A0A061HYY6_CRIGR Loading...

Zinc finger and BTB domain containing 37

AlphaFold DB , UniProt , Accession A0A061HYY6, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Zbtb37, Length 505 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	36.9	Very low	55.9	Low	245 Å²	245	157.8 Å²	157.8	100%	1.207	84%	0.842	S	S	*	*				0	131.6	0	-83.4	169.7	157.2	0	0	107.7
2	T	39.2	Very low	57.3	Low	123 Å²	123	157 Å²	157	76%	0.755	83%	0.829	S	S	*	*			trans	-61	124.5	-168.4	36.5	0	0	0	0	112.2	E4	T2-E4 PolarHBondContact O-N 3.03Å; T2-E4 VanDerWaalsContact O-N 3.09Å
3	M	45.3	Very low	58.7	Low	184 Å²	184	153 Å²	153	91%	0.906	81%	0.807	S	S	*	*			trans	-67.4	101.1	160.3	-70.1	-85.4	-80.6	0	0	106.5	K5	M3-K5 PolarHBondContact O-N 3.08Å; M3-K5 VanDerWaalsContact O-N 3.09Å
4	E	47.1	Very low	59.3	Low	177 Å²	177	149.9 Å²	149.9	83%	0.827	80%	0.8	S	S	*	*			trans	-63.5	111.3	172.4	-71.1	-175.1	162.9	0	0	108.3	T2	T2-E4 PolarHBondContact O-N 3.03Å; T2-E4 VanDerWaalsContact O-N 3.09Å
5	K	61.6	Low	59.9	Low	196 Å²	196	147.6 Å²	147.6	85%	0.852	79%	0.788	S	S	*	*	S	Bend	trans	-60.9	140.9	166.8	-75.3	173.3	172.1	178.1	0	108.2	M3	M3-K5 PolarHBondContact O-N 3.08Å; M3-K5 VanDerWaalsContact O-N 3.09Å
6	S	54.8	Low	60.8	Low	118 Å²	118	146.1 Å²	146.1	83%	0.825	77%	0.772	S	S	*	*			trans	74.6	57.7	176.8	75.4	0	0	0	0	117.7
7	G	53.2	Low	61.4	Low	68 Å²	68	142 Å²	142	70%	0.701	76%	0.759	S	S	*	*			trans	-88.2	109.2	154.1	0	0	0	0	0	109.6	I9	G7-I9 PolarHBondContact O-N 3.01Å
8	N	65.3	Low	62	Low	156 Å²	156	137.3 Å²	137.3	83%	0.834	73%	0.733	S	S	*	*			trans	-66.2	129.4	171.7	-72.3	-18.9	0	0	0	109.1	Q10	N8-Q10 PolarHBondContact O-N 3.39Å
9	I	71.9	Confident	62.5	Low	168 Å²	168	134.2 Å²	134.2	86%	0.862	72%	0.724	S	S	*	*			trans	-82	103.9	172.5	-57.3	172.3	0	0	0	107	G7	G7-I9 PolarHBondContact O-N 3.01Å
10	Q	66.4	Low	63.2	Low	156 Å²	156	130.5 Å²	130.5	73%	0.729	71%	0.706	S	S	*	*			trans	-96.9	116	171.3	-174.3	169.5	-10.9	0	0	108.1	N8 E12	N8-Q10 PolarHBondContact O-N 3.39Å; Q10-E12 HydrophobicContact CG-CG 4.49Å; Q10-E12 PolarHBondContact NE2-OE1 2.75Å
11	L	73.5	Confident	63.8	Low	145 Å²	145	127 Å²	127	76%	0.759	69%	0.687	S	S	*	*			trans	-116.4	118.5	174.2	-179.1	70.8	0	0	0	107.9
12	E	73	Confident	65.6	Low	148 Å²	148	119.2 Å²	119.2	69%	0.692	66%	0.656	S	S	*	*			trans	-110.1	116.4	174	-71.6	177.9	-170.9	0	0	108.4	Q10	Q10-E12 HydrophobicContact CG-CG 4.49Å; Q10-E12 PolarHBondContact NE2-OE1 2.75Å
13	I	74.6	Confident	67.4	Low	105 Å²	105	118.3 Å²	118.3	54%	0.538	64%	0.643	S	S	.	*			trans	-89.3	116.6	173	-59.9	172.6	0	0	0	106.6	F16	I13-F16 HydrophobicContact CB-CB 4.03Å; I13-F16 HydrophobicContact CD1-CD2 4.48Å; I13-F16 HydrophobicContact CG2-CB 4.08Å; I13-F16 HydrophobicContact CG2-CD2 4.47Å; I13-F16 WeakPolarHBondContact O-CB 3.18Å; I13-F16 PolarHBondContact O-N 2.92Å
14	P	67.5	Low	69	Low	110 Å²	110	111.8 Å²	111.8	71%	0.714	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	143.2	177.2	25	-32.5	0	0	0	110.4	F16	P14-F16 PolarHBondContact O-N 3.28Å
15	D	68.8	Low	70.6	Confident	115 Å²	115	105 Å²	105	62%	0.615	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	57.2	14.6	177.8	-61.4	-50.9	0	0	0	116.6	S17 N18 S19	D15-S17 PolarHBondContact O-N 3.08Å; D15-N18 HydrophobicContact CB-CB 4.5Å; D15-N18 PolarHBondContact O-N 2.7Å; D15-N18 VanDerWaalsContact O-N 3.11Å; D15-N18 PolarHBondContact OD1-ND2 3.46Å; D15-S19 PolarHBondContact O-N 3.49Å
16	F	73	Confident	71.4	Confident	123 Å²	123	100.6 Å²	100.6	54%	0.539	56%	0.564	S	S	.	*	H	α-helix	trans	-56.6	-40.5	178.9	-178.9	-105.9	0	0	0	112.2	I13 P14 N18 S19 V20	I13-F16 HydrophobicContact CB-CB 4.03Å; I13-F16 HydrophobicContact CD1-CD2 4.48Å; I13-F16 HydrophobicContact CG2-CB 4.08Å; I13-F16 HydrophobicContact CG2-CD2 4.47Å; I13-F16 WeakPolarHBondContact O-CB 3.18Å; I13-F16 PolarHBondContact O-N 2.92Å; P14-F16 PolarHBondContact O-N 3.28Å; F16-N18 PolarHBondContact O-N 2.81Å; F16-S19 PolarHBondContact O-N 3.11Å; F16-V20 HydrophobicContact CD1-CG2 4.15Å; F16-V20 HydrophobicContact CD2-CG2 4.46Å; F16-V20 HydrophobicContact CE1-CG2 3.75Å; F16-V20 HydrophobicContact CE2-CG2 4.09Å; F16-V20 HydrophobicContact CG-CG2 4.5Å; F16-V20 HydrophobicContact CZ-CG2 3.71Å; F16-V20 VanDerWaalsContact O-CG2 3.29Å; F16-V20 WeakPolarHBondContact O-CG2 3.47Å; F16-V20 PolarHBondContact O-N 3.1Å
17	S	72.1	Confident	72.6	Confident	77 Å²	77	95.6 Å²	95.6	54%	0.538	53%	0.527	S	S	.	.	H	α-helix	trans	-59.1	-44.5	176.2	48.9	0	0	0	0	112.7	D15 V20 L21	D15-S17 PolarHBondContact O-N 3.08Å; S17-V20 PolarHBondContact O-N 3.32Å; S17-L21 WeakPolarHBondContact O-CB 3.35Å; S17-L21 WeakPolarHBondContact O-CG 3.38Å; S17-L21 PolarHBondContact O-N 3.3Å
18	N	72.4	Confident	74.1	Confident	57 Å²	57	93.6 Å²	93.6	31%	0.305	50%	0.499	S	S	.	.	H	α-helix	trans	-66.7	-40.1	179.4	-68	-27.9	0	0	0	111.2	D15 F16 L21 S22	D15-N18 HydrophobicContact CB-CB 4.5Å; D15-N18 PolarHBondContact O-N 2.7Å; D15-N18 VanDerWaalsContact O-N 3.11Å; D15-N18 PolarHBondContact OD1-ND2 3.46Å; F16-N18 PolarHBondContact O-N 2.81Å; N18-L21 PolarHBondContact O-N 3.48Å; N18-S22 WeakPolarHBondContact O-CB 3.46Å; N18-S22 PolarHBondContact O-N 2.94Å
19	S	70.3	Confident	74.8	Confident	79 Å²	79	92.1 Å²	92.1	55%	0.552	49%	0.488	S	S	*	.	H	α-helix	trans	-62.7	-44.7	174.6	-171.2	0	0	0	0	112	D15 F16 S22 H23	D15-S19 PolarHBondContact O-N 3.49Å; F16-S19 PolarHBondContact O-N 3.11Å; S19-S22 PolarHBondContact O-N 2.92Å; S19-H23 PolarHBondContact O-N 3.14Å
20	V	76.8	Confident	75.2	Confident	60 Å²	60	89.1 Å²	89.1	36%	0.364	47%	0.47	S	S	.	.	H	α-helix	trans	-62.8	-46.2	177	171.2	0	0	0	0	111.4	F16 S17 S22 H23 L24	F16-V20 HydrophobicContact CD1-CG2 4.15Å; F16-V20 HydrophobicContact CD2-CG2 4.46Å; F16-V20 HydrophobicContact CE1-CG2 3.75Å; F16-V20 HydrophobicContact CE2-CG2 4.09Å; F16-V20 HydrophobicContact CG-CG2 4.5Å; F16-V20 HydrophobicContact CZ-CG2 3.71Å; F16-V20 VanDerWaalsContact O-CG2 3.29Å; F16-V20 WeakPolarHBondContact O-CG2 3.47Å; F16-V20 PolarHBondContact O-N 3.1Å; S17-V20 PolarHBondContact O-N 3.32Å; V20-S22 PolarHBondContact O-N 2.98Å; V20-H23 PolarHBondContact O-N 3.33Å; V20-L24 HydrophobicContact CG1-CD1 4.05Å; V20-L24 HydrophobicContact CG1-CG 4.4Å; V20-L24 WeakPolarHBondContact O-CG 3.34Å; V20-L24 PolarHBondContact O-N 3.22Å
21	L	77.1	Confident	75.8	Confident	58 Å²	58	83 Å²	83	30%	0.304	45%	0.45	S	S	.	.	H	α-helix	trans	-62.8	-40.8	178	-79.9	173.2	0	0	0	112.5	S17 N18 L24 N25	S17-L21 WeakPolarHBondContact O-CB 3.35Å; S17-L21 WeakPolarHBondContact O-CG 3.38Å; S17-L21 PolarHBondContact O-N 3.3Å; N18-L21 PolarHBondContact O-N 3.48Å; L21-L24 PolarHBondContact O-N 2.96Å; L21-N25 PolarHBondContact O-N 3.18Å
22	S	74.6	Confident	76	Confident	81 Å²	81	83.1 Å²	83.1	57%	0.566	44%	0.44	S	S	*	.	H	α-helix	trans	-61	-44.1	173.8	-174.8	0	0	0	0	111.8	N18 S19 V20 N25 Q26	N18-S22 WeakPolarHBondContact O-CB 3.46Å; N18-S22 PolarHBondContact O-N 2.94Å; S19-S22 PolarHBondContact O-N 2.92Å; V20-S22 PolarHBondContact O-N 2.98Å; S22-N25 WeakPolarHBondContact O-CB 3.32Å; S22-N25 PolarHBondContact O-N 2.79Å; S22-Q26 PolarHBondContact O-N 3.38Å
23	H	76.8	Confident	76.3	Confident	104 Å²	104	82.4 Å²	82.4	48%	0.481	44%	0.44	S	S	.	.	H	α-helix	trans	-64.9	-41.4	176.2	-167.7	61.9	0	0	0	112.3	S19 V20 N25 Q26 L27	S19-H23 PolarHBondContact O-N 3.14Å; V20-H23 PolarHBondContact O-N 3.33Å; H23-N25 VanDerWaalsContact C-N 3.28Å; H23-N25 PolarHBondContact O-N 3.1Å; H23-Q26 WeakPolarHBondContact O-CB 3.42Å; H23-Q26 PolarHBondContact O-N 3.44Å; H23-Q26 VanDerWaalsContact O-N 3.16Å; H23-L27 WeakPolarHBondContact O-CG 3.43Å; H23-L27 PolarHBondContact O-N 3.1Å
24	L	78	Confident	76.9	Confident	47 Å²	47	78.8 Å²	78.8	25%	0.246	42%	0.424	C	S	.	.	H	α-helix	trans	-62	-35.4	173.9	-71.8	173.6	0	0	0	112.2	V20 L21 L27 R28 V51 Y90	V20-L24 HydrophobicContact CG1-CD1 4.05Å; V20-L24 HydrophobicContact CG1-CG 4.4Å; V20-L24 WeakPolarHBondContact O-CG 3.34Å; V20-L24 PolarHBondContact O-N 3.22Å; L21-L24 PolarHBondContact O-N 2.96Å; L24-L27 HydrophobicContact CD2-CD1 4.36Å; L24-L27 PolarHBondContact O-N 3.47Å; L24-R28 WeakPolarHBondContact O-CB 3.22Å; L24-R28 PolarHBondContact O-N 2.96Å; L24-V51 HydrophobicContact CD1-CG2 4.07Å; L24-Y90 HydrophobicContact CB-CD1 4.04Å; L24-Y90 HydrophobicContact CB-CE1 4.06Å
25	N	80.1	Confident	77.7	Confident	34 Å²	34	76.8 Å²	76.8	18%	0.182	41%	0.407	C	S	.	.	H	α-helix	trans	-65.5	-41.9	174.1	-164	27.6	0	0	0	111.4	L21 S22 H23 R28 M29 Y90	L21-N25 PolarHBondContact O-N 3.18Å; S22-N25 WeakPolarHBondContact O-CB 3.32Å; S22-N25 PolarHBondContact O-N 2.79Å; H23-N25 VanDerWaalsContact C-N 3.28Å; H23-N25 PolarHBondContact O-N 3.1Å; N25-R28 WeakPolarHBondContact O-CB 3.48Å; N25-R28 PolarHBondContact O-N 3.18Å; N25-R28 PolarHBondContact OD1-NE 3.25Å; N25-R28 PolarHBondContact OD1-NH2 3.35Å; N25-M29 WeakPolarHBondContact O-CG 3.4Å; N25-M29 PolarHBondContact O-N 2.84Å; N25-Y90 HydrophobicContact CB-CD1 4.14Å; N25-Y90 HydrophobicContact CB-CG 4.29Å
26	Q	78.8	Confident	78.5	Confident	104 Å²	104	71.4 Å²	71.4	49%	0.486	38%	0.379	S	S	.	.	H	α-helix	trans	-62.1	-43.8	175.7	-170.6	-179.2	10.3	0	0	111.5	S22 H23 R28 M29 Q30	S22-Q26 PolarHBondContact O-N 3.38Å; H23-Q26 WeakPolarHBondContact O-CB 3.42Å; H23-Q26 PolarHBondContact O-N 3.44Å; H23-Q26 VanDerWaalsContact O-N 3.16Å; Q26-R28 PolarHBondContact O-N 2.78Å; Q26-M29 PolarHBondContact O-N 2.87Å; Q26-Q30 WeakPolarHBondContact O-CG 3.42Å; Q26-Q30 PolarHBondContact O-N 3.36Å
27	L	80.4	Confident	79.3	Confident	13 Å²	13	67 Å²	67	7%	0.068	36%	0.362	C	S	.	.	H	α-helix	trans	-61.9	-42.3	175.8	-70.3	170.3	0	0	0	111.9	H23 L24 M29 Q30 G31 R32 L33	H23-L27 WeakPolarHBondContact O-CG 3.43Å; H23-L27 PolarHBondContact O-N 3.1Å; L24-L27 HydrophobicContact CD2-CD1 4.36Å; L24-L27 PolarHBondContact O-N 3.47Å; L27-M29 PolarHBondContact O-N 3.4Å; L27-Q30 CarbonylContact O-C 3.5Å; L27-Q30 PolarHBondContact O-N 3.35Å; L27-G31 PolarHBondContact O-N 3.39Å; L27-R32 HydrophobicContact CD2-CB 4.03Å; L27-R32 PolarHBondContact O-N 3.27Å; L27-L33 HydrophobicContact CD1-CD1 4.16Å
28	R	85.1	Confident	80.1	Confident	26 Å²	26	63.4 Å²	63.4	10%	0.098	34%	0.336	C	S	.	.	H	α-helix	trans	-56.8	-49	173.9	-179.7	-170.7	67.4	90.6	-4	111.6	L24 N25 Q26 Q30 G31 R46 Y90	L24-R28 WeakPolarHBondContact O-CB 3.22Å; L24-R28 PolarHBondContact O-N 2.96Å; N25-R28 WeakPolarHBondContact O-CB 3.48Å; N25-R28 PolarHBondContact O-N 3.18Å; N25-R28 PolarHBondContact OD1-NE 3.25Å; N25-R28 PolarHBondContact OD1-NH2 3.35Å; Q26-R28 PolarHBondContact O-N 2.78Å; R28-Q30 VanDerWaalsContact C-N 3.26Å; R28-Q30 PolarHBondContact O-N 3.09Å; R28-G31 PolarHBondContact O-N 2.86Å; R28-R46 VanDerWaalsContact CG-O 3.26Å; R28-R46 WeakPolarHBondContact CG-O 3.29Å; R28-Y90 HydrophobicContact CB-CE1 4.17Å; R28-Y90 VanDerWaalsContact CD-CE2 3.47Å
29	M	79.4	Confident	80.8	Confident	124 Å²	124	63.5 Å²	63.5	61%	0.611	34%	0.337	S	S	*	.	H	α-helix	trans	-65.5	-30.1	-179.6	-67.8	-57.5	-69.5	0	0	112.6	N25 Q26 L27 G31	N25-M29 WeakPolarHBondContact O-CG 3.4Å; N25-M29 PolarHBondContact O-N 2.84Å; Q26-M29 PolarHBondContact O-N 2.87Å; L27-M29 PolarHBondContact O-N 3.4Å; M29-G31 VanDerWaalsContact C-N 3.31Å
30	Q	79.7	Confident	81.8	Confident	105 Å²	105	59.8 Å²	59.8	49%	0.491	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-6.6	172.7	-66.6	175.8	0	0	0	113.2	Q26 L27 R28 R32	Q26-Q30 WeakPolarHBondContact O-CG 3.42Å; Q26-Q30 PolarHBondContact O-N 3.36Å; L27-Q30 CarbonylContact O-C 3.5Å; L27-Q30 PolarHBondContact O-N 3.35Å; R28-Q30 VanDerWaalsContact C-N 3.26Å; R28-Q30 PolarHBondContact O-N 3.09Å; Q30-R32 HydrophobicContact CB-CG 4.05Å; Q30-R32 PolarHBondContact O-N 3.39Å
31	G	79.9	Confident	82.2	Confident	29 Å²	29	62.2 Å²	62.2	30%	0.299	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	19.6	-176.3	0	0	0	0	0	114.4	L27 R28 M29	L27-G31 PolarHBondContact O-N 3.39Å; R28-G31 PolarHBondContact O-N 2.86Å; M29-G31 VanDerWaalsContact C-N 3.31Å
32	R	77.5	Confident	82.4	Confident	147 Å²	147	63.2 Å²	63.2	56%	0.555	34%	0.343	S	S	*	.			trans	-93.2	140.4	-177.9	-66.4	179.6	66	-157	-0.7	110.1	L27 Q30 C34	L27-R32 HydrophobicContact CD2-CB 4.03Å; L27-R32 PolarHBondContact O-N 3.27Å; Q30-R32 HydrophobicContact CB-CG 4.05Å; Q30-R32 PolarHBondContact O-N 3.39Å; R32-C34 PolarHBondContact O-N 3.38Å
33	L	80.5	Confident	83.1	Confident	132 Å²	132	63.4 Å²	63.4	69%	0.691	34%	0.335	S	S	*	.	S	Bend	trans	59.8	11.8	179.3	-54.7	176.1	0	0	0	115.2	L27 D35 H48	L27-L33 HydrophobicContact CD1-CD1 4.16Å; L33-D35 PolarHBondContact O-N 3.33Å; L33-H48 PolarHBondContact O-CD2 3.33Å
34	C	85.3	Confident	83.7	Confident	29 Å²	29	61.4 Å²	61.4	20%	0.196	34%	0.336	C	S	.	.			trans	-73.3	121.5	173.9	-59.4	0	0	0	0	110.7	R32 R46 A47	R32-C34 PolarHBondContact O-N 3.38Å; C34-R46 HydrophobicContact CB-CB 3.93Å; C34-A47 WeakPolarHBondContact CA-O 3.35Å; C34-A47 WeakPolarHBondContact CB-O 3.33Å
35	D	85.3	Confident	84.2	Confident	69 Å²	69	59.8 Å²	59.8	37%	0.369	33%	0.327	S	S	.	.			trans	-100.9	-1	-178.8	60.2	-8.7	0	0	0	112.9	L33 A47 H48 K49	L33-D35 PolarHBondContact O-N 3.33Å; D35-A47 PolarHBondContact N-O 3.41Å; D35-H48 WeakPolarHBondContact OD1-CA 3.36Å; D35-K49 WeakPolarHBondContact O-CE 3.28Å; D35-K49 WeakPolarHBondContact OD1-CG 3.19Å; D35-K49 PolarHBondContact OD1-N 2.95Å; D35-K49 WeakPolarHBondContact OD2-CB 3.45Å; D35-K49 WeakPolarHBondContact OD2-CG 3.5Å
36	I	86.3	Confident	84.6	Confident	2 Å²	2	65 Å²	65	1%	0.01	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	146.2	175.4	-172.5	151.5	0	0	0	113.6	V38 A47 K49 L52 M63 S69 V71	I36-V38 HydrophobicContact CG1-CG2 4.33Å; I36-A47 HydrophobicContact CG2-CB 4.11Å; I36-A47 VanDerWaalsContact CG2-O 3.25Å; I36-A47 WeakPolarHBondContact CG2-O 3.33Å; I36-A47 PolarHBondContact N-O 2.8Å; I36-A47 PolarHBondContact O-N 2.77Å; I36-K49 HydrophobicContact CB-CG 3.75Å; I36-K49 HydrophobicContact CD1-CG 4.14Å; I36-K49 HydrophobicContact CG2-CG 3.76Å; I36-L52 HydrophobicContact CG2-CD1 4.13Å; I36-M63 HydrophobicContact CD1-CE 3.34Å; I36-M63 HydrophobicContact CD1-CG 4.23Å; I36-M63 HydrophobicContact CD1-SD 3.77Å; I36-M63 HydrophobicContact CG1-CE 4.45Å; I36-S69 CarbonylContact C-O 3.34Å; I36-S69 WeakPolarHBondContact CA-O 3.48Å; I36-V71 HydrophobicContact CD1-CB 4.47Å; I36-V71 HydrophobicContact CD1-CG2 3.69Å; I36-V71 HydrophobicContact CG1-CG2 4.48Å
37	V	88.6	Confident	85	Confident	30 Å²	30	60 Å²	60	18%	0.182	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	120.6	169.3	-172.5	0	0	0	0	109.4	A44 F45 R46 S69 T70 V71	V37-A44 HydrophobicContact CG1-CB 3.8Å; V37-F45 CarbonylContact C-O 3.5Å; V37-F45 WeakPolarHBondContact CA-O 3.43Å; V37-R46 HydrophobicContact CG2-CG 4.32Å; V37-S69 PolarHBondContact N-O 3.36Å; V37-T70 HydrophobicContact CB-CG2 4.17Å; V37-T70 CarbonylContact O-C 3.54Å; V37-T70 VanDerWaalsContact O-CA 3.27Å; V37-T70 WeakPolarHBondContact O-CA 3.49Å; V37-V71 PolarHBondContact O-N 2.85Å
38	V	88.6	Confident	85.3	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	118.4	175.6	-172.9	0	0	0	0	109.3	I36 V40 F45 L52 V71 I73 F82	I36-V38 HydrophobicContact CG1-CG2 4.33Å; V38-V40 HydrophobicContact CG1-CG2 4.07Å; V38-F45 PolarHBondContact N-O 3.39Å; V38-F45 PolarHBondContact O-N 3.39Å; V38-L52 HydrophobicContact CG2-CD1 4.15Å; V38-V71 CarbonylContact C-O 3.5Å; V38-V71 VanDerWaalsContact CA-O 3.3Å; V38-V71 WeakPolarHBondContact CA-O 3.41Å; V38-I73 HydrophobicContact CG1-CD1 3.57Å; V38-I73 HydrophobicContact CG1-CG1 4Å; V38-F82 HydrophobicContact CB-CE1 4.05Å; V38-F82 HydrophobicContact CB-CZ 3.95Å; V38-F82 HydrophobicContact CG1-CE1 3.9Å; V38-F82 HydrophobicContact CG1-CE2 4.33Å; V38-F82 HydrophobicContact CG1-CZ 3.56Å; V38-F82 HydrophobicContact CG2-CZ 4.33Å
39	N	88.1	Confident	85.3	Confident	60 Å²	60	61 Å²	61	32%	0.321	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	118	178.3	-70	-21.5	0	0	0	110.1	Q43 A44 V71 S72 I73	N39-Q43 CarbonylContact C-O 3.52Å; N39-Q43 VanDerWaalsContact CA-O 3.32Å; N39-Q43 WeakPolarHBondContact CA-O 3.35Å; N39-A44 WeakPolarHBondContact OD1-CA 3.49Å; N39-A44 VanDerWaalsContact OD1-CB 3.3Å; N39-A44 WeakPolarHBondContact OD1-CB 3.35Å; N39-V71 PolarHBondContact N-O 3.34Å; N39-S72 CarbonylContact O-C 3.56Å; N39-S72 WeakPolarHBondContact O-CA 3.47Å; N39-I73 PolarHBondContact O-N 3.26Å
40	V	90.1	Very high	85.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	118.6	177.8	-176	0	0	0	0	108.8	V38 G42 Q43 F45 I73 I76 F82	V38-V40 HydrophobicContact CG1-CG2 4.07Å; V40-G42 PolarHBondContact O-N 3.01Å; V40-Q43 PolarHBondContact N-O 2.68Å; V40-Q43 WeakPolarHBondContact O-CB 3.48Å; V40-Q43 PolarHBondContact O-N 3.13Å; V40-F45 HydrophobicContact CB-CD2 4.43Å; V40-F45 HydrophobicContact CB-CE2 4.11Å; V40-F45 HydrophobicContact CG2-CD2 4.29Å; V40-F45 HydrophobicContact CG2-CE2 4.37Å; V40-I73 HydrophobicContact CG2-CB 4.34Å; V40-I76 HydrophobicContact CG1-CB 3.89Å; V40-I76 HydrophobicContact CG1-CG2 4Å; V40-F82 HydrophobicContact CG1-CB 4.4Å; V40-F82 HydrophobicContact CG2-CB 4.27Å; V40-F82 HydrophobicContact CG2-CD1 3.62Å; V40-F82 HydrophobicContact CG2-CD2 4.2Å; V40-F82 HydrophobicContact CG2-CE1 3.96Å; V40-F82 HydrophobicContact CG2-CE2 4.49Å; V40-F82 HydrophobicContact CG2-CG 3.74Å; V40-F82 HydrophobicContact CG2-CZ 4.39Å
41	Q	85.4	Confident	85.6	Confident	111 Å²	111	54.6 Å²	54.6	52%	0.519	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	32.5	-178	-59.3	-62	-36.4	0	0	114.5	S74 I76 K77	Q41-S74 PolarHBondContact NE2-O 3.1Å; Q41-I76 VanDerWaalsContact CG-O 3.3Å; Q41-I76 WeakPolarHBondContact CG-O 3.3Å; Q41-I76 PolarHBondContact NE2-O 3.28Å; Q41-K77 WeakPolarHBondContact CG-O 3.44Å
42	G	82.3	Confident	85.9	Confident	80 Å²	80	53.3 Å²	53.3	83%	0.825	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	-3.3	-178.2	0	0	0	0	0	115.3	V40	V40-G42 PolarHBondContact O-N 3.01Å
43	Q	88.4	Confident	86.3	Confident	85 Å²	85	47.5 Å²	47.5	40%	0.397	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	131.5	171.9	-171.8	170.4	-13.7	0	0	110.7	N39 V40 F45 P79	N39-Q43 CarbonylContact C-O 3.52Å; N39-Q43 VanDerWaalsContact CA-O 3.32Å; N39-Q43 WeakPolarHBondContact CA-O 3.35Å; V40-Q43 PolarHBondContact N-O 2.68Å; V40-Q43 WeakPolarHBondContact O-CB 3.48Å; V40-Q43 PolarHBondContact O-N 3.13Å; Q43-F45 HydrophobicContact CB-CE2 3.86Å; Q43-F45 HydrophobicContact CB-CZ 4.25Å; Q43-F45 HydrophobicContact CG-CD2 4.41Å; Q43-F45 HydrophobicContact CG-CE1 4.35Å; Q43-F45 HydrophobicContact CG-CE2 3.67Å; Q43-F45 HydrophobicContact CG-CZ 3.65Å; Q43-F45 VanDerWaalsContact NE2-CZ 3.32Å; Q43-P79 HydrophobicContact CB-CB 4.37Å
44	A	89.1	Confident	86.4	Confident	62 Å²	62	45 Å²	45	51%	0.512	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	123.3	-176.8	0	0	0	0	0	111.4	V37 N39	V37-A44 HydrophobicContact CG1-CB 3.8Å; N39-A44 WeakPolarHBondContact OD1-CA 3.49Å; N39-A44 VanDerWaalsContact OD1-CB 3.3Å; N39-A44 WeakPolarHBondContact OD1-CB 3.35Å
45	F	89.5	Confident	86.2	Confident	13 Å²	13	45.4 Å²	45.4	6%	0.057	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	118.6	179.4	-63.7	-86.4	0	0	0	110.2	V37 V38 V40 Q43 P79 F82 E83 L86	V37-F45 CarbonylContact C-O 3.5Å; V37-F45 WeakPolarHBondContact CA-O 3.43Å; V38-F45 PolarHBondContact N-O 3.39Å; V38-F45 PolarHBondContact O-N 3.39Å; V40-F45 HydrophobicContact CB-CD2 4.43Å; V40-F45 HydrophobicContact CB-CE2 4.11Å; V40-F45 HydrophobicContact CG2-CD2 4.29Å; V40-F45 HydrophobicContact CG2-CE2 4.37Å; Q43-F45 HydrophobicContact CB-CE2 3.86Å; Q43-F45 HydrophobicContact CB-CZ 4.25Å; Q43-F45 HydrophobicContact CG-CD2 4.41Å; Q43-F45 HydrophobicContact CG-CE1 4.35Å; Q43-F45 HydrophobicContact CG-CE2 3.67Å; Q43-F45 HydrophobicContact CG-CZ 3.65Å; Q43-F45 VanDerWaalsContact NE2-CZ 3.32Å; F45-P79 HydrophobicContact CE2-CB 4.24Å; F45-P79 HydrophobicContact CZ-CB 4.09Å; F45-F82 HydrophobicContact CB-CD1 4.44Å; F45-F82 HydrophobicContact CB-CE1 3.93Å; F45-F82 HydrophobicContact CD1-CD1 4.43Å; F45-F82 AromaticContact CD2-CD1 3.62Å; F45-F82 HydrophobicContact CD2-CD1 3.62Å; F45-F82 AromaticContact CD2-CE1 3.86Å; F45-F82 HydrophobicContact CD2-CE1 3.86Å; F45-F82 AromaticContact CE2-CD1 3.89Å; F45-F82 HydrophobicContact CE2-CD1 3.89Å; F45-F82 AromaticContact CG-CD1 3.91Å; F45-F82 HydrophobicContact CG-CD1 3.91Å; F45-F82 AromaticContact CG-CE1 3.91Å; F45-F82 HydrophobicContact CG-CE1 3.91Å; F45-F82 HydrophobicContact CZ-CD1 4.39Å; F45-E83 HydrophobicContact CE1-CB 3.78Å; F45-E83 HydrophobicContact CE1-CG 4.05Å; F45-E83 HydrophobicContact CZ-CB 4.32Å; F45-L86 HydrophobicContact CB-CD2 4Å; F45-L86 HydrophobicContact CD1-CD2 4.32Å; F45-L86 HydrophobicContact CG-CD2 4.5Å
46	R	87.7	Confident	86.2	Confident	143 Å²	143	42.1 Å²	42.1	54%	0.54	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	138.5	176	-63.7	-179.9	179.8	-98.2	-0.9	109.9	R28 C34 V37	R28-R46 VanDerWaalsContact CG-O 3.26Å; R28-R46 WeakPolarHBondContact CG-O 3.29Å; C34-R46 HydrophobicContact CB-CB 3.93Å; V37-R46 HydrophobicContact CG2-CG 4.32Å
47	A	88.6	Confident	86.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	175.2	179.4	0	0	0	0	0	111.5	C34 D35 I36 L52 L86	C34-A47 WeakPolarHBondContact CA-O 3.35Å; C34-A47 WeakPolarHBondContact CB-O 3.33Å; D35-A47 PolarHBondContact N-O 3.41Å; I36-A47 HydrophobicContact CG2-CB 4.11Å; I36-A47 VanDerWaalsContact CG2-O 3.25Å; I36-A47 WeakPolarHBondContact CG2-O 3.33Å; I36-A47 PolarHBondContact N-O 2.8Å; I36-A47 PolarHBondContact O-N 2.77Å; A47-L52 HydrophobicContact CB-CD1 3.78Å; A47-L52 HydrophobicContact CB-CG 4.18Å; A47-L86 HydrophobicContact CB-CD1 4Å
48	H	85.8	Confident	86	Confident	16 Å²	16	44.1 Å²	44.1	7%	0.074	26%	0.263	C	S	.	.			trans	-100.7	126.4	172.1	-52.5	88	0	0	0	109.5	L33 D35 V50 V51 L52 Y90	L33-H48 PolarHBondContact O-CD2 3.33Å; D35-H48 WeakPolarHBondContact OD1-CA 3.36Å; H48-V50 PolarHBondContact O-N 2.99Å; H48-V51 HydrophobicContact CB-CB 4.41Å; H48-V51 HydrophobicContact CB-CG2 4.04Å; H48-V51 PolarHBondContact O-N 3.17Å; H48-L52 PolarHBondContact O-N 3.13Å; H48-Y90 PolarHBondContact N-OH 3.21Å; H48-Y90 AromaticContact ND1-CE1 3.55Å; H48-Y90 AromaticContact ND1-CZ 3.69Å; H48-Y90 PolarHBondContact ND1-OH 3.16Å
49	K	85.5	Confident	85.8	Confident	42 Å²	42	44.3 Å²	44.3	18%	0.183	26%	0.264	C	S	.	.	H	α-helix	trans	-55.8	-39.5	178.8	-70.2	179.9	177.4	-171.1	0	111.2	D35 I36 V51 L52 A53 M63 M68	D35-K49 WeakPolarHBondContact O-CE 3.28Å; D35-K49 WeakPolarHBondContact OD1-CG 3.19Å; D35-K49 PolarHBondContact OD1-N 2.95Å; D35-K49 WeakPolarHBondContact OD2-CB 3.45Å; D35-K49 WeakPolarHBondContact OD2-CG 3.5Å; I36-K49 HydrophobicContact CB-CG 3.75Å; I36-K49 HydrophobicContact CD1-CG 4.14Å; I36-K49 HydrophobicContact CG2-CG 3.76Å; K49-V51 PolarHBondContact O-N 3.36Å; K49-L52 PolarHBondContact O-N 2.84Å; K49-A53 VanDerWaalsContact O-CB 3.26Å; K49-A53 WeakPolarHBondContact O-CB 3.44Å; K49-A53 PolarHBondContact O-N 3.3Å; K49-M63 HydrophobicContact CB-SD 4.02Å; K49-M63 HydrophobicContact CG-SD 3.88Å; K49-M68 WeakPolarHBondContact CE-O 3.39Å; K49-M68 PolarHBondContact NZ-O 3.5Å
50	V	81.7	Confident	85.6	Confident	85 Å²	85	47 Å²	47	52%	0.515	27%	0.269	S	S	.	.	H	α-helix	trans	-59	-46.2	-179.8	-178.8	0	0	0	0	111.5	H48 A54 W222	H48-V50 PolarHBondContact O-N 2.99Å; V50-A54 WeakPolarHBondContact O-CB 3.47Å; V50-A54 PolarHBondContact O-N 3.47Å; V50-A54 VanDerWaalsContact O-N 3.11Å; V50-W222 HydrophobicContact CG2-CH2 4.43Å
51	V	84.2	Confident	85.1	Confident	11 Å²	11	51.3 Å²	51.3	7%	0.067	29%	0.293	C	S	.	.	H	α-helix	trans	-68	-44.2	-179.6	179.3	0	0	0	0	110.3	L24 H48 K49 A53 A54 S55 C89 Y90	L24-V51 HydrophobicContact CD1-CG2 4.07Å; H48-V51 HydrophobicContact CB-CB 4.41Å; H48-V51 HydrophobicContact CB-CG2 4.04Å; H48-V51 PolarHBondContact O-N 3.17Å; K49-V51 PolarHBondContact O-N 3.36Å; V51-A53 PolarHBondContact O-N 3.37Å; V51-A54 PolarHBondContact O-N 3.06Å; V51-S55 PolarHBondContact O-N 3.05Å; V51-S55 VanDerWaalsContact O-N 3.13Å; V51-S55 PolarHBondContact O-OG 3.08Å; V51-C89 HydrophobicContact CG1-CB 4.02Å; V51-C89 WeakPolarHBondContact CG1-O 3.39Å; V51-Y90 HydrophobicContact CB-CE1 4.16Å; V51-Y90 HydrophobicContact CB-CE2 4.3Å; V51-Y90 HydrophobicContact CG1-CD1 4.17Å; V51-Y90 HydrophobicContact CG1-CD2 3.98Å; V51-Y90 HydrophobicContact CG1-CE1 3.96Å; V51-Y90 HydrophobicContact CG1-CE2 3.71Å; V51-Y90 HydrophobicContact CG1-CG 4.18Å; V51-Y90 HydrophobicContact CG2-CD1 4.47Å; V51-Y90 HydrophobicContact CG2-CE1 3.85Å
52	L	86.5	Confident	84.4	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-64.3	-41.4	178.5	-70.7	-177.8	0	0	0	113	I36 V38 A47 H48 K49 A54 S55 S56 F59 M63 L86	I36-L52 HydrophobicContact CG2-CD1 4.13Å; V38-L52 HydrophobicContact CG2-CD1 4.15Å; A47-L52 HydrophobicContact CB-CD1 3.78Å; A47-L52 HydrophobicContact CB-CG 4.18Å; H48-L52 PolarHBondContact O-N 3.13Å; K49-L52 PolarHBondContact O-N 2.84Å; L52-A54 VanDerWaalsContact C-N 3.31Å; L52-A54 PolarHBondContact O-N 3.27Å; L52-S55 PolarHBondContact O-N 3.25Å; L52-S56 WeakPolarHBondContact O-CB 3.33Å; L52-S56 PolarHBondContact O-N 2.83Å; L52-F59 HydrophobicContact CB-CB 4.07Å; L52-F59 HydrophobicContact CB-CD2 3.76Å; L52-F59 HydrophobicContact CB-CE2 4.42Å; L52-F59 HydrophobicContact CB-CG 4.05Å; L52-F59 HydrophobicContact CD1-CD2 4.31Å; L52-F59 HydrophobicContact CD1-CE2 4.26Å; L52-F59 HydrophobicContact CD1-CZ 4.46Å; L52-F59 HydrophobicContact CD2-CD2 4.02Å; L52-F59 HydrophobicContact CD2-CE2 3.92Å; L52-F59 HydrophobicContact CG-CD2 4.26Å; L52-F59 HydrophobicContact CG-CE2 4.44Å; L52-M63 HydrophobicContact CB-CE 4Å; L52-M63 HydrophobicContact CB-SD 4.43Å; L52-M63 HydrophobicContact CD1-CE 3.57Å; L52-M63 HydrophobicContact CG-CE 4.46Å; L52-L86 HydrophobicContact CD2-CD1 3.64Å
53	A	85.6	Confident	83.9	Confident	25 Å²	25	48.1 Å²	48.1	21%	0.207	26%	0.256	C	S	.	.	H	α-helix	trans	-68.5	-30	178.2	0	0	0	0	0	112.8	K49 V51 R60	K49-A53 VanDerWaalsContact O-CB 3.26Å; K49-A53 WeakPolarHBondContact O-CB 3.44Å; K49-A53 PolarHBondContact O-N 3.3Å; V51-A53 PolarHBondContact O-N 3.37Å; A53-R60 HydrophobicContact CB-CB 4.06Å; A53-R60 HydrophobicContact CB-CG 4.46Å
54	A	82	Confident	82.6	Confident	80 Å²	80	48.5 Å²	48.5	66%	0.661	27%	0.268	S	S	*	.	H	α-helix	trans	-70.3	-42.6	174.2	0	0	0	0	0	111.6	V50 V51 L52	V50-A54 WeakPolarHBondContact O-CB 3.47Å; V50-A54 PolarHBondContact O-N 3.47Å; V50-A54 VanDerWaalsContact O-N 3.11Å; V51-A54 PolarHBondContact O-N 3.06Å; L52-A54 VanDerWaalsContact C-N 3.31Å; L52-A54 PolarHBondContact O-N 3.27Å
55	S	81.1	Confident	80.8	Confident	37 Å²	37	52.5 Å²	52.5	26%	0.259	28%	0.28	S	S	.	.	H	α-helix	trans	-86.2	-20.1	-175.3	-53.1	0	0	0	0	114.5	V51 L52 C89	V51-S55 PolarHBondContact O-N 3.05Å; V51-S55 VanDerWaalsContact O-N 3.13Å; V51-S55 PolarHBondContact O-OG 3.08Å; L52-S55 PolarHBondContact O-N 3.25Å; S55-C89 VanDerWaalsContact CB-SG 3.53Å
56	S	85.6	Confident	79.1	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.293	C	S	.	.			trans	-136	117.9	-174.6	169.1	0	0	0	0	111.7	L52 Y58 F59 R60 L111	L52-S56 WeakPolarHBondContact O-CB 3.33Å; L52-S56 PolarHBondContact O-N 2.83Å; S56-Y58 VanDerWaalsContact C-N 3.26Å; S56-Y58 PolarHBondContact O-N 3.48Å; S56-Y58 PolarHBondContact OG-N 3.47Å; S56-F59 PolarHBondContact O-N 3.16Å; S56-F59 PolarHBondContact OG-N 2.84Å; S56-R60 PolarHBondContact O-N 3.16Å; S56-L111 WeakPolarHBondContact CB-O 3.39Å; S56-L111 PolarHBondContact OG-O 2.82Å
57	P	84.7	Confident	77.8	Confident	33 Å²	33	57.4 Å²	57.4	21%	0.214	31%	0.311	C	S	.	.	H	α-helix	trans	-55.5	-39.5	170	-26.8	36.1	0	0	0	113.3	F59 R60 D61 Q112	P57-F59 VanDerWaalsContact C-N 3.34Å; P57-F59 PolarHBondContact O-N 2.87Å; P57-R60 VanDerWaalsContact CB-NH2 3.34Å; P57-R60 WeakPolarHBondContact O-CB 3.05Å; P57-R60 PolarHBondContact O-N 2.95Å; P57-D61 PolarHBondContact O-N 3.48Å; P57-Q112 HydrophobicContact CB-CB 4.04Å; P57-Q112 VanDerWaalsContact CD-O 3.22Å; P57-Q112 WeakPolarHBondContact CD-O 3.41Å; P57-Q112 HydrophobicContact CG-CB 4.1Å
58	Y	85.7	Confident	76.5	Confident	41 Å²	41	62.7 Å²	62.7	16%	0.161	34%	0.338	C	S	.	.	H	α-helix	trans	-55.8	-48.9	176.2	173.9	-93.8	0	0	0	111.4	S56 H62 F110 L111	S56-Y58 VanDerWaalsContact C-N 3.26Å; S56-Y58 PolarHBondContact O-N 3.48Å; S56-Y58 PolarHBondContact OG-N 3.47Å; Y58-H62 WeakPolarHBondContact O-CB 3.33Å; Y58-H62 PolarHBondContact O-N 2.73Å; Y58-F110 HydrophobicContact CD1-CE1 4.37Å; Y58-F110 AromaticContact CE1-CE1 3.79Å; Y58-F110 HydrophobicContact CE1-CE1 3.79Å; Y58-F110 HydrophobicContact CE1-CZ 4.24Å; Y58-F110 AromaticContact CE2-CE1 3.95Å; Y58-F110 HydrophobicContact CE2-CE1 3.95Å; Y58-F110 HydrophobicContact CE2-CE2 4.28Å; Y58-F110 AromaticContact CE2-CZ 3.7Å; Y58-F110 HydrophobicContact CE2-CZ 3.7Å; Y58-F110 AromaticContact CZ-CE1 3.56Å; Y58-F110 AromaticContact CZ-CZ 3.52Å; Y58-F110 WeakPolarHBondContact OH-CZ 3.36Å; Y58-L111 HydrophobicContact CD1-CD2 3.9Å; Y58-L111 HydrophobicContact CE1-CD2 4.42Å
59	F	83.9	Confident	75.8	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.018	36%	0.358	C	S	.	.	H	α-helix	trans	-68.8	-37.4	179.1	-72.9	-48.5	0	0	0	112.8	L52 S56 P57 D61 H62 M63 I73 F82 L111	L52-F59 HydrophobicContact CB-CB 4.07Å; L52-F59 HydrophobicContact CB-CD2 3.76Å; L52-F59 HydrophobicContact CB-CE2 4.42Å; L52-F59 HydrophobicContact CB-CG 4.05Å; L52-F59 HydrophobicContact CD1-CD2 4.31Å; L52-F59 HydrophobicContact CD1-CE2 4.26Å; L52-F59 HydrophobicContact CD1-CZ 4.46Å; L52-F59 HydrophobicContact CD2-CD2 4.02Å; L52-F59 HydrophobicContact CD2-CE2 3.92Å; L52-F59 HydrophobicContact CG-CD2 4.26Å; L52-F59 HydrophobicContact CG-CE2 4.44Å; S56-F59 PolarHBondContact O-N 3.16Å; S56-F59 PolarHBondContact OG-N 2.84Å; P57-F59 VanDerWaalsContact C-N 3.34Å; P57-F59 PolarHBondContact O-N 2.87Å; F59-D61 PolarHBondContact O-N 2.8Å; F59-H62 PolarHBondContact O-N 2.83Å; F59-M63 HydrophobicContact CB-CE 3.7Å; F59-M63 HydrophobicContact CB-CG 4.42Å; F59-M63 HydrophobicContact CB-SD 4.02Å; F59-M63 HydrophobicContact CD1-CE 3.1Å; F59-M63 HydrophobicContact CD1-SD 4.37Å; F59-M63 HydrophobicContact CD2-CE 4.33Å; F59-M63 HydrophobicContact CE1-CE 3.69Å; F59-M63 HydrophobicContact CG-CE 3.48Å; F59-M63 VanDerWaalsContact CG-CE 3.48Å; F59-M63 HydrophobicContact CG-SD 4.46Å; F59-M63 WeakPolarHBondContact O-CB 3.44Å; F59-M63 WeakPolarHBondContact O-CG 3.42Å; F59-M63 PolarHBondContact O-N 3.46Å; F59-I73 HydrophobicContact CE1-CD1 3.95Å; F59-I73 HydrophobicContact CZ-CD1 3.81Å; F59-F82 HydrophobicContact CZ-CE2 4.24Å; F59-F82 HydrophobicContact CZ-CZ 4.39Å; F59-L111 HydrophobicContact CD2-CD2 4.33Å; F59-L111 HydrophobicContact CE1-CD2 4.27Å; F59-L111 HydrophobicContact CE2-CD1 4.39Å; F59-L111 HydrophobicContact CE2-CD2 3.6Å; F59-L111 HydrophobicContact CZ-CD2 3.57Å
60	R	83.6	Confident	75.5	Confident	116 Å²	116	67.1 Å²	67.1	44%	0.438	37%	0.372	S	S	.	.	H	α-helix	trans	-57.7	-47.3	176.2	-176.1	174.7	57.2	-122.1	5	112.3	A53 S56 P57 S64	A53-R60 HydrophobicContact CB-CB 4.06Å; A53-R60 HydrophobicContact CB-CG 4.46Å; S56-R60 PolarHBondContact O-N 3.16Å; P57-R60 VanDerWaalsContact CB-NH2 3.34Å; P57-R60 WeakPolarHBondContact O-CB 3.05Å; P57-R60 PolarHBondContact O-N 2.95Å; R60-S64 VanDerWaalsContact O-CB 3.26Å; R60-S64 WeakPolarHBondContact O-CB 3.43Å; R60-S64 PolarHBondContact O-N 3.19Å; R60-S64 PolarHBondContact O-OG 3.2Å
61	D	79.3	Confident	75.6	Confident	92 Å²	92	64.6 Å²	64.6	49%	0.492	36%	0.357	S	S	.	.	H	α-helix	trans	-77.1	-32.9	-175.6	-62.3	-11.5	0	0	0	111.5	P57 F59 S64	P57-D61 PolarHBondContact O-N 3.48Å; F59-D61 PolarHBondContact O-N 2.8Å; D61-S64 PolarHBondContact O-OG 3.42Å
62	H	71.1	Confident	75.5	Confident	102 Å²	102	68.8 Å²	68.8	47%	0.472	39%	0.387	S	S	.	.	H	α-helix	trans	-90.1	-18.8	-175.6	-138	-68.6	0	0	0	114.1	Y58 F59	Y58-H62 WeakPolarHBondContact O-CB 3.33Å; Y58-H62 PolarHBondContact O-N 2.73Å; F59-H62 PolarHBondContact O-N 2.83Å
63	M	72.6	Confident	75.4	Confident	22 Å²	22	68.9 Å²	68.9	11%	0.108	39%	0.387	C	S	.	.	H	α-helix	trans	-98	-23.3	177.2	-62	-178.1	-176.9	0	0	113.5	I36 K49 L52 F59 L65 N66	I36-M63 HydrophobicContact CD1-CE 3.34Å; I36-M63 HydrophobicContact CD1-CG 4.23Å; I36-M63 HydrophobicContact CD1-SD 3.77Å; I36-M63 HydrophobicContact CG1-CE 4.45Å; K49-M63 HydrophobicContact CB-SD 4.02Å; K49-M63 HydrophobicContact CG-SD 3.88Å; L52-M63 HydrophobicContact CB-CE 4Å; L52-M63 HydrophobicContact CB-SD 4.43Å; L52-M63 HydrophobicContact CD1-CE 3.57Å; L52-M63 HydrophobicContact CG-CE 4.46Å; F59-M63 HydrophobicContact CB-CE 3.7Å; F59-M63 HydrophobicContact CB-CG 4.42Å; F59-M63 HydrophobicContact CB-SD 4.02Å; F59-M63 HydrophobicContact CD1-CE 3.1Å; F59-M63 HydrophobicContact CD1-SD 4.37Å; F59-M63 HydrophobicContact CD2-CE 4.33Å; F59-M63 HydrophobicContact CE1-CE 3.69Å; F59-M63 HydrophobicContact CG-CE 3.48Å; F59-M63 VanDerWaalsContact CG-CE 3.48Å; F59-M63 HydrophobicContact CG-SD 4.46Å; F59-M63 WeakPolarHBondContact O-CB 3.44Å; F59-M63 WeakPolarHBondContact O-CG 3.42Å; F59-M63 PolarHBondContact O-N 3.46Å; M63-L65 PolarHBondContact O-N 3.39Å; M63-N66 PolarHBondContact O-N 3.18Å
64	S	60.8	Low	75.2	Confident	92 Å²	92	72.3 Å²	72.3	64%	0.643	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-21.4	176.7	49.6	0	0	0	0	113.3	R60 D61	R60-S64 VanDerWaalsContact O-CB 3.26Å; R60-S64 WeakPolarHBondContact O-CB 3.43Å; R60-S64 PolarHBondContact O-N 3.19Å; R60-S64 PolarHBondContact O-OG 3.2Å; D61-S64 PolarHBondContact O-OG 3.42Å
65	L	51.2	Low	75.1	Confident	147 Å²	147	71.6 Å²	71.6	77%	0.77	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-10.3	-179.1	-65.8	170.9	0	0	0	114.1	M63	M63-L65 PolarHBondContact O-N 3.39Å
66	N	53.2	Low	75.3	Confident	60 Å²	60	70.1 Å²	70.1	32%	0.321	39%	0.386	S	S	.	.			trans	-125.7	124.1	-167.6	-83.7	-11.8	0	0	0	113.3	M63 M68	M63-N66 PolarHBondContact O-N 3.18Å; N66-M68 HydrophobicContact CB-CB 4.2Å; N66-M68 HydrophobicContact CB-CG 4.11Å; N66-M68 PolarHBondContact O-N 3.2Å; N66-M68 VanDerWaalsContact O-N 3.14Å
67	E	60.8	Low	74.9	Confident	198 Å²	198	78.7 Å²	78.7	93%	0.925	42%	0.423	S	S	*	.			trans	-65.9	-4.5	164.4	-69.9	-176.3	166.6	0	0	113	S69	E67-S69 PolarHBondContact O-N 2.65Å
68	M	60.8	Low	74.7	Confident	112 Å²	112	79 Å²	79	55%	0.552	42%	0.423	S	S	*	.			trans	-60.9	126.3	-176.9	-60.8	-176.4	-177.7	0	0	111	K49 N66 T70	K49-M68 WeakPolarHBondContact CE-O 3.39Å; K49-M68 PolarHBondContact NZ-O 3.5Å; N66-M68 HydrophobicContact CB-CB 4.2Å; N66-M68 HydrophobicContact CB-CG 4.11Å; N66-M68 PolarHBondContact O-N 3.2Å; N66-M68 VanDerWaalsContact O-N 3.14Å; M68-T70 VanDerWaalsContact C-N 3.32Å
69	S	71.9	Confident	74.7	Confident	73 Å²	73	78.5 Å²	78.5	51%	0.51	43%	0.425	S	S	.	.	S	Bend	trans	-86.5	-4.3	172.5	54.3	0	0	0	0	112.5	I36 V37 E67	I36-S69 CarbonylContact C-O 3.34Å; I36-S69 WeakPolarHBondContact CA-O 3.48Å; V37-S69 PolarHBondContact N-O 3.36Å; E67-S69 PolarHBondContact O-N 2.65Å
70	T	79.3	Confident	74.8	Confident	77 Å²	77	81.7 Å²	81.7	47%	0.472	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	138.2	-179.3	64.3	0	0	0	0	111.4	V37 M68	V37-T70 HydrophobicContact CB-CG2 4.17Å; V37-T70 CarbonylContact O-C 3.54Å; V37-T70 VanDerWaalsContact O-CA 3.27Å; V37-T70 WeakPolarHBondContact O-CA 3.49Å; M68-T70 VanDerWaalsContact C-N 3.32Å
71	V	83.6	Confident	74.9	Confident	32 Å²	32	76.1 Å²	76.1	19%	0.194	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	129.6	179.6	175.2	0	0	0	0	109	I36 V37 V38 N39 I73	I36-V71 HydrophobicContact CD1-CB 4.47Å; I36-V71 HydrophobicContact CD1-CG2 3.69Å; I36-V71 HydrophobicContact CG1-CG2 4.48Å; V37-V71 PolarHBondContact O-N 2.85Å; V38-V71 CarbonylContact C-O 3.5Å; V38-V71 VanDerWaalsContact CA-O 3.3Å; V38-V71 WeakPolarHBondContact CA-O 3.41Å; N39-V71 PolarHBondContact N-O 3.34Å; V71-I73 HydrophobicContact CG1-CG1 4.28Å
72	S	82.6	Confident	75.4	Confident	99 Å²	99	71.9 Å²	71.9	69%	0.692	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.1	175.6	59.2	0	0	0	0	111.7	N39	N39-S72 CarbonylContact O-C 3.56Å; N39-S72 WeakPolarHBondContact O-CA 3.47Å
73	I	83.3	Confident	76.2	Confident	5 Å²	5	70.6 Å²	70.6	3%	0.026	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	111.3	177.4	-54.8	175.8	0	0	0	108.7	V38 N39 V40 F59 V71 I76 F82 F110 L111	V38-I73 HydrophobicContact CG1-CD1 3.57Å; V38-I73 HydrophobicContact CG1-CG1 4Å; N39-I73 PolarHBondContact O-N 3.26Å; V40-I73 HydrophobicContact CG2-CB 4.34Å; F59-I73 HydrophobicContact CE1-CD1 3.95Å; F59-I73 HydrophobicContact CZ-CD1 3.81Å; V71-I73 HydrophobicContact CG1-CG1 4.28Å; I73-I76 HydrophobicContact CG2-CB 4.4Å; I73-I76 HydrophobicContact CG2-CD1 3.99Å; I73-I76 HydrophobicContact CG2-CG1 3.91Å; I73-F82 HydrophobicContact CD1-CE2 4.26Å; I73-F110 HydrophobicContact CG2-CD1 4.15Å; I73-F110 HydrophobicContact CG2-CE1 3.65Å; I73-F110 HydrophobicContact CG2-CZ 4.33Å; I73-L111 HydrophobicContact CD1-CD2 4.29Å
74	S	82	Confident	76.7	Confident	97 Å²	97	72.8 Å²	72.8	68%	0.678	41%	0.405	S	S	*	.			trans	-93.8	-17.5	-179.8	56.6	0	0	0	0	113.9	Q41	Q41-S74 PolarHBondContact NE2-O 3.1Å
75	V	80.4	Confident	77.9	Confident	64 Å²	64	68.4 Å²	68.4	39%	0.388	38%	0.375	S	S	.	.	S	Bend	trans	-68.9	-37.1	-177.1	179.2	0	0	0	0	111.5	K77 F110	V75-K77 PolarHBondContact O-N 3.12Å; V75-F110 HydrophobicContact CB-CD2 4.07Å; V75-F110 HydrophobicContact CB-CE2 4.21Å; V75-F110 HydrophobicContact CB-CG 4.31Å; V75-F110 HydrophobicContact CG1-CB 4.39Å; V75-F110 HydrophobicContact CG1-CD2 3.99Å; V75-F110 HydrophobicContact CG1-CG 4.2Å; V75-F110 HydrophobicContact CG2-CD2 3.92Å; V75-F110 HydrophobicContact CG2-CE2 3.67Å; V75-F110 HydrophobicContact CG2-CZ 4.17Å
76	I	84.1	Confident	79.6	Confident	7 Å²	7	61.6 Å²	61.6	4%	0.036	34%	0.339	C	S	.	.			trans	-79.2	116.9	177.8	-54.7	175	0	0	0	108.1	V40 Q41 I73 N78 F82 A107 L111	V40-I76 HydrophobicContact CG1-CB 3.89Å; V40-I76 HydrophobicContact CG1-CG2 4Å; Q41-I76 VanDerWaalsContact CG-O 3.3Å; Q41-I76 WeakPolarHBondContact CG-O 3.3Å; Q41-I76 PolarHBondContact NE2-O 3.28Å; I73-I76 HydrophobicContact CG2-CB 4.4Å; I73-I76 HydrophobicContact CG2-CD1 3.99Å; I73-I76 HydrophobicContact CG2-CG1 3.91Å; I76-N78 WeakPolarHBondContact CG2-O 3.46Å; I76-F82 HydrophobicContact CD1-CB 4.45Å; I76-F82 HydrophobicContact CD1-CD2 3.59Å; I76-F82 HydrophobicContact CD1-CE2 4.31Å; I76-F82 HydrophobicContact CD1-CG 4.39Å; I76-F82 HydrophobicContact CG2-CB 4.21Å; I76-A107 HydrophobicContact CD1-CB 3.92Å; I76-A107 HydrophobicContact CG1-CB 3.92Å; I76-A107 HydrophobicContact CG2-CB 4.33Å; I76-L111 HydrophobicContact CD1-CD1 4.29Å
77	K	78.8	Confident	81	Confident	180 Å²	180	60.2 Å²	60.2	78%	0.783	33%	0.334	S	S	*	.			trans	-91.2	-24.9	-177.3	-64.9	-175.8	-177.7	177.4	0	113.6	Q41 V75	Q41-K77 WeakPolarHBondContact CG-O 3.44Å; V75-K77 PolarHBondContact O-N 3.12Å
78	N	80.1	Confident	82.1	Confident	40 Å²	40	52.1 Å²	52.1	21%	0.214	30%	0.296	C	S	.	.			trans	-107.6	111.2	179.5	-168.6	-10	0	0	0	109.3	I76 T80 V81 F82 D100	I76-N78 WeakPolarHBondContact CG2-O 3.46Å; N78-T80 VanDerWaalsContact C-N 3.29Å; N78-T80 VanDerWaalsContact CG-OG1 3.3Å; N78-T80 PolarHBondContact ND2-OG1 3.28Å; N78-T80 PolarHBondContact O-N 3.39Å; N78-T80 PolarHBondContact OD1-N 3.11Å; N78-T80 VanDerWaalsContact OD1-N 3.16Å; N78-T80 PolarHBondContact OD1-OG1 3.41Å; N78-V81 HydrophobicContact CB-CB 4.2Å; N78-V81 HydrophobicContact CB-CG2 3.87Å; N78-V81 PolarHBondContact O-N 2.77Å; N78-F82 PolarHBondContact O-N 3.12Å; N78-D100 PolarHBondContact ND2-OD1 3.22Å
79	P	85.9	Confident	83.2	Confident	29 Å²	29	47.3 Å²	47.3	19%	0.188	27%	0.273	C	S	.	.	H	α-helix	trans	-68.8	-26.4	-179.9	28.3	-34.3	0	0	0	112.7	Q43 F45 V81 F82 E83	Q43-P79 HydrophobicContact CB-CB 4.37Å; F45-P79 HydrophobicContact CE2-CB 4.24Å; F45-P79 HydrophobicContact CZ-CB 4.09Å; P79-V81 VanDerWaalsContact C-N 3.33Å; P79-V81 PolarHBondContact O-N 3.45Å; P79-F82 PolarHBondContact O-N 3.07Å; P79-E83 PolarHBondContact O-N 3.4Å
80	T	85.6	Confident	83.6	Confident	71 Å²	71	43.9 Å²	43.9	44%	0.436	25%	0.249	S	C	.	.	H	α-helix	trans	-66.2	-38.8	177.6	64.7	0	0	0	0	111.1	N78 F82 E83 E84	N78-T80 VanDerWaalsContact C-N 3.29Å; N78-T80 VanDerWaalsContact CG-OG1 3.3Å; N78-T80 PolarHBondContact ND2-OG1 3.28Å; N78-T80 PolarHBondContact O-N 3.39Å; N78-T80 PolarHBondContact OD1-N 3.11Å; N78-T80 VanDerWaalsContact OD1-N 3.16Å; N78-T80 PolarHBondContact OD1-OG1 3.41Å; T80-F82 VanDerWaalsContact C-N 3.29Å; T80-F82 PolarHBondContact O-N 3.15Å; T80-E83 WeakPolarHBondContact O-CB 3.37Å; T80-E83 PolarHBondContact O-N 3.23Å; T80-E83 VanDerWaalsContact O-N 3.16Å; T80-E84 WeakPolarHBondContact O-CG 2.98Å; T80-E84 PolarHBondContact O-N 3.48Å
81	V	85.8	Confident	83.3	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61.7	-39.8	174.5	171.2	0	0	0	0	110.9	N78 P79 L85 D100 Y104 A107	N78-V81 HydrophobicContact CB-CB 4.2Å; N78-V81 HydrophobicContact CB-CG2 3.87Å; N78-V81 PolarHBondContact O-N 2.77Å; P79-V81 VanDerWaalsContact C-N 3.33Å; P79-V81 PolarHBondContact O-N 3.45Å; V81-L85 HydrophobicContact CG1-CD1 4.18Å; V81-L85 VanDerWaalsContact O-CG 3.24Å; V81-L85 WeakPolarHBondContact O-CG 3.22Å; V81-L85 PolarHBondContact O-N 2.76Å; V81-D100 HydrophobicContact CG2-CB 4.06Å; V81-Y104 HydrophobicContact CB-CE1 4.43Å; V81-Y104 HydrophobicContact CG1-CD1 3.69Å; V81-Y104 HydrophobicContact CG1-CE1 3.85Å; V81-Y104 HydrophobicContact CG1-CG 4.02Å; V81-Y104 HydrophobicContact CG2-CE2 4.23Å; V81-A107 HydrophobicContact CG1-CB 4.13Å
82	F	89.8	Confident	82.5	Confident	3 Å²	3	41.5 Å²	41.5	1%	0.013	24%	0.237	C	C	.	.	H	α-helix	trans	-67.5	-38.7	175	-176.9	-104	0	0	0	112.2	V38 V40 F45 F59 I73 I76 N78 P79 T80 E84 L85 L86 L111	V38-F82 HydrophobicContact CB-CE1 4.05Å; V38-F82 HydrophobicContact CB-CZ 3.95Å; V38-F82 HydrophobicContact CG1-CE1 3.9Å; V38-F82 HydrophobicContact CG1-CE2 4.33Å; V38-F82 HydrophobicContact CG1-CZ 3.56Å; V38-F82 HydrophobicContact CG2-CZ 4.33Å; V40-F82 HydrophobicContact CG1-CB 4.4Å; V40-F82 HydrophobicContact CG2-CB 4.27Å; V40-F82 HydrophobicContact CG2-CD1 3.62Å; V40-F82 HydrophobicContact CG2-CD2 4.2Å; V40-F82 HydrophobicContact CG2-CE1 3.96Å; V40-F82 HydrophobicContact CG2-CE2 4.49Å; V40-F82 HydrophobicContact CG2-CG 3.74Å; V40-F82 HydrophobicContact CG2-CZ 4.39Å; F45-F82 HydrophobicContact CB-CD1 4.44Å; F45-F82 HydrophobicContact CB-CE1 3.93Å; F45-F82 HydrophobicContact CD1-CD1 4.43Å; F45-F82 AromaticContact CD2-CD1 3.62Å; F45-F82 HydrophobicContact CD2-CD1 3.62Å; F45-F82 AromaticContact CD2-CE1 3.86Å; F45-F82 HydrophobicContact CD2-CE1 3.86Å; F45-F82 AromaticContact CE2-CD1 3.89Å; F45-F82 HydrophobicContact CE2-CD1 3.89Å; F45-F82 AromaticContact CG-CD1 3.91Å; F45-F82 HydrophobicContact CG-CD1 3.91Å; F45-F82 AromaticContact CG-CE1 3.91Å; F45-F82 HydrophobicContact CG-CE1 3.91Å; F45-F82 HydrophobicContact CZ-CD1 4.39Å; F59-F82 HydrophobicContact CZ-CE2 4.24Å; F59-F82 HydrophobicContact CZ-CZ 4.39Å; I73-F82 HydrophobicContact CD1-CE2 4.26Å; I76-F82 HydrophobicContact CD1-CB 4.45Å; I76-F82 HydrophobicContact CD1-CD2 3.59Å; I76-F82 HydrophobicContact CD1-CE2 4.31Å; I76-F82 HydrophobicContact CD1-CG 4.39Å; I76-F82 HydrophobicContact CG2-CB 4.21Å; N78-F82 PolarHBondContact O-N 3.12Å; P79-F82 PolarHBondContact O-N 3.07Å; T80-F82 VanDerWaalsContact C-N 3.29Å; T80-F82 PolarHBondContact O-N 3.15Å; F82-E84 VanDerWaalsContact C-N 3.34Å; F82-E84 PolarHBondContact O-N 3.27Å; F82-L85 PolarHBondContact O-N 3Å; F82-L86 HydrophobicContact CE1-CD2 4.43Å; F82-L86 VanDerWaalsContact O-CB 3.26Å; F82-L86 WeakPolarHBondContact O-CB 3.4Å; F82-L86 PolarHBondContact O-N 3.18Å; F82-L111 HydrophobicContact CD2-CD1 4.29Å; F82-L111 HydrophobicContact CE2-CD1 4.12Å
83	E	87.1	Confident	81.5	Confident	75 Å²	75	42.9 Å²	42.9	35%	0.35	23%	0.227	S	C	.	.	H	α-helix	trans	-62	-41	176.3	-172.3	167.2	-167	0	0	112.2	F45 P79 T80 L86 S87	F45-E83 HydrophobicContact CE1-CB 3.78Å; F45-E83 HydrophobicContact CE1-CG 4.05Å; F45-E83 HydrophobicContact CZ-CB 4.32Å; P79-E83 PolarHBondContact O-N 3.4Å; T80-E83 WeakPolarHBondContact O-CB 3.37Å; T80-E83 PolarHBondContact O-N 3.23Å; T80-E83 VanDerWaalsContact O-N 3.16Å; E83-L86 WeakPolarHBondContact O-CB 3.47Å; E83-L86 PolarHBondContact O-N 2.85Å; E83-S87 WeakPolarHBondContact O-CB 3.34Å; E83-S87 PolarHBondContact O-N 3.35Å
84	E	83.5	Confident	81	Confident	67 Å²	67	42.9 Å²	42.9	31%	0.313	23%	0.227	S	C	.	.	H	α-helix	trans	-67.1	-42	175.6	-70.4	-67.4	154.3	0	0	112	T80 F82 L86 S87 F88 Y104	T80-E84 WeakPolarHBondContact O-CG 2.98Å; T80-E84 PolarHBondContact O-N 3.48Å; F82-E84 VanDerWaalsContact C-N 3.34Å; F82-E84 PolarHBondContact O-N 3.27Å; E84-L86 VanDerWaalsContact C-N 3.32Å; E84-L86 PolarHBondContact O-N 2.97Å; E84-S87 WeakPolarHBondContact O-CB 3.47Å; E84-S87 PolarHBondContact O-N 3.17Å; E84-F88 PolarHBondContact O-N 3.07Å; E84-Y104 HydrophobicContact CB-CE1 3.95Å; E84-Y104 WeakPolarHBondContact CB-OH 3.27Å; E84-Y104 WeakPolarHBondContact CG-OH 3.37Å
85	L	86.5	Confident	80	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-64.1	-37.8	172.8	-69.9	172.4	0	0	0	112.1	V81 F82 F88 C89 I94 Y104 A107 L111 I116	V81-L85 HydrophobicContact CG1-CD1 4.18Å; V81-L85 VanDerWaalsContact O-CG 3.24Å; V81-L85 WeakPolarHBondContact O-CG 3.22Å; V81-L85 PolarHBondContact O-N 2.76Å; F82-L85 PolarHBondContact O-N 3Å; L85-F88 WeakPolarHBondContact O-CB 3.39Å; L85-F88 PolarHBondContact O-N 2.97Å; L85-C89 PolarHBondContact O-N 3.29Å; L85-C89 PolarHBondContact O-SG 3.49Å; L85-I94 HydrophobicContact CD2-CD1 3.74Å; L85-Y104 HydrophobicContact CD2-CD1 4.15Å; L85-Y104 HydrophobicContact CG-CD1 4.23Å; L85-Y104 HydrophobicContact CG-CE1 4.41Å; L85-A107 HydrophobicContact CD1-CB 3.43Å; L85-A107 VanDerWaalsContact CD1-CB 3.43Å; L85-L111 HydrophobicContact CD1-CD1 4.26Å; L85-I116 HydrophobicContact CD2-CD1 3.34Å; L85-I116 HydrophobicContact CD2-CG2 4.13Å
86	L	87.6	Confident	79.4	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-66.2	-44.5	174.7	-178.9	62.8	0	0	0	110.2	F45 A47 L52 F82 E83 E84 F88 C89 Y90	F45-L86 HydrophobicContact CB-CD2 4Å; F45-L86 HydrophobicContact CD1-CD2 4.32Å; F45-L86 HydrophobicContact CG-CD2 4.5Å; A47-L86 HydrophobicContact CB-CD1 4Å; L52-L86 HydrophobicContact CD2-CD1 3.64Å; F82-L86 HydrophobicContact CE1-CD2 4.43Å; F82-L86 VanDerWaalsContact O-CB 3.26Å; F82-L86 WeakPolarHBondContact O-CB 3.4Å; F82-L86 PolarHBondContact O-N 3.18Å; E83-L86 WeakPolarHBondContact O-CB 3.47Å; E83-L86 PolarHBondContact O-N 2.85Å; E84-L86 VanDerWaalsContact C-N 3.32Å; E84-L86 PolarHBondContact O-N 2.97Å; L86-F88 VanDerWaalsContact C-N 3.28Å; L86-F88 PolarHBondContact O-N 3.01Å; L86-C89 WeakPolarHBondContact O-CB 3.23Å; L86-C89 PolarHBondContact O-N 3.48Å; L86-C89 VanDerWaalsContact O-N 3.09Å; L86-Y90 HydrophobicContact CD1-CD2 4.5Å; L86-Y90 HydrophobicContact CD1-CE2 3.89Å; L86-Y90 HydrophobicContact CG-CE2 4.46Å; L86-Y90 VanDerWaalsContact O-CD2 3.3Å; L86-Y90 WeakPolarHBondContact O-CD2 3.44Å
87	S	82.6	Confident	78.3	Confident	32 Å²	32	42.3 Å²	42.3	22%	0.224	21%	0.214	C	C	.	.	H	α-helix	trans	-57.7	-41.8	175	-171.4	0	0	0	0	111.6	E83 E84 C89 Y90 T91	E83-S87 WeakPolarHBondContact O-CB 3.34Å; E83-S87 PolarHBondContact O-N 3.35Å; E84-S87 WeakPolarHBondContact O-CB 3.47Å; E84-S87 PolarHBondContact O-N 3.17Å; S87-C89 VanDerWaalsContact C-N 3.29Å; S87-C89 PolarHBondContact O-N 2.98Å; S87-Y90 PolarHBondContact O-N 2.96Å; S87-T91 WeakPolarHBondContact O-CB 3.34Å; S87-T91 PolarHBondContact O-N 3.2Å; S87-T91 PolarHBondContact O-OG1 3.18Å
88	F	83.8	Confident	77.4	Confident	27 Å²	27	38 Å²	38	12%	0.118	20%	0.199	C	C	.	.	H	α-helix	trans	-57.9	-38.6	174.6	171.5	-96	0	0	0	112.7	E84 L85 L86 Y90 T91 G92 R93 I94 M113 I116	E84-F88 PolarHBondContact O-N 3.07Å; L85-F88 WeakPolarHBondContact O-CB 3.39Å; L85-F88 PolarHBondContact O-N 2.97Å; L86-F88 VanDerWaalsContact C-N 3.28Å; L86-F88 PolarHBondContact O-N 3.01Å; F88-Y90 PolarHBondContact O-N 2.92Å; F88-Y90 VanDerWaalsContact O-N 3.17Å; F88-T91 PolarHBondContact O-N 3.05Å; F88-G92 WeakPolarHBondContact CE2-O 3.48Å; F88-G92 WeakPolarHBondContact O-CA 3.42Å; F88-G92 PolarHBondContact O-N 3.45Å; F88-R93 VanDerWaalsContact CA-O 3.32Å; F88-R93 WeakPolarHBondContact CA-O 3.38Å; F88-I94 HydrophobicContact CB-CB 4.11Å; F88-I94 HydrophobicContact CB-CD1 4.31Å; F88-I94 HydrophobicContact CB-CG1 4.49Å; F88-I94 HydrophobicContact CD2-CB 3.81Å; F88-I94 HydrophobicContact CD2-CG2 4.1Å; F88-I94 HydrophobicContact CG-CB 4.25Å; F88-M113 HydrophobicContact CD1-CE 3.63Å; F88-M113 HydrophobicContact CE1-CE 3.78Å; F88-I116 HydrophobicContact CD1-CD1 3.65Å; F88-I116 HydrophobicContact CD1-CG1 4.37Å; F88-I116 HydrophobicContact CE1-CD1 3.78Å; F88-I116 HydrophobicContact CE1-CG1 4.06Å; F88-I116 HydrophobicContact CG-CD1 4.18Å; F88-I116 HydrophobicContact CZ-CD1 4.42Å; F88-I116 HydrophobicContact CZ-CG1 4.28Å
89	C	83.6	Confident	76.6	Confident	12 Å²	12	40.9 Å²	40.9	8%	0.081	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-25.9	178	-59.1	0	0	0	0	113.1	V51 S55 L85 L86 S87	V51-C89 HydrophobicContact CG1-CB 4.02Å; V51-C89 WeakPolarHBondContact CG1-O 3.39Å; S55-C89 VanDerWaalsContact CB-SG 3.53Å; L85-C89 PolarHBondContact O-N 3.29Å; L85-C89 PolarHBondContact O-SG 3.49Å; L86-C89 WeakPolarHBondContact O-CB 3.23Å; L86-C89 PolarHBondContact O-N 3.48Å; L86-C89 VanDerWaalsContact O-N 3.09Å; S87-C89 VanDerWaalsContact C-N 3.29Å; S87-C89 PolarHBondContact O-N 2.98Å
90	Y	79.4	Confident	75.8	Confident	1 Å²	1	41 Å²	41	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-101.4	-21.5	-179.2	-72.3	-97.9	0	0	0	113.8	L24 N25 R28 H48 V51 L86 S87 F88	L24-Y90 HydrophobicContact CB-CD1 4.04Å; L24-Y90 HydrophobicContact CB-CE1 4.06Å; N25-Y90 HydrophobicContact CB-CD1 4.14Å; N25-Y90 HydrophobicContact CB-CG 4.29Å; R28-Y90 HydrophobicContact CB-CE1 4.17Å; R28-Y90 VanDerWaalsContact CD-CE2 3.47Å; H48-Y90 PolarHBondContact N-OH 3.21Å; H48-Y90 AromaticContact ND1-CE1 3.55Å; H48-Y90 AromaticContact ND1-CZ 3.69Å; H48-Y90 PolarHBondContact ND1-OH 3.16Å; V51-Y90 HydrophobicContact CB-CE1 4.16Å; V51-Y90 HydrophobicContact CB-CE2 4.3Å; V51-Y90 HydrophobicContact CG1-CD1 4.17Å; V51-Y90 HydrophobicContact CG1-CD2 3.98Å; V51-Y90 HydrophobicContact CG1-CE1 3.96Å; V51-Y90 HydrophobicContact CG1-CE2 3.71Å; V51-Y90 HydrophobicContact CG1-CG 4.18Å; V51-Y90 HydrophobicContact CG2-CD1 4.47Å; V51-Y90 HydrophobicContact CG2-CE1 3.85Å; L86-Y90 HydrophobicContact CD1-CD2 4.5Å; L86-Y90 HydrophobicContact CD1-CE2 3.89Å; L86-Y90 HydrophobicContact CG-CE2 4.46Å; L86-Y90 VanDerWaalsContact O-CD2 3.3Å; L86-Y90 WeakPolarHBondContact O-CD2 3.44Å; S87-Y90 PolarHBondContact O-N 2.96Å; F88-Y90 PolarHBondContact O-N 2.92Å; F88-Y90 VanDerWaalsContact O-N 3.17Å
91	T	73.2	Confident	75	Confident	46 Å²	46	38.1 Å²	38.1	28%	0.282	21%	0.209	S	C	.	.	H	α-helix	trans	-115.9	-14.9	-172.8	61.4	0	0	0	0	113.3	S87 F88 R93	S87-T91 WeakPolarHBondContact O-CB 3.34Å; S87-T91 PolarHBondContact O-N 3.2Å; S87-T91 PolarHBondContact O-OG1 3.18Å; F88-T91 PolarHBondContact O-N 3.05Å; T91-R93 PolarHBondContact O-N 2.71Å; T91-R93 VanDerWaalsContact O-N 3.12Å; T91-R93 PolarHBondContact OG1-N 3.17Å; T91-R93 PolarHBondContact OG1-O 3.22Å
92	G	66.9	Low	74.1	Confident	12 Å²	12	42.2 Å²	42.2	12%	0.124	23%	0.23	C	C	.	.	S	Bend	trans	64.2	8.2	-170.3	0	0	0	0	0	113.5	F88 T280	F88-G92 WeakPolarHBondContact CE2-O 3.48Å; F88-G92 WeakPolarHBondContact O-CA 3.42Å; F88-G92 PolarHBondContact O-N 3.45Å; G92-T280 PolarHBondContact O-N 3.36Å; G92-T280 PolarHBondContact O-OG1 3.13Å
93	R	62.4	Low	73.4	Confident	128 Å²	128	44.2 Å²	44.2	48%	0.483	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.5	-175.8	-67.7	176.3	-179.1	164	1.4	110.7	F88 T91 I278 D279	F88-R93 VanDerWaalsContact CA-O 3.32Å; F88-R93 WeakPolarHBondContact CA-O 3.38Å; T91-R93 PolarHBondContact O-N 2.71Å; T91-R93 VanDerWaalsContact O-N 3.12Å; T91-R93 PolarHBondContact OG1-N 3.17Å; T91-R93 PolarHBondContact OG1-O 3.22Å; R93-I278 VanDerWaalsContact CA-O 3.24Å; R93-I278 WeakPolarHBondContact CA-O 3.37Å; R93-D279 HydrophobicContact CG-CB 4.36Å; R93-D279 IonicContact CZ-OD2 2.68Å; R93-D279 VanDerWaalsContact CZ-OD2 3.25Å; R93-D279 IonicContact NE-OD1 2.86Å; R93-D279 IonicContact NE-OD2 3.36Å; R93-D279 PolarHBondContact NE-OD2 3.37Å; R93-D279 IonicContact NH2-OD2 2.65Å; R93-D279 PolarHBondContact NH2-OD2 3.06Å
94	I	71.3	Confident	72.9	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135	176.9	-167.2	162.3	0	0	0	110.7	L85 F88 L96 Y104 I116 I278	L85-I94 HydrophobicContact CD2-CD1 3.74Å; F88-I94 HydrophobicContact CB-CB 4.11Å; F88-I94 HydrophobicContact CB-CD1 4.31Å; F88-I94 HydrophobicContact CB-CG1 4.49Å; F88-I94 HydrophobicContact CD2-CB 3.81Å; F88-I94 HydrophobicContact CD2-CG2 4.1Å; F88-I94 HydrophobicContact CG-CB 4.25Å; I94-L96 HydrophobicContact CD1-CD2 3.71Å; I94-L96 HydrophobicContact CG1-CD2 3.81Å; I94-L96 HydrophobicContact CG1-CG 4.25Å; I94-L96 HydrophobicContact CG2-CD2 4.49Å; I94-L96 HydrophobicContact CG2-CG 4.24Å; I94-Y104 HydrophobicContact CD1-CD1 4.19Å; I94-Y104 HydrophobicContact CD1-CE1 4.03Å; I94-I116 HydrophobicContact CD1-CD1 4.13Å; I94-I116 HydrophobicContact CD1-CG2 4.31Å; I94-I278 HydrophobicContact CG2-CB 4.31Å; I94-I278 HydrophobicContact CG2-CD1 4.42Å; I94-I278 PolarHBondContact N-O 3.04Å; I94-I278 PolarHBondContact O-N 3.23Å
95	C	62.9	Low	72.6	Confident	47 Å²	47	39.2 Å²	39.2	32%	0.318	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	99.6	174.9	-67.2	0	0	0	0	108.6	Y104 M276	C95-Y104 PolarHBondContact O-OH 3.28Å; C95-M276 WeakPolarHBondContact CA-O 3.45Å
96	L	66	Low	72.2	Confident	7 Å²	7	42.6 Å²	42.6	4%	0.037	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	118.6	-178.8	-63.3	175	0	0	0	110	I94 Y104 I123 M276 I278	I94-L96 HydrophobicContact CD1-CD2 3.71Å; I94-L96 HydrophobicContact CG1-CD2 3.81Å; I94-L96 HydrophobicContact CG1-CG 4.25Å; I94-L96 HydrophobicContact CG2-CD2 4.49Å; I94-L96 HydrophobicContact CG2-CG 4.24Å; L96-Y104 HydrophobicContact CD2-CD1 3.54Å; L96-Y104 HydrophobicContact CD2-CD2 3.77Å; L96-Y104 HydrophobicContact CD2-CE1 3.78Å; L96-Y104 HydrophobicContact CD2-CE2 3.99Å; L96-Y104 HydrophobicContact CD2-CG 3.55Å; L96-I123 HydrophobicContact CD1-CD1 3.69Å; L96-M276 PolarHBondContact N-O 3.21Å; L96-M276 PolarHBondContact O-N 3.31Å; L96-I278 HydrophobicContact CD1-CD1 4.06Å
97	Q	60.9	Low	72	Confident	101 Å²	101	42.5 Å²	42.5	47%	0.472	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	127.1	167.3	-68.8	-172.2	-12	0	0	109.5	A99 D100 I101	Q97-A99 PolarHBondContact O-N 2.76Å; Q97-D100 PolarHBondContact O-N 2.77Å; Q97-I101 PolarHBondContact O-N 2.91Å
98	L	59.9	Low	72.1	Confident	91 Å²	91	41 Å²	41	48%	0.476	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-62.1	-31.6	-176.8	-174.2	59.2	0	0	0	112.6	D100 I101 I123 I127	L98-D100 PolarHBondContact O-N 2.68Å; L98-I101 HydrophobicContact CD1-CB 4.45Å; L98-I101 HydrophobicContact CD1-CD1 3.88Å; L98-I101 HydrophobicContact CD1-CG2 4.33Å; L98-I101 WeakPolarHBondContact O-CG2 3.39Å; L98-I101 PolarHBondContact O-N 3.49Å; L98-I123 HydrophobicContact CD1-CG2 4.4Å; L98-I127 HydrophobicContact CD1-CD1 3.28Å; L98-I127 HydrophobicContact CD2-CD1 3.59Å; L98-I127 HydrophobicContact CG-CD1 4.08Å
99	A	64.2	Low	72	Confident	99 Å²	99	43.3 Å²	43.3	82%	0.818	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-60.8	-28.9	175.6	0	0	0	0	0	113.2	Q97	Q97-A99 PolarHBondContact O-N 2.76Å
100	D	69	Low	72.1	Confident	32 Å²	32	45.3 Å²	45.3	17%	0.171	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-106.4	8.2	-175.8	-79.8	-53.7	0	0	0	113.3	N78 V81 Q97 L98 I102 S103 Y104	N78-D100 PolarHBondContact ND2-OD1 3.22Å; V81-D100 HydrophobicContact CG2-CB 4.06Å; Q97-D100 PolarHBondContact O-N 2.77Å; L98-D100 PolarHBondContact O-N 2.68Å; D100-I102 PolarHBondContact O-N 3.19Å; D100-I102 VanDerWaalsContact O-N 3.1Å; D100-S103 CarbonylContact O-C 3.55Å; D100-S103 WeakPolarHBondContact O-CA 3.3Å; D100-S103 VanDerWaalsContact O-CB 3.23Å; D100-S103 WeakPolarHBondContact O-CB 3.41Å; D100-S103 PolarHBondContact O-N 2.8Å; D100-Y104 HydrophobicContact CB-CD2 3.97Å; D100-Y104 HydrophobicContact CB-CE2 3.8Å; D100-Y104 VanDerWaalsContact O-CD2 3.26Å; D100-Y104 WeakPolarHBondContact O-CD2 3.28Å; D100-Y104 PolarHBondContact O-N 2.98Å
101	I	69.3	Low	72.4	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.051	26%	0.259	C	S	.	.	H	α-helix	trans	-57.6	-33.3	-172.4	-161.2	155.6	0	0	0	113.6	Q97 L98 Y104 L105 C120 I123 L124	Q97-I101 PolarHBondContact O-N 2.91Å; L98-I101 HydrophobicContact CD1-CB 4.45Å; L98-I101 HydrophobicContact CD1-CD1 3.88Å; L98-I101 HydrophobicContact CD1-CG2 4.33Å; L98-I101 WeakPolarHBondContact O-CG2 3.39Å; L98-I101 PolarHBondContact O-N 3.49Å; I101-Y104 PolarHBondContact O-N 2.81Å; I101-L105 WeakPolarHBondContact O-CB 3.41Å; I101-L105 WeakPolarHBondContact O-CG 3.46Å; I101-L105 PolarHBondContact O-N 3.44Å; I101-C120 HydrophobicContact CG1-CB 4.12Å; I101-I123 HydrophobicContact CD1-CB 4.15Å; I101-I123 HydrophobicContact CD1-CG2 3.83Å; I101-L124 HydrophobicContact CD1-CD2 3.97Å; I101-L124 HydrophobicContact CD1-CG 3.84Å; I101-L124 HydrophobicContact CG1-CD2 4.49Å; I101-L124 HydrophobicContact CG1-CG 4.38Å; I101-L124 HydrophobicContact CG2-CD2 3.99Å
102	I	66.9	Low	73	Confident	86 Å²	86	47.7 Å²	47.7	44%	0.441	27%	0.267	S	S	.	.	H	α-helix	trans	-72.4	-35.3	175.2	-56	-57.5	0	0	0	111.4	D100 L105 T106	D100-I102 PolarHBondContact O-N 3.19Å; D100-I102 VanDerWaalsContact O-N 3.1Å; I102-L105 HydrophobicContact CD1-CD1 4.25Å; I102-L105 PolarHBondContact O-N 3.43Å; I102-T106 WeakPolarHBondContact O-CB 3.4Å; I102-T106 PolarHBondContact O-N 3.33Å; I102-T106 PolarHBondContact O-OG1 3.05Å
103	S	75.3	Confident	73.7	Confident	45 Å²	45	47.5 Å²	47.5	32%	0.315	26%	0.263	S	S	.	.	H	α-helix	trans	-65.4	-42.8	173.5	-56.8	0	0	0	0	110.5	D100 T106 A107	D100-S103 CarbonylContact O-C 3.55Å; D100-S103 WeakPolarHBondContact O-CA 3.3Å; D100-S103 VanDerWaalsContact O-CB 3.23Å; D100-S103 WeakPolarHBondContact O-CB 3.41Å; D100-S103 PolarHBondContact O-N 2.8Å; S103-T106 PolarHBondContact O-N 2.86Å; S103-A107 VanDerWaalsContact O-CB 3.31Å; S103-A107 WeakPolarHBondContact O-CB 3.4Å; S103-A107 PolarHBondContact O-N 3.36Å
104	Y	75.9	Confident	74.3	Confident	5 Å²	5	46.5 Å²	46.5	2%	0.02	26%	0.264	C	S	.	.	H	α-helix	trans	-60.6	-47.7	172.6	-77.9	-73	0	0	0	111.8	V81 E84 L85 I94 C95 L96 D100 I101 T106 A107 A108	V81-Y104 HydrophobicContact CB-CE1 4.43Å; V81-Y104 HydrophobicContact CG1-CD1 3.69Å; V81-Y104 HydrophobicContact CG1-CE1 3.85Å; V81-Y104 HydrophobicContact CG1-CG 4.02Å; V81-Y104 HydrophobicContact CG2-CE2 4.23Å; E84-Y104 HydrophobicContact CB-CE1 3.95Å; E84-Y104 WeakPolarHBondContact CB-OH 3.27Å; E84-Y104 WeakPolarHBondContact CG-OH 3.37Å; L85-Y104 HydrophobicContact CD2-CD1 4.15Å; L85-Y104 HydrophobicContact CG-CD1 4.23Å; L85-Y104 HydrophobicContact CG-CE1 4.41Å; I94-Y104 HydrophobicContact CD1-CD1 4.19Å; I94-Y104 HydrophobicContact CD1-CE1 4.03Å; C95-Y104 PolarHBondContact O-OH 3.28Å; L96-Y104 HydrophobicContact CD2-CD1 3.54Å; L96-Y104 HydrophobicContact CD2-CD2 3.77Å; L96-Y104 HydrophobicContact CD2-CE1 3.78Å; L96-Y104 HydrophobicContact CD2-CE2 3.99Å; L96-Y104 HydrophobicContact CD2-CG 3.55Å; D100-Y104 HydrophobicContact CB-CD2 3.97Å; D100-Y104 HydrophobicContact CB-CE2 3.8Å; D100-Y104 VanDerWaalsContact O-CD2 3.26Å; D100-Y104 WeakPolarHBondContact O-CD2 3.28Å; D100-Y104 PolarHBondContact O-N 2.98Å; I101-Y104 PolarHBondContact O-N 2.81Å; Y104-T106 VanDerWaalsContact C-N 3.34Å; Y104-T106 PolarHBondContact O-N 3.45Å; Y104-A107 PolarHBondContact O-N 3.3Å; Y104-A108 WeakPolarHBondContact O-CB 3.21Å; Y104-A108 PolarHBondContact O-N 3.08Å
105	L	76.3	Confident	74.6	Confident	33 Å²	33	52.6 Å²	52.6	17%	0.173	29%	0.291	C	S	.	.	H	α-helix	trans	-60	-42.9	176.5	-79.2	167.9	0	0	0	112.5	I101 I102 S109 I117 C120 T121 L124	I101-L105 WeakPolarHBondContact O-CB 3.41Å; I101-L105 WeakPolarHBondContact O-CG 3.46Å; I101-L105 PolarHBondContact O-N 3.44Å; I102-L105 HydrophobicContact CD1-CD1 4.25Å; I102-L105 PolarHBondContact O-N 3.43Å; L105-S109 WeakPolarHBondContact O-CB 3.17Å; L105-S109 PolarHBondContact O-N 3.17Å; L105-I117 HydrophobicContact CD2-CB 4.5Å; L105-I117 HydrophobicContact CD2-CG2 4.03Å; L105-C120 HydrophobicContact CD1-CB 4.35Å; L105-C120 HydrophobicContact CD2-CB 3.52Å; L105-C120 HydrophobicContact CG-CB 3.71Å; L105-T121 HydrophobicContact CD2-CG2 4.3Å; L105-L124 HydrophobicContact CD1-CD1 3.8Å
106	T	78.8	Confident	75.1	Confident	72 Å²	72	50.5 Å²	50.5	44%	0.442	28%	0.277	S	S	.	.	H	α-helix	trans	-65.9	-44.8	179.3	-54.8	0	0	0	0	111.1	I102 S103 Y104 F110	I102-T106 WeakPolarHBondContact O-CB 3.4Å; I102-T106 PolarHBondContact O-N 3.33Å; I102-T106 PolarHBondContact O-OG1 3.05Å; S103-T106 PolarHBondContact O-N 2.86Å; Y104-T106 VanDerWaalsContact C-N 3.34Å; Y104-T106 PolarHBondContact O-N 3.45Å; T106-F110 WeakPolarHBondContact O-CB 3.25Å; T106-F110 PolarHBondContact O-N 2.74Å; T106-F110 VanDerWaalsContact O-N 3.08Å
107	A	83.6	Confident	75.5	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.008	28%	0.282	C	S	.	.	H	α-helix	trans	-70	-44.3	179.5	0	0	0	0	0	112	I76 V81 L85 S103 Y104 S109 F110 L111	I76-A107 HydrophobicContact CD1-CB 3.92Å; I76-A107 HydrophobicContact CG1-CB 3.92Å; I76-A107 HydrophobicContact CG2-CB 4.33Å; V81-A107 HydrophobicContact CG1-CB 4.13Å; L85-A107 HydrophobicContact CD1-CB 3.43Å; L85-A107 VanDerWaalsContact CD1-CB 3.43Å; S103-A107 VanDerWaalsContact O-CB 3.31Å; S103-A107 WeakPolarHBondContact O-CB 3.4Å; S103-A107 PolarHBondContact O-N 3.36Å; Y104-A107 PolarHBondContact O-N 3.3Å; A107-S109 PolarHBondContact O-N 3.29Å; A107-F110 PolarHBondContact O-N 3.33Å; A107-L111 WeakPolarHBondContact O-CB 3.38Å; A107-L111 VanDerWaalsContact O-CG 3.3Å; A107-L111 WeakPolarHBondContact O-CG 3.18Å; A107-L111 PolarHBondContact O-N 2.75Å
108	A	84.9	Confident	76	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.1	-37.9	177	0	0	0	0	0	111.9	Y104 L111 Q112 M113 I116 I117	Y104-A108 WeakPolarHBondContact O-CB 3.21Å; Y104-A108 PolarHBondContact O-N 3.08Å; A108-L111 CarbonylContact O-C 3.55Å; A108-L111 PolarHBondContact O-N 2.88Å; A108-Q112 CarbonylContact O-C 3.58Å; A108-Q112 WeakPolarHBondContact O-CA 3.12Å; A108-Q112 PolarHBondContact O-N 3.38Å; A108-M113 HydrophobicContact CB-CB 4.34Å; A108-M113 PolarHBondContact O-N 2.78Å; A108-I116 HydrophobicContact CB-CB 4Å; A108-I116 HydrophobicContact CB-CG2 3.9Å; A108-I117 HydrophobicContact CB-CG1 3.78Å
109	S	82.6	Confident	76.4	Confident	76 Å²	76	50 Å²	50	53%	0.531	27%	0.274	S	S	.	.	H	α-helix	trans	-63.7	-44.7	173.1	179.2	0	0	0	0	111.9	L105 A107 Q112	L105-S109 WeakPolarHBondContact O-CB 3.17Å; L105-S109 PolarHBondContact O-N 3.17Å; A107-S109 PolarHBondContact O-N 3.29Å; S109-Q112 PolarHBondContact O-N 3.14Å
110	F	85.3	Confident	76.6	Confident	53 Å²	53	45.2 Å²	45.2	23%	0.232	24%	0.235	C	C	.	.	H	α-helix	trans	-63.5	-44.1	176.9	-178.9	-98	0	0	0	112.3	Y58 I73 V75 T106 A107 Q112	Y58-F110 HydrophobicContact CD1-CE1 4.37Å; Y58-F110 AromaticContact CE1-CE1 3.79Å; Y58-F110 HydrophobicContact CE1-CE1 3.79Å; Y58-F110 HydrophobicContact CE1-CZ 4.24Å; Y58-F110 AromaticContact CE2-CE1 3.95Å; Y58-F110 HydrophobicContact CE2-CE1 3.95Å; Y58-F110 HydrophobicContact CE2-CE2 4.28Å; Y58-F110 AromaticContact CE2-CZ 3.7Å; Y58-F110 HydrophobicContact CE2-CZ 3.7Å; Y58-F110 AromaticContact CZ-CE1 3.56Å; Y58-F110 AromaticContact CZ-CZ 3.52Å; Y58-F110 WeakPolarHBondContact OH-CZ 3.36Å; I73-F110 HydrophobicContact CG2-CD1 4.15Å; I73-F110 HydrophobicContact CG2-CE1 3.65Å; I73-F110 HydrophobicContact CG2-CZ 4.33Å; V75-F110 HydrophobicContact CB-CD2 4.07Å; V75-F110 HydrophobicContact CB-CE2 4.21Å; V75-F110 HydrophobicContact CB-CG 4.31Å; V75-F110 HydrophobicContact CG1-CB 4.39Å; V75-F110 HydrophobicContact CG1-CD2 3.99Å; V75-F110 HydrophobicContact CG1-CG 4.2Å; V75-F110 HydrophobicContact CG2-CD2 3.92Å; V75-F110 HydrophobicContact CG2-CE2 3.67Å; V75-F110 HydrophobicContact CG2-CZ 4.17Å; T106-F110 WeakPolarHBondContact O-CB 3.25Å; T106-F110 PolarHBondContact O-N 2.74Å; T106-F110 VanDerWaalsContact O-N 3.08Å; A107-F110 PolarHBondContact O-N 3.33Å; F110-Q112 PolarHBondContact O-N 3.27Å
111	L	85.3	Confident	76.6	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-0.8	177.2	-61.6	177.6	0	0	0	113	S56 Y58 F59 I73 I76 F82 L85 A107 A108 M113	S56-L111 WeakPolarHBondContact CB-O 3.39Å; S56-L111 PolarHBondContact OG-O 2.82Å; Y58-L111 HydrophobicContact CD1-CD2 3.9Å; Y58-L111 HydrophobicContact CE1-CD2 4.42Å; F59-L111 HydrophobicContact CD2-CD2 4.33Å; F59-L111 HydrophobicContact CE1-CD2 4.27Å; F59-L111 HydrophobicContact CE2-CD1 4.39Å; F59-L111 HydrophobicContact CE2-CD2 3.6Å; F59-L111 HydrophobicContact CZ-CD2 3.57Å; I73-L111 HydrophobicContact CD1-CD2 4.29Å; I76-L111 HydrophobicContact CD1-CD1 4.29Å; F82-L111 HydrophobicContact CD2-CD1 4.29Å; F82-L111 HydrophobicContact CE2-CD1 4.12Å; L85-L111 HydrophobicContact CD1-CD1 4.26Å; A107-L111 WeakPolarHBondContact O-CB 3.38Å; A107-L111 VanDerWaalsContact O-CG 3.3Å; A107-L111 WeakPolarHBondContact O-CG 3.18Å; A107-L111 PolarHBondContact O-N 2.75Å; A108-L111 CarbonylContact O-C 3.55Å; A108-L111 PolarHBondContact O-N 2.88Å; L111-M113 VanDerWaalsContact C-N 3.29Å; L111-M113 HydrophobicContact CB-CG 3.91Å; L111-M113 HydrophobicContact CB-SD 4.09Å; L111-M113 HydrophobicContact CD1-SD 4.23Å; L111-M113 PolarHBondContact O-N 2.93Å
112	Q	84.8	Confident	76.4	Confident	96 Å²	96	50.9 Å²	50.9	45%	0.449	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	38.4	-179.2	-56.3	178.6	12.3	0	0	113.9	P57 A108 S109 F110 Q114	P57-Q112 HydrophobicContact CB-CB 4.04Å; P57-Q112 VanDerWaalsContact CD-O 3.22Å; P57-Q112 WeakPolarHBondContact CD-O 3.41Å; P57-Q112 HydrophobicContact CG-CB 4.1Å; A108-Q112 CarbonylContact O-C 3.58Å; A108-Q112 WeakPolarHBondContact O-CA 3.12Å; A108-Q112 PolarHBondContact O-N 3.38Å; S109-Q112 PolarHBondContact O-N 3.14Å; F110-Q112 PolarHBondContact O-N 3.27Å; Q112-Q114 PolarHBondContact O-N 3.41Å
113	M	81.6	Confident	76.1	Confident	8 Å²	8	48 Å²	48	4%	0.039	25%	0.249	C	C	.	.			trans	-92.1	81.8	179.8	-60.4	-178.4	82.4	0	0	110.7	F88 A108 L111 H115 I116 I117	F88-M113 HydrophobicContact CD1-CE 3.63Å; F88-M113 HydrophobicContact CE1-CE 3.78Å; A108-M113 HydrophobicContact CB-CB 4.34Å; A108-M113 PolarHBondContact O-N 2.78Å; L111-M113 VanDerWaalsContact C-N 3.29Å; L111-M113 HydrophobicContact CB-CG 3.91Å; L111-M113 HydrophobicContact CB-SD 4.09Å; L111-M113 HydrophobicContact CD1-SD 4.23Å; L111-M113 PolarHBondContact O-N 2.93Å; M113-H115 PolarHBondContact O-N 3.03Å; M113-I116 HydrophobicContact CB-CB 4.49Å; M113-I116 HydrophobicContact CB-CD1 4.07Å; M113-I116 HydrophobicContact CB-CG1 4.32Å; M113-I116 HydrophobicContact CE-CD1 3.67Å; M113-I116 PolarHBondContact O-N 2.87Å; M113-I116 HydrophobicContact SD-CD1 3.95Å; M113-I117 PolarHBondContact O-N 3.04Å
114	Q	76.4	Confident	75.3	Confident	107 Å²	107	49 Å²	49	50%	0.5	25%	0.25	S	S	.	.	H	α-helix	trans	-58.9	-41.8	-170.3	-164.1	61.7	29.9	0	0	113.9	Q112 I116 I117 D118	Q112-Q114 PolarHBondContact O-N 3.41Å; Q114-I116 PolarHBondContact O-N 2.84Å; Q114-I116 VanDerWaalsContact O-N 3.16Å; Q114-I117 WeakPolarHBondContact O-CA 3.38Å; Q114-I117 WeakPolarHBondContact O-CB 3.46Å; Q114-I117 PolarHBondContact O-N 2.76Å; Q114-D118 PolarHBondContact NE2-OD1 3.27Å; Q114-D118 VanDerWaalsContact O-CG 3.28Å; Q114-D118 PolarHBondContact O-N 3.33Å
115	H	76	Confident	74.5	Confident	133 Å²	133	55.1 Å²	55.1	62%	0.616	28%	0.279	S	S	*	.	H	α-helix	trans	-57.2	-34.5	179.7	-58.9	-66.1	0	0	0	113.5	M113 K119	M113-H115 PolarHBondContact O-N 3.03Å; H115-K119 WeakPolarHBondContact O-CB 3.39Å; H115-K119 VanDerWaalsContact O-CG 3.29Å; H115-K119 WeakPolarHBondContact O-CG 3.39Å; H115-K119 PolarHBondContact O-N 3.28Å
116	I	75	Confident	73.1	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-76.1	-39.1	178.6	-57.7	-179.4	0	0	0	109.9	L85 F88 I94 A108 M113 Q114 K119 C120	L85-I116 HydrophobicContact CD2-CD1 3.34Å; L85-I116 HydrophobicContact CD2-CG2 4.13Å; F88-I116 HydrophobicContact CD1-CD1 3.65Å; F88-I116 HydrophobicContact CD1-CG1 4.37Å; F88-I116 HydrophobicContact CE1-CD1 3.78Å; F88-I116 HydrophobicContact CE1-CG1 4.06Å; F88-I116 HydrophobicContact CG-CD1 4.18Å; F88-I116 HydrophobicContact CZ-CD1 4.42Å; F88-I116 HydrophobicContact CZ-CG1 4.28Å; I94-I116 HydrophobicContact CD1-CD1 4.13Å; I94-I116 HydrophobicContact CD1-CG2 4.31Å; A108-I116 HydrophobicContact CB-CB 4Å; A108-I116 HydrophobicContact CB-CG2 3.9Å; M113-I116 HydrophobicContact CB-CB 4.49Å; M113-I116 HydrophobicContact CB-CD1 4.07Å; M113-I116 HydrophobicContact CB-CG1 4.32Å; M113-I116 HydrophobicContact CE-CD1 3.67Å; M113-I116 PolarHBondContact O-N 2.87Å; M113-I116 HydrophobicContact SD-CD1 3.95Å; Q114-I116 PolarHBondContact O-N 2.84Å; Q114-I116 VanDerWaalsContact O-N 3.16Å; I116-K119 PolarHBondContact O-N 3.43Å; I116-C120 WeakPolarHBondContact O-CB 3.27Å; I116-C120 PolarHBondContact O-N 3.22Å; I116-C120 PolarHBondContact O-SG 3.39Å
117	I	73.1	Confident	71.8	Confident	28 Å²	28	54.3 Å²	54.3	14%	0.144	28%	0.279	C	S	.	.	H	α-helix	trans	-59	-51.8	176.1	-60.4	170.5	0	0	0	109.6	L105 A108 M113 Q114 K119 C120 T121	L105-I117 HydrophobicContact CD2-CB 4.5Å; L105-I117 HydrophobicContact CD2-CG2 4.03Å; A108-I117 HydrophobicContact CB-CG1 3.78Å; M113-I117 PolarHBondContact O-N 3.04Å; Q114-I117 WeakPolarHBondContact O-CA 3.38Å; Q114-I117 WeakPolarHBondContact O-CB 3.46Å; Q114-I117 PolarHBondContact O-N 2.76Å; I117-K119 VanDerWaalsContact C-N 3.29Å; I117-K119 PolarHBondContact O-N 3.06Å; I117-C120 PolarHBondContact O-N 3.26Å; I117-T121 WeakPolarHBondContact O-CG2 3.3Å; I117-T121 PolarHBondContact O-N 2.6Å; I117-T121 PolarHBondContact O-OG1 2.87Å
118	D	71.6	Confident	69.9	Low	74 Å²	74	60.1 Å²	60.1	40%	0.396	31%	0.306	S	S	.	.	H	α-helix	trans	-62.3	-36.5	-177.9	-59.1	-18.9	0	0	0	111.9	Q114 T121 Q122	Q114-D118 PolarHBondContact NE2-OD1 3.27Å; Q114-D118 VanDerWaalsContact O-CG 3.28Å; Q114-D118 PolarHBondContact O-N 3.33Å; D118-T121 WeakPolarHBondContact CA-OG1 3.04Å; D118-T121 PolarHBondContact O-OG1 3.49Å; D118-Q122 VanDerWaalsContact O-CB 3.3Å; D118-Q122 WeakPolarHBondContact O-CB 3.38Å; D118-Q122 PolarHBondContact O-N 2.95Å
119	K	69.7	Low	67.6	Low	85 Å²	85	66.6 Å²	66.6	37%	0.37	33%	0.334	S	S	.	.	H	α-helix	trans	-72.2	-40.4	175.3	-72.3	-67.8	172.1	-169.5	0	112.6	H115 I116 I117 T121 Q122 I123 I278	H115-K119 WeakPolarHBondContact O-CB 3.39Å; H115-K119 VanDerWaalsContact O-CG 3.29Å; H115-K119 WeakPolarHBondContact O-CG 3.39Å; H115-K119 PolarHBondContact O-N 3.28Å; I116-K119 PolarHBondContact O-N 3.43Å; I117-K119 VanDerWaalsContact C-N 3.29Å; I117-K119 PolarHBondContact O-N 3.06Å; K119-T121 VanDerWaalsContact C-N 3.33Å; K119-T121 PolarHBondContact O-N 3.35Å; K119-Q122 PolarHBondContact O-N 2.89Å; K119-I123 VanDerWaalsContact O-CG1 3.27Å; K119-I123 WeakPolarHBondContact O-CG1 3.3Å; K119-I123 PolarHBondContact O-N 3.21Å; K119-I278 HydrophobicContact CB-CD1 3.98Å; K119-I278 HydrophobicContact CD-CD1 4.3Å; K119-I278 HydrophobicContact CG-CD1 4.21Å
120	C	67.1	Low	65.7	Low	0 Å²	0	70.6 Å²	70.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-62.1	-40.7	173.6	-72.9	0	0	0	0	111.6	I101 L105 I116 I117 I123 L124	I101-C120 HydrophobicContact CG1-CB 4.12Å; L105-C120 HydrophobicContact CD1-CB 4.35Å; L105-C120 HydrophobicContact CD2-CB 3.52Å; L105-C120 HydrophobicContact CG-CB 3.71Å; I116-C120 WeakPolarHBondContact O-CB 3.27Å; I116-C120 PolarHBondContact O-N 3.22Å; I116-C120 PolarHBondContact O-SG 3.39Å; I117-C120 PolarHBondContact O-N 3.26Å; C120-I123 PolarHBondContact O-N 3.36Å; C120-L124 VanDerWaalsContact O-CG 3.32Å; C120-L124 WeakPolarHBondContact O-CG 3.48Å; C120-L124 PolarHBondContact O-N 2.78Å; C120-L124 VanDerWaalsContact O-N 3.11Å
121	T	69.4	Low	63.8	Low	53 Å²	53	72.4 Å²	72.4	33%	0.325	35%	0.354	S	S	.	.	H	α-helix	trans	-67.3	-42.5	176.2	53.1	0	0	0	0	111.6	L105 I117 D118 K119 I123 L124 E125	L105-T121 HydrophobicContact CD2-CG2 4.3Å; I117-T121 WeakPolarHBondContact O-CG2 3.3Å; I117-T121 PolarHBondContact O-N 2.6Å; I117-T121 PolarHBondContact O-OG1 2.87Å; D118-T121 WeakPolarHBondContact CA-OG1 3.04Å; D118-T121 PolarHBondContact O-OG1 3.49Å; K119-T121 VanDerWaalsContact C-N 3.33Å; K119-T121 PolarHBondContact O-N 3.35Å; T121-I123 VanDerWaalsContact C-N 3.32Å; T121-I123 PolarHBondContact O-N 3.38Å; T121-L124 WeakPolarHBondContact O-CB 3.32Å; T121-L124 PolarHBondContact O-N 3.35Å; T121-L124 VanDerWaalsContact O-N 3.13Å; T121-E125 WeakPolarHBondContact O-CG 3.48Å; T121-E125 PolarHBondContact O-N 2.83Å
122	Q	65.8	Low	61.6	Low	107 Å²	107	75.6 Å²	75.6	50%	0.5	37%	0.37	S	S	.	.	H	α-helix	trans	-60.1	-40.1	175.7	-176.9	171.7	48.9	0	0	112.5	D118 K119 E125 G126	D118-Q122 VanDerWaalsContact O-CB 3.3Å; D118-Q122 WeakPolarHBondContact O-CB 3.38Å; D118-Q122 PolarHBondContact O-N 2.95Å; K119-Q122 PolarHBondContact O-N 2.89Å; Q122-E125 PolarHBondContact O-N 2.93Å; Q122-G126 PolarHBondContact O-N 2.89Å
123	I	59.8	Low	59.7	Low	26 Å²	26	73.6 Å²	73.6	13%	0.133	37%	0.365	C	S	.	.	H	α-helix	trans	-64.4	-43	175.3	-69.4	165.9	0	0	0	110.7	L96 L98 I101 K119 C120 T121 G126 I127 M276 I278	L96-I123 HydrophobicContact CD1-CD1 3.69Å; L98-I123 HydrophobicContact CD1-CG2 4.4Å; I101-I123 HydrophobicContact CD1-CB 4.15Å; I101-I123 HydrophobicContact CD1-CG2 3.83Å; K119-I123 VanDerWaalsContact O-CG1 3.27Å; K119-I123 WeakPolarHBondContact O-CG1 3.3Å; K119-I123 PolarHBondContact O-N 3.21Å; C120-I123 PolarHBondContact O-N 3.36Å; T121-I123 VanDerWaalsContact C-N 3.32Å; T121-I123 PolarHBondContact O-N 3.38Å; I123-G126 PolarHBondContact O-N 3.5Å; I123-I127 HydrophobicContact CG2-CD1 3.77Å; I123-I127 WeakPolarHBondContact O-CD1 3.3Å; I123-I127 VanDerWaalsContact O-CG1 3.27Å; I123-I127 WeakPolarHBondContact O-CG1 3.43Å; I123-I127 PolarHBondContact O-N 2.92Å; I123-M276 HydrophobicContact CD1-CE 4.48Å; I123-M276 HydrophobicContact CD1-SD 3.56Å; I123-M276 VanDerWaalsContact CD1-SD 3.56Å; I123-M276 HydrophobicContact CG1-CE 4.2Å; I123-M276 HydrophobicContact CG1-SD 3.72Å; I123-I278 HydrophobicContact CD1-CD1 4.37Å
124	L	58.8	Low	57.7	Low	66 Å²	66	76 Å²	76	35%	0.346	39%	0.386	S	S	.	.	H	α-helix	trans	-62.6	-42.1	176.9	-71.8	171.1	0	0	0	112.1	I101 L105 C120 T121 H128	I101-L124 HydrophobicContact CD1-CD2 3.97Å; I101-L124 HydrophobicContact CD1-CG 3.84Å; I101-L124 HydrophobicContact CG1-CD2 4.49Å; I101-L124 HydrophobicContact CG1-CG 4.38Å; I101-L124 HydrophobicContact CG2-CD2 3.99Å; L105-L124 HydrophobicContact CD1-CD1 3.8Å; C120-L124 VanDerWaalsContact O-CG 3.32Å; C120-L124 WeakPolarHBondContact O-CG 3.48Å; C120-L124 PolarHBondContact O-N 2.78Å; C120-L124 VanDerWaalsContact O-N 3.11Å; T121-L124 WeakPolarHBondContact O-CB 3.32Å; T121-L124 PolarHBondContact O-N 3.35Å; T121-L124 VanDerWaalsContact O-N 3.13Å; L124-H128 WeakPolarHBondContact O-CB 3.12Å; L124-H128 PolarHBondContact O-N 2.91Å
125	E	58.8	Low	56.2	Low	133 Å²	133	75.7 Å²	75.7	62%	0.621	38%	0.384	S	S	*	.	H	α-helix	trans	-64.5	-42	174.6	-72.2	173.1	-179.5	0	0	112	T121 Q122 H128 F129	T121-E125 WeakPolarHBondContact O-CG 3.48Å; T121-E125 PolarHBondContact O-N 2.83Å; Q122-E125 PolarHBondContact O-N 2.93Å; E125-H128 WeakPolarHBondContact O-CB 3.5Å; E125-H128 PolarHBondContact O-N 3.42Å; E125-F129 WeakPolarHBondContact O-CB 3.26Å; E125-F129 PolarHBondContact O-N 3.39Å
126	G	46.7	Very low	55	Low	33 Å²	33	73.6 Å²	73.6	34%	0.34	38%	0.381	S	S	.	.	H	α-helix	trans	-65.4	-38	178.2	0	0	0	0	0	113.2	Q122 I123 F129 K130	Q122-G126 PolarHBondContact O-N 2.89Å; I123-G126 PolarHBondContact O-N 3.5Å; G126-F129 PolarHBondContact O-N 3.1Å; G126-K130 WeakPolarHBondContact O-CG 3.22Å; G126-K130 PolarHBondContact O-N 2.91Å
127	I	52.6	Low	53.6	Low	55 Å²	55	79.4 Å²	79.4	28%	0.282	41%	0.408	S	S	.	.	H	α-helix	trans	-66.4	-43	173.5	-67.6	162.3	0	0	0	110.1	L98 I123 F129 K130 I131	L98-I127 HydrophobicContact CD1-CD1 3.28Å; L98-I127 HydrophobicContact CD2-CD1 3.59Å; L98-I127 HydrophobicContact CG-CD1 4.08Å; I123-I127 HydrophobicContact CG2-CD1 3.77Å; I123-I127 WeakPolarHBondContact O-CD1 3.3Å; I123-I127 VanDerWaalsContact O-CG1 3.27Å; I123-I127 WeakPolarHBondContact O-CG1 3.43Å; I123-I127 PolarHBondContact O-N 2.92Å; I127-F129 VanDerWaalsContact C-N 3.32Å; I127-F129 PolarHBondContact O-N 2.86Å; I127-K130 PolarHBondContact O-N 3.45Å; I127-I131 HydrophobicContact CG2-CD1 3.89Å; I127-I131 WeakPolarHBondContact O-CD1 3.08Å; I127-I131 VanDerWaalsContact O-CG1 3.25Å; I127-I131 WeakPolarHBondContact O-CG1 3.44Å; I127-I131 PolarHBondContact O-N 2.92Å
128	H	42.8	Very low	52.4	Low	123 Å²	123	80.1 Å²	80.1	57%	0.569	42%	0.418	S	S	*	.	H	α-helix	trans	-59.8	-42.5	175.1	-173.7	-101.5	0	0	0	111.9	L124 E125 N132	L124-H128 WeakPolarHBondContact O-CB 3.12Å; L124-H128 PolarHBondContact O-N 2.91Å; E125-H128 WeakPolarHBondContact O-CB 3.5Å; E125-H128 PolarHBondContact O-N 3.42Å; H128-N132 VanDerWaalsContact O-CG 3.25Å; H128-N132 PolarHBondContact O-N 3.46Å; H128-N132 PolarHBondContact O-ND2 2.8Å; H128-N132 VanDerWaalsContact O-ND2 3.14Å
129	F	36.8	Very low	51.3	Low	136 Å²	136	83.1 Å²	83.1	60%	0.596	43%	0.43	S	S	*	.	H	α-helix	trans	-65.9	-43.9	176.8	-174.8	-96.3	0	0	0	112.8	E125 G126 I127 I131 N132 V133	E125-F129 WeakPolarHBondContact O-CB 3.26Å; E125-F129 PolarHBondContact O-N 3.39Å; G126-F129 PolarHBondContact O-N 3.1Å; I127-F129 VanDerWaalsContact C-N 3.32Å; I127-F129 PolarHBondContact O-N 2.86Å; F129-I131 VanDerWaalsContact C-N 3.33Å; F129-I131 PolarHBondContact O-N 3.48Å; F129-N132 WeakPolarHBondContact O-CB 3.13Å; F129-N132 PolarHBondContact O-N 3Å; F129-N132 VanDerWaalsContact O-N 3.13Å; F129-V133 HydrophobicContact CD1-CG2 3.97Å; F129-V133 HydrophobicContact CE1-CG2 3.55Å; F129-V133 HydrophobicContact CE2-CG2 4.47Å; F129-V133 HydrophobicContact CZ-CG2 3.83Å; F129-V133 WeakPolarHBondContact O-CG2 3.38Å; F129-V133 PolarHBondContact O-N 2.78Å
130	K	41.9	Very low	50.3	Low	160 Å²	160	84.6 Å²	84.6	70%	0.696	44%	0.441	S	S	*	.	H	α-helix	trans	-64.8	-35.2	178.5	-76.7	-175.4	176.6	-173.6	0	112.9	G126 I127 N132 V133 A134	G126-K130 WeakPolarHBondContact O-CG 3.22Å; G126-K130 PolarHBondContact O-N 2.91Å; I127-K130 PolarHBondContact O-N 3.45Å; K130-N132 VanDerWaalsContact C-N 3.33Å; K130-V133 PolarHBondContact O-N 3.41Å; K130-A134 WeakPolarHBondContact O-CB 3.46Å; K130-A134 PolarHBondContact O-N 3.2Å
131	I	46.9	Very low	49.2	Very low	92 Å²	92	88.5 Å²	88.5	47%	0.472	47%	0.468	S	S	.	.	H	α-helix	trans	-61.6	-44.8	172.1	-67.8	164.4	0	0	0	109.9	I127 F129 V133 A134 E135	I127-I131 HydrophobicContact CG2-CD1 3.89Å; I127-I131 WeakPolarHBondContact O-CD1 3.08Å; I127-I131 VanDerWaalsContact O-CG1 3.25Å; I127-I131 WeakPolarHBondContact O-CG1 3.44Å; I127-I131 PolarHBondContact O-N 2.92Å; F129-I131 VanDerWaalsContact C-N 3.33Å; F129-I131 PolarHBondContact O-N 3.48Å; I131-V133 PolarHBondContact O-N 2.85Å; I131-A134 PolarHBondContact O-N 3.34Å; I131-E135 WeakPolarHBondContact O-CG 3.39Å; I131-E135 PolarHBondContact O-N 3.36Å; I131-E135 VanDerWaalsContact O-N 3.15Å
132	N	39.1	Very low	48.3	Very low	68 Å²	68	92.1 Å²	92.1	36%	0.364	48%	0.482	S	S	.	.	H	α-helix	trans	-64.3	-37.9	178.3	-65	-29	0	0	0	113	H128 F129 K130 V136	H128-N132 VanDerWaalsContact O-CG 3.25Å; H128-N132 PolarHBondContact O-N 3.46Å; H128-N132 PolarHBondContact O-ND2 2.8Å; H128-N132 VanDerWaalsContact O-ND2 3.14Å; F129-N132 WeakPolarHBondContact O-CB 3.13Å; F129-N132 PolarHBondContact O-N 3Å; F129-N132 VanDerWaalsContact O-N 3.13Å; K130-N132 VanDerWaalsContact C-N 3.33Å; N132-V136 WeakPolarHBondContact O-CG2 3.47Å; N132-V136 PolarHBondContact O-N 3.27Å
133	V	43.8	Very low	47.2	Very low	54 Å²	54	92.2 Å²	92.2	33%	0.327	49%	0.489	S	S	.	.	H	α-helix	trans	-72.2	-41.2	178.5	175.2	0	0	0	0	111.6	F129 K130 I131 E135 V136 E137	F129-V133 HydrophobicContact CD1-CG2 3.97Å; F129-V133 HydrophobicContact CE1-CG2 3.55Å; F129-V133 HydrophobicContact CE2-CG2 4.47Å; F129-V133 HydrophobicContact CZ-CG2 3.83Å; F129-V133 WeakPolarHBondContact O-CG2 3.38Å; F129-V133 PolarHBondContact O-N 2.78Å; K130-V133 PolarHBondContact O-N 3.41Å; I131-V133 PolarHBondContact O-N 2.85Å; V133-E135 PolarHBondContact O-N 3.48Å; V133-V136 PolarHBondContact O-N 3.16Å; V133-V136 VanDerWaalsContact O-N 3.11Å; V133-E137 PolarHBondContact O-N 3.45Å
134	A	40.4	Very low	46.3	Very low	58 Å²	58	102 Å²	102	48%	0.479	53%	0.525	S	S	.	.	H	α-helix	trans	-62.3	-32.1	176.5	0	0	0	0	0	112.4	K130 I131 A138	K130-A134 WeakPolarHBondContact O-CB 3.46Å; K130-A134 PolarHBondContact O-N 3.2Å; I131-A134 PolarHBondContact O-N 3.34Å; A134-A138 VanDerWaalsContact O-CB 3.26Å; A134-A138 WeakPolarHBondContact O-CB 3.49Å; A134-A138 PolarHBondContact O-N 3.01Å; A134-A138 VanDerWaalsContact O-N 3.07Å
135	E	44.9	Very low	45.5	Very low	102 Å²	102	104.3 Å²	104.3	48%	0.477	54%	0.542	S	S	.	.	H	α-helix	trans	-68.5	-40.1	172.7	-75.6	-178.7	167.4	0	0	112.4	I131 V133 A138 E139	I131-E135 WeakPolarHBondContact O-CG 3.39Å; I131-E135 PolarHBondContact O-N 3.36Å; I131-E135 VanDerWaalsContact O-N 3.15Å; V133-E135 PolarHBondContact O-N 3.48Å; E135-A138 PolarHBondContact O-N 2.94Å; E135-E139 VanDerWaalsContact O-CG 3.22Å; E135-E139 WeakPolarHBondContact O-CG 3.39Å; E135-E139 PolarHBondContact O-N 2.82Å
136	V	50.3	Low	44.6	Very low	88 Å²	88	106.7 Å²	106.7	53%	0.533	55%	0.55	S	S	.	*	H	α-helix	trans	-67	-41.2	177.7	173.7	0	0	0	0	111.6	N132 V133 E139 L140	N132-V136 WeakPolarHBondContact O-CG2 3.47Å; N132-V136 PolarHBondContact O-N 3.27Å; V133-V136 PolarHBondContact O-N 3.16Å; V133-V136 VanDerWaalsContact O-N 3.11Å; V136-E139 PolarHBondContact O-N 3.28Å; V136-L140 HydrophobicContact CG1-CD1 4.01Å; V136-L140 PolarHBondContact O-N 3.33Å; V136-L140 VanDerWaalsContact O-N 3.08Å
137	E	46	Very low	44	Very low	126 Å²	126	113.6 Å²	113.6	59%	0.589	57%	0.573	S	S	*	*	H	α-helix	trans	-69.6	-34.2	176.8	-70	-176.8	160.5	0	0	112.6	V133 S141	V133-E137 PolarHBondContact O-N 3.45Å; E137-S141 WeakPolarHBondContact O-CB 3.41Å; E137-S141 PolarHBondContact O-N 3.43Å; E137-S141 VanDerWaalsContact O-N 3.12Å; E137-S141 PolarHBondContact O-OG 2.92Å
138	A	48.6	Very low	43.2	Very low	44 Å²	44	116.7 Å²	116.7	36%	0.364	60%	0.597	S	S	.	*	H	α-helix	trans	-68.4	-32.5	174	0	0	0	0	0	112.8	A134 E135 Q142	A134-A138 VanDerWaalsContact O-CB 3.26Å; A134-A138 WeakPolarHBondContact O-CB 3.49Å; A134-A138 PolarHBondContact O-N 3.01Å; A134-A138 VanDerWaalsContact O-N 3.07Å; E135-A138 PolarHBondContact O-N 2.94Å; A138-Q142 VanDerWaalsContact O-CG 3.29Å; A138-Q142 WeakPolarHBondContact O-CG 3.3Å; A138-Q142 PolarHBondContact O-N 3.01Å; A138-Q142 PolarHBondContact O-NE2 3.14Å
139	E	47.7	Very low	42.7	Very low	137 Å²	137	119.8 Å²	119.8	64%	0.64	61%	0.612	S	S	*	*	H	α-helix	trans	-73	-43.4	175	-70.8	-105.1	130	0	0	111.9	E135 V136 S141 Q142 T143	E135-E139 VanDerWaalsContact O-CG 3.22Å; E135-E139 WeakPolarHBondContact O-CG 3.39Å; E135-E139 PolarHBondContact O-N 2.82Å; V136-E139 PolarHBondContact O-N 3.28Å; E139-S141 VanDerWaalsContact C-N 3.31Å; E139-S141 PolarHBondContact O-N 2.92Å; E139-Q142 PolarHBondContact O-N 3.16Å; E139-T143 PolarHBondContact O-N 3.32Å
140	L	48.2	Very low	42.3	Very low	115 Å²	115	124.5 Å²	124.5	60%	0.602	63%	0.625	S	S	*	*	H	α-helix	trans	-61.5	-38.4	175.7	-97.7	134.6	0	0	0	112.2	V136 Q142 T143	V136-L140 HydrophobicContact CG1-CD1 4.01Å; V136-L140 PolarHBondContact O-N 3.33Å; V136-L140 VanDerWaalsContact O-N 3.08Å; L140-Q142 VanDerWaalsContact C-N 3.3Å; L140-Q142 PolarHBondContact O-N 2.84Å; L140-T143 PolarHBondContact O-N 3.21Å; L140-T143 PolarHBondContact O-OG1 2.96Å
141	S	45.4	Very low	41.9	Very low	83 Å²	83	122.3 Å²	122.3	58%	0.58	63%	0.627	S	S	*	*	H	α-helix	trans	-67.7	-27.7	177.1	-57	0	0	0	0	113.4	E137 E139	E137-S141 WeakPolarHBondContact O-CB 3.41Å; E137-S141 PolarHBondContact O-N 3.43Å; E137-S141 VanDerWaalsContact O-N 3.12Å; E137-S141 PolarHBondContact O-OG 2.92Å; E139-S141 VanDerWaalsContact C-N 3.31Å; E139-S141 PolarHBondContact O-N 2.92Å
142	Q	48.8	Very low	41.2	Very low	129 Å²	129	123.8 Å²	123.8	60%	0.603	64%	0.643	S	S	*	*	H	α-helix	trans	-82.9	-23.5	178.3	-72.9	173.1	53	0	0	113.3	A138 E139 L140	A138-Q142 VanDerWaalsContact O-CG 3.29Å; A138-Q142 WeakPolarHBondContact O-CG 3.3Å; A138-Q142 PolarHBondContact O-N 3.01Å; A138-Q142 PolarHBondContact O-NE2 3.14Å; E139-Q142 PolarHBondContact O-N 3.16Å; L140-Q142 VanDerWaalsContact C-N 3.3Å; L140-Q142 PolarHBondContact O-N 2.84Å
143	T	43.7	Very low	40.6	Very low	108 Å²	108	129.5 Å²	129.5	66%	0.663	67%	0.668	S	S	*	*	H	α-helix	trans	-78	-19	176.9	58.1	0	0	0	0	114.5	E139 L140	E139-T143 PolarHBondContact O-N 3.32Å; L140-T143 PolarHBondContact O-N 3.21Å; L140-T143 PolarHBondContact O-OG1 2.96Å
144	R	40.1	Very low	39.8	Very low	232 Å²	232	131.9 Å²	131.9	88%	0.875	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-9.8	-177.8	-159.9	171.1	-179	178.7	0.3	114.6
145	T	41.5	Very low	39.3	Very low	115 Å²	115	137.1 Å²	137.1	71%	0.706	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	12	-173.9	45.9	0	0	0	0	115.4
146	K	40.3	Very low	38.4	Very low	183 Å²	183	143.1 Å²	143.1	80%	0.796	72%	0.719	S	S	*	*			trans	-133.6	80.6	177.6	-71	-177.7	-178.4	171.8	0	112.8
147	H	33.6	Very low	37.3	Very low	177 Å²	177	145 Å²	145	82%	0.819	73%	0.731	S	S	*	*			trans	-120.8	119.8	152.5	-138.6	-79.6	0	0	0	108.5	E149	H147-E149 PolarHBondContact O-N 3.38Å
148	P	37.5	Very low	36.3	Very low	121 Å²	121	145 Å²	145	79%	0.786	74%	0.739	S	S	*	*			trans	-89.1	106.8	179.7	31.7	-26.6	0	0	0	109.5
149	E	31.2	Very low	35.9	Very low	188 Å²	188	147.6 Å²	147.6	88%	0.879	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-87.8	127.2	164	-74.4	-163.8	150.6	0	0	110.4	H147	H147-E149 PolarHBondContact O-N 3.38Å
150	R	28.6	Very low	34.8	Very low	234 Å²	234	146.7 Å²	146.7	88%	0.883	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-69.6	141.3	176.8	-178	-171.9	-87.1	177.4	-8.2	109.6
151	P	34.1	Very low	33.7	Very low	114 Å²	114	147.5 Å²	147.5	74%	0.74	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-87	153.8	-177.4	34.7	-32.5	0	0	0	111.9
152	P	30.7	Very low	32.7	Very low	123 Å²	123	149.9 Å²	149.9	80%	0.799	77%	0.767	S	S	*	*			trans	-110.9	151.7	147.9	32	-19.5	0	0	0	111.8
153	E	27.9	Very low	31.7	Very low	189 Å²	189	154.8 Å²	154.8	88%	0.883	78%	0.78	S	S	*	*			trans	-65.2	147.8	-173.5	-56.8	170	147.2	0	0	113.5
154	S	26	Very low	30.7	Very low	104 Å²	104	154.9 Å²	154.9	73%	0.727	79%	0.785	S	S	*	*				175.5	126	117.7	45.8	0	0	0	0	113.9
155	H	29.9	Very low	30.1	Very low	167 Å²	167	152.2 Å²	152.2	77%	0.773	79%	0.787	S	S	*	*			trans	63.2	117.3	138.2	-66.1	-53	0	0	0	123.2
156	R	26.1	Very low	29.2	Very low	229 Å²	229	151.9 Å²	151.9	86%	0.864	79%	0.789	S	S	*	*				68.9	127.2	129.6	-93.4	-179.5	177.6	162.8	-0.4	115.8
157	V	27.3	Very low	29.3	Very low	128 Å²	128	148.4 Å²	148.4	78%	0.776	79%	0.785	S	S	*	*			cis	-163.9	131.2	43.4	170.4	0	0	0	0	107.8
158	T	26	Very low	28.9	Very low	125 Å²	125	151 Å²	151	77%	0.767	79%	0.788	S	S	*	*			trans	-82.6	154.2	151.5	50.2	0	0	0	0	108
159	P	38.6	Very low	28.3	Very low	99 Å²	99	152.8 Å²	152.8	64%	0.643	79%	0.786	S	S	*	*				-159.7	-172.6	50	40	-16	0	0	0	118.9
160	T	24.7	Very low	28	Very low	117 Å²	117	150.4 Å²	150.4	72%	0.718	78%	0.779	S	S	*	*			trans	78.9	139.1	151.6	54	0	0	0	0	118.3
161	L	25.5	Very low	27.8	Very low	132 Å²	132	144 Å²	144	69%	0.691	78%	0.776	S	S	*	*			cis	-163.5	153.3	16.1	-107.9	146.5	0	0	0	108.5
162	N	24.7	Very low	27.3	Very low	134 Å²	134	143.5 Å²	143.5	72%	0.717	78%	0.782	S	S	*	*			trans	36.3	141.8	140.1	-63.6	-6	0	0	0	119.9
163	R	26.8	Very low	27.2	Very low	232 Å²	232	148.1 Å²	148.1	88%	0.875	79%	0.789	S	S	*	*			cis	-175.1	142	35.3	-152.5	170.1	-177.1	177.6	-0.4	106.9
164	S	24.2	Very low	27.1	Very low	110 Å²	110	142.2 Å²	142.2	77%	0.769	78%	0.779	S	S	*	*			trans	-54.7	150.1	165.5	-37.5	0	0	0	0	112.7
165	L	26	Very low	27	Very low	175 Å²	175	144.6 Å²	144.6	92%	0.916	78%	0.784	S	S	*	*			trans	-166.9	107.7	138.3	-95.5	171.2	0	0	0	109.4
166	S	24.4	Very low	26.8	Very low	108 Å²	108	148.2 Å²	148.2	76%	0.755	79%	0.791	S	S	*	*			trans	-91.7	-172.8	148.9	-39.7	0	0	0	0	107.5
167	P	42.6	Very low	26.7	Very low	110 Å²	110	148.5 Å²	148.5	71%	0.714	79%	0.792	S	S	*	*			cis	-136.3	175	-17	34.8	-16.3	0	0	0	112.6
168	R	23.8	Very low	26.6	Very low	231 Å²	231	145.7 Å²	145.7	87%	0.872	79%	0.789	S	S	*	*			trans	175.8	115	130.4	-100.4	171.3	168.3	-174	-3.3	114.9
169	H	24.8	Very low	26.5	Very low	159 Å²	159	149 Å²	149	74%	0.736	80%	0.796	S	S	*	*				50.8	125.4	124.4	-79.3	-71.7	0	0	0	124.5
170	N	24.5	Very low	25.7	Very low	138 Å²	138	150.9 Å²	150.9	74%	0.738	81%	0.805	S	S	*	*			trans	97.9	101.6	130.8	-68.8	-4.2	0	0	0	121
171	A	24.8	Very low	25.6	Very low	99 Å²	99	150.7 Å²	150.7	82%	0.818	81%	0.808	S	S	*	*				46.9	126.4	120.1	0	0	0	0	0	121.2
172	A	23.3	Very low	25.5	Very low	105 Å²	105	149.1 Å²	149.1	87%	0.868	82%	0.815	S	S	*	*				179.1	156.2	108.6	0	0	0	0	0	113.2
173	K	29.9	Very low	25.3	Very low	219 Å²	219	148.9 Å²	148.9	95%	0.952	82%	0.817	S	S	*	*			trans	-54.5	145.3	-179.9	-68.7	165.6	170.8	174.9	0	114.4
174	G	24.6	Very low	25	Very low	65 Å²	65	146.3 Å²	146.3	67%	0.67	82%	0.82	S	S	*	*			trans	-146.2	122	165.4	0	0	0	0	0	111.1
175	N	24.8	Very low	24.9	Very low	155 Å²	155	147.7 Å²	147.7	83%	0.829	82%	0.819	S	S	*	*			trans	-81.3	133.1	-178.4	-159.3	28.5	0	0	0	109.3
176	W	25.3	Very low	24.8	Very low	242 Å²	242	147.1 Å²	147.1	92%	0.917	82%	0.815	S	S	*	*			trans	-132.7	101.1	167.7	-69.6	102	0	0	0	110.7
177	R	25	Very low	24.8	Very low	236 Å²	236	151.7 Å²	151.7	89%	0.891	82%	0.816	S	S	*	*			trans	-75	139.1	140.6	-74	-162.1	-137.6	-93.9	4.9	106.9
178	G	23.7	Very low	23.9	Very low	69 Å²	69	153.7 Å²	153.7	71%	0.711	82%	0.816	S	S	*	*			trans	-168.4	105.7	167.5	0	0	0	0	0	110.3
179	Q	24.5	Very low	23.8	Very low	195 Å²	195	153 Å²	153	91%	0.911	82%	0.819	S	S	*	*			trans	-55.6	140.9	157	-76.9	166.5	-64.5	0	0	108.9
180	V	22.5	Very low	23.7	Very low	137 Å²	137	150.6 Å²	150.6	83%	0.83	82%	0.821	S	S	*	*			trans	-140.1	107.6	156.1	-173.7	0	0	0	0	108.4
181	S	21.6	Very low	24.2	Very low	114 Å²	114	149.5 Å²	149.5	80%	0.797	82%	0.821	S	S	*	*			trans	-75.4	140.3	156.3	-65.5	0	0	0	0	108.5
182	A	22.8	Very low	24.4	Very low	99 Å²	99	150.1 Å²	150.1	82%	0.818	82%	0.816	S	S	*	*			trans	-125.6	119.6	164.2	0	0	0	0	0	109.5
183	V	21.9	Very low	24.5	Very low	128 Å²	128	153.5 Å²	153.5	78%	0.776	82%	0.815	S	S	*	*			trans	-89	139.6	167	169.4	0	0	0	0	107.1
184	L	21	Very low	24.1	Very low	179 Å²	179	151.5 Å²	151.5	94%	0.937	81%	0.809	S	S	*	*			trans	-132.2	130.8	160.7	-94.8	163.4	0	0	0	110
185	D	21.1	Very low	24	Very low	138 Å²	138	153.2 Å²	153.2	74%	0.738	81%	0.81	S	S	*	*			trans	-120.3	141.3	-166.5	-161.5	-7	0	0	0	107.7
186	I	23.7	Very low	23.9	Very low	164 Å²	164	151.6 Å²	151.6	84%	0.841	81%	0.806	S	S	*	*			trans	-131.6	89.3	171.6	-56.5	-180	0	0	0	109.3
187	R	25.7	Very low	23.8	Very low	204 Å²	204	145.4 Å²	145.4	77%	0.77	80%	0.8	S	S	*	*			trans	25.1	115.2	134.7	-78.5	-172.6	152.9	146.9	4	119.1
188	E	22.7	Very low	23.9	Very low	151 Å²	151	139.4 Å²	139.4	71%	0.706	79%	0.791	S	S	*	*				94.1	103.9	81.6	-86.4	179.4	153.8	0	0	113.1
189	F	22	Very low	23.9	Very low	216 Å²	216	144.8 Å²	144.8	95%	0.947	80%	0.798	S	S	*	*			trans	-147.8	106.5	139.6	-89.9	-75.4	0	0	0	108.6
190	S	22.8	Very low	24	Very low	110 Å²	110	143.1 Å²	143.1	77%	0.769	79%	0.793	S	S	*	*			trans	-102.2	175.3	155.9	-59.6	0	0	0	0	107.5
191	P	34.1	Very low	24	Very low	115 Å²	115	143.4 Å²	143.4	75%	0.747	79%	0.789	S	S	*	*			cis	-140.1	-158	11.7	43.4	-20.8	0	0	0	111.4
192	P	29.8	Very low	24.4	Very low	111 Å²	111	146.5 Å²	146.5	72%	0.721	79%	0.791	S	S	*	*			cis	-135.3	155.8	3.9	37.6	-16.3	0	0	0	119.3
193	E	25.2	Very low	24.4	Very low	177 Å²	177	150.2 Å²	150.2	83%	0.827	79%	0.791	S	S	*	*			trans	20.3	124	137.2	-52.6	-87.8	131	0	0	119.5
194	E	22.4	Very low	24.7	Very low	177 Å²	177	149.8 Å²	149.8	83%	0.827	79%	0.794	S	S	*	*				-179.3	116.4	111.7	-102.3	-178.2	163.5	0	0	112.9
195	S	21.9	Very low	24.9	Very low	100 Å²	100	146.2 Å²	146.2	70%	0.699	78%	0.784	S	S	*	*			trans	72.1	131	132.3	83.8	0	0	0	0	121.9
196	T	23.4	Very low	25.5	Very low	121 Å²	121	147.7 Å²	147.7	74%	0.742	79%	0.792	S	S	*	*			trans	86.9	101.3	141.7	-18.3	0	0	0	0	118.6
197	S	23.1	Very low	25.8	Very low	113 Å²	113	145.5 Å²	145.5	79%	0.79	79%	0.786	S	S	*	*			trans	-55.4	149.4	150.4	-56.5	0	0	0	0	110.7
198	P	27.1	Very low	26.2	Very low	110 Å²	110	144.5 Å²	144.5	71%	0.714	79%	0.79	S	S	*	*				-146.2	144.9	113.1	31.4	-13.2	0	0	0	115.8
199	Q	23.4	Very low	26.5	Very low	182 Å²	182	142.2 Å²	142.2	85%	0.85	79%	0.79	S	S	*	*				42.6	129.1	129.1	-60	-177.5	-13.4	0	0	121.7
200	I	25	Very low	27	Very low	159 Å²	159	142.3 Å²	142.3	82%	0.815	79%	0.785	S	S	*	*			trans	-41.5	127.5	156.6	-61.3	160.5	0	0	0	111.6
201	I	23.5	Very low	27.5	Very low	143 Å²	143	145.3 Å²	145.3	73%	0.733	79%	0.786	S	S	*	*			trans	-133.7	116	154.5	-65.2	178.9	0	0	0	107.3	Q203	I201-Q203 HydrophobicContact CG2-CG 4.14Å
202	E	29.5	Very low	27.4	Very low	180 Å²	180	143.7 Å²	143.7	84%	0.841	78%	0.778	S	S	*	*			trans	-63.7	124.1	161.6	-67.8	-179.1	140.9	0	0	109.2
203	Q	24.3	Very low	27.7	Very low	176 Å²	176	142.5 Å²	142.5	82%	0.822	76%	0.764	S	S	*	*			trans	-139	114.4	152.5	-73.9	-169.3	2.2	0	0	109.9	I201	I201-Q203 HydrophobicContact CG2-CG 4.14Å
204	S	26.7	Very low	28	Very low	120 Å²	120	139.2 Å²	139.2	84%	0.839	75%	0.752	S	S	*	*			trans	-52.4	129.9	162.9	51.9	0	0	0	0	111.4
205	S	25	Very low	28.9	Very low	104 Å²	104	136.4 Å²	136.4	73%	0.727	73%	0.734	S	S	*	*			trans	-146.7	121.2	147.5	54.8	0	0	0	0	109.1	V207	S205-V207 PolarHBondContact O-N 3.25Å
206	D	34.1	Very low	29.6	Very low	169 Å²	169	135.9 Å²	135.9	90%	0.904	72%	0.722	S	S	*	*			trans	-55.5	112.9	172.4	-64.8	-65.6	0	0	0	110.1
207	V	29.6	Very low	30.2	Very low	117 Å²	117	132.9 Å²	132.9	71%	0.709	70%	0.702	S	S	*	*			trans	-127	92.8	160.2	-176.3	0	0	0	0	107	S205 S209	S205-V207 PolarHBondContact O-N 3.25Å; V207-S209 PolarHBondContact O-N 2.86Å; V207-S209 PolarHBondContact O-OG 3.14Å
208	E	34.1	Very low	30.6	Very low	184 Å²	184	140.3 Å²	140.3	86%	0.86	71%	0.713	S	S	*	*			trans	-51	103.1	170.4	-158.7	162.7	-156.6	0	0	108.8	R210	E208-R210 PolarHBondContact O-N 3.48Å
209	S	29	Very low	30.8	Very low	102 Å²	102	138.9 Å²	138.9	71%	0.713	71%	0.71	S	S	*	*			trans	-73.9	98.9	-175.5	-47.8	0	0	0	0	108.2	V207 E211	V207-S209 PolarHBondContact O-N 2.86Å; V207-S209 PolarHBondContact O-OG 3.14Å; S209-E211 PolarHBondContact O-N 3.32Å; S209-E211 VanDerWaalsContact O-N 3.16Å
210	R	34.1	Very low	31.2	Very low	218 Å²	218	132.4 Å²	132.4	82%	0.823	69%	0.692	S	S	*	*			trans	-65.9	108.5	174.1	-70.6	175.8	166.6	-178.8	-6	109.3	E208	E208-R210 PolarHBondContact O-N 3.48Å
211	E	31.2	Very low	31.5	Very low	173 Å²	173	129 Å²	129	81%	0.808	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-76.7	124.4	180	-66.9	-175.7	161.8	0	0	111.6	S209	S209-E211 PolarHBondContact O-N 3.32Å; S209-E211 VanDerWaalsContact O-N 3.16Å
212	S	33.5	Very low	32.1	Very low	81 Å²	81	127.5 Å²	127.5	57%	0.566	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-78.9	120.5	170.7	-28	0	0	0	0	109.3
213	I	36	Very low	32.7	Very low	86 Å²	86	123.7 Å²	123.7	44%	0.441	64%	0.637	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.1	120.3	-180	-57	174	0	0	0	108.9	R215 E225	I213-R215 HydrophobicContact CG2-CG 4.13Å; I213-E225 PolarHBondContact O-N 3.11Å
214	L	32	Very low	33.3	Very low	108 Å²	108	119.2 Å²	119.2	57%	0.565	62%	0.621	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.8	131.9	172.4	-108.7	118.7	0	0	0	110.3	W222 V224	L214-W222 HydrophobicContact CD2-CB 4.46Å; L214-W222 HydrophobicContact CD2-CD2 4.39Å; L214-W222 HydrophobicContact CD2-CE3 3.64Å; L214-W222 HydrophobicContact CD2-CZ3 4.25Å; L214-V224 HydrophobicContact CD1-CG2 4.28Å; L214-V224 HydrophobicContact CG-CG2 4.1Å
215	R	40.6	Very low	34	Very low	118 Å²	118	118.1 Å²	118.1	45%	0.445	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.4	156.7	179.7	-70.7	-171.3	156	133.1	0.8	112.2	I213 W222 Y223 E225	I213-R215 HydrophobicContact CG2-CG 4.13Å; R215-W222 WeakPolarHBondContact O-CA 3.31Å; R215-Y223 HydrophobicContact CB-CE1 3.92Å; R215-Y223 HydrophobicContact CB-CE2 4.12Å; R215-Y223 PolarHBondContact N-O 2.88Å; R215-Y223 PolarHBondContact O-N 3.27Å; R215-E225 IonicContact CZ-OE2 3.73Å; R215-E225 IonicContact NH1-OE2 3.31Å; R215-E225 PolarHBondContact NH1-OE2 3.38Å
216	I	35.5	Very low	34.6	Very low	89 Å²	89	117.8 Å²	117.8	46%	0.456	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.6	131.8	176.6	-61.7	173.6	0	0	0	109.1	Q221 W222	I216-Q221 WeakPolarHBondContact CA-O 3.37Å; I216-W222 HydrophobicContact CD1-CD2 4.03Å; I216-W222 HydrophobicContact CD1-CE3 3.93Å; I216-W222 HydrophobicContact CD1-CH2 3.26Å; I216-W222 HydrophobicContact CD1-CZ2 3.29Å; I216-W222 HydrophobicContact CD1-CZ3 3.57Å; I216-W222 HydrophobicContact CG1-CD2 3.51Å; I216-W222 HydrophobicContact CG1-CE3 3.31Å; I216-W222 HydrophobicContact CG1-CG 4.31Å; I216-W222 HydrophobicContact CG1-CH2 3.69Å; I216-W222 HydrophobicContact CG1-CZ2 3.8Å; I216-W222 HydrophobicContact CG1-CZ3 3.42Å; I216-W222 VanDerWaalsContact CG1-CZ3 3.42Å
217	N	36.9	Very low	34.7	Very low	58 Å²	58	113 Å²	113	31%	0.31	59%	0.587	S	S	.	*			trans	-80.7	168.8	172.4	74.1	11.2	0	0	0	111.9	A219 G220 Q221 Y223	N217-A219 PolarHBondContact O-N 2.91Å; N217-A219 WeakPolarHBondContact OD1-CA 3.35Å; N217-A219 WeakPolarHBondContact OD1-CB 3.36Å; N217-A219 PolarHBondContact OD1-N 3.39Å; N217-G220 PolarHBondContact O-N 3.49Å; N217-G220 PolarHBondContact OD1-N 3.13Å; N217-G220 VanDerWaalsContact OD1-N 3.14Å; N217-Q221 PolarHBondContact N-O 3.33Å; N217-Q221 PolarHBondContact ND2-OE1 3.18Å; N217-Q221 PolarHBondContact OD1-N 2.85Å; N217-Y223 HydrophobicContact CB-CE1 4.34Å
218	R	30.7	Very low	34.9	Very low	270 Å²	270	115 Å²	115	100%	1.019	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-8.1	179.4	-66.5	-176.4	179.8	179.1	-0.1	114.6
219	A	31.1	Very low	34.9	Very low	79 Å²	79	111 Å²	111	65%	0.653	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	6.3	176.1	0	0	0	0	0	113.4	N217	N217-A219 PolarHBondContact O-N 2.91Å; N217-A219 WeakPolarHBondContact OD1-CA 3.35Å; N217-A219 WeakPolarHBondContact OD1-CB 3.36Å; N217-A219 PolarHBondContact OD1-N 3.39Å
220	G	32.3	Very low	34.9	Very low	47 Å²	47	113.7 Å²	113.7	49%	0.485	60%	0.598	S	S	.	*	S	Bend	trans	81.5	14	176.8	0	0	0	0	0	115.2	N217	N217-G220 PolarHBondContact O-N 3.49Å; N217-G220 PolarHBondContact OD1-N 3.13Å; N217-G220 VanDerWaalsContact OD1-N 3.14Å
221	Q	31.9	Very low	35	Very low	88 Å²	88	112.4 Å²	112.4	41%	0.411	60%	0.601	S	S	.	*			trans	-96.6	136	-179.8	-58	169.8	-34.5	0	0	111	I216 N217	I216-Q221 WeakPolarHBondContact CA-O 3.37Å; N217-Q221 PolarHBondContact N-O 3.33Å; N217-Q221 PolarHBondContact ND2-OE1 3.18Å; N217-Q221 PolarHBondContact OD1-N 2.85Å
222	W	36.8	Very low	35.1	Very low	110 Å²	110	107.9 Å²	107.9	42%	0.417	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.2	138.4	-178.4	-61.4	87.3	0	0	0	111.7	V50 L214 R215 I216	V50-W222 HydrophobicContact CG2-CH2 4.43Å; L214-W222 HydrophobicContact CD2-CB 4.46Å; L214-W222 HydrophobicContact CD2-CD2 4.39Å; L214-W222 HydrophobicContact CD2-CE3 3.64Å; L214-W222 HydrophobicContact CD2-CZ3 4.25Å; R215-W222 WeakPolarHBondContact O-CA 3.31Å; I216-W222 HydrophobicContact CD1-CD2 4.03Å; I216-W222 HydrophobicContact CD1-CE3 3.93Å; I216-W222 HydrophobicContact CD1-CH2 3.26Å; I216-W222 HydrophobicContact CD1-CZ2 3.29Å; I216-W222 HydrophobicContact CD1-CZ3 3.57Å; I216-W222 HydrophobicContact CG1-CD2 3.51Å; I216-W222 HydrophobicContact CG1-CE3 3.31Å; I216-W222 HydrophobicContact CG1-CG 4.31Å; I216-W222 HydrophobicContact CG1-CH2 3.69Å; I216-W222 HydrophobicContact CG1-CZ2 3.8Å; I216-W222 HydrophobicContact CG1-CZ3 3.42Å; I216-W222 VanDerWaalsContact CG1-CZ3 3.42Å
223	Y	41.8	Very low	34.8	Very low	100 Å²	100	108.9 Å²	108.9	39%	0.392	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-142	154.6	170.8	66.7	-83.9	0	0	0	111.1	R215 N217 E225	R215-Y223 HydrophobicContact CB-CE1 3.92Å; R215-Y223 HydrophobicContact CB-CE2 4.12Å; R215-Y223 PolarHBondContact N-O 2.88Å; R215-Y223 PolarHBondContact O-N 3.27Å; N217-Y223 HydrophobicContact CB-CE1 4.34Å; Y223-E225 HydrophobicContact CE2-CB 4.38Å
224	V	37	Very low	35	Very low	82 Å²	82	116.8 Å²	116.8	50%	0.497	64%	0.639	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.7	122.8	177.8	-178.2	0	0	0	0	108.2	L214 T226	L214-V224 HydrophobicContact CD1-CG2 4.28Å; L214-V224 HydrophobicContact CG-CG2 4.1Å; V224-T226 HydrophobicContact CG1-CG2 4.24Å
225	E	40.2	Very low	35	Very low	97 Å²	97	117.1 Å²	117.1	45%	0.453	65%	0.65	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99	108.5	176.9	-162.3	171.7	-167.6	0	0	108.7	I213 R215 Y223	I213-E225 PolarHBondContact O-N 3.11Å; R215-E225 IonicContact CZ-OE2 3.73Å; R215-E225 IonicContact NH1-OE2 3.31Å; R215-E225 PolarHBondContact NH1-OE2 3.38Å; Y223-E225 HydrophobicContact CE2-CB 4.38Å
226	T	38.4	Very low	34.5	Very low	97 Å²	97	115 Å²	115	60%	0.595	67%	0.665	S	S	*	*			trans	-96.6	112.4	172.9	52.4	0	0	0	0	108.6	V224 L228	V224-T226 HydrophobicContact CG1-CG2 4.24Å; T226-L228 PolarHBondContact O-N 2.89Å; T226-L228 VanDerWaalsContact O-N 3.1Å
227	G	36.2	Very low	34.6	Very low	69 Å²	69	118.7 Å²	118.7	71%	0.711	69%	0.686	S	S	*	*			trans	-68.1	107.8	-178.2	0	0	0	0	0	112.1
228	L	34.2	Very low	34	Very low	159 Å²	159	122.8 Å²	122.8	83%	0.832	70%	0.703	S	S	*	*			trans	-96.1	102.8	158.3	-90.3	158.8	0	0	0	107.7	T226	T226-L228 PolarHBondContact O-N 2.89Å; T226-L228 VanDerWaalsContact O-N 3.1Å
229	A	32.6	Very low	34.1	Very low	101 Å²	101	116.4 Å²	116.4	84%	0.835	69%	0.694	S	S	*	*			trans	-83.1	109.3	157.8	0	0	0	0	0	107
230	D	30.5	Very low	34	Very low	157 Å²	157	121.3 Å²	121.3	84%	0.84	70%	0.695	S	S	*	*			trans	-133	130.1	146.9	-139.4	-6	0	0	0	110
231	Q	35.9	Very low	33.9	Very low	192 Å²	192	124.3 Å²	124.3	90%	0.897	70%	0.704	S	S	*	*			trans	-76.2	126.5	-176.9	-70	-179.5	9.5	0	0	109.3
232	G	32.7	Very low	33.7	Very low	78 Å²	78	127.7 Å²	127.7	80%	0.804	72%	0.724	S	S	*	*			trans	98.7	85.1	151.8	0	0	0	0	0	116.5
233	A	27.1	Very low	33.3	Very low	102 Å²	102	124.9 Å²	124.9	84%	0.843	73%	0.729	S	S	*	*			trans	-170.9	124.2	131	0	0	0	0	0	109.4	S235	A233-S235 PolarHBondContact O-N 3.49Å
234	R	40.9	Very low	32.5	Very low	251 Å²	251	123 Å²	123	95%	0.947	74%	0.735	S	S	*	*			trans	-67	121.2	167.1	-76.9	177.1	168.8	173.1	-3.6	109.2
235	S	32.3	Very low	32	Very low	116 Å²	116	124.3 Å²	124.3	81%	0.811	74%	0.742	S	S	*	*				168.6	126.4	126.7	59	0	0	0	0	110.7	A233	A233-S235 PolarHBondContact O-N 3.49Å
236	G	30.5	Very low	31.3	Very low	74 Å²	74	126.2 Å²	126.2	76%	0.763	75%	0.751	S	S	*	*			trans	67.1	119.1	148.8	0	0	0	0	0	118.6
237	D	36.3	Very low	30.7	Very low	166 Å²	166	128.4 Å²	128.4	89%	0.888	76%	0.757	S	S	*	*			trans	33.5	113	149.3	-66.3	-15.6	0	0	0	120
238	E	25.7	Very low	30.1	Very low	144 Å²	144	132.2 Å²	132.2	67%	0.673	76%	0.755	S	S	*	*				-170	93.1	121.4	-119.1	-173.3	173.3	0	0	109.7	R240	E238-R240 HydrophobicContact CB-CG 4.45Å; E238-R240 HydrophobicContact CG-CG 4.4Å; E238-R240 PolarHBondContact O-N 3.18Å; E238-R240 IonicContact OE1-NE 2.85Å; E238-R240 IonicContact OE2-CZ 3.31Å; E238-R240 VanDerWaalsContact OE2-CZ 3.31Å; E238-R240 IonicContact OE2-NE 2.85Å; E238-R240 PolarHBondContact OE2-NE 3.21Å; E238-R240 IonicContact OE2-NH2 3.54Å; E238-R240 PolarHBondContact OE2-NH2 3.13Å
239	V	31.2	Very low	29.8	Very low	136 Å²	136	131.3 Å²	131.3	82%	0.824	76%	0.756	S	S	*	*			trans	-75.7	98.8	156.4	177.4	0	0	0	0	105.9	V241	V239-V241 HydrophobicContact CG1-CG2 4.36Å; V239-V241 PolarHBondContact O-N 3.11Å; V239-V241 VanDerWaalsContact O-N 3.08Å
240	R	29.9	Very low	29.9	Very low	182 Å²	182	132.1 Å²	132.1	69%	0.687	74%	0.742	S	S	*	*			trans	-74.4	98.1	171.4	-71.4	-172.5	-173.1	-177.8	3.5	109	E238 L242	E238-R240 HydrophobicContact CB-CG 4.45Å; E238-R240 HydrophobicContact CG-CG 4.4Å; E238-R240 PolarHBondContact O-N 3.18Å; E238-R240 IonicContact OE1-NE 2.85Å; E238-R240 IonicContact OE2-CZ 3.31Å; E238-R240 VanDerWaalsContact OE2-CZ 3.31Å; E238-R240 IonicContact OE2-NE 2.85Å; E238-R240 PolarHBondContact OE2-NE 3.21Å; E238-R240 IonicContact OE2-NH2 3.54Å; E238-R240 PolarHBondContact OE2-NH2 3.13Å; R240-L242 PolarHBondContact O-N 3.33Å
241	V	30	Very low	29.8	Very low	110 Å²	110	132.5 Å²	132.5	67%	0.667	74%	0.744	S	S	*	*			trans	-67.2	95.5	166	-179.4	0	0	0	0	107.5	V239 G243	V239-V241 HydrophobicContact CG1-CG2 4.36Å; V239-V241 PolarHBondContact O-N 3.11Å; V239-V241 VanDerWaalsContact O-N 3.08Å; V241-G243 PolarHBondContact O-N 2.96Å
242	L	28.3	Very low	29.8	Very low	159 Å²	159	130.6 Å²	130.6	83%	0.832	74%	0.739	S	S	*	*			trans	-77.7	76.6	172.4	-68.9	173.3	0	0	0	109.2	R240	R240-L242 PolarHBondContact O-N 3.33Å
243	G	27.6	Very low	29.8	Very low	51 Å²	51	135.7 Å²	135.7	53%	0.526	74%	0.742	S	S	.	*			trans	79.9	118	168.7	0	0	0	0	0	114.9	V241	V241-G243 PolarHBondContact O-N 2.96Å
244	A	24.4	Very low	29.9	Very low	61 Å²	61	139.2 Å²	139.2	50%	0.504	74%	0.742	S	S	.	*			trans	-81.3	118.8	163.8	0	0	0	0	0	108.8	H246	A244-H246 PolarHBondContact O-N 3.31Å
245	V	27.5	Very low	29	Very low	108 Å²	108	138.4 Å²	138.4	66%	0.655	74%	0.738	S	S	*	*			trans	-81.3	97.6	170.9	-178.6	0	0	0	0	108.2	I247	V245-I247 HydrophobicContact CG1-CG1 3.94Å; V245-I247 PolarHBondContact O-N 2.89Å
246	H	25.2	Very low	28.7	Very low	137 Å²	137	141.1 Å²	141.1	63%	0.634	74%	0.743	S	S	*	*			trans	-84	101.9	166	-96.3	-78.6	0	0	0	108.7	A244 K248	A244-H246 PolarHBondContact O-N 3.31Å; H246-K248 PolarHBondContact O-N 3.38Å
247	I	25.7	Very low	28.4	Very low	143 Å²	143	141 Å²	141	73%	0.733	74%	0.741	S	S	*	*			trans	-79.8	97.6	165	-54.7	178.8	0	0	0	106.4	V245 T249	V245-I247 HydrophobicContact CG1-CG1 3.94Å; V245-I247 PolarHBondContact O-N 2.89Å; I247-T249 PolarHBondContact O-N 3.47Å
248	K	22.9	Very low	28.6	Very low	150 Å²	150	139 Å²	139	65%	0.652	74%	0.738	S	S	*	*			trans	-78.6	109.7	171.9	-85.5	174	164.5	-126.5	0	108.9	H246 E250	H246-K248 PolarHBondContact O-N 3.38Å; K248-E250 VanDerWaalsContact C-N 3.3Å; K248-E250 HydrophobicContact CB-CG 3.8Å; K248-E250 HydrophobicContact CD-CG 4.47Å; K248-E250 WeakPolarHBondContact CD-OE1 3.35Å; K248-E250 WeakPolarHBondContact CE-OE1 3.26Å; K248-E250 HydrophobicContact CG-CG 4.24Å; K248-E250 WeakPolarHBondContact CG-OE1 3.23Å; K248-E250 IonicContact NZ-OE1 3.57Å; K248-E250 PolarHBondContact NZ-OE1 3.06Å; K248-E250 PolarHBondContact O-N 3.43Å
249	T	29.8	Very low	28.6	Very low	140 Å²	140	140.7 Å²	140.7	86%	0.859	75%	0.746	S	S	*	*			trans	-83.6	76.3	163.6	51.1	0	0	0	0	108.5	I247	I247-T249 PolarHBondContact O-N 3.47Å
250	E	33.8	Very low	28.4	Very low	117 Å²	117	141.6 Å²	141.6	55%	0.547	75%	0.746	S	S	.	*			trans	-147.9	93.5	173.9	36.8	-179.8	-175.7	0	0	110.1	K248	K248-E250 VanDerWaalsContact C-N 3.3Å; K248-E250 HydrophobicContact CB-CG 3.8Å; K248-E250 HydrophobicContact CD-CG 4.47Å; K248-E250 WeakPolarHBondContact CD-OE1 3.35Å; K248-E250 WeakPolarHBondContact CE-OE1 3.26Å; K248-E250 HydrophobicContact CG-CG 4.24Å; K248-E250 WeakPolarHBondContact CG-OE1 3.23Å; K248-E250 IonicContact NZ-OE1 3.57Å; K248-E250 PolarHBondContact NZ-OE1 3.06Å; K248-E250 PolarHBondContact O-N 3.43Å
251	N	27.7	Very low	28.3	Very low	166 Å²	166	141.5 Å²	141.5	89%	0.888	75%	0.753	S	S	*	*				170.4	93.8	124.5	-92.8	-36	0	0	0	110
252	L	36.9	Very low	28.2	Very low	151 Å²	151	142.4 Å²	142.4	79%	0.791	76%	0.762	S	S	*	*			trans	-115.9	101	158.9	-172.7	83.6	0	0	0	104.3
253	E	33.2	Very low	28	Very low	186 Å²	186	140.1 Å²	140.1	87%	0.869	76%	0.759	S	S	*	*			trans	155.3	98.6	157.6	-90.6	176.5	-168.9	0	0	110.3
254	E	28.1	Very low	28	Very low	176 Å²	176	140.8 Å²	140.8	82%	0.822	77%	0.766	S	S	*	*			trans	-164.5	109	144.9	-137.4	160.8	-171.8	0	0	113.9
255	W	23.2	Very low	28.2	Very low	233 Å²	233	146.8 Å²	146.8	88%	0.883	78%	0.783	S	S	*	*			trans	82	135.9	143	-73.8	53.7	0	0	0	125.4
256	L	25.3	Very low	28.1	Very low	173 Å²	173	149.4 Å²	149.4	91%	0.906	79%	0.794	S	S	*	*			trans	-82.2	141.4	165	-74.9	157.8	0	0	0	111.1
257	G	24.9	Very low	28.2	Very low	71 Å²	71	146.8 Å²	146.8	73%	0.732	80%	0.804	S	S	*	*			trans	179.9	133.4	163.6	0	0	0	0	0	112
258	P	40	Very low	28.1	Very low	125 Å²	125	145.7 Å²	145.7	81%	0.812	81%	0.809	S	S	*	*			trans	-95	125.6	-165.6	34.8	-27.3	0	0	0	111.4
259	E	26	Very low	28.2	Very low	180 Å²	180	143.7 Å²	143.7	84%	0.841	81%	0.813	S	S	*	*			trans	-165.2	103.1	159.9	-113.9	166.5	-156.5	0	0	111.1
260	N	25.9	Very low	28	Very low	154 Å²	154	141.7 Å²	141.7	82%	0.824	81%	0.811	S	S	*	*				160.3	105.4	125.3	-82.8	-46.6	0	0	0	110.5
261	Q	28.1	Very low	27.5	Very low	180 Å²	180	144.9 Å²	144.9	84%	0.841	83%	0.826	S	S	*	*			trans	-66.3	149.4	154.3	-78.1	177.8	-5.1	0	0	109.4
262	P	27.3	Very low	27.4	Very low	130 Å²	130	145.6 Å²	145.6	84%	0.844	82%	0.824	S	S	*	*			trans	-116.1	123.9	137.8	28.5	-16.7	0	0	0	110.4
263	S	25.1	Very low	26.8	Very low	111 Å²	111	144.7 Å²	144.7	78%	0.776	83%	0.825	S	S	*	*			trans	-74.6	146.5	168.5	39.6	0	0	0	0	112.7
264	G	26.4	Very low	26.6	Very low	65 Å²	65	141.5 Å²	141.5	67%	0.67	82%	0.818	S	S	*	*			trans	95.9	101.9	164	0	0	0	0	0	114
265	E	29.1	Very low	26.5	Very low	187 Å²	187	135.3 Å²	135.3	87%	0.874	80%	0.797	S	S	*	*				56	103.7	92.4	-62.9	-172.1	159.9	0	0	111
266	D	26.2	Very low	26.8	Very low	163 Å²	163	129 Å²	129	87%	0.872	78%	0.779	S	S	*	*				-152.6	149.5	79.8	-78.6	-41	0	0	0	113.9
267	G	27.1	Very low	27	Very low	82 Å²	82	125.3 Å²	125.3	85%	0.845	76%	0.763	S	S	*	*			trans	-74.5	135.7	-179.5	0	0	0	0	0	114.4
268	S	24.2	Very low	27.3	Very low	119 Å²	119	123.1 Å²	123.1	83%	0.832	73%	0.734	S	S	*	*			trans	-157.4	146.8	146.8	-165	0	0	0	0	109.9
269	S	24.6	Very low	26.9	Very low	108 Å²	108	120.9 Å²	120.9	76%	0.755	72%	0.715	S	S	*	*			trans	-38.6	132.6	-166.2	50.2	0	0	0	0	117.8
270	A	24.6	Very low	27.3	Very low	99 Å²	99	116.2 Å²	116.2	82%	0.818	70%	0.7	S	S	*	*			trans	-66.3	123.1	168.8	0	0	0	0	0	112.4
271	E	23.1	Very low	27.8	Very low	184 Å²	184	111.7 Å²	111.7	86%	0.86	68%	0.678	S	S	*	*			trans	-101.1	120.6	149.7	-74.1	-172.8	153.1	0	0	107.4	V273	E271-V273 PolarHBondContact O-N 3.43Å; E271-V273 VanDerWaalsContact O-N 3.14Å
272	E	25.9	Very low	27.9	Very low	181 Å²	181	105.9 Å²	105.9	85%	0.846	67%	0.666	S	S	*	*			trans	-65.1	108.9	179.8	-80.7	-177	139.4	0	0	110.9	T274	E272-T274 PolarHBondContact O-N 3.41Å
273	V	24.7	Very low	27.9	Very low	132 Å²	132	109.6 Å²	109.6	80%	0.8	67%	0.671	S	S	*	*			trans	-70.8	112.5	170.5	-178.6	0	0	0	0	108.9	E271 A275	E271-V273 PolarHBondContact O-N 3.43Å; E271-V273 VanDerWaalsContact O-N 3.14Å; V273-A275 WeakPolarHBondContact CG1-O 3.4Å
274	T	28.2	Very low	27.9	Very low	119 Å²	119	107.5 Å²	107.5	73%	0.73	67%	0.668	S	S	*	*			trans	-92.7	13.2	-175.6	40	0	0	0	0	114.7	E272	E272-T274 PolarHBondContact O-N 3.41Å
275	A	27.1	Very low	28	Very low	46 Å²	46	110.4 Å²	110.4	38%	0.38	68%	0.678	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-140.7	126.9	175.9	0	0	0	0	0	111.2	V273	V273-A275 WeakPolarHBondContact CG1-O 3.4Å
276	M	29	Very low	27.9	Very low	100 Å²	100	109.9 Å²	109.9	49%	0.493	68%	0.679	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.9	119.3	173.7	-174	179.3	-71.5	0	0	109.1	C95 L96 I123 I278	C95-M276 WeakPolarHBondContact CA-O 3.45Å; L96-M276 PolarHBondContact N-O 3.21Å; L96-M276 PolarHBondContact O-N 3.31Å; I123-M276 HydrophobicContact CD1-CE 4.48Å; I123-M276 HydrophobicContact CD1-SD 3.56Å; I123-M276 VanDerWaalsContact CD1-SD 3.56Å; I123-M276 HydrophobicContact CG1-CE 4.2Å; I123-M276 HydrophobicContact CG1-SD 3.72Å; M276-I278 HydrophobicContact CG-CG1 4.31Å
277	V	29	Very low	27.8	Very low	96 Å²	96	105.3 Å²	105.3	58%	0.582	67%	0.671	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94	123.4	174.5	-171.3	0	0	0	0	108.5
278	I	32.1	Very low	27.7	Very low	25 Å²	25	110.6 Å²	110.6	13%	0.128	67%	0.673	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.4	125	177.8	-55.7	173.9	0	0	0	108.6	R93 I94 L96 K119 I123 M276 T280	R93-I278 VanDerWaalsContact CA-O 3.24Å; R93-I278 WeakPolarHBondContact CA-O 3.37Å; I94-I278 HydrophobicContact CG2-CB 4.31Å; I94-I278 HydrophobicContact CG2-CD1 4.42Å; I94-I278 PolarHBondContact N-O 3.04Å; I94-I278 PolarHBondContact O-N 3.23Å; L96-I278 HydrophobicContact CD1-CD1 4.06Å; K119-I278 HydrophobicContact CB-CD1 3.98Å; K119-I278 HydrophobicContact CD-CD1 4.3Å; K119-I278 HydrophobicContact CG-CD1 4.21Å; I123-I278 HydrophobicContact CD1-CD1 4.37Å; M276-I278 HydrophobicContact CG-CG1 4.31Å; I278-T280 HydrophobicContact CG2-CG2 4.23Å
279	D	31.1	Very low	27.6	Very low	77 Å²	77	112.8 Å²	112.8	41%	0.412	67%	0.67	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.2	124.4	171	-163	-22	0	0	0	109.6	R93 T281	R93-D279 HydrophobicContact CG-CB 4.36Å; R93-D279 IonicContact CZ-OD2 2.68Å; R93-D279 VanDerWaalsContact CZ-OD2 3.25Å; R93-D279 IonicContact NE-OD1 2.86Å; R93-D279 IonicContact NE-OD2 3.36Å; R93-D279 PolarHBondContact NE-OD2 3.37Å; R93-D279 IonicContact NH2-OD2 2.65Å; R93-D279 PolarHBondContact NH2-OD2 3.06Å; D279-T281 PolarHBondContact OD1-N 3.15Å; D279-T281 PolarHBondContact OD1-OG1 3.45Å
280	T	34.5	Very low	27.4	Very low	83 Å²	83	112 Å²	112	51%	0.509	67%	0.665	S	S	.	*			trans	-106.4	8.8	178	57.7	0	0	0	0	112.9	G92 I278	G92-T280 PolarHBondContact O-N 3.36Å; G92-T280 PolarHBondContact O-OG1 3.13Å; I278-T280 HydrophobicContact CG2-CG2 4.23Å
281	T	36.1	Very low	27.3	Very low	59 Å²	59	117 Å²	117	36%	0.362	66%	0.664	S	S	.	*			trans	-115	31.7	-169	60	0	0	0	0	114.9	D279	D279-T281 PolarHBondContact OD1-N 3.15Å; D279-T281 PolarHBondContact OD1-OG1 3.45Å
282	G	29.8	Very low	27.3	Very low	58 Å²	58	113.8 Å²	113.8	60%	0.598	66%	0.662	S	S	*	*			trans	-121	110.6	-178.9	0	0	0	0	0	114.5
283	H	27.9	Very low	27.2	Very low	207 Å²	207	113.9 Å²	113.9	96%	0.958	67%	0.668	S	S	*	*			trans	-142.6	112	146.8	-87.6	-70.6	0	0	0	109.8
284	G	25.1	Very low	27.1	Very low	68 Å²	68	110.8 Å²	110.8	70%	0.701	66%	0.663	S	S	*	*			trans	-113.1	131.5	165.8	0	0	0	0	0	110.4
285	S	29	Very low	26.8	Very low	125 Å²	125	110.3 Å²	110.3	87%	0.874	66%	0.664	S	S	*	*			trans	54.5	115.3	143.5	-45.4	0	0	0	0	120.3
286	I	26.8	Very low	26.7	Very low	176 Å²	176	114.4 Å²	114.4	90%	0.903	68%	0.679	S	S	*	*			trans	-122.6	131.6	146	-76.7	178.4	0	0	0	109.1
287	G	24.2	Very low	26.4	Very low	68 Å²	68	117.7 Å²	117.7	70%	0.701	69%	0.693	S	S	*	*			trans	-76.1	167.9	-174.8	0	0	0	0	0	114.8
288	Q	24.7	Very low	26.2	Very low	192 Å²	192	117.8 Å²	117.8	90%	0.897	70%	0.703	S	S	*	*			trans	-50.8	129.5	167.7	-65.9	171.4	-84.1	0	0	111.4
289	E	22.4	Very low	25.8	Very low	165 Å²	165	125.9 Å²	125.9	77%	0.771	74%	0.738	S	S	*	*			trans	-135.8	125.2	133.5	-74.9	-163.7	148.9	0	0	109.6
290	S	20.1	Very low	25.5	Very low	93 Å²	93	129 Å²	129	65%	0.65	76%	0.759	S	S	*	*			trans	-95.5	129.1	-175.6	46.8	0	0	0	0	110.5
291	Y	21.9	Very low	24.9	Very low	202 Å²	202	129.5 Å²	129.5	79%	0.792	77%	0.772	S	S	*	*			trans	-138	124.6	150.2	-45.3	-75	0	0	0	109.8
292	S	23.2	Very low	24.3	Very low	117 Å²	117	138.3 Å²	138.3	82%	0.818	80%	0.799	S	S	*	*			trans	-86.8	139.7	-177.9	-50.9	0	0	0	0	111.7
293	L	24.2	Very low	24.2	Very low	184 Å²	184	140.6 Å²	140.6	96%	0.963	80%	0.803	S	S	*	*			trans	-167.7	120.3	149.2	-98.1	159.1	0	0	0	103.9
294	G	22.5	Very low	23.9	Very low	67 Å²	67	136.7 Å²	136.7	69%	0.691	79%	0.794	S	S	*	*			cis	144.1	98.7	19.4	0	0	0	0	0	106.2
295	S	23.3	Very low	23.8	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	80%	0.795	S	S	*	*			trans	58.8	123.6	151.2	-76.8	0	0	0	0	123.1
296	L	24.3	Very low	23.6	Very low	131 Å²	131	137.3 Å²	137.3	69%	0.686	79%	0.787	S	S	*	*				84.3	115.8	125.8	-93.8	85.3	0	0	0	121.2
297	E	22.9	Very low	23.5	Very low	170 Å²	170	137.1 Å²	137.1	79%	0.794	78%	0.783	S	S	*	*				59.1	118.9	124.5	-67.8	-179.1	166.1	0	0	119.5
298	A	24.7	Very low	23.5	Very low	97 Å²	97	139.1 Å²	139.1	80%	0.802	78%	0.781	S	S	*	*				173.9	130.8	93.5	0	0	0	0	0	113.6
299	K	23.6	Very low	23.3	Very low	196 Å²	196	136 Å²	136	85%	0.852	77%	0.771	S	S	*	*			trans	5.9	130.3	145.6	-75.1	169.5	174.6	170.6	0	120.6
300	V	24	Very low	23.4	Very low	141 Å²	141	138.3 Å²	138.3	86%	0.855	77%	0.772	S	S	*	*				50.1	114.5	121.3	-173.3	0	0	0	0	118.2
301	A	22.2	Very low	23.5	Very low	95 Å²	95	143.2 Å²	143.2	79%	0.785	78%	0.782	S	S	*	*				-168.2	123.8	127.8	0	0	0	0	0	111.5
302	R	24.3	Very low	23.7	Very low	243 Å²	243	138.7 Å²	138.7	92%	0.917	78%	0.78	S	S	*	*			trans	-86.6	147.4	143.6	-97.4	-178.2	176.1	166.8	-0.5	106
303	P	26.6	Very low	24.4	Very low	106 Å²	106	138.9 Å²	138.9	69%	0.688	78%	0.779	S	S	*	*				-156.3	162.1	82.8	40	-19.1	0	0	0	118.1
304	T	22.6	Very low	24.4	Very low	125 Å²	125	136 Å²	136	77%	0.767	77%	0.774	S	S	*	*			trans	55.6	117.3	138.9	56.3	0	0	0	0	124.3
305	S	23.1	Very low	24.4	Very low	104 Å²	104	136.8 Å²	136.8	73%	0.727	78%	0.782	S	S	*	*			trans	28.1	145.9	132.2	70.5	0	0	0	0	124.8
306	S	24.7	Very low	24.4	Very low	102 Å²	102	137.6 Å²	137.6	71%	0.713	79%	0.787	S	S	*	*			trans	69.4	140.8	150.9	59.9	0	0	0	0	116.9
307	E	24.3	Very low	24.4	Very low	173 Å²	173	137 Å²	137	81%	0.808	79%	0.789	S	S	*	*			cis	-174.1	151.1	6.3	-116.4	179	172	0	0	107.7
308	V	24.1	Very low	24.4	Very low	109 Å²	109	135.8 Å²	135.8	66%	0.661	79%	0.793	S	S	*	*			trans	82.1	126.1	138.5	-176	0	0	0	0	122.5
309	D	21.4	Very low	24.3	Very low	128 Å²	128	135.6 Å²	135.6	68%	0.684	79%	0.786	S	S	*	*			trans	74.3	115.1	147.5	-77.1	-15.2	0	0	0	123.5
310	R	23.1	Very low	24.3	Very low	212 Å²	212	134.2 Å²	134.2	80%	0.8	78%	0.784	S	S	*	*				163.9	130.1	95.3	-79.6	-157.6	-168.1	100.4	8.3	113.4
311	F	22.8	Very low	24.4	Very low	196 Å²	196	133.7 Å²	133.7	86%	0.86	78%	0.782	S	S	*	*			trans	46.1	117.5	139.6	-76.4	-89.5	0	0	0	122.2
312	S	25.3	Very low	24.5	Very low	107 Å²	107	136.9 Å²	136.9	75%	0.748	78%	0.78	S	S	*	*			trans	-63.1	168.4	148.2	-38.6	0	0	0	0	111.6
313	P	37.9	Very low	24.5	Very low	121 Å²	121	136.9 Å²	136.9	79%	0.786	78%	0.78	S	S	*	*				-154.4	166	73.7	37.7	-16.6	0	0	0	117.4
314	S	24.2	Very low	24.2	Very low	125 Å²	125	142.2 Å²	142.2	87%	0.874	79%	0.788	S	S	*	*			trans	152	109.5	144.6	-66.5	0	0	0	0	107.1
315	G	23.8	Very low	24.3	Very low	82 Å²	82	148 Å²	148	85%	0.845	80%	0.796	S	S	*	*				105.1	107.7	53.3	0	0	0	0	0	107.2
316	S	23.6	Very low	24.4	Very low	126 Å²	126	147.8 Å²	147.8	88%	0.881	80%	0.8	S	S	*	*				-169.1	151.9	81.1	-167.8	0	0	0	0	112.8
317	V	22.9	Very low	24.3	Very low	118 Å²	118	154.1 Å²	154.1	72%	0.715	81%	0.809	S	S	*	*			trans	-115.6	148.5	-177.9	166.2	0	0	0	0	108.2
318	V	22.7	Very low	24.3	Very low	146 Å²	146	150.3 Å²	150.3	89%	0.885	80%	0.801	S	S	*	*			trans	-144.7	131.7	138.8	-175.8	0	0	0	0	110.6
319	S	22.8	Very low	24.3	Very low	92 Å²	92	153.3 Å²	153.3	64%	0.643	81%	0.808	S	S	*	*			trans	-135.2	162.7	166.5	59.9	0	0	0	0	110.5
320	M	24.3	Very low	24.7	Very low	168 Å²	168	152.8 Å²	152.8	83%	0.828	81%	0.814	S	S	*	*			trans	95.1	130.6	152.7	-103.3	-177.8	-169.5	0	0	121.7
321	T	24.7	Very low	25.4	Very low	130 Å²	130	149 Å²	149	80%	0.798	82%	0.817	S	S	*	*				178.5	115.3	118.8	25.8	0	0	0	0	109.5
322	E	25	Very low	25.6	Very low	162 Å²	162	143.4 Å²	143.4	76%	0.757	82%	0.815	S	S	*	*				69	122.3	90.2	-82.4	-162	155.6	0	0	118.2
323	R	24.5	Very low	25.7	Very low	243 Å²	243	150 Å²	150	92%	0.917	82%	0.823	S	S	*	*				172.7	147.4	111.4	-91.1	177.6	-161.5	155.3	6.7	115.3
324	Y	21.3	Very low	25.4	Very low	217 Å²	217	152.1 Å²	152.1	85%	0.851	83%	0.825	S	S	*	*			trans	-66.8	153.4	179.8	-91.3	-105.8	0	0	0	117.8
325	R	23.3	Very low	25.4	Very low	247 Å²	247	154.1 Å²	154.1	93%	0.932	83%	0.826	S	S	*	*				-177.9	146.1	113.2	-104.2	-172.7	-158.6	102.2	1.5	114
326	A	25	Very low	25.7	Very low	99 Å²	99	159.1 Å²	159.1	82%	0.818	83%	0.827	S	S	*	*			trans	-102.6	158.4	-178.8	0	0	0	0	0	113.4
327	R	23.2	Very low	26.4	Very low	236 Å²	236	157.8 Å²	157.8	89%	0.891	82%	0.815	S	S	*	*			trans	-160.3	143.2	138.3	-152.1	164.9	-161.4	-147.1	-0.6	113.3
328	S	24.7	Very low	26.5	Very low	93 Å²	93	162.1 Å²	162.1	65%	0.65	83%	0.825	S	S	*	*			trans	-82.4	158.4	-175.7	49.3	0	0	0	0	115.9
329	E	23.8	Very low	26.9	Very low	171 Å²	171	164.2 Å²	164.2	80%	0.799	83%	0.825	S	S	*	*				-179.2	112.4	124.8	-98	167.3	-163.6	0	0	114.9
330	S	30.4	Very low	27	Very low	118 Å²	118	167.7 Å²	167.7	83%	0.825	84%	0.835	S	S	*	*			trans	61.5	147.7	136.2	-51.1	0	0	0	0	126.9
331	P	37.9	Very low	26.9	Very low	132 Å²	132	164.6 Å²	164.6	86%	0.857	83%	0.83	S	S	*	*			trans	-110.9	159.3	-173.6	40.8	-28.3	0	0	0	115.2
332	G	27	Very low	27.3	Very low	79 Å²	79	163.3 Å²	163.3	81%	0.814	83%	0.826	S	S	*	*			trans	-160.7	104.4	177.2	0	0	0	0	0	116.4
333	R	27	Very low	27.3	Very low	245 Å²	245	164.7 Å²	164.7	93%	0.925	83%	0.833	S	S	*	*			trans	13.7	143.4	150.5	-130.8	173.7	-176.2	-178.2	-0.4	123.7
334	M	30.6	Very low	27.5	Very low	166 Å²	166	158.9 Å²	158.9	82%	0.818	82%	0.824	S	S	*	*			trans	-41.6	147.9	178.7	-57.8	-164.3	-120.4	0	0	119.9
335	D	25.2	Very low	27.8	Very low	167 Å²	167	157.5 Å²	157.5	89%	0.893	83%	0.826	S	S	*	*				-165.2	126	124.3	-88.4	-41.2	0	0	0	110.6
336	E	28.9	Very low	28.2	Very low	186 Å²	186	154.8 Å²	154.8	87%	0.869	82%	0.823	S	S	*	*			trans	-82.4	175.1	168.7	-116.2	-166.4	105.3	0	0	109.9
337	P	40	Very low	28.7	Very low	98 Å²	98	155.5 Å²	155.5	64%	0.636	82%	0.822	S	S	*	*			cis	-133.8	156.7	-4	36.3	-18.3	0	0	0	114.4
338	K	24.9	Very low	29.3	Very low	209 Å²	209	148.8 Å²	148.8	91%	0.909	82%	0.818	S	S	*	*			trans	-175.9	139.4	143.5	-108.4	164.3	-176	176.8	0	112.5
339	Q	29.7	Very low	29.8	Very low	190 Å²	190	153.3 Å²	153.3	89%	0.888	83%	0.83	S	S	*	*			trans	-37.3	138.3	177.4	-63	176.9	-61.6	0	0	115.7
340	L	25.6	Very low	30.4	Very low	165 Å²	165	154.7 Å²	154.7	86%	0.864	84%	0.84	S	S	*	*				160.8	122	117.1	-172.7	70.8	0	0	0	110
341	S	22.9	Very low	30.8	Very low	103 Å²	103	151.6 Å²	151.6	72%	0.72	83%	0.826	S	S	*	*			trans	174	117	130.5	40.3	0	0	0	0	112.5
342	S	32	Very low	30.9	Very low	103 Å²	103	151.3 Å²	151.3	72%	0.72	82%	0.822	S	S	*	*			trans	36.9	88.2	140.7	62.2	0	0	0	0	118.5
343	Q	25.2	Very low	31.5	Very low	192 Å²	192	151.4 Å²	151.4	90%	0.897	81%	0.81	S	S	*	*			trans	-112.6	96.2	133.9	-75	-175	-13.3	0	0	106.4	E345	Q343-E345 PolarHBondContact O-N 3.46Å
344	V	28.4	Very low	31.9	Very low	120 Å²	120	142.5 Å²	142.5	73%	0.727	79%	0.794	S	S	*	*			trans	-74.1	112.2	160.6	175.8	0	0	0	0	104.4	E346	V344-E346 HydrophobicContact CG1-CB 4.38Å; V344-E346 PolarHBondContact O-N 3.26Å
345	E	28	Very low	32.2	Very low	189 Å²	189	140.8 Å²	140.8	88%	0.883	78%	0.78	S	S	*	*			trans	-59.7	89.8	158	-73.8	179.8	151.5	0	0	107.2	Q343 S347	Q343-E345 PolarHBondContact O-N 3.46Å; E345-S347 VanDerWaalsContact C-N 3.26Å; E345-S347 PolarHBondContact O-N 3.44Å; E345-S347 VanDerWaalsContact O-N 3.16Å
346	E	32.2	Very low	32.7	Very low	189 Å²	189	137 Å²	137	88%	0.883	76%	0.762	S	S	*	*			trans	-85.2	78.7	171	-160.5	167.2	-151.1	0	0	107.1	V344	V344-E346 HydrophobicContact CG1-CB 4.38Å; V344-E346 PolarHBondContact O-N 3.26Å
347	S	35.5	Very low	33	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	74%	0.743	S	S	*	*			trans	-132.1	127	167.2	-144.7	0	0	0	0	109.3	E345	E345-S347 VanDerWaalsContact C-N 3.26Å; E345-S347 PolarHBondContact O-N 3.44Å; E345-S347 VanDerWaalsContact O-N 3.16Å
348	A	36.4	Very low	32.9	Very low	96 Å²	96	134.4 Å²	134.4	79%	0.793	74%	0.737	S	S	*	*	S	Bend	trans	85.1	74.4	178.4	0	0	0	0	0	118
349	M	34	Very low	33.5	Very low	187 Å²	187	129.3 Å²	129.3	92%	0.921	72%	0.719	S	S	*	*			trans	-151.8	64.4	136.5	-89.2	-122.2	-161.4	0	0	109.8	G351	M349-G351 PolarHBondContact O-N 3.33Å
350	M	35.7	Very low	33.9	Very low	201 Å²	201	129.6 Å²	129.6	99%	0.99	71%	0.712	S	S	*	*			trans	-85.3	94.1	163.4	-77.7	-69.5	-82.5	0	0	108.2
351	G	39.1	Very low	34.3	Very low	53 Å²	53	129.3 Å²	129.3	55%	0.546	71%	0.706	S	S	.	*	S	Bend	trans	175.8	128.7	172.7	0	0	0	0	0	108.8	M349	M349-G351 PolarHBondContact O-N 3.33Å
352	V	40.5	Very low	35	Very low	126 Å²	126	129.5 Å²	129.5	76%	0.764	70%	0.696	S	S	*	*	S	Bend	trans	88.3	21	176.7	-149.7	0	0	0	0	117
353	S	38.9	Very low	35.3	Very low	80 Å²	80	133.8 Å²	133.8	56%	0.559	70%	0.704	S	S	*	*			trans	-74.8	-39.7	170.5	-156.5	0	0	0	0	113.3	Y355 V356 E357	S353-Y355 PolarHBondContact O-N 2.72Å; S353-V356 PolarHBondContact O-N 3.18Å; S353-E357 PolarHBondContact O-N 3.18Å; S353-E357 PolarHBondContact OG-OE2 3.42Å
354	G	36	Very low	36.1	Very low	58 Å²	58	127.6 Å²	127.6	60%	0.598	68%	0.68	S	S	*	*	H	α-helix	trans	-65	-30.9	-166.8	0	0	0	0	0	116.7	Y358	G354-Y358 VanDerWaalsContact O-CB 3.27Å; G354-Y358 WeakPolarHBondContact O-CB 3.49Å; G354-Y358 PolarHBondContact O-N 3.24Å
355	Y	36.4	Very low	36.7	Very low	130 Å²	130	125.3 Å²	125.3	51%	0.51	67%	0.669	S	S	.	*	H	α-helix	trans	-87	-26.5	-176.1	-166.8	-104.7	0	0	0	113.5	S353 Y358 L359	S353-Y355 PolarHBondContact O-N 2.72Å; Y355-Y358 HydrophobicContact CD2-CD1 4.08Å; Y355-Y358 AromaticContact CE2-CD1 3.89Å; Y355-Y358 HydrophobicContact CE2-CD1 3.89Å; Y355-Y358 HydrophobicContact CE2-CE1 4.31Å; Y355-L359 HydrophobicContact CD1-CD1 3.96Å; Y355-L359 HydrophobicContact CD1-CG 4.42Å; Y355-L359 HydrophobicContact CE1-CD1 3.54Å; Y355-L359 HydrophobicContact CE1-CG 4.08Å; Y355-L359 WeakPolarHBondContact O-CG 3.38Å; Y355-L359 PolarHBondContact O-N 2.93Å
356	V	36.9	Very low	37.2	Very low	88 Å²	88	124.1 Å²	124.1	53%	0.533	66%	0.664	S	S	.	*	H	α-helix	trans	-77.6	-28.7	175.2	-179.5	0	0	0	0	110.4	S353 R360	S353-V356 PolarHBondContact O-N 3.18Å; V356-R360 PolarHBondContact O-N 3.19Å
357	E	33.9	Very low	37.5	Very low	98 Å²	98	123.7 Å²	123.7	46%	0.458	65%	0.654	S	S	.	*	H	α-helix	trans	-73.4	-43.6	167.5	-87.3	161.8	147.1	0	0	112.2	S353 L359 R360 E361	S353-E357 PolarHBondContact O-N 3.18Å; S353-E357 PolarHBondContact OG-OE2 3.42Å; E357-L359 VanDerWaalsContact C-N 3.26Å; E357-L359 PolarHBondContact O-N 3.25Å; E357-R360 PolarHBondContact O-N 3.32Å; E357-E361 PolarHBondContact O-N 2.97Å
358	Y	37.8	Very low	37.7	Very low	131 Å²	131	124.5 Å²	124.5	51%	0.514	64%	0.64	S	S	.	*	H	α-helix	trans	-54.3	-38.5	173.4	178.5	-99.6	0	0	0	113.6	G354 Y355 Q362	G354-Y358 VanDerWaalsContact O-CB 3.27Å; G354-Y358 WeakPolarHBondContact O-CB 3.49Å; G354-Y358 PolarHBondContact O-N 3.24Å; Y355-Y358 HydrophobicContact CD2-CD1 4.08Å; Y355-Y358 AromaticContact CE2-CD1 3.89Å; Y355-Y358 HydrophobicContact CE2-CD1 3.89Å; Y355-Y358 HydrophobicContact CE2-CE1 4.31Å; Y358-Q362 WeakPolarHBondContact O-CG 3.39Å; Y358-Q362 PolarHBondContact O-N 3.33Å
359	L	38.9	Very low	38.1	Very low	102 Å²	102	123.1 Å²	123.1	53%	0.534	62%	0.616	S	S	.	*	H	α-helix	trans	-80.5	-13.1	177.3	-70.2	177	0	0	0	114.3	Y355 E357	Y355-L359 HydrophobicContact CD1-CD1 3.96Å; Y355-L359 HydrophobicContact CD1-CG 4.42Å; Y355-L359 HydrophobicContact CE1-CD1 3.54Å; Y355-L359 HydrophobicContact CE1-CG 4.08Å; Y355-L359 WeakPolarHBondContact O-CG 3.38Å; Y355-L359 PolarHBondContact O-N 2.93Å; E357-L359 VanDerWaalsContact C-N 3.26Å; E357-L359 PolarHBondContact O-N 3.25Å
360	R	36.7	Very low	38.4	Very low	196 Å²	196	122.8 Å²	122.8	74%	0.74	60%	0.604	S	S	*	*	H	α-helix	trans	-93.9	-30.1	177.5	-168.4	-176.1	-64.5	-162.4	2.6	111.8	V356 E357	V356-R360 PolarHBondContact O-N 3.19Å; E357-R360 PolarHBondContact O-N 3.32Å
361	E	34.1	Very low	38.8	Very low	159 Å²	159	121.9 Å²	121.9	74%	0.743	59%	0.591	S	S	*	*	H	α-helix	trans	-82.4	-18.8	177.9	-70.5	178.9	164	0	0	113.5	E357 E363	E357-E361 PolarHBondContact O-N 2.97Å; E361-E363 PolarHBondContact O-N 3.42Å
362	Q	38.5	Very low	38.9	Very low	108 Å²	108	123 Å²	123	51%	0.505	58%	0.584	S	S	.	*	S	Bend	trans	-79	94.4	164.7	-68	-81.9	-23.4	0	0	108.1	Y358 V364	Y358-Q362 WeakPolarHBondContact O-CG 3.39Å; Y358-Q362 PolarHBondContact O-N 3.33Å; Q362-V364 HydrophobicContact CB-CG2 3.86Å; Q362-V364 PolarHBondContact O-N 2.8Å
363	E	38.6	Very low	39.4	Very low	192 Å²	192	121.9 Å²	121.9	90%	0.897	58%	0.58	S	S	*	*			trans	-62.9	71.8	159.9	-76.2	-173.2	157.7	0	0	109	E361 S365	E361-E363 PolarHBondContact O-N 3.42Å; E363-S365 PolarHBondContact O-N 3.47Å
364	V	42.5	Very low	40.1	Very low	63 Å²	63	127.4 Å²	127.4	38%	0.382	59%	0.589	S	S	.	*			trans	-68.4	90.7	169.2	-165.9	0	0	0	0	105.5	Q362 E366 F369	Q362-V364 HydrophobicContact CB-CG2 3.86Å; Q362-V364 PolarHBondContact O-N 2.8Å; V364-E366 PolarHBondContact O-N 3.5Å; V364-E366 VanDerWaalsContact O-N 3.17Å; V364-F369 HydrophobicContact CB-CE2 4.19Å; V364-F369 HydrophobicContact CB-CZ 4.49Å; V364-F369 HydrophobicContact CG1-CE2 3.54Å; V364-F369 HydrophobicContact CG1-CZ 3.62Å
365	S	39.6	Very low	41.4	Very low	71 Å²	71	125.7 Å²	125.7	50%	0.497	57%	0.565	S	S	.	*			trans	-41.6	125.4	-179.6	-175.5	0	0	0	0	109.7	E363 R367 W368	E363-S365 PolarHBondContact O-N 3.47Å; S365-R367 PolarHBondContact O-N 3.36Å; S365-R367 WeakPolarHBondContact OG-CB 3.34Å; S365-W368 PolarHBondContact O-N 3.05Å
366	E	39.8	Very low	42.3	Very low	165 Å²	165	123.6 Å²	123.6	77%	0.771	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.9	-14.4	174.9	-65.8	-172.1	149.2	0	0	112.8	V364	V364-E366 PolarHBondContact O-N 3.5Å; V364-E366 VanDerWaalsContact O-N 3.17Å
367	R	38.3	Very low	43.3	Very low	179 Å²	179	119.5 Å²	119.5	68%	0.675	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-32.5	176.9	-133.6	169.8	-173.2	162.3	0.3	113.8	S365 F369 R370	S365-R367 PolarHBondContact O-N 3.36Å; S365-R367 WeakPolarHBondContact OG-CB 3.34Å; R367-F369 VanDerWaalsContact C-N 3.33Å; R367-F369 PolarHBondContact O-N 2.98Å; R367-R370 PolarHBondContact O-N 2.79Å
368	W	38.8	Very low	44.2	Very low	132 Å²	132	121.4 Å²	121.4	50%	0.5	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-64.7	-35.7	177.7	-173.4	90.2	0	0	0	112.1	S365 R370 L375	S365-W368 PolarHBondContact O-N 3.05Å; W368-R370 PolarHBondContact O-N 3.16Å; W368-L375 HydrophobicContact CH2-CD2 3.99Å; W368-L375 HydrophobicContact CZ3-CD2 4.01Å
369	F	45.2	Very low	44.7	Very low	66 Å²	66	121.2 Å²	121.2	29%	0.289	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-75.3	-9.4	180	-61.8	-69.7	0	0	0	114.4	V364 R367 K387	V364-F369 HydrophobicContact CB-CE2 4.19Å; V364-F369 HydrophobicContact CB-CZ 4.49Å; V364-F369 HydrophobicContact CG1-CE2 3.54Å; V364-F369 HydrophobicContact CG1-CZ 3.62Å; R367-F369 VanDerWaalsContact C-N 3.33Å; R367-F369 PolarHBondContact O-N 2.98Å; F369-K387 HydrophobicContact CD1-CB 3.6Å; F369-K387 HydrophobicContact CD1-CD 3.93Å; F369-K387 HydrophobicContact CD1-CG 3.93Å; F369-K387 HydrophobicContact CE1-CB 3.56Å; F369-K387 HydrophobicContact CE1-CD 3.18Å; F369-K387 VanDerWaalsContact CE1-CE 3.5Å; F369-K387 HydrophobicContact CE1-CG 3.31Å; F369-K387 HydrophobicContact CE2-CD 3.91Å; F369-K387 HydrophobicContact CZ-CB 4.46Å; F369-K387 HydrophobicContact CZ-CD 3.23Å; F369-K387 HydrophobicContact CZ-CG 3.92Å
370	R	39.9	Very low	45.9	Very low	181 Å²	181	118.8 Å²	118.8	68%	0.683	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-84.7	-17.7	-177.5	-153.1	-178.3	-68.8	179.7	-1.8	112.9	R367 W368	R367-R370 PolarHBondContact O-N 2.79Å; W368-R370 PolarHBondContact O-N 3.16Å
371	Y	43.6	Very low	47.3	Very low	181 Å²	181	113.4 Å²	113.4	71%	0.71	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	-3.8	-170.1	-72.1	-84.8	0	0	0	115.8	P373	Y371-P373 WeakPolarHBondContact O-CD 3.3Å
372	N	42	Very low	48.6	Very low	77 Å²	77	112 Å²	112	41%	0.412	53%	0.532	S	S	.	.			trans	-109.9	100	-178.9	-116.2	-53.9	0	0	0	112.1	R374	N372-R374 PolarHBondContact O-N 2.95Å
373	P	51.5	Low	50	Low	103 Å²	103	110.5 Å²	110.5	67%	0.669	53%	0.534	S	S	*	.			trans	-78.1	-10.5	-165.6	27	-32.4	0	0	0	115.2	Y371	Y371-P373 WeakPolarHBondContact O-CD 3.3Å
374	R	53.3	Low	51.7	Low	196 Å²	196	103.2 Å²	103.2	74%	0.74	50%	0.499	S	S	*	.			trans	-147.8	103	-177.4	-64.3	-172.8	179	132.1	0.9	112.6	N372	N372-R374 PolarHBondContact O-N 2.95Å
375	L	62.2	Low	53	Low	21 Å²	21	106 Å²	106	11%	0.11	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	118.2	175.7	-62.9	172.4	0	0	0	110.5	W368 S383 F384 K387 L390	W368-L375 HydrophobicContact CH2-CD2 3.99Å; W368-L375 HydrophobicContact CZ3-CD2 4.01Å; L375-S383 CarbonylContact O-C 3.56Å; L375-S383 WeakPolarHBondContact O-CA 3.26Å; L375-F384 HydrophobicContact CB-CB 4.45Å; L375-F384 WeakPolarHBondContact CB-O 3.39Å; L375-F384 PolarHBondContact N-O 2.79Å; L375-F384 PolarHBondContact O-N 2.97Å; L375-K387 HydrophobicContact CD1-CB 4.06Å; L375-K387 VanDerWaalsContact CD1-N 3.3Å; L375-L390 HydrophobicContact CB-CB 4.39Å; L375-L390 HydrophobicContact CB-CD2 4.15Å
376	T	55.3	Low	54.3	Low	86 Å²	86	108.3 Å²	108.3	53%	0.528	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	140.5	-176.9	46.7	0	0	0	0	112.6	K382	T376-K382 CarbonylContact C-O 3.57Å; T376-K382 WeakPolarHBondContact CA-O 3.42Å
377	C	58.7	Low	55.3	Low	2 Å²	2	104.1 Å²	104.1	1%	0.014	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-75.1	128.4	171.2	174	0	0	0	0	110.4	Y379 A381 K382 F384 L390 H393 M394	C377-Y379 VanDerWaalsContact C-N 3.31Å; C377-Y379 PolarHBondContact O-N 3.04Å; C377-Y379 PolarHBondContact SG-N 3.22Å; C377-A381 WeakPolarHBondContact O-CA 3.41Å; C377-A381 PolarHBondContact O-N 3.41Å; C377-K382 HydrophobicContact CB-CB 4.44Å; C377-K382 PolarHBondContact N-O 3.01Å; C377-F384 HydrophobicContact CB-CE2 4.01Å; C377-L390 HydrophobicContact CB-CD1 4.14Å; C377-H393 VanDerWaalsContact CB-CD2 3.41Å; C377-H393 WeakPolarHBondContact CB-CD2 3.45Å; C377-H393 WeakPolarHBondContact CB-NE2 3.24Å; C377-H393 PolarHBondContact SG-CD2 3.11Å; C377-H393 PolarHBondContact SG-NE2 3.42Å; C377-M394 VanDerWaalsContact SG-SD 3.66Å
378	I	52.6	Low	56.7	Low	139 Å²	139	97.9 Å²	97.9	71%	0.713	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-22.3	-179.6	64.3	179.2	0	0	0	113.8
379	Y	49.5	Very low	58.3	Low	127 Å²	127	92.4 Å²	92.4	50%	0.498	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-23.5	-177.7	-64.3	-89.8	0	0	0	113.7	C377 M394 H397	C377-Y379 VanDerWaalsContact C-N 3.31Å; C377-Y379 PolarHBondContact O-N 3.04Å; C377-Y379 PolarHBondContact SG-N 3.22Å; Y379-M394 HydrophobicContact CD2-CE 3.18Å; Y379-M394 HydrophobicContact CD2-SD 4Å; Y379-M394 HydrophobicContact CE2-CE 3.13Å; Y379-M394 HydrophobicContact CE2-SD 4.31Å; Y379-M394 HydrophobicContact CG-CE 4.39Å; Y379-H397 WeakPolarHBondContact CB-CE1 3.5Å; Y379-H397 WeakPolarHBondContact CB-ND1 3.41Å; Y379-H397 HydrophobicContact CD2-CB 4.04Å; Y379-H397 AromaticContact CD2-CG 3.97Å; Y379-H397 HydrophobicContact CE2-CB 4.42Å; Y379-H397 HydrophobicContact CG-CB 4.09Å; Y379-H397 AromaticContact CG-CG 3.8Å; Y379-H397 AromaticContact CG-ND1 3.91Å
380	C	63	Low	59.5	Low	51 Å²	51	90.7 Å²	90.7	35%	0.345	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.9	13	-177.6	79.7	0	0	0	0	114.2	K382 H393	C380-K382 PolarHBondContact O-N 2.95Å; C380-K382 VanDerWaalsContact SG-CG 3.5Å; C380-H393 PolarHBondContact SG-CE1 3.31Å; C380-H393 PolarHBondContact SG-NE2 3.07Å
381	A	67.4	Low	60.7	Low	82 Å²	82	85.2 Å²	85.2	68%	0.678	45%	0.445	S	S	*	.			trans	53.2	16.3	179.1	0	0	0	0	0	115.5	C377 S383	C377-A381 WeakPolarHBondContact O-CA 3.41Å; C377-A381 PolarHBondContact O-N 3.41Å; A381-S383 PolarHBondContact O-N 3.42Å
382	K	61.4	Low	61.9	Low	129 Å²	129	80.5 Å²	80.5	56%	0.561	43%	0.426	S	S	*	.			trans	-73.7	129.6	-179.6	-80.4	-175.8	-177.4	-171.7	0	110.3	T376 C377 C380 F384	T376-K382 CarbonylContact C-O 3.57Å; T376-K382 WeakPolarHBondContact CA-O 3.42Å; C377-K382 HydrophobicContact CB-CB 4.44Å; C377-K382 PolarHBondContact N-O 3.01Å; C380-K382 PolarHBondContact O-N 2.95Å; C380-K382 VanDerWaalsContact SG-CG 3.5Å; K382-F384 HydrophobicContact CB-CE2 3.72Å; K382-F384 HydrophobicContact CB-CZ 3.91Å; K382-F384 VanDerWaalsContact O-CD2 3.25Å; K382-F384 WeakPolarHBondContact O-CD2 3.39Å; K382-F384 WeakPolarHBondContact O-CE2 3.39Å
383	S	67.9	Low	63.3	Low	77 Å²	77	77.9 Å²	77.9	54%	0.538	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	142	176.3	55.2	0	0	0	0	112	L375 A381	L375-S383 CarbonylContact O-C 3.56Å; L375-S383 WeakPolarHBondContact O-CA 3.26Å; A381-S383 PolarHBondContact O-N 3.42Å
384	F	73.5	Confident	63.8	Low	40 Å²	40	74.4 Å²	74.4	18%	0.175	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	141.4	-179.7	-61.9	-84.9	0	0	0	108.3	L375 C377 K382 L390 H393	L375-F384 HydrophobicContact CB-CB 4.45Å; L375-F384 WeakPolarHBondContact CB-O 3.39Å; L375-F384 PolarHBondContact N-O 2.79Å; L375-F384 PolarHBondContact O-N 2.97Å; C377-F384 HydrophobicContact CB-CE2 4.01Å; K382-F384 HydrophobicContact CB-CE2 3.72Å; K382-F384 HydrophobicContact CB-CZ 3.91Å; K382-F384 VanDerWaalsContact O-CD2 3.25Å; K382-F384 WeakPolarHBondContact O-CD2 3.39Å; K382-F384 WeakPolarHBondContact O-CE2 3.39Å; F384-L390 HydrophobicContact CB-CB 4.25Å; F384-L390 HydrophobicContact CD2-CB 4.23Å; F384-L390 HydrophobicContact CD2-CD1 3.57Å; F384-L390 HydrophobicContact CE2-CD1 4.03Å; F384-L390 HydrophobicContact CG-CB 4.33Å; F384-L390 HydrophobicContact CG-CD1 4.46Å; F384-H393 HydrophobicContact CE1-CB 3.8Å; F384-H393 AromaticContact CE1-CG 3.99Å; F384-H393 HydrophobicContact CE2-CB 3.93Å; F384-H393 AromaticContact CE2-CD2 3.3Å; F384-H393 WeakPolarHBondContact CE2-CD2 3.36Å; F384-H393 AromaticContact CE2-CG 3.56Å; F384-H393 AromaticContact CE2-NE2 3.81Å; F384-H393 HydrophobicContact CZ-CB 3.43Å; F384-H393 VanDerWaalsContact CZ-CB 3.43Å; F384-H393 AromaticContact CZ-CD2 3.39Å; F384-H393 WeakPolarHBondContact CZ-CD2 3.48Å; F384-H393 AromaticContact CZ-CE1 3.93Å; F384-H393 AromaticContact CZ-CG 3.13Å; F384-H393 AromaticContact CZ-ND1 3.52Å; F384-H393 AromaticContact CZ-NE2 3.83Å
385	N	70.3	Confident	64.6	Low	122 Å²	122	69.4 Å²	69.4	65%	0.652	37%	0.368	S	S	*	.	S	Bend	trans	-91.9	0	-179.7	56.8	-9.1	0	0	0	113
386	Q	65.9	Low	64.7	Low	119 Å²	119	73.4 Å²	73.4	56%	0.556	39%	0.389	S	S	*	.	S	Bend	trans	-147.9	136.9	-175.9	-64	178.1	5.2	0	0	110.5	G388 S389 L390	Q386-G388 PolarHBondContact O-N 3.21Å; Q386-S389 WeakPolarHBondContact O-CB 3.45Å; Q386-S389 PolarHBondContact O-N 2.98Å; Q386-L390 PolarHBondContact O-N 2.88Å; Q386-L390 VanDerWaalsContact O-N 3.17Å
387	K	60.6	Low	64.7	Low	77 Å²	77	73.1 Å²	73.1	34%	0.335	38%	0.381	S	S	.	.	H	α-helix	trans	-53.5	-50.8	178.4	-170.8	-156.5	-163.1	168.9	0	112.5	F369 L375 S389 L390 D391	F369-K387 HydrophobicContact CD1-CB 3.6Å; F369-K387 HydrophobicContact CD1-CD 3.93Å; F369-K387 HydrophobicContact CD1-CG 3.93Å; F369-K387 HydrophobicContact CE1-CB 3.56Å; F369-K387 HydrophobicContact CE1-CD 3.18Å; F369-K387 VanDerWaalsContact CE1-CE 3.5Å; F369-K387 HydrophobicContact CE1-CG 3.31Å; F369-K387 HydrophobicContact CE2-CD 3.91Å; F369-K387 HydrophobicContact CZ-CB 4.46Å; F369-K387 HydrophobicContact CZ-CD 3.23Å; F369-K387 HydrophobicContact CZ-CG 3.92Å; L375-K387 HydrophobicContact CD1-CB 4.06Å; L375-K387 VanDerWaalsContact CD1-N 3.3Å; K387-S389 PolarHBondContact O-N 3.18Å; K387-S389 VanDerWaalsContact O-N 3.07Å; K387-L390 WeakPolarHBondContact O-CA 3.27Å; K387-L390 WeakPolarHBondContact O-CB 3.32Å; K387-L390 PolarHBondContact O-N 2.95Å; K387-D391 PolarHBondContact O-N 3.43Å
388	G	68.1	Low	64.3	Low	47 Å²	47	77.7 Å²	77.7	49%	0.485	40%	0.404	S	S	.	.	H	α-helix	trans	-60.9	-24.1	-180	0	0	0	0	0	113.6	Q386 R392	Q386-G388 PolarHBondContact O-N 3.21Å; G388-R392 VanDerWaalsContact O-CB 3.22Å; G388-R392 WeakPolarHBondContact O-CB 3.22Å; G388-R392 PolarHBondContact O-N 2.98Å
389	S	72.8	Confident	64.4	Low	18 Å²	18	73.7 Å²	73.7	13%	0.126	40%	0.397	C	S	.	.	H	α-helix	trans	-77.2	-39.8	173.6	-71	0	0	0	0	112.2	Q386 K387 R392 H393	Q386-S389 WeakPolarHBondContact O-CB 3.45Å; Q386-S389 PolarHBondContact O-N 2.98Å; K387-S389 PolarHBondContact O-N 3.18Å; K387-S389 VanDerWaalsContact O-N 3.07Å; S389-R392 PolarHBondContact OG-NH2 2.97Å; S389-H393 VanDerWaalsContact O-CB 3.23Å; S389-H393 WeakPolarHBondContact O-CB 3.44Å; S389-H393 PolarHBondContact O-N 3.32Å
390	L	69.8	Low	64.9	Low	30 Å²	30	71.3 Å²	71.3	16%	0.157	39%	0.392	C	S	.	.	H	α-helix	trans	-62.8	-50.8	171.3	-178.9	74.3	0	0	0	110.6	L375 C377 F384 Q386 K387 R392 H393 M394	L375-L390 HydrophobicContact CB-CB 4.39Å; L375-L390 HydrophobicContact CB-CD2 4.15Å; C377-L390 HydrophobicContact CB-CD1 4.14Å; F384-L390 HydrophobicContact CB-CB 4.25Å; F384-L390 HydrophobicContact CD2-CB 4.23Å; F384-L390 HydrophobicContact CD2-CD1 3.57Å; F384-L390 HydrophobicContact CE2-CD1 4.03Å; F384-L390 HydrophobicContact CG-CB 4.33Å; F384-L390 HydrophobicContact CG-CD1 4.46Å; Q386-L390 PolarHBondContact O-N 2.88Å; Q386-L390 VanDerWaalsContact O-N 3.17Å; K387-L390 WeakPolarHBondContact O-CA 3.27Å; K387-L390 WeakPolarHBondContact O-CB 3.32Å; K387-L390 PolarHBondContact O-N 2.95Å; L390-R392 VanDerWaalsContact C-N 3.29Å; L390-R392 PolarHBondContact O-N 3.42Å; L390-H393 CarbonylContact O-C 3.35Å; L390-H393 WeakPolarHBondContact O-CA 3.46Å; L390-H393 WeakPolarHBondContact O-CB 3.45Å; L390-H393 PolarHBondContact O-N 3.01Å; L390-M394 HydrophobicContact CG-CG 4.32Å; L390-M394 WeakPolarHBondContact O-CG 3.25Å; L390-M394 PolarHBondContact O-N 3.08Å
391	D	65.4	Low	65.3	Low	65 Å²	65	71 Å²	71	35%	0.348	39%	0.389	S	S	.	.	H	α-helix	trans	-58.7	-42.3	-178.5	-68.5	-15.6	0	0	0	111.7	K387 M394 R395	K387-D391 PolarHBondContact O-N 3.43Å; D391-M394 WeakPolarHBondContact O-CB 3.46Å; D391-M394 PolarHBondContact O-N 3.38Å; D391-R395 WeakPolarHBondContact O-CG 3.17Å; D391-R395 PolarHBondContact O-N 3.4Å
392	R	68.8	Low	65.3	Low	82 Å²	82	70.6 Å²	70.6	31%	0.309	38%	0.379	S	S	.	.	H	α-helix	trans	-65.5	-41.3	175	176.5	177.4	64.3	-161.5	-7	111.9	G388 S389 L390 M394 R395 R414	G388-R392 VanDerWaalsContact O-CB 3.22Å; G388-R392 WeakPolarHBondContact O-CB 3.22Å; G388-R392 PolarHBondContact O-N 2.98Å; S389-R392 PolarHBondContact OG-NH2 2.97Å; L390-R392 VanDerWaalsContact C-N 3.29Å; L390-R392 PolarHBondContact O-N 3.42Å; R392-M394 PolarHBondContact O-N 3.06Å; R392-R395 PolarHBondContact O-N 3.4Å; R392-R414 HydrophobicContact CG-CG 4.01Å
393	H	71.4	Confident	66	Low	22 Å²	22	67.2 Å²	67.2	10%	0.102	36%	0.364	C	S	.	.	H	α-helix	trans	-63.2	-36.5	175.5	170.4	71.6	0	0	0	110.9	C377 C380 F384 S389 L390 R395 L396 H397	C377-H393 VanDerWaalsContact CB-CD2 3.41Å; C377-H393 WeakPolarHBondContact CB-CD2 3.45Å; C377-H393 WeakPolarHBondContact CB-NE2 3.24Å; C377-H393 PolarHBondContact SG-CD2 3.11Å; C377-H393 PolarHBondContact SG-NE2 3.42Å; C380-H393 PolarHBondContact SG-CE1 3.31Å; C380-H393 PolarHBondContact SG-NE2 3.07Å; F384-H393 HydrophobicContact CE1-CB 3.8Å; F384-H393 AromaticContact CE1-CG 3.99Å; F384-H393 HydrophobicContact CE2-CB 3.93Å; F384-H393 AromaticContact CE2-CD2 3.3Å; F384-H393 WeakPolarHBondContact CE2-CD2 3.36Å; F384-H393 AromaticContact CE2-CG 3.56Å; F384-H393 AromaticContact CE2-NE2 3.81Å; F384-H393 HydrophobicContact CZ-CB 3.43Å; F384-H393 VanDerWaalsContact CZ-CB 3.43Å; F384-H393 AromaticContact CZ-CD2 3.39Å; F384-H393 WeakPolarHBondContact CZ-CD2 3.48Å; F384-H393 AromaticContact CZ-CE1 3.93Å; F384-H393 AromaticContact CZ-CG 3.13Å; F384-H393 AromaticContact CZ-ND1 3.52Å; F384-H393 AromaticContact CZ-NE2 3.83Å; S389-H393 VanDerWaalsContact O-CB 3.23Å; S389-H393 WeakPolarHBondContact O-CB 3.44Å; S389-H393 PolarHBondContact O-N 3.32Å; L390-H393 CarbonylContact O-C 3.35Å; L390-H393 WeakPolarHBondContact O-CA 3.46Å; L390-H393 WeakPolarHBondContact O-CB 3.45Å; L390-H393 PolarHBondContact O-N 3.01Å; H393-R395 VanDerWaalsContact C-N 3.3Å; H393-R395 PolarHBondContact O-N 3.24Å; H393-L396 VanDerWaalsContact O-CB 3.28Å; H393-L396 WeakPolarHBondContact O-CB 3.25Å; H393-L396 PolarHBondContact O-N 3.06Å; H393-H397 AromaticContact CE1-NE2 3.56Å; H393-H397 AromaticContact NE2-CD2 3.74Å; H393-H397 AromaticContact NE2-NE2 3.37Å; H393-H397 PolarHBondContact NE2-NE2 3.38Å
394	M	61.7	Low	66.4	Low	30 Å²	30	66.7 Å²	66.7	15%	0.148	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-33.7	178.6	-77.3	-42	-40.9	0	0	113.8	C377 Y379 L390 D391 R392 L396 H397 M398	C377-M394 VanDerWaalsContact SG-SD 3.66Å; Y379-M394 HydrophobicContact CD2-CE 3.18Å; Y379-M394 HydrophobicContact CD2-SD 4Å; Y379-M394 HydrophobicContact CE2-CE 3.13Å; Y379-M394 HydrophobicContact CE2-SD 4.31Å; Y379-M394 HydrophobicContact CG-CE 4.39Å; L390-M394 HydrophobicContact CG-CG 4.32Å; L390-M394 WeakPolarHBondContact O-CG 3.25Å; L390-M394 PolarHBondContact O-N 3.08Å; D391-M394 WeakPolarHBondContact O-CB 3.46Å; D391-M394 PolarHBondContact O-N 3.38Å; R392-M394 PolarHBondContact O-N 3.06Å; M394-L396 PolarHBondContact O-N 3.18Å; M394-L396 VanDerWaalsContact O-N 3.15Å; M394-H397 HydrophobicContact CE-CB 3.81Å; M394-H397 PolarHBondContact O-N 3.42Å; M394-M398 WeakPolarHBondContact O-CG 3.44Å; M394-M398 PolarHBondContact O-N 3.07Å; M394-M398 VanDerWaalsContact O-N 3.12Å
395	R	69.8	Low	66.8	Low	91 Å²	91	64.8 Å²	64.8	34%	0.343	35%	0.349	S	S	.	.	H	α-helix	trans	-59.6	-25.7	173.6	-64.5	171.6	-158.7	164.6	3.1	113.5	D391 R392 H393 G399 I400	D391-R395 WeakPolarHBondContact O-CG 3.17Å; D391-R395 PolarHBondContact O-N 3.4Å; R392-R395 PolarHBondContact O-N 3.4Å; H393-R395 VanDerWaalsContact C-N 3.3Å; H393-R395 PolarHBondContact O-N 3.24Å; R395-G399 PolarHBondContact O-N 3.17Å; R395-G399 VanDerWaalsContact O-N 3.11Å; R395-I400 HydrophobicContact CB-CB 4.44Å; R395-I400 PolarHBondContact O-N 3.09Å; R395-I400 VanDerWaalsContact O-N 3.1Å
396	L	64.1	Low	67.2	Low	106 Å²	106	71.2 Å²	71.2	56%	0.555	36%	0.364	S	S	*	.	H	α-helix	trans	-69.8	-40.2	175.8	-62.9	165.9	0	0	0	111.5	H393 M394 M398 T413	H393-L396 VanDerWaalsContact O-CB 3.28Å; H393-L396 WeakPolarHBondContact O-CB 3.25Å; H393-L396 PolarHBondContact O-N 3.06Å; M394-L396 PolarHBondContact O-N 3.18Å; M394-L396 VanDerWaalsContact O-N 3.15Å; L396-M398 VanDerWaalsContact C-N 3.35Å; L396-T413 HydrophobicContact CD2-CG2 3.95Å
397	H	56.3	Low	67.7	Low	79 Å²	79	70.5 Å²	70.5	37%	0.366	36%	0.362	S	S	.	.	H	α-helix	trans	-69.8	-35.1	176.6	-73.3	-67.2	0	0	0	112	Y379 H393 M394 G399	Y379-H397 WeakPolarHBondContact CB-CE1 3.5Å; Y379-H397 WeakPolarHBondContact CB-ND1 3.41Å; Y379-H397 HydrophobicContact CD2-CB 4.04Å; Y379-H397 AromaticContact CD2-CG 3.97Å; Y379-H397 HydrophobicContact CE2-CB 4.42Å; Y379-H397 HydrophobicContact CG-CB 4.09Å; Y379-H397 AromaticContact CG-CG 3.8Å; Y379-H397 AromaticContact CG-ND1 3.91Å; H393-H397 AromaticContact CE1-NE2 3.56Å; H393-H397 AromaticContact NE2-CD2 3.74Å; H393-H397 AromaticContact NE2-NE2 3.37Å; H393-H397 PolarHBondContact NE2-NE2 3.38Å; M394-H397 HydrophobicContact CE-CB 3.81Å; M394-H397 PolarHBondContact O-N 3.42Å; H397-G399 VanDerWaalsContact C-N 3.32Å
398	M	50.7	Low	68.7	Low	99 Å²	99	69.6 Å²	69.6	49%	0.488	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-4.5	-178.7	-57.4	174	86.7	0	0	113.4	M394 L396 I400	M394-M398 WeakPolarHBondContact O-CG 3.44Å; M394-M398 PolarHBondContact O-N 3.07Å; M394-M398 VanDerWaalsContact O-N 3.12Å; L396-M398 VanDerWaalsContact C-N 3.35Å; M398-I400 HydrophobicContact CB-CD1 3.65Å; M398-I400 HydrophobicContact CB-CG1 3.7Å; M398-I400 HydrophobicContact CE-CD1 3.91Å; M398-I400 HydrophobicContact CG-CD1 4.39Å; M398-I400 PolarHBondContact O-N 2.82Å; M398-I400 VanDerWaalsContact O-N 3.12Å; M398-I400 HydrophobicContact SD-CD1 3.88Å
399	G	54.5	Low	69	Low	55 Å²	55	69.6 Å²	69.6	57%	0.567	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	14.5	-176.1	0	0	0	0	0	114.4	R395 H397 T401	R395-G399 PolarHBondContact O-N 3.17Å; R395-G399 VanDerWaalsContact O-N 3.11Å; H397-G399 VanDerWaalsContact C-N 3.32Å; G399-T401 PolarHBondContact O-N 3.33Å
400	I	60.3	Low	69.1	Low	76 Å²	76	74.7 Å²	74.7	39%	0.39	39%	0.385	S	S	.	.			trans	-77.3	112.4	-176.3	-60.4	171.2	0	0	0	108.6	R395 M398 P402	R395-I400 HydrophobicContact CB-CB 4.44Å; R395-I400 PolarHBondContact O-N 3.09Å; R395-I400 VanDerWaalsContact O-N 3.1Å; M398-I400 HydrophobicContact CB-CD1 3.65Å; M398-I400 HydrophobicContact CB-CG1 3.7Å; M398-I400 HydrophobicContact CE-CD1 3.91Å; M398-I400 HydrophobicContact CG-CD1 4.39Å; M398-I400 PolarHBondContact O-N 2.82Å; M398-I400 VanDerWaalsContact O-N 3.12Å; M398-I400 HydrophobicContact SD-CD1 3.88Å; I400-P402 WeakPolarHBondContact O-CD 3.4Å
401	T	69.6	Low	69.6	Low	46 Å²	46	79.9 Å²	79.9	28%	0.282	41%	0.406	S	S	.	.			trans	-119.2	80.4	179.3	45.2	0	0	0	0	110.1	G399 F403 K411 Y412 T413	G399-T401 PolarHBondContact O-N 3.33Å; T401-F403 PolarHBondContact O-N 3.36Å; T401-K411 HydrophobicContact CG2-CB 4.24Å; T401-K411 WeakPolarHBondContact OG1-CB 3.39Å; T401-K411 WeakPolarHBondContact OG1-CD 3.32Å; T401-Y412 CarbonylContact C-O 3.58Å; T401-Y412 WeakPolarHBondContact CA-O 3.34Å; T401-T413 HydrophobicContact CG2-CG2 3.62Å
402	P	68.6	Low	70.2	Confident	73 Å²	73	78.9 Å²	78.9	47%	0.474	40%	0.398	S	S	.	.			trans	-74.4	-8.8	-170.2	28.9	-29.8	0	0	0	113	I400	I400-P402 WeakPolarHBondContact O-CD 3.4Å
403	F	76.4	Confident	70.2	Confident	57 Å²	57	75.7 Å²	75.7	25%	0.25	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	110.7	-175.5	-57.1	-72.7	0	0	0	110.4	T401 K411 Y412 R414 K415 L418	T401-F403 PolarHBondContact O-N 3.36Å; F403-K411 CarbonylContact O-C 3.5Å; F403-K411 WeakPolarHBondContact O-CA 3.49Å; F403-Y412 PolarHBondContact N-O 2.9Å; F403-Y412 PolarHBondContact O-N 3.39Å; F403-R414 VanDerWaalsContact CD2-CA 3.48Å; F403-K415 HydrophobicContact CD1-CB 4.08Å; F403-K415 HydrophobicContact CD1-CG 4.45Å; F403-K415 HydrophobicContact CE1-CB 3.75Å; F403-K415 HydrophobicContact CE1-CG 4.25Å; F403-K415 HydrophobicContact CE2-CB 4.34Å; F403-K415 HydrophobicContact CZ-CB 3.88Å; F403-L418 HydrophobicContact CB-CB 3.97Å; F403-L418 HydrophobicContact CB-CD2 3.79Å; F403-L418 HydrophobicContact CB-CG 4.45Å
404	V	75.3	Confident	70.4	Confident	66 Å²	66	78.1 Å²	78.1	40%	0.4	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	133.6	-178.2	-172.9	0	0	0	0	110.5	R406 K411	V404-R406 PolarHBondContact O-N 3.16Å; V404-K411 HydrophobicContact CG1-CG 4.41Å; V404-K411 HydrophobicContact CG2-CB 4.49Å; V404-K411 HydrophobicContact CG2-CD 4.47Å; V404-K411 HydrophobicContact CG2-CG 4.05Å
405	C	82.6	Confident	71.1	Confident	1 Å²	1	83.6 Å²	83.6	1%	0.007	42%	0.419	C	S	.	.			trans	-74.4	117	171.3	-175.4	0	0	0	0	110.2	M407 G409 K410 Y412 L418 H421	C405-M407 PolarHBondContact O-N 2.98Å; C405-G409 WeakPolarHBondContact O-CA 3.26Å; C405-G409 PolarHBondContact O-N 3.04Å; C405-K410 PolarHBondContact N-O 3.4Å; C405-Y412 HydrophobicContact CB-CE2 4.49Å; C405-L418 HydrophobicContact CB-CD1 3.73Å; C405-H421 PolarHBondContact SG-CD2 2.98Å; C405-H421 PolarHBondContact SG-NE2 3.1Å; C405-H421 VanDerWaalsContact SG-NE2 3.39Å
406	R	78.4	Confident	71.6	Confident	256 Å²	256	82.8 Å²	82.8	97%	0.966	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.9	177.6	-64	-174.2	-179.4	175.7	-1.3	113.8	V404	V404-R406 PolarHBondContact O-N 3.16Å
407	M	76.2	Confident	72.4	Confident	104 Å²	104	81.2 Å²	81.2	51%	0.512	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-28.2	179.9	-68.6	-178.5	-76.8	0	0	113.7	C405 I422 H425	C405-M407 PolarHBondContact O-N 2.98Å; M407-I422 HydrophobicContact CE-CB 4.28Å; M407-I422 HydrophobicContact CE-CG1 4.14Å; M407-I422 HydrophobicContact CE-CG2 3.91Å; M407-H425 HydrophobicContact CE-CB 3.32Å; M407-H425 HydrophobicContact SD-CB 3.59Å; M407-H425 VanDerWaalsContact SD-CB 3.59Å
408	C	81.1	Confident	73.6	Confident	58 Å²	58	78.5 Å²	78.5	39%	0.392	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.2	6.8	-176.2	71.9	0	0	0	0	114.9	K410 H421	C408-K410 PolarHBondContact O-N 3.07Å; C408-K410 VanDerWaalsContact O-N 3.13Å; C408-H421 PolarHBondContact SG-NE2 3.29Å
409	G	74.9	Confident	75.1	Confident	47 Å²	47	77.7 Å²	77.7	49%	0.485	39%	0.394	S	S	.	.			trans	72	-0.7	177.3	0	0	0	0	0	115.9	C405 K411	C405-G409 WeakPolarHBondContact O-CA 3.26Å; C405-G409 PolarHBondContact O-N 3.04Å; G409-K411 PolarHBondContact O-N 3.07Å
410	K	75.6	Confident	76.4	Confident	125 Å²	125	79.7 Å²	79.7	54%	0.543	39%	0.386	S	S	.	.			trans	-65.6	134.3	-179.3	-74.5	-174.4	179.3	-178.7	0	111.9	C405 C408 Y412	C405-K410 PolarHBondContact N-O 3.4Å; C408-K410 PolarHBondContact O-N 3.07Å; C408-K410 VanDerWaalsContact O-N 3.13Å; K410-Y412 HydrophobicContact CB-CE2 3.84Å; K410-Y412 WeakPolarHBondContact O-CE2 3.26Å
411	K	79.7	Confident	77.5	Confident	140 Å²	140	77 Å²	77	61%	0.609	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.5	146.3	-177.5	-45.5	-172.9	179	176.8	0	111.8	T401 F403 V404 G409	T401-K411 HydrophobicContact CG2-CB 4.24Å; T401-K411 WeakPolarHBondContact OG1-CB 3.39Å; T401-K411 WeakPolarHBondContact OG1-CD 3.32Å; F403-K411 CarbonylContact O-C 3.5Å; F403-K411 WeakPolarHBondContact O-CA 3.49Å; V404-K411 HydrophobicContact CG1-CG 4.41Å; V404-K411 HydrophobicContact CG2-CB 4.49Å; V404-K411 HydrophobicContact CG2-CD 4.47Å; V404-K411 HydrophobicContact CG2-CG 4.05Å; G409-K411 PolarHBondContact O-N 3.07Å
412	Y	77.3	Confident	78	Confident	43 Å²	43	77.7 Å²	77.7	17%	0.169	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	146.7	-176.1	-63.3	-82.3	0	0	0	110.5	T401 F403 C405 K410 R414 Q417 L418 H421	T401-Y412 CarbonylContact C-O 3.58Å; T401-Y412 WeakPolarHBondContact CA-O 3.34Å; F403-Y412 PolarHBondContact N-O 2.9Å; F403-Y412 PolarHBondContact O-N 3.39Å; C405-Y412 HydrophobicContact CB-CE2 4.49Å; K410-Y412 HydrophobicContact CB-CE2 3.84Å; K410-Y412 WeakPolarHBondContact O-CE2 3.26Å; Y412-R414 VanDerWaalsContact C-N 3.31Å; Y412-Q417 HydrophobicContact CD1-CB 3.72Å; Y412-Q417 HydrophobicContact CG-CB 4.18Å; Y412-L418 HydrophobicContact CD2-CB 4.01Å; Y412-L418 HydrophobicContact CD2-CD1 3.86Å; Y412-L418 HydrophobicContact CE2-CD1 4.18Å; Y412-L418 HydrophobicContact CG-CB 4.31Å; Y412-H421 HydrophobicContact CE1-CB 4.26Å; Y412-H421 HydrophobicContact CE2-CB 3.8Å; Y412-H421 AromaticContact CE2-CD2 3.68Å; Y412-H421 AromaticContact CE2-CG 3.69Å; Y412-H421 AromaticContact CZ-CD2 3.95Å; Y412-H421 AromaticContact CZ-CG 3.51Å; Y412-H421 AromaticContact CZ-ND1 3.97Å; Y412-H421 WeakPolarHBondContact OH-CB 3.38Å; Y412-H421 PolarHBondContact OH-ND1 2.89Å
413	T	70.3	Confident	78.6	Confident	16 Å²	16	76.7 Å²	76.7	10%	0.098	36%	0.359	C	S	.	.	S	Bend	trans	-82.7	-12.5	176.5	55.3	0	0	0	0	112.5	L396 T401	L396-T413 HydrophobicContact CD2-CG2 3.95Å; T401-T413 HydrophobicContact CG2-CG2 3.62Å
414	R	75.3	Confident	78.7	Confident	73 Å²	73	80.4 Å²	80.4	28%	0.275	38%	0.375	S	S	.	.	S	Bend	trans	-136.7	148.1	-178.2	-51.7	163.3	55.6	153.2	-5.8	113.1	R392 F403 Y412 D416 Q417 L418	R392-R414 HydrophobicContact CG-CG 4.01Å; F403-R414 VanDerWaalsContact CD2-CA 3.48Å; Y412-R414 VanDerWaalsContact C-N 3.31Å; R414-D416 WeakPolarHBondContact CB-OD1 3.45Å; R414-D416 IonicContact CZ-OD1 3.99Å; R414-D416 IonicContact CZ-OD2 3.25Å; R414-D416 VanDerWaalsContact CZ-OD2 3.31Å; R414-D416 IonicContact NE-OD1 2.92Å; R414-D416 PolarHBondContact NE-OD1 3.36Å; R414-D416 IonicContact NE-OD2 3.82Å; R414-D416 PolarHBondContact NE-OD2 2.97Å; R414-D416 IonicContact NH2-OD1 2.77Å; R414-D416 IonicContact NH2-OD2 2.69Å; R414-D416 PolarHBondContact NH2-OD2 3.23Å; R414-Q417 HydrophobicContact CB-CB 4.36Å; R414-Q417 HydrophobicContact CB-CG 4.05Å; R414-Q417 PolarHBondContact O-N 3.48Å; R414-L418 PolarHBondContact O-N 3.3Å
415	K	76.6	Confident	78.8	Confident	145 Å²	145	81.2 Å²	81.2	63%	0.63	38%	0.375	S	S	*	.	H	α-helix	trans	-65	-41.3	178.5	-171.9	178.8	177.7	-178.7	0	112.7	F403 Q417 L418 E419	F403-K415 HydrophobicContact CD1-CB 4.08Å; F403-K415 HydrophobicContact CD1-CG 4.45Å; F403-K415 HydrophobicContact CE1-CB 3.75Å; F403-K415 HydrophobicContact CE1-CG 4.25Å; F403-K415 HydrophobicContact CE2-CB 4.34Å; F403-K415 HydrophobicContact CZ-CB 3.88Å; K415-Q417 VanDerWaalsContact C-N 3.3Å; K415-Q417 PolarHBondContact O-N 2.95Å; K415-L418 WeakPolarHBondContact O-CB 3.39Å; K415-L418 PolarHBondContact O-N 3Å; K415-E419 WeakPolarHBondContact O-CB 3.46Å; K415-E419 PolarHBondContact O-N 3.38Å
416	D	79.3	Confident	78.6	Confident	73 Å²	73	85.4 Å²	85.4	39%	0.39	40%	0.4	S	S	.	.	H	α-helix	trans	-65.8	-32.6	178.8	63.4	-41.9	0	0	0	112.4	R414 E419 Y420	R414-D416 WeakPolarHBondContact CB-OD1 3.45Å; R414-D416 IonicContact CZ-OD1 3.99Å; R414-D416 IonicContact CZ-OD2 3.25Å; R414-D416 VanDerWaalsContact CZ-OD2 3.31Å; R414-D416 IonicContact NE-OD1 2.92Å; R414-D416 PolarHBondContact NE-OD1 3.36Å; R414-D416 IonicContact NE-OD2 3.82Å; R414-D416 PolarHBondContact NE-OD2 2.97Å; R414-D416 IonicContact NH2-OD1 2.77Å; R414-D416 IonicContact NH2-OD2 2.69Å; R414-D416 PolarHBondContact NH2-OD2 3.23Å; D416-E419 PolarHBondContact O-N 2.97Å; D416-Y420 VanDerWaalsContact O-CB 3.3Å; D416-Y420 WeakPolarHBondContact O-CB 3.44Å; D416-Y420 PolarHBondContact O-N 3.31Å
417	Q	80.9	Confident	78.5	Confident	73 Å²	73	75.4 Å²	75.4	34%	0.341	38%	0.377	S	S	.	.	H	α-helix	trans	-68.7	-40.9	172.3	-67.8	179.7	-14.3	0	0	112	Y412 R414 K415 Y420 H421	Y412-Q417 HydrophobicContact CD1-CB 3.72Å; Y412-Q417 HydrophobicContact CG-CB 4.18Å; R414-Q417 HydrophobicContact CB-CB 4.36Å; R414-Q417 HydrophobicContact CB-CG 4.05Å; R414-Q417 PolarHBondContact O-N 3.48Å; K415-Q417 VanDerWaalsContact C-N 3.3Å; K415-Q417 PolarHBondContact O-N 2.95Å; Q417-Y420 PolarHBondContact O-N 2.69Å; Q417-H421 WeakPolarHBondContact O-CB 3.46Å; Q417-H421 PolarHBondContact O-N 3.26Å
418	L	83.2	Confident	78.7	Confident	22 Å²	22	74.7 Å²	74.7	12%	0.115	38%	0.375	C	S	.	.	H	α-helix	trans	-63.4	-43.2	172.9	172.8	62.7	0	0	0	110.8	F403 C405 Y412 R414 K415 H421 I422	F403-L418 HydrophobicContact CB-CB 3.97Å; F403-L418 HydrophobicContact CB-CD2 3.79Å; F403-L418 HydrophobicContact CB-CG 4.45Å; C405-L418 HydrophobicContact CB-CD1 3.73Å; Y412-L418 HydrophobicContact CD2-CB 4.01Å; Y412-L418 HydrophobicContact CD2-CD1 3.86Å; Y412-L418 HydrophobicContact CE2-CD1 4.18Å; Y412-L418 HydrophobicContact CG-CB 4.31Å; R414-L418 PolarHBondContact O-N 3.3Å; K415-L418 WeakPolarHBondContact O-CB 3.39Å; K415-L418 PolarHBondContact O-N 3Å; L418-H421 CarbonylContact O-C 3.49Å; L418-H421 WeakPolarHBondContact O-CB 3.47Å; L418-H421 PolarHBondContact O-N 3.47Å; L418-H421 VanDerWaalsContact O-N 3.16Å; L418-I422 HydrophobicContact CD1-CD1 3.87Å; L418-I422 HydrophobicContact CD1-CG1 4.06Å; L418-I422 HydrophobicContact CD2-CD1 4.34Å; L418-I422 HydrophobicContact CG-CD1 3.77Å; L418-I422 HydrophobicContact CG-CG1 4.36Å; L418-I422 VanDerWaalsContact O-CG1 3.28Å; L418-I422 WeakPolarHBondContact O-CG1 3.49Å; L418-I422 PolarHBondContact O-N 2.76Å
419	E	81.9	Confident	78.7	Confident	83 Å²	83	77.5 Å²	77.5	39%	0.388	38%	0.381	S	S	.	.	H	α-helix	trans	-65.5	-42.1	178.2	-168.8	175.7	175.6	0	0	111.8	K415 D416 H421 I422 R423	K415-E419 WeakPolarHBondContact O-CB 3.46Å; K415-E419 PolarHBondContact O-N 3.38Å; D416-E419 PolarHBondContact O-N 2.97Å; E419-H421 VanDerWaalsContact C-N 3.25Å; E419-H421 PolarHBondContact O-N 3.19Å; E419-I422 PolarHBondContact O-N 3.42Å; E419-R423 WeakPolarHBondContact O-CG 3.27Å; E419-R423 PolarHBondContact O-N 3.12Å; E419-R423 IonicContact OE1-CZ 3.88Å; E419-R423 IonicContact OE1-NE 3.6Å; E419-R423 IonicContact OE1-NH2 2.79Å; E419-R423 PolarHBondContact OE1-NH2 3.5Å
420	Y	80.6	Confident	78.9	Confident	97 Å²	97	78.1 Å²	78.1	38%	0.38	38%	0.376	S	S	.	.	H	α-helix	trans	-52.5	-46.7	168.5	175.2	-95.1	0	0	0	112.2	D416 Q417 K424 F442 I445	D416-Y420 VanDerWaalsContact O-CB 3.3Å; D416-Y420 WeakPolarHBondContact O-CB 3.44Å; D416-Y420 PolarHBondContact O-N 3.31Å; Q417-Y420 PolarHBondContact O-N 2.69Å; Y420-K424 HydrophobicContact CE1-CD 4.3Å; Y420-K424 WeakPolarHBondContact OH-CE 3.42Å; Y420-K424 PolarHBondContact OH-NZ 2.95Å; Y420-F442 VanDerWaalsContact CA-CZ 3.43Å; Y420-F442 AromaticContact CD2-CD2 3.68Å; Y420-F442 HydrophobicContact CD2-CD2 3.68Å; Y420-F442 AromaticContact CD2-CE2 3.26Å; Y420-F442 HydrophobicContact CD2-CE2 3.26Å; Y420-F442 AromaticContact CD2-CZ 3.93Å; Y420-F442 HydrophobicContact CD2-CZ 3.93Å; Y420-F442 HydrophobicContact CE2-CD2 4.08Å; Y420-F442 AromaticContact CE2-CE2 3.93Å; Y420-F442 HydrophobicContact CE2-CE2 3.93Å; Y420-F442 HydrophobicContact CG-CE2 4.1Å; Y420-F442 HydrophobicContact CG-CZ 4.42Å; Y420-I445 HydrophobicContact CE2-CD1 4.26Å
421	H	83.6	Confident	79.3	Confident	20 Å²	20	73.5 Å²	73.5	9%	0.093	36%	0.356	C	S	.	.	H	α-helix	trans	-67.3	-41.6	179	176.2	67.7	0	0	0	112.6	C405 C408 Y412 Q417 L418 E419 R423 K424 H425	C405-H421 PolarHBondContact SG-CD2 2.98Å; C405-H421 PolarHBondContact SG-NE2 3.1Å; C405-H421 VanDerWaalsContact SG-NE2 3.39Å; C408-H421 PolarHBondContact SG-NE2 3.29Å; Y412-H421 HydrophobicContact CE1-CB 4.26Å; Y412-H421 HydrophobicContact CE2-CB 3.8Å; Y412-H421 AromaticContact CE2-CD2 3.68Å; Y412-H421 AromaticContact CE2-CG 3.69Å; Y412-H421 AromaticContact CZ-CD2 3.95Å; Y412-H421 AromaticContact CZ-CG 3.51Å; Y412-H421 AromaticContact CZ-ND1 3.97Å; Y412-H421 WeakPolarHBondContact OH-CB 3.38Å; Y412-H421 PolarHBondContact OH-ND1 2.89Å; Q417-H421 WeakPolarHBondContact O-CB 3.46Å; Q417-H421 PolarHBondContact O-N 3.26Å; L418-H421 CarbonylContact O-C 3.49Å; L418-H421 WeakPolarHBondContact O-CB 3.47Å; L418-H421 PolarHBondContact O-N 3.47Å; L418-H421 VanDerWaalsContact O-N 3.16Å; E419-H421 VanDerWaalsContact C-N 3.25Å; E419-H421 PolarHBondContact O-N 3.19Å; H421-R423 PolarHBondContact O-N 3.5Å; H421-K424 WeakPolarHBondContact O-CB 3.29Å; H421-K424 PolarHBondContact O-N 3.22Å; H421-K424 VanDerWaalsContact O-N 3.17Å; H421-H425 AromaticContact CD2-NE2 3.87Å; H421-H425 AromaticContact CE1-CD2 3.99Å; H421-H425 AromaticContact CE1-NE2 3.38Å; H421-H425 PolarHBondContact CE1-NE2 3.29Å; H421-H425 AromaticContact NE2-CD2 3.57Å; H421-H425 AromaticContact NE2-NE2 2.98Å; H421-H425 PolarHBondContact NE2-NE2 3.12Å
422	I	80.6	Confident	79.6	Confident	60 Å²	60	72 Å²	72	31%	0.308	35%	0.351	S	S	.	.	H	α-helix	trans	-63.2	-40.8	178.1	-72.1	168.6	0	0	0	111.2	M407 L418 E419 K424 H425 T426	M407-I422 HydrophobicContact CE-CB 4.28Å; M407-I422 HydrophobicContact CE-CG1 4.14Å; M407-I422 HydrophobicContact CE-CG2 3.91Å; L418-I422 HydrophobicContact CD1-CD1 3.87Å; L418-I422 HydrophobicContact CD1-CG1 4.06Å; L418-I422 HydrophobicContact CD2-CD1 4.34Å; L418-I422 HydrophobicContact CG-CD1 3.77Å; L418-I422 HydrophobicContact CG-CG1 4.36Å; L418-I422 VanDerWaalsContact O-CG1 3.28Å; L418-I422 WeakPolarHBondContact O-CG1 3.49Å; L418-I422 PolarHBondContact O-N 2.76Å; E419-I422 PolarHBondContact O-N 3.42Å; I422-K424 PolarHBondContact O-N 2.77Å; I422-H425 WeakPolarHBondContact O-CB 3.35Å; I422-H425 PolarHBondContact O-N 3.25Å; I422-T426 HydrophobicContact CG2-CG2 4.41Å; I422-T426 PolarHBondContact O-N 2.78Å; I422-T426 VanDerWaalsContact O-N 3.1Å; I422-T426 PolarHBondContact O-OG1 3.02Å
423	R	81.8	Confident	80	Confident	52 Å²	52	70 Å²	70	20%	0.196	34%	0.343	C	S	.	.	H	α-helix	trans	-64.7	-19.6	177.7	-66.1	-167.5	-158.5	169.2	-3.5	113.5	E419 H421 G427 P441 F442	E419-R423 WeakPolarHBondContact O-CG 3.27Å; E419-R423 PolarHBondContact O-N 3.12Å; E419-R423 IonicContact OE1-CZ 3.88Å; E419-R423 IonicContact OE1-NE 3.6Å; E419-R423 IonicContact OE1-NH2 2.79Å; E419-R423 PolarHBondContact OE1-NH2 3.5Å; H421-R423 PolarHBondContact O-N 3.5Å; R423-G427 PolarHBondContact O-N 3.16Å; R423-G427 VanDerWaalsContact O-N 3.1Å; R423-P441 HydrophobicContact CB-CB 4.36Å; R423-P441 PolarHBondContact NH1-O 3.08Å; R423-F442 HydrophobicContact CB-CE2 4.28Å; R423-F442 HydrophobicContact CB-CZ 4.1Å; R423-F442 VanDerWaalsContact CD-CZ 3.41Å; R423-F442 HydrophobicContact CG-CZ 4.02Å; R423-F442 VanDerWaalsContact NH1-CD1 3.27Å
424	K	78.1	Confident	80.6	Confident	134 Å²	134	74.5 Å²	74.5	58%	0.583	36%	0.363	S	S	*	.	H	α-helix	trans	-72.2	-33	170	-68.5	-169.2	174.2	-177.2	0	112.9	Y420 H421 I422	Y420-K424 HydrophobicContact CE1-CD 4.3Å; Y420-K424 WeakPolarHBondContact OH-CE 3.42Å; Y420-K424 PolarHBondContact OH-NZ 2.95Å; H421-K424 WeakPolarHBondContact O-CB 3.29Å; H421-K424 PolarHBondContact O-N 3.22Å; H421-K424 VanDerWaalsContact O-N 3.17Å; I422-K424 PolarHBondContact O-N 2.77Å
425	H	77.3	Confident	80.9	Confident	84 Å²	84	74.2 Å²	74.2	39%	0.389	37%	0.369	S	S	.	.	H	α-helix	trans	-74.9	-43.1	176.2	-72.3	-72.7	0	0	0	111.7	M407 H421 I422 G427	M407-H425 HydrophobicContact CE-CB 3.32Å; M407-H425 HydrophobicContact SD-CB 3.59Å; M407-H425 VanDerWaalsContact SD-CB 3.59Å; H421-H425 AromaticContact CD2-NE2 3.87Å; H421-H425 AromaticContact CE1-CD2 3.99Å; H421-H425 AromaticContact CE1-NE2 3.38Å; H421-H425 PolarHBondContact CE1-NE2 3.29Å; H421-H425 AromaticContact NE2-CD2 3.57Å; H421-H425 AromaticContact NE2-NE2 2.98Å; H421-H425 PolarHBondContact NE2-NE2 3.12Å; I422-H425 WeakPolarHBondContact O-CB 3.35Å; I422-H425 PolarHBondContact O-N 3.25Å; H425-G427 VanDerWaalsContact C-N 3.33Å
426	T	77.8	Confident	81.5	Confident	88 Å²	88	69.9 Å²	69.9	54%	0.54	36%	0.356	S	S	.	.	H	α-helix	trans	-82.7	-11	-176.9	59.6	0	0	0	0	113.7	I422 N428	I422-T426 HydrophobicContact CG2-CG2 4.41Å; I422-T426 PolarHBondContact O-N 2.78Å; I422-T426 VanDerWaalsContact O-N 3.1Å; I422-T426 PolarHBondContact O-OG1 3.02Å; T426-N428 PolarHBondContact O-N 3.35Å; T426-N428 VanDerWaalsContact O-N 3.08Å
427	G	77	Confident	81.6	Confident	46 Å²	46	68.9 Å²	68.9	47%	0.474	36%	0.364	S	S	.	.			trans	65	8.7	-177.5	0	0	0	0	0	114.5	R423 H425 K429	R423-G427 PolarHBondContact O-N 3.16Å; R423-G427 VanDerWaalsContact O-N 3.1Å; H425-G427 VanDerWaalsContact C-N 3.33Å; G427-K429 PolarHBondContact O-N 3.39Å
428	N	79.6	Confident	81.8	Confident	89 Å²	89	71.4 Å²	71.4	48%	0.476	37%	0.373	S	S	.	.			trans	-67.7	121.2	-174.6	-171.8	-5.3	0	0	0	111.4	T426 P430 P441	T426-N428 PolarHBondContact O-N 3.35Å; T426-N428 VanDerWaalsContact O-N 3.08Å; N428-P430 WeakPolarHBondContact OD1-CD 3.29Å; N428-P441 WeakPolarHBondContact O-CB 3.26Å
429	K	81.8	Confident	81.8	Confident	118 Å²	118	73 Å²	73	51%	0.513	39%	0.387	S	S	.	.			trans	-129	73.8	-175.7	-68.9	170.7	-180	-179.7	0	111.4	G427 F431 F440 P441	G427-K429 PolarHBondContact O-N 3.39Å; K429-F431 VanDerWaalsContact C-N 3.26Å; K429-F431 PolarHBondContact O-N 2.91Å; K429-F440 CarbonylContact C-O 3.5Å; K429-F440 VanDerWaalsContact C-O 3.3Å; K429-F440 WeakPolarHBondContact CA-O 3.35Å; K429-P441 HydrophobicContact CG-CB 4.36Å
430	P	80.1	Confident	81.8	Confident	60 Å²	60	70.6 Å²	70.6	39%	0.39	38%	0.375	S	S	.	.			trans	-76.2	-10.9	-171	29	-32.1	0	0	0	114	N428	N428-P430 WeakPolarHBondContact OD1-CD 3.29Å
431	F	82.6	Confident	81.7	Confident	27 Å²	27	67.3 Å²	67.3	12%	0.118	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117.9	-175.6	-56.4	-79.4	0	0	0	110.7	K429 S439 F440 Q443 L446 P464	K429-F431 VanDerWaalsContact C-N 3.26Å; K429-F431 PolarHBondContact O-N 2.91Å; F431-S439 CarbonylContact O-C 3.46Å; F431-S439 WeakPolarHBondContact O-CA 3.42Å; F431-F440 WeakPolarHBondContact CB-O 3.41Å; F431-F440 PolarHBondContact N-O 3.22Å; F431-F440 VanDerWaalsContact N-O 3.1Å; F431-F440 PolarHBondContact O-N 3.19Å; F431-Q443 HydrophobicContact CD1-CB 4.02Å; F431-Q443 VanDerWaalsContact CD2-N 3.34Å; F431-Q443 HydrophobicContact CE1-CB 3.89Å; F431-Q443 HydrophobicContact CG-CB 4.44Å; F431-Q443 HydrophobicContact CZ-CB 4.24Å; F431-L446 HydrophobicContact CB-CB 4.38Å; F431-L446 HydrophobicContact CB-CD2 4.02Å; F431-P464 HydrophobicContact CE1-CB 4.03Å; F431-P464 HydrophobicContact CZ-CB 4.41Å
432	H	85.4	Confident	81.5	Confident	109 Å²	109	68.2 Å²	68.2	51%	0.505	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	144.5	-177.6	58	-85.4	0	0	0	111.8	H434 K438 L446	H432-H434 PolarHBondContact O-N 3.32Å; H432-K438 CarbonylContact C-O 3.54Å; H432-K438 WeakPolarHBondContact CA-O 3.36Å; H432-L446 WeakPolarHBondContact O-CD2 3.36Å
433	C	86.1	Confident	81.6	Confident	1 Å²	1	68 Å²	68	1%	0.007	37%	0.367	C	S	.	.			trans	-79.3	114.8	170.1	-175.3	0	0	0	0	109.3	V435 C436 G437 K438 F440 L446 H454	C433-V435 PolarHBondContact O-N 2.97Å; C433-C436 PolarHBondContact O-N 3.16Å; C433-C436 VanDerWaalsContact SG-SG 3.61Å; C433-G437 WeakPolarHBondContact O-CA 3.49Å; C433-G437 PolarHBondContact O-N 3.05Å; C433-K438 PolarHBondContact N-O 3.44Å; C433-F440 HydrophobicContact CB-CE2 4.31Å; C433-L446 HydrophobicContact CB-CD1 3.6Å; C433-H454 VanDerWaalsContact SG-CD2 3.51Å; C433-H454 PolarHBondContact SG-NE2 2.93Å
434	H	82.6	Confident	81.6	Confident	111 Å²	111	69.1 Å²	69.1	51%	0.514	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-19	177.6	72.3	-69.5	0	0	0	113.9	H432 F450 P460	H432-H434 PolarHBondContact O-N 3.32Å; H434-F450 AromaticContact CE1-CE2 3.32Å; H434-F450 WeakPolarHBondContact CE1-CE2 3.3Å; H434-F450 AromaticContact CE1-CZ 3.54Å; H434-F450 AromaticContact ND1-CE2 3.75Å; H434-P460 VanDerWaalsContact CE1-CD 3.49Å; H434-P460 WeakPolarHBondContact CE1-CD 3.36Å; H434-P460 WeakPolarHBondContact CE1-CG 3.29Å; H434-P460 WeakPolarHBondContact ND1-CG 3.32Å
435	V	82.7	Confident	81.8	Confident	67 Å²	67	65.3 Å²	65.3	41%	0.406	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-37.9	-179.5	-178.3	0	0	0	0	112.3	C433 F450 H454	C433-V435 PolarHBondContact O-N 2.97Å; V435-F450 HydrophobicContact CG2-CE2 3.68Å; V435-F450 HydrophobicContact CG2-CZ 4.2Å; V435-H454 WeakPolarHBondContact CG1-ND1 3.37Å
436	C	88.4	Confident	82.2	Confident	53 Å²	53	62 Å²	62	36%	0.358	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.5	7.1	-176.8	71.4	0	0	0	0	115.3	C433 K438 H449 H454	C433-C436 PolarHBondContact O-N 3.16Å; C433-C436 VanDerWaalsContact SG-SG 3.61Å; C436-K438 PolarHBondContact O-N 3.39Å; C436-H449 PolarHBondContact SG-NE2 2.83Å; C436-H454 PolarHBondContact SG-NE2 3.14Å
437	G	82.3	Confident	82.6	Confident	53 Å²	53	60 Å²	60	55%	0.546	34%	0.344	S	S	.	.			trans	69.5	-4.5	177.7	0	0	0	0	0	115.8	C433 S439	C433-G437 WeakPolarHBondContact O-CA 3.49Å; C433-G437 PolarHBondContact O-N 3.05Å; G437-S439 PolarHBondContact O-N 3.27Å
438	K	84.1	Confident	83	Confident	125 Å²	125	63 Å²	63	54%	0.543	35%	0.345	S	S	.	.			trans	-65.7	131.1	-177	-72	-177.7	-179.8	176.7	0	111.4	H432 C433 C436 F440	H432-K438 CarbonylContact C-O 3.54Å; H432-K438 WeakPolarHBondContact CA-O 3.36Å; C433-K438 PolarHBondContact N-O 3.44Å; C436-K438 PolarHBondContact O-N 3.39Å; K438-F440 HydrophobicContact CB-CE2 3.71Å; K438-F440 HydrophobicContact CB-CZ 3.8Å; K438-F440 WeakPolarHBondContact O-CD2 3.44Å; K438-F440 VanDerWaalsContact O-CE2 3.22Å; K438-F440 WeakPolarHBondContact O-CE2 3.19Å
439	S	84.3	Confident	83.3	Confident	57 Å²	57	59.7 Å²	59.7	40%	0.399	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	140.2	-179	-62.6	0	0	0	0	112.1	F431 G437	F431-S439 CarbonylContact O-C 3.46Å; F431-S439 WeakPolarHBondContact O-CA 3.42Å; G437-S439 PolarHBondContact O-N 3.27Å
440	F	81.4	Confident	83.5	Confident	31 Å²	31	54.4 Å²	54.4	14%	0.136	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	147.8	-173.3	-60	-82.9	0	0	0	110.9	K429 F431 C433 K438 F442 I445 L446 H449	K429-F440 CarbonylContact C-O 3.5Å; K429-F440 VanDerWaalsContact C-O 3.3Å; K429-F440 WeakPolarHBondContact CA-O 3.35Å; F431-F440 WeakPolarHBondContact CB-O 3.41Å; F431-F440 PolarHBondContact N-O 3.22Å; F431-F440 VanDerWaalsContact N-O 3.1Å; F431-F440 PolarHBondContact O-N 3.19Å; C433-F440 HydrophobicContact CB-CE2 4.31Å; K438-F440 HydrophobicContact CB-CE2 3.71Å; K438-F440 HydrophobicContact CB-CZ 3.8Å; K438-F440 WeakPolarHBondContact O-CD2 3.44Å; K438-F440 VanDerWaalsContact O-CE2 3.22Å; K438-F440 WeakPolarHBondContact O-CE2 3.19Å; F440-F442 VanDerWaalsContact C-N 3.28Å; F440-F442 PolarHBondContact O-N 3Å; F440-I445 HydrophobicContact CB-CG2 4.5Å; F440-I445 HydrophobicContact CD1-CB 4.49Å; F440-I445 HydrophobicContact CD1-CG2 3.63Å; F440-I445 HydrophobicContact CE1-CG2 4.28Å; F440-I445 HydrophobicContact CG-CG2 4.34Å; F440-L446 HydrophobicContact CB-CB 4.26Å; F440-L446 HydrophobicContact CD2-CB 3.93Å; F440-L446 HydrophobicContact CD2-CD1 3.67Å; F440-L446 HydrophobicContact CD2-CG 4.4Å; F440-L446 HydrophobicContact CE2-CD1 3.84Å; F440-L446 HydrophobicContact CG-CB 4.29Å; F440-H449 HydrophobicContact CE1-CB 4Å; F440-H449 HydrophobicContact CE2-CB 4.08Å; F440-H449 AromaticContact CE2-CD2 3.5Å; F440-H449 AromaticContact CE2-CG 3.77Å; F440-H449 HydrophobicContact CZ-CB 3.57Å; F440-H449 AromaticContact CZ-CD2 3.48Å; F440-H449 VanDerWaalsContact CZ-CD2 3.48Å; F440-H449 WeakPolarHBondContact CZ-CD2 3.11Å; F440-H449 AromaticContact CZ-CG 3.28Å; F440-H449 AromaticContact CZ-ND1 3.74Å
441	P	78.7	Confident	83.7	Confident	28 Å²	28	60.4 Å²	60.4	18%	0.182	32%	0.319	C	S	.	.	S	Bend	trans	-75.4	-15	-179.3	28.1	-30.7	0	0	0	113.8	R423 N428 K429 I445	R423-P441 HydrophobicContact CB-CB 4.36Å; R423-P441 PolarHBondContact NH1-O 3.08Å; N428-P441 WeakPolarHBondContact O-CB 3.26Å; K429-P441 HydrophobicContact CG-CB 4.36Å; P441-I445 HydrophobicContact CG-CD1 4.24Å
442	F	79.6	Confident	83.8	Confident	39 Å²	39	66.3 Å²	66.3	17%	0.171	34%	0.344	C	S	.	.	S	Bend	trans	-145.7	142.2	-177.9	-61.7	-81.6	0	0	0	112.4	Y420 R423 F440 A444 I445 L446	Y420-F442 VanDerWaalsContact CA-CZ 3.43Å; Y420-F442 AromaticContact CD2-CD2 3.68Å; Y420-F442 HydrophobicContact CD2-CD2 3.68Å; Y420-F442 AromaticContact CD2-CE2 3.26Å; Y420-F442 HydrophobicContact CD2-CE2 3.26Å; Y420-F442 AromaticContact CD2-CZ 3.93Å; Y420-F442 HydrophobicContact CD2-CZ 3.93Å; Y420-F442 HydrophobicContact CE2-CD2 4.08Å; Y420-F442 AromaticContact CE2-CE2 3.93Å; Y420-F442 HydrophobicContact CE2-CE2 3.93Å; Y420-F442 HydrophobicContact CG-CE2 4.1Å; Y420-F442 HydrophobicContact CG-CZ 4.42Å; R423-F442 HydrophobicContact CB-CE2 4.28Å; R423-F442 HydrophobicContact CB-CZ 4.1Å; R423-F442 VanDerWaalsContact CD-CZ 3.41Å; R423-F442 HydrophobicContact CG-CZ 4.02Å; R423-F442 VanDerWaalsContact NH1-CD1 3.27Å; F440-F442 VanDerWaalsContact C-N 3.28Å; F440-F442 PolarHBondContact O-N 3Å; F442-A444 PolarHBondContact O-N 2.97Å; F442-I445 HydrophobicContact CB-CD1 4.29Å; F442-I445 HydrophobicContact CB-CG1 4.27Å; F442-I445 HydrophobicContact CD2-CD1 4.02Å; F442-I445 PolarHBondContact O-N 3.46Å; F442-I445 VanDerWaalsContact O-N 3.08Å; F442-L446 PolarHBondContact O-N 3.11Å; F442-L446 VanDerWaalsContact O-N 3.13Å
443	Q	82.1	Confident	83.8	Confident	57 Å²	57	65.6 Å²	65.6	27%	0.266	35%	0.345	S	S	.	.	H	α-helix	trans	-54	-38.8	174.5	-167.9	76.4	-21.9	0	0	112.5	F431 I445 L446 N447	F431-Q443 HydrophobicContact CD1-CB 4.02Å; F431-Q443 VanDerWaalsContact CD2-N 3.34Å; F431-Q443 HydrophobicContact CE1-CB 3.89Å; F431-Q443 HydrophobicContact CG-CB 4.44Å; F431-Q443 HydrophobicContact CZ-CB 4.24Å; Q443-I445 VanDerWaalsContact C-N 3.31Å; Q443-I445 PolarHBondContact O-N 2.96Å; Q443-L446 PolarHBondContact O-N 3.37Å; Q443-N447 WeakPolarHBondContact O-CB 3.39Å; Q443-N447 PolarHBondContact O-N 3.25Å; Q443-N447 PolarHBondContact O-ND2 2.95Å
444	A	82.1	Confident	83.7	Confident	74 Å²	74	67.1 Å²	67.1	61%	0.612	35%	0.351	S	S	*	.	H	α-helix	trans	-63.1	-36.3	179.3	0	0	0	0	0	113	F442 Q448	F442-A444 PolarHBondContact O-N 2.97Å; A444-Q448 PolarHBondContact O-N 3.24Å
445	I	82.6	Confident	83.3	Confident	54 Å²	54	66.9 Å²	66.9	28%	0.277	36%	0.36	S	S	.	.	H	α-helix	trans	-74.5	-41.1	177.8	-58.5	176.3	0	0	0	109.9	Y420 F440 P441 F442 Q443 N447 Q448 H449	Y420-I445 HydrophobicContact CE2-CD1 4.26Å; F440-I445 HydrophobicContact CB-CG2 4.5Å; F440-I445 HydrophobicContact CD1-CB 4.49Å; F440-I445 HydrophobicContact CD1-CG2 3.63Å; F440-I445 HydrophobicContact CE1-CG2 4.28Å; F440-I445 HydrophobicContact CG-CG2 4.34Å; P441-I445 HydrophobicContact CG-CD1 4.24Å; F442-I445 HydrophobicContact CB-CD1 4.29Å; F442-I445 HydrophobicContact CB-CG1 4.27Å; F442-I445 HydrophobicContact CD2-CD1 4.02Å; F442-I445 PolarHBondContact O-N 3.46Å; F442-I445 VanDerWaalsContact O-N 3.08Å; Q443-I445 VanDerWaalsContact C-N 3.31Å; Q443-I445 PolarHBondContact O-N 2.96Å; I445-N447 VanDerWaalsContact C-N 3.33Å; I445-N447 PolarHBondContact O-N 3.39Å; I445-Q448 PolarHBondContact O-N 2.88Å; I445-H449 WeakPolarHBondContact O-CB 3.42Å; I445-H449 PolarHBondContact O-N 3.32Å
446	L	86	Confident	82.7	Confident	16 Å²	16	67.8 Å²	67.8	8%	0.084	38%	0.383	C	S	.	.	H	α-helix	trans	-56.6	-48	171.3	170.9	62	0	0	0	110.8	F431 H432 C433 F440 F442 Q443 Q448 H449 F450	F431-L446 HydrophobicContact CB-CB 4.38Å; F431-L446 HydrophobicContact CB-CD2 4.02Å; H432-L446 WeakPolarHBondContact O-CD2 3.36Å; C433-L446 HydrophobicContact CB-CD1 3.6Å; F440-L446 HydrophobicContact CB-CB 4.26Å; F440-L446 HydrophobicContact CD2-CB 3.93Å; F440-L446 HydrophobicContact CD2-CD1 3.67Å; F440-L446 HydrophobicContact CD2-CG 4.4Å; F440-L446 HydrophobicContact CE2-CD1 3.84Å; F440-L446 HydrophobicContact CG-CB 4.29Å; F442-L446 PolarHBondContact O-N 3.11Å; F442-L446 VanDerWaalsContact O-N 3.13Å; Q443-L446 PolarHBondContact O-N 3.37Å; L446-Q448 VanDerWaalsContact C-N 3.33Å; L446-Q448 PolarHBondContact O-N 2.66Å; L446-H449 WeakPolarHBondContact O-CB 3.41Å; L446-H449 PolarHBondContact O-N 2.88Å; L446-F450 VanDerWaalsContact O-CB 3.29Å; L446-F450 WeakPolarHBondContact O-CB 3.44Å; L446-F450 PolarHBondContact O-N 3.47Å
447	N	84.8	Confident	81.9	Confident	45 Å²	45	68.4 Å²	68.4	24%	0.241	39%	0.387	C	S	.	.	H	α-helix	trans	-61.1	-39.8	178.4	-72.5	-15	0	0	0	112.4	Q443 I445 F450 R451 I459	Q443-N447 WeakPolarHBondContact O-CB 3.39Å; Q443-N447 PolarHBondContact O-N 3.25Å; Q443-N447 PolarHBondContact O-ND2 2.95Å; I445-N447 VanDerWaalsContact C-N 3.33Å; I445-N447 PolarHBondContact O-N 3.39Å; N447-F450 PolarHBondContact O-N 2.97Å; N447-R451 WeakPolarHBondContact O-CB 3.33Å; N447-R451 WeakPolarHBondContact O-CG 3.24Å; N447-R451 PolarHBondContact O-N 3.48Å; N447-I459 WeakPolarHBondContact OD1-CG2 3.5Å
448	Q	85.4	Confident	81.2	Confident	108 Å²	108	73.1 Å²	73.1	51%	0.505	40%	0.398	S	S	.	.	H	α-helix	trans	-66.3	-43.7	174.8	-172.4	-177.3	24.1	0	0	111.7	A444 I445 L446 F450 K452	A444-Q448 PolarHBondContact O-N 3.24Å; I445-Q448 PolarHBondContact O-N 2.88Å; L446-Q448 VanDerWaalsContact C-N 3.33Å; L446-Q448 PolarHBondContact O-N 2.66Å; Q448-F450 VanDerWaalsContact C-N 3.32Å; Q448-K452 HydrophobicContact CG-CD 4.35Å; Q448-K452 WeakPolarHBondContact O-CB 3.37Å; Q448-K452 WeakPolarHBondContact O-CG 3.42Å; Q448-K452 PolarHBondContact O-N 2.96Å; Q448-K452 VanDerWaalsContact O-N 3.16Å
449	H	87	Confident	80.3	Confident	21 Å²	21	69.6 Å²	69.6	10%	0.097	38%	0.384	C	S	.	.	H	α-helix	trans	-58.9	-46.8	174.5	163.6	73	0	0	0	110.7	C436 F440 I445 L446 K452 N453 H454	C436-H449 PolarHBondContact SG-NE2 2.83Å; F440-H449 HydrophobicContact CE1-CB 4Å; F440-H449 HydrophobicContact CE2-CB 4.08Å; F440-H449 AromaticContact CE2-CD2 3.5Å; F440-H449 AromaticContact CE2-CG 3.77Å; F440-H449 HydrophobicContact CZ-CB 3.57Å; F440-H449 AromaticContact CZ-CD2 3.48Å; F440-H449 VanDerWaalsContact CZ-CD2 3.48Å; F440-H449 WeakPolarHBondContact CZ-CD2 3.11Å; F440-H449 AromaticContact CZ-CG 3.28Å; F440-H449 AromaticContact CZ-ND1 3.74Å; I445-H449 WeakPolarHBondContact O-CB 3.42Å; I445-H449 PolarHBondContact O-N 3.32Å; L446-H449 WeakPolarHBondContact O-CB 3.41Å; L446-H449 PolarHBondContact O-N 2.88Å; H449-K452 PolarHBondContact O-N 2.77Å; H449-N453 PolarHBondContact ND1-ND2 3.31Å; H449-N453 WeakPolarHBondContact O-CB 3.39Å; H449-N453 PolarHBondContact O-N 2.92Å; H449-N453 PolarHBondContact O-ND2 3.05Å; H449-H454 AromaticContact NE2-CD2 3.92Å; H449-H454 AromaticContact NE2-NE2 3.52Å
450	F	84.3	Confident	79.1	Confident	7 Å²	7	69.7 Å²	69.7	3%	0.031	38%	0.384	C	S	.	.	H	α-helix	trans	-61.6	-48.4	-179.2	-161.4	-91.8	0	0	0	111.8	H434 V435 L446 N447 Q448 K452 H454 C457 I458 I459	H434-F450 AromaticContact CE1-CE2 3.32Å; H434-F450 WeakPolarHBondContact CE1-CE2 3.3Å; H434-F450 AromaticContact CE1-CZ 3.54Å; H434-F450 AromaticContact ND1-CE2 3.75Å; V435-F450 HydrophobicContact CG2-CE2 3.68Å; V435-F450 HydrophobicContact CG2-CZ 4.2Å; L446-F450 VanDerWaalsContact O-CB 3.29Å; L446-F450 WeakPolarHBondContact O-CB 3.44Å; L446-F450 PolarHBondContact O-N 3.47Å; N447-F450 PolarHBondContact O-N 2.97Å; Q448-F450 VanDerWaalsContact C-N 3.32Å; F450-K452 VanDerWaalsContact C-N 3.27Å; F450-K452 PolarHBondContact O-N 3.04Å; F450-H454 HydrophobicContact CD2-CB 4.34Å; F450-H454 AromaticContact CD2-CD2 3.96Å; F450-H454 HydrophobicContact CE2-CB 4.31Å; F450-H454 HydrophobicContact CG-CB 4.48Å; F450-H454 HydrophobicContact CZ-CB 4.48Å; F450-H454 CarbonylContact O-C 3.3Å; F450-H454 WeakPolarHBondContact O-CA 3.48Å; F450-H454 PolarHBondContact O-N 2.93Å; F450-C457 HydrophobicContact CE1-CB 3.74Å; F450-C457 WeakPolarHBondContact CE1-O 3.35Å; F450-C457 HydrophobicContact CE2-CB 4.43Å; F450-C457 HydrophobicContact CZ-CB 3.43Å; F450-C457 VanDerWaalsContact CZ-CB 3.43Å; F450-I458 WeakPolarHBondContact CZ-O 3.49Å; F450-I459 HydrophobicContact CD1-CD1 4.47Å; F450-I459 HydrophobicContact CD1-CG1 3.51Å; F450-I459 HydrophobicContact CE1-CB 4.5Å; F450-I459 HydrophobicContact CE1-CG1 3.79Å; F450-I459 HydrophobicContact CG-CG1 4.33Å
451	R	84.4	Confident	77.9	Confident	186 Å²	186	76.5 Å²	76.5	70%	0.702	42%	0.421	S	S	*	.	H	α-helix	trans	-59.8	-34.2	176.5	-76.1	-179.9	-178.8	-179.2	0.5	113.7	N447	N447-R451 WeakPolarHBondContact O-CB 3.33Å; N447-R451 WeakPolarHBondContact O-CG 3.24Å; N447-R451 PolarHBondContact O-N 3.48Å
452	K	86.3	Confident	76.5	Confident	150 Å²	150	81.4 Å²	81.4	65%	0.652	44%	0.441	S	S	*	.	H	α-helix	trans	-87.5	-36.2	-176.9	-73.2	-175.3	173.7	-172.8	0	113.6	Q448 H449 F450	Q448-K452 HydrophobicContact CG-CD 4.35Å; Q448-K452 WeakPolarHBondContact O-CB 3.37Å; Q448-K452 WeakPolarHBondContact O-CG 3.42Å; Q448-K452 PolarHBondContact O-N 2.96Å; Q448-K452 VanDerWaalsContact O-N 3.16Å; H449-K452 PolarHBondContact O-N 2.77Å; F450-K452 VanDerWaalsContact C-N 3.27Å; F450-K452 PolarHBondContact O-N 3.04Å
453	N	84.1	Confident	75.2	Confident	95 Å²	95	81.8 Å²	81.8	51%	0.508	46%	0.456	S	S	.	.	H	α-helix	trans	-108.5	-15.4	-169.2	-59.8	-88.3	0	0	0	113.1	H449 P455	H449-N453 PolarHBondContact ND1-ND2 3.31Å; H449-N453 WeakPolarHBondContact O-CB 3.39Å; H449-N453 PolarHBondContact O-N 2.92Å; H449-N453 PolarHBondContact O-ND2 3.05Å; N453-P455 VanDerWaalsContact C-CD 3.43Å
454	H	85.3	Confident	73.4	Confident	32 Å²	32	83.1 Å²	83.1	15%	0.148	47%	0.469	C	S	.	.	S	Bend	trans	-131.4	58.5	177.2	-54.8	-54.3	0	0	0	111.3	C433 V435 C436 H449 F450 G456 C457	C433-H454 VanDerWaalsContact SG-CD2 3.51Å; C433-H454 PolarHBondContact SG-NE2 2.93Å; V435-H454 WeakPolarHBondContact CG1-ND1 3.37Å; C436-H454 PolarHBondContact SG-NE2 3.14Å; H449-H454 AromaticContact NE2-CD2 3.92Å; H449-H454 AromaticContact NE2-NE2 3.52Å; F450-H454 HydrophobicContact CD2-CB 4.34Å; F450-H454 AromaticContact CD2-CD2 3.96Å; F450-H454 HydrophobicContact CE2-CB 4.31Å; F450-H454 HydrophobicContact CG-CB 4.48Å; F450-H454 HydrophobicContact CZ-CB 4.48Å; F450-H454 CarbonylContact O-C 3.3Å; F450-H454 WeakPolarHBondContact O-CA 3.48Å; F450-H454 PolarHBondContact O-N 2.93Å; H454-G456 PolarHBondContact O-N 3.21Å; H454-C457 HydrophobicContact CB-CB 4.41Å; H454-C457 PolarHBondContact O-N 2.86Å
455	P	74.1	Confident	71.6	Confident	107 Å²	107	85.7 Å²	85.7	70%	0.695	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	128.6	177.7	26.8	-33.2	0	0	0	110.6	N453	N453-P455 VanDerWaalsContact C-CD 3.43Å
456	G	69.9	Low	69.1	Low	86 Å²	86	88.6 Å²	88.6	89%	0.887	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	96	-10.3	177.4	0	0	0	0	0	115.8	H454	H454-G456 PolarHBondContact O-N 3.21Å
457	C	70.8	Confident	66.7	Low	66 Å²	66	95.5 Å²	95.5	45%	0.446	53%	0.529	S	S	.	.	S	Bend	trans	-81.8	152.4	169.6	-66.3	0	0	0	0	110.6	F450 H454	F450-C457 HydrophobicContact CE1-CB 3.74Å; F450-C457 WeakPolarHBondContact CE1-O 3.35Å; F450-C457 HydrophobicContact CE2-CB 4.43Å; F450-C457 HydrophobicContact CZ-CB 3.43Å; F450-C457 VanDerWaalsContact CZ-CB 3.43Å; H454-C457 HydrophobicContact CB-CB 4.41Å; H454-C457 PolarHBondContact O-N 2.86Å
458	I	68.1	Low	63.9	Low	151 Å²	151	97.9 Å²	97.9	77%	0.774	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-84.5	133.3	177.4	-58.8	-179	0	0	0	109	F450 P460	F450-I458 WeakPolarHBondContact CZ-O 3.49Å; I458-P460 WeakPolarHBondContact O-CD 3.46Å
459	I	64.6	Low	61.9	Low	51 Å²	51	98.9 Å²	98.9	26%	0.262	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-71	120.3	174.2	-60.5	170.1	0	0	0	107.7	N447 F450 L461	N447-I459 WeakPolarHBondContact OD1-CG2 3.5Å; F450-I459 HydrophobicContact CD1-CD1 4.47Å; F450-I459 HydrophobicContact CD1-CG1 3.51Å; F450-I459 HydrophobicContact CE1-CB 4.5Å; F450-I459 HydrophobicContact CE1-CG1 3.79Å; F450-I459 HydrophobicContact CG-CG1 4.33Å; I459-L461 PolarHBondContact O-N 2.85Å
460	P	59.9	Low	59.1	Low	59 Å²	59	105.9 Å²	105.9	38%	0.383	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-63.3	129.7	173.5	-16.9	30.6	0	0	0	109.2	H434 I458 E462	H434-P460 VanDerWaalsContact CE1-CD 3.49Å; H434-P460 WeakPolarHBondContact CE1-CD 3.36Å; H434-P460 WeakPolarHBondContact CE1-CG 3.29Å; H434-P460 WeakPolarHBondContact ND1-CG 3.32Å; I458-P460 WeakPolarHBondContact O-CD 3.46Å; P460-E462 PolarHBondContact O-N 2.78Å
461	L	56.4	Low	56.5	Low	175 Å²	175	111.8 Å²	111.8	92%	0.916	64%	0.635	S	S	*	*			trans	-79.9	2.6	-178.9	-77.2	167.9	0	0	0	113.4	I459 G463	I459-L461 PolarHBondContact O-N 2.85Å; L461-G463 PolarHBondContact O-N 3.47Å
462	E	49.4	Very low	53.8	Low	131 Å²	131	108.1 Å²	108.1	61%	0.612	63%	0.633	S	S	*	*			trans	-70.7	126.9	-176	-58.2	-147.9	158.8	0	0	111.3	P460 H465	P460-E462 PolarHBondContact O-N 2.78Å; E462-H465 IonicContact OE2-CE1 3.11Å; E462-H465 PolarHBondContact OE2-CE1 3.04Å; E462-H465 IonicContact OE2-NE2 3.28Å; E462-H465 PolarHBondContact OE2-NE2 3.28Å
463	G	51.3	Low	51.5	Low	46 Å²	46	107.8 Å²	107.8	47%	0.474	64%	0.643	S	S	.	*			trans	-66.2	177.1	174.1	0	0	0	0	0	111.7	L461 H465	L461-G463 PolarHBondContact O-N 3.47Å; G463-H465 PolarHBondContact O-N 2.99Å
464	P	43.8	Very low	48.8	Very low	85 Å²	85	108.7 Å²	108.7	55%	0.552	65%	0.653	S	S	*	*			trans	-57.7	112.8	-179.6	25.1	-31.5	0	0	0	108.8	F431 S466	F431-P464 HydrophobicContact CE1-CB 4.03Å; F431-P464 HydrophobicContact CZ-CB 4.41Å; P464-S466 PolarHBondContact O-N 3.45Å
465	H	43.9	Very low	46.6	Very low	129 Å²	129	111.9 Å²	111.9	60%	0.597	68%	0.678	S	S	*	*			trans	-52.7	116	164.1	-69.6	-76.1	0	0	0	106.2	E462 G463 I467	E462-H465 IonicContact OE2-CE1 3.11Å; E462-H465 PolarHBondContact OE2-CE1 3.04Å; E462-H465 IonicContact OE2-NE2 3.28Å; E462-H465 PolarHBondContact OE2-NE2 3.28Å; G463-H465 PolarHBondContact O-N 2.99Å; H465-I467 PolarHBondContact O-N 3.31Å
466	S	31.8	Very low	44.6	Very low	115 Å²	115	117.3 Å²	117.3	80%	0.804	69%	0.685	S	S	*	*			trans	-64.3	101.1	-178.9	-65	0	0	0	0	107.3	P464	P464-S466 PolarHBondContact O-N 3.45Å
467	I	35.5	Very low	42.8	Very low	161 Å²	161	120.7 Å²	120.7	83%	0.826	68%	0.678	S	S	*	*			trans	-95.5	94.6	159.5	-53.9	177	0	0	0	104.6	H465	H465-I467 PolarHBondContact O-N 3.31Å
468	S	24.8	Very low	40.7	Very low	95 Å²	95	122 Å²	122	66%	0.664	69%	0.694	S	S	*	*			trans	-53.7	143.3	165.3	-68.7	0	0	0	0	109.4	E470	S468-E470 PolarHBondContact O-N 3.09Å; S468-E470 VanDerWaalsContact O-N 3.08Å
469	P	43.2	Very low	38.8	Very low	129 Å²	129	122.8 Å²	122.8	84%	0.838	69%	0.694	S	S	*	*	S	Bend	trans	-86.8	77.3	-179.4	35.9	-30.7	0	0	0	109
470	E	28.2	Very low	37	Very low	167 Å²	167	129.7 Å²	129.7	78%	0.78	73%	0.725	S	S	*	*			trans	-145.7	123.4	160.3	-78.9	-156.2	155.5	0	0	111.9	S468	S468-E470 PolarHBondContact O-N 3.09Å; S468-E470 VanDerWaalsContact O-N 3.08Å
471	T	30.4	Very low	35.5	Very low	132 Å²	132	130.1 Å²	130.1	81%	0.81	74%	0.74	S	S	*	*			trans	67.4	126.3	163.2	70.6	0	0	0	0	114.6
472	T	27	Very low	34.1	Very low	109 Å²	109	127.5 Å²	127.5	67%	0.669	74%	0.737	S	S	*	*			cis	-165.7	134.4	36.7	-28.1	0	0	0	0	106.1	T474	T472-T474 VanDerWaalsContact C-N 3.32Å; T472-T474 PolarHBondContact O-N 3.09Å
473	V	39.3	Very low	33.4	Very low	142 Å²	142	126.6 Å²	126.6	86%	0.861	74%	0.742	S	S	*	*			trans	-67.3	100.4	157.8	173	0	0	0	0	106.1
474	T	26.6	Very low	32.2	Very low	115 Å²	115	131.4 Å²	131.4	71%	0.706	76%	0.762	S	S	*	*			trans	-135.4	102	156	34.1	0	0	0	0	107.8	T472	T472-T474 VanDerWaalsContact C-N 3.32Å; T472-T474 PolarHBondContact O-N 3.09Å
475	S	39.9	Very low	31.6	Very low	99 Å²	99	135.9 Å²	135.9	69%	0.692	78%	0.776	S	S	*	*			trans	-42.9	133	155.2	-40.2	0	0	0	0	110.1
476	R	31.7	Very low	30.8	Very low	221 Å²	221	138.4 Å²	138.4	83%	0.834	79%	0.788	S	S	*	*				165.2	130.4	122.9	-91.5	170.9	175.2	177.7	-2.2	112.7
477	Q	31.3	Very low	30.7	Very low	156 Å²	156	141.3 Å²	141.3	73%	0.729	79%	0.789	S	S	*	*			trans	72.8	107.9	137.8	-67.2	171.4	-46.3	0	0	119.9
478	A	26.6	Very low	30.3	Very low	95 Å²	95	139.1 Å²	139.1	79%	0.785	78%	0.783	S	S	*	*				-137.6	98.8	122.9	0	0	0	0	0	105
479	E	28.4	Very low	30.6	Very low	167 Å²	167	141.3 Å²	141.3	78%	0.78	79%	0.792	S	S	*	*				47.2	76.3	90.9	-71	-76.8	140.7	0	0	110.6
480	E	27.6	Very low	30	Very low	195 Å²	195	139.2 Å²	139.2	91%	0.911	79%	0.785	S	S	*	*			trans	-73.5	115.7	157.7	-74.2	-159.6	151	0	0	108.5
481	G	27.4	Very low	30.7	Very low	68 Å²	68	137.4 Å²	137.4	70%	0.701	79%	0.788	S	S	*	*			trans	-85.5	106.6	169.2	0	0	0	0	0	111.4
482	S	28.1	Very low	30.6	Very low	121 Å²	121	134.5 Å²	134.5	85%	0.846	79%	0.785	S	S	*	*			trans	82.2	150.9	139.1	-69.8	0	0	0	0	121.4
483	P	34.5	Very low	30.7	Very low	111 Å²	111	138.4 Å²	138.4	72%	0.721	80%	0.795	S	S	*	*			trans	-111.9	159.7	-147.1	38.4	-25.7	0	0	0	113
484	T	26.8	Very low	30.1	Very low	147 Å²	147	137 Å²	137	90%	0.902	79%	0.792	S	S	*	*			trans	-111.5	126.6	159.7	41.6	0	0	0	0	109.9
485	Q	30.3	Very low	30.3	Very low	180 Å²	180	136 Å²	136	84%	0.841	80%	0.795	S	S	*	*			trans	-75.4	156.2	-176.8	-73.6	173.2	-27.4	0	0	113.1
486	E	28.1	Very low	29.7	Very low	181 Å²	181	140.8 Å²	140.8	85%	0.846	81%	0.806	S	S	*	*			trans	-6.4	136.5	158.4	-62.6	176.8	125.4	0	0	120.5
487	E	29	Very low	29.6	Very low	177 Å²	177	133.7 Å²	133.7	83%	0.827	80%	0.802	S	S	*	*				-168.8	107.2	123.5	-108.8	-175.8	145.9	0	0	109.4
488	T	28.1	Very low	29.6	Very low	115 Å²	115	131.4 Å²	131.4	71%	0.706	80%	0.803	S	S	*	*				84.8	117.6	105.5	52.6	0	0	0	0	118.5
489	V	29.9	Very low	29.8	Very low	141 Å²	141	133.4 Å²	133.4	86%	0.855	81%	0.805	S	S	*	*			trans	78	123.2	132.4	-177.2	0	0	0	0	120.1
490	A	29.9	Very low	29.9	Very low	84 Å²	84	129.8 Å²	129.8	69%	0.694	80%	0.799	S	S	*	*			trans	-87.2	-169.6	168	0	0	0	0	0	111
491	P	44.8	Very low	30.2	Very low	129 Å²	129	126.1 Å²	126.1	84%	0.838	79%	0.79	S	S	*	*			cis	-141.7	-170.4	-4.1	39.4	-17.6	0	0	0	115.2
492	G	28	Very low	30.7	Very low	71 Å²	71	129.3 Å²	129.3	73%	0.732	80%	0.796	S	S	*	*			trans	92.4	153.9	160.3	0	0	0	0	0	115.1
493	E	27.9	Very low	30.9	Very low	191 Å²	191	126.8 Å²	126.8	89%	0.893	79%	0.789	S	S	*	*			cis	-165.4	159.3	-3.5	-116.1	-178.9	150.7	0	0	107.6
494	S	27.8	Very low	32	Very low	114 Å²	114	127 Å²	127	80%	0.797	79%	0.79	S	S	*	*			trans	-26.4	142.2	164.3	-46.8	0	0	0	0	120.3
495	A	29.4	Very low	32.6	Very low	92 Å²	92	131.1 Å²	131.1	76%	0.76	81%	0.807	S	S	*	*			trans	168.5	112.5	134	0	0	0	0	0	109.1
496	Q	28.7	Very low	32.7	Very low	200 Å²	200	128.7 Å²	128.7	94%	0.935	81%	0.805	S	S	*	*				71.1	128.9	80.9	-77.8	-165.2	-11.1	0	0	116.4
497	G	28.4	Very low	32.9	Very low	73 Å²	73	125.9 Å²	125.9	75%	0.753	80%	0.803	S	S	*	*			trans	100.8	131.2	159.8	0	0	0	0	0	114
498	S	32.1	Very low	33.1	Very low	107 Å²	107	123.1 Å²	123.1	75%	0.748	80%	0.802	S	S	*	*			cis	-176.4	133	2.5	28	0	0	0	0	105.4
499	V	31	Very low	33.4	Very low	137 Å²	137	123.6 Å²	123.6	83%	0.83	81%	0.808	S	S	*	*				56.3	123.1	100.7	-167.4	0	0	0	0	111.1
500	S	29.4	Very low	33.6	Very low	91 Å²	91	122.5 Å²	122.5	64%	0.636	81%	0.805	S	S	*	*			cis	-166.9	151.5	36	-22.6	0	0	0	0	111.9
501	T	34.9	Very low	33.9	Very low	118 Å²	118	125.1 Å²	125.1	72%	0.724	81%	0.812	S	S	*	*			trans	14.7	134	132.2	61.2	0	0	0	0	120.3
502	T	37	Very low	33.1	Very low	135 Å²	135	124.8 Å²	124.8	83%	0.828	81%	0.81	S	S	*	*				167.1	138.1	100.8	42.3	0	0	0	0	110.4
503	G	33	Very low	33.5	Very low	68 Å²	68	128.9 Å²	128.9	70%	0.701	82%	0.816	S	S	*	*			trans	-70.5	-157.7	156.8	0	0	0	0	0	111
504	P	56.6	Low	34	Very low	116 Å²	116	123.8 Å²	123.8	75%	0.753	81%	0.81	S	S	*	*			cis	-127.1	172.6	5.3	39.2	-22.2	0	0	0	114
505	D	39.3	Very low	34.5	Very low	234 Å²	234	124.6 Å²	124.6	100%	1.251	81%	0.811	S	S	*	*				171.5	0	120.1	-94.3	-17.2	0	0	0	111

Retrieved 505 of 505 residues in 586.1 ms (Link to these results)

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