContact C-N 3.33Å; P610-E612 PolarHBondContact O-N 3.04Å; E612-L615 PolarHBondContact O-N 2.92Å; E612-S616 PolarHBondContact O-N 2.81Å; E612-S616 PolarHBondContact O-OG 3.22Å; E612-S616 VanDerWaalsContact O-OG 3.13Å; E612-K677 IonicContact OE1-NZ 2.87Å; E612-K677 PolarHBondContact OE1-NZ 2.72Å; E612-Y678 HydrophobicContact CG-CE2 3.5Å; E612-Y678 VanDerWaalsContact CG-CZ 3.48Å; E612-Y678 WeakPolarHBondContact CG-OH 3.42Å; E612-Y678 WeakPolarHBondContact OE1-CE2 3.46Å; E612-Y678 PolarHBondContact OE1-OH 2.9Å
613	T	90.3	Very high	82.2	Confident	13 Å²	13	60.2 Å²	60.2	8%	0.08	30%	0.297	C	S	.	.	H	α-helix	trans	-59.4	-48.2	170.7	-66.5	0	0	0	0	110.9	P539 F609 P610 L615 S616 R617	P539-T613 WeakPolarHBondContact O-CB 3.46Å; P539-T613 WeakPolarHBondContact O-CG2 3.4Å; P539-T613 PolarHBondContact O-OG1 2.73Å; F609-T613 PolarHBondContact O-N 3.35Å; F609-T613 VanDerWaalsContact O-N 3.15Å; P610-T613 PolarHBondContact O-N 3.16Å; T613-L615 VanDerWaalsContact C-N 3.33Å; T613-L615 PolarHBondContact O-N 2.84Å; T613-S616 WeakPolarHBondContact O-CB 3.24Å; T613-S616 PolarHBondContact O-N 2.76Å; T613-S616 VanDerWaalsContact O-N 3.16Å; T613-R617 WeakPolarHBondContact O-CG 3.32Å; T613-R617 PolarHBondContact O-N 3.36Å
614	E	89.1	Confident	82.4	Confident	69 Å²	69	60.7 Å²	60.7	32%	0.322	30%	0.304	S	S	.	.	H	α-helix	trans	-62.7	-40.1	178	177.2	55.5	-159.3	0	0	111.8	P610 S616 R617 R618	P610-E614 VanDerWaalsContact O-CB 3.26Å; P610-E614 WeakPolarHBondContact O-CB 3.04Å; P610-E614 PolarHBondContact O-N 3.27Å; E614-S616 VanDerWaalsContact C-N 3.33Å; E614-S616 PolarHBondContact O-N 3.43Å; E614-R617 PolarHBondContact O-N 3.23Å; E614-R618 WeakPolarHBondContact O-CG 3.3Å; E614-R618 PolarHBondContact O-N 3.33Å; E614-R618 VanDerWaalsContact O-N 3.08Å; E614-R618 IonicContact OE1-CZ 2.76Å; E614-R618 IonicContact OE1-NE 3.69Å; E614-R618 PolarHBondContact OE1-NE 3.13Å; E614-R618 IonicContact OE1-NH2 3.34Å; E614-R618 PolarHBondContact OE1-NH2 2.88Å; E614-R618 VanDerWaalsContact OE1-NH2 3.14Å
615	L	89.3	Confident	82.3	Confident	16 Å²	16	62.4 Å²	62.4	8%	0.084	31%	0.309	C	S	.	.	H	α-helix	trans	-58.8	-44.7	173.2	176.5	59.8	0	0	0	111.7	S611 E612 T613 R618 I619	S611-L615 WeakPolarHBondContact O-CB 3.14Å; S611-L615 PolarHBondContact O-N 3.2Å; E612-L615 PolarHBondContact O-N 2.92Å; T613-L615 VanDerWaalsContact C-N 3.33Å; T613-L615 PolarHBondContact O-N 2.84Å; L615-R618 PolarHBondContact O-N 3.3Å; L615-I619 HydrophobicContact CD1-CD1 4.21Å; L615-I619 HydrophobicContact CD1-CG1 4.49Å; L615-I619 HydrophobicContact CG-CD1 4.08Å; L615-I619 WeakPolarHBondContact O-CG1 2.99Å; L615-I619 PolarHBondContact O-N 2.84Å; L615-I619 VanDerWaalsContact O-N 3.08Å
616	S	90.9	Very high	81.4	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-65.9	-39.8	178.6	-62.6	0	0	0	0	112.9	V540 R592 E612 T613 E614 R618 I619 A620	V540-S616 WeakPolarHBondContact O-CB 3.49Å; V540-S616 PolarHBondContact O-OG 2.83Å; R592-S616 PolarHBondContact NH1-OG 3.35Å; R592-S616 PolarHBondContact NH2-OG 3.44Å; E612-S616 PolarHBondContact O-N 2.81Å; E612-S616 PolarHBondContact O-OG 3.22Å; E612-S616 VanDerWaalsContact O-OG 3.13Å; T613-S616 WeakPolarHBondContact O-CB 3.24Å; T613-S616 PolarHBondContact O-N 2.76Å; T613-S616 VanDerWaalsContact O-N 3.16Å; E614-S616 VanDerWaalsContact C-N 3.33Å; E614-S616 PolarHBondContact O-N 3.43Å; S616-R618 VanDerWaalsContact C-N 3.29Å; S616-R618 PolarHBondContact O-N 2.9Å; S616-I619 PolarHBondContact O-N 3.49Å; S616-A620 WeakPolarHBondContact O-CB 3.42Å; S616-A620 PolarHBondContact O-N 3.1Å
617	R	89.6	Confident	80	Confident	143 Å²	143	65.3 Å²	65.3	54%	0.54	32%	0.322	S	S	.	.	H	α-helix	trans	-59.1	-41.2	174	-70.8	177.7	-172.4	160.2	-0.9	111.6	L542 T613 E614 A620 A621	L542-R617 HydrophobicContact CD1-CG 4.33Å; T613-R617 WeakPolarHBondContact O-CG 3.32Å; T613-R617 PolarHBondContact O-N 3.36Å; E614-R617 PolarHBondContact O-N 3.23Å; R617-A620 PolarHBondContact O-N 3.36Å; R617-A621 VanDerWaalsContact O-CB 3.29Å; R617-A621 WeakPolarHBondContact O-CB 3.07Å; R617-A621 PolarHBondContact O-N 2.97Å
618	R	86.9	Confident	78.1	Confident	100 Å²	100	72.2 Å²	72.2	38%	0.377	36%	0.36	S	S	.	.	H	α-helix	trans	-65.5	-38	176	-68.6	173	-170.2	-176.9	1.8	113.1	R599 E614 L615 S616	R599-R618 PolarHBondContact O-NH1 3.24Å; E614-R618 WeakPolarHBondContact O-CG 3.3Å; E614-R618 PolarHBondContact O-N 3.33Å; E614-R618 VanDerWaalsContact O-N 3.08Å; E614-R618 IonicContact OE1-CZ 2.76Å; E614-R618 IonicContact OE1-NE 3.69Å; E614-R618 PolarHBondContact OE1-NE 3.13Å; E614-R618 IonicContact OE1-NH2 3.34Å; E614-R618 PolarHBondContact OE1-NH2 2.88Å; E614-R618 VanDerWaalsContact OE1-NH2 3.14Å; L615-R618 PolarHBondContact O-N 3.3Å; S616-R618 VanDerWaalsContact C-N 3.29Å; S616-R618 PolarHBondContact O-N 2.9Å
619	I	87.4	Confident	76.2	Confident	1 Å²	1	78.5 Å²	78.5	1%	0.005	38%	0.384	C	S	.	.	H	α-helix	trans	-66.1	-51.3	175.9	-66.5	164.2	0	0	0	109.3	R592 Y597 L615 S616 A621 K622 E623	R592-I619 HydrophobicContact CG-CD1 3.82Å; Y597-I619 HydrophobicContact CD1-CG1 4.48Å; Y597-I619 HydrophobicContact CD2-CG1 4.23Å; Y597-I619 HydrophobicContact CG-CG1 4.19Å; L615-I619 HydrophobicContact CD1-CD1 4.21Å; L615-I619 HydrophobicContact CD1-CG1 4.49Å; L615-I619 HydrophobicContact CG-CD1 4.08Å; L615-I619 WeakPolarHBondContact O-CG1 2.99Å; L615-I619 PolarHBondContact O-N 2.84Å; L615-I619 VanDerWaalsContact O-N 3.08Å; S616-I619 PolarHBondContact O-N 3.49Å; I619-A621 PolarHBondContact O-N 3.44Å; I619-K622 PolarHBondContact O-N 2.83Å; I619-K622 VanDerWaalsContact O-N 3.14Å; I619-E623 PolarHBondContact O-N 2.92Å; I619-E623 VanDerWaalsContact O-N 3.11Å
620	A	86.7	Confident	74.2	Confident	21 Å²	21	84.7 Å²	84.7	17%	0.174	42%	0.423	C	S	.	.	H	α-helix	trans	-57.3	-44.9	-179.8	0	0	0	0	0	112.7	L542 A586 T588 S616 R617 K622 E623 S624	L542-A620 HydrophobicContact CD1-CB 4.08Å; A586-A620 HydrophobicContact CB-CB 3.81Å; T588-A620 HydrophobicContact CG2-CB 4.16Å; S616-A620 WeakPolarHBondContact O-CB 3.42Å; S616-A620 PolarHBondContact O-N 3.1Å; R617-A620 PolarHBondContact O-N 3.36Å; A620-K622 PolarHBondContact O-N 3.17Å; A620-E623 PolarHBondContact O-N 3.26Å; A620-S624 PolarHBondContact O-N 2.86Å
621	A	84.5	Confident	72.6	Confident	58 Å²	58	89.3 Å²	89.3	48%	0.479	44%	0.438	S	S	.	.	H	α-helix	trans	-64.4	-22.3	-179.1	0	0	0	0	0	114	R617 I619 S624	R617-A621 VanDerWaalsContact O-CB 3.29Å; R617-A621 WeakPolarHBondContact O-CB 3.07Å; R617-A621 PolarHBondContact O-N 2.97Å; I619-A621 PolarHBondContact O-N 3.44Å; A621-S624 PolarHBondContact O-OG 3.17Å
622	K	74.3	Confident	71.6	Confident	96 Å²	96	88.1 Å²	88.1	42%	0.417	43%	0.433	S	S	.	.	H	α-helix	trans	-96	-31.8	179.9	-162.7	-177.6	172	-165.2	0	112.6	Y597 I619 A620 S624 W625	Y597-K622 HydrophobicContact CE1-CB 4.45Å; Y597-K622 HydrophobicContact CE1-CD 3.55Å; Y597-K622 WeakPolarHBondContact OH-CD 3.27Å; Y597-K622 PolarHBondContact OH-NZ 3Å; I619-K622 PolarHBondContact O-N 2.83Å; I619-K622 VanDerWaalsContact O-N 3.14Å; A620-K622 PolarHBondContact O-N 3.17Å; K622-S624 VanDerWaalsContact C-N 3.32Å; K622-W625 PolarHBondContact O-N 3.28Å
623	E	67.3	Low	71.1	Confident	53 Å²	53	90.1 Å²	90.1	25%	0.248	45%	0.446	C	S	.	.	H	α-helix	trans	-69.8	-30.4	174.3	-72.8	-166.3	162.8	0	0	112.5	C587 I619 A620 W625 H626	C587-E623 WeakPolarHBondContact CB-OE2 2.99Å; I619-E623 PolarHBondContact O-N 2.92Å; I619-E623 VanDerWaalsContact O-N 3.11Å; A620-E623 PolarHBondContact O-N 3.26Å; E623-W625 PolarHBondContact O-N 3.31Å; E623-W625 VanDerWaalsContact O-N 3.09Å; E623-H626 PolarHBondContact O-N 3.27Å
624	S	60.2	Low	70.9	Confident	88 Å²	88	89.7 Å²	89.7	62%	0.615	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.5	173.8	62.7	0	0	0	0	113.6	A620 A621 K622	A620-S624 PolarHBondContact O-N 2.86Å; A621-S624 PolarHBondContact O-OG 3.17Å; K622-S624 VanDerWaalsContact C-N 3.32Å
625	W	53.1	Low	71	Confident	212 Å²	212	91.1 Å²	91.1	80%	0.803	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-8.8	177.1	-74.1	41.7	0	0	0	113.6	K622 E623	K622-W625 PolarHBondContact O-N 3.28Å; E623-W625 PolarHBondContact O-N 3.31Å; E623-W625 VanDerWaalsContact O-N 3.09Å
626	H	51.7	Low	71.1	Confident	153 Å²	153	90.6 Å²	90.6	71%	0.708	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.9	2.5	-164.6	-75.6	-21	0	0	0	117.3	E623	E623-H626 PolarHBondContact O-N 3.27Å
627	K	52.8	Low	71.1	Confident	150 Å²	150	94 Å²	94	65%	0.652	46%	0.463	S	S	*	.			trans	-143.3	136.5	179.5	-77.8	-171.1	173.8	-177.5	0	116.6
628	N	44.7	Very low	71.2	Confident	155 Å²	155	87.2 Å²	87.2	83%	0.829	44%	0.437	S	S	*	.			trans	-62.5	143.6	162.6	-74.7	-21.6	0	0	0	111	T630	N628-T630 VanDerWaalsContact C-N 3.32Å; N628-T630 PolarHBondContact O-N 3.37Å
629	E	46.1	Very low	71.5	Confident	186 Å²	186	84.7 Å²	84.7	87%	0.869	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	0.5	-153.3	-68.8	-179.8	138.1	0	0	118.7
630	T	48.2	Very low	71.7	Confident	132 Å²	132	84.7 Å²	84.7	81%	0.81	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-14	-165.2	46.4	0	0	0	0	117.2	N628	N628-T630 VanDerWaalsContact C-N 3.32Å; N628-T630 PolarHBondContact O-N 3.37Å
631	E	54.9	Low	71.9	Confident	168 Å²	168	87.2 Å²	87.2	79%	0.785	44%	0.438	S	S	*	.	S	Bend	trans	-99.4	-0.3	-176.6	-75.8	-167.4	158.2	0	0	115.8
632	G	64.6	Low	72.1	Confident	22 Å²	22	86 Å²	86	23%	0.227	42%	0.424	C	S	.	.			trans	-108.2	-9.4	-168	0	0	0	0	0	117.6	C587 L634	C587-G632 PolarHBondContact SG-O 2.77Å; C587-G632 VanDerWaalsContact SG-O 3.38Å; G632-L634 PolarHBondContact O-N 2.85Å
633	T	79.6	Confident	72.6	Confident	57 Å²	57	83.8 Å²	83.8	35%	0.35	41%	0.414	S	S	.	.			trans	-80.7	122.2	-169.8	-54.1	0	0	0	0	111.7	R583 T585	R583-T633 HydrophobicContact CG-CG2 4.07Å; T585-T633 HydrophobicContact CG2-CG2 4.17Å
634	L	87.4	Confident	73	Confident	4 Å²	4	84.6 Å²	84.6	2%	0.021	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	124.2	168.9	-178.7	59.5	0	0	0	109.5	F543 R583 S584 W589 G632 F636 Q663 L664 F667	F543-L634 HydrophobicContact CZ-CD2 4.12Å; R583-L634 WeakPolarHBondContact CA-O 3.25Å; S584-L634 PolarHBondContact N-O 3.02Å; S584-L634 PolarHBondContact O-N 2.92Å; W589-L634 HydrophobicContact CH2-CB 3.6Å; W589-L634 HydrophobicContact CH2-CD2 3.61Å; W589-L634 HydrophobicContact CH2-CG 4.24Å; W589-L634 HydrophobicContact CZ2-CB 3.97Å; W589-L634 HydrophobicContact CZ2-CD2 3.63Å; W589-L634 HydrophobicContact CZ2-CG 4.44Å; W589-L634 HydrophobicContact CZ3-CD2 4.25Å; G632-L634 PolarHBondContact O-N 2.85Å; L634-F636 HydrophobicContact CD1-CD1 4.32Å; L634-F636 HydrophobicContact CD2-CD1 4.21Å; L634-F636 HydrophobicContact CD2-CE1 4.04Å; L634-F636 HydrophobicContact CG-CD1 3.94Å; L634-F636 HydrophobicContact CG-CE1 4.17Å; L634-Q663 HydrophobicContact CD1-CB 4.47Å; L634-L664 HydrophobicContact CD1-CB 4.12Å; L634-L664 HydrophobicContact CD1-CD1 4.41Å; L634-F667 HydrophobicContact CD2-CB 3.79Å; L634-F667 HydrophobicContact CD2-CD1 4.26Å; L634-F667 HydrophobicContact CD2-CG 4.06Å
635	Q	90	Very high	73.5	Confident	99 Å²	99	85.1 Å²	85.1	46%	0.463	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	134.2	173.7	-175.1	175	-31.8	0	0	110.6	T581 C582 S657	T581-Q635 HydrophobicContact CG2-CG 4.45Å; C582-Q635 VanDerWaalsContact O-CA 3.31Å; C582-Q635 WeakPolarHBondContact O-CA 3.1Å; Q635-S657 PolarHBondContact O-OG 2.88Å
636	F	91.3	Very high	74.2	Confident	4 Å²	4	80 Å²	80	2%	0.018	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	157.7	175.8	59.3	-96.5	0	0	0	111	L537 F543 C582 L634 M638 F655 H656 L664 F667	L537-F636 HydrophobicContact CD2-CE2 4.44Å; L537-F636 HydrophobicContact CD2-CZ 3.95Å; F543-F636 HydrophobicContact CD1-CE1 4.31Å; F543-F636 HydrophobicContact CD1-CZ 4.4Å; F543-F636 HydrophobicContact CE1-CD1 4.33Å; F543-F636 AromaticContact CE1-CE1 3.44Å; F543-F636 HydrophobicContact CE1-CE1 3.44Å; F543-F636 VanDerWaalsContact CE1-CE1 3.44Å; F543-F636 AromaticContact CE1-CZ 3.9Å; F543-F636 HydrophobicContact CE1-CZ 3.9Å; F543-F636 AromaticContact CZ-CE1 3.67Å; F543-F636 HydrophobicContact CZ-CE1 3.67Å; F543-F636 HydrophobicContact CZ-CZ 4.11Å; C582-F636 HydrophobicContact CB-CD2 4.05Å; C582-F636 HydrophobicContact CB-CE1 4.24Å; C582-F636 HydrophobicContact CB-CE2 3.58Å; C582-F636 HydrophobicContact CB-CZ 3.68Å; C582-F636 PolarHBondContact N-O 3.27Å; C582-F636 PolarHBondContact O-N 2.91Å; L634-F636 HydrophobicContact CD1-CD1 4.32Å; L634-F636 HydrophobicContact CD2-CD1 4.21Å; L634-F636 HydrophobicContact CD2-CE1 4.04Å; L634-F636 HydrophobicContact CG-CD1 3.94Å; L634-F636 HydrophobicContact CG-CE1 4.17Å; F636-M638 HydrophobicContact CD2-CB 4.42Å; F636-M638 HydrophobicContact CE2-CB 4.21Å; F636-F655 AromaticContact CD2-CD1 3.74Å; F636-F655 HydrophobicContact CD2-CD1 3.74Å; F636-F655 HydrophobicContact CD2-CE1 4.46Å; F636-F655 AromaticContact CE2-CD1 3.67Å; F636-F655 HydrophobicContact CE2-CD1 3.67Å; F636-F655 AromaticContact CE2-CE1 3.95Å; F636-F655 HydrophobicContact CE2-CE1 3.95Å; F636-F655 HydrophobicContact CZ-CD1 4.47Å; F636-H656 CarbonylContact C-O 3.52Å; F636-H656 WeakPolarHBondContact CA-O 3.18Å; F636-H656 VanDerWaalsContact CB-O 3.31Å; F636-H656 WeakPolarHBondContact CB-O 3.48Å; F636-L664 HydrophobicContact CB-CD1 4.38Å; F636-L664 HydrophobicContact CD1-CD1 3.74Å; F636-L664 HydrophobicContact CE1-CD1 4.24Å; F636-L664 HydrophobicContact CG-CD1 4.11Å; F636-F667 AromaticContact CE1-CD1 3.87Å; F636-F667 HydrophobicContact CE1-CD1 3.87Å; F636-F667 AromaticContact CE1-CE1 3.68Å; F636-F667 HydrophobicContact CE1-CE1 3.68Å; F636-F667 HydrophobicContact CE1-CZ 4.4Å; F636-F667 HydrophobicContact CE2-CE1 4.35Å; F636-F667 HydrophobicContact CZ-CD1 4.08Å; F636-F667 AromaticContact CZ-CE1 3.39Å; F636-F667 HydrophobicContact CZ-CE1 3.39Å; F636-F667 AromaticContact CZ-CZ 3.95Å; F636-F667 HydrophobicContact CZ-CZ 3.95Å
637	E	91.5	Very high	75.2	Confident	72 Å²	72	76.2 Å²	76.2	34%	0.336	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	135	163.8	-56.7	-178.2	171.7	0	0	109.2	K579 V580 F655 H656	K579-E637 WeakPolarHBondContact CE-OE2 3.43Å; K579-E637 IonicContact NZ-OE2 3.17Å; K579-E637 PolarHBondContact NZ-OE2 3.49Å; V580-E637 CarbonylContact O-C 3.45Å; V580-E637 WeakPolarHBondContact O-CA 3.35Å; E637-F655 CarbonylContact O-C 3.56Å; E637-F655 WeakPolarHBondContact O-CA 3.46Å; E637-H656 HydrophobicContact CB-CB 4.23Å; E637-H656 PolarHBondContact N-O 3.46Å; E637-H656 PolarHBondContact O-N 3Å
638	M	92.6	Very high	76.5	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.5	169.2	-175.6	-173	73.5	0	0	108.9	L537 L578 K579 V580 F636 V653 R654 F655	L537-M638 HydrophobicContact CD1-CE 3.74Å; L537-M638 HydrophobicContact CD1-SD 3.62Å; L578-M638 HydrophobicContact CD2-CE 3.98Å; K579-M638 CarbonylContact C-O 3.6Å; K579-M638 WeakPolarHBondContact CA-O 3.49Å; V580-M638 HydrophobicContact CG2-CB 4.01Å; V580-M638 HydrophobicContact CG2-CE 3.76Å; V580-M638 PolarHBondContact N-O 3.41Å; V580-M638 PolarHBondContact O-N 2.84Å; F636-M638 HydrophobicContact CD2-CB 4.42Å; F636-M638 HydrophobicContact CE2-CB 4.21Å; M638-V653 HydrophobicContact CG-CG1 3.41Å; M638-V653 VanDerWaalsContact CG-CG1 3.41Å; M638-V653 HydrophobicContact SD-CG1 3.59Å; M638-V653 VanDerWaalsContact SD-CG1 3.59Å; M638-R654 WeakPolarHBondContact CA-O 3.34Å; M638-F655 HydrophobicContact CB-CD1 4.27Å; M638-F655 HydrophobicContact CB-CE1 4.21Å; M638-F655 HydrophobicContact CG-CD1 4.2Å; M638-F655 HydrophobicContact CG-CE1 3.78Å; M638-F655 HydrophobicContact CG-CZ 4.31Å; M638-F655 HydrophobicContact SD-CE1 4.08Å; M638-F655 HydrophobicContact SD-CZ 4.42Å
639	E	91.8	Very high	78.6	Confident	47 Å²	47	62.8 Å²	62.8	22%	0.22	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	126.7	169.9	-71.3	173.9	-171.8	0	0	108.7	L578 K579 V653 R654 H656	L578-E639 CarbonylContact O-C 3.3Å; L578-E639 VanDerWaalsContact O-CA 3.23Å; L578-E639 WeakPolarHBondContact O-CA 3.5Å; K579-E639 HydrophobicContact CB-CG 4.09Å; K579-E639 HydrophobicContact CD-CG 3.88Å; K579-E639 WeakPolarHBondContact CD-OE1 3.35Å; K579-E639 WeakPolarHBondContact CE-OE1 3.43Å; K579-E639 HydrophobicContact CG-CG 3.71Å; K579-E639 IonicContact NZ-OE1 3.62Å; K579-E639 PolarHBondContact NZ-OE1 2.81Å; E639-V653 CarbonylContact O-C 3.48Å; E639-V653 WeakPolarHBondContact O-CA 3.42Å; E639-R654 HydrophobicContact CB-CB 4.47Å; E639-R654 PolarHBondContact N-O 3.3Å; E639-R654 PolarHBondContact O-N 2.96Å; E639-H656 IonicContact OE1-CE1 2.69Å; E639-H656 IonicContact OE1-ND1 2.76Å; E639-H656 IonicContact OE2-CE1 3.61Å; E639-H656 PolarHBondContact OE2-CE1 2.89Å
640	A	91.7	Very high	80.7	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.008	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	121.1	175.4	0	0	0	0	0	110.7	Y526 L533 L578 V651 S652 V653	Y526-A640 PolarHBondContact OH-O 3.18Å; Y526-A640 VanDerWaalsContact OH-O 3.06Å; L533-A640 HydrophobicContact CD1-CB 4.23Å; L578-A640 HydrophobicContact CB-CB 4.24Å; L578-A640 HydrophobicContact CD2-CB 4.35Å; L578-A640 PolarHBondContact N-O 3.08Å; L578-A640 PolarHBondContact O-N 3.27Å; A640-V651 HydrophobicContact CB-CG1 4.22Å; A640-S652 CarbonylContact C-O 3.6Å; A640-S652 VanDerWaalsContact CA-O 3.31Å; A640-S652 WeakPolarHBondContact CA-O 3.43Å; A640-V653 HydrophobicContact CB-CG2 4.08Å
641	E	91.1	Very high	82.8	Confident	74 Å²	74	47.9 Å²	47.9	35%	0.346	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.1	-173.7	-175.1	-177.1	-167.6	0	0	109.3	K643 V651 S652 R654	E641-K643 PolarHBondContact O-N 3.36Å; E641-V651 WeakPolarHBondContact O-CA 3.45Å; E641-S652 PolarHBondContact N-O 3.35Å; E641-S652 PolarHBondContact O-N 3.39Å; E641-R654 IonicContact OE2-CZ 3.81Å; E641-R654 IonicContact OE2-NH1 2.74Å; E641-R654 IonicContact OE2-NH2 2.86Å; E641-R654 PolarHBondContact OE2-NH2 2.81Å
642	L	88.3	Confident	84.5	Confident	33 Å²	33	40 Å²	40	17%	0.173	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	122.2	166.7	177	75.6	0	0	0	108.4	V522 Y526 P575 M649	V522-L642 HydrophobicContact CG1-CD1 3.49Å; V522-L642 VanDerWaalsContact CG1-CD1 3.49Å; V522-L642 HydrophobicContact CG1-CD2 3.28Å; V522-L642 HydrophobicContact CG1-CG 3.96Å; Y526-L642 HydrophobicContact CD2-CB 3.72Å; Y526-L642 HydrophobicContact CD2-CD1 4.42Å; Y526-L642 HydrophobicContact CE2-CB 4.2Å; Y526-L642 HydrophobicContact CG-CB 4.41Å; P575-L642 HydrophobicContact CB-CB 3.81Å; P575-L642 HydrophobicContact CB-CD2 3.35Å; P575-L642 HydrophobicContact CB-CG 4.18Å; P575-L642 HydrophobicContact CG-CD2 3.93Å; L642-M649 HydrophobicContact CD1-CG 4.35Å
643	K	85.1	Confident	85.8	Confident	49 Å²	49	38.9 Å²	38.9	21%	0.213	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.6	166.1	-65.5	-168.8	176.1	-179.3	0	109.4	E491 E641 D645 S650 S652	E491-K643 IonicContact OE1-NZ 3.39Å; E641-K643 PolarHBondContact O-N 3.36Å; K643-D645 WeakPolarHBondContact CD-OD2 3.25Å; K643-S650 PolarHBondContact N-O 3.43Å; K643-S650 PolarHBondContact O-N 2.86Å; K643-S650 VanDerWaalsContact O-O 3.08Å; K643-S650 PolarHBondContact O-OG 3.44Å; K643-S652 VanDerWaalsContact CE-CB 3.45Å
644	N	76.5	Confident	86.4	Confident	70 Å²	70	39.6 Å²	39.6	37%	0.374	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	44.4	170.1	-164.1	26.1	0	0	0	110.5	D646 N647 I648 M649	N644-D646 PolarHBondContact O-N 2.98Å; N644-N647 PolarHBondContact O-N 2.68Å; N644-N647 WeakPolarHBondContact OD1-CA 3.42Å; N644-N647 PolarHBondContact OD1-O 2.93Å; N644-I648 PolarHBondContact OD1-N 2.91Å; N644-M649 PolarHBondContact OD1-N 2.8Å
645	D	70.1	Confident	86.5	Confident	99 Å²	99	39.6 Å²	39.6	53%	0.529	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	126.6	179.8	-61.4	-22.5	0	0	0	109	K643 N647 I648	K643-D645 WeakPolarHBondContact CD-OD2 3.25Å; D645-N647 PolarHBondContact O-N 2.89Å; D645-N647 VanDerWaalsContact O-N 3.15Å; D645-I648 WeakPolarHBondContact O-CB 3.4Å; D645-I648 PolarHBondContact O-N 2.9Å
646	D	68.2	Low	86.4	Confident	106 Å²	106	38.8 Å²	38.8	57%	0.567	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	28.9	-177.5	-70.5	-54.7	0	0	0	114.4	R405 N644 I648	R405-D646 WeakPolarHBondContact CB-O 3.4Å; R405-D646 WeakPolarHBondContact CD-O 3.43Å; R405-D646 IonicContact NH1-OD1 3.7Å; R405-D646 PolarHBondContact NH1-OD1 2.79Å; N644-D646 PolarHBondContact O-N 2.98Å; D646-I648 PolarHBondContact O-N 3.39Å
647	N	72.5	Confident	86	Confident	73 Å²	73	39.4 Å²	39.4	39%	0.39	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	16.4	-172.4	-57.3	-51.6	0	0	0	114.8	R405 N406 N644 D645 M649	R405-N647 HydrophobicContact CB-CB 3.85Å; R405-N647 WeakPolarHBondContact O-CB 3.38Å; N406-N647 HydrophobicContact CB-CB 4.2Å; N644-N647 PolarHBondContact O-N 2.68Å; N644-N647 WeakPolarHBondContact OD1-CA 3.42Å; N644-N647 PolarHBondContact OD1-O 2.93Å; D645-N647 PolarHBondContact O-N 2.89Å; D645-N647 VanDerWaalsContact O-N 3.15Å; N647-M649 PolarHBondContact O-N 3.17Å
648	I	81.2	Confident	84.8	Confident	16 Å²	16	41.3 Å²	41.3	8%	0.082	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	101.3	173.4	-53.9	173.2	0	0	0	108.3	Y390 H393 K495 N644 D645 D646 S650	Y390-I648 HydrophobicContact CG-CD1 4.44Å; H393-I648 HydrophobicContact CB-CB 4.49Å; H393-I648 HydrophobicContact CB-CD1 4.43Å; H393-I648 HydrophobicContact CB-CG1 3.98Å; H393-I648 HydrophobicContact CB-CG2 4Å; K495-I648 HydrophobicContact CD-CG2 4.25Å; N644-I648 PolarHBondContact OD1-N 2.91Å; D645-I648 WeakPolarHBondContact O-CB 3.4Å; D645-I648 PolarHBondContact O-N 2.9Å; D646-I648 PolarHBondContact O-N 3.39Å; I648-S650 PolarHBondContact O-N 3.5Å
649	M	87.5	Confident	83.2	Confident	6 Å²	6	45.2 Å²	45.2	3%	0.03	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	119.7	169.9	171.8	169.2	60.8	0	0	110.8	P496 Y501 I504 V522 F525 L642 N644 N647	P496-M649 WeakPolarHBondContact CD-O 3.36Å; P496-M649 HydrophobicContact CG-CE 3.7Å; P496-M649 HydrophobicContact CG-CG 4.42Å; Y501-M649 HydrophobicContact CE1-CE 4.29Å; I504-M649 HydrophobicContact CD1-CE 4.45Å; V522-M649 VanDerWaalsContact CA-SD 3.56Å; V522-M649 HydrophobicContact CB-SD 4.01Å; V522-M649 HydrophobicContact CG1-CG 4.17Å; V522-M649 HydrophobicContact CG1-SD 3.95Å; V522-M649 HydrophobicContact CG2-SD 3.87Å; F525-M649 HydrophobicContact CB-CE 3.8Å; F525-M649 HydrophobicContact CB-CG 4.21Å; F525-M649 HydrophobicContact CB-SD 3.24Å; F525-M649 WeakPolarHBondContact CB-SD 3.42Å; F525-M649 HydrophobicContact CD1-CE 4.31Å; F525-M649 HydrophobicContact CD1-CG 3.24Å; F525-M649 HydrophobicContact CD1-SD 3.51Å; F525-M649 VanDerWaalsContact CD1-SD 3.51Å; F525-M649 HydrophobicContact CD2-CE 4.22Å; F525-M649 HydrophobicContact CD2-SD 4.38Å; F525-M649 HydrophobicContact CE1-CG 3.69Å; F525-M649 HydrophobicContact CE1-SD 4.45Å; F525-M649 HydrophobicContact CG-CE 3.85Å; F525-M649 HydrophobicContact CG-CG 3.81Å; F525-M649 HydrophobicContact CG-SD 3.46Å; F525-M649 WeakPolarHBondContact CG-SD 3.39Å; L642-M649 HydrophobicContact CD1-CG 4.35Å; N644-M649 PolarHBondContact OD1-N 2.8Å; N647-M649 PolarHBondContact O-N 3.17Å
650	S	90.8	Very high	81.6	Confident	6 Å²	6	47.8 Å²	47.8	4%	0.042	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	155.8	176.9	67	0	0	0	0	111.7	I494 K643 I648	I494-S650 CarbonylContact O-C 3.59Å; I494-S650 WeakPolarHBondContact O-CA 3.5Å; I494-S650 WeakPolarHBondContact O-CB 3.47Å; K643-S650 PolarHBondContact N-O 3.43Å; K643-S650 PolarHBondContact O-N 2.86Å; K643-S650 VanDerWaalsContact O-O 3.08Å; K643-S650 PolarHBondContact O-OG 3.44Å; I648-S650 PolarHBondContact O-N 3.5Å
651	V	92.1	Very high	80.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	109.7	170.5	179.4	0	0	0	0	108.1	S493 I494 F525 Y526 C529 L533 A640 E641 V653	S493-V651 CarbonylContact C-O 3.43Å; S493-V651 WeakPolarHBondContact CA-O 3.46Å; I494-V651 HydrophobicContact CB-CB 4.31Å; I494-V651 PolarHBondContact N-O 2.94Å; I494-V651 PolarHBondContact O-N 3.35Å; F525-V651 HydrophobicContact CD1-CG2 4.24Å; F525-V651 HydrophobicContact CE1-CG2 3.8Å; Y526-V651 HydrophobicContact CD2-CG1 4.47Å; Y526-V651 HydrophobicContact CD2-CG2 3.76Å; Y526-V651 HydrophobicContact CE2-CG1 4.3Å; Y526-V651 HydrophobicContact CE2-CG2 4.39Å; C529-V651 HydrophobicContact CB-CB 4.32Å; C529-V651 HydrophobicContact CB-CG2 3.77Å; L533-V651 HydrophobicContact CD1-CG1 4.47Å; A640-V651 HydrophobicContact CB-CG1 4.22Å; E641-V651 WeakPolarHBondContact O-CA 3.45Å; V651-V653 HydrophobicContact CG1-CG2 3.97Å
652	S	91.6	Very high	79.7	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.007	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	128.8	171.8	171	0	0	0	0	108.2	E491 A640 E641 K643	E491-S652 PolarHBondContact OE1-OG 3.24Å; A640-S652 CarbonylContact C-O 3.6Å; A640-S652 VanDerWaalsContact CA-O 3.31Å; A640-S652 WeakPolarHBondContact CA-O 3.43Å; E641-S652 PolarHBondContact N-O 3.35Å; E641-S652 PolarHBondContact O-N 3.39Å; K643-S652 VanDerWaalsContact CE-CB 3.45Å
653	V	91.8	Very high	79.3	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	116.8	178.3	-171.9	0	0	0	0	108.7	E491 L492 L533 M638 E639 A640 V651 F655	E491-V653 CarbonylContact C-O 3.49Å; E491-V653 VanDerWaalsContact CA-O 3.29Å; E491-V653 WeakPolarHBondContact CA-O 3.33Å; L492-V653 HydrophobicContact CD1-CB 3.71Å; L492-V653 HydrophobicContact CD1-CG2 3.67Å; L492-V653 HydrophobicContact CG-CB 3.85Å; L492-V653 HydrophobicContact CG-CG2 4.37Å; L492-V653 PolarHBondContact N-O 2.89Å; L492-V653 PolarHBondContact O-N 3.35Å; L533-V653 HydrophobicContact CD1-CG2 3.7Å; L533-V653 HydrophobicContact CD2-CG2 4.34Å; M638-V653 HydrophobicContact CG-CG1 3.41Å; M638-V653 VanDerWaalsContact CG-CG1 3.41Å; M638-V653 HydrophobicContact SD-CG1 3.59Å; M638-V653 VanDerWaalsContact SD-CG1 3.59Å; E639-V653 CarbonylContact O-C 3.48Å; E639-V653 WeakPolarHBondContact O-CA 3.42Å; A640-V653 HydrophobicContact CB-CG2 4.08Å; V651-V653 HydrophobicContact CG1-CG2 3.97Å; V653-F655 HydrophobicContact CB-CE2 4.35Å; V653-F655 HydrophobicContact CB-CZ 4.47Å; V653-F655 HydrophobicContact CG1-CE1 4.22Å; V653-F655 HydrophobicContact CG1-CE2 3.8Å; V653-F655 HydrophobicContact CG1-CZ 3.55Å
654	R	91.3	Very high	79.2	Confident	72 Å²	72	48.8 Å²	48.8	27%	0.272	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	145.2	-179.8	-58	-178.9	-157.8	129.6	17.7	110.3	E491 M638 E639 E641	E491-R654 HydrophobicContact CG-CG 4.07Å; M638-R654 WeakPolarHBondContact CA-O 3.34Å; E639-R654 HydrophobicContact CB-CB 4.47Å; E639-R654 PolarHBondContact N-O 3.3Å; E639-R654 PolarHBondContact O-N 2.96Å; E641-R654 IonicContact OE2-CZ 3.81Å; E641-R654 IonicContact OE2-NH1 2.74Å; E641-R654 IonicContact OE2-NH2 2.86Å; E641-R654 PolarHBondContact OE2-NH2 2.81Å
655	F	89.9	Confident	79.6	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	118.9	-179.5	-58.5	-88.8	0	0	0	110.8	R490 L492 F636 E637 M638 V653 L668 Y671	R490-F655 WeakPolarHBondContact O-CD2 3.46Å; R490-F655 PolarHBondContact O-N 3.15Å; L492-F655 HydrophobicContact CD2-CE2 3.7Å; L492-F655 HydrophobicContact CD2-CZ 3.92Å; L492-F655 HydrophobicContact CG-CE2 4.07Å; F636-F655 AromaticContact CD2-CD1 3.74Å; F636-F655 HydrophobicContact CD2-CD1 3.74Å; F636-F655 HydrophobicContact CD2-CE1 4.46Å; F636-F655 AromaticContact CE2-CD1 3.67Å; F636-F655 HydrophobicContact CE2-CD1 3.67Å; F636-F655 AromaticContact CE2-CE1 3.95Å; F636-F655 HydrophobicContact CE2-CE1 3.95Å; F636-F655 HydrophobicContact CZ-CD1 4.47Å; E637-F655 CarbonylContact O-C 3.56Å; E637-F655 WeakPolarHBondContact O-CA 3.46Å; M638-F655 HydrophobicContact CB-CD1 4.27Å; M638-F655 HydrophobicContact CB-CE1 4.21Å; M638-F655 HydrophobicContact CG-CD1 4.2Å; M638-F655 HydrophobicContact CG-CE1 3.78Å; M638-F655 HydrophobicContact CG-CZ 4.31Å; M638-F655 HydrophobicContact SD-CE1 4.08Å; M638-F655 HydrophobicContact SD-CZ 4.42Å; V653-F655 HydrophobicContact CB-CE2 4.35Å; V653-F655 HydrophobicContact CB-CZ 4.47Å; V653-F655 HydrophobicContact CG1-CE1 4.22Å; V653-F655 HydrophobicContact CG1-CE2 3.8Å; V653-F655 HydrophobicContact CG1-CZ 3.55Å; F655-L668 HydrophobicContact CB-CD1 4.39Å; F655-L668 HydrophobicContact CD1-CD2 3.7Å; F655-L668 HydrophobicContact CD2-CD1 4.03Å; F655-L668 HydrophobicContact CD2-CD2 3.62Å; F655-L668 HydrophobicContact CE1-CD2 3.56Å; F655-L668 HydrophobicContact CE2-CD2 3.51Å; F655-L668 HydrophobicContact CG-CD1 4.18Å; F655-L668 HydrophobicContact CG-CD2 3.72Å; F655-L668 HydrophobicContact CZ-CD2 3.46Å; F655-L668 VanDerWaalsContact CZ-CD2 3.46Å; F655-Y671 HydrophobicContact CE1-CE1 4.48Å; F655-Y671 HydrophobicContact CZ-CD1 4.19Å; F655-Y671 HydrophobicContact CZ-CE1 4.06Å
656	H	87.9	Confident	80.3	Confident	81 Å²	81	50.4 Å²	50.4	38%	0.375	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.6	176.9	-53.5	100.2	0	0	0	109.5	F636 E637 E639	F636-H656 CarbonylContact C-O 3.52Å; F636-H656 WeakPolarHBondContact CA-O 3.18Å; F636-H656 VanDerWaalsContact CB-O 3.31Å; F636-H656 WeakPolarHBondContact CB-O 3.48Å; E637-H656 HydrophobicContact CB-CB 4.23Å; E637-H656 PolarHBondContact N-O 3.46Å; E637-H656 PolarHBondContact O-N 3Å; E639-H656 IonicContact OE1-CE1 2.69Å; E639-H656 IonicContact OE1-ND1 2.76Å; E639-H656 IonicContact OE2-CE1 3.61Å; E639-H656 PolarHBondContact OE2-CE1 2.89Å
657	S	81.9	Confident	81.3	Confident	17 Å²	17	45.4 Å²	45.4	12%	0.119	27%	0.265	C	S	.	.			trans	-141.3	135.7	176.1	-173.8	0	0	0	0	110.6	Q635 C659	Q635-S657 PolarHBondContact O-OG 2.88Å; S657-C659 VanDerWaalsContact C-N 3.34Å; S657-C659 PolarHBondContact OG-N 2.76Å; S657-C659 PolarHBondContact OG-O 3.19Å
658	A	68	Low	82.2	Confident	113 Å²	113	42.1 Å²	42.1	93%	0.934	25%	0.247	S	C	*	.	S	Bend	trans	-80.2	-14.9	171.7	0	0	0	0	0	112.7
659	C	58	Low	82.5	Confident	82 Å²	82	46 Å²	46	55%	0.554	27%	0.265	S	S	*	.	S	Bend	trans	-113.2	164.8	-170.5	-74.3	0	0	0	0	113.9	S657 S661	S657-C659 VanDerWaalsContact C-N 3.34Å; S657-C659 PolarHBondContact OG-N 2.76Å; S657-C659 PolarHBondContact OG-O 3.19Å; C659-S661 PolarHBondContact O-N 3.39Å
660	C	57.9	Low	82.6	Confident	101 Å²	101	46.6 Å²	46.6	68%	0.682	27%	0.269	S	S	*	.			trans	-14.9	108.9	-175.1	-93.1	0	0	0	0	117.5	A662 Q663	C660-A662 PolarHBondContact O-N 3.29Å; C660-A662 VanDerWaalsContact O-N 3.13Å; C660-Q663 PolarHBondContact O-N 3.05Å
661	S	66.4	Low	82.7	Confident	71 Å²	71	46.3 Å²	46.3	50%	0.497	27%	0.267	S	S	.	.	H	α-helix	trans	-59	-27.9	-179.9	68.3	0	0	0	0	114.2	C659 N665	C659-S661 PolarHBondContact O-N 3.39Å; S661-N665 WeakPolarHBondContact O-CB 3.42Å; S661-N665 PolarHBondContact O-N 3.25Å; S661-N665 VanDerWaalsContact O-N 3.09Å; S661-N665 PolarHBondContact O-ND2 3.18Å
662	A	77	Confident	82.7	Confident	59 Å²	59	50 Å²	50	49%	0.488	29%	0.286	S	S	.	.	H	α-helix	trans	-71.1	-43.7	-175.2	0	0	0	0	0	113.7	C660 N665 R666	C660-A662 PolarHBondContact O-N 3.29Å; C660-A662 VanDerWaalsContact O-N 3.13Å; A662-N665 PolarHBondContact O-N 2.99Å; A662-R666 WeakPolarHBondContact O-CG 3.19Å; A662-R666 PolarHBondContact O-N 2.85Å
663	Q	79.3	Confident	82.6	Confident	47 Å²	47	54.2 Å²	54.2	22%	0.22	31%	0.307	C	S	.	.	H	α-helix	trans	-67.9	-45.3	179	-80.1	-66.2	-4.7	0	0	111.3	W589 Q590 L634 C660 N665 R666 F667	W589-Q663 VanDerWaalsContact NE1-OE1 3.09Å; Q590-Q663 VanDerWaalsContact NE2-OE1 3.1Å; L634-Q663 HydrophobicContact CD1-CB 4.47Å; C660-Q663 PolarHBondContact O-N 3.05Å; Q663-N665 VanDerWaalsContact C-N 3.3Å; Q663-N665 PolarHBondContact O-N 2.89Å; Q663-R666 PolarHBondContact O-N 3.4Å; Q663-R666 VanDerWaalsContact O-N 3.12Å; Q663-F667 PolarHBondContact O-N 2.87Å
664	L	84.3	Confident	82.6	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-55.9	-45.7	174.6	-177.1	62.5	0	0	0	111.2	L634 F636 R666 F667 L668	L634-L664 HydrophobicContact CD1-CB 4.12Å; L634-L664 HydrophobicContact CD1-CD1 4.41Å; F636-L664 HydrophobicContact CB-CD1 4.38Å; F636-L664 HydrophobicContact CD1-CD1 3.74Å; F636-L664 HydrophobicContact CE1-CD1 4.24Å; F636-L664 HydrophobicContact CG-CD1 4.11Å; L664-R666 VanDerWaalsContact C-N 3.3Å; L664-R666 PolarHBondContact O-N 3.34Å; L664-F667 HydrophobicContact CD1-CD1 4.3Å; L664-F667 PolarHBondContact O-N 2.76Å; L664-L668 HydrophobicContact CD1-CD1 3.96Å; L664-L668 HydrophobicContact CD1-CD2 4.39Å; L664-L668 HydrophobicContact CD1-CG 3.96Å; L664-L668 HydrophobicContact CD2-CD1 4.4Å; L664-L668 HydrophobicContact CG-CD1 3.78Å; L664-L668 HydrophobicContact CG-CG 4.17Å; L664-L668 WeakPolarHBondContact O-CB 3.22Å; L664-L668 VanDerWaalsContact O-CG 3.24Å; L664-L668 WeakPolarHBondContact O-CG 3.39Å; L664-L668 PolarHBondContact O-N 2.89Å
665	N	83.9	Confident	82.7	Confident	50 Å²	50	51.6 Å²	51.6	27%	0.267	30%	0.298	S	S	.	.	H	α-helix	trans	-63.1	-32.4	179.1	-79.7	-34.4	0	0	0	114.1	R489 S661 A662 Q663 H669	R489-N665 VanDerWaalsContact CB-OD1 3.3Å; R489-N665 WeakPolarHBondContact CB-OD1 3.43Å; R489-N665 PolarHBondContact NH1-O 2.8Å; S661-N665 WeakPolarHBondContact O-CB 3.42Å; S661-N665 PolarHBondContact O-N 3.25Å; S661-N665 VanDerWaalsContact O-N 3.09Å; S661-N665 PolarHBondContact O-ND2 3.18Å; A662-N665 PolarHBondContact O-N 2.99Å; Q663-N665 VanDerWaalsContact C-N 3.3Å; Q663-N665 PolarHBondContact O-N 2.89Å; N665-H669 WeakPolarHBondContact O-CB 3.4Å; N665-H669 PolarHBondContact O-N 3.06Å
666	R	85	Confident	82.7	Confident	153 Å²	153	59.7 Å²	59.7	58%	0.577	33%	0.333	S	S	*	.	H	α-helix	trans	-73.4	-45.9	175.4	-72.2	179	-178.2	-179.5	1.5	111	A662 Q663 L664 H669 C670	A662-R666 WeakPolarHBondContact O-CG 3.19Å; A662-R666 PolarHBondContact O-N 2.85Å; Q663-R666 PolarHBondContact O-N 3.4Å; Q663-R666 VanDerWaalsContact O-N 3.12Å; L664-R666 VanDerWaalsContact C-N 3.3Å; L664-R666 PolarHBondContact O-N 3.34Å; R666-H669 PolarHBondContact O-N 3.18Å; R666-C670 PolarHBondContact O-N 2.87Å; R666-C670 VanDerWaalsContact O-N 3.16Å
667	F	90	Very high	82.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-55.6	-55.2	173.6	165.1	-107.2	0	0	0	110.8	L537 F541 F543 W589 L634 F636 Q663 L664 H669 C670 Y671	L537-F667 HydrophobicContact CD2-CE1 4.4Å; L537-F667 HydrophobicContact CD2-CE2 4.46Å; L537-F667 HydrophobicContact CD2-CZ 3.63Å; F541-F667 HydrophobicContact CB-CE2 4.43Å; F541-F667 HydrophobicContact CD1-CE2 4.38Å; F541-F667 AromaticContact CD2-CE2 3.94Å; F541-F667 HydrophobicContact CD2-CE2 3.94Å; F541-F667 HydrophobicContact CE2-CE2 4.32Å; F541-F667 HydrophobicContact CG-CE2 4Å; F543-F667 HydrophobicContact CD2-CE2 4.44Å; F543-F667 AromaticContact CE2-CD2 3.92Å; F543-F667 HydrophobicContact CE2-CD2 3.92Å; F543-F667 AromaticContact CE2-CE2 3.51Å; F543-F667 HydrophobicContact CE2-CE2 3.51Å; F543-F667 AromaticContact CE2-CZ 3.97Å; F543-F667 HydrophobicContact CE2-CZ 3.97Å; F543-F667 HydrophobicContact CZ-CD2 4.11Å; F543-F667 HydrophobicContact CZ-CE2 4.01Å; F543-F667 HydrophobicContact CZ-CG 4.44Å; F543-F667 HydrophobicContact CZ-CZ 4.24Å; W589-F667 HydrophobicContact CB-CB 4.46Å; W589-F667 HydrophobicContact CB-CD2 4.19Å; W589-F667 HydrophobicContact CD2-CB 3.75Å; W589-F667 AromaticContact CD2-CD2 3.94Å; W589-F667 HydrophobicContact CD2-CD2 3.94Å; W589-F667 HydrophobicContact CD2-CG 4.28Å; W589-F667 HydrophobicContact CE3-CB 4.26Å; W589-F667 AromaticContact CE3-CD2 3.71Å; W589-F667 HydrophobicContact CE3-CD2 3.71Å; W589-F667 HydrophobicContact CE3-CG 4.33Å; W589-F667 HydrophobicContact CG-CB 3.83Å; W589-F667 HydrophobicContact CG-CD2 4.17Å; W589-F667 HydrophobicContact CZ3-CD2 4.41Å; L634-F667 HydrophobicContact CD2-CB 3.79Å; L634-F667 HydrophobicContact CD2-CD1 4.26Å; L634-F667 HydrophobicContact CD2-CG 4.06Å; F636-F667 AromaticContact CE1-CD1 3.87Å; F636-F667 HydrophobicContact CE1-CD1 3.87Å; F636-F667 AromaticContact CE1-CE1 3.68Å; F636-F667 HydrophobicContact CE1-CE1 3.68Å; F636-F667 HydrophobicContact CE1-CZ 4.4Å; F636-F667 HydrophobicContact CE2-CE1 4.35Å; F636-F667 HydrophobicContact CZ-CD1 4.08Å; F636-F667 AromaticContact CZ-CE1 3.39Å; F636-F667 HydrophobicContact CZ-CE1 3.39Å; F636-F667 AromaticContact CZ-CZ 3.95Å; F636-F667 HydrophobicContact CZ-CZ 3.95Å; Q663-F667 PolarHBondContact O-N 2.87Å; L664-F667 HydrophobicContact CD1-CD1 4.3Å; L664-F667 PolarHBondContact O-N 2.76Å; F667-H669 VanDerWaalsContact C-N 3.27Å; F667-H669 PolarHBondContact O-N 2.89Å; F667-C670 CarbonylContact O-C 3.57Å; F667-C670 WeakPolarHBondContact O-CA 3.49Å; F667-C670 WeakPolarHBondContact O-CB 3.29Å; F667-C670 PolarHBondContact O-N 3.06Å; F667-Y671 HydrophobicContact CE1-CG 4.31Å; F667-Y671 HydrophobicContact CE2-CD2 4.11Å; F667-Y671 HydrophobicContact CE2-CG 4.27Å; F667-Y671 HydrophobicContact CZ-CD1 4.29Å; F667-Y671 AromaticContact CZ-CD2 3.78Å; F667-Y671 HydrophobicContact CZ-CD2 3.78Å; F667-Y671 HydrophobicContact CZ-CE2 4.35Å; F667-Y671 AromaticContact CZ-CG 3.76Å; F667-Y671 HydrophobicContact CZ-CG 3.76Å; F667-Y671 WeakPolarHBondContact O-CB 3.31Å; F667-Y671 PolarHBondContact O-N 2.75Å
668	L	90	Very high	83.4	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	33%	0.325	C	S	.	.	H	α-helix	trans	-59.5	-37.1	-176.9	-68.8	179.5	0	0	0	112.5	R489 F655 L664 Y671 M672	R489-L668 WeakPolarHBondContact O-CD1 3.17Å; F655-L668 HydrophobicContact CB-CD1 4.39Å; F655-L668 HydrophobicContact CD1-CD2 3.7Å; F655-L668 HydrophobicContact CD2-CD1 4.03Å; F655-L668 HydrophobicContact CD2-CD2 3.62Å; F655-L668 HydrophobicContact CE1-CD2 3.56Å; F655-L668 HydrophobicContact CE2-CD2 3.51Å; F655-L668 HydrophobicContact CG-CD1 4.18Å; F655-L668 HydrophobicContact CG-CD2 3.72Å; F655-L668 HydrophobicContact CZ-CD2 3.46Å; F655-L668 VanDerWaalsContact CZ-CD2 3.46Å; L664-L668 HydrophobicContact CD1-CD1 3.96Å; L664-L668 HydrophobicContact CD1-CD2 4.39Å; L664-L668 HydrophobicContact CD1-CG 3.96Å; L664-L668 HydrophobicContact CD2-CD1 4.4Å; L664-L668 HydrophobicContact CG-CD1 3.78Å; L664-L668 HydrophobicContact CG-CG 4.17Å; L664-L668 WeakPolarHBondContact O-CB 3.22Å; L664-L668 VanDerWaalsContact O-CG 3.24Å; L664-L668 WeakPolarHBondContact O-CG 3.39Å; L664-L668 PolarHBondContact O-N 2.89Å; L668-Y671 PolarHBondContact O-N 2.81Å; L668-M672 WeakPolarHBondContact O-CB 3.46Å; L668-M672 VanDerWaalsContact O-CG 3.27Å; L668-M672 WeakPolarHBondContact O-CG 3.44Å; L668-M672 PolarHBondContact O-N 2.78Å
669	H	87.4	Confident	84.7	Confident	98 Å²	98	53.8 Å²	53.8	45%	0.454	28%	0.284	S	S	.	.	H	α-helix	trans	-61.7	-45.9	173.6	-176.8	65.2	0	0	0	112.2	N665 R666 F667 I673	N665-H669 WeakPolarHBondContact O-CB 3.4Å; N665-H669 PolarHBondContact O-N 3.06Å; R666-H669 PolarHBondContact O-N 3.18Å; F667-H669 VanDerWaalsContact C-N 3.27Å; F667-H669 PolarHBondContact O-N 2.89Å; H669-I673 WeakPolarHBondContact O-CG1 3.49Å; H669-I673 PolarHBondContact O-N 2.9Å
670	C	90.7	Very high	86.4	Confident	19 Å²	19	52.7 Å²	52.7	13%	0.128	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-44.5	177.1	-166.4	0	0	0	0	111.7	F541 W589 R592 R666 F667 M672 I673 L674	F541-C670 HydrophobicContact CZ-CB 4.39Å; W589-C670 HydrophobicContact CB-CB 3.92Å; R592-C670 WeakPolarHBondContact CD-SG 3.49Å; R666-C670 PolarHBondContact O-N 2.87Å; R666-C670 VanDerWaalsContact O-N 3.16Å; F667-C670 CarbonylContact O-C 3.57Å; F667-C670 WeakPolarHBondContact O-CA 3.49Å; F667-C670 WeakPolarHBondContact O-CB 3.29Å; F667-C670 PolarHBondContact O-N 3.06Å; C670-M672 PolarHBondContact O-N 2.8Å; C670-I673 WeakPolarHBondContact O-CB 3.33Å; C670-I673 PolarHBondContact O-N 2.82Å; C670-I673 VanDerWaalsContact O-N 3.11Å; C670-L674 PolarHBondContact O-N 2.74Å
671	Y	93	Very high	88	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-57.5	-48.9	178.9	-169.1	-123.1	0	0	0	111.5	L492 L533 L536 L537 F541 F655 F667 L668 I673 L674 I675	L492-Y671 HydrophobicContact CD2-CD1 4.25Å; L533-Y671 VanDerWaalsContact C-OH 3.32Å; L533-Y671 WeakPolarHBondContact CA-OH 3.31Å; L533-Y671 WeakPolarHBondContact CB-OH 3.34Å; L533-Y671 HydrophobicContact CD2-CE1 3.68Å; L533-Y671 WeakPolarHBondContact CD2-OH 3.5Å; L533-Y671 PolarHBondContact O-OH 3.04Å; L536-Y671 HydrophobicContact CB-CD2 4.21Å; L536-Y671 HydrophobicContact CB-CE2 3.53Å; L536-Y671 HydrophobicContact CD1-CE2 4.31Å; L537-Y671 HydrophobicContact CD2-CE2 4.2Å; L537-Y671 HydrophobicContact CG-CE2 3.91Å; L537-Y671 WeakPolarHBondContact CG-OH 3.48Å; F541-Y671 AromaticContact CD2-CD2 3.91Å; F541-Y671 HydrophobicContact CD2-CD2 3.91Å; F541-Y671 HydrophobicContact CD2-CE2 4.41Å; F541-Y671 AromaticContact CE2-CD2 3.66Å; F541-Y671 HydrophobicContact CE2-CD2 3.66Å; F541-Y671 HydrophobicContact CE2-CE2 4.46Å; F655-Y671 HydrophobicContact CE1-CE1 4.48Å; F655-Y671 HydrophobicContact CZ-CD1 4.19Å; F655-Y671 HydrophobicContact CZ-CE1 4.06Å; F667-Y671 HydrophobicContact CE1-CG 4.31Å; F667-Y671 HydrophobicContact CE2-CD2 4.11Å; F667-Y671 HydrophobicContact CE2-CG 4.27Å; F667-Y671 HydrophobicContact CZ-CD1 4.29Å; F667-Y671 AromaticContact CZ-CD2 3.78Å; F667-Y671 HydrophobicContact CZ-CD2 3.78Å; F667-Y671 HydrophobicContact CZ-CE2 4.35Å; F667-Y671 AromaticContact CZ-CG 3.76Å; F667-Y671 HydrophobicContact CZ-CG 3.76Å; F667-Y671 WeakPolarHBondContact O-CB 3.31Å; F667-Y671 PolarHBondContact O-N 2.75Å; L668-Y671 PolarHBondContact O-N 2.81Å; Y671-I673 VanDerWaalsContact C-N 3.29Å; Y671-I673 PolarHBondContact O-N 3.36Å; Y671-L674 PolarHBondContact O-N 3.47Å; Y671-L674 VanDerWaalsContact O-N 3.12Å; Y671-I675 HydrophobicContact CD1-CD1 3.69Å; Y671-I675 HydrophobicContact CE1-CD1 3.62Å; Y671-I675 HydrophobicContact CE1-CG1 4.46Å; Y671-I675 HydrophobicContact CG-CD1 4.26Å; Y671-I675 WeakPolarHBondContact O-CG1 3.39Å; Y671-I675 PolarHBondContact O-N 3.23Å
672	M	90.7	Very high	89.3	Confident	78 Å²	78	44.8 Å²	44.8	38%	0.384	22%	0.216	S	C	.	.	H	α-helix	trans	-59.5	-36.9	175.4	-73.9	-179.9	74.6	0	0	113.3	L492 L668 C670 K676	L492-M672 HydrophobicContact CB-SD 4.5Å; L492-M672 HydrophobicContact CD2-CG 3.91Å; L668-M672 WeakPolarHBondContact O-CB 3.46Å; L668-M672 VanDerWaalsContact O-CG 3.27Å; L668-M672 WeakPolarHBondContact O-CG 3.44Å; L668-M672 PolarHBondContact O-N 2.78Å; C670-M672 PolarHBondContact O-N 2.8Å; M672-K676 WeakPolarHBondContact O-CG 3.23Å; M672-K676 PolarHBondContact O-N 2.77Å; M672-K676 VanDerWaalsContact O-N 3.14Å
673	I	89.8	Confident	90.1	Very high	88 Å²	88	42 Å²	42	45%	0.451	19%	0.193	S	C	.	.	H	α-helix	trans	-65.7	-43.8	176.2	-69.6	167.7	0	0	0	110.3	H669 C670 Y671 K676 K677	H669-I673 WeakPolarHBondContact O-CG1 3.49Å; H669-I673 PolarHBondContact O-N 2.9Å; C670-I673 WeakPolarHBondContact O-CB 3.33Å; C670-I673 PolarHBondContact O-N 2.82Å; C670-I673 VanDerWaalsContact O-N 3.11Å; Y671-I673 VanDerWaalsContact C-N 3.29Å; Y671-I673 PolarHBondContact O-N 3.36Å; I673-K676 PolarHBondContact O-N 2.84Å; I673-K677 WeakPolarHBondContact O-CB 3.31Å; I673-K677 PolarHBondContact O-N 3Å
674	L	92.4	Very high	90.7	Very high	9 Å²	9	43.8 Å²	43.8	5%	0.047	20%	0.201	C	C	.	.	H	α-helix	trans	-69.1	-39.8	179.3	-65.3	-161.3	0	0	0	112.2	L536 V540 F541 C670 Y671 K676 K677 Y678	L536-L674 HydrophobicContact CD1-CB 4.1Å; L536-L674 HydrophobicContact CD2-CB 4Å; L536-L674 HydrophobicContact CD2-CD1 4.3Å; V540-L674 HydrophobicContact CG1-CD1 4.04Å; F541-L674 HydrophobicContact CE1-CD1 4.26Å; F541-L674 HydrophobicContact CE2-CD1 3.6Å; F541-L674 HydrophobicContact CE2-CG 4.34Å; F541-L674 HydrophobicContact CZ-CD1 3.35Å; F541-L674 HydrophobicContact CZ-CG 4.03Å; C670-L674 PolarHBondContact O-N 2.74Å; Y671-L674 PolarHBondContact O-N 3.47Å; Y671-L674 VanDerWaalsContact O-N 3.12Å; L674-K676 PolarHBondContact O-N 3.39Å; L674-K677 HydrophobicContact CD2-CD 4.4Å; L674-K677 WeakPolarHBondContact O-CB 3.36Å; L674-K677 PolarHBondContact O-N 3.46Å; L674-Y678 HydrophobicContact CB-CD2 4.21Å; L674-Y678 HydrophobicContact CD2-CD2 4.44Å; L674-Y678 HydrophobicContact CD2-CE2 4.06Å; L674-Y678 WeakPolarHBondContact O-CB 3.33Å; L674-Y678 WeakPolarHBondContact O-CD2 3.31Å; L674-Y678 PolarHBondContact O-N 3.35Å
675	I	94	Very high	91	Very high	9 Å²	9	48.2 Å²	48.2	5%	0.046	22%	0.222	C	C	.	.	H	α-helix	trans	-53.7	-54.7	172.1	-68	165.5	0	0	0	109.5	L492 I494 L533 L536 Y671 K677 Y678 L679	L492-I675 HydrophobicContact CD1-CD1 4.49Å; L492-I675 HydrophobicContact CD2-CD1 4.13Å; I494-I675 HydrophobicContact CD1-CG2 4.02Å; I494-I675 HydrophobicContact CG1-CG2 4.4Å; L533-I675 HydrophobicContact CD2-CD1 3.66Å; L533-I675 HydrophobicContact CD2-CG1 4.27Å; L536-I675 HydrophobicContact CD1-CB 4.37Å; L536-I675 HydrophobicContact CD1-CG1 3.64Å; Y671-I675 HydrophobicContact CD1-CD1 3.69Å; Y671-I675 HydrophobicContact CE1-CD1 3.62Å; Y671-I675 HydrophobicContact CE1-CG1 4.46Å; Y671-I675 HydrophobicContact CG-CD1 4.26Å; Y671-I675 WeakPolarHBondContact O-CG1 3.39Å; Y671-I675 PolarHBondContact O-N 3.23Å; I675-K677 PolarHBondContact O-N 3.49Å; I675-K677 VanDerWaalsContact O-N 3.16Å; I675-Y678 PolarHBondContact O-N 2.91Å; I675-L679 HydrophobicContact CG2-CB 4.48Å; I675-L679 WeakPolarHBondContact O-CB 3.35Å; I675-L679 PolarHBondContact O-N 3.43Å
676	K	90.1	Very high	91.4	Very high	173 Å²	173	46.9 Å²	46.9	75%	0.752	21%	0.213	S	C	*	.	H	α-helix	trans	-59.2	-31.1	179.1	-72.2	-178.3	-179.6	-173.9	0	113.4	M672 I673 L674	M672-K676 WeakPolarHBondContact O-CG 3.23Å; M672-K676 PolarHBondContact O-N 2.77Å; M672-K676 VanDerWaalsContact O-N 3.14Å; I673-K676 PolarHBondContact O-N 2.84Å; L674-K676 PolarHBondContact O-N 3.39Å
677	K	90.7	Very high	91.7	Very high	73 Å²	73	39.6 Å²	39.6	32%	0.317	19%	0.186	S	C	.	.	H	α-helix	trans	-76.4	-34.6	-179	-176.1	178.6	173.3	-167.2	0	112.8	K605 E612 I673 L674 I675	K605-K677 PolarHBondContact NZ-O 3.2Å; E612-K677 IonicContact OE1-NZ 2.87Å; E612-K677 PolarHBondContact OE1-NZ 2.72Å; I673-K677 WeakPolarHBondContact O-CB 3.31Å; I673-K677 PolarHBondContact O-N 3Å; L674-K677 HydrophobicContact CD2-CD 4.4Å; L674-K677 WeakPolarHBondContact O-CB 3.36Å; L674-K677 PolarHBondContact O-N 3.46Å; I675-K677 PolarHBondContact O-N 3.49Å; I675-K677 VanDerWaalsContact O-N 3.16Å
678	Y	93.4	Very high	91.6	Very high	1 Å²	1	43.3 Å²	43.3	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-117.9	-14.7	-164.3	-72.5	-57.6	0	0	0	115.6	L536 K605 F609 E612 L674 I675 F680 T681 C682	L536-Y678 HydrophobicContact CD2-CD2 4.26Å; K605-Y678 HydrophobicContact CG-CE1 4.32Å; F609-Y678 AromaticContact CD1-CD1 3.4Å; F609-Y678 HydrophobicContact CD1-CD1 3.4Å; F609-Y678 AromaticContact CD1-CE1 3.83Å; F609-Y678 HydrophobicContact CD1-CE1 3.83Å; F609-Y678 AromaticContact CD1-CG 3.92Å; F609-Y678 HydrophobicContact CD1-CG 3.92Å; F609-Y678 HydrophobicContact CD2-CG 4.39Å; F609-Y678 AromaticContact CE1-CD1 3.45Å; F609-Y678 HydrophobicContact CE1-CD1 3.45Å; F609-Y678 VanDerWaalsContact CE1-CD1 3.45Å; F609-Y678 HydrophobicContact CE1-CE1 4.31Å; F609-Y678 AromaticContact CE1-CG 3.83Å; F609-Y678 HydrophobicContact CE1-CG 3.83Å; F609-Y678 HydrophobicContact CE2-CG 4.3Å; F609-Y678 HydrophobicContact CG-CD1 4.04Å; F609-Y678 HydrophobicContact CG-CE1 4.36Å; F609-Y678 HydrophobicContact CG-CG 4.2Å; F609-Y678 HydrophobicContact CZ-CD1 4.12Å; F609-Y678 HydrophobicContact CZ-CG 4.02Å; E612-Y678 HydrophobicContact CG-CE2 3.5Å; E612-Y678 VanDerWaalsContact CG-CZ 3.48Å; E612-Y678 WeakPolarHBondContact CG-OH 3.42Å; E612-Y678 WeakPolarHBondContact OE1-CE2 3.46Å; E612-Y678 PolarHBondContact OE1-OH 2.9Å; L674-Y678 HydrophobicContact CB-CD2 4.21Å; L674-Y678 HydrophobicContact CD2-CD2 4.44Å; L674-Y678 HydrophobicContact CD2-CE2 4.06Å; L674-Y678 WeakPolarHBondContact O-CB 3.33Å; L674-Y678 WeakPolarHBondContact O-CD2 3.31Å; L674-Y678 PolarHBondContact O-N 3.35Å; I675-Y678 PolarHBondContact O-N 2.91Å; Y678-F680 VanDerWaalsContact C-N 3.34Å; Y678-F680 PolarHBondContact O-N 3.42Å; Y678-T681 WeakPolarHBondContact O-CB 3.19Å; Y678-T681 PolarHBondContact O-N 3.25Å; Y678-C682 PolarHBondContact O-N 2.75Å; Y678-C682 VanDerWaalsContact O-N 3.08Å
679	L	94.4	Very high	91.5	Very high	13 Å²	13	45.8 Å²	45.8	7%	0.068	22%	0.223	C	C	.	.	H	α-helix	trans	-54.9	-48.1	-179	-174.8	64.1	0	0	0	112.2	I494 L500 C532 I675 T681 C682 F683	I494-L679 HydrophobicContact CG2-CD2 3.49Å; I494-L679 VanDerWaalsContact CG2-CD2 3.49Å; L500-L679 HydrophobicContact CD1-CD2 3.75Å; L500-L679 HydrophobicContact CD1-CG 4.23Å; C532-L679 HydrophobicContact CB-CD1 3.87Å; I675-L679 HydrophobicContact CG2-CB 4.48Å; I675-L679 WeakPolarHBondContact O-CB 3.35Å; I675-L679 PolarHBondContact O-N 3.43Å; L679-T681 VanDerWaalsContact C-N 3.25Å; L679-T681 PolarHBondContact O-N 3Å; L679-C682 WeakPolarHBondContact O-CB 3.36Å; L679-C682 PolarHBondContact O-N 2.88Å; L679-C682 VanDerWaalsContact O-N 3.07Å; L679-F683 HydrophobicContact CD1-CD2 4.26Å; L679-F683 HydrophobicContact CD1-CE2 3.82Å; L679-F683 HydrophobicContact CG-CD2 4.28Å; L679-F683 HydrophobicContact CG-CE2 4.05Å; L679-F683 WeakPolarHBondContact O-CD2 3.5Å; L679-F683 PolarHBondContact O-N 2.86Å; L679-F683 VanDerWaalsContact O-N 3.13Å
680	F	93.9	Very high	90.8	Very high	59 Å²	59	45.3 Å²	45.3	26%	0.259	23%	0.228	S	C	.	.	H	α-helix	trans	-59.1	-37.1	177.9	-173.8	-101.9	0	0	0	112.7	Q499 L500 R503 Y678 F683 E684	Q499-F680 HydrophobicContact CB-CD2 3.77Å; Q499-F680 HydrophobicContact CB-CE2 3.65Å; Q499-F680 HydrophobicContact CB-CZ 4.49Å; L500-F680 HydrophobicContact CD2-CD2 3.96Å; R503-F680 HydrophobicContact CB-CE2 4.1Å; Y678-F680 VanDerWaalsContact C-N 3.34Å; Y678-F680 PolarHBondContact O-N 3.42Å; F680-F683 WeakPolarHBondContact O-CB 3.41Å; F680-F683 PolarHBondContact O-N 2.74Å; F680-F683 VanDerWaalsContact O-N 3.16Å; F680-E684 HydrophobicContact CD1-CG 4.01Å; F680-E684 HydrophobicContact CE1-CG 3.66Å; F680-E684 VanDerWaalsContact CE1-OE1 3.26Å; F680-E684 WeakPolarHBondContact CE1-OE1 3.03Å; F680-E684 HydrophobicContact CZ-CG 4.11Å; F680-E684 WeakPolarHBondContact O-CG 3.4Å; F680-E684 PolarHBondContact O-N 2.93Å
681	T	92.5	Very high	89.4	Confident	7 Å²	7	57.1 Å²	57.1	4%	0.043	28%	0.282	C	S	.	.	H	α-helix	trans	-67.7	-35	176.9	-59.6	0	0	0	0	112.2	K605 F609 Y678 L679 F683 E684 H685	K605-T681 HydrophobicContact CB-CG2 4.23Å; K605-T681 WeakPolarHBondContact O-CG2 3.32Å; F609-T681 HydrophobicContact CE1-CG2 3.78Å; Y678-T681 WeakPolarHBondContact O-CB 3.19Å; Y678-T681 PolarHBondContact O-N 3.25Å; L679-T681 VanDerWaalsContact C-N 3.25Å; L679-T681 PolarHBondContact O-N 3Å; T681-F683 VanDerWaalsContact C-N 3.34Å; T681-E684 PolarHBondContact O-N 3.45Å; T681-H685 PolarHBondContact O-N 3.33Å; T681-H685 VanDerWaalsContact O-N 3.09Å
682	C	93	Very high	89.2	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.3	-46.3	168.6	-87.9	0	0	0	0	111.1	C532 Y607 Y678 L679 E684 H685 F686	C532-C682 VanDerWaalsContact CA-SG 3.55Å; C532-C682 HydrophobicContact CB-CB 4.09Å; C532-C682 VanDerWaalsContact CB-SG 3.54Å; Y607-C682 WeakPolarHBondContact CD2-SG 3.35Å; Y607-C682 WeakPolarHBondContact CE2-SG 3.4Å; Y678-C682 PolarHBondContact O-N 2.75Å; Y678-C682 VanDerWaalsContact O-N 3.08Å; L679-C682 WeakPolarHBondContact O-CB 3.36Å; L679-C682 PolarHBondContact O-N 2.88Å; L679-C682 VanDerWaalsContact O-N 3.07Å; C682-E684 VanDerWaalsContact C-N 3.3Å; C682-E684 PolarHBondContact O-N 3.06Å; C682-H685 PolarHBondContact O-N 2.87Å; C682-H685 VanDerWaalsContact O-N 3.13Å; C682-F686 HydrophobicContact CB-CD2 4.34Å; C682-F686 HydrophobicContact CB-CE2 4.49Å; C682-F686 WeakPolarHBondContact O-CD2 3.19Å; C682-F686 PolarHBondContact O-N 3.15Å
683	F	93.8	Very high	89.1	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.9	-37.5	177.7	-83	-111.1	0	0	0	112	L500 R503 I504 F525 C528 L679 F680 T681 H685 L687	L500-F683 HydrophobicContact CD2-CB 3.97Å; L500-F683 HydrophobicContact CD2-CD1 3.78Å; L500-F683 HydrophobicContact CD2-CD2 3.53Å; L500-F683 HydrophobicContact CD2-CE1 4.16Å; L500-F683 HydrophobicContact CD2-CE2 3.89Å; L500-F683 HydrophobicContact CD2-CG 3.47Å; L500-F683 VanDerWaalsContact CD2-CG 3.47Å; L500-F683 HydrophobicContact CD2-CZ 4.21Å; R503-F683 HydrophobicContact CG-CB 4.25Å; I504-F683 HydrophobicContact CD1-CD1 4.44Å; I504-F683 HydrophobicContact CD1-CE1 3.82Å; I504-F683 HydrophobicContact CG1-CD1 4.01Å; I504-F683 HydrophobicContact CG1-CE1 3.83Å; F525-F683 HydrophobicContact CB-CZ 4.48Å; F525-F683 AromaticContact CD2-CE1 3.97Å; F525-F683 HydrophobicContact CD2-CE1 3.97Å; F525-F683 AromaticContact CD2-CZ 3.47Å; F525-F683 HydrophobicContact CD2-CZ 3.47Å; F525-F683 VanDerWaalsContact CD2-CZ 3.47Å; F525-F683 HydrophobicContact CE2-CZ 4.02Å; F525-F683 HydrophobicContact CG-CZ 4.27Å; C528-F683 HydrophobicContact CB-CD1 4.18Å; C528-F683 HydrophobicContact CB-CD2 3.52Å; C528-F683 HydrophobicContact CB-CE1 3.9Å; C528-F683 HydrophobicContact CB-CE2 3.24Å; C528-F683 HydrophobicContact CB-CG 3.99Å; C528-F683 HydrophobicContact CB-CZ 3.43Å; C528-F683 VanDerWaalsContact CB-CZ 3.43Å; L679-F683 HydrophobicContact CD1-CD2 4.26Å; L679-F683 HydrophobicContact CD1-CE2 3.82Å; L679-F683 HydrophobicContact CG-CD2 4.28Å; L679-F683 HydrophobicContact CG-CE2 4.05Å; L679-F683 WeakPolarHBondContact O-CD2 3.5Å; L679-F683 PolarHBondContact O-N 2.86Å; L679-F683 VanDerWaalsContact O-N 3.13Å; F680-F683 WeakPolarHBondContact O-CB 3.41Å; F680-F683 PolarHBondContact O-N 2.74Å; F680-F683 VanDerWaalsContact O-N 3.16Å; T681-F683 VanDerWaalsContact C-N 3.34Å; F683-H685 VanDerWaalsContact C-N 3.27Å; F683-H685 PolarHBondContact O-N 3.46Å; F683-L687 HydrophobicContact CD1-CD1 3.66Å; F683-L687 HydrophobicContact CE1-CD1 4.23Å; F683-L687 HydrophobicContact CG-CD1 4.5Å; F683-L687 WeakPolarHBondContact O-CA 3.38Å; F683-L687 VanDerWaalsContact O-CB 3.24Å; F683-L687 WeakPolarHBondContact O-CB 3.16Å; F683-L687 PolarHBondContact O-N 3.2Å
684	E	92.1	Very high	89.1	Confident	84 Å²	84	57.4 Å²	57.4	39%	0.393	28%	0.282	S	S	.	.	H	α-helix	trans	-62.6	-36	174.6	-72.4	-175.9	130.1	0	0	112.8	R503 F680 T681 C682	R503-E684 PolarHBondContact NH2-O 3.3Å; F680-E684 HydrophobicContact CD1-CG 4.01Å; F680-E684 HydrophobicContact CE1-CG 3.66Å; F680-E684 VanDerWaalsContact CE1-OE1 3.26Å; F680-E684 WeakPolarHBondContact CE1-OE1 3.03Å; F680-E684 HydrophobicContact CZ-CG 4.11Å; F680-E684 WeakPolarHBondContact O-CG 3.4Å; F680-E684 PolarHBondContact O-N 2.93Å; T681-E684 PolarHBondContact O-N 3.45Å; C682-E684 VanDerWaalsContact C-N 3.3Å; C682-E684 PolarHBondContact O-N 3.06Å
685	H	91.2	Very high	88.9	Confident	95 Å²	95	60.3 Å²	60.3	44%	0.44	30%	0.296	S	S	.	.	H	α-helix	trans	-75.1	-50.1	-179.7	-173.9	74.8	0	0	0	112.6	Y607 T681 C682 F683	Y607-H685 HydrophobicContact CD1-CB 4.27Å; Y607-H685 AromaticContact CD1-CD2 3.22Å; Y607-H685 WeakPolarHBondContact CD1-CD2 3.32Å; Y607-H685 AromaticContact CD1-CE1 3.92Å; Y607-H685 AromaticContact CD1-CG 3.58Å; Y607-H685 AromaticContact CD1-NE2 3.44Å; Y607-H685 WeakPolarHBondContact CD1-NE2 3.38Å; Y607-H685 AromaticContact CE1-CD2 3.67Å; Y607-H685 AromaticContact CE1-NE2 3.84Å; Y607-H685 HydrophobicContact CG-CB 4.16Å; Y607-H685 AromaticContact CG-CD2 3.96Å; Y607-H685 AromaticContact CG-CG 3.94Å; T681-H685 PolarHBondContact O-N 3.33Å; T681-H685 VanDerWaalsContact O-N 3.09Å; C682-H685 PolarHBondContact O-N 2.87Å; C682-H685 VanDerWaalsContact O-N 3.13Å; F683-H685 VanDerWaalsContact C-N 3.27Å; F683-H685 PolarHBondContact O-N 3.46Å
686	F	90.6	Very high	88.6	Confident	22 Å²	22	63.5 Å²	63.5	10%	0.096	31%	0.312	C	S	.	.	H	α-helix	trans	-85.8	-15.3	-173.7	-66.2	-65.9	0	0	0	114.5	R531 R572 Y607 C682 P688	R531-F686 HydrophobicContact CB-CD2 4.36Å; R531-F686 HydrophobicContact CB-CE2 3.74Å; R531-F686 HydrophobicContact CB-CZ 4.09Å; R531-F686 VanDerWaalsContact CD-CE1 3.42Å; R531-F686 VanDerWaalsContact CD-CE2 3.47Å; R531-F686 HydrophobicContact CG-CE2 4.28Å; R531-F686 HydrophobicContact CG-CZ 4.27Å; R572-F686 PolarHBondContact NH2-O 3.38Å; Y607-F686 HydrophobicContact CD1-CE2 4.37Å; Y607-F686 HydrophobicContact CD1-CZ 4.2Å; Y607-F686 HydrophobicContact CD2-CE2 4.41Å; Y607-F686 HydrophobicContact CE1-CE1 4.34Å; Y607-F686 AromaticContact CE1-CE2 3.81Å; Y607-F686 HydrophobicContact CE1-CE2 3.81Å; Y607-F686 AromaticContact CE1-CZ 3.38Å; Y607-F686 HydrophobicContact CE1-CZ 3.38Å; Y607-F686 AromaticContact CE2-CE2 3.91Å; Y607-F686 HydrophobicContact CE2-CE2 3.91Å; Y607-F686 HydrophobicContact CE2-CZ 4.24Å; Y607-F686 AromaticContact CZ-CE2 3.58Å; Y607-F686 AromaticContact CZ-CZ 3.43Å; Y607-F686 VanDerWaalsContact CZ-CZ 3.43Å; Y607-F686 WeakPolarHBondContact OH-CZ 3.39Å; C682-F686 HydrophobicContact CB-CD2 4.34Å; C682-F686 HydrophobicContact CB-CE2 4.49Å; C682-F686 WeakPolarHBondContact O-CD2 3.19Å; C682-F686 PolarHBondContact O-N 3.15Å; F686-P688 WeakPolarHBondContact O-CD 3.44Å
687	L	91.7	Very high	88.5	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.282	C	S	.	.	S	Bend	trans	-121.2	67.1	174.8	-49.5	179.4	0	0	0	109.4	R503 I504 Y507 L524 F683 L689	R503-L687 VanDerWaalsContact CZ-O 3.23Å; R503-L687 PolarHBondContact NE-O 2.92Å; R503-L687 PolarHBondContact NH2-O 3.27Å; I504-L687 HydrophobicContact CG1-CD1 4.03Å; Y507-L687 HydrophobicContact CD1-CB 4.21Å; Y507-L687 HydrophobicContact CD1-CD2 3.79Å; Y507-L687 HydrophobicContact CD1-CG 4.43Å; Y507-L687 HydrophobicContact CD2-CB 3.7Å; Y507-L687 HydrophobicContact CD2-CD2 4.47Å; Y507-L687 HydrophobicContact CE1-CD2 3.73Å; Y507-L687 HydrophobicContact CE2-CB 4.24Å; Y507-L687 HydrophobicContact CE2-CD2 4.44Å; Y507-L687 HydrophobicContact CG-CB 3.69Å; Y507-L687 HydrophobicContact CG-CD2 4.16Å; Y507-L687 HydrophobicContact CG-CG 4.38Å; L524-L687 HydrophobicContact CB-CD2 4.33Å; L524-L687 HydrophobicContact CD1-CD2 4.35Å; L524-L687 HydrophobicContact CD2-CD2 3.89Å; L524-L687 HydrophobicContact CG-CD2 4.43Å; F683-L687 HydrophobicContact CD1-CD1 3.66Å; F683-L687 HydrophobicContact CE1-CD1 4.23Å; F683-L687 HydrophobicContact CG-CD1 4.5Å; F683-L687 WeakPolarHBondContact O-CA 3.38Å; F683-L687 VanDerWaalsContact O-CB 3.24Å; F683-L687 WeakPolarHBondContact O-CB 3.16Å; F683-L687 PolarHBondContact O-N 3.2Å; L687-L689 PolarHBondContact O-N 3.1Å
688	P	89.2	Confident	88.3	Confident	77 Å²	77	55 Å²	55	50%	0.5	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-63.2	134.7	179	28	-34.4	0	0	0	110.1	Y507 F686	Y507-P688 VanDerWaalsContact CD2-O 3.27Å; Y507-P688 WeakPolarHBondContact CD2-O 3.41Å; F686-P688 WeakPolarHBondContact O-CD 3.44Å
689	L	86.2	Confident	87.9	Confident	56 Å²	56	59.2 Å²	59.2	29%	0.293	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-78.9	143.5	174.7	-59.9	-177.9	0	0	0	109	R506 L687	R506-L689 HydrophobicContact CB-CD1 4.13Å; R506-L689 HydrophobicContact CB-CD2 3.47Å; R506-L689 VanDerWaalsContact CB-CD2 3.47Å; R506-L689 HydrophobicContact CB-CG 4.45Å; L687-L689 PolarHBondContact O-N 3.1Å
690	P	73.3	Confident	87.4	Confident	88 Å²	88	63 Å²	63	57%	0.571	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-53.9	140.7	168.1	-18.3	28.8	0	0	0	110
691	E	61.7	Low	86.8	Confident	268 Å²	268	63.4 Å²	63.4	100%	1.252	33%	0.326	S	S	*	.			trans	-63.4	0	177.2	-70.9	-168	158.7	0	0	113.4

Retrieved 691 of 691 residues in 643 ms (Link to these results)

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