A0A096NA69_PAPAN Loading...

Zinc finger protein 251

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A096NA69, Species PAPAN (Papio anubis, Olive baboon), Gene ZNF251, Length 671 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.5	Very low	31.1	Very low	249 Å²	249	148.2 Å²	148.2	100%	1.227	86%	0.861	S	S	*	*				0	101.6	0	-69.5	178.6	175.5	0	0	108.2
2	S	25.9	Very low	31.7	Very low	127 Å²	127	147.8 Å²	147.8	89%	0.888	85%	0.845	S	S	*	*			trans	-130.2	112.2	170	-67.9	0	0	0	0	106.9
3	A	27.7	Very low	32.2	Very low	102 Å²	102	149.8 Å²	149.8	84%	0.843	85%	0.846	S	S	*	*			trans	-86.8	133.8	-173.3	0	0	0	0	0	111.3
4	T	28.7	Very low	33.9	Very low	114 Å²	114	143.9 Å²	143.9	70%	0.699	82%	0.816	S	S	*	*			trans	-60.8	143.2	167.7	-34.8	0	0	0	0	111.4
5	V	27.2	Very low	35.1	Very low	137 Å²	137	140.4 Å²	140.4	83%	0.83	79%	0.794	S	S	*	*			trans	-126.7	110.5	155.5	176.6	0	0	0	0	108.3
6	Q	28.8	Very low	36.8	Very low	163 Å²	163	135.3 Å²	135.3	76%	0.762	77%	0.766	S	S	*	*			trans	-72.9	140.1	168.6	-82.6	123.4	-36.6	0	0	111.1
7	L	27.1	Very low	38.3	Very low	157 Å²	157	127.6 Å²	127.6	82%	0.822	72%	0.723	S	S	*	*			trans	-101.7	132.3	165.1	-75.7	163.9	0	0	0	109.1
8	P	34.5	Very low	39.7	Very low	130 Å²	130	128.6 Å²	128.6	84%	0.844	72%	0.72	S	S	*	*			trans	-104.2	141.6	169	29.2	-16.9	0	0	0	113
9	G	34.2	Very low	40.7	Very low	80 Å²	80	125.2 Å²	125.2	83%	0.825	70%	0.7	S	S	*	*			trans	95.8	59	144.9	0	0	0	0	0	119.4
10	H	34.3	Very low	41.5	Very low	177 Å²	177	121.1 Å²	121.1	82%	0.819	68%	0.678	S	S	*	*			trans	-102.9	102.4	155	-106.3	-86.3	0	0	0	108.3	E12	H10-E12 PolarHBondContact O-N 3.05Å
11	Q	35.3	Very low	42.4	Very low	194 Å²	194	115.7 Å²	115.7	91%	0.907	65%	0.649	S	S	*	*			trans	-83.4	97.8	161.6	-86.3	-177.8	-19.3	0	0	107.9	M13	Q11-M13 PolarHBondContact O-N 2.99Å
12	E	37.8	Very low	43.3	Very low	143 Å²	143	105.6 Å²	105.6	67%	0.668	60%	0.601	S	S	*	*			trans	-71.4	112.5	165.2	-69.5	-175.5	158.6	0	0	108.3	H10 P14	H10-E12 PolarHBondContact O-N 3.05Å; E12-P14 WeakPolarHBondContact O-CD 3.33Å
13	M	38.9	Very low	45.1	Very low	175 Å²	175	105.3 Å²	105.3	86%	0.862	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-68.6	123.6	167.5	-72.8	-143.5	-57.1	0	0	109	Q11 L15	Q11-M13 PolarHBondContact O-N 2.99Å; M13-L15 PolarHBondContact O-N 3.18Å
14	P	56	Low	46.3	Very low	66 Å²	66	104.6 Å²	104.6	43%	0.429	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-70.8	127.7	-177.3	27.2	-32	0	0	0	110.6	E12 T16 F56	E12-P14 WeakPolarHBondContact O-CD 3.33Å; P14-T16 WeakPolarHBondContact O-CG2 3.22Å; P14-T16 PolarHBondContact O-N 3.09Å; P14-F56 HydrophobicContact CB-CB 4.41Å; P14-F56 HydrophobicContact CB-CD1 3.56Å; P14-F56 HydrophobicContact CB-CD2 4.23Å; P14-F56 HydrophobicContact CB-CE1 3.77Å; P14-F56 HydrophobicContact CB-CE2 4.42Å; P14-F56 HydrophobicContact CB-CG 3.8Å; P14-F56 HydrophobicContact CB-CZ 4.2Å
15	L	51.6	Low	47.7	Very low	92 Å²	92	102 Å²	102	48%	0.482	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-54	121.3	168.5	-87	149	0	0	0	109.7	M13 L54	M13-L15 PolarHBondContact O-N 3.18Å; L15-L54 HydrophobicContact CB-CD1 4.37Å; L15-L54 HydrophobicContact CD1-CD1 4.04Å
16	T	61.7	Low	48.8	Very low	58 Å²	58	101 Å²	101	36%	0.356	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-99.5	161.9	179.7	74.4	0	0	0	0	111.1	P14 Q18 D19	P14-T16 WeakPolarHBondContact O-CG2 3.22Å; P14-T16 PolarHBondContact O-N 3.09Å; T16-Q18 PolarHBondContact O-N 3.3Å; T16-Q18 PolarHBondContact OG1-N 3.44Å; T16-D19 WeakPolarHBondContact CA-OD2 3.31Å; T16-D19 WeakPolarHBondContact CB-OD2 3.39Å; T16-D19 PolarHBondContact N-OD2 3.19Å; T16-D19 WeakPolarHBondContact O-CB 3.22Å; T16-D19 PolarHBondContact O-N 2.93Å; T16-D19 VanDerWaalsContact OG1-CG 3.3Å; T16-D19 PolarHBondContact OG1-OD2 2.89Å
17	F	62.4	Low	50	Low	5 Å²	5	96.3 Å²	96.3	2%	0.022	52%	0.522	C	S	.	.	G	3₁₀ helix	trans	-63.1	-30.8	175.2	178.1	-99.8	0	0	0	112.2	D19 V20 A21 N47 Y48 V58 P61 I64	F17-D19 PolarHBondContact O-N 2.81Å; F17-V20 HydrophobicContact CD2-CG2 4.05Å; F17-V20 HydrophobicContact CE2-CG2 4.47Å; F17-V20 VanDerWaalsContact O-CG2 3.3Å; F17-V20 WeakPolarHBondContact O-CG2 3.37Å; F17-V20 PolarHBondContact O-N 2.86Å; F17-V20 VanDerWaalsContact O-N 3.08Å; F17-A21 HydrophobicContact CD1-CB 3.79Å; F17-A21 HydrophobicContact CE1-CB 3.4Å; F17-A21 HydrophobicContact CE2-CB 4.43Å; F17-A21 HydrophobicContact CZ-CB 3.72Å; F17-A21 VanDerWaalsContact O-CB 3.27Å; F17-A21 WeakPolarHBondContact O-CB 3.4Å; F17-A21 PolarHBondContact O-N 3.33Å; F17-N47 HydrophobicContact CE2-CB 4.48Å; F17-Y48 AromaticContact CD2-CD2 3.77Å; F17-Y48 HydrophobicContact CD2-CD2 3.77Å; F17-Y48 HydrophobicContact CD2-CG 4.31Å; F17-Y48 HydrophobicContact CE2-CD2 4.26Å; F17-Y48 HydrophobicContact CE2-CG 4.4Å; F17-Y48 HydrophobicContact CG-CD2 4.23Å; F17-V58 HydrophobicContact CB-CG1 4.17Å; F17-P61 HydrophobicContact CB-CG 3.72Å; F17-P61 HydrophobicContact CD1-CB 3.73Å; F17-P61 HydrophobicContact CD1-CG 3.11Å; F17-P61 HydrophobicContact CD2-CG 4.41Å; F17-P61 HydrophobicContact CE1-CB 4.03Å; F17-P61 HydrophobicContact CE1-CG 3.74Å; F17-P61 HydrophobicContact CG-CG 3.47Å; F17-P61 VanDerWaalsContact CG-CG 3.47Å; F17-I64 HydrophobicContact CD1-CG1 4.34Å; F17-I64 HydrophobicContact CD2-CG1 4.41Å; F17-I64 HydrophobicContact CE1-CD1 3.87Å; F17-I64 HydrophobicContact CE1-CG1 3.62Å; F17-I64 HydrophobicContact CE2-CD1 3.66Å; F17-I64 HydrophobicContact CE2-CG1 3.77Å; F17-I64 HydrophobicContact CZ-CD1 3.14Å; F17-I64 HydrophobicContact CZ-CG1 3.33Å
18	Q	63.8	Low	51.3	Low	146 Å²	146	93.6 Å²	93.6	68%	0.682	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-64.7	-23.2	179.8	-156.6	159.7	4.7	0	0	112.2	T16 V20 Y23	T16-Q18 PolarHBondContact O-N 3.3Å; T16-Q18 PolarHBondContact OG1-N 3.44Å; Q18-V20 VanDerWaalsContact C-N 3.33Å; Q18-Y23 HydrophobicContact CG-CE2 4.39Å
19	D	58.5	Low	52.3	Low	64 Å²	64	87.7 Å²	87.7	34%	0.342	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-76	-19.9	176.3	-57.9	-51.3	0	0	0	113.5	T16 F17 S333	T16-D19 WeakPolarHBondContact CA-OD2 3.31Å; T16-D19 WeakPolarHBondContact CB-OD2 3.39Å; T16-D19 PolarHBondContact N-OD2 3.19Å; T16-D19 WeakPolarHBondContact O-CB 3.22Å; T16-D19 PolarHBondContact O-N 2.93Å; T16-D19 VanDerWaalsContact OG1-CG 3.3Å; T16-D19 PolarHBondContact OG1-OD2 2.89Å; F17-D19 PolarHBondContact O-N 2.81Å; D19-S333 WeakPolarHBondContact O-CB 3.48Å; D19-S333 PolarHBondContact O-OG 3.45Å
20	V	57.2	Low	53.3	Low	42 Å²	42	88.7 Å²	88.7	26%	0.255	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-6.2	-176.8	-59.1	0	0	0	0	113.7	F17 Q18 N47 V51	F17-V20 HydrophobicContact CD2-CG2 4.05Å; F17-V20 HydrophobicContact CE2-CG2 4.47Å; F17-V20 VanDerWaalsContact O-CG2 3.3Å; F17-V20 WeakPolarHBondContact O-CG2 3.37Å; F17-V20 PolarHBondContact O-N 2.86Å; F17-V20 VanDerWaalsContact O-N 3.08Å; Q18-V20 VanDerWaalsContact C-N 3.33Å; V20-N47 HydrophobicContact CG2-CB 4.15Å; V20-N47 PolarHBondContact O-ND2 3.2Å; V20-V51 HydrophobicContact CB-CG2 4.41Å; V20-V51 HydrophobicContact CG1-CG2 4.16Å; V20-V51 HydrophobicContact CG2-CG2 3.43Å; V20-V51 VanDerWaalsContact CG2-CG2 3.43Å
21	A	59.8	Low	54.4	Low	8 Å²	8	88.1 Å²	88.1	7%	0.066	45%	0.449	C	S	.	.			trans	-77.8	142	177.1	0	0	0	0	0	110.5	F17 Y23	F17-A21 HydrophobicContact CD1-CB 3.79Å; F17-A21 HydrophobicContact CE1-CB 3.4Å; F17-A21 HydrophobicContact CE2-CB 4.43Å; F17-A21 HydrophobicContact CZ-CB 3.72Å; F17-A21 VanDerWaalsContact O-CB 3.27Å; F17-A21 WeakPolarHBondContact O-CB 3.4Å; F17-A21 PolarHBondContact O-N 3.33Å; A21-Y23 HydrophobicContact CB-CD2 4.33Å; A21-Y23 HydrophobicContact CB-CE2 3.55Å
22	V	58.3	Low	55.3	Low	37 Å²	37	80.3 Å²	80.3	22%	0.224	41%	0.413	C	S	.	.			trans	-108.3	126	170.8	178.6	0	0	0	0	106.5	F24 Y40 M44 Y321	V22-F24 HydrophobicContact CG1-CZ 4.5Å; V22-Y40 HydrophobicContact CB-CE2 4.26Å; V22-Y40 HydrophobicContact CG1-CE2 4.49Å; V22-Y40 WeakPolarHBondContact O-CE2 2.88Å; V22-Y40 PolarHBondContact O-OH 3.4Å; V22-M44 HydrophobicContact CB-CE 3.59Å; V22-M44 HydrophobicContact CB-SD 4.21Å; V22-M44 HydrophobicContact CG2-CE 3.75Å; V22-M44 PolarHBondContact N-SD 3.13Å; V22-Y321 WeakPolarHBondContact CG2-OH 3.18Å
23	Y	62.4	Low	56.3	Low	121 Å²	121	74.8 Å²	74.8	48%	0.475	40%	0.395	S	S	.	.			trans	-109.2	136	177.8	-60.7	-87.8	0	0	0	108.7	Q18 A21 L63	Q18-Y23 HydrophobicContact CG-CE2 4.39Å; A21-Y23 HydrophobicContact CB-CD2 4.33Å; A21-Y23 HydrophobicContact CB-CE2 3.55Å; Y23-L63 HydrophobicContact CD1-CD2 3.76Å; Y23-L63 HydrophobicContact CE1-CD2 3.48Å; Y23-L63 VanDerWaalsContact CE1-CD2 3.48Å
24	F	54.2	Low	57.1	Low	87 Å²	87	71.8 Å²	71.8	38%	0.382	39%	0.388	S	S	.	.			trans	-102.8	143.5	168.5	-70	-70.2	0	0	0	109	V22 E28 L32 Y40	V22-F24 HydrophobicContact CG1-CZ 4.5Å; F24-E28 HydrophobicContact CB-CB 4.28Å; F24-E28 HydrophobicContact CD1-CB 4.07Å; F24-L32 HydrophobicContact CD2-CD1 3.88Å; F24-L32 HydrophobicContact CE2-CD1 3.69Å; F24-L32 HydrophobicContact CG-CD1 4.35Å; F24-L32 HydrophobicContact CZ-CD1 4.04Å; F24-Y40 HydrophobicContact CD2-CD1 4.5Å; F24-Y40 AromaticContact CD2-CD2 3.97Å; F24-Y40 HydrophobicContact CD2-CD2 3.97Å; F24-Y40 HydrophobicContact CD2-CE1 4.28Å; F24-Y40 AromaticContact CD2-CE2 3.7Å; F24-Y40 HydrophobicContact CD2-CE2 3.7Å; F24-Y40 HydrophobicContact CD2-CG 4.33Å; F24-Y40 AromaticContact CD2-CZ 3.88Å; F24-Y40 HydrophobicContact CE2-CD1 4.47Å; F24-Y40 AromaticContact CE2-CD2 3.39Å; F24-Y40 HydrophobicContact CE2-CD2 3.39Å; F24-Y40 AromaticContact CE2-CE2 3.53Å; F24-Y40 HydrophobicContact CE2-CE2 3.53Å; F24-Y40 AromaticContact CE2-CG 3.88Å; F24-Y40 HydrophobicContact CE2-CG 3.88Å; F24-Y40 HydrophobicContact CZ-CD2 4.44Å
25	S	57.9	Low	56.8	Low	59 Å²	59	76.9 Å²	76.9	41%	0.413	41%	0.406	S	S	.	.			trans	-67.3	161.1	163.8	66.7	0	0	0	0	110.5	A27 E28 G29	S25-A27 PolarHBondContact O-N 2.71Å; S25-E28 VanDerWaalsContact CB-OE2 3.31Å; S25-E28 WeakPolarHBondContact CB-OE2 3.34Å; S25-E28 PolarHBondContact N-OE2 3.28Å; S25-E28 PolarHBondContact O-N 3.29Å; S25-E28 VanDerWaalsContact O-N 3.14Å; S25-E28 WeakPolarHBondContact OG-CG 3.2Å; S25-E28 PolarHBondContact OG-N 3.13Å; S25-E28 PolarHBondContact OG-OE2 3.2Å; S25-G29 PolarHBondContact O-N 3.34Å
26	Q	49.5	Very low	56.8	Low	116 Å²	116	77.7 Å²	77.7	54%	0.542	41%	0.407	S	S	.	.	H	α-helix	trans	-56.3	-36.3	178.5	172.2	164.4	15.2	0	0	112.8	Q30 W74	Q26-Q30 WeakPolarHBondContact O-CG 3.41Å; Q26-Q30 PolarHBondContact O-N 3.25Å; Q26-W74 HydrophobicContact CB-CB 4.08Å; Q26-W74 HydrophobicContact CG-CB 3.53Å; Q26-W74 HydrophobicContact CG-CG 4Å; Q26-W74 PolarHBondContact NE2-O 3.22Å
27	A	53.9	Low	56.6	Low	65 Å²	65	78.1 Å²	78.1	54%	0.537	40%	0.402	S	S	.	.	H	α-helix	trans	-71.8	-38.9	177.6	0	0	0	0	0	112.6	S25	S25-A27 PolarHBondContact O-N 2.71Å
28	E	54.6	Low	56.6	Low	100 Å²	100	80.1 Å²	80.1	47%	0.467	42%	0.42	S	S	.	.	H	α-helix	trans	-72.4	-37.6	179.6	-69.3	163.8	145.7	0	0	112	F24 S25 Q30 Q31	F24-E28 HydrophobicContact CB-CB 4.28Å; F24-E28 HydrophobicContact CD1-CB 4.07Å; S25-E28 VanDerWaalsContact CB-OE2 3.31Å; S25-E28 WeakPolarHBondContact CB-OE2 3.34Å; S25-E28 PolarHBondContact N-OE2 3.28Å; S25-E28 PolarHBondContact O-N 3.29Å; S25-E28 VanDerWaalsContact O-N 3.14Å; S25-E28 WeakPolarHBondContact OG-CG 3.2Å; S25-E28 PolarHBondContact OG-N 3.13Å; S25-E28 PolarHBondContact OG-OE2 3.2Å; E28-Q30 VanDerWaalsContact C-N 3.32Å; E28-Q30 PolarHBondContact O-N 3.36Å; E28-Q31 PolarHBondContact O-N 3.43Å
29	G	56.3	Low	56.6	Low	7 Å²	7	77.1 Å²	77.1	7%	0.072	41%	0.408	C	S	.	.	H	α-helix	trans	-65.4	-33.3	178.4	0	0	0	0	0	113.6	S25 Q31 L32	S25-G29 PolarHBondContact O-N 3.34Å; G29-Q31 VanDerWaalsContact C-N 3.27Å; G29-Q31 PolarHBondContact O-N 3.41Å; G29-L32 PolarHBondContact O-N 3.21Å
30	Q	55.1	Low	57.1	Low	101 Å²	101	75.9 Å²	75.9	47%	0.472	40%	0.399	S	S	.	.	H	α-helix	trans	-68.8	-25.7	177.3	-75.2	-179.5	5.1	0	0	112.9	Q26 E28 R37 W74	Q26-Q30 WeakPolarHBondContact O-CG 3.41Å; Q26-Q30 PolarHBondContact O-N 3.25Å; E28-Q30 VanDerWaalsContact C-N 3.32Å; E28-Q30 PolarHBondContact O-N 3.36Å; Q30-R37 PolarHBondContact O-NH2 3.02Å; Q30-W74 HydrophobicContact CG-CD2 3.94Å; Q30-W74 HydrophobicContact CG-CE3 4.24Å; Q30-W74 HydrophobicContact CG-CH2 3.86Å; Q30-W74 HydrophobicContact CG-CZ2 3.52Å; Q30-W74 HydrophobicContact CG-CZ3 4.21Å
31	Q	57.3	Low	57.6	Low	164 Å²	164	77.1 Å²	77.1	77%	0.766	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-12.4	177.7	-65.9	-178.7	-20.4	0	0	113.7	E28 G29	E28-Q31 PolarHBondContact O-N 3.43Å; G29-Q31 VanDerWaalsContact C-N 3.27Å; G29-Q31 PolarHBondContact O-N 3.41Å
32	L	53.3	Low	57.9	Low	31 Å²	31	81.4 Å²	81.4	16%	0.162	42%	0.421	C	S	.	.	S	Bend	trans	-74.4	128.6	178.1	-62.4	176.9	0	0	0	110.9	F24 G29 Q36 R37	F24-L32 HydrophobicContact CD2-CD1 3.88Å; F24-L32 HydrophobicContact CE2-CD1 3.69Å; F24-L32 HydrophobicContact CG-CD1 4.35Å; F24-L32 HydrophobicContact CZ-CD1 4.04Å; G29-L32 PolarHBondContact O-N 3.21Å; L32-Q36 HydrophobicContact CB-CB 4.21Å; L32-Q36 HydrophobicContact CD2-CB 4.17Å; L32-R37 HydrophobicContact CB-CG 3.79Å; L32-R37 VanDerWaalsContact O-CZ 3.26Å; L32-R37 PolarHBondContact O-NE 3.34Å; L32-R37 PolarHBondContact O-NH2 3.08Å; L32-R37 VanDerWaalsContact O-NH2 3.11Å
33	G	58.6	Low	58.3	Low	27 Å²	27	81.7 Å²	81.7	28%	0.278	42%	0.423	S	S	.	.			trans	-70.1	163.3	171.9	0	0	0	0	0	112.6	Q35 Q36 R37	G33-Q35 PolarHBondContact O-N 2.88Å; G33-Q35 VanDerWaalsContact O-N 3.11Å; G33-Q36 PolarHBondContact O-N 3.13Å; G33-R37 WeakPolarHBondContact O-CG 3.33Å; G33-R37 PolarHBondContact O-N 2.85Å
34	P	55.9	Low	58.9	Low	112 Å²	112	76 Å²	76	73%	0.727	40%	0.401	S	S	*	.	H	α-helix	trans	-54	-36.2	-176	-27.6	34.6	0	0	0	114.6	A38	P34-A38 PolarHBondContact O-N 2.76Å
35	Q	51.1	Low	59.8	Low	173 Å²	173	73.7 Å²	73.7	81%	0.808	39%	0.392	S	S	*	.	H	α-helix	trans	-72.7	-36.7	178.4	-65.8	171.7	-2.7	0	0	112.5	G33 R37 A38 L39	G33-Q35 PolarHBondContact O-N 2.88Å; G33-Q35 VanDerWaalsContact O-N 3.11Å; Q35-R37 VanDerWaalsContact C-N 3.35Å; Q35-A38 PolarHBondContact O-N 3.39Å; Q35-L39 WeakPolarHBondContact O-CB 3.48Å; Q35-L39 PolarHBondContact O-N 3.01Å
36	Q	50.6	Low	60.5	Low	108 Å²	108	75.5 Å²	75.5	51%	0.505	39%	0.394	S	S	.	.	H	α-helix	trans	-70.1	-34.8	175.5	-67.8	170	-40.4	0	0	111.1	L32 G33 L39 Y40	L32-Q36 HydrophobicContact CB-CB 4.21Å; L32-Q36 HydrophobicContact CD2-CB 4.17Å; G33-Q36 PolarHBondContact O-N 3.13Å; Q36-L39 PolarHBondContact O-N 3.3Å; Q36-Y40 WeakPolarHBondContact O-CB 3.29Å; Q36-Y40 PolarHBondContact O-N 2.98Å
37	R	58.8	Low	61.2	Low	67 Å²	67	71.9 Å²	71.9	25%	0.253	38%	0.378	S	S	.	.	H	α-helix	trans	-66.3	-42.9	173.9	-66.3	179	-172.7	179.2	4.5	112.4	Q30 L32 G33 Q35 Y40 R41 E72	Q30-R37 PolarHBondContact O-NH2 3.02Å; L32-R37 HydrophobicContact CB-CG 3.79Å; L32-R37 VanDerWaalsContact O-CZ 3.26Å; L32-R37 PolarHBondContact O-NE 3.34Å; L32-R37 PolarHBondContact O-NH2 3.08Å; L32-R37 VanDerWaalsContact O-NH2 3.11Å; G33-R37 WeakPolarHBondContact O-CG 3.33Å; G33-R37 PolarHBondContact O-N 2.85Å; Q35-R37 VanDerWaalsContact C-N 3.35Å; R37-Y40 PolarHBondContact O-N 3.02Å; R37-R41 PolarHBondContact O-N 3.5Å; R37-E72 IonicContact CZ-OE1 3.15Å; R37-E72 IonicContact NH1-OE1 3.96Å; R37-E72 PolarHBondContact NH1-OE1 2.96Å; R37-E72 IonicContact NH1-OE2 3.78Å; R37-E72 PolarHBondContact NH1-OE2 3.02Å
38	A	62	Low	62.2	Low	47 Å²	47	70.1 Å²	70.1	39%	0.388	36%	0.358	S	S	.	.	H	α-helix	trans	-61.8	-45.2	174.2	0	0	0	0	0	111.3	P34 Q35 Y40 R41 D42	P34-A38 PolarHBondContact O-N 2.76Å; Q35-A38 PolarHBondContact O-N 3.39Å; A38-Y40 PolarHBondContact O-N 3.36Å; A38-R41 WeakPolarHBondContact O-CB 3.43Å; A38-R41 PolarHBondContact O-N 3.31Å; A38-D42 PolarHBondContact O-N 3.27Å
39	L	63.8	Low	63	Low	83 Å²	83	66.8 Å²	66.8	44%	0.435	35%	0.35	S	S	.	.	H	α-helix	trans	-62.3	-43.3	176.5	-178.5	62.8	0	0	0	112.3	Q35 Q36 R41 D42 V43 I309	Q35-L39 WeakPolarHBondContact O-CB 3.48Å; Q35-L39 PolarHBondContact O-N 3.01Å; Q36-L39 PolarHBondContact O-N 3.3Å; L39-R41 VanDerWaalsContact C-N 3.35Å; L39-R41 PolarHBondContact O-N 2.99Å; L39-D42 PolarHBondContact O-N 3.32Å; L39-V43 HydrophobicContact CD1-CG2 4.05Å; L39-V43 HydrophobicContact CG-CG2 4.33Å; L39-V43 WeakPolarHBondContact O-CB 3.33Å; L39-V43 VanDerWaalsContact O-CG2 3.24Å; L39-V43 WeakPolarHBondContact O-CG2 3.19Å; L39-V43 PolarHBondContact O-N 2.86Å; L39-I309 HydrophobicContact CD1-CD1 4.21Å; L39-I309 HydrophobicContact CD2-CD1 4.44Å
40	Y	68.8	Low	63.6	Low	39 Å²	39	70.6 Å²	70.6	15%	0.153	37%	0.369	C	S	.	.	H	α-helix	trans	-59.5	-45.7	176.3	172.9	-111	0	0	0	111.8	V22 F24 Q36 R37 A38 D42 V43 M44 L67	V22-Y40 HydrophobicContact CB-CE2 4.26Å; V22-Y40 HydrophobicContact CG1-CE2 4.49Å; V22-Y40 WeakPolarHBondContact O-CE2 2.88Å; V22-Y40 PolarHBondContact O-OH 3.4Å; F24-Y40 HydrophobicContact CD2-CD1 4.5Å; F24-Y40 AromaticContact CD2-CD2 3.97Å; F24-Y40 HydrophobicContact CD2-CD2 3.97Å; F24-Y40 HydrophobicContact CD2-CE1 4.28Å; F24-Y40 AromaticContact CD2-CE2 3.7Å; F24-Y40 HydrophobicContact CD2-CE2 3.7Å; F24-Y40 HydrophobicContact CD2-CG 4.33Å; F24-Y40 AromaticContact CD2-CZ 3.88Å; F24-Y40 HydrophobicContact CE2-CD1 4.47Å; F24-Y40 AromaticContact CE2-CD2 3.39Å; F24-Y40 HydrophobicContact CE2-CD2 3.39Å; F24-Y40 AromaticContact CE2-CE2 3.53Å; F24-Y40 HydrophobicContact CE2-CE2 3.53Å; F24-Y40 AromaticContact CE2-CG 3.88Å; F24-Y40 HydrophobicContact CE2-CG 3.88Å; F24-Y40 HydrophobicContact CZ-CD2 4.44Å; Q36-Y40 WeakPolarHBondContact O-CB 3.29Å; Q36-Y40 PolarHBondContact O-N 2.98Å; R37-Y40 PolarHBondContact O-N 3.02Å; A38-Y40 PolarHBondContact O-N 3.36Å; Y40-D42 PolarHBondContact O-N 3.44Å; Y40-V43 PolarHBondContact O-N 3.3Å; Y40-M44 HydrophobicContact CD2-CE 4.26Å; Y40-M44 HydrophobicContact CD2-CG 3.92Å; Y40-M44 HydrophobicContact CE1-CG 4.26Å; Y40-M44 HydrophobicContact CE2-CE 4Å; Y40-M44 HydrophobicContact CE2-CG 3.53Å; Y40-M44 HydrophobicContact CE2-SD 3.93Å; Y40-M44 HydrophobicContact CG-CG 4.47Å; Y40-M44 WeakPolarHBondContact O-CB 3.22Å; Y40-M44 VanDerWaalsContact O-CG 3.3Å; Y40-M44 WeakPolarHBondContact O-CG 3.45Å; Y40-M44 PolarHBondContact O-N 3.29Å; Y40-L67 HydrophobicContact CD1-CD2 4.25Å; Y40-L67 HydrophobicContact CE1-CD1 4.15Å; Y40-L67 HydrophobicContact CE1-CD2 4.07Å
41	R	68.6	Low	63.9	Low	67 Å²	67	66 Å²	66	25%	0.253	35%	0.348	S	S	.	.	H	α-helix	trans	-55.5	-51.7	173.3	163.8	179.7	-88.5	133.3	12.1	110.9	R37 A38 L39 V43 M44 L45 L67 G70	R37-R41 PolarHBondContact O-N 3.5Å; A38-R41 WeakPolarHBondContact O-CB 3.43Å; A38-R41 PolarHBondContact O-N 3.31Å; L39-R41 VanDerWaalsContact C-N 3.35Å; L39-R41 PolarHBondContact O-N 2.99Å; R41-V43 PolarHBondContact O-N 3.46Å; R41-M44 PolarHBondContact O-N 2.93Å; R41-L45 HydrophobicContact CG-CD1 3.93Å; R41-L45 WeakPolarHBondContact O-CB 3.47Å; R41-L45 WeakPolarHBondContact O-CG 3.33Å; R41-L45 PolarHBondContact O-N 3.3Å; R41-L67 HydrophobicContact CB-CD2 4.33Å; R41-L67 VanDerWaalsContact CZ-O 3.24Å; R41-L67 PolarHBondContact NE-O 3.47Å; R41-L67 PolarHBondContact NH2-O 3.39Å; R41-G70 VanDerWaalsContact NH2-N 3.2Å
42	D	65	Low	64.4	Low	99 Å²	99	59.9 Å²	59.9	53%	0.529	33%	0.325	S	S	.	.	H	α-helix	trans	-63.2	-42.3	-176.3	-68.9	-16.1	0	0	0	112.1	A38 L39 Y40 L45 E46	A38-D42 PolarHBondContact O-N 3.27Å; L39-D42 PolarHBondContact O-N 3.32Å; Y40-D42 PolarHBondContact O-N 3.44Å; D42-L45 PolarHBondContact O-N 3.03Å; D42-E46 WeakPolarHBondContact O-CB 3.2Å; D42-E46 PolarHBondContact O-N 3.41Å
43	V	67.8	Low	65	Low	43 Å²	43	61.9 Å²	61.9	26%	0.261	34%	0.342	S	S	.	.	H	α-helix	trans	-67.3	-42.2	179.2	175.2	0	0	0	0	111.7	L39 Y40 R41 L45 E46 N47	L39-V43 HydrophobicContact CD1-CG2 4.05Å; L39-V43 HydrophobicContact CG-CG2 4.33Å; L39-V43 WeakPolarHBondContact O-CB 3.33Å; L39-V43 VanDerWaalsContact O-CG2 3.24Å; L39-V43 WeakPolarHBondContact O-CG2 3.19Å; L39-V43 PolarHBondContact O-N 2.86Å; Y40-V43 PolarHBondContact O-N 3.3Å; R41-V43 PolarHBondContact O-N 3.46Å; V43-L45 VanDerWaalsContact C-N 3.34Å; V43-L45 PolarHBondContact O-N 2.96Å; V43-E46 PolarHBondContact O-N 3.1Å; V43-N47 WeakPolarHBondContact O-CB 3.22Å; V43-N47 PolarHBondContact O-N 3.26Å; V43-N47 PolarHBondContact O-OD1 3.05Å
44	M	74.8	Confident	65.2	Low	2 Å²	2	64.2 Å²	64.2	1%	0.01	35%	0.347	C	S	.	.	H	α-helix	trans	-66.3	-37.8	177.6	-70.2	-56.2	107.3	0	0	111.8	V22 Y40 R41 Y48 I64 L67	V22-M44 HydrophobicContact CB-CE 3.59Å; V22-M44 HydrophobicContact CB-SD 4.21Å; V22-M44 HydrophobicContact CG2-CE 3.75Å; V22-M44 PolarHBondContact N-SD 3.13Å; Y40-M44 HydrophobicContact CD2-CE 4.26Å; Y40-M44 HydrophobicContact CD2-CG 3.92Å; Y40-M44 HydrophobicContact CE1-CG 4.26Å; Y40-M44 HydrophobicContact CE2-CE 4Å; Y40-M44 HydrophobicContact CE2-CG 3.53Å; Y40-M44 HydrophobicContact CE2-SD 3.93Å; Y40-M44 HydrophobicContact CG-CG 4.47Å; Y40-M44 WeakPolarHBondContact O-CB 3.22Å; Y40-M44 VanDerWaalsContact O-CG 3.3Å; Y40-M44 WeakPolarHBondContact O-CG 3.45Å; Y40-M44 PolarHBondContact O-N 3.29Å; R41-M44 PolarHBondContact O-N 2.93Å; M44-Y48 WeakPolarHBondContact O-CB 3.41Å; M44-Y48 PolarHBondContact O-N 3.32Å; M44-I64 HydrophobicContact CB-CD1 4.02Å; M44-I64 WeakPolarHBondContact O-CD1 3.49Å; M44-L67 HydrophobicContact CB-CD1 3.49Å; M44-L67 VanDerWaalsContact CB-CD1 3.49Å; M44-L67 HydrophobicContact CG-CD1 3.81Å
45	L	73.3	Confident	64.9	Low	37 Å²	37	59.4 Å²	59.4	19%	0.194	32%	0.318	C	S	.	.	H	α-helix	trans	-69.1	-38.8	175.4	-65.7	179.3	0	0	0	112.4	R41 D42 V43 G49 I64 L67 E68	R41-L45 HydrophobicContact CG-CD1 3.93Å; R41-L45 WeakPolarHBondContact O-CB 3.47Å; R41-L45 WeakPolarHBondContact O-CG 3.33Å; R41-L45 PolarHBondContact O-N 3.3Å; D42-L45 PolarHBondContact O-N 3.03Å; V43-L45 VanDerWaalsContact C-N 3.34Å; V43-L45 PolarHBondContact O-N 2.96Å; L45-G49 PolarHBondContact O-N 2.79Å; L45-I64 HydrophobicContact CD2-CD1 4.43Å; L45-I64 HydrophobicContact CD2-CG2 3.97Å; L45-L67 HydrophobicContact CD2-CB 4.48Å; L45-E68 HydrophobicContact CD1-CG 4.22Å; L45-E68 HydrophobicContact CD2-CB 4.49Å; L45-E68 HydrophobicContact CD2-CG 3.24Å; L45-E68 HydrophobicContact CG-CG 4.37Å
46	E	70.9	Confident	65.2	Low	98 Å²	98	53.6 Å²	53.6	46%	0.458	29%	0.29	S	S	.	.	H	α-helix	trans	-65.4	-44	173.8	-170.9	-178.1	173.7	0	0	111.2	D42 V43 Y48 G49 N50	D42-E46 WeakPolarHBondContact O-CB 3.2Å; D42-E46 PolarHBondContact O-N 3.41Å; V43-E46 PolarHBondContact O-N 3.1Å; E46-Y48 PolarHBondContact O-N 3.38Å; E46-G49 PolarHBondContact O-N 3.46Å; E46-N50 WeakPolarHBondContact O-CB 3.37Å; E46-N50 PolarHBondContact O-N 2.88Å; E46-N50 PolarHBondContact O-ND2 3.41Å; E46-N50 VanDerWaalsContact O-ND2 3.12Å
47	N	65.7	Low	65.2	Low	40 Å²	40	53.7 Å²	53.7	21%	0.214	30%	0.3	C	S	.	.	H	α-helix	trans	-61.5	-44.1	176.6	-75.5	-2	0	0	0	111.7	F17 V20 V43 N50 V51	F17-N47 HydrophobicContact CE2-CB 4.48Å; V20-N47 HydrophobicContact CG2-CB 4.15Å; V20-N47 PolarHBondContact O-ND2 3.2Å; V43-N47 WeakPolarHBondContact O-CB 3.22Å; V43-N47 PolarHBondContact O-N 3.26Å; V43-N47 PolarHBondContact O-OD1 3.05Å; N47-N50 PolarHBondContact O-N 3.06Å; N47-V51 WeakPolarHBondContact O-CG2 3.35Å; N47-V51 PolarHBondContact O-N 3.13Å
48	Y	74.8	Confident	65	Low	27 Å²	27	51.7 Å²	51.7	11%	0.106	30%	0.295	C	S	.	.	H	α-helix	trans	-62	-45.3	173.9	179.9	-109	0	0	0	111.7	F17 M44 E46 N50 V51 A52 K60 P61 I64	F17-Y48 AromaticContact CD2-CD2 3.77Å; F17-Y48 HydrophobicContact CD2-CD2 3.77Å; F17-Y48 HydrophobicContact CD2-CG 4.31Å; F17-Y48 HydrophobicContact CE2-CD2 4.26Å; F17-Y48 HydrophobicContact CE2-CG 4.4Å; F17-Y48 HydrophobicContact CG-CD2 4.23Å; M44-Y48 WeakPolarHBondContact O-CB 3.41Å; M44-Y48 PolarHBondContact O-N 3.32Å; E46-Y48 PolarHBondContact O-N 3.38Å; Y48-N50 VanDerWaalsContact C-N 3.27Å; Y48-N50 PolarHBondContact O-N 3.31Å; Y48-V51 PolarHBondContact O-N 3.41Å; Y48-A52 VanDerWaalsContact O-CB 3.23Å; Y48-A52 WeakPolarHBondContact O-CB 3.11Å; Y48-A52 PolarHBondContact O-N 3.35Å; Y48-K60 HydrophobicContact CE1-CD 4.26Å; Y48-K60 HydrophobicContact CE1-CG 4.24Å; Y48-K60 HydrophobicContact CE2-CG 4.29Å; Y48-K60 WeakPolarHBondContact OH-CB 3.46Å; Y48-P61 HydrophobicContact CD2-CG 4.39Å; Y48-P61 VanDerWaalsContact CE2-CD 3.47Å; Y48-P61 HydrophobicContact CE2-CG 4.41Å; Y48-I64 HydrophobicContact CD1-CG2 3.56Å; Y48-I64 HydrophobicContact CD2-CG1 4.05Å; Y48-I64 HydrophobicContact CD2-CG2 4.26Å; Y48-I64 HydrophobicContact CE1-CG2 4Å; Y48-I64 HydrophobicContact CG-CB 4.37Å; Y48-I64 HydrophobicContact CG-CG1 3.94Å; Y48-I64 HydrophobicContact CG-CG2 3.69Å
49	G	71.6	Confident	64.9	Low	30 Å²	30	54.5 Å²	54.5	31%	0.309	31%	0.31	S	S	.	.	H	α-helix	trans	-58.2	-39.4	175.7	0	0	0	0	0	112.7	L45 E46 S53	L45-G49 PolarHBondContact O-N 2.79Å; E46-G49 PolarHBondContact O-N 3.46Å; G49-S53 WeakPolarHBondContact O-CB 3.38Å; G49-S53 PolarHBondContact O-N 3.19Å; G49-S53 PolarHBondContact O-OG 3.31Å
50	N	67.1	Low	65.2	Low	87 Å²	87	51.7 Å²	51.7	47%	0.465	29%	0.294	S	S	.	.	H	α-helix	trans	-68.1	-45.4	177.6	-71	-33.8	0	0	0	112	E46 N47 Y48 S53	E46-N50 WeakPolarHBondContact O-CB 3.37Å; E46-N50 PolarHBondContact O-N 2.88Å; E46-N50 PolarHBondContact O-ND2 3.41Å; E46-N50 VanDerWaalsContact O-ND2 3.12Å; N47-N50 PolarHBondContact O-N 3.06Å; Y48-N50 VanDerWaalsContact C-N 3.27Å; Y48-N50 PolarHBondContact O-N 3.31Å; N50-S53 WeakPolarHBondContact O-CB 3.47Å; N50-S53 PolarHBondContact O-N 3.31Å
51	V	62.1	Low	65.5	Low	6 Å²	6	51.1 Å²	51.1	4%	0.036	30%	0.295	C	S	.	.	H	α-helix	trans	-66.4	-43.2	177.1	173.5	0	0	0	0	111.4	V20 N47 Y48 S53 L54 V58	V20-V51 HydrophobicContact CB-CG2 4.41Å; V20-V51 HydrophobicContact CG1-CG2 4.16Å; V20-V51 HydrophobicContact CG2-CG2 3.43Å; V20-V51 VanDerWaalsContact CG2-CG2 3.43Å; N47-V51 WeakPolarHBondContact O-CG2 3.35Å; N47-V51 PolarHBondContact O-N 3.13Å; Y48-V51 PolarHBondContact O-N 3.41Å; V51-S53 PolarHBondContact O-N 3.18Å; V51-L54 WeakPolarHBondContact O-CB 3.44Å; V51-L54 PolarHBondContact O-N 3.29Å; V51-V58 HydrophobicContact CG1-CG2 3.97Å
52	A	67.9	Low	65.6	Low	34 Å²	34	53.6 Å²	53.6	28%	0.281	31%	0.31	S	S	.	.	H	α-helix	trans	-60.8	-29.2	175.1	0	0	0	0	0	112.5	Y48 L54	Y48-A52 VanDerWaalsContact O-CB 3.23Å; Y48-A52 WeakPolarHBondContact O-CB 3.11Å; Y48-A52 PolarHBondContact O-N 3.35Å; A52-L54 VanDerWaalsContact C-N 3.28Å; A52-L54 PolarHBondContact O-N 3.39Å
53	S	65	Low	65.9	Low	73 Å²	73	50.6 Å²	50.6	51%	0.51	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-12	177.1	-59.9	0	0	0	0	114.1	G49 N50 V51 G55	G49-S53 WeakPolarHBondContact O-CB 3.38Å; G49-S53 PolarHBondContact O-N 3.19Å; G49-S53 PolarHBondContact O-OG 3.31Å; N50-S53 WeakPolarHBondContact O-CB 3.47Å; N50-S53 PolarHBondContact O-N 3.31Å; V51-S53 PolarHBondContact O-N 3.18Å; S53-G55 PolarHBondContact O-N 3.42Å
54	L	63.1	Low	66.5	Low	76 Å²	76	48.5 Å²	48.5	40%	0.398	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-7.9	178.6	-63.7	175.8	0	0	0	113.3	L15 V51 A52 F56 R244	L15-L54 HydrophobicContact CB-CD1 4.37Å; L15-L54 HydrophobicContact CD1-CD1 4.04Å; V51-L54 WeakPolarHBondContact O-CB 3.44Å; V51-L54 PolarHBondContact O-N 3.29Å; A52-L54 VanDerWaalsContact C-N 3.28Å; A52-L54 PolarHBondContact O-N 3.39Å; L54-F56 HydrophobicContact CB-CD2 4.06Å; L54-F56 HydrophobicContact CB-CE2 4.25Å; L54-R244 PolarHBondContact O-NH1 3.32Å
55	G	50.9	Low	66.6	Low	11 Å²	11	48.8 Å²	48.8	11%	0.113	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.2	6.7	171.1	0	0	0	0	0	115.3	S53	S53-G55 PolarHBondContact O-N 3.42Å
56	F	56.5	Low	66.3	Low	52 Å²	52	48.9 Å²	48.9	23%	0.228	28%	0.282	C	S	.	.			trans	-85.2	140.8	172	-59.2	-73.1	0	0	0	110.8	P14 L54 V58 K235	P14-F56 HydrophobicContact CB-CB 4.41Å; P14-F56 HydrophobicContact CB-CD1 3.56Å; P14-F56 HydrophobicContact CB-CD2 4.23Å; P14-F56 HydrophobicContact CB-CE1 3.77Å; P14-F56 HydrophobicContact CB-CE2 4.42Å; P14-F56 HydrophobicContact CB-CG 3.8Å; P14-F56 HydrophobicContact CB-CZ 4.2Å; L54-F56 HydrophobicContact CB-CD2 4.06Å; L54-F56 HydrophobicContact CB-CE2 4.25Å; F56-V58 VanDerWaalsContact C-N 3.31Å; F56-V58 HydrophobicContact CB-CG2 4.19Å; F56-V58 PolarHBondContact O-N 2.9Å; F56-K235 PolarHBondContact O-NZ 2.89Å
57	P	50.1	Low	66.4	Low	109 Å²	109	45 Å²	45	71%	0.708	26%	0.264	S	S	*	.			trans	-69.7	90.2	168.9	28.6	-29.6	0	0	0	108.7
58	V	56	Low	66.9	Low	25 Å²	25	44.4 Å²	44.4	15%	0.152	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-94	116.4	172.5	-175.1	0	0	0	0	106.8	F17 V51 F56 K60	F17-V58 HydrophobicContact CB-CG1 4.17Å; V51-V58 HydrophobicContact CG1-CG2 3.97Å; F56-V58 VanDerWaalsContact C-N 3.31Å; F56-V58 HydrophobicContact CB-CG2 4.19Å; F56-V58 PolarHBondContact O-N 2.9Å; V58-K60 PolarHBondContact O-N 3.02Å
59	P	58.8	Low	66.6	Low	107 Å²	107	43.9 Å²	43.9	70%	0.695	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-57.4	136.5	170.9	-15.4	27.1	0	0	0	108.1	P61	P59-P61 WeakPolarHBondContact O-CD 3.32Å; P59-P61 VanDerWaalsContact O-N 3.12Å
60	K	70.8	Confident	65.8	Low	24 Å²	24	44.7 Å²	44.7	10%	0.104	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-65	119.6	-177.9	-175.8	167.3	171.2	-160.6	0	109.7	Y48 V58 I64 E68 S230 H231	Y48-K60 HydrophobicContact CE1-CD 4.26Å; Y48-K60 HydrophobicContact CE1-CG 4.24Å; Y48-K60 HydrophobicContact CE2-CG 4.29Å; Y48-K60 WeakPolarHBondContact OH-CB 3.46Å; V58-K60 PolarHBondContact O-N 3.02Å; K60-I64 HydrophobicContact CD-CG2 4.22Å; K60-I64 VanDerWaalsContact CE-CG2 3.46Å; K60-I64 HydrophobicContact CG-CB 4.18Å; K60-I64 HydrophobicContact CG-CG2 4.06Å; K60-E68 VanDerWaalsContact CE-OE2 3.27Å; K60-E68 WeakPolarHBondContact CE-OE2 3.14Å; K60-E68 IonicContact NZ-OE2 3.42Å; K60-E68 PolarHBondContact NZ-OE2 3.06Å; K60-S230 WeakPolarHBondContact CB-O 3.3Å; K60-S230 WeakPolarHBondContact CD-O 3.4Å; K60-S230 PolarHBondContact NZ-OG 3.07Å; K60-H231 PolarHBondContact NZ-CE1 2.98Å; K60-H231 PolarHBondContact NZ-ND1 3.39Å; K60-H231 PolarHBondContact NZ-NE2 3.35Å
61	P	75.1	Confident	65.5	Low	27 Å²	27	45.7 Å²	45.7	18%	0.175	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-62.6	140.1	178.9	-13.9	23.6	0	0	0	110.2	F17 Y48 P59 L63 I64 S65	F17-P61 HydrophobicContact CB-CG 3.72Å; F17-P61 HydrophobicContact CD1-CB 3.73Å; F17-P61 HydrophobicContact CD1-CG 3.11Å; F17-P61 HydrophobicContact CD2-CG 4.41Å; F17-P61 HydrophobicContact CE1-CB 4.03Å; F17-P61 HydrophobicContact CE1-CG 3.74Å; F17-P61 HydrophobicContact CG-CG 3.47Å; F17-P61 VanDerWaalsContact CG-CG 3.47Å; Y48-P61 HydrophobicContact CD2-CG 4.39Å; Y48-P61 VanDerWaalsContact CE2-CD 3.47Å; Y48-P61 HydrophobicContact CE2-CG 4.41Å; P59-P61 WeakPolarHBondContact O-CD 3.32Å; P59-P61 VanDerWaalsContact O-N 3.12Å; P61-L63 PolarHBondContact O-N 2.75Å; P61-I64 HydrophobicContact CB-CG1 4.31Å; P61-I64 HydrophobicContact CG-CG1 4.08Å; P61-I64 WeakPolarHBondContact O-CA 3.39Å; P61-I64 WeakPolarHBondContact O-CB 3.18Å; P61-I64 PolarHBondContact O-N 3.49Å; P61-S65 PolarHBondContact O-N 3.22Å
62	E	69.9	Low	65	Low	119 Å²	119	51.6 Å²	51.6	56%	0.556	30%	0.295	S	S	*	.	H	α-helix	trans	-55.1	-37.2	179.2	-178.3	54.8	-156.7	0	0	111.6	I64 S65 Q66	E62-I64 VanDerWaalsContact C-N 3.33Å; E62-I64 PolarHBondContact O-N 2.99Å; E62-S65 WeakPolarHBondContact O-CB 3.4Å; E62-S65 PolarHBondContact O-N 2.94Å; E62-Q66 HydrophobicContact CG-CG 4.4Å; E62-Q66 WeakPolarHBondContact O-CB 2.82Å; E62-Q66 WeakPolarHBondContact O-CG 3.49Å; E62-Q66 PolarHBondContact O-N 2.94Å; E62-Q66 WeakPolarHBondContact OE1-CG 3.45Å; E62-Q66 PolarHBondContact OE1-NE2 2.92Å
63	L	72.7	Confident	63.9	Low	35 Å²	35	53.1 Å²	53.1	18%	0.183	30%	0.298	C	S	.	.	H	α-helix	trans	-56.6	-41.7	172.6	179.4	64.5	0	0	0	113.1	Y23 P61 Q66 L67	Y23-L63 HydrophobicContact CD1-CD2 3.76Å; Y23-L63 HydrophobicContact CE1-CD2 3.48Å; Y23-L63 VanDerWaalsContact CE1-CD2 3.48Å; P61-L63 PolarHBondContact O-N 2.75Å; L63-Q66 PolarHBondContact O-N 3.2Å; L63-L67 HydrophobicContact CD1-CD1 4.14Å; L63-L67 HydrophobicContact CD1-CG 4.21Å; L63-L67 HydrophobicContact CG-CD1 4.03Å; L63-L67 HydrophobicContact CG-CG 4.47Å; L63-L67 WeakPolarHBondContact O-CB 3.26Å; L63-L67 VanDerWaalsContact O-CG 3.25Å; L63-L67 WeakPolarHBondContact O-CG 3.21Å; L63-L67 PolarHBondContact O-N 3.07Å
64	I	79.4	Confident	63.4	Low	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-72.7	-43.4	177.2	-64.6	-53.6	0	0	0	109.9	F17 M44 L45 Y48 K60 P61 E62 Q66 L67 E68	F17-I64 HydrophobicContact CD1-CG1 4.34Å; F17-I64 HydrophobicContact CD2-CG1 4.41Å; F17-I64 HydrophobicContact CE1-CD1 3.87Å; F17-I64 HydrophobicContact CE1-CG1 3.62Å; F17-I64 HydrophobicContact CE2-CD1 3.66Å; F17-I64 HydrophobicContact CE2-CG1 3.77Å; F17-I64 HydrophobicContact CZ-CD1 3.14Å; F17-I64 HydrophobicContact CZ-CG1 3.33Å; M44-I64 HydrophobicContact CB-CD1 4.02Å; M44-I64 WeakPolarHBondContact O-CD1 3.49Å; L45-I64 HydrophobicContact CD2-CD1 4.43Å; L45-I64 HydrophobicContact CD2-CG2 3.97Å; Y48-I64 HydrophobicContact CD1-CG2 3.56Å; Y48-I64 HydrophobicContact CD2-CG1 4.05Å; Y48-I64 HydrophobicContact CD2-CG2 4.26Å; Y48-I64 HydrophobicContact CE1-CG2 4Å; Y48-I64 HydrophobicContact CG-CB 4.37Å; Y48-I64 HydrophobicContact CG-CG1 3.94Å; Y48-I64 HydrophobicContact CG-CG2 3.69Å; K60-I64 HydrophobicContact CD-CG2 4.22Å; K60-I64 VanDerWaalsContact CE-CG2 3.46Å; K60-I64 HydrophobicContact CG-CB 4.18Å; K60-I64 HydrophobicContact CG-CG2 4.06Å; P61-I64 HydrophobicContact CB-CG1 4.31Å; P61-I64 HydrophobicContact CG-CG1 4.08Å; P61-I64 WeakPolarHBondContact O-CA 3.39Å; P61-I64 WeakPolarHBondContact O-CB 3.18Å; P61-I64 PolarHBondContact O-N 3.49Å; E62-I64 VanDerWaalsContact C-N 3.33Å; E62-I64 PolarHBondContact O-N 2.99Å; I64-Q66 PolarHBondContact O-N 3.49Å; I64-L67 HydrophobicContact CD1-CD1 4.41Å; I64-L67 PolarHBondContact O-N 2.89Å; I64-E68 HydrophobicContact CG2-CG 4.48Å; I64-E68 WeakPolarHBondContact O-CB 3.45Å; I64-E68 VanDerWaalsContact O-CG 3.25Å; I64-E68 WeakPolarHBondContact O-CG 3.48Å; I64-E68 PolarHBondContact O-N 3.5Å
65	S	77.8	Confident	62.1	Low	7 Å²	7	55.1 Å²	55.1	5%	0.049	30%	0.301	C	S	.	.	H	α-helix	trans	-50.8	-43.1	173.7	-178.8	0	0	0	0	110.5	P61 E62 Q69 I213 C214 H231	P61-S65 PolarHBondContact O-N 3.22Å; E62-S65 WeakPolarHBondContact O-CB 3.4Å; E62-S65 PolarHBondContact O-N 2.94Å; S65-Q69 WeakPolarHBondContact O-CG 3.34Å; S65-Q69 PolarHBondContact O-NE2 3.08Å; S65-Q69 PolarHBondContact OG-NE2 2.88Å; S65-I213 WeakPolarHBondContact OG-CG2 3.49Å; S65-C214 VanDerWaalsContact O-CB 3.29Å; S65-C214 WeakPolarHBondContact O-CB 3.27Å; S65-H231 PolarHBondContact OG-CE1 3.09Å; S65-H231 PolarHBondContact OG-ND1 3.28Å; S65-H231 VanDerWaalsContact OG-ND1 3.16Å
66	Q	66.3	Low	61.1	Low	39 Å²	39	62.2 Å²	62.2	18%	0.182	34%	0.336	C	S	.	.	H	α-helix	trans	-75.8	-44.3	-177.5	-80.5	175.6	1.6	0	0	115.3	E62 L63 I64 E68 Q69 L73	E62-Q66 HydrophobicContact CG-CG 4.4Å; E62-Q66 WeakPolarHBondContact O-CB 2.82Å; E62-Q66 WeakPolarHBondContact O-CG 3.49Å; E62-Q66 PolarHBondContact O-N 2.94Å; E62-Q66 WeakPolarHBondContact OE1-CG 3.45Å; E62-Q66 PolarHBondContact OE1-NE2 2.92Å; L63-Q66 PolarHBondContact O-N 3.2Å; I64-Q66 PolarHBondContact O-N 3.49Å; Q66-E68 PolarHBondContact O-N 2.83Å; Q66-Q69 VanDerWaalsContact CA-CG 3.41Å; Q66-Q69 WeakPolarHBondContact O-CB 3.33Å; Q66-Q69 WeakPolarHBondContact O-CG 3.34Å; Q66-Q69 PolarHBondContact O-N 3.4Å; Q66-L73 HydrophobicContact CB-CD1 3.32Å; Q66-L73 VanDerWaalsContact CD-CD2 3.5Å; Q66-L73 HydrophobicContact CG-CD1 3.56Å; Q66-L73 HydrophobicContact CG-CD2 4.45Å
67	L	73.8	Confident	60.1	Low	16 Å²	16	66.9 Å²	66.9	8%	0.084	36%	0.363	C	S	.	.	H	α-helix	trans	-63.7	-34	175.2	-77.1	173.8	0	0	0	110.8	Y40 R41 M44 L45 L63 I64 Q69	Y40-L67 HydrophobicContact CD1-CD2 4.25Å; Y40-L67 HydrophobicContact CE1-CD1 4.15Å; Y40-L67 HydrophobicContact CE1-CD2 4.07Å; R41-L67 HydrophobicContact CB-CD2 4.33Å; R41-L67 VanDerWaalsContact CZ-O 3.24Å; R41-L67 PolarHBondContact NE-O 3.47Å; R41-L67 PolarHBondContact NH2-O 3.39Å; M44-L67 HydrophobicContact CB-CD1 3.49Å; M44-L67 VanDerWaalsContact CB-CD1 3.49Å; M44-L67 HydrophobicContact CG-CD1 3.81Å; L45-L67 HydrophobicContact CD2-CB 4.48Å; L63-L67 HydrophobicContact CD1-CD1 4.14Å; L63-L67 HydrophobicContact CD1-CG 4.21Å; L63-L67 HydrophobicContact CG-CD1 4.03Å; L63-L67 HydrophobicContact CG-CG 4.47Å; L63-L67 WeakPolarHBondContact O-CB 3.26Å; L63-L67 VanDerWaalsContact O-CG 3.25Å; L63-L67 WeakPolarHBondContact O-CG 3.21Å; L63-L67 PolarHBondContact O-N 3.07Å; I64-L67 HydrophobicContact CD1-CD1 4.41Å; I64-L67 PolarHBondContact O-N 2.89Å; L67-Q69 PolarHBondContact O-N 3.49Å
68	E	75.8	Confident	59.1	Low	28 Å²	28	70 Å²	70	13%	0.131	37%	0.373	C	S	.	.	H	α-helix	trans	-60.3	-29	171.5	-71.2	-159.1	122.5	0	0	111.8	L45 K60 I64 Q66 G70 C214 K216 H227 H231	L45-E68 HydrophobicContact CD1-CG 4.22Å; L45-E68 HydrophobicContact CD2-CB 4.49Å; L45-E68 HydrophobicContact CD2-CG 3.24Å; L45-E68 HydrophobicContact CG-CG 4.37Å; K60-E68 VanDerWaalsContact CE-OE2 3.27Å; K60-E68 WeakPolarHBondContact CE-OE2 3.14Å; K60-E68 IonicContact NZ-OE2 3.42Å; K60-E68 PolarHBondContact NZ-OE2 3.06Å; I64-E68 HydrophobicContact CG2-CG 4.48Å; I64-E68 WeakPolarHBondContact O-CB 3.45Å; I64-E68 VanDerWaalsContact O-CG 3.25Å; I64-E68 WeakPolarHBondContact O-CG 3.48Å; I64-E68 PolarHBondContact O-N 3.5Å; Q66-E68 PolarHBondContact O-N 2.83Å; E68-G70 VanDerWaalsContact C-N 3.32Å; E68-G70 PolarHBondContact O-N 3.31Å; E68-C214 HydrophobicContact CB-CB 4.32Å; E68-C214 WeakPolarHBondContact CB-SG 3.25Å; E68-K216 HydrophobicContact CB-CD 3.93Å; E68-K216 VanDerWaalsContact CD-NZ 3.26Å; E68-K216 WeakPolarHBondContact O-CD 3.39Å; E68-K216 WeakPolarHBondContact O-CE 2.99Å; E68-K216 WeakPolarHBondContact O-CG 3.47Å; E68-K216 IonicContact OE1-NZ 3.57Å; E68-K216 PolarHBondContact OE1-NZ 3.27Å; E68-H227 IonicContact OE1-CE1 3.96Å; E68-H227 IonicContact OE2-CE1 3.49Å; E68-H227 PolarHBondContact OE2-CE1 3.4Å; E68-H227 IonicContact OE2-ND1 2.74Å; E68-H231 IonicContact OE2-CE1 3.35Å
69	Q	67.7	Low	57.9	Low	17 Å²	17	77.1 Å²	77.1	8%	0.079	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-4.4	-170.1	-12.3	-139.5	-52.4	0	0	119.1	S65 Q66 L67 K71 I213 C214	S65-Q69 WeakPolarHBondContact O-CG 3.34Å; S65-Q69 PolarHBondContact O-NE2 3.08Å; S65-Q69 PolarHBondContact OG-NE2 2.88Å; Q66-Q69 VanDerWaalsContact CA-CG 3.41Å; Q66-Q69 WeakPolarHBondContact O-CB 3.33Å; Q66-Q69 WeakPolarHBondContact O-CG 3.34Å; Q66-Q69 PolarHBondContact O-N 3.4Å; L67-Q69 PolarHBondContact O-N 3.49Å; Q69-K71 HydrophobicContact CB-CB 4.28Å; Q69-K71 HydrophobicContact CB-CD 4.14Å; Q69-K71 HydrophobicContact CB-CG 3.93Å; Q69-K71 HydrophobicContact CG-CB 4.48Å; Q69-K71 HydrophobicContact CG-CD 4.01Å; Q69-K71 HydrophobicContact CG-CG 4.27Å; Q69-K71 PolarHBondContact O-N 3.12Å; Q69-K71 VanDerWaalsContact OE1-CD 3.28Å; Q69-I213 PolarHBondContact NE2-O 3.17Å; Q69-I213 PolarHBondContact OE1-O 2.8Å; Q69-C214 WeakPolarHBondContact CA-O 3.34Å; Q69-C214 VanDerWaalsContact CB-C 3.48Å; Q69-C214 HydrophobicContact CB-CB 3.84Å; Q69-C214 WeakPolarHBondContact CB-O 3.36Å; Q69-C214 HydrophobicContact CG-CB 3.48Å; Q69-C214 VanDerWaalsContact CG-CB 3.48Å
70	G	56	Low	56.3	Low	47 Å²	47	76 Å²	76	49%	0.485	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	-8.1	-163.9	0	0	0	0	0	113.3	R41 E68 E72	R41-G70 VanDerWaalsContact NH2-N 3.2Å; E68-G70 VanDerWaalsContact C-N 3.32Å; E68-G70 PolarHBondContact O-N 3.31Å; G70-E72 PolarHBondContact O-N 3.42Å
71	K	59.2	Low	54.2	Low	108 Å²	108	79.6 Å²	79.6	47%	0.47	45%	0.451	S	S	.	.			trans	-65.3	131.2	-179.4	-76.5	176.6	-177	169.8	0	110.8	Q69 L73	Q69-K71 HydrophobicContact CB-CB 4.28Å; Q69-K71 HydrophobicContact CB-CD 4.14Å; Q69-K71 HydrophobicContact CB-CG 3.93Å; Q69-K71 HydrophobicContact CG-CB 4.48Å; Q69-K71 HydrophobicContact CG-CD 4.01Å; Q69-K71 HydrophobicContact CG-CG 4.27Å; Q69-K71 PolarHBondContact O-N 3.12Å; Q69-K71 VanDerWaalsContact OE1-CD 3.28Å; K71-L73 HydrophobicContact CB-CD1 4.08Å
72	E	52.1	Low	51.8	Low	130 Å²	130	87.5 Å²	87.5	61%	0.607	49%	0.486	S	S	*	.			trans	-86.2	128.5	162.7	-64	-165.5	143.3	0	0	107.4	R37 G70	R37-E72 IonicContact CZ-OE1 3.15Å; R37-E72 IonicContact NH1-OE1 3.96Å; R37-E72 PolarHBondContact NH1-OE1 2.96Å; R37-E72 IonicContact NH1-OE2 3.78Å; R37-E72 PolarHBondContact NH1-OE2 3.02Å; G70-E72 PolarHBondContact O-N 3.42Å
73	L	45.9	Very low	49.7	Very low	66 Å²	66	90 Å²	90	35%	0.346	50%	0.497	S	S	.	.			trans	-119	118.4	-173.4	-91.3	123.9	0	0	0	113.3	Q66 K71	Q66-L73 HydrophobicContact CB-CD1 3.32Å; Q66-L73 VanDerWaalsContact CD-CD2 3.5Å; Q66-L73 HydrophobicContact CG-CD1 3.56Å; Q66-L73 HydrophobicContact CG-CD2 4.45Å; K71-L73 HydrophobicContact CB-CD1 4.08Å
74	W	53.8	Low	47.4	Very low	77 Å²	77	94.2 Å²	94.2	29%	0.292	53%	0.527	S	S	.	.			trans	-155.2	69.7	146.8	34.6	72.9	0	0	0	109.9	Q26 Q30	Q26-W74 HydrophobicContact CB-CB 4.08Å; Q26-W74 HydrophobicContact CG-CB 3.53Å; Q26-W74 HydrophobicContact CG-CG 4Å; Q26-W74 PolarHBondContact NE2-O 3.22Å; Q30-W74 HydrophobicContact CG-CD2 3.94Å; Q30-W74 HydrophobicContact CG-CE3 4.24Å; Q30-W74 HydrophobicContact CG-CH2 3.86Å; Q30-W74 HydrophobicContact CG-CZ2 3.52Å; Q30-W74 HydrophobicContact CG-CZ3 4.21Å
75	V	35.1	Very low	44.8	Very low	114 Å²	114	101.9 Å²	101.9	69%	0.691	56%	0.563	S	S	*	*			trans	-150.4	103.5	151.7	-167	0	0	0	0	107.5
76	L	31.7	Very low	42.3	Very low	160 Å²	160	109.6 Å²	109.6	84%	0.838	60%	0.601	S	S	*	*				177.3	137	117.3	-91.7	171.3	0	0	0	112.4
77	N	34.6	Very low	40.2	Very low	149 Å²	149	114 Å²	114	80%	0.797	63%	0.626	S	S	*	*			trans	-51.8	139.2	172.2	-70.9	-37.1	0	0	0	113
78	L	29.7	Very low	37.8	Very low	176 Å²	176	122.4 Å²	122.4	92%	0.921	66%	0.662	S	S	*	*			trans	-117	77.4	158.6	-98.1	153.9	0	0	0	108.5
79	L	30.6	Very low	35.3	Very low	174 Å²	174	126.6 Å²	126.6	91%	0.911	69%	0.694	S	S	*	*			trans	-142.3	123.1	152.1	-76.1	179.5	0	0	0	107.1
80	G	25.2	Very low	33.2	Very low	83 Å²	83	131.6 Å²	131.6	86%	0.856	73%	0.729	S	S	*	*			trans	139.4	77.2	164.2	0	0	0	0	0	115.8
81	A	25.3	Very low	31.7	Very low	99 Å²	99	138.4 Å²	138.4	82%	0.818	75%	0.749	S	S	*	*	S	Bend	trans	-162.3	95	139.8	0	0	0	0	0	109.7
82	E	24.8	Very low	30.1	Very low	193 Å²	193	142.1 Å²	142.1	90%	0.902	77%	0.765	S	S	*	*			trans	67.2	111.1	149.6	-59.6	-176.3	170	0	0	121.1
83	E	25.5	Very low	28.7	Very low	172 Å²	172	142.8 Å²	142.8	80%	0.804	77%	0.773	S	S	*	*			trans	-64.6	152.9	159.3	-69	178.5	135	0	0	111.9
84	P	25.6	Very low	27.6	Very low	124 Å²	124	144.3 Å²	144.3	81%	0.805	79%	0.789	S	S	*	*			trans	-94.5	115.7	138.1	5.3	13.8	0	0	0	108.9	I86	P84-I86 PolarHBondContact O-N 3.36Å
85	E	24.3	Very low	26.4	Very low	161 Å²	161	148.2 Å²	148.2	75%	0.752	81%	0.81	S	S	*	*			trans	-57.2	119.7	162.1	-74.5	-155.8	152.3	0	0	110.1
86	I	24.6	Very low	26.1	Very low	168 Å²	168	151 Å²	151	86%	0.862	81%	0.814	S	S	*	*			trans	-120.9	103.8	141.8	-62.1	-178.6	0	0	0	107.5	P84	P84-I86 PolarHBondContact O-N 3.36Å
87	L	22.5	Very low	25.8	Very low	133 Å²	133	146.4 Å²	146.4	70%	0.696	81%	0.805	S	S	*	*			trans	-34.9	121.5	168.6	-168.7	69.5	0	0	0	114.6
88	K	24.7	Very low	25.5	Very low	191 Å²	191	145.9 Å²	145.9	83%	0.83	81%	0.807	S	S	*	*			trans	20	125.2	136.2	-63.3	171.7	-179.9	168.9	0	117.5
89	S	22.3	Very low	25.6	Very low	116 Å²	116	146.8 Å²	146.8	81%	0.811	80%	0.803	S	S	*	*				-140.9	126.4	129.3	69.9	0	0	0	0	112.2
90	C	22.8	Very low	25.7	Very low	122 Å²	122	146.6 Å²	146.6	82%	0.824	80%	0.795	S	S	*	*			trans	65.7	98.1	152.6	-64	0	0	0	0	121
91	Q	26.5	Very low	26	Very low	191 Å²	191	151.1 Å²	151.1	89%	0.893	79%	0.794	S	S	*	*			trans	-53.9	143.8	133.3	-75.4	171.6	-37.3	0	0	111.5
92	K	24.5	Very low	26.6	Very low	186 Å²	186	153.6 Å²	153.6	81%	0.809	79%	0.793	S	S	*	*			trans	172.3	126.6	149.7	-93.8	-177.1	-174.3	-175.8	0	104.9
93	D	23.2	Very low	26.7	Very low	144 Å²	144	148.4 Å²	148.4	77%	0.77	78%	0.778	S	S	*	*			cis	-151.2	151	12.3	-78.4	-50	0	0	0	110.1
94	S	23.1	Very low	27.3	Very low	98 Å²	98	147 Å²	147	69%	0.685	77%	0.774	S	S	*	*			trans	-74.6	151.2	169.6	50.1	0	0	0	0	111.9
95	E	27.4	Very low	27.5	Very low	159 Å²	159	148 Å²	148	74%	0.743	77%	0.772	S	S	*	*				143.2	156.2	104.2	-77.7	-152	137.8	0	0	107.1
96	F	29.1	Very low	27.8	Very low	173 Å²	173	147.8 Å²	147.8	76%	0.759	78%	0.776	S	S	*	*			cis	-165.7	147.2	-6.9	-126.5	-113.9	0	0	0	105.6
97	G	25.5	Very low	28.3	Very low	63 Å²	63	148 Å²	148	65%	0.649	77%	0.774	S	S	*	*				125.8	143.3	102.2	0	0	0	0	0	110.2
98	T	28.1	Very low	28.8	Very low	137 Å²	137	150.8 Å²	150.8	84%	0.84	78%	0.78	S	S	*	*			cis	-148.1	137.8	30.1	48.1	0	0	0	0	114.6	K100	T98-K100 PolarHBondContact O-N 3.1Å
99	K	31.8	Very low	29	Very low	196 Å²	196	151.5 Å²	151.5	85%	0.852	78%	0.783	S	S	*	*			trans	-70.9	87.4	164.4	-74.7	168.6	168	172.5	0	111.9
100	K	32	Very low	29.4	Very low	170 Å²	170	151.4 Å²	151.4	74%	0.739	78%	0.783	S	S	*	*			trans	-132.1	4.6	166.4	-139.6	177.6	-178.4	179.5	0	116.1	T98	T98-K100 PolarHBondContact O-N 3.1Å
101	E	33.4	Very low	29.6	Very low	178 Å²	178	154.6 Å²	154.6	83%	0.832	79%	0.786	S	S	*	*	S	Bend	trans	-112.6	-7.7	178.1	-70.5	-176.7	152.8	0	0	114.3
102	L	37.2	Very low	29.6	Very low	150 Å²	150	154.1 Å²	154.1	79%	0.785	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	3.6	-179.9	-86.9	156.5	0	0	0	114.7
103	S	27.7	Very low	29.9	Very low	85 Å²	85	151.7 Å²	151.7	59%	0.594	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	-7.4	173.7	59.1	0	0	0	0	114.5
104	I	37.1	Very low	30	Very low	141 Å²	141	153.6 Å²	153.6	72%	0.723	79%	0.785	S	S	*	*	S	Bend	trans	-96.9	-18.7	-178.2	-62.9	177.4	0	0	0	112.3
105	L	30	Very low	30.1	Very low	145 Å²	145	155.1 Å²	155.1	76%	0.759	79%	0.791	S	S	*	*	S	Bend	trans	-94.1	-18	-177.4	-158.7	64.8	0	0	0	114.4	Q107	L105-Q107 PolarHBondContact O-N 3.48Å
106	N	30.8	Very low	30.7	Very low	157 Å²	157	153 Å²	153	84%	0.84	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.3	9.2	-176.7	-109.3	3.3	0	0	0	114.8
107	Q	34	Very low	30.4	Very low	174 Å²	174	154.5 Å²	154.5	81%	0.813	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	16.2	179.8	-151.1	174.4	4.2	0	0	113.7	L105	L105-Q107 PolarHBondContact O-N 3.48Å
108	K	34.3	Very low	30.3	Very low	191 Å²	191	160.8 Å²	160.8	83%	0.83	81%	0.81	S	S	*	*	S	Bend	trans	-131.7	15	178.8	-87.7	-168	177.2	-175.4	0	116.4
109	F	28.6	Very low	30.1	Very low	205 Å²	205	160.5 Å²	160.5	90%	0.899	81%	0.808	S	S	*	*	S	Bend	trans	-131.2	64.6	172.1	-100.2	-87.3	0	0	0	110.5
110	S	30.5	Very low	29.8	Very low	114 Å²	114	156 Å²	156	80%	0.797	80%	0.801	S	S	*	*			trans	-162.8	78.8	163.8	-84.2	0	0	0	0	108.7
111	E	27.5	Very low	29.5	Very low	189 Å²	189	159.3 Å²	159.3	88%	0.883	81%	0.809	S	S	*	*			trans	170.9	115.1	167.2	-98.5	166.2	-154.6	0	0	102.7
112	E	25.7	Very low	29	Very low	181 Å²	181	155.3 Å²	155.3	85%	0.846	80%	0.8	S	S	*	*			cis	-151.4	146	20.7	-67.7	177.2	122.6	0	0	109.8
113	V	30.8	Very low	28.3	Very low	135 Å²	135	155.3 Å²	155.3	82%	0.818	80%	0.8	S	S	*	*			trans	-107	128.5	155.5	167.3	0	0	0	0	105.9
114	K	26.1	Very low	28.2	Very low	184 Å²	184	158.6 Å²	158.6	80%	0.8	81%	0.81	S	S	*	*			trans	-166	92.7	156.2	-102	162.6	-162.2	-177.2	0	112.4
115	T	23.7	Very low	27.7	Very low	131 Å²	131	162.4 Å²	162.4	80%	0.804	82%	0.816	S	S	*	*			trans	61.6	157.9	133.3	50.4	0	0	0	0	124
116	P	41.4	Very low	27.5	Very low	115 Å²	115	162.4 Å²	162.4	75%	0.747	82%	0.816	S	S	*	*			trans	-114.3	154.3	-149.8	40.4	-28.2	0	0	0	115.5
117	E	22.7	Very low	27.2	Very low	204 Å²	204	162.9 Å²	162.9	95%	0.953	82%	0.819	S	S	*	*			trans	-143	152.9	166.9	-76.3	-166.9	159.4	0	0	114.3
118	F	23.6	Very low	26.8	Very low	195 Å²	195	158.8 Å²	158.8	86%	0.855	82%	0.815	S	S	*	*			trans	-112.5	164.4	-165.3	-164.4	-98.5	0	0	0	110.4
119	V	23.8	Very low	26.3	Very low	131 Å²	131	158.9 Å²	158.9	79%	0.794	82%	0.818	S	S	*	*			trans	116.7	125.5	158.8	-171.3	0	0	0	0	117.9
120	S	25.5	Very low	26.1	Very low	100 Å²	100	154.3 Å²	154.3	70%	0.699	82%	0.818	S	S	*	*			trans	-67.5	159	-178	-37	0	0	0	0	118.8
121	R	24.8	Very low	25.7	Very low	241 Å²	241	153 Å²	153	91%	0.909	82%	0.815	S	S	*	*			trans	163.9	140.7	136.2	-95.3	172.1	-177	154.9	1.5	108
122	S	23.4	Very low	25.6	Very low	94 Å²	94	152.4 Å²	152.4	66%	0.657	81%	0.812	S	S	*	*			cis	-159.4	133.5	9.1	-101.2	0	0	0	0	106.1
123	L	23.3	Very low	25.4	Very low	150 Å²	150	153.8 Å²	153.8	79%	0.785	82%	0.815	S	S	*	*				57	102.5	91.1	-80.9	173.4	0	0	0	115.5
124	L	24.5	Very low	25	Very low	154 Å²	154	158.1 Å²	158.1	81%	0.806	82%	0.817	S	S	*	*				154.5	142.1	109.6	-85.4	159.6	0	0	0	114.4
125	R	26.3	Very low	24.9	Very low	220 Å²	220	157.7 Å²	157.7	83%	0.83	82%	0.818	S	S	*	*	S	Bend	trans	88.7	115.6	173.5	-68.3	-170.6	-95	-145.9	-6	116.5
126	D	26.5	Very low	24.8	Very low	145 Å²	145	155.6 Å²	155.6	78%	0.775	81%	0.814	S	S	*	*			cis	-153.9	139	3.3	-84.1	-44	0	0	0	110.3
127	N	24.8	Very low	23.9	Very low	167 Å²	167	162.5 Å²	162.5	89%	0.893	83%	0.825	S	S	*	*			trans	-71.9	166.8	160.8	-78.9	-26.5	0	0	0	109
128	A	24.7	Very low	23.8	Very low	88 Å²	88	158.4 Å²	158.4	73%	0.727	82%	0.818	S	S	*	*			cis	-159.7	153.8	16	0	0	0	0	0	105.2
129	Q	25	Very low	23.8	Very low	194 Å²	194	158.2 Å²	158.2	91%	0.907	82%	0.819	S	S	*	*				-167	122.5	71	-95.5	169.3	-13.2	0	0	109.2
130	A	23.4	Very low	23.8	Very low	108 Å²	108	161.2 Å²	161.2	89%	0.893	83%	0.825	S	S	*	*			trans	-132.2	105.7	161.2	0	0	0	0	0	107
131	A	22.5	Very low	23.6	Very low	88 Å²	88	159.8 Å²	159.8	73%	0.727	83%	0.825	S	S	*	*			trans	176.3	110.6	164.6	0	0	0	0	0	102
132	E	24.3	Very low	23.6	Very low	176 Å²	176	157.7 Å²	157.7	82%	0.822	82%	0.823	S	S	*	*				-176.2	142.2	62.9	-80.5	161	168.8	0	0	105.2
133	F	22.8	Very low	23.5	Very low	209 Å²	209	160.7 Å²	160.7	92%	0.917	83%	0.831	S	S	*	*			trans	-173.4	84.2	143.3	-110	-75.2	0	0	0	108.8
134	R	21.9	Very low	23.5	Very low	227 Å²	227	161.4 Å²	161.4	86%	0.857	83%	0.83	S	S	*	*			trans	-105.5	146.2	149.2	-86.1	-173	-179.2	-175.4	2.8	106.9
135	E	23.5	Very low	23.5	Very low	174 Å²	174	161.1 Å²	161.1	81%	0.813	82%	0.824	S	S	*	*			trans	78.2	103.1	162.7	-65.4	171	-162.4	0	0	117.9
136	A	22.8	Very low	23.4	Very low	88 Å²	88	157.6 Å²	157.6	73%	0.727	82%	0.817	S	S	*	*				171.5	147.6	104.5	0	0	0	0	0	107.8
137	W	22.6	Very low	23.4	Very low	260 Å²	260	158.7 Å²	158.7	99%	0.985	82%	0.822	S	S	*	*			trans	178.6	92.3	135.8	-99.1	43	0	0	0	108.5
138	C	20.3	Very low	23.3	Very low	118 Å²	118	153.6 Å²	153.6	80%	0.797	81%	0.809	S	S	*	*			trans	-138.6	102.3	153	-115.3	0	0	0	0	105.5
139	H	23.8	Very low	23.4	Very low	190 Å²	190	157.4 Å²	157.4	88%	0.88	82%	0.817	S	S	*	*				167.2	132.4	125.5	-99.6	-81.6	0	0	0	112
140	E	22.5	Very low	23.4	Very low	195 Å²	195	153.5 Å²	153.5	91%	0.911	81%	0.811	S	S	*	*			trans	-84.6	145.1	168.4	-174.5	176.8	-154	0	0	109.4
141	G	22.3	Very low	23.5	Very low	69 Å²	69	153.5 Å²	153.5	71%	0.711	81%	0.811	S	S	*	*			trans	151.3	108.4	163.4	0	0	0	0	0	116.4
142	K	24.2	Very low	23.6	Very low	198 Å²	198	152.7 Å²	152.7	86%	0.861	81%	0.811	S	S	*	*			trans	34.3	135.7	141.7	-68.4	177.2	175.4	-179.3	0	118.6
143	L	21.6	Very low	23.7	Very low	156 Å²	156	153.6 Å²	153.6	82%	0.817	82%	0.816	S	S	*	*				-175	170.4	55.4	-156.6	84	0	0	0	108.8
144	E	24.2	Very low	23.8	Very low	166 Å²	166	148.8 Å²	148.8	78%	0.776	81%	0.808	S	S	*	*			trans	-69.3	-179.2	-169.3	-54.5	-162.7	136.8	0	0	118.9
145	E	23.9	Very low	23.9	Very low	147 Å²	147	145 Å²	145	69%	0.687	80%	0.804	S	S	*	*			trans	94.9	104.9	145.3	-85.8	-173.7	164.5	0	0	118.8
146	H	24.5	Very low	24	Very low	146 Å²	146	144.3 Å²	144.3	68%	0.676	81%	0.806	S	S	*	*				137.7	145.2	86.8	-109.8	-34.9	0	0	0	115
147	L	24.9	Very low	24.1	Very low	169 Å²	169	148.5 Å²	148.5	89%	0.885	81%	0.808	S	S	*	*			trans	81	120.5	168	-53.4	169	0	0	0	116.1
148	G	23.4	Very low	24.4	Very low	60 Å²	60	142.5 Å²	142.5	62%	0.619	80%	0.802	S	S	*	*			cis	146.7	136	5.1	0	0	0	0	0	110.7
149	N	26.1	Very low	24.6	Very low	167 Å²	167	142.9 Å²	142.9	89%	0.893	80%	0.797	S	S	*	*			trans	74.6	138.9	157.1	-57.4	-20.2	0	0	0	118.2
150	S	25.9	Very low	24.7	Very low	112 Å²	112	141.7 Å²	141.7	78%	0.783	80%	0.795	S	S	*	*			cis	-159.8	147.2	20.9	33.5	0	0	0	0	114.9
151	A	24.5	Very low	24.9	Very low	108 Å²	108	140.8 Å²	140.8	89%	0.893	79%	0.79	S	S	*	*			trans	57.1	137.6	139.8	0	0	0	0	0	122.1
152	G	24.9	Very low	25	Very low	71 Å²	71	146.8 Å²	146.8	73%	0.732	80%	0.797	S	S	*	*			cis	174.6	-178	4.8	0	0	0	0	0	115
153	Q	27.3	Very low	25	Very low	195 Å²	195	149.1 Å²	149.1	91%	0.911	80%	0.8	S	S	*	*			trans	90.6	100.2	169.1	-59.5	-176.7	5	0	0	117.9
154	S	24.2	Very low	25.1	Very low	108 Å²	108	147.3 Å²	147.3	76%	0.755	80%	0.795	S	S	*	*				64.1	133.9	86.2	-111.7	0	0	0	0	113.5
155	L	24.9	Very low	25.1	Very low	148 Å²	148	146.6 Å²	146.6	78%	0.775	80%	0.796	S	S	*	*			cis	-169.7	139	11.6	-118.5	159.3	0	0	0	107.1
156	N	24.7	Very low	25.1	Very low	160 Å²	160	145.5 Å²	145.5	86%	0.856	80%	0.799	S	S	*	*			trans	163.3	116.4	136.5	-87	-19.5	0	0	0	112.1
157	K	24.9	Very low	25.3	Very low	176 Å²	176	148 Å²	148	77%	0.765	81%	0.811	S	S	*	*			trans	-102.5	160.8	161.5	-85.1	-177.4	176.5	177.2	0	108.8
158	P	30	Very low	25.3	Very low	133 Å²	133	144.9 Å²	144.9	86%	0.864	81%	0.81	S	S	*	*				-133	151.2	102.9	16.1	4.3	0	0	0	115
159	N	24.6	Very low	25.4	Very low	127 Å²	127	148.5 Å²	148.5	68%	0.679	82%	0.82	S	S	*	*			trans	-60.5	156.2	168.8	-72.3	-54.9	0	0	0	113
160	I	25.8	Very low	25.3	Very low	165 Å²	165	149.6 Å²	149.6	85%	0.846	82%	0.822	S	S	*	*				-153.1	116.6	122.6	-62.9	-159.4	0	0	0	111.5
161	H	25.5	Very low	25.1	Very low	175 Å²	175	148 Å²	148	81%	0.81	82%	0.824	S	S	*	*			trans	27.2	125.3	146.8	-83.9	-93.3	0	0	0	125.7
162	K	24.6	Very low	25.3	Very low	195 Å²	195	153.9 Å²	153.9	85%	0.848	82%	0.823	S	S	*	*			trans	-71.1	148.2	145.7	-74.5	174.1	173.5	176	0	111
163	R	24.7	Very low	25.2	Very low	247 Å²	247	159 Å²	159	93%	0.932	83%	0.828	S	S	*	*			trans	-137.6	129.8	162.2	-135.7	175.6	171	178.4	-4	109.9
164	V	24.4	Very low	25.2	Very low	118 Å²	118	161.2 Å²	161.2	72%	0.715	83%	0.828	S	S	*	*			trans	-119.3	164.9	174.7	176.9	0	0	0	0	107.1
165	L	23.2	Very low	25.3	Very low	151 Å²	151	161.9 Å²	161.9	79%	0.791	83%	0.833	S	S	*	*			trans	97.3	141.2	166	-54.5	168.5	0	0	0	113.4
166	T	24.4	Very low	25.3	Very low	124 Å²	124	163.5 Å²	163.5	76%	0.761	84%	0.841	S	S	*	*			cis	-174.7	162.4	1.7	17.1	0	0	0	0	108
167	E	28.3	Very low	25.3	Very low	198 Å²	198	159.3 Å²	159.3	93%	0.925	84%	0.836	S	S	*	*			trans	-66.4	152.8	167.4	-67.5	173.7	142.1	0	0	113.4
168	A	24.2	Very low	25.2	Very low	104 Å²	104	160.2 Å²	160.2	86%	0.86	84%	0.843	S	S	*	*			trans	-150.5	134.3	158.6	0	0	0	0	0	111.5
169	T	25.8	Very low	25	Very low	136 Å²	136	163.8 Å²	163.8	83%	0.834	84%	0.839	S	S	*	*			trans	-80	151.5	178.5	45.8	0	0	0	0	114
170	M	24.7	Very low	24.9	Very low	190 Å²	190	163.7 Å²	163.7	94%	0.936	85%	0.845	S	S	*	*			trans	-148.3	130.8	144.9	-77.3	-142.3	-68.6	0	0	111.4
171	G	22.6	Very low	24.9	Very low	80 Å²	80	163.1 Å²	163.1	83%	0.825	84%	0.839	S	S	*	*			trans	-72.8	176.6	165.2	0	0	0	0	0	111.2
172	R	28.4	Very low	24.8	Very low	231 Å²	231	164.1 Å²	164.1	87%	0.872	84%	0.844	S	S	*	*			cis	-169.8	146.8	37.3	-136.8	-178.4	-163.4	167.1	3	103.9
173	E	23.1	Very low	24.8	Very low	179 Å²	179	158.3 Å²	158.3	84%	0.836	84%	0.84	S	S	*	*				171.4	166.6	80.6	-113.2	172.6	-166.7	0	0	110.5
174	R	27.3	Very low	25.1	Very low	240 Å²	240	152.7 Å²	152.7	91%	0.906	84%	0.838	S	S	*	*			trans	-97.2	141	-162.5	-175.5	-169.2	-75.2	179.3	-5.7	112
175	S	24.8	Very low	25.3	Very low	122 Å²	122	150.9 Å²	150.9	85%	0.853	84%	0.835	S	S	*	*			trans	-160.2	149.6	149.3	34.3	0	0	0	0	112.7
176	L	25.6	Very low	25.3	Very low	182 Å²	182	153.7 Å²	153.7	95%	0.953	84%	0.842	S	S	*	*			trans	-74.5	152.9	-164.2	-68.9	136.8	0	0	0	114.1
177	G	23.8	Very low	25.5	Very low	72 Å²	72	155.1 Å²	155.1	74%	0.742	85%	0.845	S	S	*	*			trans	164.4	81	165.8	0	0	0	0	0	114.9
178	E	24.1	Very low	25.6	Very low	195 Å²	195	156 Å²	156	91%	0.911	84%	0.84	S	S	*	*			trans	40.9	126.4	145.4	-61.8	-178.5	150.9	0	0	122.6
179	R	25.2	Very low	25.7	Very low	208 Å²	208	157.9 Å²	157.9	79%	0.785	84%	0.836	S	S	*	*			trans	-70.4	154.9	162.2	-110.7	-178.8	-168.3	172.4	2.4	111.3
180	P	23.1	Very low	26	Very low	125 Å²	125	160 Å²	160	81%	0.812	84%	0.841	S	S	*	*				-128.8	112	110.7	11.3	8.7	0	0	0	109.9
181	Q	24.8	Very low	26.1	Very low	153 Å²	153	157.7 Å²	157.7	72%	0.715	83%	0.832	S	S	*	*				31.7	91.1	99.1	-77.9	-166.7	-11.7	0	0	115.6
182	E	24.3	Very low	26.7	Very low	197 Å²	197	160.5 Å²	160.5	92%	0.921	83%	0.828	S	S	*	*				-120.4	129.8	129.7	-76.9	-168.8	168.2	0	0	108.4
183	G	24.5	Very low	26.8	Very low	73 Å²	73	156.6 Å²	156.6	75%	0.753	82%	0.824	S	S	*	*			trans	-72.4	141.3	-159.3	0	0	0	0	0	114.7	A185	G183-A185 PolarHBondContact O-N 3.41Å
184	S	30.3	Very low	27.7	Very low	128 Å²	128	156 Å²	156	90%	0.895	82%	0.821	S	S	*	*			trans	-57.2	110.6	151.6	55.7	0	0	0	0	109.9
185	A	28.5	Very low	28.2	Very low	80 Å²	80	150.3 Å²	150.3	66%	0.661	81%	0.809	S	S	*	*			trans	-144.6	92.4	158.5	0	0	0	0	0	107.6	G183	G183-A185 PolarHBondContact O-N 3.41Å
186	F	24.2	Very low	29.1	Very low	210 Å²	210	150.2 Å²	150.2	92%	0.921	80%	0.803	S	S	*	*			trans	-154.8	62.1	152.6	-108.4	-74.4	0	0	0	108.6
187	D	27.2	Very low	30.3	Very low	155 Å²	155	145.1 Å²	145.1	83%	0.829	78%	0.779	S	S	*	*			trans	-94.5	135.6	151.2	-128.4	-23.9	0	0	0	107.6
188	R	30.5	Very low	31.7	Very low	215 Å²	215	149.6 Å²	149.6	81%	0.811	77%	0.774	S	S	*	*			trans	77.5	92.7	174	-56.7	178.3	175	171.5	-1.6	118.5
189	N	26.4	Very low	33.1	Very low	145 Å²	145	145 Å²	145	78%	0.775	75%	0.754	S	S	*	*				-174.2	77.5	109.9	-109.3	-45.2	0	0	0	110.5	N191	N189-N191 PolarHBondContact O-N 3.08Å
190	L	31.8	Very low	34.7	Very low	180 Å²	180	139.2 Å²	139.2	94%	0.942	74%	0.736	S	S	*	*			trans	-73.3	87.5	153.6	-85.5	162.2	0	0	0	105.9	L192	L190-L192 VanDerWaalsContact C-N 3.26Å; L190-L192 PolarHBondContact O-N 3.08Å
191	N	28	Very low	36.4	Very low	141 Å²	141	142.3 Å²	142.3	75%	0.754	73%	0.732	S	S	*	*			trans	-68.2	97.1	170.8	-150.4	-19.7	0	0	0	107	N189 N193	N189-N191 PolarHBondContact O-N 3.08Å; N191-N193 VanDerWaalsContact C-N 3.31Å; N191-N193 PolarHBondContact O-N 3.44Å
192	L	34.8	Very low	37.9	Very low	140 Å²	140	137.4 Å²	137.4	73%	0.733	71%	0.711	S	S	*	*			trans	-56.6	94.1	169.8	-170.1	84.2	0	0	0	106.9	L190 Q194	L190-L192 VanDerWaalsContact C-N 3.26Å; L190-L192 PolarHBondContact O-N 3.08Å; L192-Q194 VanDerWaalsContact C-N 3.27Å; L192-Q194 HydrophobicContact CD2-CG 4.5Å; L192-Q194 PolarHBondContact O-N 3.15Å
193	N	29.6	Very low	39.3	Very low	149 Å²	149	138.7 Å²	138.7	80%	0.797	71%	0.713	S	S	*	*			trans	-68.1	99.3	166.7	-126	-19.4	0	0	0	106.5	N191 N195	N191-N193 VanDerWaalsContact C-N 3.31Å; N191-N193 PolarHBondContact O-N 3.44Å; N193-N195 PolarHBondContact O-N 3.41Å
194	Q	42.9	Very low	40.8	Very low	166 Å²	166	140.5 Å²	140.5	78%	0.776	71%	0.71	S	S	*	*			trans	-53.6	97	174	-76.8	168.3	-32.3	0	0	109.1	L192	L192-Q194 VanDerWaalsContact C-N 3.27Å; L192-Q194 HydrophobicContact CD2-CG 4.5Å; L192-Q194 PolarHBondContact O-N 3.15Å
195	N	37.4	Very low	42.1	Very low	120 Å²	120	136.5 Å²	136.5	64%	0.642	69%	0.688	S	S	*	*			trans	-113.8	111.3	152.7	-75.1	-47.9	0	0	0	106.1	N193 V197	N193-N195 PolarHBondContact O-N 3.41Å; N195-V197 PolarHBondContact O-N 3.41Å
196	V	43.7	Very low	43.8	Very low	120 Å²	120	137.5 Å²	137.5	73%	0.727	68%	0.68	S	S	*	*			trans	-48.7	107.6	-176.2	177.8	0	0	0	0	110.4	R198	V196-R198 PolarHBondContact O-N 3.08Å; V196-R198 VanDerWaalsContact O-N 3.08Å
197	V	52.1	Low	45.9	Very low	75 Å²	75	135.7 Å²	135.7	46%	0.455	67%	0.667	S	S	.	*			trans	-70.1	102.6	177.9	-179.8	0	0	0	0	109	N195 L199 F209	N195-V197 PolarHBondContact O-N 3.41Å; V197-L199 PolarHBondContact O-N 3.4Å; V197-F209 HydrophobicContact CG1-CD1 3.66Å; V197-F209 HydrophobicContact CG1-CE1 3.82Å
198	R	52.2	Low	48.3	Very low	167 Å²	167	129 Å²	129	63%	0.63	63%	0.632	S	S	*	*			trans	-80.5	95.6	170.6	-92.5	-179.1	168	154.5	-2.6	110.6	V196 Q200	V196-R198 PolarHBondContact O-N 3.08Å; V196-R198 VanDerWaalsContact O-N 3.08Å; R198-Q200 PolarHBondContact O-N 3.17Å
199	L	54.2	Low	50.7	Low	97 Å²	97	120.4 Å²	120.4	51%	0.508	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-65	118.9	161.3	-90	131.4	0	0	0	109.2	V197 R207 F209	V197-L199 PolarHBondContact O-N 3.4Å; L199-R207 HydrophobicContact CD2-CB 3.91Å; L199-R207 HydrophobicContact CD2-CG 4.06Å; L199-F209 HydrophobicContact CD1-CE1 4.28Å; L199-F209 HydrophobicContact CD2-CE1 4.04Å; L199-F209 HydrophobicContact CD2-CZ 4.03Å; L199-F209 HydrophobicContact CG-CD1 4.42Å; L199-F209 HydrophobicContact CG-CE1 3.86Å; L199-F209 HydrophobicContact CG-CZ 4.36Å
200	Q	58.5	Low	53	Low	87 Å²	87	116.8 Å²	116.8	41%	0.407	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.7	149.4	171.9	-67.9	-171	-23.7	0	0	110.1	R198 V208	R198-Q200 PolarHBondContact O-N 3.17Å; Q200-V208 PolarHBondContact N-O 3.5Å; Q200-V208 VanDerWaalsContact N-O 3.08Å; Q200-V208 WeakPolarHBondContact O-CG2 3.2Å; Q200-V208 PolarHBondContact O-N 3.05Å
201	R	58.7	Low	55.2	Low	190 Å²	190	108.2 Å²	108.2	72%	0.717	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	130.4	169.4	-79.7	-179.7	169.4	159.8	-2.4	108.8	E206	R201-E206 WeakPolarHBondContact CA-O 3.48Å
202	N	57.1	Low	57.3	Low	51 Å²	51	106 Å²	106	27%	0.273	52%	0.521	S	S	.	.			trans	-74.7	178.7	171.8	69	5.6	0	0	0	110.8	T204 G205 E206 V208	N202-T204 VanDerWaalsContact CG-OG1 3.29Å; N202-T204 PolarHBondContact ND2-OG1 3.26Å; N202-T204 PolarHBondContact O-N 3.4Å; N202-T204 PolarHBondContact OD1-N 3.07Å; N202-T204 VanDerWaalsContact OD1-N 3.14Å; N202-T204 PolarHBondContact OD1-OG1 3.27Å; N202-G205 PolarHBondContact O-N 3.46Å; N202-G205 PolarHBondContact OD1-N 2.81Å; N202-E206 PolarHBondContact N-O 3.39Å; N202-E206 PolarHBondContact ND2-OE2 2.99Å; N202-E206 PolarHBondContact OD1-N 3.31Å; N202-E206 PolarHBondContact OD1-O 3.15Å; N202-V208 HydrophobicContact CB-CG1 4.13Å; N202-V208 HydrophobicContact CB-CG2 4.11Å
203	K	53.5	Low	59	Low	223 Å²	223	103.3 Å²	103.3	97%	0.97	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-13.2	-179	-64.7	-175.7	178.4	-177.2	0	114.3
204	T	55.6	Low	61.3	Low	112 Å²	112	96.2 Å²	96.2	69%	0.687	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	5	176.6	55.5	0	0	0	0	112.8	N202	N202-T204 VanDerWaalsContact CG-OG1 3.29Å; N202-T204 PolarHBondContact ND2-OG1 3.26Å; N202-T204 PolarHBondContact O-N 3.4Å; N202-T204 PolarHBondContact OD1-N 3.07Å; N202-T204 VanDerWaalsContact OD1-N 3.14Å; N202-T204 PolarHBondContact OD1-OG1 3.27Å
205	G	57.6	Low	62.7	Low	43 Å²	43	90.3 Å²	90.3	44%	0.443	45%	0.445	S	S	.	.	S	Bend	trans	84.9	-1.5	177.4	0	0	0	0	0	115.5	N202	N202-G205 PolarHBondContact O-N 3.46Å; N202-G205 PolarHBondContact OD1-N 2.81Å
206	E	64.9	Low	64.5	Low	102 Å²	102	87.3 Å²	87.3	48%	0.477	43%	0.426	S	S	.	.			trans	-76.3	139.1	177.9	-61.8	-177.5	134.5	0	0	111.6	R201 N202 V208	R201-E206 WeakPolarHBondContact CA-O 3.48Å; N202-E206 PolarHBondContact N-O 3.39Å; N202-E206 PolarHBondContact ND2-OE2 2.99Å; N202-E206 PolarHBondContact OD1-N 3.31Å; N202-E206 PolarHBondContact OD1-O 3.15Å; E206-V208 PolarHBondContact O-N 3.41Å
207	R	68.3	Low	65.9	Low	172 Å²	172	85.8 Å²	85.8	65%	0.649	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	118.1	174.7	-73.4	176.6	177.4	171.5	1.8	109.5	L199	L199-R207 HydrophobicContact CD2-CB 3.91Å; L199-R207 HydrophobicContact CD2-CG 4.06Å
208	V	77	Confident	67.3	Low	15 Å²	15	84.1 Å²	84.1	9%	0.091	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	147.5	176.5	-63.7	0	0	0	0	110.8	Q200 N202 E206 T217 F218	Q200-V208 PolarHBondContact N-O 3.5Å; Q200-V208 VanDerWaalsContact N-O 3.08Å; Q200-V208 WeakPolarHBondContact O-CG2 3.2Å; Q200-V208 PolarHBondContact O-N 3.05Å; N202-V208 HydrophobicContact CB-CG1 4.13Å; N202-V208 HydrophobicContact CB-CG2 4.11Å; E206-V208 PolarHBondContact O-N 3.41Å; V208-T217 HydrophobicContact CG2-CG2 4.24Å; V208-F218 CarbonylContact C-O 3.53Å; V208-F218 WeakPolarHBondContact CA-O 3.41Å
209	F	79.6	Confident	68.4	Low	34 Å²	34	81.7 Å²	81.7	15%	0.149	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	116.6	178.8	-62.6	-87.1	0	0	0	108.7	V197 L199 T217 F218 N221 L224	V197-F209 HydrophobicContact CG1-CD1 3.66Å; V197-F209 HydrophobicContact CG1-CE1 3.82Å; L199-F209 HydrophobicContact CD1-CE1 4.28Å; L199-F209 HydrophobicContact CD2-CE1 4.04Å; L199-F209 HydrophobicContact CD2-CZ 4.03Å; L199-F209 HydrophobicContact CG-CD1 4.42Å; L199-F209 HydrophobicContact CG-CE1 3.86Å; L199-F209 HydrophobicContact CG-CZ 4.36Å; F209-T217 CarbonylContact O-C 3.57Å; F209-T217 WeakPolarHBondContact O-CA 3.48Å; F209-F218 PolarHBondContact N-O 3.3Å; F209-F218 PolarHBondContact O-N 3.25Å; F209-N221 HydrophobicContact CD1-CB 3.83Å; F209-N221 HydrophobicContact CD2-CB 4.31Å; F209-N221 VanDerWaalsContact CD2-N 3.25Å; F209-N221 HydrophobicContact CE1-CB 3.69Å; F209-N221 HydrophobicContact CE2-CB 4.17Å; F209-N221 VanDerWaalsContact CE2-N 3.35Å; F209-N221 HydrophobicContact CG-CB 4.14Å; F209-N221 HydrophobicContact CZ-CB 3.86Å; F209-L224 HydrophobicContact CB-CB 3.98Å; F209-L224 HydrophobicContact CB-CD2 3.69Å; F209-L224 HydrophobicContact CB-CG 4.44Å
210	K	74.8	Confident	69.4	Low	68 Å²	68	83.2 Å²	83.2	30%	0.296	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	136	-177.6	-169.9	179.1	176.5	-176.7	0	110.6	S215 K216 T217 L224	K210-S215 VanDerWaalsContact CE-CA 3.49Å; K210-S215 WeakPolarHBondContact CE-O 3.24Å; K210-S215 WeakPolarHBondContact CE-OG 3.31Å; K210-K216 CarbonylContact C-O 3.55Å; K210-K216 WeakPolarHBondContact CA-O 3.45Å; K210-T217 HydrophobicContact CB-CG2 4.31Å; K210-T217 HydrophobicContact CG-CG2 4.19Å; K210-L224 WeakPolarHBondContact O-CD2 3.44Å
211	C	79.7	Confident	70.1	Confident	0 Å²	0	82 Å²	82	0%	0	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-76.3	133.5	171.5	-174.2	0	0	0	0	110.2	C214 S215 K216 F218 L224	C211-C214 PolarHBondContact SG-N 3.49Å; C211-S215 WeakPolarHBondContact O-CA 3.43Å; C211-S215 PolarHBondContact O-N 3.42Å; C211-K216 PolarHBondContact N-O 3.32Å; C211-F218 HydrophobicContact CB-CE2 4.24Å; C211-L224 VanDerWaalsContact CA-CD1 3.42Å; C211-L224 HydrophobicContact CB-CD1 3.42Å; C211-L224 VanDerWaalsContact CB-CD1 3.42Å
212	D	70.2	Confident	70.7	Confident	96 Å²	96	76.8 Å²	76.8	51%	0.513	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-34	-177.7	-61.1	-50.6	0	0	0	113
213	I	72.5	Confident	71.6	Confident	83 Å²	83	76.1 Å²	76.1	43%	0.426	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-63.3	169.9	-56.5	169.5	0	0	0	106	S65 Q69 H231	S65-I213 WeakPolarHBondContact OG-CG2 3.49Å; Q69-I213 PolarHBondContact NE2-O 3.17Å; Q69-I213 PolarHBondContact OE1-O 2.8Å; I213-H231 HydrophobicContact CD1-CB 3.52Å; I213-H231 HydrophobicContact CG2-CB 4.41Å
214	C	76.2	Confident	72.8	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-31.6	-179.2	131.9	0	0	0	0	121.8	S65 E68 Q69 C211 K216 H227 H231	S65-C214 VanDerWaalsContact O-CB 3.29Å; S65-C214 WeakPolarHBondContact O-CB 3.27Å; E68-C214 HydrophobicContact CB-CB 4.32Å; E68-C214 WeakPolarHBondContact CB-SG 3.25Å; Q69-C214 WeakPolarHBondContact CA-O 3.34Å; Q69-C214 VanDerWaalsContact CB-C 3.48Å; Q69-C214 HydrophobicContact CB-CB 3.84Å; Q69-C214 WeakPolarHBondContact CB-O 3.36Å; Q69-C214 HydrophobicContact CG-CB 3.48Å; Q69-C214 VanDerWaalsContact CG-CB 3.48Å; C211-C214 PolarHBondContact SG-N 3.49Å; C214-K216 PolarHBondContact O-N 3.34Å; C214-K216 VanDerWaalsContact SG-CG 3.56Å; C214-H227 PolarHBondContact SG-CE1 2.99Å; C214-H227 PolarHBondContact SG-NE2 3.42Å; C214-H231 WeakPolarHBondContact CB-CE1 3.31Å; C214-H231 WeakPolarHBondContact CB-NE2 3.41Å; C214-H231 PolarHBondContact SG-NE2 3.47Å; C214-H231 VanDerWaalsContact SG-NE2 3.44Å
215	S	73.7	Confident	73.6	Confident	42 Å²	42	62.7 Å²	62.7	29%	0.294	32%	0.322	S	S	.	.			trans	45.4	-1.7	-155.7	-65.6	0	0	0	0	119.1	K210 C211	K210-S215 VanDerWaalsContact CE-CA 3.49Å; K210-S215 WeakPolarHBondContact CE-O 3.24Å; K210-S215 WeakPolarHBondContact CE-OG 3.31Å; C211-S215 WeakPolarHBondContact O-CA 3.43Å; C211-S215 PolarHBondContact O-N 3.42Å
216	K	74.9	Confident	74.4	Confident	56 Å²	56	66 Å²	66	24%	0.243	32%	0.321	C	S	.	.			trans	-63.1	136.9	173.5	-81	-172.4	169.1	175.1	0	109.8	E68 K210 C211 C214 F218	E68-K216 HydrophobicContact CB-CD 3.93Å; E68-K216 VanDerWaalsContact CD-NZ 3.26Å; E68-K216 WeakPolarHBondContact O-CD 3.39Å; E68-K216 WeakPolarHBondContact O-CE 2.99Å; E68-K216 WeakPolarHBondContact O-CG 3.47Å; E68-K216 IonicContact OE1-NZ 3.57Å; E68-K216 PolarHBondContact OE1-NZ 3.27Å; K210-K216 CarbonylContact C-O 3.55Å; K210-K216 WeakPolarHBondContact CA-O 3.45Å; C211-K216 PolarHBondContact N-O 3.32Å; C214-K216 PolarHBondContact O-N 3.34Å; C214-K216 VanDerWaalsContact SG-CG 3.56Å; K216-F218 HydrophobicContact CB-CD2 4.45Å; K216-F218 HydrophobicContact CB-CE2 3.48Å; K216-F218 VanDerWaalsContact CB-CE2 3.48Å; K216-F218 HydrophobicContact CB-CZ 3.64Å; K216-F218 HydrophobicContact CD-CZ 3.97Å; K216-F218 HydrophobicContact CG-CZ 4.44Å; K216-F218 WeakPolarHBondContact O-CE2 3.39Å
217	T	73.3	Confident	74.9	Confident	89 Å²	89	62 Å²	62	55%	0.546	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	134.3	177.4	54.5	0	0	0	0	110.7	V208 F209 K210	V208-T217 HydrophobicContact CG2-CG2 4.24Å; F209-T217 CarbonylContact O-C 3.57Å; F209-T217 WeakPolarHBondContact O-CA 3.48Å; K210-T217 HydrophobicContact CB-CG2 4.31Å; K210-T217 HydrophobicContact CG-CG2 4.19Å
218	F	80	Confident	75	Confident	39 Å²	39	56.3 Å²	56.3	17%	0.171	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	146.5	-179.2	-61.2	-86.9	0	0	0	109.9	V208 F209 C211 K216 D223 L224 H227	V208-F218 CarbonylContact C-O 3.53Å; V208-F218 WeakPolarHBondContact CA-O 3.41Å; F209-F218 PolarHBondContact N-O 3.3Å; F209-F218 PolarHBondContact O-N 3.25Å; C211-F218 HydrophobicContact CB-CE2 4.24Å; K216-F218 HydrophobicContact CB-CD2 4.45Å; K216-F218 HydrophobicContact CB-CE2 3.48Å; K216-F218 VanDerWaalsContact CB-CE2 3.48Å; K216-F218 HydrophobicContact CB-CZ 3.64Å; K216-F218 HydrophobicContact CD-CZ 3.97Å; K216-F218 HydrophobicContact CG-CZ 4.44Å; K216-F218 WeakPolarHBondContact O-CE2 3.39Å; F218-D223 HydrophobicContact CB-CB 4.07Å; F218-D223 HydrophobicContact CD1-CB 3.86Å; F218-D223 HydrophobicContact CG-CB 4.27Å; F218-L224 HydrophobicContact CB-CB 4.12Å; F218-L224 HydrophobicContact CD2-CB 3.81Å; F218-L224 HydrophobicContact CD2-CD1 3.65Å; F218-L224 HydrophobicContact CD2-CG 4.33Å; F218-L224 HydrophobicContact CE2-CD1 3.84Å; F218-L224 HydrophobicContact CG-CB 4.11Å; F218-H227 HydrophobicContact CE1-CB 3.74Å; F218-H227 AromaticContact CE1-CG 3.95Å; F218-H227 HydrophobicContact CE2-CB 3.9Å; F218-H227 AromaticContact CE2-CD2 3.36Å; F218-H227 WeakPolarHBondContact CE2-CD2 3.4Å; F218-H227 AromaticContact CE2-CG 3.61Å; F218-H227 HydrophobicContact CZ-CB 3.36Å; F218-H227 AromaticContact CZ-CD2 3.37Å; F218-H227 WeakPolarHBondContact CZ-CD2 3.28Å; F218-H227 AromaticContact CZ-CG 3.11Å; F218-H227 AromaticContact CZ-ND1 3.59Å; F218-H227 AromaticContact CZ-NE2 3.94Å
219	K	76.1	Confident	75.1	Confident	117 Å²	117	58.5 Å²	58.5	51%	0.509	29%	0.29	S	S	.	.	S	Bend	trans	-70.9	-35.3	178.1	-172.8	171.8	-178.9	166.6	0	112.1
220	Y	75.1	Confident	74.5	Confident	128 Å²	128	57.9 Å²	57.9	50%	0.502	29%	0.29	S	S	.	.	S	Bend	trans	-122.5	147.5	-179	-54.5	-69	0	0	0	111.8	S222 D223 L224	Y220-S222 VanDerWaalsContact C-N 3.25Å; Y220-S222 PolarHBondContact O-N 3.37Å; Y220-D223 WeakPolarHBondContact CD2-OD2 3.38Å; Y220-D223 WeakPolarHBondContact O-CB 3.3Å; Y220-D223 PolarHBondContact O-N 3.07Å; Y220-D223 VanDerWaalsContact O-N 3.14Å; Y220-L224 PolarHBondContact O-N 2.98Å
221	N	73.3	Confident	74.4	Confident	63 Å²	63	56.1 Å²	56.1	34%	0.337	28%	0.282	S	S	.	.	H	α-helix	trans	-62.3	-34.9	177.3	-168.2	38.4	0	0	0	111.7	F209 D223 L224 S225	F209-N221 HydrophobicContact CD1-CB 3.83Å; F209-N221 HydrophobicContact CD2-CB 4.31Å; F209-N221 VanDerWaalsContact CD2-N 3.25Å; F209-N221 HydrophobicContact CE1-CB 3.69Å; F209-N221 HydrophobicContact CE2-CB 4.17Å; F209-N221 VanDerWaalsContact CE2-N 3.35Å; F209-N221 HydrophobicContact CG-CB 4.14Å; F209-N221 HydrophobicContact CZ-CB 3.86Å; N221-D223 PolarHBondContact O-N 3.42Å; N221-L224 PolarHBondContact O-N 3.12Å; N221-L224 VanDerWaalsContact O-N 3.17Å; N221-S225 WeakPolarHBondContact O-CB 3.42Å; N221-S225 PolarHBondContact O-N 2.81Å; N221-S225 PolarHBondContact O-OG 2.87Å
222	S	72.4	Confident	74	Confident	80 Å²	80	60 Å²	60	56%	0.559	31%	0.306	S	S	*	.	H	α-helix	trans	-59.1	-34.9	175.3	51.3	0	0	0	0	112.9	Y220 R226	Y220-S222 VanDerWaalsContact C-N 3.25Å; Y220-S222 PolarHBondContact O-N 3.37Å; S222-R226 VanDerWaalsContact O-CB 3.24Å; S222-R226 WeakPolarHBondContact O-CB 3.31Å; S222-R226 PolarHBondContact O-N 3.35Å
223	D	75.8	Confident	73.9	Confident	37 Å²	37	57 Å²	57	20%	0.198	30%	0.297	C	S	.	.	H	α-helix	trans	-74.8	-39	176.3	-62.4	-39.9	0	0	0	111.6	F218 Y220 N221 R226 H227	F218-D223 HydrophobicContact CB-CB 4.07Å; F218-D223 HydrophobicContact CD1-CB 3.86Å; F218-D223 HydrophobicContact CG-CB 4.27Å; Y220-D223 WeakPolarHBondContact CD2-OD2 3.38Å; Y220-D223 WeakPolarHBondContact O-CB 3.3Å; Y220-D223 PolarHBondContact O-N 3.07Å; Y220-D223 VanDerWaalsContact O-N 3.14Å; N221-D223 PolarHBondContact O-N 3.42Å; D223-R226 PolarHBondContact O-N 2.87Å; D223-R226 IonicContact OD1-CZ 3.92Å; D223-R226 IonicContact OD1-NH1 3.3Å; D223-R226 IonicContact OD1-NH2 2.72Å; D223-R226 PolarHBondContact OD1-NH2 3.13Å; D223-H227 WeakPolarHBondContact O-CB 3.36Å; D223-H227 PolarHBondContact O-N 2.77Å
224	L	77	Confident	74	Confident	7 Å²	7	58.1 Å²	58.1	4%	0.037	30%	0.301	C	S	.	.	H	α-helix	trans	-63	-49.4	172.5	172.4	60.4	0	0	0	111.1	F209 K210 C211 F218 Y220 N221 R226 H227 Q228	F209-L224 HydrophobicContact CB-CB 3.98Å; F209-L224 HydrophobicContact CB-CD2 3.69Å; F209-L224 HydrophobicContact CB-CG 4.44Å; K210-L224 WeakPolarHBondContact O-CD2 3.44Å; C211-L224 VanDerWaalsContact CA-CD1 3.42Å; C211-L224 HydrophobicContact CB-CD1 3.42Å; C211-L224 VanDerWaalsContact CB-CD1 3.42Å; F218-L224 HydrophobicContact CB-CB 4.12Å; F218-L224 HydrophobicContact CD2-CB 3.81Å; F218-L224 HydrophobicContact CD2-CD1 3.65Å; F218-L224 HydrophobicContact CD2-CG 4.33Å; F218-L224 HydrophobicContact CE2-CD1 3.84Å; F218-L224 HydrophobicContact CG-CB 4.11Å; Y220-L224 PolarHBondContact O-N 2.98Å; N221-L224 PolarHBondContact O-N 3.12Å; N221-L224 VanDerWaalsContact O-N 3.17Å; L224-R226 VanDerWaalsContact C-N 3.3Å; L224-R226 PolarHBondContact O-N 3.13Å; L224-H227 CarbonylContact O-C 3.26Å; L224-H227 WeakPolarHBondContact O-CB 3.44Å; L224-H227 PolarHBondContact O-N 2.96Å; L224-H227 VanDerWaalsContact O-N 3.11Å; L224-Q228 HydrophobicContact CD1-CG 4.13Å; L224-Q228 HydrophobicContact CG-CG 4.47Å; L224-Q228 WeakPolarHBondContact O-CG 3.39Å; L224-Q228 PolarHBondContact O-N 3.48Å
225	S	73.9	Confident	74.1	Confident	45 Å²	45	60.4 Å²	60.4	32%	0.315	31%	0.311	S	S	.	.	H	α-helix	trans	-61.6	-37.6	177.8	-58.4	0	0	0	0	111.8	N221	N221-S225 WeakPolarHBondContact O-CB 3.42Å; N221-S225 PolarHBondContact O-N 2.81Å; N221-S225 PolarHBondContact O-OG 2.87Å
226	R	73.6	Confident	74.4	Confident	113 Å²	113	61.8 Å²	61.8	43%	0.426	32%	0.319	S	S	.	.	H	α-helix	trans	-66.6	-42	172.3	-178.1	173.1	66.6	-137.9	-5.8	111.8	S222 D223 L224 Q228 R229 H248	S222-R226 VanDerWaalsContact O-CB 3.24Å; S222-R226 WeakPolarHBondContact O-CB 3.31Å; S222-R226 PolarHBondContact O-N 3.35Å; D223-R226 PolarHBondContact O-N 2.87Å; D223-R226 IonicContact OD1-CZ 3.92Å; D223-R226 IonicContact OD1-NH1 3.3Å; D223-R226 IonicContact OD1-NH2 2.72Å; D223-R226 PolarHBondContact OD1-NH2 3.13Å; L224-R226 VanDerWaalsContact C-N 3.3Å; L224-R226 PolarHBondContact O-N 3.13Å; R226-Q228 VanDerWaalsContact C-N 3.35Å; R226-R229 WeakPolarHBondContact O-CB 3.42Å; R226-R229 PolarHBondContact O-N 3.22Å; R226-H248 WeakPolarHBondContact CD-NE2 3.37Å; R226-H248 WeakPolarHBondContact CG-NE2 3.48Å
227	H	75	Confident	74.7	Confident	17 Å²	17	62.8 Å²	62.8	8%	0.079	32%	0.322	C	S	.	.	H	α-helix	trans	-65.7	-36.4	176.9	165.5	74.9	0	0	0	112.3	E68 C214 F218 D223 L224 R229 S230 H231	E68-H227 IonicContact OE1-CE1 3.96Å; E68-H227 IonicContact OE2-CE1 3.49Å; E68-H227 PolarHBondContact OE2-CE1 3.4Å; E68-H227 IonicContact OE2-ND1 2.74Å; C214-H227 PolarHBondContact SG-CE1 2.99Å; C214-H227 PolarHBondContact SG-NE2 3.42Å; F218-H227 HydrophobicContact CE1-CB 3.74Å; F218-H227 AromaticContact CE1-CG 3.95Å; F218-H227 HydrophobicContact CE2-CB 3.9Å; F218-H227 AromaticContact CE2-CD2 3.36Å; F218-H227 WeakPolarHBondContact CE2-CD2 3.4Å; F218-H227 AromaticContact CE2-CG 3.61Å; F218-H227 HydrophobicContact CZ-CB 3.36Å; F218-H227 AromaticContact CZ-CD2 3.37Å; F218-H227 WeakPolarHBondContact CZ-CD2 3.28Å; F218-H227 AromaticContact CZ-CG 3.11Å; F218-H227 AromaticContact CZ-ND1 3.59Å; F218-H227 AromaticContact CZ-NE2 3.94Å; D223-H227 WeakPolarHBondContact O-CB 3.36Å; D223-H227 PolarHBondContact O-N 2.77Å; L224-H227 CarbonylContact O-C 3.26Å; L224-H227 WeakPolarHBondContact O-CB 3.44Å; L224-H227 PolarHBondContact O-N 2.96Å; L224-H227 VanDerWaalsContact O-N 3.11Å; H227-R229 PolarHBondContact O-N 3.24Å; H227-S230 VanDerWaalsContact O-CB 3.26Å; H227-S230 WeakPolarHBondContact O-CB 3.39Å; H227-S230 PolarHBondContact O-N 3.06Å; H227-S230 PolarHBondContact O-OG 2.92Å; H227-H231 AromaticContact CD2-NE2 3.96Å; H227-H231 AromaticContact CE1-NE2 3.46Å; H227-H231 PolarHBondContact CE1-NE2 2.99Å; H227-H231 AromaticContact NE2-CD2 3.77Å; H227-H231 AromaticContact NE2-NE2 3.05Å; H227-H231 PolarHBondContact NE2-NE2 3.31Å
228	Q	71.4	Confident	75	Confident	54 Å²	54	64.7 Å²	64.7	25%	0.252	32%	0.324	S	S	.	.	H	α-helix	trans	-59.1	-32.2	176.2	-77.6	170.4	-35.8	0	0	112.6	L224 R226 S230 H231 T232	L224-Q228 HydrophobicContact CD1-CG 4.13Å; L224-Q228 HydrophobicContact CG-CG 4.47Å; L224-Q228 WeakPolarHBondContact O-CG 3.39Å; L224-Q228 PolarHBondContact O-N 3.48Å; R226-Q228 VanDerWaalsContact C-N 3.35Å; Q228-S230 PolarHBondContact O-N 3.21Å; Q228-S230 VanDerWaalsContact O-N 3.17Å; Q228-H231 WeakPolarHBondContact O-CA 3.46Å; Q228-H231 WeakPolarHBondContact O-CB 3.36Å; Q228-H231 PolarHBondContact O-N 2.89Å; Q228-T232 PolarHBondContact O-N 3.3Å; Q228-T232 VanDerWaalsContact O-N 3.1Å
229	R	78.4	Confident	75.2	Confident	61 Å²	61	62.8 Å²	62.8	23%	0.23	32%	0.316	C	S	.	.	H	α-helix	trans	-61.2	-23	173.2	-60.6	178.6	-171.5	175.3	0.4	113.9	R226 H227 H231 T232 G233 E234 Y237 T247	R226-R229 WeakPolarHBondContact O-CB 3.42Å; R226-R229 PolarHBondContact O-N 3.22Å; H227-R229 PolarHBondContact O-N 3.24Å; R229-H231 VanDerWaalsContact C-N 3.33Å; R229-T232 WeakPolarHBondContact CA-OG1 3.5Å; R229-G233 WeakPolarHBondContact O-CA 3.42Å; R229-G233 PolarHBondContact O-N 2.81Å; R229-E234 HydrophobicContact CB-CB 4.39Å; R229-E234 HydrophobicContact CG-CB 4.29Å; R229-E234 PolarHBondContact O-N 3.05Å; R229-Y237 VanDerWaalsContact NH1-CE2 3.3Å; R229-Y237 PolarHBondContact NH1-OH 3.06Å; R229-T247 PolarHBondContact NH1-O 3.46Å
230	S	68.1	Low	75.2	Confident	21 Å²	21	61.3 Å²	61.3	15%	0.147	33%	0.334	C	S	.	.	H	α-helix	trans	-66.6	-38.9	172	73.2	0	0	0	0	110.5	K60 H227 Q228	K60-S230 WeakPolarHBondContact CB-O 3.3Å; K60-S230 WeakPolarHBondContact CD-O 3.4Å; K60-S230 PolarHBondContact NZ-OG 3.07Å; H227-S230 VanDerWaalsContact O-CB 3.26Å; H227-S230 WeakPolarHBondContact O-CB 3.39Å; H227-S230 PolarHBondContact O-N 3.06Å; H227-S230 PolarHBondContact O-OG 2.92Å; Q228-S230 PolarHBondContact O-N 3.21Å; Q228-S230 VanDerWaalsContact O-N 3.17Å
231	H	72.2	Confident	75.3	Confident	30 Å²	30	63.9 Å²	63.9	14%	0.139	34%	0.343	C	S	.	.	H	α-helix	trans	-74.9	-40.4	178.2	-60.1	-64.1	0	0	0	113.1	K60 S65 E68 I213 C214 H227 Q228 R229 G233	K60-H231 PolarHBondContact NZ-CE1 2.98Å; K60-H231 PolarHBondContact NZ-ND1 3.39Å; K60-H231 PolarHBondContact NZ-NE2 3.35Å; S65-H231 PolarHBondContact OG-CE1 3.09Å; S65-H231 PolarHBondContact OG-ND1 3.28Å; S65-H231 VanDerWaalsContact OG-ND1 3.16Å; E68-H231 IonicContact OE2-CE1 3.35Å; I213-H231 HydrophobicContact CD1-CB 3.52Å; I213-H231 HydrophobicContact CG2-CB 4.41Å; C214-H231 WeakPolarHBondContact CB-CE1 3.31Å; C214-H231 WeakPolarHBondContact CB-NE2 3.41Å; C214-H231 PolarHBondContact SG-NE2 3.47Å; C214-H231 VanDerWaalsContact SG-NE2 3.44Å; H227-H231 AromaticContact CD2-NE2 3.96Å; H227-H231 AromaticContact CE1-NE2 3.46Å; H227-H231 PolarHBondContact CE1-NE2 2.99Å; H227-H231 AromaticContact NE2-CD2 3.77Å; H227-H231 AromaticContact NE2-NE2 3.05Å; H227-H231 PolarHBondContact NE2-NE2 3.31Å; Q228-H231 WeakPolarHBondContact O-CA 3.46Å; Q228-H231 WeakPolarHBondContact O-CB 3.36Å; Q228-H231 PolarHBondContact O-N 2.89Å; R229-H231 VanDerWaalsContact C-N 3.33Å; H231-G233 VanDerWaalsContact C-N 3.34Å
232	T	70.8	Confident	75.6	Confident	81 Å²	81	63.6 Å²	63.6	50%	0.497	35%	0.345	S	S	.	.	H	α-helix	trans	-82.5	-12.6	-177.9	61.4	0	0	0	0	113.5	Q228 R229 E234	Q228-T232 PolarHBondContact O-N 3.3Å; Q228-T232 VanDerWaalsContact O-N 3.1Å; R229-T232 WeakPolarHBondContact CA-OG1 3.5Å; T232-E234 PolarHBondContact O-N 3.48Å; T232-E234 WeakPolarHBondContact OG1-CG 3.42Å
233	G	69.3	Low	75.8	Confident	33 Å²	33	61.7 Å²	61.7	34%	0.34	34%	0.338	S	S	.	.			trans	69.6	7.4	-176.1	0	0	0	0	0	114	R229 H231 K235	R229-G233 WeakPolarHBondContact O-CA 3.42Å; R229-G233 PolarHBondContact O-N 2.81Å; H231-G233 VanDerWaalsContact C-N 3.34Å; G233-K235 PolarHBondContact O-N 3.08Å
234	E	73.9	Confident	75.8	Confident	108 Å²	108	64.4 Å²	64.4	51%	0.505	35%	0.345	S	S	.	.			trans	-60.5	127.2	179.1	-76.9	176.6	-169.2	0	0	111.2	R229 T232 P236	R229-E234 HydrophobicContact CB-CB 4.39Å; R229-E234 HydrophobicContact CG-CB 4.29Å; R229-E234 PolarHBondContact O-N 3.05Å; T232-E234 PolarHBondContact O-N 3.48Å; T232-E234 WeakPolarHBondContact OG1-CG 3.42Å; E234-P236 WeakPolarHBondContact O-CD 3.37Å
235	K	78.1	Confident	75.9	Confident	47 Å²	47	65.2 Å²	65.2	20%	0.204	35%	0.353	C	S	.	.			trans	-122.9	75	178.8	-70.8	170.7	172.1	-153.1	0	110.3	F56 G233 Y237 A245 F246 T247	F56-K235 PolarHBondContact O-NZ 2.89Å; G233-K235 PolarHBondContact O-N 3.08Å; K235-Y237 PolarHBondContact O-N 3.2Å; K235-Y237 VanDerWaalsContact O-N 3.14Å; K235-A245 HydrophobicContact CB-CB 3.54Å; K235-A245 HydrophobicContact CD-CB 4.25Å; K235-A245 WeakPolarHBondContact CD-O 3.19Å; K235-F246 CarbonylContact C-O 3.54Å; K235-F246 VanDerWaalsContact C-O 3.27Å; K235-F246 WeakPolarHBondContact CA-O 3.34Å; K235-T247 HydrophobicContact CG-CG2 3.82Å
236	P	80	Confident	76.1	Confident	71 Å²	71	63.9 Å²	63.9	46%	0.461	34%	0.342	S	S	.	.			trans	-67.6	-16.8	-170.6	-22.1	35.8	0	0	0	114.3	E234	E234-P236 WeakPolarHBondContact O-CD 3.37Å
237	Y	80.3	Confident	76.2	Confident	78 Å²	78	60.3 Å²	60.3	31%	0.306	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	95.1	-173.9	-55.5	-74.2	0	0	0	110.1	R229 K235 A245 F246 T247 S249	R229-Y237 VanDerWaalsContact NH1-CE2 3.3Å; R229-Y237 PolarHBondContact NH1-OH 3.06Å; K235-Y237 PolarHBondContact O-N 3.2Å; K235-Y237 VanDerWaalsContact O-N 3.14Å; Y237-A245 CarbonylContact O-C 3.27Å; Y237-A245 WeakPolarHBondContact O-CA 3.27Å; Y237-F246 PolarHBondContact N-O 3.02Å; Y237-F246 VanDerWaalsContact N-O 3.15Å; Y237-F246 PolarHBondContact O-N 3.37Å; Y237-T247 WeakPolarHBondContact CE2-O 3.14Å; Y237-S249 VanDerWaalsContact CE2-N 3.33Å
238	Q	80.1	Confident	76.2	Confident	128 Å²	128	62.5 Å²	62.5	60%	0.598	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	136.5	-179.6	-164.7	177.1	13.7	0	0	112.3	G240 G243 A245	Q238-G240 PolarHBondContact O-N 3.43Å; Q238-G243 WeakPolarHBondContact CG-O 3.17Å; Q238-G243 PolarHBondContact NE2-O 3.31Å; Q238-A245 HydrophobicContact CB-CB 4.41Å; Q238-A245 HydrophobicContact CG-CB 4.33Å
239	C	84	Confident	76.4	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.351	C	S	.	.			trans	-77.2	111.7	172.1	-175.6	0	0	0	0	110	R241 C242 G243 R244 F246 L252	C239-R241 PolarHBondContact O-N 3.24Å; C239-C242 PolarHBondContact O-N 2.82Å; C239-G243 WeakPolarHBondContact O-CA 3.5Å; C239-G243 PolarHBondContact O-N 3.49Å; C239-R244 WeakPolarHBondContact CB-O 3.36Å; C239-R244 PolarHBondContact N-O 3.43Å; C239-F246 HydrophobicContact CB-CE2 4.49Å; C239-L252 HydrophobicContact CB-CD1 3.58Å
240	G	77.6	Confident	76.2	Confident	85 Å²	85	63.2 Å²	63.2	88%	0.876	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-15.5	177.5	0	0	0	0	0	115.3	Q238	Q238-G240 PolarHBondContact O-N 3.43Å
241	R	76.3	Confident	76.6	Confident	182 Å²	182	64.6 Å²	64.6	69%	0.687	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-33.1	-179.2	-169	173.5	-176.1	178.1	-1.4	114.6	C239 H259	C239-R241 PolarHBondContact O-N 3.24Å; R241-H259 PolarHBondContact NH1-O 3.25Å
242	C	80.3	Confident	76.9	Confident	57 Å²	57	64.3 Å²	64.3	39%	0.385	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131	5.8	-175.7	71.9	0	0	0	0	113.9	C239 R244 H255 H259	C239-C242 PolarHBondContact O-N 2.82Å; C242-R244 PolarHBondContact O-N 2.94Å; C242-H255 PolarHBondContact SG-NE2 3.21Å; C242-H259 PolarHBondContact SG-NE2 3.49Å; C242-H259 VanDerWaalsContact SG-NE2 3.37Å
243	G	75.9	Confident	77.1	Confident	40 Å²	40	64.4 Å²	64.4	41%	0.412	37%	0.368	S	S	.	.			trans	70.5	-5.3	177.5	0	0	0	0	0	115.4	Q238 C239 A245	Q238-G243 WeakPolarHBondContact CG-O 3.17Å; Q238-G243 PolarHBondContact NE2-O 3.31Å; C239-G243 WeakPolarHBondContact O-CA 3.5Å; C239-G243 PolarHBondContact O-N 3.49Å; G243-A245 PolarHBondContact O-N 3.33Å
244	R	74.8	Confident	77.1	Confident	94 Å²	94	65.4 Å²	65.4	36%	0.355	37%	0.366	S	S	.	.			trans	-65.6	131.7	179.7	-75.5	-173.5	176.2	-171	-0.3	111.5	L54 C239 C242 F246	L54-R244 PolarHBondContact O-NH1 3.32Å; C239-R244 WeakPolarHBondContact CB-O 3.36Å; C239-R244 PolarHBondContact N-O 3.43Å; C242-R244 PolarHBondContact O-N 2.94Å; R244-F246 HydrophobicContact CB-CE2 3.95Å; R244-F246 HydrophobicContact CB-CZ 4.02Å; R244-F246 WeakPolarHBondContact O-CE2 3.37Å
245	A	78.9	Confident	77.3	Confident	25 Å²	25	60.8 Å²	60.8	21%	0.207	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	142.7	-178.4	0	0	0	0	0	111.8	K235 Y237 Q238 G243	K235-A245 HydrophobicContact CB-CB 3.54Å; K235-A245 HydrophobicContact CD-CB 4.25Å; K235-A245 WeakPolarHBondContact CD-O 3.19Å; Y237-A245 CarbonylContact O-C 3.27Å; Y237-A245 WeakPolarHBondContact O-CA 3.27Å; Q238-A245 HydrophobicContact CB-CB 4.41Å; Q238-A245 HydrophobicContact CG-CB 4.33Å; G243-A245 PolarHBondContact O-N 3.33Å
246	F	79.6	Confident	77.1	Confident	17 Å²	17	61.9 Å²	61.9	8%	0.075	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	146.4	-176.1	-58.3	-87.9	0	0	0	110.5	K235 Y237 C239 R244 H248 N251 L252 H255	K235-F246 CarbonylContact C-O 3.54Å; K235-F246 VanDerWaalsContact C-O 3.27Å; K235-F246 WeakPolarHBondContact CA-O 3.34Å; Y237-F246 PolarHBondContact N-O 3.02Å; Y237-F246 VanDerWaalsContact N-O 3.15Å; Y237-F246 PolarHBondContact O-N 3.37Å; C239-F246 HydrophobicContact CB-CE2 4.49Å; R244-F246 HydrophobicContact CB-CE2 3.95Å; R244-F246 HydrophobicContact CB-CZ 4.02Å; R244-F246 WeakPolarHBondContact O-CE2 3.37Å; F246-H248 VanDerWaalsContact C-N 3.31Å; F246-N251 HydrophobicContact CB-CB 4.16Å; F246-N251 HydrophobicContact CD1-CB 3.88Å; F246-N251 HydrophobicContact CG-CB 4.25Å; F246-L252 HydrophobicContact CB-CB 4.33Å; F246-L252 HydrophobicContact CD2-CB 3.79Å; F246-L252 HydrophobicContact CD2-CD1 3.68Å; F246-L252 HydrophobicContact CD2-CG 4.33Å; F246-L252 HydrophobicContact CE2-CD1 3.81Å; F246-L252 HydrophobicContact CG-CB 4.24Å; F246-H255 HydrophobicContact CE1-CB 3.97Å; F246-H255 HydrophobicContact CE2-CB 3.72Å; F246-H255 AromaticContact CE2-CD2 3.58Å; F246-H255 AromaticContact CE2-CG 3.55Å; F246-H255 HydrophobicContact CZ-CB 3.37Å; F246-H255 AromaticContact CZ-CD2 3.67Å; F246-H255 AromaticContact CZ-CG 3.19Å; F246-H255 AromaticContact CZ-ND1 3.51Å
247	T	74.5	Confident	76.9	Confident	37 Å²	37	60.4 Å²	60.4	23%	0.227	34%	0.337	C	S	.	.	S	Bend	trans	-71.6	-29.5	175.3	54.1	0	0	0	0	111.7	R229 K235 Y237	R229-T247 PolarHBondContact NH1-O 3.46Å; K235-T247 HydrophobicContact CG-CG2 3.82Å; Y237-T247 WeakPolarHBondContact CE2-O 3.14Å
248	H	76.3	Confident	76.3	Confident	64 Å²	64	62.6 Å²	62.6	30%	0.296	35%	0.352	S	S	.	.	S	Bend	trans	-120.4	140.4	-178.4	-58.9	178.7	0	0	0	111.6	R226 F246 S250 N251 L252	R226-H248 WeakPolarHBondContact CD-NE2 3.37Å; R226-H248 WeakPolarHBondContact CG-NE2 3.48Å; F246-H248 VanDerWaalsContact C-N 3.31Å; H248-S250 VanDerWaalsContact C-N 3.32Å; H248-S250 PolarHBondContact O-N 2.91Å; H248-N251 HydrophobicContact CB-CB 4.33Å; H248-N251 PolarHBondContact O-N 3.05Å; H248-L252 PolarHBondContact O-N 3.37Å
249	S	75.5	Confident	76	Confident	61 Å²	61	59 Å²	59	43%	0.427	34%	0.335	S	S	.	.	H	α-helix	trans	-63.5	-36.4	174.9	55.3	0	0	0	0	112.2	Y237 N251 L252 V253	Y237-S249 VanDerWaalsContact CE2-N 3.33Å; S249-N251 PolarHBondContact O-N 3.36Å; S249-L252 WeakPolarHBondContact O-CB 3.36Å; S249-L252 PolarHBondContact O-N 2.95Å; S249-L252 VanDerWaalsContact O-N 3.13Å; S249-V253 WeakPolarHBondContact O-CG2 3.5Å; S249-V253 PolarHBondContact O-N 3.48Å
250	S	74.1	Confident	75.3	Confident	68 Å²	68	63.4 Å²	63.4	48%	0.476	36%	0.363	S	S	.	.	H	α-helix	trans	-58.7	-35.2	175.2	59.8	0	0	0	0	112.7	H248 V253 L254	H248-S250 VanDerWaalsContact C-N 3.32Å; H248-S250 PolarHBondContact O-N 2.91Å; S250-V253 PolarHBondContact O-N 2.77Å; S250-L254 WeakPolarHBondContact O-CB 3.32Å; S250-L254 PolarHBondContact O-N 3.17Å
251	N	75.3	Confident	74.8	Confident	51 Å²	51	61.9 Å²	61.9	27%	0.273	35%	0.347	S	S	.	.	H	α-helix	trans	-75.6	-34.4	178.6	-65.4	-7	0	0	0	111.1	F246 H248 S249 H255	F246-N251 HydrophobicContact CB-CB 4.16Å; F246-N251 HydrophobicContact CD1-CB 3.88Å; F246-N251 HydrophobicContact CG-CB 4.25Å; H248-N251 HydrophobicContact CB-CB 4.33Å; H248-N251 PolarHBondContact O-N 3.05Å; S249-N251 PolarHBondContact O-N 3.36Å; N251-H255 WeakPolarHBondContact O-CB 3.41Å; N251-H255 PolarHBondContact O-N 2.89Å
252	L	78.9	Confident	74.6	Confident	23 Å²	23	57.3 Å²	57.3	12%	0.12	34%	0.336	C	S	.	.	H	α-helix	trans	-64.9	-43.1	170.5	175.9	61.7	0	0	0	111.3	C239 F246 H248 S249 H255 H256	C239-L252 HydrophobicContact CB-CD1 3.58Å; F246-L252 HydrophobicContact CB-CB 4.33Å; F246-L252 HydrophobicContact CD2-CB 3.79Å; F246-L252 HydrophobicContact CD2-CD1 3.68Å; F246-L252 HydrophobicContact CD2-CG 4.33Å; F246-L252 HydrophobicContact CE2-CD1 3.81Å; F246-L252 HydrophobicContact CG-CB 4.24Å; H248-L252 PolarHBondContact O-N 3.37Å; S249-L252 WeakPolarHBondContact O-CB 3.36Å; S249-L252 PolarHBondContact O-N 2.95Å; S249-L252 VanDerWaalsContact O-N 3.13Å; L252-H255 CarbonylContact O-C 3.39Å; L252-H255 WeakPolarHBondContact O-CA 3.2Å; L252-H255 WeakPolarHBondContact O-CB 3.46Å; L252-H255 PolarHBondContact O-N 3.24Å; L252-H255 VanDerWaalsContact O-N 3.14Å; L252-H256 PolarHBondContact O-CD2 2.82Å; L252-H256 PolarHBondContact O-N 3.31Å
253	V	75.2	Confident	74.4	Confident	84 Å²	84	59.7 Å²	59.7	51%	0.509	34%	0.34	S	S	.	.	H	α-helix	trans	-61.3	-46	174.9	173.5	0	0	0	0	111	S249 S250 H255 H256 H257	S249-V253 WeakPolarHBondContact O-CG2 3.5Å; S249-V253 PolarHBondContact O-N 3.48Å; S250-V253 PolarHBondContact O-N 2.77Å; V253-H255 VanDerWaalsContact C-N 3.26Å; V253-H255 PolarHBondContact O-N 3.07Å; V253-H256 WeakPolarHBondContact O-CB 3.14Å; V253-H256 PolarHBondContact O-N 3.46Å; V253-H256 VanDerWaalsContact O-N 3.16Å; V253-H257 PolarHBondContact O-N 2.96Å
254	L	70.5	Confident	74.4	Confident	53 Å²	53	61 Å²	61	28%	0.277	34%	0.341	S	S	.	.	H	α-helix	trans	-61.4	-36.3	173.2	178.1	61.8	0	0	0	112.1	S250 H257 G275 L276	S250-L254 WeakPolarHBondContact O-CB 3.32Å; S250-L254 PolarHBondContact O-N 3.17Å; L254-H257 VanDerWaalsContact O-CB 3.29Å; L254-H257 WeakPolarHBondContact O-CB 3.43Å; L254-H257 PolarHBondContact O-N 3.17Å; L254-G275 WeakPolarHBondContact CD1-O 3.49Å; L254-L276 HydrophobicContact CD1-CD1 4.47Å; L254-L276 HydrophobicContact CD1-CD2 3.86Å; L254-L276 HydrophobicContact CD1-CG 3.72Å; L254-L276 HydrophobicContact CD2-CD1 3.64Å; L254-L276 HydrophobicContact CD2-CD2 3.94Å; L254-L276 HydrophobicContact CD2-CG 3.79Å; L254-L276 HydrophobicContact CG-CD2 4.45Å; L254-L276 HydrophobicContact CG-CG 4.41Å
255	H	76.1	Confident	74.6	Confident	12 Å²	12	60.1 Å²	60.1	6%	0.056	34%	0.34	C	S	.	.	H	α-helix	trans	-68.9	-35.2	175.9	175	74.7	0	0	0	112.2	C242 F246 N251 L252 V253 H257 I258 H259	C242-H255 PolarHBondContact SG-NE2 3.21Å; F246-H255 HydrophobicContact CE1-CB 3.97Å; F246-H255 HydrophobicContact CE2-CB 3.72Å; F246-H255 AromaticContact CE2-CD2 3.58Å; F246-H255 AromaticContact CE2-CG 3.55Å; F246-H255 HydrophobicContact CZ-CB 3.37Å; F246-H255 AromaticContact CZ-CD2 3.67Å; F246-H255 AromaticContact CZ-CG 3.19Å; F246-H255 AromaticContact CZ-ND1 3.51Å; N251-H255 WeakPolarHBondContact O-CB 3.41Å; N251-H255 PolarHBondContact O-N 2.89Å; L252-H255 CarbonylContact O-C 3.39Å; L252-H255 WeakPolarHBondContact O-CA 3.2Å; L252-H255 WeakPolarHBondContact O-CB 3.46Å; L252-H255 PolarHBondContact O-N 3.24Å; L252-H255 VanDerWaalsContact O-N 3.14Å; V253-H255 VanDerWaalsContact C-N 3.26Å; V253-H255 PolarHBondContact O-N 3.07Å; H255-H257 PolarHBondContact O-N 3.09Å; H255-I258 VanDerWaalsContact O-CB 3.25Å; H255-I258 WeakPolarHBondContact O-CB 3.44Å; H255-I258 PolarHBondContact O-N 3.25Å; H255-H259 AromaticContact CD2-CD2 3.96Å; H255-H259 AromaticContact CD2-NE2 3.76Å; H255-H259 AromaticContact CE1-NE2 3.6Å; H255-H259 AromaticContact NE2-CD2 3.61Å; H255-H259 AromaticContact NE2-NE2 2.95Å; H255-H259 PolarHBondContact NE2-NE2 3.33Å
256	H	73.9	Confident	74.7	Confident	70 Å²	70	64.7 Å²	64.7	32%	0.324	36%	0.355	S	S	.	.	H	α-helix	trans	-61.3	-25.7	173.4	-79.7	-67.4	0	0	0	113.2	L252 V253 I258 H259 T260	L252-H256 PolarHBondContact O-CD2 2.82Å; L252-H256 PolarHBondContact O-N 3.31Å; V253-H256 WeakPolarHBondContact O-CB 3.14Å; V253-H256 PolarHBondContact O-N 3.46Å; V253-H256 VanDerWaalsContact O-N 3.16Å; H256-I258 PolarHBondContact O-N 2.84Å; H256-H259 PolarHBondContact O-N 3.25Å; H256-H259 VanDerWaalsContact O-N 3.16Å; H256-T260 WeakPolarHBondContact O-CG2 3.46Å; H256-T260 PolarHBondContact O-N 2.76Å; H256-T260 PolarHBondContact O-OG1 2.69Å
257	H	76.9	Confident	75	Confident	40 Å²	40	63.9 Å²	63.9	19%	0.185	35%	0.352	C	S	.	.	H	α-helix	trans	-62.5	-24.1	171.2	-66	-31.4	0	0	0	113.5	V253 L254 H255 T260 G261 N262	V253-H257 PolarHBondContact O-N 2.96Å; L254-H257 VanDerWaalsContact O-CB 3.29Å; L254-H257 WeakPolarHBondContact O-CB 3.43Å; L254-H257 PolarHBondContact O-N 3.17Å; H255-H257 PolarHBondContact O-N 3.09Å; H257-T260 WeakPolarHBondContact CA-OG1 3.38Å; H257-G261 CarbonylContact O-C 3.57Å; H257-G261 WeakPolarHBondContact O-CA 3.25Å; H257-G261 PolarHBondContact O-N 3.36Å; H257-N262 WeakPolarHBondContact CB-O 3.4Å; H257-N262 VanDerWaalsContact CG-O 3.25Å; H257-N262 PolarHBondContact ND1-O 2.85Å; H257-N262 PolarHBondContact O-N 3.03Å
258	I	68.3	Low	75.4	Confident	123 Å²	123	67.9 Å²	67.9	63%	0.631	37%	0.372	S	S	*	.	H	α-helix	trans	-71.2	-40.9	174.3	-57.6	171.8	0	0	0	110.4	H255 H256	H255-I258 VanDerWaalsContact O-CB 3.25Å; H255-I258 WeakPolarHBondContact O-CB 3.44Å; H255-I258 PolarHBondContact O-N 3.25Å; H256-I258 PolarHBondContact O-N 2.84Å
259	H	72.5	Confident	75.6	Confident	52 Å²	52	70.1 Å²	70.1	24%	0.241	38%	0.382	C	S	.	.	H	α-helix	trans	-77.5	-31.5	-179	-68.1	-56.6	0	0	0	114	R241 C242 H255 H256	R241-H259 PolarHBondContact NH1-O 3.25Å; C242-H259 PolarHBondContact SG-NE2 3.49Å; C242-H259 VanDerWaalsContact SG-NE2 3.37Å; H255-H259 AromaticContact CD2-CD2 3.96Å; H255-H259 AromaticContact CD2-NE2 3.76Å; H255-H259 AromaticContact CE1-NE2 3.6Å; H255-H259 AromaticContact NE2-CD2 3.61Å; H255-H259 AromaticContact NE2-NE2 2.95Å; H255-H259 PolarHBondContact NE2-NE2 3.33Å; H256-H259 PolarHBondContact O-N 3.25Å; H256-H259 VanDerWaalsContact O-N 3.16Å
260	T	69.8	Low	75.9	Confident	94 Å²	94	69.8 Å²	69.8	58%	0.577	38%	0.379	S	S	*	.	H	α-helix	trans	-94.4	-9.4	-178.1	53.8	0	0	0	0	112.4	H256 H257 N262	H256-T260 WeakPolarHBondContact O-CG2 3.46Å; H256-T260 PolarHBondContact O-N 2.76Å; H256-T260 PolarHBondContact O-OG1 2.69Å; H257-T260 WeakPolarHBondContact CA-OG1 3.38Å; T260-N262 PolarHBondContact O-N 3.41Å
261	G	67.6	Low	76	Confident	53 Å²	53	68.3 Å²	68.3	55%	0.546	38%	0.375	S	S	.	.			trans	64.3	2.3	-172.8	0	0	0	0	0	113.9	H257 K263	H257-G261 CarbonylContact O-C 3.57Å; H257-G261 WeakPolarHBondContact O-CA 3.25Å; H257-G261 PolarHBondContact O-N 3.36Å; G261-K263 PolarHBondContact O-N 3.36Å; G261-K263 VanDerWaalsContact O-N 3.1Å
262	N	71.2	Confident	76	Confident	86 Å²	86	71.8 Å²	71.8	46%	0.46	39%	0.387	S	S	.	.			trans	-71.8	106.4	-176.5	-172	0.9	0	0	0	109.3	H257 T260 P264	H257-N262 WeakPolarHBondContact CB-O 3.4Å; H257-N262 VanDerWaalsContact CG-O 3.25Å; H257-N262 PolarHBondContact ND1-O 2.85Å; H257-N262 PolarHBondContact O-N 3.03Å; T260-N262 PolarHBondContact O-N 3.41Å; N262-P264 WeakPolarHBondContact O-CD 3.46Å
263	K	75.9	Confident	76	Confident	107 Å²	107	73.5 Å²	73.5	47%	0.465	40%	0.399	S	S	.	.			trans	-116.9	87.4	177.2	-70.3	-180	-177.7	179.1	0	107.5	G261 F265 T273 F274	G261-K263 PolarHBondContact O-N 3.36Å; G261-K263 VanDerWaalsContact O-N 3.1Å; K263-F265 PolarHBondContact O-N 2.9Å; K263-F265 VanDerWaalsContact O-N 3.12Å; K263-T273 VanDerWaalsContact CB-CB 3.46Å; K263-T273 WeakPolarHBondContact CB-OG1 3.41Å; K263-T273 WeakPolarHBondContact CD-O 3.49Å; K263-T273 VanDerWaalsContact CD-OG1 3.28Å; K263-T273 WeakPolarHBondContact CD-OG1 3.14Å; K263-F274 CarbonylContact C-O 3.52Å
264	P	75.7	Confident	76.2	Confident	68 Å²	68	71.5 Å²	71.5	44%	0.442	38%	0.384	S	S	.	.			trans	-63.9	-24.8	-165.1	-21.9	32.9	0	0	0	113.4	N262 K266	N262-P264 WeakPolarHBondContact O-CD 3.46Å; P264-K266 PolarHBondContact O-N 3.41Å
265	F	80.2	Confident	76.4	Confident	75 Å²	75	69.9 Å²	69.9	33%	0.329	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	98.5	-172.4	-55.6	-73.4	0	0	0	110.2	K263 T273 F274 L276 N277 L280	K263-F265 PolarHBondContact O-N 2.9Å; K263-F265 VanDerWaalsContact O-N 3.12Å; F265-T273 CarbonylContact O-C 3.55Å; F265-T273 WeakPolarHBondContact O-CA 3.33Å; F265-F274 HydrophobicContact CB-CB 4.39Å; F265-F274 PolarHBondContact N-O 3.46Å; F265-F274 PolarHBondContact O-N 3.28Å; F265-L276 VanDerWaalsContact CD2-C 3.45Å; F265-N277 HydrophobicContact CD1-CB 3.71Å; F265-N277 HydrophobicContact CD2-CB 4.31Å; F265-N277 VanDerWaalsContact CD2-N 3.31Å; F265-N277 HydrophobicContact CE1-CB 3.66Å; F265-N277 HydrophobicContact CE2-CB 4.25Å; F265-N277 HydrophobicContact CG-CB 4.05Å; F265-N277 HydrophobicContact CZ-CB 3.93Å; F265-L280 HydrophobicContact CB-CB 4.11Å; F265-L280 HydrophobicContact CB-CD2 3.82Å
266	K	79.8	Confident	76.5	Confident	121 Å²	121	72 Å²	72	53%	0.526	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	139.8	177.1	-173.7	179.1	174.3	-171.3	0	111.2	P264 T273 L280	P264-K266 PolarHBondContact O-N 3.41Å; K266-T273 HydrophobicContact CB-CG2 4.01Å; K266-T273 HydrophobicContact CG-CG2 3.98Å; K266-L280 WeakPolarHBondContact O-CD2 3.48Å
267	C	86.4	Confident	76.6	Confident	0 Å²	0	73 Å²	73	0%	0	40%	0.399	C	S	.	.			trans	-83.6	121.3	166.6	179	0	0	0	0	109.3	E269 G271 K272 F274 L280 H287	C267-E269 VanDerWaalsContact C-N 3.28Å; C267-E269 PolarHBondContact O-N 2.76Å; C267-G271 WeakPolarHBondContact O-CA 3.27Å; C267-G271 PolarHBondContact O-N 3.29Å; C267-K272 WeakPolarHBondContact CB-O 3.5Å; C267-K272 PolarHBondContact N-O 3.42Å; C267-F274 HydrophobicContact CB-CE2 4.3Å; C267-L280 HydrophobicContact CB-CD1 3.53Å; C267-H287 PolarHBondContact SG-NE2 3.46Å; C267-H287 VanDerWaalsContact SG-NE2 3.36Å
268	D	83.5	Confident	76.7	Confident	121 Å²	121	74.6 Å²	74.6	65%	0.647	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-27.8	-177.3	-51.6	-50.9	0	0	0	112.5	R284	D268-R284 IonicContact OD2-CZ 3.37Å; D268-R284 IonicContact OD2-NH1 3.88Å; D268-R284 IonicContact OD2-NH2 2.99Å; D268-R284 PolarHBondContact OD2-NH2 3.41Å
269	E	80.3	Confident	77.3	Confident	111 Å²	111	73.4 Å²	73.4	52%	0.519	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-30.6	-174.5	-65.7	164.8	-124.7	0	0	113.6	C267 R284 H287	C267-E269 VanDerWaalsContact C-N 3.28Å; C267-E269 PolarHBondContact O-N 2.76Å; E269-R284 IonicContact OE1-NH1 2.97Å; E269-R284 PolarHBondContact OE1-NH1 3.18Å; E269-H287 WeakPolarHBondContact OE2-CB 3.26Å; E269-H287 IonicContact OE2-CD2 3.39Å; E269-H287 PolarHBondContact OE2-CD2 2.85Å; E269-H287 VanDerWaalsContact OE2-CD2 3.31Å; E269-H287 IonicContact OE2-CG 2.63Å
270	C	81.3	Confident	77.7	Confident	53 Å²	53	71.4 Å²	71.4	36%	0.358	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.4	4.3	-178.7	75.2	0	0	0	0	114.6	K272 H283	C270-K272 PolarHBondContact O-N 3.27Å; C270-K272 VanDerWaalsContact SG-CG 3.58Å; C270-H283 PolarHBondContact SG-NE2 3.35Å
271	G	77.2	Confident	78.3	Confident	37 Å²	37	75.3 Å²	75.3	38%	0.381	40%	0.401	S	S	.	.			trans	70.2	-3.2	178	0	0	0	0	0	115.8	C267	C267-G271 WeakPolarHBondContact O-CA 3.27Å; C267-G271 PolarHBondContact O-N 3.29Å
272	K	75.4	Confident	79	Confident	124 Å²	124	74.7 Å²	74.7	54%	0.539	39%	0.385	S	S	.	.			trans	-65.9	136.3	-179.1	-71.2	178.4	-176.6	173.8	0	111.3	C267 C270 F274	C267-K272 WeakPolarHBondContact CB-O 3.5Å; C267-K272 PolarHBondContact N-O 3.42Å; C270-K272 PolarHBondContact O-N 3.27Å; C270-K272 VanDerWaalsContact SG-CG 3.58Å; K272-F274 HydrophobicContact CB-CE2 3.85Å; K272-F274 HydrophobicContact CB-CZ 3.94Å; K272-F274 WeakPolarHBondContact O-CE2 3.46Å
273	T	77.9	Confident	79.6	Confident	59 Å²	59	71.3 Å²	71.3	36%	0.362	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	145.2	-178.8	57.2	0	0	0	0	111.6	K263 F265 K266	K263-T273 VanDerWaalsContact CB-CB 3.46Å; K263-T273 WeakPolarHBondContact CB-OG1 3.41Å; K263-T273 WeakPolarHBondContact CD-O 3.49Å; K263-T273 VanDerWaalsContact CD-OG1 3.28Å; K263-T273 WeakPolarHBondContact CD-OG1 3.14Å; F265-T273 CarbonylContact O-C 3.55Å; F265-T273 WeakPolarHBondContact O-CA 3.33Å; K266-T273 HydrophobicContact CB-CG2 4.01Å; K266-T273 HydrophobicContact CG-CG2 3.98Å
274	F	79	Confident	79.9	Confident	43 Å²	43	69.7 Å²	69.7	19%	0.189	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.2	-175.6	-57.9	-88.8	0	0	0	110.4	K263 F265 C267 K272 L276 H279 L280 H283	K263-F274 CarbonylContact C-O 3.52Å; F265-F274 HydrophobicContact CB-CB 4.39Å; F265-F274 PolarHBondContact N-O 3.46Å; F265-F274 PolarHBondContact O-N 3.28Å; C267-F274 HydrophobicContact CB-CE2 4.3Å; K272-F274 HydrophobicContact CB-CE2 3.85Å; K272-F274 HydrophobicContact CB-CZ 3.94Å; K272-F274 WeakPolarHBondContact O-CE2 3.46Å; F274-L276 VanDerWaalsContact C-N 3.31Å; F274-H279 HydrophobicContact CB-CB 4.29Å; F274-H279 HydrophobicContact CD1-CB 3.98Å; F274-H279 HydrophobicContact CG-CB 4.4Å; F274-L280 HydrophobicContact CB-CB 4.29Å; F274-L280 HydrophobicContact CD2-CB 3.82Å; F274-L280 HydrophobicContact CD2-CD1 3.7Å; F274-L280 HydrophobicContact CD2-CG 4.35Å; F274-L280 HydrophobicContact CE2-CD1 3.81Å; F274-L280 HydrophobicContact CG-CB 4.2Å; F274-H283 HydrophobicContact CE1-CB 3.93Å; F274-H283 HydrophobicContact CE2-CB 3.93Å; F274-H283 AromaticContact CE2-CD2 3.48Å; F274-H283 VanDerWaalsContact CE2-CD2 3.48Å; F274-H283 WeakPolarHBondContact CE2-CD2 3.45Å; F274-H283 AromaticContact CE2-CG 3.68Å; F274-H283 HydrophobicContact CZ-CB 3.45Å; F274-H283 VanDerWaalsContact CZ-CB 3.45Å; F274-H283 AromaticContact CZ-CD2 3.46Å; F274-H283 VanDerWaalsContact CZ-CD2 3.46Å; F274-H283 WeakPolarHBondContact CZ-CD2 3.36Å; F274-H283 AromaticContact CZ-CG 3.19Å; F274-H283 AromaticContact CZ-ND1 3.69Å
275	G	74.5	Confident	80.4	Confident	18 Å²	18	68.9 Å²	68.9	19%	0.186	35%	0.345	C	S	.	.	S	Bend	trans	-77.2	-16.2	175	0	0	0	0	0	113.8	L254	L254-G275 WeakPolarHBondContact CD1-O 3.49Å
276	L	78.4	Confident	80.5	Confident	58 Å²	58	71 Å²	71	30%	0.304	36%	0.359	S	S	.	.	S	Bend	trans	-131.4	138.9	178.3	-70.9	175.4	0	0	0	111	L254 F265 F274 S278 H279 L280	L254-L276 HydrophobicContact CD1-CD1 4.47Å; L254-L276 HydrophobicContact CD1-CD2 3.86Å; L254-L276 HydrophobicContact CD1-CG 3.72Å; L254-L276 HydrophobicContact CD2-CD1 3.64Å; L254-L276 HydrophobicContact CD2-CD2 3.94Å; L254-L276 HydrophobicContact CD2-CG 3.79Å; L254-L276 HydrophobicContact CG-CD2 4.45Å; L254-L276 HydrophobicContact CG-CG 4.41Å; F265-L276 VanDerWaalsContact CD2-C 3.45Å; F274-L276 VanDerWaalsContact C-N 3.31Å; L276-S278 VanDerWaalsContact C-N 3.29Å; L276-S278 PolarHBondContact O-N 2.83Å; L276-H279 HydrophobicContact CB-CB 4.44Å; L276-H279 WeakPolarHBondContact O-CB 3.34Å; L276-H279 PolarHBondContact O-N 3.37Å; L276-L280 PolarHBondContact O-N 3.1Å
277	N	77.6	Confident	80.6	Confident	91 Å²	91	68.6 Å²	68.6	49%	0.487	35%	0.349	S	S	.	.	H	α-helix	trans	-63.8	-33.9	176.2	-167.2	38.5	0	0	0	112.5	F265 H279 L280 R281	F265-N277 HydrophobicContact CD1-CB 3.71Å; F265-N277 HydrophobicContact CD2-CB 4.31Å; F265-N277 VanDerWaalsContact CD2-N 3.31Å; F265-N277 HydrophobicContact CE1-CB 3.66Å; F265-N277 HydrophobicContact CE2-CB 4.25Å; F265-N277 HydrophobicContact CG-CB 4.05Å; F265-N277 HydrophobicContact CZ-CB 3.93Å; N277-H279 VanDerWaalsContact C-N 3.26Å; N277-H279 PolarHBondContact O-N 2.84Å; N277-L280 PolarHBondContact O-N 2.88Å; N277-R281 PolarHBondContact O-N 2.99Å
278	S	78.8	Confident	80.4	Confident	73 Å²	73	72.3 Å²	72.3	51%	0.51	37%	0.372	S	S	.	.	H	α-helix	trans	-59.5	-37.8	175.3	55.9	0	0	0	0	112.2	L276 L282	L276-S278 VanDerWaalsContact C-N 3.29Å; L276-S278 PolarHBondContact O-N 2.83Å; S278-L282 WeakPolarHBondContact O-CB 3.39Å; S278-L282 PolarHBondContact O-N 3.28Å
279	H	80.6	Confident	80.3	Confident	98 Å²	98	68.7 Å²	68.7	45%	0.454	36%	0.363	S	S	.	.	H	α-helix	trans	-71.3	-38.8	175.7	-64.4	171.8	0	0	0	112	F274 L276 N277 L282 H283	F274-H279 HydrophobicContact CB-CB 4.29Å; F274-H279 HydrophobicContact CD1-CB 3.98Å; F274-H279 HydrophobicContact CG-CB 4.4Å; L276-H279 HydrophobicContact CB-CB 4.44Å; L276-H279 WeakPolarHBondContact O-CB 3.34Å; L276-H279 PolarHBondContact O-N 3.37Å; N277-H279 VanDerWaalsContact C-N 3.26Å; N277-H279 PolarHBondContact O-N 2.84Å; H279-L282 PolarHBondContact O-N 3.11Å; H279-H283 VanDerWaalsContact O-CB 3.25Å; H279-H283 WeakPolarHBondContact O-CB 3.4Å; H279-H283 PolarHBondContact O-N 3.18Å
280	L	81.6	Confident	80.5	Confident	10 Å²	10	68.4 Å²	68.4	5%	0.052	36%	0.362	C	S	.	.	H	α-helix	trans	-62	-45.9	172.3	173.1	61.2	0	0	0	111.2	F265 K266 C267 F274 L276 N277 L282 H283 R284	F265-L280 HydrophobicContact CB-CB 4.11Å; F265-L280 HydrophobicContact CB-CD2 3.82Å; K266-L280 WeakPolarHBondContact O-CD2 3.48Å; C267-L280 HydrophobicContact CB-CD1 3.53Å; F274-L280 HydrophobicContact CB-CB 4.29Å; F274-L280 HydrophobicContact CD2-CB 3.82Å; F274-L280 HydrophobicContact CD2-CD1 3.7Å; F274-L280 HydrophobicContact CD2-CG 4.35Å; F274-L280 HydrophobicContact CE2-CD1 3.81Å; F274-L280 HydrophobicContact CG-CB 4.2Å; L276-L280 PolarHBondContact O-N 3.1Å; N277-L280 PolarHBondContact O-N 2.88Å; L280-L282 VanDerWaalsContact C-N 3.34Å; L280-L282 PolarHBondContact O-N 3.22Å; L280-H283 CarbonylContact O-C 3.52Å; L280-H283 WeakPolarHBondContact O-CB 3.16Å; L280-H283 PolarHBondContact O-N 2.81Å; L280-H283 VanDerWaalsContact O-N 3.11Å; L280-R284 HydrophobicContact CD1-CG 4.32Å; L280-R284 WeakPolarHBondContact O-CG 3.38Å; L280-R284 PolarHBondContact O-N 3.04Å
281	R	81.6	Confident	80.7	Confident	175 Å²	175	72 Å²	72	66%	0.66	37%	0.371	S	S	*	.	H	α-helix	trans	-60.6	-42.9	177.3	-177.7	177.2	163.1	-179.2	-5.5	111.8	N277 H283 R284	N277-R281 PolarHBondContact O-N 2.99Å; R281-H283 VanDerWaalsContact C-N 3.33Å; R281-R284 PolarHBondContact O-N 3.06Å
282	L	82.1	Confident	81.1	Confident	40 Å²	40	73.8 Å²	73.8	21%	0.209	38%	0.376	C	S	.	.	H	α-helix	trans	-64	-40.2	173.6	177.5	63	0	0	0	111.7	S278 H279 L280 R285 R304	S278-L282 WeakPolarHBondContact O-CB 3.39Å; S278-L282 PolarHBondContact O-N 3.28Å; H279-L282 PolarHBondContact O-N 3.11Å; L280-L282 VanDerWaalsContact C-N 3.34Å; L280-L282 PolarHBondContact O-N 3.22Å; L282-R285 WeakPolarHBondContact O-CB 3.46Å; L282-R285 PolarHBondContact O-N 2.88Å; L282-R304 HydrophobicContact CD1-CG 3.71Å; L282-R304 HydrophobicContact CD2-CG 4.29Å; L282-R304 VanDerWaalsContact CD2-CZ 3.5Å
283	H	83.6	Confident	81.6	Confident	16 Å²	16	71 Å²	71	7%	0.074	36%	0.364	C	S	.	.	H	α-helix	trans	-64.6	-38.7	177.7	170.6	68.7	0	0	0	112.7	C270 F274 H279 L280 R281 R285 I286 H287	C270-H283 PolarHBondContact SG-NE2 3.35Å; F274-H283 HydrophobicContact CE1-CB 3.93Å; F274-H283 HydrophobicContact CE2-CB 3.93Å; F274-H283 AromaticContact CE2-CD2 3.48Å; F274-H283 VanDerWaalsContact CE2-CD2 3.48Å; F274-H283 WeakPolarHBondContact CE2-CD2 3.45Å; F274-H283 AromaticContact CE2-CG 3.68Å; F274-H283 HydrophobicContact CZ-CB 3.45Å; F274-H283 VanDerWaalsContact CZ-CB 3.45Å; F274-H283 AromaticContact CZ-CD2 3.46Å; F274-H283 VanDerWaalsContact CZ-CD2 3.46Å; F274-H283 WeakPolarHBondContact CZ-CD2 3.36Å; F274-H283 AromaticContact CZ-CG 3.19Å; F274-H283 AromaticContact CZ-ND1 3.69Å; H279-H283 VanDerWaalsContact O-CB 3.25Å; H279-H283 WeakPolarHBondContact O-CB 3.4Å; H279-H283 PolarHBondContact O-N 3.18Å; L280-H283 CarbonylContact O-C 3.52Å; L280-H283 WeakPolarHBondContact O-CB 3.16Å; L280-H283 PolarHBondContact O-N 2.81Å; L280-H283 VanDerWaalsContact O-N 3.11Å; R281-H283 VanDerWaalsContact C-N 3.33Å; H283-R285 PolarHBondContact O-N 3.2Å; H283-R285 VanDerWaalsContact O-N 3.16Å; H283-I286 VanDerWaalsContact O-CB 3.26Å; H283-I286 WeakPolarHBondContact O-CB 3.47Å; H283-I286 WeakPolarHBondContact O-CG1 3.48Å; H283-I286 PolarHBondContact O-N 2.89Å; H283-H287 AromaticContact CE1-NE2 3.84Å; H283-H287 AromaticContact NE2-CE1 3.97Å; H283-H287 AromaticContact NE2-NE2 3.24Å; H283-H287 PolarHBondContact NE2-NE2 3.37Å
284	R	83.5	Confident	81.9	Confident	73 Å²	73	70.2 Å²	70.2	28%	0.275	37%	0.368	S	S	.	.	H	α-helix	trans	-57.6	-27.8	177	-76.5	-173.8	-179.2	-94	6.4	113.1	D268 E269 L280 R281 I286 H287 T288	D268-R284 IonicContact OD2-CZ 3.37Å; D268-R284 IonicContact OD2-NH1 3.88Å; D268-R284 IonicContact OD2-NH2 2.99Å; D268-R284 PolarHBondContact OD2-NH2 3.41Å; E269-R284 IonicContact OE1-NH1 2.97Å; E269-R284 PolarHBondContact OE1-NH1 3.18Å; L280-R284 HydrophobicContact CD1-CG 4.32Å; L280-R284 WeakPolarHBondContact O-CG 3.38Å; L280-R284 PolarHBondContact O-N 3.04Å; R281-R284 PolarHBondContact O-N 3.06Å; R284-I286 PolarHBondContact O-N 3.3Å; R284-I286 VanDerWaalsContact O-N 3.1Å; R284-H287 PolarHBondContact O-N 3.07Å; R284-T288 PolarHBondContact O-N 3.32Å; R284-T288 PolarHBondContact O-OG1 3.27Å
285	R	85.7	Confident	82.5	Confident	50 Å²	50	68.3 Å²	68.3	19%	0.189	36%	0.36	C	S	.	.	H	α-helix	trans	-60	-20.1	173.5	-60.6	-173.4	-178	153.7	2.3	114	L282 H283 H287 T288 G289 E290 S303	L282-R285 WeakPolarHBondContact O-CB 3.46Å; L282-R285 PolarHBondContact O-N 2.88Å; H283-R285 PolarHBondContact O-N 3.2Å; H283-R285 VanDerWaalsContact O-N 3.16Å; R285-H287 VanDerWaalsContact C-N 3.33Å; R285-T288 WeakPolarHBondContact CA-OG1 3.27Å; R285-G289 WeakPolarHBondContact O-CA 3.4Å; R285-G289 PolarHBondContact O-N 2.89Å; R285-E290 HydrophobicContact CB-CB 4.31Å; R285-E290 HydrophobicContact CG-CB 4.15Å; R285-E290 PolarHBondContact O-N 3.02Å; R285-S303 PolarHBondContact NH1-O 3.44Å
286	I	81.6	Confident	82.9	Confident	120 Å²	120	71.2 Å²	71.2	62%	0.615	39%	0.39	S	S	*	.	H	α-helix	trans	-68.7	-37.1	174.4	-60.3	176.9	0	0	0	110.4	H283 R284	H283-I286 VanDerWaalsContact O-CB 3.26Å; H283-I286 WeakPolarHBondContact O-CB 3.47Å; H283-I286 WeakPolarHBondContact O-CG1 3.48Å; H283-I286 PolarHBondContact O-N 2.89Å; R284-I286 PolarHBondContact O-N 3.3Å; R284-I286 VanDerWaalsContact O-N 3.1Å
287	H	83.1	Confident	83.2	Confident	70 Å²	70	74.1 Å²	74.1	32%	0.324	40%	0.402	S	S	.	.	H	α-helix	trans	-86.3	-41	-178.1	-51.3	-52.1	0	0	0	112.2	C267 E269 H283 R284 R285 G289	C267-H287 PolarHBondContact SG-NE2 3.46Å; C267-H287 VanDerWaalsContact SG-NE2 3.36Å; E269-H287 WeakPolarHBondContact OE2-CB 3.26Å; E269-H287 IonicContact OE2-CD2 3.39Å; E269-H287 PolarHBondContact OE2-CD2 2.85Å; E269-H287 VanDerWaalsContact OE2-CD2 3.31Å; E269-H287 IonicContact OE2-CG 2.63Å; H283-H287 AromaticContact CE1-NE2 3.84Å; H283-H287 AromaticContact NE2-CE1 3.97Å; H283-H287 AromaticContact NE2-NE2 3.24Å; H283-H287 PolarHBondContact NE2-NE2 3.37Å; R284-H287 PolarHBondContact O-N 3.07Å; R285-H287 VanDerWaalsContact C-N 3.33Å; H287-G289 PolarHBondContact O-N 3.48Å
288	T	82.1	Confident	83.6	Confident	79 Å²	79	72.2 Å²	72.2	49%	0.485	40%	0.396	S	S	.	.	H	α-helix	trans	-74.5	-14.7	176.9	63.8	0	0	0	0	113	R284 R285 E290	R284-T288 PolarHBondContact O-N 3.32Å; R284-T288 PolarHBondContact O-OG1 3.27Å; R285-T288 WeakPolarHBondContact CA-OG1 3.27Å; T288-E290 PolarHBondContact O-N 3.11Å; T288-E290 WeakPolarHBondContact OG1-CG 3.2Å; T288-E290 PolarHBondContact OG1-N 3.08Å
289	G	81.4	Confident	83.7	Confident	44 Å²	44	72 Å²	72	45%	0.454	40%	0.404	S	S	.	.			trans	70	5.9	-175.9	0	0	0	0	0	114.1	R285 H287 K291	R285-G289 WeakPolarHBondContact O-CA 3.4Å; R285-G289 PolarHBondContact O-N 2.89Å; H287-G289 PolarHBondContact O-N 3.48Å; G289-K291 PolarHBondContact O-N 2.95Å
290	E	82.6	Confident	83.9	Confident	106 Å²	106	73.2 Å²	73.2	50%	0.495	41%	0.408	S	S	.	.			trans	-57.4	119.9	-179.5	-80.1	176.7	-157.4	0	0	111.6	R285 T288	R285-E290 HydrophobicContact CB-CB 4.31Å; R285-E290 HydrophobicContact CG-CB 4.15Å; R285-E290 PolarHBondContact O-N 3.02Å; T288-E290 PolarHBondContact O-N 3.11Å; T288-E290 WeakPolarHBondContact OG1-CG 3.2Å; T288-E290 PolarHBondContact OG1-N 3.08Å
291	K	85.9	Confident	84.2	Confident	127 Å²	127	74.5 Å²	74.5	55%	0.552	42%	0.42	S	S	*	.			trans	-126.8	77.4	177.7	-73.2	163.9	172.4	-173.6	0	109.7	G289 F293 A301 F302	G289-K291 PolarHBondContact O-N 2.95Å; K291-F293 PolarHBondContact O-N 3.44Å; K291-F293 VanDerWaalsContact O-N 3.09Å; K291-A301 HydrophobicContact CB-CB 3.54Å; K291-A301 HydrophobicContact CD-CB 4.31Å; K291-A301 WeakPolarHBondContact CD-O 3.49Å; K291-F302 CarbonylContact C-O 3.54Å; K291-F302 VanDerWaalsContact C-O 3.25Å; K291-F302 VanDerWaalsContact CA-O 3.3Å; K291-F302 WeakPolarHBondContact CA-O 3.34Å
292	P	85.8	Confident	84.4	Confident	75 Å²	75	68.3 Å²	68.3	49%	0.487	40%	0.398	S	S	.	.			trans	-64.9	-16.7	-172.6	-22.1	34.6	0	0	0	114.2
293	F	87	Confident	84.5	Confident	66 Å²	66	68.5 Å²	68.5	29%	0.289	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	91.5	-171.3	-55.7	-76.7	0	0	0	110.7	K291 A301 F302 L308	K291-F293 PolarHBondContact O-N 3.44Å; K291-F293 VanDerWaalsContact O-N 3.09Å; F293-A301 CarbonylContact O-C 3.59Å; F293-A301 WeakPolarHBondContact O-CA 3.37Å; F293-F302 HydrophobicContact CB-CB 4.47Å; F293-F302 WeakPolarHBondContact CB-O 2.92Å; F293-F302 WeakPolarHBondContact CD2-O 3.44Å; F293-F302 PolarHBondContact N-O 2.87Å; F293-F302 VanDerWaalsContact N-O 3.11Å; F293-F302 PolarHBondContact O-N 3.15Å; F293-L308 HydrophobicContact CB-CB 4.09Å; F293-L308 HydrophobicContact CB-CD2 3.82Å
294	G	84.3	Confident	84.5	Confident	43 Å²	43	73.3 Å²	73.3	44%	0.443	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	139.7	176.6	0	0	0	0	0	113.8	L308	G294-L308 WeakPolarHBondContact O-CD2 3.36Å
295	C	89.8	Confident	84.5	Confident	3 Å²	3	72.4 Å²	72.4	2%	0.02	43%	0.425	C	S	.	.			trans	-85	117.6	164.7	-178.2	0	0	0	0	109.2	E297 G299 K300 F302 L308 H315	C295-E297 PolarHBondContact O-N 2.63Å; C295-G299 VanDerWaalsContact O-CA 3.26Å; C295-G299 WeakPolarHBondContact O-CA 3.08Å; C295-G299 PolarHBondContact O-N 2.98Å; C295-K300 WeakPolarHBondContact CB-O 3.34Å; C295-K300 PolarHBondContact N-O 3.5Å; C295-F302 HydrophobicContact CB-CE2 4.45Å; C295-L308 HydrophobicContact CB-CD1 3.59Å; C295-H315 PolarHBondContact SG-NE2 3.2Å; C295-H315 VanDerWaalsContact SG-NE2 3.38Å
296	G	84.6	Confident	84.2	Confident	79 Å²	79	72.6 Å²	72.6	81%	0.814	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.8	178.8	0	0	0	0	0	114.3
297	E	83.9	Confident	84.3	Confident	118 Å²	118	69 Å²	69	55%	0.551	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-34.5	-174.6	-68.7	164	-145.5	0	0	113.4	C295 H315	C295-E297 PolarHBondContact O-N 2.63Å; E297-H315 WeakPolarHBondContact OE2-CB 3.29Å; E297-H315 IonicContact OE2-CD2 3.07Å; E297-H315 PolarHBondContact OE2-CD2 3.36Å; E297-H315 IonicContact OE2-CG 3.42Å
298	C	85.4	Confident	84.4	Confident	52 Å²	52	66.4 Å²	66.4	35%	0.351	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.3	9.6	-177.8	80	0	0	0	0	114.3	K300 H311 H315	C298-K300 PolarHBondContact O-N 3.07Å; C298-K300 VanDerWaalsContact SG-CG 3.54Å; C298-H311 PolarHBondContact SG-NE2 3.22Å; C298-H315 PolarHBondContact SG-NE2 3.22Å; C298-H315 VanDerWaalsContact SG-NE2 3.39Å
299	G	82.1	Confident	84.5	Confident	67 Å²	67	66 Å²	66	69%	0.691	40%	0.4	S	S	*	.			trans	66.5	2.5	178.3	0	0	0	0	0	115.6	C295 A301	C295-G299 VanDerWaalsContact O-CA 3.26Å; C295-G299 WeakPolarHBondContact O-CA 3.08Å; C295-G299 PolarHBondContact O-N 2.98Å; G299-A301 PolarHBondContact O-N 3.21Å
300	K	84.7	Confident	84.5	Confident	124 Å²	124	67.4 Å²	67.4	54%	0.539	40%	0.395	S	S	.	.			trans	-73.4	128.5	-179.9	-73.2	178.9	-176	173.9	0	110.2	C295 C298 F302	C295-K300 WeakPolarHBondContact CB-O 3.34Å; C295-K300 PolarHBondContact N-O 3.5Å; C298-K300 PolarHBondContact O-N 3.07Å; C298-K300 VanDerWaalsContact SG-CG 3.54Å; K300-F302 HydrophobicContact CB-CE2 3.93Å; K300-F302 HydrophobicContact CB-CZ 4.01Å; K300-F302 WeakPolarHBondContact O-CE2 3.44Å
301	A	87	Confident	84.6	Confident	37 Å²	37	63.1 Å²	63.1	31%	0.306	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	145.6	179	0	0	0	0	0	112.2	K291 F293 G299	K291-A301 HydrophobicContact CB-CB 3.54Å; K291-A301 HydrophobicContact CD-CB 4.31Å; K291-A301 WeakPolarHBondContact CD-O 3.49Å; F293-A301 CarbonylContact O-C 3.59Å; F293-A301 WeakPolarHBondContact O-CA 3.37Å; G299-A301 PolarHBondContact O-N 3.21Å
302	F	86.6	Confident	84.4	Confident	46 Å²	46	62.4 Å²	62.4	20%	0.202	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	152.4	-175.4	-58.4	-89.4	0	0	0	111.5	K291 F293 C295 K300 R304 T307 L308 H311	K291-F302 CarbonylContact C-O 3.54Å; K291-F302 VanDerWaalsContact C-O 3.25Å; K291-F302 VanDerWaalsContact CA-O 3.3Å; K291-F302 WeakPolarHBondContact CA-O 3.34Å; F293-F302 HydrophobicContact CB-CB 4.47Å; F293-F302 WeakPolarHBondContact CB-O 2.92Å; F293-F302 WeakPolarHBondContact CD2-O 3.44Å; F293-F302 PolarHBondContact N-O 2.87Å; F293-F302 VanDerWaalsContact N-O 3.11Å; F293-F302 PolarHBondContact O-N 3.15Å; C295-F302 HydrophobicContact CB-CE2 4.45Å; K300-F302 HydrophobicContact CB-CE2 3.93Å; K300-F302 HydrophobicContact CB-CZ 4.01Å; K300-F302 WeakPolarHBondContact O-CE2 3.44Å; F302-R304 VanDerWaalsContact C-N 3.34Å; F302-T307 WeakPolarHBondContact CB-OG1 3.27Å; F302-L308 HydrophobicContact CB-CB 4.33Å; F302-L308 HydrophobicContact CD2-CB 3.85Å; F302-L308 HydrophobicContact CD2-CD1 3.71Å; F302-L308 HydrophobicContact CD2-CG 4.38Å; F302-L308 HydrophobicContact CE2-CD1 3.88Å; F302-L308 HydrophobicContact CG-CB 4.3Å; F302-H311 HydrophobicContact CE1-CB 4.03Å; F302-H311 HydrophobicContact CE2-CB 3.74Å; F302-H311 AromaticContact CE2-CD2 3.36Å; F302-H311 WeakPolarHBondContact CE2-CD2 3.24Å; F302-H311 AromaticContact CE2-CG 3.52Å; F302-H311 HydrophobicContact CZ-CB 3.42Å; F302-H311 VanDerWaalsContact CZ-CB 3.42Å; F302-H311 AromaticContact CZ-CD2 3.47Å; F302-H311 VanDerWaalsContact CZ-CD2 3.47Å; F302-H311 WeakPolarHBondContact CZ-CD2 3.42Å; F302-H311 AromaticContact CZ-CG 3.18Å; F302-H311 AromaticContact CZ-ND1 3.64Å
303	S	84.2	Confident	84.3	Confident	43 Å²	43	60.3 Å²	60.3	30%	0.301	35%	0.353	S	S	.	.	S	Bend	trans	-81.7	-13.4	178.9	58.4	0	0	0	0	113.4	R285	R285-S303 PolarHBondContact NH1-O 3.44Å
304	R	83.3	Confident	84.1	Confident	118 Å²	118	63 Å²	63	45%	0.445	37%	0.369	S	S	.	.	S	Bend	trans	-132.4	144.4	177.6	-57.4	176.2	87.4	159.3	4.3	110.7	L282 F302 T307 L308	L282-R304 HydrophobicContact CD1-CG 3.71Å; L282-R304 HydrophobicContact CD2-CG 4.29Å; L282-R304 VanDerWaalsContact CD2-CZ 3.5Å; F302-R304 VanDerWaalsContact C-N 3.34Å; R304-T307 HydrophobicContact CB-CG2 4.29Å; R304-T307 PolarHBondContact O-N 2.72Å; R304-T307 PolarHBondContact O-OG1 3.37Å; R304-L308 PolarHBondContact O-N 2.79Å
305	S	82.5	Confident	83.9	Confident	53 Å²	53	64.4 Å²	64.4	37%	0.371	36%	0.364	S	S	.	.	H	α-helix	trans	-63.4	-43.5	175.4	51.5	0	0	0	0	111.8	T307 L308 I309	S305-T307 VanDerWaalsContact C-N 3.27Å; S305-T307 PolarHBondContact O-N 3.32Å; S305-L308 WeakPolarHBondContact O-CA 3.14Å; S305-L308 WeakPolarHBondContact O-CB 3.48Å; S305-L308 PolarHBondContact O-N 2.98Å; S305-I309 WeakPolarHBondContact O-CG1 3.48Å; S305-I309 PolarHBondContact O-N 2.84Å
306	S	80.9	Confident	83.5	Confident	55 Å²	55	67.7 Å²	67.7	39%	0.385	38%	0.384	S	S	.	.	H	α-helix	trans	-57.5	-38.5	178.3	55.4	0	0	0	0	112.9	I309 Q310	S306-I309 PolarHBondContact O-N 2.91Å; S306-Q310 WeakPolarHBondContact O-CB 3.46Å; S306-Q310 PolarHBondContact O-N 3.48Å
307	T	83.9	Confident	83.2	Confident	43 Å²	43	66.3 Å²	66.3	26%	0.264	37%	0.37	S	S	.	.	H	α-helix	trans	-70.4	-32.1	175.7	51.3	0	0	0	0	113	F302 R304 S305 H311	F302-T307 WeakPolarHBondContact CB-OG1 3.27Å; R304-T307 HydrophobicContact CB-CG2 4.29Å; R304-T307 PolarHBondContact O-N 2.72Å; R304-T307 PolarHBondContact O-OG1 3.37Å; S305-T307 VanDerWaalsContact C-N 3.27Å; S305-T307 PolarHBondContact O-N 3.32Å; T307-H311 VanDerWaalsContact O-CB 3.28Å; T307-H311 WeakPolarHBondContact O-CB 3.41Å; T307-H311 PolarHBondContact O-N 2.87Å
308	L	85.3	Confident	82.9	Confident	16 Å²	16	66.6 Å²	66.6	8%	0.084	37%	0.371	C	S	.	.	H	α-helix	trans	-68.4	-43.2	172.3	170.8	63.9	0	0	0	110.9	F293 G294 C295 F302 R304 S305 H311 R312	F293-L308 HydrophobicContact CB-CB 4.09Å; F293-L308 HydrophobicContact CB-CD2 3.82Å; G294-L308 WeakPolarHBondContact O-CD2 3.36Å; C295-L308 HydrophobicContact CB-CD1 3.59Å; F302-L308 HydrophobicContact CB-CB 4.33Å; F302-L308 HydrophobicContact CD2-CB 3.85Å; F302-L308 HydrophobicContact CD2-CD1 3.71Å; F302-L308 HydrophobicContact CD2-CG 4.38Å; F302-L308 HydrophobicContact CE2-CD1 3.88Å; F302-L308 HydrophobicContact CG-CB 4.3Å; R304-L308 PolarHBondContact O-N 2.79Å; S305-L308 WeakPolarHBondContact O-CA 3.14Å; S305-L308 WeakPolarHBondContact O-CB 3.48Å; S305-L308 PolarHBondContact O-N 2.98Å; L308-H311 WeakPolarHBondContact O-CB 3.47Å; L308-H311 PolarHBondContact O-N 3.32Å; L308-H311 VanDerWaalsContact O-N 3.12Å; L308-R312 HydrophobicContact CD1-CG 4.43Å; L308-R312 WeakPolarHBondContact O-CG 3.38Å; L308-R312 PolarHBondContact O-N 2.99Å
309	I	82.6	Confident	82.8	Confident	70 Å²	70	69.8 Å²	69.8	36%	0.359	38%	0.379	S	S	.	.	H	α-helix	trans	-60.2	-47.9	176.9	-65.9	167.6	0	0	0	109.9	L39 S305 S306 H311 R312	L39-I309 HydrophobicContact CD1-CD1 4.21Å; L39-I309 HydrophobicContact CD2-CD1 4.44Å; S305-I309 WeakPolarHBondContact O-CG1 3.48Å; S305-I309 PolarHBondContact O-N 2.84Å; S306-I309 PolarHBondContact O-N 2.91Å; I309-H311 VanDerWaalsContact C-N 3.27Å; I309-H311 PolarHBondContact O-N 3.03Å; I309-R312 PolarHBondContact O-N 2.83Å
310	Q	81.3	Confident	82.9	Confident	75 Å²	75	70 Å²	70	35%	0.35	37%	0.368	S	S	.	.	H	α-helix	trans	-58.6	-39.2	173.5	171.7	174.9	31	0	0	112.5	S306 I313 Q332	S306-Q310 WeakPolarHBondContact O-CB 3.46Å; S306-Q310 PolarHBondContact O-N 3.48Å; Q310-I313 WeakPolarHBondContact O-CB 3.31Å; Q310-I313 PolarHBondContact O-N 3.06Å; Q310-Q332 VanDerWaalsContact CD-NE2 3.33Å; Q310-Q332 VanDerWaalsContact CG-NE2 3.25Å; Q310-Q332 VanDerWaalsContact NE2-NE2 3.2Å
311	H	85.4	Confident	82.9	Confident	15 Å²	15	66.5 Å²	66.5	7%	0.069	35%	0.352	C	S	.	.	H	α-helix	trans	-66.1	-37.9	178.7	171.4	65.1	0	0	0	112.6	C298 F302 T307 L308 I309 I313 I314 H315	C298-H311 PolarHBondContact SG-NE2 3.22Å; F302-H311 HydrophobicContact CE1-CB 4.03Å; F302-H311 HydrophobicContact CE2-CB 3.74Å; F302-H311 AromaticContact CE2-CD2 3.36Å; F302-H311 WeakPolarHBondContact CE2-CD2 3.24Å; F302-H311 AromaticContact CE2-CG 3.52Å; F302-H311 HydrophobicContact CZ-CB 3.42Å; F302-H311 VanDerWaalsContact CZ-CB 3.42Å; F302-H311 AromaticContact CZ-CD2 3.47Å; F302-H311 VanDerWaalsContact CZ-CD2 3.47Å; F302-H311 WeakPolarHBondContact CZ-CD2 3.42Å; F302-H311 AromaticContact CZ-CG 3.18Å; F302-H311 AromaticContact CZ-ND1 3.64Å; T307-H311 VanDerWaalsContact O-CB 3.28Å; T307-H311 WeakPolarHBondContact O-CB 3.41Å; T307-H311 PolarHBondContact O-N 2.87Å; L308-H311 WeakPolarHBondContact O-CB 3.47Å; L308-H311 PolarHBondContact O-N 3.32Å; L308-H311 VanDerWaalsContact O-N 3.12Å; I309-H311 VanDerWaalsContact C-N 3.27Å; I309-H311 PolarHBondContact O-N 3.03Å; H311-I313 PolarHBondContact O-N 2.99Å; H311-I314 VanDerWaalsContact O-CB 3.24Å; H311-I314 WeakPolarHBondContact O-CB 3.22Å; H311-I314 WeakPolarHBondContact O-CG1 3.47Å; H311-I314 PolarHBondContact O-N 3.41Å; H311-H315 AromaticContact CD2-NE2 3.96Å; H311-H315 AromaticContact CE1-NE2 3.76Å; H311-H315 AromaticContact NE2-CE1 3.91Å; H311-H315 AromaticContact NE2-NE2 3.19Å; H311-H315 PolarHBondContact NE2-NE2 2.76Å; H311-H315 VanDerWaalsContact NE2-NE2 3.19Å
312	R	82.3	Confident	82.9	Confident	113 Å²	113	71.5 Å²	71.5	43%	0.426	37%	0.367	S	S	.	.	H	α-helix	trans	-59.3	-28.8	178.4	-74.5	177.8	177.7	-126.8	3.9	113.1	L308 I309 I314 H315 T316	L308-R312 HydrophobicContact CD1-CG 4.43Å; L308-R312 WeakPolarHBondContact O-CG 3.38Å; L308-R312 PolarHBondContact O-N 2.99Å; I309-R312 PolarHBondContact O-N 2.83Å; R312-I314 PolarHBondContact O-N 3.4Å; R312-I314 VanDerWaalsContact O-N 3.12Å; R312-H315 PolarHBondContact O-N 3.21Å; R312-T316 PolarHBondContact O-N 3.13Å; R312-T316 VanDerWaalsContact O-N 3.16Å
313	I	84	Confident	83.1	Confident	30 Å²	30	69.4 Å²	69.4	15%	0.154	36%	0.358	C	S	.	.	H	α-helix	trans	-57.9	-26.5	174.6	-56.1	176.3	0	0	0	111.8	Q310 H311 H315 T316 G317 E318	Q310-I313 WeakPolarHBondContact O-CB 3.31Å; Q310-I313 PolarHBondContact O-N 3.06Å; H311-I313 PolarHBondContact O-N 2.99Å; I313-H315 VanDerWaalsContact C-N 3.33Å; I313-T316 PolarHBondContact O-OG1 3.19Å; I313-G317 PolarHBondContact O-N 3.27Å; I313-E318 WeakPolarHBondContact CG2-O 3.31Å
314	I	81.6	Confident	83.3	Confident	122 Å²	122	74.9 Å²	74.9	63%	0.626	38%	0.384	S	S	*	.	H	α-helix	trans	-67.6	-35.8	176.9	-58.1	176.7	0	0	0	111.2	H311 R312	H311-I314 VanDerWaalsContact O-CB 3.24Å; H311-I314 WeakPolarHBondContact O-CB 3.22Å; H311-I314 WeakPolarHBondContact O-CG1 3.47Å; H311-I314 PolarHBondContact O-N 3.41Å; R312-I314 PolarHBondContact O-N 3.4Å; R312-I314 VanDerWaalsContact O-N 3.12Å
315	H	80.8	Confident	83.4	Confident	73 Å²	73	75.2 Å²	75.2	34%	0.338	39%	0.391	S	S	.	.	H	α-helix	trans	-82.2	-39.7	-178.3	-58.2	-49.4	0	0	0	112.1	C295 E297 C298 H311 R312 I313 G317	C295-H315 PolarHBondContact SG-NE2 3.2Å; C295-H315 VanDerWaalsContact SG-NE2 3.38Å; E297-H315 WeakPolarHBondContact OE2-CB 3.29Å; E297-H315 IonicContact OE2-CD2 3.07Å; E297-H315 PolarHBondContact OE2-CD2 3.36Å; E297-H315 IonicContact OE2-CG 3.42Å; C298-H315 PolarHBondContact SG-NE2 3.22Å; C298-H315 VanDerWaalsContact SG-NE2 3.39Å; H311-H315 AromaticContact CD2-NE2 3.96Å; H311-H315 AromaticContact CE1-NE2 3.76Å; H311-H315 AromaticContact NE2-CE1 3.91Å; H311-H315 AromaticContact NE2-NE2 3.19Å; H311-H315 PolarHBondContact NE2-NE2 2.76Å; H311-H315 VanDerWaalsContact NE2-NE2 3.19Å; R312-H315 PolarHBondContact O-N 3.21Å; I313-H315 VanDerWaalsContact C-N 3.33Å; H315-G317 PolarHBondContact O-N 2.98Å
316	T	80.6	Confident	83.7	Confident	73 Å²	73	75.8 Å²	75.8	45%	0.448	39%	0.394	S	S	.	.	H	α-helix	trans	-71.6	-21	175.8	64.1	0	0	0	0	112.1	R312 I313 E318	R312-T316 PolarHBondContact O-N 3.13Å; R312-T316 VanDerWaalsContact O-N 3.16Å; I313-T316 PolarHBondContact O-OG1 3.19Å; T316-E318 PolarHBondContact O-N 3.34Å; T316-E318 PolarHBondContact OG1-N 3.39Å
317	G	78.2	Confident	83.8	Confident	49 Å²	49	75.8 Å²	75.8	51%	0.505	40%	0.403	S	S	.	.			trans	67.4	2.3	-175.9	0	0	0	0	0	113.5	I313 H315 K319	I313-G317 PolarHBondContact O-N 3.27Å; H315-G317 PolarHBondContact O-N 2.98Å; G317-K319 PolarHBondContact O-N 3.47Å
318	E	78.4	Confident	83.9	Confident	125 Å²	125	81.1 Å²	81.1	58%	0.584	42%	0.418	S	S	*	.			trans	-61.3	137.6	179	-70.7	178.5	171.8	0	0	109.5	I313 T316 P320	I313-E318 WeakPolarHBondContact CG2-O 3.31Å; T316-E318 PolarHBondContact O-N 3.34Å; T316-E318 PolarHBondContact OG1-N 3.39Å; E318-P320 WeakPolarHBondContact O-CD 3.39Å
319	K	83.8	Confident	83.9	Confident	118 Å²	118	81 Å²	81	51%	0.513	42%	0.42	S	S	.	.			trans	-125.2	81.3	176.5	-75	166.7	174	-178.4	0	107.3	G317 Y321 G329 F330	G317-K319 PolarHBondContact O-N 3.47Å; K319-Y321 PolarHBondContact O-N 3.46Å; K319-Y321 VanDerWaalsContact O-N 3.11Å; K319-G329 WeakPolarHBondContact CD-O 3.43Å; K319-F330 CarbonylContact C-O 3.59Å; K319-F330 WeakPolarHBondContact CA-O 3.28Å
320	P	83.7	Confident	84	Confident	72 Å²	72	78.9 Å²	78.9	47%	0.468	41%	0.408	S	S	.	.			trans	-59.4	-27	-171.6	-24.5	34.6	0	0	0	112.6	E318	E318-P320 WeakPolarHBondContact O-CD 3.39Å
321	Y	85.5	Confident	84.2	Confident	50 Å²	50	76.8 Å²	76.8	20%	0.196	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	98.6	-175.6	-54.5	-81.1	0	0	0	109.9	V22 K319 G329 F330 S333	V22-Y321 WeakPolarHBondContact CG2-OH 3.18Å; K319-Y321 PolarHBondContact O-N 3.46Å; K319-Y321 VanDerWaalsContact O-N 3.11Å; Y321-G329 CarbonylContact O-C 3.54Å; Y321-G329 WeakPolarHBondContact O-CA 3.36Å; Y321-F330 PolarHBondContact N-O 2.94Å; Y321-F330 PolarHBondContact O-N 3.28Å; Y321-S333 VanDerWaalsContact CE1-CB 3.46Å
322	K	86.1	Confident	84	Confident	143 Å²	143	78.5 Å²	78.5	62%	0.622	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	138.8	179.8	-63.5	179.6	-174.8	171.9	0	111.2
323	C	91.4	Very high	84.1	Confident	2 Å²	2	74 Å²	74	1%	0.014	40%	0.396	C	S	.	.			trans	-78.3	124.1	169.7	-179.3	0	0	0	0	109.6	E325 C326 G327 R328 F330 L336	C323-E325 VanDerWaalsContact C-N 3.26Å; C323-E325 PolarHBondContact O-N 2.84Å; C323-C326 VanDerWaalsContact SG-SG 3.67Å; C323-G327 WeakPolarHBondContact O-CA 3.39Å; C323-G327 PolarHBondContact O-N 3.37Å; C323-R328 WeakPolarHBondContact CB-O 3.39Å; C323-R328 PolarHBondContact N-O 2.88Å; C323-F330 HydrophobicContact CB-CE2 4.39Å; C323-L336 HydrophobicContact CB-CD1 3.68Å
324	N	87.5	Confident	84.1	Confident	158 Å²	158	77 Å²	77	85%	0.845	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-23.4	-179.7	-64.7	-17.6	0	0	0	112.8
325	E	86.8	Confident	84.4	Confident	125 Å²	125	74.9 Å²	74.9	58%	0.584	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-39.7	-176.8	-64.6	-173.9	-137	0	0	114	C323 H343	C323-E325 VanDerWaalsContact C-N 3.26Å; C323-E325 PolarHBondContact O-N 2.84Å; E325-H343 WeakPolarHBondContact OE1-CB 3.25Å; E325-H343 IonicContact OE1-CG 3.57Å; E325-H343 WeakPolarHBondContact OE2-CB 3.44Å; E325-H343 IonicContact OE2-CE1 3.31Å; E325-H343 IonicContact OE2-CG 3.37Å; E325-H343 IonicContact OE2-ND1 2.64Å; E325-H343 PolarHBondContact OE2-ND1 2.89Å
326	C	87.9	Confident	84.8	Confident	64 Å²	64	72.5 Å²	72.5	43%	0.432	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	3.3	-178.8	67.9	0	0	0	0	114.4	C323 R328 H339 H343	C323-C326 VanDerWaalsContact SG-SG 3.67Å; C326-R328 PolarHBondContact O-N 3.11Å; C326-R328 WeakPolarHBondContact SG-CB 3.43Å; C326-H339 PolarHBondContact SG-NE2 2.67Å; C326-H343 PolarHBondContact SG-NE2 3.06Å
327	G	82.9	Confident	85.1	Confident	56 Å²	56	71.7 Å²	71.7	58%	0.577	39%	0.39	S	S	*	.			trans	68.4	1.5	-178.5	0	0	0	0	0	114.7	C323 G329	C323-G327 WeakPolarHBondContact O-CA 3.39Å; C323-G327 PolarHBondContact O-N 3.37Å; G327-G329 PolarHBondContact O-N 3.5Å
328	R	85.6	Confident	85.5	Confident	155 Å²	155	72.4 Å²	72.4	59%	0.585	38%	0.38	S	S	*	.			trans	-71.5	125.2	-175.7	-171.2	171.1	-179.6	164.1	3.4	111	C323 C326 F330	C323-R328 WeakPolarHBondContact CB-O 3.39Å; C323-R328 PolarHBondContact N-O 2.88Å; C326-R328 PolarHBondContact O-N 3.11Å; C326-R328 WeakPolarHBondContact SG-CB 3.43Å; R328-F330 HydrophobicContact CB-CE2 4.17Å; R328-F330 HydrophobicContact CB-CZ 4.34Å; R328-F330 HydrophobicContact CG-CE2 4.02Å; R328-F330 HydrophobicContact CG-CZ 3.83Å; R328-F330 WeakPolarHBondContact O-CD2 2.9Å; R328-F330 VanDerWaalsContact O-CE2 3.27Å; R328-F330 WeakPolarHBondContact O-CE2 3.29Å
329	G	85.9	Confident	86	Confident	12 Å²	12	67.3 Å²	67.3	12%	0.124	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	147.1	176.3	0	0	0	0	0	114.4	K319 Y321 G327	K319-G329 WeakPolarHBondContact CD-O 3.43Å; Y321-G329 CarbonylContact O-C 3.54Å; Y321-G329 WeakPolarHBondContact O-CA 3.36Å; G327-G329 PolarHBondContact O-N 3.5Å
330	F	85.4	Confident	86.2	Confident	26 Å²	26	65.1 Å²	65.1	11%	0.114	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	152.8	177.8	-59.1	-88.4	0	0	0	110.6	K319 Y321 C323 R328 Q332 Q335 L336 H339	K319-F330 CarbonylContact C-O 3.59Å; K319-F330 WeakPolarHBondContact CA-O 3.28Å; Y321-F330 PolarHBondContact N-O 2.94Å; Y321-F330 PolarHBondContact O-N 3.28Å; C323-F330 HydrophobicContact CB-CE2 4.39Å; R328-F330 HydrophobicContact CB-CE2 4.17Å; R328-F330 HydrophobicContact CB-CZ 4.34Å; R328-F330 HydrophobicContact CG-CE2 4.02Å; R328-F330 HydrophobicContact CG-CZ 3.83Å; R328-F330 WeakPolarHBondContact O-CD2 2.9Å; R328-F330 VanDerWaalsContact O-CE2 3.27Å; R328-F330 WeakPolarHBondContact O-CE2 3.29Å; F330-Q332 VanDerWaalsContact C-N 3.34Å; F330-Q335 HydrophobicContact CB-CB 4.11Å; F330-Q335 HydrophobicContact CD1-CB 3.83Å; F330-Q335 HydrophobicContact CG-CB 4.21Å; F330-L336 HydrophobicContact CB-CB 4.37Å; F330-L336 HydrophobicContact CD2-CB 3.88Å; F330-L336 HydrophobicContact CD2-CD1 3.78Å; F330-L336 HydrophobicContact CD2-CG 4.44Å; F330-L336 HydrophobicContact CE2-CD1 3.93Å; F330-L336 HydrophobicContact CG-CB 4.27Å; F330-H339 HydrophobicContact CE1-CB 3.86Å; F330-H339 HydrophobicContact CE2-CB 3.84Å; F330-H339 AromaticContact CE2-CD2 3.29Å; F330-H339 WeakPolarHBondContact CE2-CD2 3.48Å; F330-H339 AromaticContact CE2-CG 3.61Å; F330-H339 AromaticContact CE2-NE2 3.98Å; F330-H339 HydrophobicContact CZ-CB 3.36Å; F330-H339 AromaticContact CZ-CD2 3.31Å; F330-H339 WeakPolarHBondContact CZ-CD2 3.45Å; F330-H339 AromaticContact CZ-CG 3.15Å; F330-H339 AromaticContact CZ-ND1 3.71Å; F330-H339 AromaticContact CZ-NE2 3.89Å
331	S	83.8	Confident	86.5	Confident	32 Å²	32	65 Å²	65	22%	0.224	34%	0.338	C	S	.	.	S	Bend	trans	-86.6	-7.5	178.5	57.3	0	0	0	0	113.2	Q335	S331-Q335 PolarHBondContact OG-OE1 3.07Å
332	Q	82.6	Confident	86.6	Confident	50 Å²	50	68.3 Å²	68.3	23%	0.234	36%	0.358	C	S	.	.	S	Bend	trans	-144	139.3	-176.9	-64.3	-69.1	-56.5	0	0	111.2	Q310 F330 Q335 L336	Q310-Q332 VanDerWaalsContact CD-NE2 3.33Å; Q310-Q332 VanDerWaalsContact CG-NE2 3.25Å; Q310-Q332 VanDerWaalsContact NE2-NE2 3.2Å; F330-Q332 VanDerWaalsContact C-N 3.34Å; Q332-Q335 HydrophobicContact CB-CB 4.42Å; Q332-Q335 HydrophobicContact CB-CG 3.94Å; Q332-Q335 WeakPolarHBondContact O-CB 3.47Å; Q332-Q335 PolarHBondContact O-N 3.41Å; Q332-Q335 VanDerWaalsContact O-N 3.17Å; Q332-L336 PolarHBondContact O-N 3.3Å
333	S	84.6	Confident	86.7	Confident	19 Å²	19	64.7 Å²	64.7	13%	0.133	34%	0.343	C	S	.	.	H	α-helix	trans	-54.4	-50	176.4	165.7	0	0	0	0	112.9	D19 Y321 Q335 L336 T337	D19-S333 WeakPolarHBondContact O-CB 3.48Å; D19-S333 PolarHBondContact O-OG 3.45Å; Y321-S333 VanDerWaalsContact CE1-CB 3.46Å; S333-Q335 PolarHBondContact O-N 3.26Å; S333-L336 WeakPolarHBondContact O-CA 3.41Å; S333-L336 WeakPolarHBondContact O-CB 3.46Å; S333-L336 PolarHBondContact O-N 3.41Å; S333-T337 PolarHBondContact O-N 3.06Å; S333-T337 PolarHBondContact O-OG1 3.46Å
334	P	84.2	Confident	86.5	Confident	92 Å²	92	68.3 Å²	68.3	60%	0.597	37%	0.365	S	S	*	.	H	α-helix	trans	-60.2	-25.6	-179.7	-26.6	35.1	0	0	0	114.6	Q338	P334-Q338 VanDerWaalsContact O-CB 3.23Å; P334-Q338 WeakPolarHBondContact O-CB 3.39Å; P334-Q338 PolarHBondContact O-N 3.11Å
335	Q	86.5	Confident	86.5	Confident	79 Å²	79	63 Å²	63	37%	0.369	35%	0.347	S	S	.	.	H	α-helix	trans	-72.8	-38.4	175.1	-64.6	173.3	-9.5	0	0	111.3	F330 S331 Q332 S333 H339	F330-Q335 HydrophobicContact CB-CB 4.11Å; F330-Q335 HydrophobicContact CD1-CB 3.83Å; F330-Q335 HydrophobicContact CG-CB 4.21Å; S331-Q335 PolarHBondContact OG-OE1 3.07Å; Q332-Q335 HydrophobicContact CB-CB 4.42Å; Q332-Q335 HydrophobicContact CB-CG 3.94Å; Q332-Q335 WeakPolarHBondContact O-CB 3.47Å; Q332-Q335 PolarHBondContact O-N 3.41Å; Q332-Q335 VanDerWaalsContact O-N 3.17Å; S333-Q335 PolarHBondContact O-N 3.26Å; Q335-H339 VanDerWaalsContact O-CB 3.25Å; Q335-H339 WeakPolarHBondContact O-CB 3.41Å; Q335-H339 PolarHBondContact O-N 2.86Å
336	L	88.9	Confident	86.5	Confident	22 Å²	22	62.1 Å²	62.1	12%	0.115	34%	0.343	C	S	.	.	H	α-helix	trans	-64.8	-50	173.1	172.6	61.8	0	0	0	110.7	C323 F330 Q332 S333 Q338 H339 Q340	C323-L336 HydrophobicContact CB-CD1 3.68Å; F330-L336 HydrophobicContact CB-CB 4.37Å; F330-L336 HydrophobicContact CD2-CB 3.88Å; F330-L336 HydrophobicContact CD2-CD1 3.78Å; F330-L336 HydrophobicContact CD2-CG 4.44Å; F330-L336 HydrophobicContact CE2-CD1 3.93Å; F330-L336 HydrophobicContact CG-CB 4.27Å; Q332-L336 PolarHBondContact O-N 3.3Å; S333-L336 WeakPolarHBondContact O-CA 3.41Å; S333-L336 WeakPolarHBondContact O-CB 3.46Å; S333-L336 PolarHBondContact O-N 3.41Å; L336-Q338 VanDerWaalsContact C-N 3.27Å; L336-Q338 PolarHBondContact O-N 3.45Å; L336-H339 CarbonylContact O-C 3.25Å; L336-H339 WeakPolarHBondContact O-CA 3.43Å; L336-H339 WeakPolarHBondContact O-CB 3.43Å; L336-H339 PolarHBondContact O-N 2.88Å; L336-Q340 HydrophobicContact CD1-CG 4.24Å; L336-Q340 WeakPolarHBondContact O-CG 3.27Å; L336-Q340 PolarHBondContact O-N 2.9Å
337	T	86.8	Confident	86.6	Confident	57 Å²	57	65 Å²	65	35%	0.35	35%	0.348	S	S	.	.	H	α-helix	trans	-56.6	-43.3	177.5	-47.9	0	0	0	0	111.5	S333 H339 Q340	S333-T337 PolarHBondContact O-N 3.06Å; S333-T337 PolarHBondContact O-OG1 3.46Å; T337-H339 VanDerWaalsContact C-N 3.33Å; T337-H339 PolarHBondContact O-N 3.12Å; T337-Q340 PolarHBondContact O-N 3.41Å
338	Q	87.3	Confident	86.9	Confident	64 Å²	64	65.9 Å²	65.9	30%	0.299	34%	0.344	S	S	.	.	H	α-helix	trans	-66.4	-35.9	175.9	-178.8	-178.7	84.2	0	0	112.6	P334 L336 R341 R360	P334-Q338 VanDerWaalsContact O-CB 3.23Å; P334-Q338 WeakPolarHBondContact O-CB 3.39Å; P334-Q338 PolarHBondContact O-N 3.11Å; L336-Q338 VanDerWaalsContact C-N 3.27Å; L336-Q338 PolarHBondContact O-N 3.45Å; Q338-R341 WeakPolarHBondContact O-CB 3.33Å; Q338-R341 PolarHBondContact O-N 3.2Å; Q338-R360 HydrophobicContact CG-CG 4.44Å; Q338-R360 VanDerWaalsContact NE2-NE 3.11Å
339	H	89.5	Confident	87.1	Confident	17 Å²	17	61.1 Å²	61.1	8%	0.079	33%	0.328	C	S	.	.	H	α-helix	trans	-69.6	-37.4	177.5	167.4	67	0	0	0	112.4	C326 F330 Q335 L336 T337 R341 I342 H343	C326-H339 PolarHBondContact SG-NE2 2.67Å; F330-H339 HydrophobicContact CE1-CB 3.86Å; F330-H339 HydrophobicContact CE2-CB 3.84Å; F330-H339 AromaticContact CE2-CD2 3.29Å; F330-H339 WeakPolarHBondContact CE2-CD2 3.48Å; F330-H339 AromaticContact CE2-CG 3.61Å; F330-H339 AromaticContact CE2-NE2 3.98Å; F330-H339 HydrophobicContact CZ-CB 3.36Å; F330-H339 AromaticContact CZ-CD2 3.31Å; F330-H339 WeakPolarHBondContact CZ-CD2 3.45Å; F330-H339 AromaticContact CZ-CG 3.15Å; F330-H339 AromaticContact CZ-ND1 3.71Å; F330-H339 AromaticContact CZ-NE2 3.89Å; Q335-H339 VanDerWaalsContact O-CB 3.25Å; Q335-H339 WeakPolarHBondContact O-CB 3.41Å; Q335-H339 PolarHBondContact O-N 2.86Å; L336-H339 CarbonylContact O-C 3.25Å; L336-H339 WeakPolarHBondContact O-CA 3.43Å; L336-H339 WeakPolarHBondContact O-CB 3.43Å; L336-H339 PolarHBondContact O-N 2.88Å; T337-H339 VanDerWaalsContact C-N 3.33Å; T337-H339 PolarHBondContact O-N 3.12Å; H339-R341 PolarHBondContact O-N 2.72Å; H339-R341 VanDerWaalsContact O-N 3.12Å; H339-I342 WeakPolarHBondContact ND1-CD1 3.41Å; H339-I342 VanDerWaalsContact O-CB 3.24Å; H339-I342 WeakPolarHBondContact O-CB 3.34Å; H339-I342 WeakPolarHBondContact O-CG1 3.41Å; H339-I342 PolarHBondContact O-N 3.24Å; H339-H343 AromaticContact CE1-NE2 3.74Å; H339-H343 AromaticContact NE2-CD2 3.94Å; H339-H343 AromaticContact NE2-NE2 3.47Å; H339-H343 PolarHBondContact NE2-NE2 3.03Å
340	Q	87.9	Confident	87.4	Confident	73 Å²	73	66.4 Å²	66.4	34%	0.341	35%	0.35	S	S	.	.	H	α-helix	trans	-56.3	-28.1	175.9	-75.3	170.4	-37.4	0	0	112.4	L336 T337 I342 H343 T344	L336-Q340 HydrophobicContact CD1-CG 4.24Å; L336-Q340 WeakPolarHBondContact O-CG 3.27Å; L336-Q340 PolarHBondContact O-N 2.9Å; T337-Q340 PolarHBondContact O-N 3.41Å; Q340-I342 PolarHBondContact O-N 3.11Å; Q340-I342 VanDerWaalsContact O-N 3.11Å; Q340-H343 WeakPolarHBondContact O-CB 3.4Å; Q340-H343 PolarHBondContact O-N 3.49Å; Q340-T344 PolarHBondContact O-N 3.39Å; Q340-T344 VanDerWaalsContact O-N 3.07Å; Q340-T344 PolarHBondContact O-OG1 3.49Å
341	R	90.1	Very high	87.8	Confident	68 Å²	68	65.2 Å²	65.2	26%	0.257	34%	0.344	S	S	.	.	H	α-helix	trans	-60.7	-20.4	172.9	-59.4	-178.1	-175.5	-179.8	-3.8	114.4	Q338 H339 H343 T344 G345 E346 S359	Q338-R341 WeakPolarHBondContact O-CB 3.33Å; Q338-R341 PolarHBondContact O-N 3.2Å; H339-R341 PolarHBondContact O-N 2.72Å; H339-R341 VanDerWaalsContact O-N 3.12Å; R341-H343 VanDerWaalsContact C-N 3.31Å; R341-T344 WeakPolarHBondContact CA-OG1 3.37Å; R341-G345 CarbonylContact O-C 3.54Å; R341-G345 WeakPolarHBondContact O-CA 3.23Å; R341-G345 PolarHBondContact O-N 3.16Å; R341-E346 HydrophobicContact CB-CB 4.45Å; R341-E346 HydrophobicContact CG-CB 4.36Å; R341-E346 PolarHBondContact O-N 2.89Å; R341-S359 PolarHBondContact NH1-O 2.86Å
342	I	87.8	Confident	88.1	Confident	121 Å²	121	74.2 Å²	74.2	62%	0.621	37%	0.374	S	S	*	.	H	α-helix	trans	-70	-35.6	174.1	-62.3	167.5	0	0	0	110.2	H339 Q340	H339-I342 WeakPolarHBondContact ND1-CD1 3.41Å; H339-I342 VanDerWaalsContact O-CB 3.24Å; H339-I342 WeakPolarHBondContact O-CB 3.34Å; H339-I342 WeakPolarHBondContact O-CG1 3.41Å; H339-I342 PolarHBondContact O-N 3.24Å; Q340-I342 PolarHBondContact O-N 3.11Å; Q340-I342 VanDerWaalsContact O-N 3.11Å
343	H	88	Confident	88.4	Confident	67 Å²	67	77.9 Å²	77.9	31%	0.31	39%	0.39	S	S	.	.	H	α-helix	trans	-79.2	-48.6	-179.2	-71.1	-74.1	0	0	0	112	E325 C326 H339 Q340 R341 G345	E325-H343 WeakPolarHBondContact OE1-CB 3.25Å; E325-H343 IonicContact OE1-CG 3.57Å; E325-H343 WeakPolarHBondContact OE2-CB 3.44Å; E325-H343 IonicContact OE2-CE1 3.31Å; E325-H343 IonicContact OE2-CG 3.37Å; E325-H343 IonicContact OE2-ND1 2.64Å; E325-H343 PolarHBondContact OE2-ND1 2.89Å; C326-H343 PolarHBondContact SG-NE2 3.06Å; H339-H343 AromaticContact CE1-NE2 3.74Å; H339-H343 AromaticContact NE2-CD2 3.94Å; H339-H343 AromaticContact NE2-NE2 3.47Å; H339-H343 PolarHBondContact NE2-NE2 3.03Å; Q340-H343 WeakPolarHBondContact O-CB 3.4Å; Q340-H343 PolarHBondContact O-N 3.49Å; R341-H343 VanDerWaalsContact C-N 3.31Å; H343-G345 PolarHBondContact O-N 3.45Å
344	T	86.5	Confident	88.7	Confident	78 Å²	78	79.6 Å²	79.6	48%	0.479	40%	0.402	S	S	.	.	H	α-helix	trans	-73.7	-16.3	178.8	63.2	0	0	0	0	112.9	Q340 R341 E346	Q340-T344 PolarHBondContact O-N 3.39Å; Q340-T344 VanDerWaalsContact O-N 3.07Å; Q340-T344 PolarHBondContact O-OG1 3.49Å; R341-T344 WeakPolarHBondContact CA-OG1 3.37Å; T344-E346 PolarHBondContact O-N 3.07Å; T344-E346 WeakPolarHBondContact OG1-CG 3.44Å; T344-E346 PolarHBondContact OG1-N 3.05Å
345	G	86.5	Confident	88.8	Confident	45 Å²	45	77.2 Å²	77.2	46%	0.464	39%	0.393	S	S	.	.			trans	72	5	-174.7	0	0	0	0	0	114	R341 H343 K347	R341-G345 CarbonylContact O-C 3.54Å; R341-G345 WeakPolarHBondContact O-CA 3.23Å; R341-G345 PolarHBondContact O-N 3.16Å; H343-G345 PolarHBondContact O-N 3.45Å; G345-K347 PolarHBondContact O-N 3.34Å
346	E	87.6	Confident	89	Confident	108 Å²	108	79.3 Å²	79.3	51%	0.505	40%	0.402	S	S	.	.			trans	-59.3	124.7	-178.7	-77.5	-179.4	-174.4	0	0	112.1	R341 T344	R341-E346 HydrophobicContact CB-CB 4.45Å; R341-E346 HydrophobicContact CG-CB 4.36Å; R341-E346 PolarHBondContact O-N 2.89Å; T344-E346 PolarHBondContact O-N 3.07Å; T344-E346 WeakPolarHBondContact OG1-CG 3.44Å; T344-E346 PolarHBondContact OG1-N 3.05Å
347	K	90.4	Very high	89.1	Confident	123 Å²	123	80 Å²	80	54%	0.535	41%	0.41	S	S	.	.			trans	-129.5	78.5	177.7	-71.6	165.6	175.6	-178	0	109.7	G345 H349 A357 F358	G345-K347 PolarHBondContact O-N 3.34Å; K347-H349 PolarHBondContact O-N 3.47Å; K347-A357 HydrophobicContact CB-CB 3.49Å; K347-A357 VanDerWaalsContact CB-CB 3.49Å; K347-A357 HydrophobicContact CD-CB 4.15Å; K347-A357 WeakPolarHBondContact CD-O 3.43Å; K347-A357 HydrophobicContact CG-CB 4.43Å; K347-F358 CarbonylContact C-O 3.56Å; K347-F358 WeakPolarHBondContact CA-O 3.31Å
348	P	88.7	Confident	89.3	Confident	75 Å²	75	79.4 Å²	79.4	49%	0.487	40%	0.403	S	S	.	.			trans	-65.5	-12.4	-171.8	-22.7	34.6	0	0	0	114.9
349	H	91	Very high	89.3	Confident	56 Å²	56	78.3 Å²	78.3	26%	0.259	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	95.4	-171.8	-56	-66.7	0	0	0	110.7	K347 A357 F358 S361 L364	K347-H349 PolarHBondContact O-N 3.47Å; H349-A357 CarbonylContact O-C 3.54Å; H349-A357 WeakPolarHBondContact O-CA 3.23Å; H349-F358 HydrophobicContact CB-CB 4.46Å; H349-F358 WeakPolarHBondContact CB-O 3.48Å; H349-F358 PolarHBondContact N-O 3.33Å; H349-F358 VanDerWaalsContact N-O 3.15Å; H349-F358 PolarHBondContact O-N 3.03Å; H349-S361 PolarHBondContact CD2-N 3.43Å; H349-S361 PolarHBondContact NE2-N 3.47Å; H349-L364 HydrophobicContact CB-CB 4.06Å; H349-L364 HydrophobicContact CB-CD2 3.84Å
350	E	92.1	Very high	89.2	Confident	123 Å²	123	83 Å²	83	58%	0.575	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	136.5	-179.4	-167.5	179	166.2	0	0	112.9	G355 A357	E350-G355 WeakPolarHBondContact OE1-CA 3.33Å; E350-A357 HydrophobicContact CB-CB 4.44Å; E350-A357 HydrophobicContact CG-CB 4.46Å
351	C	93.3	Very high	89.3	Confident	0 Å²	0	82.5 Å²	82.5	0%	0	42%	0.424	C	S	.	.			trans	-79	119	173.2	-176.1	0	0	0	0	111.2	H353 C354 G355 K356 F358 L364	C351-H353 PolarHBondContact O-N 3.07Å; C351-H353 VanDerWaalsContact O-N 3.17Å; C351-C354 PolarHBondContact O-N 2.98Å; C351-G355 WeakPolarHBondContact O-CA 3.4Å; C351-G355 PolarHBondContact O-N 3.2Å; C351-K356 WeakPolarHBondContact CB-O 3.31Å; C351-K356 PolarHBondContact N-O 3.24Å; C351-F358 HydrophobicContact CB-CE2 4.4Å; C351-L364 HydrophobicContact CB-CD1 3.58Å
352	R	90.6	Very high	89.1	Confident	222 Å²	222	83 Å²	83	84%	0.838	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-21.1	179	-63.7	-178.1	177.1	172.2	-1.3	114.3
353	H	87.7	Confident	89.3	Confident	127 Å²	127	78.9 Å²	78.9	59%	0.588	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-29.2	-177.3	-66.4	-69.7	0	0	0	114.3	C351 H371	C351-H353 PolarHBondContact O-N 3.07Å; C351-H353 VanDerWaalsContact O-N 3.17Å; H353-H371 HydrophobicContact CB-CB 4.32Å; H353-H371 AromaticContact CG-CG 3.97Å
354	C	90.7	Very high	89.5	Confident	55 Å²	55	76.8 Å²	76.8	37%	0.372	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.3	6.6	-175.2	69	0	0	0	0	115	C351 K356 H367 H371	C351-C354 PolarHBondContact O-N 2.98Å; C354-K356 PolarHBondContact O-N 2.99Å; C354-K356 VanDerWaalsContact O-N 3.1Å; C354-H367 PolarHBondContact SG-NE2 2.96Å; C354-H371 PolarHBondContact SG-NE2 3.3Å
355	G	87.1	Confident	89.6	Confident	41 Å²	41	77.4 Å²	77.4	42%	0.423	41%	0.41	S	S	.	.			trans	67.3	5.6	-179.9	0	0	0	0	0	114.4	E350 C351 A357	E350-G355 WeakPolarHBondContact OE1-CA 3.33Å; C351-G355 WeakPolarHBondContact O-CA 3.4Å; C351-G355 PolarHBondContact O-N 3.2Å; G355-A357 PolarHBondContact O-N 3.44Å
356	K	90.3	Very high	89.7	Confident	124 Å²	124	79.1 Å²	79.1	54%	0.539	41%	0.406	S	S	.	.			trans	-73.1	122.5	179	-73.7	-177.9	-178.1	177.2	0	110.2	C351 C354 F358	C351-K356 WeakPolarHBondContact CB-O 3.31Å; C351-K356 PolarHBondContact N-O 3.24Å; C354-K356 PolarHBondContact O-N 2.99Å; C354-K356 VanDerWaalsContact O-N 3.1Å; K356-F358 HydrophobicContact CB-CE2 3.99Å; K356-F358 HydrophobicContact CB-CZ 4.16Å; K356-F358 WeakPolarHBondContact O-CD2 3.41Å; K356-F358 VanDerWaalsContact O-CE2 3.27Å; K356-F358 WeakPolarHBondContact O-CE2 3.36Å
357	A	91.6	Very high	89.9	Confident	36 Å²	36	75 Å²	75	30%	0.298	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	144.1	178.2	0	0	0	0	0	113	K347 H349 E350 G355	K347-A357 HydrophobicContact CB-CB 3.49Å; K347-A357 VanDerWaalsContact CB-CB 3.49Å; K347-A357 HydrophobicContact CD-CB 4.15Å; K347-A357 WeakPolarHBondContact CD-O 3.43Å; K347-A357 HydrophobicContact CG-CB 4.43Å; H349-A357 CarbonylContact O-C 3.54Å; H349-A357 WeakPolarHBondContact O-CA 3.23Å; E350-A357 HydrophobicContact CB-CB 4.44Å; E350-A357 HydrophobicContact CG-CB 4.46Å; G355-A357 PolarHBondContact O-N 3.44Å
358	F	90.1	Very high	89.9	Confident	45 Å²	45	72 Å²	72	20%	0.197	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147	-177.8	-60.8	-89	0	0	0	111.3	K347 H349 C351 K356 R360 L364 H367	K347-F358 CarbonylContact C-O 3.56Å; K347-F358 WeakPolarHBondContact CA-O 3.31Å; H349-F358 HydrophobicContact CB-CB 4.46Å; H349-F358 WeakPolarHBondContact CB-O 3.48Å; H349-F358 PolarHBondContact N-O 3.33Å; H349-F358 VanDerWaalsContact N-O 3.15Å; H349-F358 PolarHBondContact O-N 3.03Å; C351-F358 HydrophobicContact CB-CE2 4.4Å; K356-F358 HydrophobicContact CB-CE2 3.99Å; K356-F358 HydrophobicContact CB-CZ 4.16Å; K356-F358 WeakPolarHBondContact O-CD2 3.41Å; K356-F358 VanDerWaalsContact O-CE2 3.27Å; K356-F358 WeakPolarHBondContact O-CE2 3.36Å; F358-R360 VanDerWaalsContact C-N 3.3Å; F358-R360 PolarHBondContact O-N 3.1Å; F358-L364 HydrophobicContact CB-CB 4.36Å; F358-L364 HydrophobicContact CD2-CB 3.96Å; F358-L364 HydrophobicContact CD2-CD1 3.84Å; F358-L364 HydrophobicContact CE2-CD1 4.05Å; F358-L364 HydrophobicContact CG-CB 4.36Å; F358-H367 HydrophobicContact CE1-CB 4.01Å; F358-H367 HydrophobicContact CE2-CB 3.76Å; F358-H367 AromaticContact CE2-CD2 3.41Å; F358-H367 VanDerWaalsContact CE2-CD2 3.41Å; F358-H367 WeakPolarHBondContact CE2-CD2 3.49Å; F358-H367 AromaticContact CE2-CG 3.55Å; F358-H367 HydrophobicContact CZ-CB 3.41Å; F358-H367 VanDerWaalsContact CZ-CB 3.41Å; F358-H367 AromaticContact CZ-CD2 3.51Å; F358-H367 AromaticContact CZ-CG 3.19Å; F358-H367 AromaticContact CZ-ND1 3.6Å
359	S	88	Confident	90	Very high	41 Å²	41	71.5 Å²	71.5	29%	0.287	36%	0.363	S	S	.	.	S	Bend	trans	-78.8	-12.7	177	58.6	0	0	0	0	113.6	R341	R341-S359 PolarHBondContact NH1-O 2.86Å
360	R	87.9	Confident	89.9	Confident	114 Å²	114	74.7 Å²	74.7	43%	0.43	38%	0.381	S	S	.	.	S	Bend	trans	-132.9	136.9	180	-57.7	-179.2	179.8	161.8	-5.3	110.7	Q338 F358 S362 S363 L364	Q338-R360 HydrophobicContact CG-CG 4.44Å; Q338-R360 VanDerWaalsContact NE2-NE 3.11Å; F358-R360 VanDerWaalsContact C-N 3.3Å; F358-R360 PolarHBondContact O-N 3.1Å; R360-S362 VanDerWaalsContact C-N 3.32Å; R360-S362 PolarHBondContact O-N 3.27Å; R360-S363 WeakPolarHBondContact O-CB 3.24Å; R360-S363 PolarHBondContact O-N 3.42Å; R360-S363 VanDerWaalsContact O-N 3.17Å; R360-L364 PolarHBondContact O-N 3.35Å
361	S	88.8	Confident	89.8	Confident	64 Å²	64	72.5 Å²	72.5	45%	0.448	37%	0.37	S	S	.	.	H	α-helix	trans	-61.7	-38.6	176.3	57.8	0	0	0	0	112.6	H349 S363 L364 I365	H349-S361 PolarHBondContact CD2-N 3.43Å; H349-S361 PolarHBondContact NE2-N 3.47Å; S361-S363 VanDerWaalsContact C-N 3.25Å; S361-S363 PolarHBondContact O-N 2.81Å; S361-L364 WeakPolarHBondContact O-CB 3.47Å; S361-L364 PolarHBondContact O-N 2.77Å; S361-L364 VanDerWaalsContact O-N 3.13Å; S361-I365 WeakPolarHBondContact O-CG1 3.4Å; S361-I365 PolarHBondContact O-N 3.16Å
362	S	87.5	Confident	89.6	Confident	77 Å²	77	76.2 Å²	76.2	54%	0.538	39%	0.393	S	S	.	.	H	α-helix	trans	-62.2	-32.8	176.4	56.6	0	0	0	0	113	R360 Q366	R360-S362 VanDerWaalsContact C-N 3.32Å; R360-S362 PolarHBondContact O-N 3.27Å; S362-Q366 WeakPolarHBondContact O-CB 3.36Å; S362-Q366 PolarHBondContact O-N 3.48Å
363	S	90.8	Very high	89.5	Confident	36 Å²	36	67.9 Å²	67.9	25%	0.252	38%	0.376	S	S	.	.	H	α-helix	trans	-71.2	-38.1	174.3	-62.1	0	0	0	0	111.8	R360 S361 Q366 H367	R360-S363 WeakPolarHBondContact O-CB 3.24Å; R360-S363 PolarHBondContact O-N 3.42Å; R360-S363 VanDerWaalsContact O-N 3.17Å; S361-S363 VanDerWaalsContact C-N 3.25Å; S361-S363 PolarHBondContact O-N 2.81Å; S363-Q366 PolarHBondContact O-N 3.15Å; S363-H367 VanDerWaalsContact O-CB 3.31Å; S363-H367 WeakPolarHBondContact O-CB 3.47Å; S363-H367 PolarHBondContact O-N 3.5Å
364	L	92.1	Very high	89.5	Confident	22 Å²	22	67.4 Å²	67.4	12%	0.115	37%	0.374	C	S	.	.	H	α-helix	trans	-62.1	-51.4	172.6	172.1	62.1	0	0	0	111.1	H349 C351 F358 R360 S361 Q366 H367 E368	H349-L364 HydrophobicContact CB-CB 4.06Å; H349-L364 HydrophobicContact CB-CD2 3.84Å; C351-L364 HydrophobicContact CB-CD1 3.58Å; F358-L364 HydrophobicContact CB-CB 4.36Å; F358-L364 HydrophobicContact CD2-CB 3.96Å; F358-L364 HydrophobicContact CD2-CD1 3.84Å; F358-L364 HydrophobicContact CE2-CD1 4.05Å; F358-L364 HydrophobicContact CG-CB 4.36Å; R360-L364 PolarHBondContact O-N 3.35Å; S361-L364 WeakPolarHBondContact O-CB 3.47Å; S361-L364 PolarHBondContact O-N 2.77Å; S361-L364 VanDerWaalsContact O-N 3.13Å; L364-Q366 PolarHBondContact O-N 3.44Å; L364-H367 CarbonylContact O-C 3.54Å; L364-H367 WeakPolarHBondContact O-CA 3.48Å; L364-H367 WeakPolarHBondContact O-CB 3.4Å; L364-H367 PolarHBondContact O-N 2.84Å; L364-E368 HydrophobicContact CD1-CG 4.04Å; L364-E368 HydrophobicContact CG-CG 4.41Å; L364-E368 WeakPolarHBondContact O-CG 2.86Å; L364-E368 PolarHBondContact O-N 3.04Å
365	I	88.3	Confident	89.5	Confident	92 Å²	92	70.4 Å²	70.4	47%	0.472	38%	0.381	S	S	.	.	H	α-helix	trans	-57.5	-40.6	178.8	-66	166.4	0	0	0	111	S361 H367	S361-I365 WeakPolarHBondContact O-CG1 3.4Å; S361-I365 PolarHBondContact O-N 3.16Å; I365-H367 VanDerWaalsContact C-N 3.34Å
366	Q	89.3	Confident	89.6	Confident	80 Å²	80	71.8 Å²	71.8	37%	0.374	38%	0.383	S	S	.	.	H	α-helix	trans	-65.9	-37.8	175.5	178.1	177.5	82.6	0	0	112.3	S362 S363 L364 R369 Q388	S362-Q366 WeakPolarHBondContact O-CB 3.36Å; S362-Q366 PolarHBondContact O-N 3.48Å; S363-Q366 PolarHBondContact O-N 3.15Å; L364-Q366 PolarHBondContact O-N 3.44Å; Q366-R369 WeakPolarHBondContact O-CB 3.28Å; Q366-Q388 HydrophobicContact CG-CG 4.33Å
367	H	91.4	Very high	89.7	Confident	21 Å²	21	68.5 Å²	68.5	10%	0.097	37%	0.369	C	S	.	.	H	α-helix	trans	-68.7	-39.3	177.3	172.4	71.2	0	0	0	112.4	C354 F358 S363 L364 I365 R369 I370 H371	C354-H367 PolarHBondContact SG-NE2 2.96Å; F358-H367 HydrophobicContact CE1-CB 4.01Å; F358-H367 HydrophobicContact CE2-CB 3.76Å; F358-H367 AromaticContact CE2-CD2 3.41Å; F358-H367 VanDerWaalsContact CE2-CD2 3.41Å; F358-H367 WeakPolarHBondContact CE2-CD2 3.49Å; F358-H367 AromaticContact CE2-CG 3.55Å; F358-H367 HydrophobicContact CZ-CB 3.41Å; F358-H367 VanDerWaalsContact CZ-CB 3.41Å; F358-H367 AromaticContact CZ-CD2 3.51Å; F358-H367 AromaticContact CZ-CG 3.19Å; F358-H367 AromaticContact CZ-ND1 3.6Å; S363-H367 VanDerWaalsContact O-CB 3.31Å; S363-H367 WeakPolarHBondContact O-CB 3.47Å; S363-H367 PolarHBondContact O-N 3.5Å; L364-H367 CarbonylContact O-C 3.54Å; L364-H367 WeakPolarHBondContact O-CA 3.48Å; L364-H367 WeakPolarHBondContact O-CB 3.4Å; L364-H367 PolarHBondContact O-N 2.84Å; I365-H367 VanDerWaalsContact C-N 3.34Å; H367-R369 PolarHBondContact O-N 3.35Å; H367-R369 VanDerWaalsContact O-N 3.13Å; H367-I370 VanDerWaalsContact O-CB 3.23Å; H367-I370 WeakPolarHBondContact O-CB 3.44Å; H367-I370 VanDerWaalsContact O-CG1 3.31Å; H367-I370 WeakPolarHBondContact O-CG1 3.44Å; H367-I370 PolarHBondContact O-N 3.5Å; H367-H371 AromaticContact NE2-CD2 3.99Å; H367-H371 AromaticContact NE2-NE2 3.44Å; H367-H371 PolarHBondContact NE2-NE2 3.14Å
368	E	89.9	Confident	89.6	Confident	61 Å²	61	73.6 Å²	73.6	29%	0.285	39%	0.385	S	S	.	.	H	α-helix	trans	-58.2	-27.7	178.2	-74	176.3	152.9	0	0	112.6	L364 I370 H371 T372	L364-E368 HydrophobicContact CD1-CG 4.04Å; L364-E368 HydrophobicContact CG-CG 4.41Å; L364-E368 WeakPolarHBondContact O-CG 2.86Å; L364-E368 PolarHBondContact O-N 3.04Å; E368-I370 PolarHBondContact O-N 2.97Å; E368-I370 VanDerWaalsContact O-N 3.1Å; E368-H371 WeakPolarHBondContact O-CB 3.48Å; E368-H371 PolarHBondContact O-N 2.93Å; E368-T372 PolarHBondContact O-N 3.04Å; E368-T372 PolarHBondContact O-OG1 2.98Å
369	R	91.1	Very high	89.7	Confident	65 Å²	65	71.5 Å²	71.5	25%	0.245	38%	0.376	C	S	.	.	H	α-helix	trans	-59.9	-20.3	172.5	-61.2	178.4	-173.5	-175.9	-2.5	113.8	Q366 H367 T372 G373 E374 S387	Q366-R369 WeakPolarHBondContact O-CB 3.28Å; H367-R369 PolarHBondContact O-N 3.35Å; H367-R369 VanDerWaalsContact O-N 3.13Å; R369-T372 WeakPolarHBondContact CA-OG1 3.22Å; R369-G373 WeakPolarHBondContact O-CA 3.36Å; R369-G373 PolarHBondContact O-N 2.93Å; R369-E374 PolarHBondContact O-N 2.91Å; R369-S387 PolarHBondContact NH1-O 3.42Å
370	I	89.9	Confident	89.8	Confident	122 Å²	122	77 Å²	77	63%	0.626	40%	0.402	S	S	*	.	H	α-helix	trans	-71.6	-35.5	173.9	-57.7	175.8	0	0	0	110.3	H367 E368	H367-I370 VanDerWaalsContact O-CB 3.23Å; H367-I370 WeakPolarHBondContact O-CB 3.44Å; H367-I370 VanDerWaalsContact O-CG1 3.31Å; H367-I370 WeakPolarHBondContact O-CG1 3.44Å; H367-I370 PolarHBondContact O-N 3.5Å; E368-I370 PolarHBondContact O-N 2.97Å; E368-I370 VanDerWaalsContact O-N 3.1Å
371	H	90.1	Very high	89.9	Confident	77 Å²	77	77.5 Å²	77.5	36%	0.356	41%	0.409	S	S	.	.	H	α-helix	trans	-79.9	-43.5	179.2	-66.1	-64.4	0	0	0	112	H353 C354 H367 E368 G373	H353-H371 HydrophobicContact CB-CB 4.32Å; H353-H371 AromaticContact CG-CG 3.97Å; C354-H371 PolarHBondContact SG-NE2 3.3Å; H367-H371 AromaticContact NE2-CD2 3.99Å; H367-H371 AromaticContact NE2-NE2 3.44Å; H367-H371 PolarHBondContact NE2-NE2 3.14Å; E368-H371 WeakPolarHBondContact O-CB 3.48Å; E368-H371 PolarHBondContact O-N 2.93Å; H371-G373 VanDerWaalsContact C-N 3.31Å
372	T	88.4	Confident	90	Very high	78 Å²	78	77 Å²	77	48%	0.479	41%	0.405	S	S	.	.	H	α-helix	trans	-77.9	-18.6	179.4	63.1	0	0	0	0	112.9	E368 R369 E374	E368-T372 PolarHBondContact O-N 3.04Å; E368-T372 PolarHBondContact O-OG1 2.98Å; R369-T372 WeakPolarHBondContact CA-OG1 3.22Å; T372-E374 PolarHBondContact O-N 3.35Å; T372-E374 WeakPolarHBondContact OG1-CG 3.46Å; T372-E374 PolarHBondContact OG1-N 3.46Å
373	G	88	Confident	90	Very high	47 Å²	47	76 Å²	76	49%	0.485	41%	0.407	S	S	.	.			trans	70.4	7.2	-174	0	0	0	0	0	113.8	R369 H371 K375	R369-G373 WeakPolarHBondContact O-CA 3.36Å; R369-G373 PolarHBondContact O-N 2.93Å; H371-G373 VanDerWaalsContact C-N 3.31Å; G373-K375 PolarHBondContact O-N 2.94Å
374	E	89.2	Confident	90	Very high	117 Å²	117	80.2 Å²	80.2	55%	0.547	42%	0.421	S	S	.	.			trans	-61.1	126.3	-178.9	-76.6	-176.5	179.4	0	0	111.8	R369 T372	R369-E374 PolarHBondContact O-N 2.91Å; T372-E374 PolarHBondContact O-N 3.35Å; T372-E374 WeakPolarHBondContact OG1-CG 3.46Å; T372-E374 PolarHBondContact OG1-N 3.46Å
375	K	90.9	Very high	90	Very high	118 Å²	118	80.5 Å²	80.5	51%	0.513	43%	0.427	S	S	.	.			trans	-127.8	79.7	178.3	-71.1	166.1	174.5	-175.8	0	109.8	G373 H377 A385 F386	G373-K375 PolarHBondContact O-N 2.94Å; K375-H377 PolarHBondContact O-N 2.89Å; K375-A385 HydrophobicContact CB-CB 3.5Å; K375-A385 HydrophobicContact CD-CB 4.15Å; K375-A385 WeakPolarHBondContact CD-O 3.37Å; K375-A385 HydrophobicContact CG-CB 4.42Å; K375-F386 CarbonylContact C-O 3.54Å; K375-F386 WeakPolarHBondContact CA-O 3.36Å
376	P	88.9	Confident	90.1	Very high	71 Å²	71	78.3 Å²	78.3	46%	0.461	41%	0.414	S	S	.	.			trans	-64.3	-22.6	-173.4	-23	34.6	0	0	0	113.9
377	H	90.9	Very high	90	Very high	55 Å²	55	76.3 Å²	76.3	26%	0.255	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	94.9	-170.7	-56.1	-70.9	0	0	0	110.6	K375 A385 F386 S389 L392	K375-H377 PolarHBondContact O-N 2.89Å; H377-A385 CarbonylContact O-C 3.19Å; H377-A385 WeakPolarHBondContact O-CA 3.42Å; H377-F386 HydrophobicContact CB-CB 4.49Å; H377-F386 PolarHBondContact N-O 2.97Å; H377-F386 VanDerWaalsContact N-O 3.12Å; H377-F386 PolarHBondContact O-N 3.42Å; H377-S389 PolarHBondContact CD2-N 3.13Å; H377-S389 PolarHBondContact NE2-N 3.42Å; H377-L392 HydrophobicContact CB-CB 4.04Å; H377-L392 HydrophobicContact CB-CD2 3.84Å
378	K	90.1	Very high	89.9	Confident	143 Å²	143	78.1 Å²	78.1	62%	0.622	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	137.9	-179.7	-61	-174.9	-179.6	179.6	0	111.5	A385	K378-A385 HydrophobicContact CG-CB 3.87Å
379	C	93.1	Very high	89.7	Confident	1 Å²	1	78.7 Å²	78.7	1%	0.007	43%	0.428	C	S	.	.			trans	-83.1	121.4	170.9	-175.5	0	0	0	0	109.9	Q381 G383 K384 F386 L392	C379-Q381 PolarHBondContact O-N 3.26Å; C379-G383 VanDerWaalsContact O-CA 3.23Å; C379-G383 WeakPolarHBondContact O-CA 3.45Å; C379-G383 PolarHBondContact O-N 3.32Å; C379-K384 VanDerWaalsContact CB-O 3.31Å; C379-K384 WeakPolarHBondContact CB-O 3.37Å; C379-K384 PolarHBondContact N-O 3.42Å; C379-F386 HydrophobicContact CB-CE2 4.47Å; C379-L392 HydrophobicContact CB-CD1 3.57Å
380	N	90.4	Very high	89.5	Confident	156 Å²	156	78.4 Å²	78.4	83%	0.834	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-19.8	-178.8	-63.2	-15.4	0	0	0	113.3
381	Q	89.4	Confident	89.4	Confident	125 Å²	125	74.5 Å²	74.5	58%	0.584	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-31.8	-175.6	-62.7	-175.8	24.1	0	0	114	C379	C379-Q381 PolarHBondContact O-N 3.26Å
382	C	91	Very high	89.4	Confident	52 Å²	52	72 Å²	72	35%	0.351	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.4	6	-179.5	67.6	0	0	0	0	114.5	K384 H395 H399	C382-K384 PolarHBondContact O-N 3.17Å; C382-K384 VanDerWaalsContact SG-CG 3.58Å; C382-H395 PolarHBondContact SG-NE2 3.33Å; C382-H399 PolarHBondContact SG-NE2 3.43Å
383	G	88.1	Confident	89.3	Confident	58 Å²	58	74.6 Å²	74.6	60%	0.598	41%	0.413	S	S	*	.			trans	69.1	-4.8	-179.4	0	0	0	0	0	115.1	C379 A385	C379-G383 VanDerWaalsContact O-CA 3.23Å; C379-G383 WeakPolarHBondContact O-CA 3.45Å; C379-G383 PolarHBondContact O-N 3.32Å; G383-A385 PolarHBondContact O-N 3.28Å
384	K	90.3	Very high	89.1	Confident	124 Å²	124	75.2 Å²	75.2	54%	0.539	41%	0.405	S	S	.	.			trans	-65.3	130.4	-179.2	-69.7	-178.8	-176.4	178	0	110.7	C379 C382 F386	C379-K384 VanDerWaalsContact CB-O 3.31Å; C379-K384 WeakPolarHBondContact CB-O 3.37Å; C379-K384 PolarHBondContact N-O 3.42Å; C382-K384 PolarHBondContact O-N 3.17Å; C382-K384 VanDerWaalsContact SG-CG 3.58Å; K384-F386 HydrophobicContact CB-CE2 3.99Å; K384-F386 HydrophobicContact CB-CZ 4.14Å; K384-F386 WeakPolarHBondContact O-CE2 3.44Å
385	A	91.5	Very high	89.1	Confident	28 Å²	28	70.8 Å²	70.8	23%	0.231	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	143.5	-179.4	0	0	0	0	0	111.7	K375 H377 K378 G383	K375-A385 HydrophobicContact CB-CB 3.5Å; K375-A385 HydrophobicContact CD-CB 4.15Å; K375-A385 WeakPolarHBondContact CD-O 3.37Å; K375-A385 HydrophobicContact CG-CB 4.42Å; H377-A385 CarbonylContact O-C 3.19Å; H377-A385 WeakPolarHBondContact O-CA 3.42Å; K378-A385 HydrophobicContact CG-CB 3.87Å; G383-A385 PolarHBondContact O-N 3.28Å
386	F	89.9	Confident	88.8	Confident	46 Å²	46	68 Å²	68	20%	0.202	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148	-178.3	-59.4	-89.2	0	0	0	110.9	K375 H377 C379 K384 Q388 L392 H395	K375-F386 CarbonylContact C-O 3.54Å; K375-F386 WeakPolarHBondContact CA-O 3.36Å; H377-F386 HydrophobicContact CB-CB 4.49Å; H377-F386 PolarHBondContact N-O 2.97Å; H377-F386 VanDerWaalsContact N-O 3.12Å; H377-F386 PolarHBondContact O-N 3.42Å; C379-F386 HydrophobicContact CB-CE2 4.47Å; K384-F386 HydrophobicContact CB-CE2 3.99Å; K384-F386 HydrophobicContact CB-CZ 4.14Å; K384-F386 WeakPolarHBondContact O-CE2 3.44Å; F386-Q388 VanDerWaalsContact C-N 3.28Å; F386-L392 HydrophobicContact CB-CB 4.38Å; F386-L392 HydrophobicContact CD2-CB 3.98Å; F386-L392 HydrophobicContact CD2-CD1 3.8Å; F386-L392 HydrophobicContact CE2-CD1 4.02Å; F386-L392 HydrophobicContact CG-CB 4.39Å; F386-H395 HydrophobicContact CE1-CB 4.06Å; F386-H395 HydrophobicContact CE2-CB 3.77Å; F386-H395 AromaticContact CE2-CD2 3.4Å; F386-H395 WeakPolarHBondContact CE2-CD2 3.33Å; F386-H395 AromaticContact CE2-CG 3.56Å; F386-H395 HydrophobicContact CZ-CB 3.46Å; F386-H395 VanDerWaalsContact CZ-CB 3.46Å; F386-H395 AromaticContact CZ-CD2 3.48Å; F386-H395 VanDerWaalsContact CZ-CD2 3.48Å; F386-H395 WeakPolarHBondContact CZ-CD2 3.45Å; F386-H395 AromaticContact CZ-CG 3.21Å; F386-H395 AromaticContact CZ-ND1 3.65Å; F386-H395 AromaticContact CZ-NE2 3.99Å
387	S	88.2	Confident	88.7	Confident	38 Å²	38	66.4 Å²	66.4	27%	0.266	36%	0.358	S	S	.	.	S	Bend	trans	-77.1	-14.1	176.8	56.6	0	0	0	0	112.9	R369	R369-S387 PolarHBondContact NH1-O 3.42Å
388	Q	88.1	Confident	88.5	Confident	58 Å²	58	68.8 Å²	68.8	27%	0.271	38%	0.376	S	S	.	.	S	Bend	trans	-134.3	142.7	180	-53	-179.9	15	0	0	111	Q366 F386 S390 S391 L392	Q366-Q388 HydrophobicContact CG-CG 4.33Å; F386-Q388 VanDerWaalsContact C-N 3.28Å; Q388-S390 VanDerWaalsContact C-N 3.34Å; Q388-S390 PolarHBondContact O-N 2.96Å; Q388-S390 PolarHBondContact OE1-OG 3.2Å; Q388-S391 PolarHBondContact O-N 3.43Å; Q388-L392 PolarHBondContact O-N 3.5Å
389	S	86.9	Confident	88.4	Confident	74 Å²	74	65.1 Å²	65.1	52%	0.517	36%	0.361	S	S	.	.	H	α-helix	trans	-65.4	-36.5	177.4	55.4	0	0	0	0	112.4	H377 S391 L392 F393	H377-S389 PolarHBondContact CD2-N 3.13Å; H377-S389 PolarHBondContact NE2-N 3.42Å; S389-S391 VanDerWaalsContact C-N 3.31Å; S389-S391 PolarHBondContact O-N 3.3Å; S389-L392 WeakPolarHBondContact O-CB 3.49Å; S389-L392 PolarHBondContact O-N 2.88Å; S389-F393 PolarHBondContact O-N 3.12Å
390	S	86.1	Confident	88	Confident	58 Å²	58	68.8 Å²	68.8	41%	0.406	38%	0.383	S	S	.	.	H	α-helix	trans	-59.8	-40.8	174.7	54	0	0	0	0	111.9	Q388 F393 L394	Q388-S390 VanDerWaalsContact C-N 3.34Å; Q388-S390 PolarHBondContact O-N 2.96Å; Q388-S390 PolarHBondContact OE1-OG 3.2Å; S390-F393 PolarHBondContact O-N 3.2Å; S390-L394 WeakPolarHBondContact O-CB 3.36Å; S390-L394 VanDerWaalsContact O-CG 3.29Å; S390-L394 WeakPolarHBondContact O-CG 3.28Å; S390-L394 PolarHBondContact O-N 3.22Å
391	S	87.8	Confident	87.7	Confident	40 Å²	40	63.6 Å²	63.6	28%	0.28	37%	0.367	S	S	.	.	H	α-helix	trans	-66.2	-39.1	175.6	-54.3	0	0	0	0	112	Q388 S389 L394 H395	Q388-S391 PolarHBondContact O-N 3.43Å; S389-S391 VanDerWaalsContact C-N 3.31Å; S389-S391 PolarHBondContact O-N 3.3Å; S391-L394 PolarHBondContact O-N 2.94Å; S391-H395 VanDerWaalsContact O-CB 3.28Å; S391-H395 WeakPolarHBondContact O-CB 3.45Å; S391-H395 PolarHBondContact O-N 3.4Å
392	L	89.9	Confident	87.5	Confident	26 Å²	26	62.9 Å²	62.9	14%	0.136	36%	0.363	C	S	.	.	H	α-helix	trans	-63.1	-48	173.1	173.9	63	0	0	0	111.2	H377 C379 F386 Q388 S389 L394 H395 H396	H377-L392 HydrophobicContact CB-CB 4.04Å; H377-L392 HydrophobicContact CB-CD2 3.84Å; C379-L392 HydrophobicContact CB-CD1 3.57Å; F386-L392 HydrophobicContact CB-CB 4.38Å; F386-L392 HydrophobicContact CD2-CB 3.98Å; F386-L392 HydrophobicContact CD2-CD1 3.8Å; F386-L392 HydrophobicContact CE2-CD1 4.02Å; F386-L392 HydrophobicContact CG-CB 4.39Å; Q388-L392 PolarHBondContact O-N 3.5Å; S389-L392 WeakPolarHBondContact O-CB 3.49Å; S389-L392 PolarHBondContact O-N 2.88Å; L392-L394 VanDerWaalsContact C-N 3.32Å; L392-L394 PolarHBondContact O-N 3.48Å; L392-H395 WeakPolarHBondContact O-CA 3.45Å; L392-H395 WeakPolarHBondContact O-CB 3.31Å; L392-H395 PolarHBondContact O-N 3.19Å; L392-H396 PolarHBondContact O-CD2 3.14Å; L392-H396 PolarHBondContact O-N 2.94Å
393	F	86.1	Confident	87.4	Confident	132 Å²	132	66.2 Å²	66.2	58%	0.579	37%	0.372	S	S	*	.	H	α-helix	trans	-57.2	-44.7	176.9	176.5	-99.4	0	0	0	112.1	S389 S390 H395 H396	S389-F393 PolarHBondContact O-N 3.12Å; S390-F393 PolarHBondContact O-N 3.2Å; F393-H395 VanDerWaalsContact C-N 3.31Å; F393-H395 PolarHBondContact O-N 3.39Å; F393-H396 PolarHBondContact O-N 2.88Å
394	L	85.4	Confident	87.4	Confident	60 Å²	60	67 Å²	67	31%	0.314	37%	0.366	S	S	.	.	H	α-helix	trans	-65.8	-35.5	175.1	-71.2	170.6	0	0	0	112.3	S390 S391 L392 H396 R397 F416	S390-L394 WeakPolarHBondContact O-CB 3.36Å; S390-L394 VanDerWaalsContact O-CG 3.29Å; S390-L394 WeakPolarHBondContact O-CG 3.28Å; S390-L394 PolarHBondContact O-N 3.22Å; S391-L394 PolarHBondContact O-N 2.94Å; L392-L394 VanDerWaalsContact C-N 3.32Å; L392-L394 PolarHBondContact O-N 3.48Å; L394-H396 VanDerWaalsContact C-N 3.35Å; L394-R397 WeakPolarHBondContact O-CB 3.41Å; L394-R397 PolarHBondContact O-N 3.38Å; L394-F416 HydrophobicContact CB-CE1 3.95Å; L394-F416 HydrophobicContact CB-CZ 4.45Å; L394-F416 HydrophobicContact CD1-CE1 4.11Å; L394-F416 HydrophobicContact CD2-CD1 4.29Å; L394-F416 HydrophobicContact CD2-CE1 3.96Å; L394-F416 HydrophobicContact CG-CE1 4.22Å
395	H	87.9	Confident	87.4	Confident	24 Å²	24	64.9 Å²	64.9	11%	0.111	36%	0.355	C	S	.	.	H	α-helix	trans	-66	-35.5	176.1	175.7	64.4	0	0	0	112.6	C382 F386 S391 L392 F393 R397 V398 H399	C382-H395 PolarHBondContact SG-NE2 3.33Å; F386-H395 HydrophobicContact CE1-CB 4.06Å; F386-H395 HydrophobicContact CE2-CB 3.77Å; F386-H395 AromaticContact CE2-CD2 3.4Å; F386-H395 WeakPolarHBondContact CE2-CD2 3.33Å; F386-H395 AromaticContact CE2-CG 3.56Å; F386-H395 HydrophobicContact CZ-CB 3.46Å; F386-H395 VanDerWaalsContact CZ-CB 3.46Å; F386-H395 AromaticContact CZ-CD2 3.48Å; F386-H395 VanDerWaalsContact CZ-CD2 3.48Å; F386-H395 WeakPolarHBondContact CZ-CD2 3.45Å; F386-H395 AromaticContact CZ-CG 3.21Å; F386-H395 AromaticContact CZ-ND1 3.65Å; F386-H395 AromaticContact CZ-NE2 3.99Å; S391-H395 VanDerWaalsContact O-CB 3.28Å; S391-H395 WeakPolarHBondContact O-CB 3.45Å; S391-H395 PolarHBondContact O-N 3.4Å; L392-H395 WeakPolarHBondContact O-CA 3.45Å; L392-H395 WeakPolarHBondContact O-CB 3.31Å; L392-H395 PolarHBondContact O-N 3.19Å; F393-H395 VanDerWaalsContact C-N 3.31Å; F393-H395 PolarHBondContact O-N 3.39Å; H395-R397 PolarHBondContact O-N 3.09Å; H395-V398 VanDerWaalsContact O-CB 3.28Å; H395-V398 WeakPolarHBondContact O-CB 3.36Å; H395-V398 WeakPolarHBondContact O-CG2 3.38Å; H395-V398 PolarHBondContact O-N 3.39Å; H395-H399 AromaticContact NE2-NE2 3.35Å; H395-H399 PolarHBondContact NE2-NE2 3.14Å
396	H	85.8	Confident	87.4	Confident	58 Å²	58	66.9 Å²	66.9	27%	0.269	37%	0.365	S	S	.	.	H	α-helix	trans	-55	-28.1	176.2	-83.3	-75.5	0	0	0	113.1	L392 F393 L394 V398 H399 T400	L392-H396 PolarHBondContact O-CD2 3.14Å; L392-H396 PolarHBondContact O-N 2.94Å; F393-H396 PolarHBondContact O-N 2.88Å; L394-H396 VanDerWaalsContact C-N 3.35Å; H396-V398 PolarHBondContact O-N 3.33Å; H396-H399 WeakPolarHBondContact O-CB 3.22Å; H396-H399 PolarHBondContact O-N 3Å; H396-T400 PolarHBondContact O-N 3.17Å; H396-T400 VanDerWaalsContact O-N 3.07Å; H396-T400 PolarHBondContact O-OG1 3.22Å
397	R	86.9	Confident	87.6	Confident	39 Å²	39	64.9 Å²	64.9	15%	0.147	36%	0.356	C	S	.	.	H	α-helix	trans	-61.8	-24	174.7	-59.7	-179.2	178	-160.2	-9.3	114	L394 H395 H399 T400 G401 G415	L394-R397 WeakPolarHBondContact O-CB 3.41Å; L394-R397 PolarHBondContact O-N 3.38Å; H395-R397 PolarHBondContact O-N 3.09Å; R397-H399 VanDerWaalsContact C-N 3.27Å; R397-T400 WeakPolarHBondContact CA-OG1 3.23Å; R397-G401 WeakPolarHBondContact O-CA 3.47Å; R397-G401 PolarHBondContact O-N 3.35Å; R397-G415 PolarHBondContact NH1-O 3.34Å
398	V	85.9	Confident	87.7	Confident	104 Å²	104	70.7 Å²	70.7	63%	0.63	39%	0.385	S	S	*	.	H	α-helix	trans	-68	-33	174.5	-179.2	0	0	0	0	110.7	H395 H396	H395-V398 VanDerWaalsContact O-CB 3.28Å; H395-V398 WeakPolarHBondContact O-CB 3.36Å; H395-V398 WeakPolarHBondContact O-CG2 3.38Å; H395-V398 PolarHBondContact O-N 3.39Å; H396-V398 PolarHBondContact O-N 3.33Å
399	H	86.9	Confident	87.8	Confident	67 Å²	67	73.7 Å²	73.7	31%	0.31	40%	0.399	S	S	.	.	H	α-helix	trans	-83.5	-43.5	179.3	-64.8	-58.5	0	0	0	112.8	C382 H395 H396 R397 G401	C382-H399 PolarHBondContact SG-NE2 3.43Å; H395-H399 AromaticContact NE2-NE2 3.35Å; H395-H399 PolarHBondContact NE2-NE2 3.14Å; H396-H399 WeakPolarHBondContact O-CB 3.22Å; H396-H399 PolarHBondContact O-N 3Å; R397-H399 VanDerWaalsContact C-N 3.27Å; H399-G401 PolarHBondContact O-N 3.42Å
400	T	85.7	Confident	88	Confident	77 Å²	77	73.2 Å²	73.2	47%	0.472	39%	0.394	S	S	.	.	H	α-helix	trans	-75.8	-17.1	179.4	60.3	0	0	0	0	112.5	H396 R397 E402	H396-T400 PolarHBondContact O-N 3.17Å; H396-T400 VanDerWaalsContact O-N 3.07Å; H396-T400 PolarHBondContact O-OG1 3.22Å; R397-T400 WeakPolarHBondContact CA-OG1 3.23Å; T400-E402 PolarHBondContact O-N 3.17Å; T400-E402 WeakPolarHBondContact OG1-CG 3.26Å; T400-E402 PolarHBondContact OG1-N 3.23Å
401	G	84.4	Confident	88.1	Confident	47 Å²	47	73 Å²	73	49%	0.485	40%	0.401	S	S	.	.			trans	71.2	5.9	-175	0	0	0	0	0	113.7	R397 H399 K403	R397-G401 WeakPolarHBondContact O-CA 3.47Å; R397-G401 PolarHBondContact O-N 3.35Å; H399-G401 PolarHBondContact O-N 3.42Å; G401-K403 PolarHBondContact O-N 2.62Å
402	E	85.7	Confident	88.2	Confident	110 Å²	110	78.7 Å²	78.7	51%	0.514	42%	0.417	S	S	.	.			trans	-59.1	123.9	-179.8	-77.2	176.1	-164.7	0	0	111.4	T400	T400-E402 PolarHBondContact O-N 3.17Å; T400-E402 WeakPolarHBondContact OG1-CG 3.26Å; T400-E402 PolarHBondContact OG1-N 3.23Å
403	K	88.4	Confident	88.2	Confident	123 Å²	123	79 Å²	79	54%	0.535	42%	0.423	S	S	.	.			trans	-127.1	77.8	177.1	-70.9	168.6	177.7	176.8	0	109.9	G401 Y405 A413 F414	G401-K403 PolarHBondContact O-N 2.62Å; K403-Y405 PolarHBondContact O-N 3.28Å; K403-Y405 VanDerWaalsContact O-N 3.13Å; K403-A413 HydrophobicContact CB-CB 3.53Å; K403-A413 HydrophobicContact CD-CB 4.13Å; K403-A413 HydrophobicContact CG-CB 4.46Å; K403-F414 CarbonylContact C-O 3.28Å; K403-F414 WeakPolarHBondContact CA-O 3.45Å
404	P	87.8	Confident	88.2	Confident	73 Å²	73	74.1 Å²	74.1	47%	0.474	40%	0.402	S	S	.	.			trans	-66.5	-16.9	-172.3	-22	34.8	0	0	0	114.2
405	Y	90.6	Very high	88.2	Confident	80 Å²	80	72 Å²	72	31%	0.314	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	98.8	-172.1	-55.8	-74.5	0	0	0	110	K403 A413 F414 N417	K403-Y405 PolarHBondContact O-N 3.28Å; K403-Y405 VanDerWaalsContact O-N 3.13Å; Y405-A413 CarbonylContact O-C 3.57Å; Y405-A413 WeakPolarHBondContact O-CA 3.46Å; Y405-F414 PolarHBondContact N-O 2.72Å; Y405-F414 PolarHBondContact O-N 3.42Å; Y405-N417 HydrophobicContact CD1-CB 3.84Å; Y405-N417 HydrophobicContact CD2-CB 4.43Å; Y405-N417 VanDerWaalsContact CD2-N 3.31Å; Y405-N417 HydrophobicContact CE1-CB 3.64Å; Y405-N417 HydrophobicContact CE2-CB 4.22Å; Y405-N417 VanDerWaalsContact CE2-N 3.34Å; Y405-N417 HydrophobicContact CG-CB 4.23Å
406	V	91	Very high	88	Confident	71 Å²	71	74.2 Å²	74.2	43%	0.43	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	135.7	-178.2	-174.7	0	0	0	0	110.3	A413	V406-A413 HydrophobicContact CG2-CB 4.06Å
407	C	93.7	Very high	88.1	Confident	3 Å²	3	75.4 Å²	75.4	2%	0.02	41%	0.412	C	S	.	.			trans	-77.6	118.2	169.9	-176.9	0	0	0	0	109.6	E409 G411 R412 F414 L420 H423	C407-E409 PolarHBondContact O-N 2.94Å; C407-G411 WeakPolarHBondContact O-CA 3.46Å; C407-G411 PolarHBondContact O-N 2.85Å; C407-R412 WeakPolarHBondContact CB-O 3.45Å; C407-R412 PolarHBondContact N-O 3.22Å; C407-F414 HydrophobicContact CB-CE2 4.29Å; C407-L420 HydrophobicContact CB-CD1 3.62Å; C407-H423 VanDerWaalsContact SG-CD2 3.57Å; C407-H423 PolarHBondContact SG-NE2 3.17Å; C407-H423 VanDerWaalsContact SG-NE2 3.42Å
408	N	91.4	Very high	88	Confident	161 Å²	161	77.2 Å²	77.2	86%	0.861	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-22.7	-179.3	-65.5	-16.5	0	0	0	112.9
409	E	89.5	Confident	88.1	Confident	121 Å²	121	76.4 Å²	76.4	57%	0.565	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-32.1	-176.4	-63.2	-171	-136.5	0	0	114.4	C407 H427	C407-E409 PolarHBondContact O-N 2.94Å; E409-H427 WeakPolarHBondContact OE2-CB 3.48Å; E409-H427 IonicContact OE2-CD2 3.11Å; E409-H427 IonicContact OE2-CG 3.3Å; E409-H427 IonicContact OE2-ND1 3.49Å; E409-H427 PolarHBondContact OE2-ND1 3.13Å
410	C	91.3	Very high	88.3	Confident	63 Å²	63	74.4 Å²	74.4	43%	0.426	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	7	-179.5	67.5	0	0	0	0	114.6	R412 H423 H427	C410-R412 PolarHBondContact O-N 3.32Å; C410-R412 VanDerWaalsContact SG-CB 3.54Å; C410-H423 PolarHBondContact SG-NE2 2.88Å; C410-H427 PolarHBondContact SG-NE2 2.94Å
411	G	88	Confident	88.5	Confident	54 Å²	54	74 Å²	74	56%	0.557	41%	0.408	S	S	*	.			trans	67.2	2.2	-179.1	0	0	0	0	0	114.7	C407 A413	C407-G411 WeakPolarHBondContact O-CA 3.46Å; C407-G411 PolarHBondContact O-N 2.85Å; G411-A413 PolarHBondContact O-N 3.25Å
412	R	90.3	Very high	88.7	Confident	160 Å²	160	74.2 Å²	74.2	60%	0.604	40%	0.397	S	S	*	.			trans	-74.2	126.4	-175	-168	170.5	-177.3	168.4	3.3	111	C407 C410 F414	C407-R412 WeakPolarHBondContact CB-O 3.45Å; C407-R412 PolarHBondContact N-O 3.22Å; C410-R412 PolarHBondContact O-N 3.32Å; C410-R412 VanDerWaalsContact SG-CB 3.54Å; R412-F414 HydrophobicContact CB-CE2 4.07Å; R412-F414 HydrophobicContact CB-CZ 4.29Å; R412-F414 HydrophobicContact CG-CE2 4Å; R412-F414 HydrophobicContact CG-CZ 3.86Å; R412-F414 WeakPolarHBondContact O-CD2 3.19Å; R412-F414 VanDerWaalsContact O-CE2 3.27Å; R412-F414 WeakPolarHBondContact O-CE2 3.2Å
413	A	89.3	Confident	88.9	Confident	32 Å²	32	69.9 Å²	69.9	26%	0.264	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	144.5	-179.7	0	0	0	0	0	113.1	K403 Y405 V406 G411	K403-A413 HydrophobicContact CB-CB 3.53Å; K403-A413 HydrophobicContact CD-CB 4.13Å; K403-A413 HydrophobicContact CG-CB 4.46Å; Y405-A413 CarbonylContact O-C 3.57Å; Y405-A413 WeakPolarHBondContact O-CA 3.46Å; V406-A413 HydrophobicContact CG2-CB 4.06Å; G411-A413 PolarHBondContact O-N 3.25Å
414	F	86.4	Confident	89	Confident	30 Å²	30	66.2 Å²	66.2	13%	0.132	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	146.6	-178.5	-60.1	-90.2	0	0	0	111.4	K403 Y405 C407 R412 F416 H419 L420 H423	K403-F414 CarbonylContact C-O 3.28Å; K403-F414 WeakPolarHBondContact CA-O 3.45Å; Y405-F414 PolarHBondContact N-O 2.72Å; Y405-F414 PolarHBondContact O-N 3.42Å; C407-F414 HydrophobicContact CB-CE2 4.29Å; R412-F414 HydrophobicContact CB-CE2 4.07Å; R412-F414 HydrophobicContact CB-CZ 4.29Å; R412-F414 HydrophobicContact CG-CE2 4Å; R412-F414 HydrophobicContact CG-CZ 3.86Å; R412-F414 WeakPolarHBondContact O-CD2 3.19Å; R412-F414 VanDerWaalsContact O-CE2 3.27Å; R412-F414 WeakPolarHBondContact O-CE2 3.2Å; F414-F416 VanDerWaalsContact C-N 3.3Å; F414-F416 PolarHBondContact O-N 3.05Å; F414-H419 HydrophobicContact CB-CB 4.31Å; F414-H419 HydrophobicContact CD1-CB 3.93Å; F414-H419 HydrophobicContact CG-CB 4.37Å; F414-L420 HydrophobicContact CB-CB 4.41Å; F414-L420 HydrophobicContact CD2-CB 4.04Å; F414-L420 HydrophobicContact CD2-CD1 3.89Å; F414-L420 HydrophobicContact CE2-CD1 4.08Å; F414-L420 HydrophobicContact CG-CB 4.4Å; F414-H423 HydrophobicContact CE1-CB 4.02Å; F414-H423 HydrophobicContact CE2-CB 3.91Å; F414-H423 AromaticContact CE2-CD2 3.4Å; F414-H423 VanDerWaalsContact CE2-CD2 3.4Å; F414-H423 WeakPolarHBondContact CE2-CD2 3.3Å; F414-H423 AromaticContact CE2-CG 3.61Å; F414-H423 AromaticContact CE2-NE2 4Å; F414-H423 HydrophobicContact CZ-CB 3.48Å; F414-H423 VanDerWaalsContact CZ-CB 3.48Å; F414-H423 AromaticContact CZ-CD2 3.51Å; F414-H423 AromaticContact CZ-CG 3.22Å; F414-H423 AromaticContact CZ-ND1 3.61Å; F414-H423 AromaticContact CZ-NE2 3.99Å
415	G	84.4	Confident	89.1	Confident	14 Å²	14	65.2 Å²	65.2	14%	0.144	35%	0.351	C	S	.	.	S	Bend	trans	-75.6	-16.7	176.1	0	0	0	0	0	114.1	R397	R397-G415 PolarHBondContact NH1-O 3.34Å
416	F	84	Confident	89.1	Confident	72 Å²	72	65.6 Å²	65.6	32%	0.316	36%	0.357	S	S	.	.	S	Bend	trans	-134	138.1	-175.6	-58.1	-86.8	0	0	0	111.5	L394 F414 S418 H419 L420	L394-F416 HydrophobicContact CB-CE1 3.95Å; L394-F416 HydrophobicContact CB-CZ 4.45Å; L394-F416 HydrophobicContact CD1-CE1 4.11Å; L394-F416 HydrophobicContact CD2-CD1 4.29Å; L394-F416 HydrophobicContact CD2-CE1 3.96Å; L394-F416 HydrophobicContact CG-CE1 4.22Å; F414-F416 VanDerWaalsContact C-N 3.3Å; F414-F416 PolarHBondContact O-N 3.05Å; F416-S418 VanDerWaalsContact C-N 3.3Å; F416-S418 PolarHBondContact O-N 3.1Å; F416-H419 HydrophobicContact CB-CB 4.4Å; F416-H419 AromaticContact CD2-CE1 3.51Å; F416-H419 AromaticContact CD2-ND1 3.53Å; F416-H419 PolarHBondContact O-N 3.46Å; F416-L420 PolarHBondContact O-N 3.25Å
417	N	87.4	Confident	89	Confident	83 Å²	83	65.5 Å²	65.5	44%	0.444	35%	0.352	S	S	.	.	H	α-helix	trans	-63.8	-35.3	177.7	-170.8	36.9	0	0	0	112.7	Y405 H419 L420 T421	Y405-N417 HydrophobicContact CD1-CB 3.84Å; Y405-N417 HydrophobicContact CD2-CB 4.43Å; Y405-N417 VanDerWaalsContact CD2-N 3.31Å; Y405-N417 HydrophobicContact CE1-CB 3.64Å; Y405-N417 HydrophobicContact CE2-CB 4.22Å; Y405-N417 VanDerWaalsContact CE2-N 3.34Å; Y405-N417 HydrophobicContact CG-CB 4.23Å; N417-H419 VanDerWaalsContact C-N 3.27Å; N417-H419 PolarHBondContact O-N 3Å; N417-L420 PolarHBondContact O-N 2.92Å; N417-T421 WeakPolarHBondContact O-CB 3.35Å; N417-T421 PolarHBondContact O-N 2.81Å; N417-T421 PolarHBondContact O-OG1 3.5Å
418	S	86.6	Confident	88.7	Confident	76 Å²	76	68.8 Å²	68.8	53%	0.531	37%	0.372	S	S	.	.	H	α-helix	trans	-60.2	-38	176.3	52.9	0	0	0	0	112.1	F416 E422	F416-S418 VanDerWaalsContact C-N 3.3Å; F416-S418 PolarHBondContact O-N 3.1Å; S418-E422 WeakPolarHBondContact O-CB 3.3Å; S418-E422 PolarHBondContact O-N 3.33Å
419	H	87.6	Confident	88.5	Confident	88 Å²	88	62.9 Å²	62.9	41%	0.407	35%	0.349	S	S	.	.	H	α-helix	trans	-71.6	-37.8	176.6	-63.2	172.4	0	0	0	111.9	F414 F416 N417 H423	F414-H419 HydrophobicContact CB-CB 4.31Å; F414-H419 HydrophobicContact CD1-CB 3.93Å; F414-H419 HydrophobicContact CG-CB 4.37Å; F416-H419 HydrophobicContact CB-CB 4.4Å; F416-H419 AromaticContact CD2-CE1 3.51Å; F416-H419 AromaticContact CD2-ND1 3.53Å; F416-H419 PolarHBondContact O-N 3.46Å; N417-H419 VanDerWaalsContact C-N 3.27Å; N417-H419 PolarHBondContact O-N 3Å; H419-H423 WeakPolarHBondContact O-CB 3.48Å; H419-H423 PolarHBondContact O-N 3.11Å
420	L	91	Very high	88.5	Confident	25 Å²	25	62.5 Å²	62.5	13%	0.131	35%	0.348	C	S	.	.	H	α-helix	trans	-61.6	-50.1	172.1	173	61.3	0	0	0	110.6	C407 F414 F416 N417 E422 H423 V424	C407-L420 HydrophobicContact CB-CD1 3.62Å; F414-L420 HydrophobicContact CB-CB 4.41Å; F414-L420 HydrophobicContact CD2-CB 4.04Å; F414-L420 HydrophobicContact CD2-CD1 3.89Å; F414-L420 HydrophobicContact CE2-CD1 4.08Å; F414-L420 HydrophobicContact CG-CB 4.4Å; F416-L420 PolarHBondContact O-N 3.25Å; N417-L420 PolarHBondContact O-N 2.92Å; L420-E422 VanDerWaalsContact C-N 3.29Å; L420-E422 PolarHBondContact O-N 3.11Å; L420-H423 CarbonylContact O-C 3.55Å; L420-H423 WeakPolarHBondContact O-CA 3.25Å; L420-H423 WeakPolarHBondContact O-CB 3.35Å; L420-H423 PolarHBondContact O-N 3.49Å; L420-V424 HydrophobicContact CD1-CG2 4.08Å; L420-V424 HydrophobicContact CG-CG2 4.44Å; L420-V424 WeakPolarHBondContact O-CG2 3.46Å; L420-V424 PolarHBondContact O-N 3.45Å
421	T	89.5	Confident	88.5	Confident	68 Å²	68	64.7 Å²	64.7	42%	0.417	35%	0.35	S	S	.	.	H	α-helix	trans	-57.3	-43.8	179.3	-55.8	0	0	0	0	111.4	N417 V424	N417-T421 WeakPolarHBondContact O-CB 3.35Å; N417-T421 PolarHBondContact O-N 2.81Å; N417-T421 PolarHBondContact O-OG1 3.5Å; T421-V424 PolarHBondContact O-N 3.07Å
422	E	88.5	Confident	88.6	Confident	52 Å²	52	65.5 Å²	65.5	24%	0.243	35%	0.345	C	S	.	.	H	α-helix	trans	-66.6	-38.3	175.6	-178.1	-178.2	-128.7	0	0	112.6	S418 L420 R425 R444	S418-E422 WeakPolarHBondContact O-CB 3.3Å; S418-E422 PolarHBondContact O-N 3.33Å; L420-E422 VanDerWaalsContact C-N 3.29Å; L420-E422 PolarHBondContact O-N 3.11Å; E422-R425 WeakPolarHBondContact O-CB 3.33Å; E422-R425 PolarHBondContact O-N 3.41Å; E422-R444 VanDerWaalsContact CD-NH2 3.31Å; E422-R444 WeakPolarHBondContact OE1-CD 3.27Å; E422-R444 WeakPolarHBondContact OE1-CG 3.08Å; E422-R444 IonicContact OE1-CZ 3.85Å; E422-R444 IonicContact OE1-NE 3.98Å; E422-R444 PolarHBondContact OE1-NE 2.77Å; E422-R444 IonicContact OE1-NH2 2.81Å; E422-R444 IonicContact OE2-CZ 3.15Å; E422-R444 IonicContact OE2-NE 2.54Å; E422-R444 PolarHBondContact OE2-NE 3Å; E422-R444 IonicContact OE2-NH2 3.98Å; E422-R444 PolarHBondContact OE2-NH2 3Å
423	H	90.3	Very high	88.8	Confident	18 Å²	18	61.6 Å²	61.6	8%	0.083	33%	0.331	C	S	.	.	H	α-helix	trans	-66.3	-38.5	177	167.1	72.9	0	0	0	112.3	C407 C410 F414 H419 L420 R425 I426 H427	C407-H423 VanDerWaalsContact SG-CD2 3.57Å; C407-H423 PolarHBondContact SG-NE2 3.17Å; C407-H423 VanDerWaalsContact SG-NE2 3.42Å; C410-H423 PolarHBondContact SG-NE2 2.88Å; F414-H423 HydrophobicContact CE1-CB 4.02Å; F414-H423 HydrophobicContact CE2-CB 3.91Å; F414-H423 AromaticContact CE2-CD2 3.4Å; F414-H423 VanDerWaalsContact CE2-CD2 3.4Å; F414-H423 WeakPolarHBondContact CE2-CD2 3.3Å; F414-H423 AromaticContact CE2-CG 3.61Å; F414-H423 AromaticContact CE2-NE2 4Å; F414-H423 HydrophobicContact CZ-CB 3.48Å; F414-H423 VanDerWaalsContact CZ-CB 3.48Å; F414-H423 AromaticContact CZ-CD2 3.51Å; F414-H423 AromaticContact CZ-CG 3.22Å; F414-H423 AromaticContact CZ-ND1 3.61Å; F414-H423 AromaticContact CZ-NE2 3.99Å; H419-H423 WeakPolarHBondContact O-CB 3.48Å; H419-H423 PolarHBondContact O-N 3.11Å; L420-H423 CarbonylContact O-C 3.55Å; L420-H423 WeakPolarHBondContact O-CA 3.25Å; L420-H423 WeakPolarHBondContact O-CB 3.35Å; L420-H423 PolarHBondContact O-N 3.49Å; H423-R425 PolarHBondContact O-N 3.18Å; H423-I426 WeakPolarHBondContact O-CA 3.41Å; H423-I426 WeakPolarHBondContact O-CB 3.48Å; H423-I426 VanDerWaalsContact O-CG1 3.27Å; H423-I426 WeakPolarHBondContact O-CG1 3.45Å; H423-I426 PolarHBondContact O-N 3.18Å; H423-H427 AromaticContact CE1-NE2 3.66Å; H423-H427 AromaticContact NE2-CD2 3.88Å; H423-H427 AromaticContact NE2-NE2 3.28Å; H423-H427 PolarHBondContact NE2-NE2 3.34Å
424	V	90.2	Very high	88.9	Confident	46 Å²	46	63.4 Å²	63.4	28%	0.279	34%	0.339	S	S	.	.	H	α-helix	trans	-57.6	-30.7	176.7	169.7	0	0	0	0	111.6	L420 T421 I426 H427 T428	L420-V424 HydrophobicContact CD1-CG2 4.08Å; L420-V424 HydrophobicContact CG-CG2 4.44Å; L420-V424 WeakPolarHBondContact O-CG2 3.46Å; L420-V424 PolarHBondContact O-N 3.45Å; T421-V424 PolarHBondContact O-N 3.07Å; V424-I426 PolarHBondContact O-N 2.71Å; V424-H427 WeakPolarHBondContact O-CB 3.24Å; V424-H427 PolarHBondContact O-N 3.22Å; V424-T428 HydrophobicContact CG1-CG2 3.97Å; V424-T428 PolarHBondContact O-N 2.93Å; V424-T428 VanDerWaalsContact O-N 3.07Å
425	R	91	Very high	89.2	Confident	52 Å²	52	62 Å²	62	20%	0.196	33%	0.333	C	S	.	.	H	α-helix	trans	-61	-16.4	172.6	-56.9	177.6	-175.1	171.3	0.4	114.1	E422 H423 T428 G429 R443	E422-R425 WeakPolarHBondContact O-CB 3.33Å; E422-R425 PolarHBondContact O-N 3.41Å; H423-R425 PolarHBondContact O-N 3.18Å; R425-T428 WeakPolarHBondContact CA-OG1 3.44Å; R425-G429 PolarHBondContact O-N 3.12Å; R425-R443 PolarHBondContact NH1-O 3.12Å; R425-R443 PolarHBondContact O-NE 3.38Å
426	I	89.6	Confident	89.6	Confident	88 Å²	88	69 Å²	69	45%	0.451	37%	0.366	S	S	.	.	H	α-helix	trans	-68.8	-41.1	172.7	-59.6	178.5	0	0	0	110.5	H423 V424 R443	H423-I426 WeakPolarHBondContact O-CA 3.41Å; H423-I426 WeakPolarHBondContact O-CB 3.48Å; H423-I426 VanDerWaalsContact O-CG1 3.27Å; H423-I426 WeakPolarHBondContact O-CG1 3.45Å; H423-I426 PolarHBondContact O-N 3.18Å; V424-I426 PolarHBondContact O-N 2.71Å; I426-R443 VanDerWaalsContact CA-CZ 3.48Å; I426-R443 PolarHBondContact O-NH2 3.34Å
427	H	88.6	Confident	89.8	Confident	70 Å²	70	70.1 Å²	70.1	32%	0.324	37%	0.373	S	S	.	.	H	α-helix	trans	-77.6	-50.5	-178.9	-65.4	-70.6	0	0	0	112.3	E409 C410 H423 V424 G429	E409-H427 WeakPolarHBondContact OE2-CB 3.48Å; E409-H427 IonicContact OE2-CD2 3.11Å; E409-H427 IonicContact OE2-CG 3.3Å; E409-H427 IonicContact OE2-ND1 3.49Å; E409-H427 PolarHBondContact OE2-ND1 3.13Å; C410-H427 PolarHBondContact SG-NE2 2.94Å; H423-H427 AromaticContact CE1-NE2 3.66Å; H423-H427 AromaticContact NE2-CD2 3.88Å; H423-H427 AromaticContact NE2-NE2 3.28Å; H423-H427 PolarHBondContact NE2-NE2 3.34Å; V424-H427 WeakPolarHBondContact O-CB 3.24Å; V424-H427 PolarHBondContact O-N 3.22Å; H427-G429 PolarHBondContact O-N 2.94Å
428	T	87.9	Confident	89.9	Confident	72 Å²	72	68.6 Å²	68.6	44%	0.442	37%	0.368	S	S	.	.	H	α-helix	trans	-70.3	-16.8	-179.3	64.2	0	0	0	0	113.1	V424 R425 E430	V424-T428 HydrophobicContact CG1-CG2 3.97Å; V424-T428 PolarHBondContact O-N 2.93Å; V424-T428 VanDerWaalsContact O-N 3.07Å; R425-T428 WeakPolarHBondContact CA-OG1 3.44Å; T428-E430 PolarHBondContact O-N 2.79Å; T428-E430 WeakPolarHBondContact OG1-CG 3.45Å; T428-E430 PolarHBondContact OG1-N 3.39Å
429	G	87.3	Confident	90	Very high	37 Å²	37	67.5 Å²	67.5	38%	0.381	37%	0.369	S	S	.	.			trans	74	-0.2	-176.3	0	0	0	0	0	114.2	R425 H427 K431	R425-G429 PolarHBondContact O-N 3.12Å; H427-G429 PolarHBondContact O-N 2.94Å; G429-K431 PolarHBondContact O-N 2.8Å
430	E	89.1	Confident	90.1	Very high	113 Å²	113	69.2 Å²	69.2	53%	0.528	38%	0.375	S	S	.	.			trans	-56.4	130.7	-179.1	-75.2	-179.6	-177.7	0	0	112.2	T428	T428-E430 PolarHBondContact O-N 2.79Å; T428-E430 WeakPolarHBondContact OG1-CG 3.45Å; T428-E430 PolarHBondContact OG1-N 3.39Å
431	K	91.4	Very high	90.2	Very high	109 Å²	109	69.7 Å²	69.7	47%	0.474	38%	0.383	S	S	.	.			trans	-130.4	78.3	177.7	-71.6	167.8	178.5	-175.7	0	109.6	G429 Y433 A441 F442 R443	G429-K431 PolarHBondContact O-N 2.8Å; K431-Y433 PolarHBondContact O-N 3Å; K431-Y433 VanDerWaalsContact O-N 3.07Å; K431-A441 HydrophobicContact CB-CB 3.54Å; K431-A441 HydrophobicContact CD-CB 4.07Å; K431-A441 WeakPolarHBondContact CD-O 3.35Å; K431-A441 HydrophobicContact CG-CB 4.44Å; K431-F442 CarbonylContact C-O 3.48Å; K431-F442 VanDerWaalsContact C-O 3.26Å; K431-F442 VanDerWaalsContact CA-O 3.31Å; K431-F442 WeakPolarHBondContact CA-O 3.13Å; K431-R443 HydrophobicContact CG-CG 3.86Å
432	P	90.7	Very high	90.2	Very high	70 Å²	70	68.4 Å²	68.4	46%	0.455	37%	0.371	S	S	.	.			trans	-64.6	-17.4	-171.3	-22.9	34.4	0	0	0	114.4
433	Y	93.2	Very high	90.2	Very high	78 Å²	78	70 Å²	70	31%	0.306	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	97	-171.1	-54.2	-75.2	0	0	0	110.4	K431 A441 F442 R443 S445	K431-Y433 PolarHBondContact O-N 3Å; K431-Y433 VanDerWaalsContact O-N 3.07Å; Y433-A441 CarbonylContact O-C 3.39Å; Y433-A441 WeakPolarHBondContact O-CA 3.11Å; Y433-F442 WeakPolarHBondContact CD2-O 3.48Å; Y433-F442 PolarHBondContact N-O 3.15Å; Y433-F442 VanDerWaalsContact N-O 3.17Å; Y433-F442 PolarHBondContact O-N 3.44Å; Y433-R443 WeakPolarHBondContact CE2-O 3.39Å; Y433-S445 VanDerWaalsContact CD2-N 3.33Å
434	V	92.1	Very high	90.1	Very high	70 Å²	70	74.8 Å²	74.8	42%	0.424	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	137	-179.1	-173.6	0	0	0	0	110.7	A441	V434-A441 HydrophobicContact CG2-CB 4.01Å
435	C	93.6	Very high	90.1	Very high	1 Å²	1	75.5 Å²	75.5	1%	0.007	40%	0.399	C	S	.	.			trans	-82.3	116.9	169.4	-177.5	0	0	0	0	109.7	E437 G439 K440 F442 L448	C435-E437 PolarHBondContact O-N 3.3Å; C435-G439 WeakPolarHBondContact O-CA 3.37Å; C435-G439 PolarHBondContact O-N 2.73Å; C435-K440 WeakPolarHBondContact CB-O 3.45Å; C435-K440 PolarHBondContact N-O 2.91Å; C435-F442 HydrophobicContact CB-CE2 4.3Å; C435-L448 HydrophobicContact CB-CD1 3.55Å
436	N	91.1	Very high	90	Very high	160 Å²	160	76.6 Å²	76.6	86%	0.856	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-21	-179.7	-62.5	-16.6	0	0	0	113.1
437	E	88.9	Confident	90	Very high	97 Å²	97	74.5 Å²	74.5	45%	0.453	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-27.5	-175.7	-62.3	168	-142.8	0	0	112.8	C435 R452 H455	C435-E437 PolarHBondContact O-N 3.3Å; E437-R452 IonicContact OE1-CZ 3.11Å; E437-R452 IonicContact OE1-NE 3.09Å; E437-R452 PolarHBondContact OE1-NE 2.95Å; E437-R452 IonicContact OE1-NH2 3.94Å; E437-R452 PolarHBondContact OE1-NH2 2.77Å; E437-H455 WeakPolarHBondContact OE2-CB 3.33Å; E437-H455 IonicContact OE2-CD2 3.92Å; E437-H455 PolarHBondContact OE2-CD2 3.46Å; E437-H455 VanDerWaalsContact OE2-CD2 3.3Å; E437-H455 IonicContact OE2-CG 2.98Å; E437-H455 IonicContact OE2-ND1 3.92Å
438	C	90.3	Very high	90.1	Very high	50 Å²	50	72.4 Å²	72.4	34%	0.338	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138	7.8	-179.6	69.2	0	0	0	0	115.3	K440 H451 H455	C438-K440 PolarHBondContact O-N 2.8Å; C438-H451 PolarHBondContact SG-NE2 3.46Å; C438-H455 PolarHBondContact SG-NE2 3.5Å
439	G	88.4	Confident	90.2	Very high	54 Å²	54	73 Å²	73	56%	0.557	40%	0.401	S	S	*	.			trans	68.7	-0.9	-179.4	0	0	0	0	0	115.2	C435 A441	C435-G439 WeakPolarHBondContact O-CA 3.37Å; C435-G439 PolarHBondContact O-N 2.73Å; G439-A441 PolarHBondContact O-N 3.24Å
440	K	90.5	Very high	90.3	Very high	124 Å²	124	74.5 Å²	74.5	54%	0.539	40%	0.398	S	S	.	.			trans	-68.7	125.6	-178.5	-72.7	179	-177.8	171.2	0	110.9	C435 C438 F442	C435-K440 WeakPolarHBondContact CB-O 3.45Å; C435-K440 PolarHBondContact N-O 2.91Å; C438-K440 PolarHBondContact O-N 2.8Å; K440-F442 HydrophobicContact CB-CE2 3.85Å; K440-F442 HydrophobicContact CB-CZ 3.96Å; K440-F442 WeakPolarHBondContact O-CD2 3.49Å; K440-F442 VanDerWaalsContact O-CE2 3.24Å; K440-F442 WeakPolarHBondContact O-CE2 3.34Å
441	A	91.5	Very high	90.3	Very high	34 Å²	34	70.4 Å²	70.4	28%	0.281	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	143.8	178.5	0	0	0	0	0	112.3	K431 Y433 V434 G439	K431-A441 HydrophobicContact CB-CB 3.54Å; K431-A441 HydrophobicContact CD-CB 4.07Å; K431-A441 WeakPolarHBondContact CD-O 3.35Å; K431-A441 HydrophobicContact CG-CB 4.44Å; Y433-A441 CarbonylContact O-C 3.39Å; Y433-A441 WeakPolarHBondContact O-CA 3.11Å; V434-A441 HydrophobicContact CG2-CB 4.01Å; G439-A441 PolarHBondContact O-N 3.24Å
442	F	90.1	Very high	90.1	Very high	42 Å²	42	70.6 Å²	70.6	18%	0.184	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	151.8	-176.8	-59.7	-88.4	0	0	0	111.8	K431 Y433 C435 K440 T447 L448 H451	K431-F442 CarbonylContact C-O 3.48Å; K431-F442 VanDerWaalsContact C-O 3.26Å; K431-F442 VanDerWaalsContact CA-O 3.31Å; K431-F442 WeakPolarHBondContact CA-O 3.13Å; Y433-F442 WeakPolarHBondContact CD2-O 3.48Å; Y433-F442 PolarHBondContact N-O 3.15Å; Y433-F442 VanDerWaalsContact N-O 3.17Å; Y433-F442 PolarHBondContact O-N 3.44Å; C435-F442 HydrophobicContact CB-CE2 4.3Å; K440-F442 HydrophobicContact CB-CE2 3.85Å; K440-F442 HydrophobicContact CB-CZ 3.96Å; K440-F442 WeakPolarHBondContact O-CD2 3.49Å; K440-F442 VanDerWaalsContact O-CE2 3.24Å; K440-F442 WeakPolarHBondContact O-CE2 3.34Å; F442-T447 WeakPolarHBondContact CB-OG1 3.16Å; F442-L448 HydrophobicContact CB-CB 4.36Å; F442-L448 HydrophobicContact CD2-CB 3.95Å; F442-L448 HydrophobicContact CD2-CD1 3.78Å; F442-L448 HydrophobicContact CD2-CG 4.47Å; F442-L448 HydrophobicContact CE2-CD1 3.96Å; F442-L448 HydrophobicContact CG-CB 4.34Å; F442-H451 HydrophobicContact CE1-CB 3.99Å; F442-H451 HydrophobicContact CE2-CB 3.87Å; F442-H451 AromaticContact CE2-CD2 3.36Å; F442-H451 WeakPolarHBondContact CE2-CD2 2.83Å; F442-H451 AromaticContact CE2-CG 3.66Å; F442-H451 HydrophobicContact CZ-CB 3.46Å; F442-H451 VanDerWaalsContact CZ-CB 3.46Å; F442-H451 AromaticContact CZ-CD2 3.33Å; F442-H451 WeakPolarHBondContact CZ-CD2 2.77Å; F442-H451 AromaticContact CZ-CG 3.19Å; F442-H451 AromaticContact CZ-ND1 3.73Å; F442-H451 AromaticContact CZ-NE2 3.88Å
443	R	87.9	Confident	90.1	Very high	86 Å²	86	69.9 Å²	69.9	33%	0.325	37%	0.365	S	S	.	.	S	Bend	trans	-78.7	-23.3	178.3	-64.6	-175.6	171.7	152.1	-4.5	113.4	R425 I426 K431 Y433	R425-R443 PolarHBondContact NH1-O 3.12Å; R425-R443 PolarHBondContact O-NE 3.38Å; I426-R443 VanDerWaalsContact CA-CZ 3.48Å; I426-R443 PolarHBondContact O-NH2 3.34Å; K431-R443 HydrophobicContact CG-CG 3.86Å; Y433-R443 WeakPolarHBondContact CE2-O 3.39Å
444	R	88.3	Confident	89.9	Confident	117 Å²	117	70.3 Å²	70.3	44%	0.442	38%	0.375	S	S	.	.	S	Bend	trans	-126.3	141.7	-177.2	-53.3	-177.8	166.9	170.7	-13	111	E422 S446 T447 L448	E422-R444 VanDerWaalsContact CD-NH2 3.31Å; E422-R444 WeakPolarHBondContact OE1-CD 3.27Å; E422-R444 WeakPolarHBondContact OE1-CG 3.08Å; E422-R444 IonicContact OE1-CZ 3.85Å; E422-R444 IonicContact OE1-NE 3.98Å; E422-R444 PolarHBondContact OE1-NE 2.77Å; E422-R444 IonicContact OE1-NH2 2.81Å; E422-R444 IonicContact OE2-CZ 3.15Å; E422-R444 IonicContact OE2-NE 2.54Å; E422-R444 PolarHBondContact OE2-NE 3Å; E422-R444 IonicContact OE2-NH2 3.98Å; E422-R444 PolarHBondContact OE2-NH2 3Å; R444-S446 VanDerWaalsContact C-N 3.33Å; R444-S446 PolarHBondContact O-N 2.87Å; R444-T447 HydrophobicContact CB-CG2 4.2Å; R444-T447 WeakPolarHBondContact CB-OG1 3.29Å; R444-T447 PolarHBondContact O-N 2.84Å; R444-T447 PolarHBondContact O-OG1 3.45Å; R444-L448 PolarHBondContact O-N 3.18Å
445	S	90.9	Very high	89.6	Confident	61 Å²	61	70.6 Å²	70.6	43%	0.427	37%	0.372	S	S	.	.	H	α-helix	trans	-63	-39.7	174.9	57.6	0	0	0	0	111.9	Y433 T447 L448 V449	Y433-S445 VanDerWaalsContact CD2-N 3.33Å; S445-T447 VanDerWaalsContact C-N 3.29Å; S445-T447 PolarHBondContact O-N 3.17Å; S445-L448 WeakPolarHBondContact O-CB 3.25Å; S445-L448 PolarHBondContact O-N 2.84Å; S445-L448 VanDerWaalsContact O-N 3.09Å; S445-V449 WeakPolarHBondContact O-CG2 3.46Å; S445-V449 PolarHBondContact O-N 3.08Å
446	S	88.8	Confident	89.2	Confident	75 Å²	75	73.7 Å²	73.7	52%	0.524	39%	0.391	S	S	.	.	H	α-helix	trans	-60.3	-37.6	177.7	56.3	0	0	0	0	112.8	R444 V449 Q450	R444-S446 VanDerWaalsContact C-N 3.33Å; R444-S446 PolarHBondContact O-N 2.87Å; S446-V449 PolarHBondContact O-N 2.82Å; S446-Q450 WeakPolarHBondContact O-CB 3.47Å; S446-Q450 PolarHBondContact O-N 3.48Å
447	T	89.1	Confident	89	Confident	44 Å²	44	68.3 Å²	68.3	27%	0.27	37%	0.373	S	S	.	.	H	α-helix	trans	-70.3	-34	175.5	51.8	0	0	0	0	112.4	F442 R444 S445 H451	F442-T447 WeakPolarHBondContact CB-OG1 3.16Å; R444-T447 HydrophobicContact CB-CG2 4.2Å; R444-T447 WeakPolarHBondContact CB-OG1 3.29Å; R444-T447 PolarHBondContact O-N 2.84Å; R444-T447 PolarHBondContact O-OG1 3.45Å; S445-T447 VanDerWaalsContact C-N 3.29Å; S445-T447 PolarHBondContact O-N 3.17Å; T447-H451 VanDerWaalsContact O-CB 3.25Å; T447-H451 WeakPolarHBondContact O-CB 3.49Å; T447-H451 PolarHBondContact O-N 2.97Å
448	L	91.9	Very high	88.9	Confident	27 Å²	27	69 Å²	69	14%	0.141	38%	0.376	C	S	.	.	H	α-helix	trans	-65.5	-48.4	171.9	171.4	62.6	0	0	0	110.7	C435 F442 R444 S445 Q450 H451 R452	C435-L448 HydrophobicContact CB-CD1 3.55Å; F442-L448 HydrophobicContact CB-CB 4.36Å; F442-L448 HydrophobicContact CD2-CB 3.95Å; F442-L448 HydrophobicContact CD2-CD1 3.78Å; F442-L448 HydrophobicContact CD2-CG 4.47Å; F442-L448 HydrophobicContact CE2-CD1 3.96Å; F442-L448 HydrophobicContact CG-CB 4.34Å; R444-L448 PolarHBondContact O-N 3.18Å; S445-L448 WeakPolarHBondContact O-CB 3.25Å; S445-L448 PolarHBondContact O-N 2.84Å; S445-L448 VanDerWaalsContact O-N 3.09Å; L448-Q450 VanDerWaalsContact C-N 3.3Å; L448-Q450 PolarHBondContact O-N 3.33Å; L448-H451 CarbonylContact O-C 3.57Å; L448-H451 WeakPolarHBondContact O-CA 3.41Å; L448-H451 WeakPolarHBondContact O-CB 3.43Å; L448-H451 PolarHBondContact O-N 2.88Å; L448-R452 HydrophobicContact CD1-CG 4.28Å; L448-R452 WeakPolarHBondContact O-CG 3.21Å; L448-R452 PolarHBondContact O-N 3.48Å
449	V	89.6	Confident	88.9	Confident	84 Å²	84	72.6 Å²	72.6	51%	0.509	39%	0.386	S	S	.	.	H	α-helix	trans	-58.5	-43.9	177.9	173.3	0	0	0	0	111.1	S445 S446 H451 R452	S445-V449 WeakPolarHBondContact O-CG2 3.46Å; S445-V449 PolarHBondContact O-N 3.08Å; S446-V449 PolarHBondContact O-N 2.82Å; V449-H451 VanDerWaalsContact C-N 3.33Å; V449-H451 PolarHBondContact O-N 3.37Å; V449-R452 PolarHBondContact O-N 3.3Å
450	Q	88.6	Confident	88.9	Confident	69 Å²	69	73.6 Å²	73.6	32%	0.322	38%	0.383	S	S	.	.	H	α-helix	trans	-62.9	-40.2	174.5	178.9	178.5	71.5	0	0	112	S446 L448 R453 Q472	S446-Q450 WeakPolarHBondContact O-CB 3.47Å; S446-Q450 PolarHBondContact O-N 3.48Å; L448-Q450 VanDerWaalsContact C-N 3.3Å; L448-Q450 PolarHBondContact O-N 3.33Å; Q450-R453 WeakPolarHBondContact O-CB 3.46Å; Q450-R453 PolarHBondContact O-N 2.98Å; Q450-Q472 VanDerWaalsContact CD-CD 3.49Å; Q450-Q472 HydrophobicContact CG-CG 4.25Å; Q450-Q472 VanDerWaalsContact NE2-CG 3.27Å; Q450-Q472 VanDerWaalsContact NE2-NE2 3.12Å
451	H	90	Very high	89	Confident	27 Å²	27	71.3 Å²	71.3	13%	0.125	37%	0.372	C	S	.	.	H	α-helix	trans	-64.6	-39.1	177.1	175	63	0	0	0	112.4	C438 F442 T447 L448 V449 R453 V454 H455	C438-H451 PolarHBondContact SG-NE2 3.46Å; F442-H451 HydrophobicContact CE1-CB 3.99Å; F442-H451 HydrophobicContact CE2-CB 3.87Å; F442-H451 AromaticContact CE2-CD2 3.36Å; F442-H451 WeakPolarHBondContact CE2-CD2 2.83Å; F442-H451 AromaticContact CE2-CG 3.66Å; F442-H451 HydrophobicContact CZ-CB 3.46Å; F442-H451 VanDerWaalsContact CZ-CB 3.46Å; F442-H451 AromaticContact CZ-CD2 3.33Å; F442-H451 WeakPolarHBondContact CZ-CD2 2.77Å; F442-H451 AromaticContact CZ-CG 3.19Å; F442-H451 AromaticContact CZ-ND1 3.73Å; F442-H451 AromaticContact CZ-NE2 3.88Å; T447-H451 VanDerWaalsContact O-CB 3.25Å; T447-H451 WeakPolarHBondContact O-CB 3.49Å; T447-H451 PolarHBondContact O-N 2.97Å; L448-H451 CarbonylContact O-C 3.57Å; L448-H451 WeakPolarHBondContact O-CA 3.41Å; L448-H451 WeakPolarHBondContact O-CB 3.43Å; L448-H451 PolarHBondContact O-N 2.88Å; V449-H451 VanDerWaalsContact C-N 3.33Å; V449-H451 PolarHBondContact O-N 3.37Å; H451-R453 PolarHBondContact O-N 3.02Å; H451-R453 VanDerWaalsContact O-N 3.13Å; H451-V454 WeakPolarHBondContact O-CB 3.45Å; H451-V454 WeakPolarHBondContact O-CG2 3.43Å; H451-V454 PolarHBondContact O-N 3.41Å; H451-H455 AromaticContact CE1-NE2 3.95Å; H451-H455 AromaticContact NE2-NE2 3.39Å; H451-H455 PolarHBondContact NE2-NE2 2.87Å
452	R	87.3	Confident	89	Confident	113 Å²	113	75.7 Å²	75.7	43%	0.426	39%	0.386	S	S	.	.	H	α-helix	trans	-56.7	-29.9	177.4	-71.7	-169.7	70.2	-116.8	-7.4	113.2	E437 L448 V449 V454 H455 T456	E437-R452 IonicContact OE1-CZ 3.11Å; E437-R452 IonicContact OE1-NE 3.09Å; E437-R452 PolarHBondContact OE1-NE 2.95Å; E437-R452 IonicContact OE1-NH2 3.94Å; E437-R452 PolarHBondContact OE1-NH2 2.77Å; L448-R452 HydrophobicContact CD1-CG 4.28Å; L448-R452 WeakPolarHBondContact O-CG 3.21Å; L448-R452 PolarHBondContact O-N 3.48Å; V449-R452 PolarHBondContact O-N 3.3Å; R452-V454 PolarHBondContact O-N 3.49Å; R452-V454 VanDerWaalsContact O-N 3.13Å; R452-H455 WeakPolarHBondContact O-CB 3.44Å; R452-H455 PolarHBondContact O-N 3.39Å; R452-T456 PolarHBondContact O-N 3.44Å; R452-T456 VanDerWaalsContact O-N 3.12Å
453	R	89.9	Confident	89.1	Confident	55 Å²	55	73.8 Å²	73.8	21%	0.208	38%	0.378	C	S	.	.	H	α-helix	trans	-60.7	-21.3	173.8	-60.3	-179.2	-177.5	169.5	-0.6	113.8	Q450 H451 H455 T456 G457 E458 S471	Q450-R453 WeakPolarHBondContact O-CB 3.46Å; Q450-R453 PolarHBondContact O-N 2.98Å; H451-R453 PolarHBondContact O-N 3.02Å; H451-R453 VanDerWaalsContact O-N 3.13Å; R453-H455 VanDerWaalsContact C-N 3.32Å; R453-T456 WeakPolarHBondContact CA-OG1 3.48Å; R453-G457 WeakPolarHBondContact O-CA 3.49Å; R453-G457 PolarHBondContact O-N 3.07Å; R453-E458 HydrophobicContact CG-CB 4.42Å; R453-E458 PolarHBondContact O-N 3.45Å; R453-S471 PolarHBondContact NH1-O 2.79Å
454	V	88.6	Confident	89.2	Confident	87 Å²	87	76.5 Å²	76.5	53%	0.527	40%	0.404	S	S	.	.	H	α-helix	trans	-69.7	-34.2	174.8	-179.2	0	0	0	0	111.1	H451 R452	H451-V454 WeakPolarHBondContact O-CB 3.45Å; H451-V454 WeakPolarHBondContact O-CG2 3.43Å; H451-V454 PolarHBondContact O-N 3.41Å; R452-V454 PolarHBondContact O-N 3.49Å; R452-V454 VanDerWaalsContact O-N 3.13Å
455	H	86	Confident	89.2	Confident	76 Å²	76	77 Å²	77	35%	0.352	41%	0.411	S	S	.	.	H	α-helix	trans	-80.9	-46.5	178.3	-63	-64.2	0	0	0	111.8	E437 C438 H451 R452 R453 G457	E437-H455 WeakPolarHBondContact OE2-CB 3.33Å; E437-H455 IonicContact OE2-CD2 3.92Å; E437-H455 PolarHBondContact OE2-CD2 3.46Å; E437-H455 VanDerWaalsContact OE2-CD2 3.3Å; E437-H455 IonicContact OE2-CG 2.98Å; E437-H455 IonicContact OE2-ND1 3.92Å; C438-H455 PolarHBondContact SG-NE2 3.5Å; H451-H455 AromaticContact CE1-NE2 3.95Å; H451-H455 AromaticContact NE2-NE2 3.39Å; H451-H455 PolarHBondContact NE2-NE2 2.87Å; R452-H455 WeakPolarHBondContact O-CB 3.44Å; R452-H455 PolarHBondContact O-N 3.39Å; R453-H455 VanDerWaalsContact C-N 3.32Å; H455-G457 PolarHBondContact O-N 3.4Å
456	T	86.1	Confident	89.1	Confident	66 Å²	66	76.7 Å²	76.7	41%	0.405	41%	0.408	S	S	.	.	H	α-helix	trans	-74	-17.7	179.6	63.2	0	0	0	0	113	R452 R453 E458	R452-T456 PolarHBondContact O-N 3.44Å; R452-T456 VanDerWaalsContact O-N 3.12Å; R453-T456 WeakPolarHBondContact CA-OG1 3.48Å; T456-E458 PolarHBondContact O-N 3.43Å; T456-E458 WeakPolarHBondContact OG1-CG 3.36Å; T456-E458 PolarHBondContact OG1-N 2.94Å
457	G	85.9	Confident	89	Confident	47 Å²	47	74.9 Å²	74.9	49%	0.485	40%	0.401	S	S	.	.			trans	71.7	5	-174.8	0	0	0	0	0	114	R453 H455 K459	R453-G457 WeakPolarHBondContact O-CA 3.49Å; R453-G457 PolarHBondContact O-N 3.07Å; H455-G457 PolarHBondContact O-N 3.4Å; G457-K459 PolarHBondContact O-N 3.49Å
458	E	86.8	Confident	88.9	Confident	110 Å²	110	78.9 Å²	78.9	51%	0.514	42%	0.415	S	S	.	.			trans	-59	125.7	-179.8	-76.7	175.7	-166.1	0	0	111.7	R453 T456	R453-E458 HydrophobicContact CG-CB 4.42Å; R453-E458 PolarHBondContact O-N 3.45Å; T456-E458 PolarHBondContact O-N 3.43Å; T456-E458 WeakPolarHBondContact OG1-CG 3.36Å; T456-E458 PolarHBondContact OG1-N 2.94Å
459	K	90.3	Very high	88.8	Confident	126 Å²	126	79.2 Å²	79.2	55%	0.548	42%	0.422	S	S	.	.			trans	-126.8	78.6	177.5	-71.4	169.1	171	-167.8	0	110.1	G457 Y461 A469 F470	G457-K459 PolarHBondContact O-N 3.49Å; K459-Y461 PolarHBondContact O-N 3.48Å; K459-Y461 VanDerWaalsContact O-N 3.11Å; K459-A469 HydrophobicContact CB-CB 3.6Å; K459-A469 HydrophobicContact CD-CB 4.18Å; K459-A469 WeakPolarHBondContact CD-O 3.44Å; K459-F470 CarbonylContact C-O 3.57Å; K459-F470 VanDerWaalsContact C-O 3.26Å; K459-F470 VanDerWaalsContact CA-O 3.28Å; K459-F470 WeakPolarHBondContact CA-O 3.3Å
460	P	89.7	Confident	88.8	Confident	75 Å²	75	77.1 Å²	77.1	49%	0.487	41%	0.406	S	S	.	.			trans	-66.4	-15.6	-172.1	-21.6	33.9	0	0	0	114.6
461	Y	91.1	Very high	88.7	Confident	77 Å²	77	75 Å²	75	30%	0.302	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	97.4	-172.2	-54.6	-76.9	0	0	0	110.4	K459 A469 F470 S473	K459-Y461 PolarHBondContact O-N 3.48Å; K459-Y461 VanDerWaalsContact O-N 3.11Å; Y461-A469 CarbonylContact O-C 3.55Å; Y461-A469 WeakPolarHBondContact O-CA 3.47Å; Y461-F470 PolarHBondContact N-O 3.43Å; Y461-F470 PolarHBondContact O-N 2.7Å; Y461-S473 VanDerWaalsContact CD2-N 3.32Å; Y461-S473 VanDerWaalsContact CE2-N 3.32Å
462	Q	92.1	Very high	88.6	Confident	126 Å²	126	76.1 Å²	76.1	59%	0.589	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	135.5	179.6	-166.2	175.2	10.5	0	0	111.6	G467 A469	Q462-G467 WeakPolarHBondContact CG-O 3.48Å; Q462-G467 PolarHBondContact NE2-O 3.38Å; Q462-A469 HydrophobicContact CG-CB 4.48Å
463	C	92.6	Very high	88.8	Confident	2 Å²	2	73.8 Å²	73.8	1%	0.014	41%	0.405	C	S	.	.			trans	-75.1	124.1	168.3	-179.9	0	0	0	0	109.5	E465 C466 G467 K468 L476	C463-E465 VanDerWaalsContact C-N 3.32Å; C463-C466 VanDerWaalsContact SG-SG 3.66Å; C463-G467 WeakPolarHBondContact O-CA 3.5Å; C463-G467 PolarHBondContact O-N 2.96Å; C463-K468 WeakPolarHBondContact CB-O 2.88Å; C463-K468 PolarHBondContact N-O 3.27Å; C463-L476 HydrophobicContact CB-CD1 3.64Å
464	V	90.3	Very high	88.7	Confident	142 Å²	142	74.5 Å²	74.5	86%	0.861	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-33.8	179.4	-177.3	0	0	0	0	111.3
465	E	87.3	Confident	88.7	Confident	129 Å²	129	73.7 Å²	73.7	60%	0.603	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-35.2	-173.7	-64.2	174.1	147.1	0	0	113.7	C463 H483	C463-E465 VanDerWaalsContact C-N 3.32Å; E465-H483 WeakPolarHBondContact OE2-CB 3.45Å; E465-H483 IonicContact OE2-CD2 2.82Å; E465-H483 PolarHBondContact OE2-CD2 3.03Å; E465-H483 IonicContact OE2-CG 3.17Å; E465-H483 IonicContact OE2-ND1 3.73Å; E465-H483 IonicContact OE2-NE2 3.71Å
466	C	88.6	Confident	88.9	Confident	53 Å²	53	71.1 Å²	71.1	36%	0.358	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	6.2	-177.8	72.9	0	0	0	0	114.8	C463 K468 H479 H483	C463-C466 VanDerWaalsContact SG-SG 3.66Å; C466-K468 PolarHBondContact O-N 3Å; C466-H479 PolarHBondContact SG-NE2 3.17Å; C466-H483 PolarHBondContact SG-NE2 3.29Å; C466-H483 VanDerWaalsContact SG-NE2 3.37Å
467	G	86.5	Confident	89	Confident	37 Å²	37	71.4 Å²	71.4	38%	0.381	40%	0.399	S	S	.	.			trans	69.5	-3.4	178.4	0	0	0	0	0	115.3	Q462 C463 A469	Q462-G467 WeakPolarHBondContact CG-O 3.48Å; Q462-G467 PolarHBondContact NE2-O 3.38Å; C463-G467 WeakPolarHBondContact O-CA 3.5Å; C463-G467 PolarHBondContact O-N 2.96Å; G467-A469 PolarHBondContact O-N 3.31Å
468	K	87.8	Confident	89.1	Confident	128 Å²	128	71.1 Å²	71.1	56%	0.557	39%	0.386	S	S	*	.			trans	-66.2	127.1	-178.8	-72.3	-179.1	-177.8	177.5	0	111.1	C463 C466 F470	C463-K468 WeakPolarHBondContact CB-O 2.88Å; C463-K468 PolarHBondContact N-O 3.27Å; C466-K468 PolarHBondContact O-N 3Å; K468-F470 HydrophobicContact CB-CE2 3.93Å; K468-F470 HydrophobicContact CB-CZ 4.08Å; K468-F470 WeakPolarHBondContact O-CE2 3.06Å
469	A	90.2	Very high	89.2	Confident	34 Å²	34	67 Å²	67	28%	0.281	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	143.6	179.7	0	0	0	0	0	112.6	K459 Y461 Q462 G467	K459-A469 HydrophobicContact CB-CB 3.6Å; K459-A469 HydrophobicContact CD-CB 4.18Å; K459-A469 WeakPolarHBondContact CD-O 3.44Å; Y461-A469 CarbonylContact O-C 3.55Å; Y461-A469 WeakPolarHBondContact O-CA 3.47Å; Q462-A469 HydrophobicContact CG-CB 4.48Å; G467-A469 PolarHBondContact O-N 3.31Å
470	F	88.6	Confident	89.1	Confident	40 Å²	40	64.8 Å²	64.8	18%	0.175	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.5	-177.1	-59.3	-87.7	0	0	0	111.5	K459 Y461 K468 Q472 Q475 L476 H479	K459-F470 CarbonylContact C-O 3.57Å; K459-F470 VanDerWaalsContact C-O 3.26Å; K459-F470 VanDerWaalsContact CA-O 3.28Å; K459-F470 WeakPolarHBondContact CA-O 3.3Å; Y461-F470 PolarHBondContact N-O 3.43Å; Y461-F470 PolarHBondContact O-N 2.7Å; K468-F470 HydrophobicContact CB-CE2 3.93Å; K468-F470 HydrophobicContact CB-CZ 4.08Å; K468-F470 WeakPolarHBondContact O-CE2 3.06Å; F470-Q472 VanDerWaalsContact C-N 3.33Å; F470-Q475 HydrophobicContact CB-CB 3.99Å; F470-Q475 HydrophobicContact CD1-CB 3.83Å; F470-Q475 HydrophobicContact CG-CB 4.11Å; F470-L476 HydrophobicContact CD2-CB 4.03Å; F470-L476 HydrophobicContact CD2-CD1 3.96Å; F470-L476 HydrophobicContact CE2-CD1 4.13Å; F470-L476 HydrophobicContact CG-CB 4.49Å; F470-H479 HydrophobicContact CE1-CB 4.12Å; F470-H479 HydrophobicContact CE2-CB 3.81Å; F470-H479 AromaticContact CE2-CD2 3.31Å; F470-H479 WeakPolarHBondContact CE2-CD2 3.45Å; F470-H479 AromaticContact CE2-CG 3.59Å; F470-H479 HydrophobicContact CZ-CB 3.48Å; F470-H479 VanDerWaalsContact CZ-CB 3.48Å; F470-H479 AromaticContact CZ-CD2 3.46Å; F470-H479 VanDerWaalsContact CZ-CD2 3.46Å; F470-H479 WeakPolarHBondContact CZ-CD2 3.37Å; F470-H479 AromaticContact CZ-CG 3.27Å; F470-H479 AromaticContact CZ-ND1 3.84Å
471	S	87.2	Confident	89.1	Confident	26 Å²	26	63.9 Å²	63.9	18%	0.182	35%	0.346	C	S	.	.	S	Bend	trans	-79.8	-16.2	179.1	64.1	0	0	0	0	113.3	R453 Q475	R453-S471 PolarHBondContact NH1-O 2.79Å; S471-Q475 PolarHBondContact OG-OE1 3.38Å
472	Q	88.5	Confident	88.9	Confident	50 Å²	50	64.7 Å²	64.7	23%	0.234	36%	0.359	C	S	.	.	S	Bend	trans	-136.6	142.1	-176.7	-46	-176.8	8	0	0	110.7	Q450 F470 S474 Q475 L476	Q450-Q472 VanDerWaalsContact CD-CD 3.49Å; Q450-Q472 HydrophobicContact CG-CG 4.25Å; Q450-Q472 VanDerWaalsContact NE2-CG 3.27Å; Q450-Q472 VanDerWaalsContact NE2-NE2 3.12Å; F470-Q472 VanDerWaalsContact C-N 3.33Å; Q472-S474 VanDerWaalsContact C-N 3.32Å; Q472-S474 PolarHBondContact O-N 2.63Å; Q472-Q475 HydrophobicContact CB-CB 4.45Å; Q472-Q475 HydrophobicContact CB-CG 4.02Å; Q472-Q475 HydrophobicContact CG-CG 4.45Å; Q472-Q475 WeakPolarHBondContact O-CB 3.26Å; Q472-Q475 PolarHBondContact O-N 2.94Å; Q472-L476 PolarHBondContact O-N 3.37Å
473	S	89.8	Confident	88.6	Confident	64 Å²	64	62.4 Å²	62.4	45%	0.448	35%	0.348	S	S	.	.	H	α-helix	trans	-62.6	-38.1	178.1	54.8	0	0	0	0	112.5	Y461 Q475 L476 T477	Y461-S473 VanDerWaalsContact CD2-N 3.32Å; Y461-S473 VanDerWaalsContact CE2-N 3.32Å; S473-Q475 PolarHBondContact O-N 2.74Å; S473-L476 WeakPolarHBondContact O-CB 3.27Å; S473-L476 PolarHBondContact O-N 3.16Å; S473-T477 PolarHBondContact O-N 3.45Å; S473-T477 PolarHBondContact O-OG1 2.95Å
474	S	87.9	Confident	88.3	Confident	69 Å²	69	66.1 Å²	66.1	48%	0.483	37%	0.37	S	S	.	.	H	α-helix	trans	-59.8	-33.1	176.6	57.1	0	0	0	0	113	Q472 L478	Q472-S474 VanDerWaalsContact C-N 3.32Å; Q472-S474 PolarHBondContact O-N 2.63Å; S474-L478 VanDerWaalsContact O-CB 3.27Å; S474-L478 WeakPolarHBondContact O-CB 3.3Å; S474-L478 PolarHBondContact O-N 3.35Å
475	Q	88.7	Confident	88	Confident	70 Å²	70	61.7 Å²	61.7	33%	0.327	35%	0.353	S	S	.	.	H	α-helix	trans	-71	-40.1	175.4	-66.9	172.2	-7.3	0	0	110.9	F470 S471 Q472 S473 L478 H479	F470-Q475 HydrophobicContact CB-CB 3.99Å; F470-Q475 HydrophobicContact CD1-CB 3.83Å; F470-Q475 HydrophobicContact CG-CB 4.11Å; S471-Q475 PolarHBondContact OG-OE1 3.38Å; Q472-Q475 HydrophobicContact CB-CB 4.45Å; Q472-Q475 HydrophobicContact CB-CG 4.02Å; Q472-Q475 HydrophobicContact CG-CG 4.45Å; Q472-Q475 WeakPolarHBondContact O-CB 3.26Å; Q472-Q475 PolarHBondContact O-N 2.94Å; S473-Q475 PolarHBondContact O-N 2.74Å; Q475-L478 PolarHBondContact O-N 3.19Å; Q475-H479 VanDerWaalsContact O-CB 3.25Å; Q475-H479 WeakPolarHBondContact O-CB 3.37Å; Q475-H479 PolarHBondContact O-N 3.38Å
476	L	90.9	Very high	87.9	Confident	23 Å²	23	60.9 Å²	60.9	12%	0.12	35%	0.35	C	S	.	.	H	α-helix	trans	-63.2	-49.5	173.9	174.3	61.5	0	0	0	111.3	C463 F470 Q472 S473 L478 H479 Q480	C463-L476 HydrophobicContact CB-CD1 3.64Å; F470-L476 HydrophobicContact CD2-CB 4.03Å; F470-L476 HydrophobicContact CD2-CD1 3.96Å; F470-L476 HydrophobicContact CE2-CD1 4.13Å; F470-L476 HydrophobicContact CG-CB 4.49Å; Q472-L476 PolarHBondContact O-N 3.37Å; S473-L476 WeakPolarHBondContact O-CB 3.27Å; S473-L476 PolarHBondContact O-N 3.16Å; L476-L478 VanDerWaalsContact C-N 3.27Å; L476-L478 PolarHBondContact O-N 2.98Å; L476-H479 CarbonylContact O-C 3.42Å; L476-H479 WeakPolarHBondContact O-CA 2.9Å; L476-H479 WeakPolarHBondContact O-CB 2.9Å; L476-H479 PolarHBondContact O-N 3.06Å; L476-Q480 HydrophobicContact CD1-CG 4.27Å; L476-Q480 WeakPolarHBondContact O-CG 3.23Å; L476-Q480 PolarHBondContact O-N 2.97Å
477	T	88.7	Confident	87.9	Confident	72 Å²	72	64 Å²	64	44%	0.442	36%	0.357	S	S	.	.	H	α-helix	trans	-57.5	-41.5	177.4	-55.2	0	0	0	0	112	S473 H479 Q480	S473-T477 PolarHBondContact O-N 3.45Å; S473-T477 PolarHBondContact O-OG1 2.95Å; T477-H479 VanDerWaalsContact C-N 3.32Å; T477-Q480 PolarHBondContact O-N 3.21Å
478	L	87.8	Confident	88	Confident	40 Å²	40	65.8 Å²	65.8	21%	0.209	36%	0.362	C	S	.	.	H	α-helix	trans	-69	-33.9	176.8	179.1	56.9	0	0	0	112.7	S474 Q475 L476 R481 R500	S474-L478 VanDerWaalsContact O-CB 3.27Å; S474-L478 WeakPolarHBondContact O-CB 3.3Å; S474-L478 PolarHBondContact O-N 3.35Å; Q475-L478 PolarHBondContact O-N 3.19Å; L476-L478 VanDerWaalsContact C-N 3.27Å; L476-L478 PolarHBondContact O-N 2.98Å; L478-R481 WeakPolarHBondContact O-CB 3.45Å; L478-R500 HydrophobicContact CD1-CG 3.54Å; L478-R500 HydrophobicContact CD2-CG 4.15Å; L478-R500 VanDerWaalsContact CD2-CZ 3.4Å; L478-R500 HydrophobicContact CG-CG 4.41Å
479	H	89.2	Confident	88.1	Confident	24 Å²	24	63.3 Å²	63.3	11%	0.111	35%	0.349	C	S	.	.	H	α-helix	trans	-70.2	-37.6	175.5	170.2	60.6	0	0	0	112.1	C466 F470 Q475 L476 T477 R481 V482 H483	C466-H479 PolarHBondContact SG-NE2 3.17Å; F470-H479 HydrophobicContact CE1-CB 4.12Å; F470-H479 HydrophobicContact CE2-CB 3.81Å; F470-H479 AromaticContact CE2-CD2 3.31Å; F470-H479 WeakPolarHBondContact CE2-CD2 3.45Å; F470-H479 AromaticContact CE2-CG 3.59Å; F470-H479 HydrophobicContact CZ-CB 3.48Å; F470-H479 VanDerWaalsContact CZ-CB 3.48Å; F470-H479 AromaticContact CZ-CD2 3.46Å; F470-H479 VanDerWaalsContact CZ-CD2 3.46Å; F470-H479 WeakPolarHBondContact CZ-CD2 3.37Å; F470-H479 AromaticContact CZ-CG 3.27Å; F470-H479 AromaticContact CZ-ND1 3.84Å; Q475-H479 VanDerWaalsContact O-CB 3.25Å; Q475-H479 WeakPolarHBondContact O-CB 3.37Å; Q475-H479 PolarHBondContact O-N 3.38Å; L476-H479 CarbonylContact O-C 3.42Å; L476-H479 WeakPolarHBondContact O-CA 2.9Å; L476-H479 WeakPolarHBondContact O-CB 2.9Å; L476-H479 PolarHBondContact O-N 3.06Å; T477-H479 VanDerWaalsContact C-N 3.32Å; H479-R481 PolarHBondContact O-N 3.24Å; H479-R481 VanDerWaalsContact O-N 3.15Å; H479-V482 WeakPolarHBondContact O-CB 3.4Å; H479-V482 WeakPolarHBondContact O-CG2 3.25Å; H479-V482 PolarHBondContact O-N 3.24Å; H479-H483 AromaticContact CE1-NE2 3.63Å; H479-H483 AromaticContact NE2-NE2 3.35Å; H479-H483 PolarHBondContact NE2-NE2 2.97Å
480	Q	87.6	Confident	87.9	Confident	79 Å²	79	68.2 Å²	68.2	37%	0.369	37%	0.366	S	S	.	.	H	α-helix	trans	-56.5	-30.5	175.8	-74.5	171.7	-43.3	0	0	112.5	L476 T477 V482 H483 T484	L476-Q480 HydrophobicContact CD1-CG 4.27Å; L476-Q480 WeakPolarHBondContact O-CG 3.23Å; L476-Q480 PolarHBondContact O-N 2.97Å; T477-Q480 PolarHBondContact O-N 3.21Å; Q480-V482 PolarHBondContact O-N 2.88Å; Q480-V482 VanDerWaalsContact O-N 3.11Å; Q480-H483 WeakPolarHBondContact O-CB 3.39Å; Q480-H483 PolarHBondContact O-N 3.38Å; Q480-T484 PolarHBondContact O-N 2.97Å; Q480-T484 VanDerWaalsContact O-N 3.08Å; Q480-T484 PolarHBondContact O-OG1 2.68Å
481	R	89.4	Confident	88	Confident	56 Å²	56	66.4 Å²	66.4	21%	0.211	36%	0.359	C	S	.	.	H	α-helix	trans	-61.4	-19.1	173.2	-61.8	-176.5	-175.9	164.3	-0.2	114.4	L478 H479 H483 T484 G485 E486 S499	L478-R481 WeakPolarHBondContact O-CB 3.45Å; H479-R481 PolarHBondContact O-N 3.24Å; H479-R481 VanDerWaalsContact O-N 3.15Å; R481-H483 VanDerWaalsContact C-N 3.33Å; R481-T484 WeakPolarHBondContact CA-OG1 3.48Å; R481-G485 WeakPolarHBondContact O-CA 3.47Å; R481-G485 PolarHBondContact O-N 2.92Å; R481-E486 HydrophobicContact CG-CB 4.34Å; R481-S499 PolarHBondContact NH1-O 3.11Å
482	V	87.6	Confident	88	Confident	95 Å²	95	69 Å²	69	58%	0.576	39%	0.389	S	S	*	.	H	α-helix	trans	-71.6	-33.8	173.8	-178.8	0	0	0	0	110.6	H479 Q480	H479-V482 WeakPolarHBondContact O-CB 3.4Å; H479-V482 WeakPolarHBondContact O-CG2 3.25Å; H479-V482 PolarHBondContact O-N 3.24Å; Q480-V482 PolarHBondContact O-N 2.88Å; Q480-V482 VanDerWaalsContact O-N 3.11Å
483	H	86.5	Confident	87.6	Confident	78 Å²	78	72 Å²	72	36%	0.361	41%	0.407	S	S	.	.	H	α-helix	trans	-81	-43.5	178.3	-62.7	-62	0	0	0	111.7	E465 C466 H479 Q480 R481 G485	E465-H483 WeakPolarHBondContact OE2-CB 3.45Å; E465-H483 IonicContact OE2-CD2 2.82Å; E465-H483 PolarHBondContact OE2-CD2 3.03Å; E465-H483 IonicContact OE2-CG 3.17Å; E465-H483 IonicContact OE2-ND1 3.73Å; E465-H483 IonicContact OE2-NE2 3.71Å; C466-H483 PolarHBondContact SG-NE2 3.29Å; C466-H483 VanDerWaalsContact SG-NE2 3.37Å; H479-H483 AromaticContact CE1-NE2 3.63Å; H479-H483 AromaticContact NE2-NE2 3.35Å; H479-H483 PolarHBondContact NE2-NE2 2.97Å; Q480-H483 WeakPolarHBondContact O-CB 3.39Å; Q480-H483 PolarHBondContact O-N 3.38Å; R481-H483 VanDerWaalsContact C-N 3.33Å; H483-G485 VanDerWaalsContact C-N 3.32Å; H483-G485 PolarHBondContact O-N 2.96Å
484	T	85.8	Confident	87.5	Confident	79 Å²	79	71.5 Å²	71.5	49%	0.485	40%	0.403	S	S	.	.	H	α-helix	trans	-78.9	-16.5	179.8	63.5	0	0	0	0	113.5	Q480 R481 E486	Q480-T484 PolarHBondContact O-N 2.97Å; Q480-T484 VanDerWaalsContact O-N 3.08Å; Q480-T484 PolarHBondContact O-OG1 2.68Å; R481-T484 WeakPolarHBondContact CA-OG1 3.48Å; T484-E486 PolarHBondContact O-N 3.34Å; T484-E486 WeakPolarHBondContact OG1-CG 3.37Å; T484-E486 PolarHBondContact OG1-N 3.3Å
485	G	84.1	Confident	87.1	Confident	49 Å²	49	70.9 Å²	70.9	51%	0.505	41%	0.408	S	S	.	.			trans	70	5.6	-174.6	0	0	0	0	0	114.2	R481 H483 K487	R481-G485 WeakPolarHBondContact O-CA 3.47Å; R481-G485 PolarHBondContact O-N 2.92Å; H483-G485 VanDerWaalsContact C-N 3.32Å; H483-G485 PolarHBondContact O-N 2.96Å; G485-K487 PolarHBondContact O-N 2.86Å
486	E	85.2	Confident	86.9	Confident	113 Å²	113	73.6 Å²	73.6	53%	0.528	42%	0.418	S	S	.	.			trans	-60	125.3	-177.7	-77	179	-174.3	0	0	112.1	R481 T484	R481-E486 HydrophobicContact CG-CB 4.34Å; T484-E486 PolarHBondContact O-N 3.34Å; T484-E486 WeakPolarHBondContact OG1-CG 3.37Å; T484-E486 PolarHBondContact OG1-N 3.3Å
487	K	87.9	Confident	86.6	Confident	119 Å²	119	74 Å²	74	52%	0.517	43%	0.425	S	S	.	.			trans	-126.5	75.9	177	-68.6	173.5	-176.8	-179.4	0	110.6	G485 Y489 A497 F498	G485-K487 PolarHBondContact O-N 2.86Å; K487-Y489 PolarHBondContact O-N 3.23Å; K487-A497 HydrophobicContact CB-CB 3.58Å; K487-A497 HydrophobicContact CD-CB 4.08Å; K487-A497 WeakPolarHBondContact CD-O 3.48Å; K487-A497 HydrophobicContact CG-CB 4.49Å; K487-F498 CarbonylContact C-O 3.6Å; K487-F498 VanDerWaalsContact C-O 3.32Å; K487-F498 WeakPolarHBondContact CA-O 3.4Å
488	P	88.4	Confident	86.5	Confident	73 Å²	73	72.8 Å²	72.8	47%	0.474	41%	0.413	S	S	.	.			trans	-68.4	-5.5	-170.7	-20.4	33.7	0	0	0	115.4
489	Y	89.3	Confident	86.3	Confident	76 Å²	76	73 Å²	73	30%	0.298	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	97	-172.5	-56.4	-70.7	0	0	0	110.2	K487 A497 F498 R501	K487-Y489 PolarHBondContact O-N 3.23Å; Y489-A497 CarbonylContact O-C 3.33Å; Y489-A497 WeakPolarHBondContact O-CA 3.33Å; Y489-F498 WeakPolarHBondContact CB-O 3.37Å; Y489-F498 WeakPolarHBondContact CD2-O 3.26Å; Y489-F498 PolarHBondContact N-O 3.09Å; Y489-F498 PolarHBondContact O-N 3.12Å; Y489-R501 HydrophobicContact CD1-CB 4.12Å; Y489-R501 HydrophobicContact CD1-CG 4.48Å; Y489-R501 HydrophobicContact CE1-CB 3.92Å; Y489-R501 HydrophobicContact CE1-CG 4.44Å; Y489-R501 HydrophobicContact CE2-CB 4.32Å; Y489-R501 HydrophobicContact CG-CB 4.42Å
490	E	87.9	Confident	86.1	Confident	137 Å²	137	77.9 Å²	77.9	64%	0.64	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	141.7	179.7	-60.9	-174.6	166.7	0	0	111.5	A497	E490-A497 HydrophobicContact CG-CB 3.84Å
491	C	89.4	Confident	86.1	Confident	3 Å²	3	82.2 Å²	82.2	2%	0.02	45%	0.449	C	S	.	.			trans	-81.4	118.6	171.9	179.9	0	0	0	0	109.4	D493 G495 K496 F498 L504 H511	C491-D493 PolarHBondContact O-N 3.48Å; C491-G495 VanDerWaalsContact O-CA 3.26Å; C491-G495 WeakPolarHBondContact O-CA 2.82Å; C491-G495 PolarHBondContact O-N 2.97Å; C491-K496 WeakPolarHBondContact CB-O 3.36Å; C491-K496 PolarHBondContact N-O 2.89Å; C491-F498 HydrophobicContact CB-CE2 4.49Å; C491-L504 HydrophobicContact CB-CD1 3.65Å; C491-H511 PolarHBondContact SG-CD2 2.82Å; C491-H511 PolarHBondContact SG-NE2 3.05Å
492	G	87	Confident	85.9	Confident	79 Å²	79	83.2 Å²	83.2	81%	0.814	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-27.9	176.4	0	0	0	0	0	113.7
493	D	81.1	Confident	85.8	Confident	115 Å²	115	81 Å²	81	62%	0.615	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-30.5	-174.3	-46.6	-48.2	0	0	0	113.2	C491 H511	C491-D493 PolarHBondContact O-N 3.48Å; D493-H511 IonicContact OD2-CD2 3.06Å; D493-H511 PolarHBondContact OD2-CD2 2.69Å
494	C	86.2	Confident	85.8	Confident	53 Å²	53	78 Å²	78	36%	0.358	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139	10.8	-175.1	83.3	0	0	0	0	114.9	K496 H507 H511	C494-K496 PolarHBondContact O-N 3.03Å; C494-K496 VanDerWaalsContact SG-CG 3.59Å; C494-H507 PolarHBondContact SG-NE2 2.57Å; C494-H511 PolarHBondContact SG-NE2 3.27Å; C494-H511 VanDerWaalsContact SG-NE2 3.37Å
495	G	80.9	Confident	85.7	Confident	56 Å²	56	77.8 Å²	77.8	58%	0.577	43%	0.433	S	S	*	.			trans	66.5	2.7	177.2	0	0	0	0	0	115.9	C491 A497	C491-G495 VanDerWaalsContact O-CA 3.26Å; C491-G495 WeakPolarHBondContact O-CA 2.82Å; C491-G495 PolarHBondContact O-N 2.97Å; G495-A497 PolarHBondContact O-N 3.41Å
496	K	83.1	Confident	85.6	Confident	126 Å²	126	79.1 Å²	79.1	55%	0.548	43%	0.426	S	S	.	.			trans	-71.4	122.4	-178.3	-75.5	179.8	-175.5	173.8	0	110.6	C491 C494 F498	C491-K496 WeakPolarHBondContact CB-O 3.36Å; C491-K496 PolarHBondContact N-O 2.89Å; C494-K496 PolarHBondContact O-N 3.03Å; C494-K496 VanDerWaalsContact SG-CG 3.59Å; K496-F498 HydrophobicContact CB-CE2 3.78Å; K496-F498 HydrophobicContact CB-CZ 3.96Å; K496-F498 VanDerWaalsContact O-CD2 3.32Å; K496-F498 WeakPolarHBondContact O-CD2 3.37Å; K496-F498 WeakPolarHBondContact O-CE2 3.33Å
497	A	86.3	Confident	85.4	Confident	31 Å²	31	74.7 Å²	74.7	26%	0.256	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	141.2	177.4	0	0	0	0	0	112.2	K487 Y489 E490 G495	K487-A497 HydrophobicContact CB-CB 3.58Å; K487-A497 HydrophobicContact CD-CB 4.08Å; K487-A497 WeakPolarHBondContact CD-O 3.48Å; K487-A497 HydrophobicContact CG-CB 4.49Å; Y489-A497 CarbonylContact O-C 3.33Å; Y489-A497 WeakPolarHBondContact O-CA 3.33Å; E490-A497 HydrophobicContact CG-CB 3.84Å; G495-A497 PolarHBondContact O-N 3.41Å
498	F	85.1	Confident	85.1	Confident	47 Å²	47	72.4 Å²	72.4	21%	0.206	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.4	-179.6	-60.1	-89.5	0	0	0	111.6	K487 Y489 C491 K496 R500 L504 H507	K487-F498 CarbonylContact C-O 3.6Å; K487-F498 VanDerWaalsContact C-O 3.32Å; K487-F498 WeakPolarHBondContact CA-O 3.4Å; Y489-F498 WeakPolarHBondContact CB-O 3.37Å; Y489-F498 WeakPolarHBondContact CD2-O 3.26Å; Y489-F498 PolarHBondContact N-O 3.09Å; Y489-F498 PolarHBondContact O-N 3.12Å; C491-F498 HydrophobicContact CB-CE2 4.49Å; K496-F498 HydrophobicContact CB-CE2 3.78Å; K496-F498 HydrophobicContact CB-CZ 3.96Å; K496-F498 VanDerWaalsContact O-CD2 3.32Å; K496-F498 WeakPolarHBondContact O-CD2 3.37Å; K496-F498 WeakPolarHBondContact O-CE2 3.33Å; F498-R500 VanDerWaalsContact C-N 3.34Å; F498-L504 HydrophobicContact CB-CB 4.37Å; F498-L504 HydrophobicContact CD2-CB 3.97Å; F498-L504 HydrophobicContact CD2-CD1 3.82Å; F498-L504 HydrophobicContact CE2-CD1 4.01Å; F498-L504 HydrophobicContact CG-CB 4.36Å; F498-H507 HydrophobicContact CE1-CB 4.12Å; F498-H507 HydrophobicContact CE2-CB 3.85Å; F498-H507 AromaticContact CE2-CD2 3.36Å; F498-H507 WeakPolarHBondContact CE2-CD2 3.45Å; F498-H507 AromaticContact CE2-CG 3.62Å; F498-H507 HydrophobicContact CZ-CB 3.48Å; F498-H507 VanDerWaalsContact CZ-CB 3.48Å; F498-H507 AromaticContact CZ-CD2 3.5Å; F498-H507 VanDerWaalsContact CZ-CD2 3.5Å; F498-H507 WeakPolarHBondContact CZ-CD2 3.4Å; F498-H507 AromaticContact CZ-CG 3.28Å; F498-H507 AromaticContact CZ-ND1 3.82Å
499	S	84	Confident	84.8	Confident	44 Å²	44	73 Å²	73	31%	0.308	39%	0.391	S	S	.	.	S	Bend	trans	-81.2	-12.6	177.6	60.2	0	0	0	0	113.7	R481	R481-S499 PolarHBondContact NH1-O 3.11Å
500	R	85.3	Confident	84.4	Confident	127 Å²	127	73.1 Å²	73.1	48%	0.479	40%	0.396	S	S	.	.	S	Bend	trans	-131.9	141.8	179.4	-61.1	177.2	-171.5	-166.6	-5.7	111.1	L478 F498 S502 T503 L504	L478-R500 HydrophobicContact CD1-CG 3.54Å; L478-R500 HydrophobicContact CD2-CG 4.15Å; L478-R500 VanDerWaalsContact CD2-CZ 3.4Å; L478-R500 HydrophobicContact CG-CG 4.41Å; F498-R500 VanDerWaalsContact C-N 3.34Å; R500-S502 VanDerWaalsContact C-N 3.31Å; R500-S502 PolarHBondContact O-N 3.2Å; R500-T503 HydrophobicContact CB-CG2 4.32Å; R500-T503 PolarHBondContact O-N 3.1Å; R500-T503 PolarHBondContact O-OG1 2.65Å; R500-L504 PolarHBondContact O-N 3.05Å
501	R	86.6	Confident	83.9	Confident	171 Å²	171	70.6 Å²	70.6	65%	0.645	38%	0.384	S	S	*	.	H	α-helix	trans	-62.8	-37.3	173.7	-171.8	178.8	-177	-177.9	2.7	112.4	Y489 T503 L504 I505	Y489-R501 HydrophobicContact CD1-CB 4.12Å; Y489-R501 HydrophobicContact CD1-CG 4.48Å; Y489-R501 HydrophobicContact CE1-CB 3.92Å; Y489-R501 HydrophobicContact CE1-CG 4.44Å; Y489-R501 HydrophobicContact CE2-CB 4.32Å; Y489-R501 HydrophobicContact CG-CB 4.42Å; R501-T503 VanDerWaalsContact C-N 3.31Å; R501-T503 PolarHBondContact O-N 2.91Å; R501-L504 PolarHBondContact O-N 3.44Å; R501-I505 HydrophobicContact CG-CD1 3.96Å; R501-I505 HydrophobicContact CG-CG1 4.35Å; R501-I505 WeakPolarHBondContact O-CG1 3.41Å; R501-I505 PolarHBondContact O-N 2.8Å
502	S	85.7	Confident	83	Confident	77 Å²	77	73.9 Å²	73.9	54%	0.538	41%	0.407	S	S	.	.	H	α-helix	trans	-64.1	-35.7	-179.6	53	0	0	0	0	112.8	R500 Q506	R500-S502 VanDerWaalsContact C-N 3.31Å; R500-S502 PolarHBondContact O-N 3.2Å; S502-Q506 WeakPolarHBondContact O-CB 3.42Å; S502-Q506 PolarHBondContact O-N 3.22Å
503	T	85.6	Confident	81.6	Confident	47 Å²	47	72.9 Å²	72.9	29%	0.288	40%	0.397	S	S	.	.	H	α-helix	trans	-73	-36	175.8	50.5	0	0	0	0	111.4	R500 R501 Q506 H507	R500-T503 HydrophobicContact CB-CG2 4.32Å; R500-T503 PolarHBondContact O-N 3.1Å; R500-T503 PolarHBondContact O-OG1 2.65Å; R501-T503 VanDerWaalsContact C-N 3.31Å; R501-T503 PolarHBondContact O-N 2.91Å; T503-Q506 PolarHBondContact O-N 3.03Å; T503-H507 VanDerWaalsContact O-CB 3.3Å; T503-H507 WeakPolarHBondContact O-CB 3.42Å; T503-H507 PolarHBondContact O-N 2.78Å
504	L	87.1	Confident	80	Confident	17 Å²	17	73.6 Å²	73.6	9%	0.089	40%	0.396	C	S	.	.	H	α-helix	trans	-61.8	-49.8	171	172.7	63.2	0	0	0	111.1	C491 F498 R500 R501 Q506 H507 Q508	C491-L504 HydrophobicContact CB-CD1 3.65Å; F498-L504 HydrophobicContact CB-CB 4.37Å; F498-L504 HydrophobicContact CD2-CB 3.97Å; F498-L504 HydrophobicContact CD2-CD1 3.82Å; F498-L504 HydrophobicContact CE2-CD1 4.01Å; F498-L504 HydrophobicContact CG-CB 4.36Å; R500-L504 PolarHBondContact O-N 3.05Å; R501-L504 PolarHBondContact O-N 3.44Å; L504-Q506 VanDerWaalsContact C-N 3.26Å; L504-Q506 PolarHBondContact O-N 2.88Å; L504-H507 CarbonylContact O-C 3.34Å; L504-H507 WeakPolarHBondContact O-CA 3.45Å; L504-H507 WeakPolarHBondContact O-CB 3.36Å; L504-H507 PolarHBondContact O-N 3Å; L504-Q508 HydrophobicContact CD1-CG 4.01Å; L504-Q508 HydrophobicContact CG-CG 4.33Å; L504-Q508 WeakPolarHBondContact O-CG 3.33Å; L504-Q508 PolarHBondContact O-N 2.54Å
505	I	84.4	Confident	77.8	Confident	74 Å²	74	76 Å²	76	38%	0.379	41%	0.41	S	S	.	.	H	α-helix	trans	-58.9	-41	177.8	-67.8	167.7	0	0	0	110.6	R501 H507 Q508 K509	R501-I505 HydrophobicContact CG-CD1 3.96Å; R501-I505 HydrophobicContact CG-CG1 4.35Å; R501-I505 WeakPolarHBondContact O-CG1 3.41Å; R501-I505 PolarHBondContact O-N 2.8Å; I505-H507 VanDerWaalsContact C-N 3.29Å; I505-H507 PolarHBondContact O-N 3.19Å; I505-Q508 PolarHBondContact O-N 3.46Å; I505-K509 WeakPolarHBondContact O-CG 3.37Å; I505-K509 PolarHBondContact O-N 3.5Å
506	Q	80.1	Confident	76	Confident	76 Å²	76	79.8 Å²	79.8	36%	0.355	41%	0.406	S	S	.	.	H	α-helix	trans	-64.4	-36.6	175.4	-179	173.5	8.2	0	0	112.2	S502 T503 L504	S502-Q506 WeakPolarHBondContact O-CB 3.42Å; S502-Q506 PolarHBondContact O-N 3.22Å; T503-Q506 PolarHBondContact O-N 3.03Å; L504-Q506 VanDerWaalsContact C-N 3.26Å; L504-Q506 PolarHBondContact O-N 2.88Å
507	H	82.7	Confident	73.6	Confident	20 Å²	20	83.2 Å²	83.2	9%	0.093	42%	0.422	C	S	.	.	H	α-helix	trans	-70.5	-41.7	177	170.2	66.2	0	0	0	112.3	C494 F498 T503 L504 I505 K509 I510 H511	C494-H507 PolarHBondContact SG-NE2 2.57Å; F498-H507 HydrophobicContact CE1-CB 4.12Å; F498-H507 HydrophobicContact CE2-CB 3.85Å; F498-H507 AromaticContact CE2-CD2 3.36Å; F498-H507 WeakPolarHBondContact CE2-CD2 3.45Å; F498-H507 AromaticContact CE2-CG 3.62Å; F498-H507 HydrophobicContact CZ-CB 3.48Å; F498-H507 VanDerWaalsContact CZ-CB 3.48Å; F498-H507 AromaticContact CZ-CD2 3.5Å; F498-H507 VanDerWaalsContact CZ-CD2 3.5Å; F498-H507 WeakPolarHBondContact CZ-CD2 3.4Å; F498-H507 AromaticContact CZ-CG 3.28Å; F498-H507 AromaticContact CZ-ND1 3.82Å; T503-H507 VanDerWaalsContact O-CB 3.3Å; T503-H507 WeakPolarHBondContact O-CB 3.42Å; T503-H507 PolarHBondContact O-N 2.78Å; L504-H507 CarbonylContact O-C 3.34Å; L504-H507 WeakPolarHBondContact O-CA 3.45Å; L504-H507 WeakPolarHBondContact O-CB 3.36Å; L504-H507 PolarHBondContact O-N 3Å; I505-H507 VanDerWaalsContact C-N 3.29Å; I505-H507 PolarHBondContact O-N 3.19Å; H507-K509 PolarHBondContact O-N 3.26Å; H507-I510 WeakPolarHBondContact O-CB 3.36Å; H507-I510 WeakPolarHBondContact O-CG1 3.45Å; H507-I510 PolarHBondContact O-N 2.87Å; H507-H511 AromaticContact CD2-NE2 3.86Å; H507-H511 AromaticContact CE1-CE1 3.84Å; H507-H511 AromaticContact CE1-NE2 3.43Å; H507-H511 PolarHBondContact CE1-NE2 2.78Å; H507-H511 AromaticContact NE2-CD2 3.9Å; H507-H511 AromaticContact NE2-CE1 3.86Å; H507-H511 AromaticContact NE2-NE2 3.05Å; H507-H511 PolarHBondContact NE2-NE2 3.15Å
508	Q	81.3	Confident	70.8	Confident	71 Å²	71	86.9 Å²	86.9	33%	0.332	44%	0.444	S	S	.	.	H	α-helix	trans	-60.1	-28.7	176.1	-73.1	175.4	-46.5	0	0	112.8	L504 I505 I510 H511 S512	L504-Q508 HydrophobicContact CD1-CG 4.01Å; L504-Q508 HydrophobicContact CG-CG 4.33Å; L504-Q508 WeakPolarHBondContact O-CG 3.33Å; L504-Q508 PolarHBondContact O-N 2.54Å; I505-Q508 PolarHBondContact O-N 3.46Å; Q508-I510 PolarHBondContact O-N 3.43Å; Q508-H511 PolarHBondContact O-N 2.84Å; Q508-S512 PolarHBondContact O-N 3.39Å; Q508-S512 PolarHBondContact O-OG 3.24Å
509	K	81.8	Confident	68	Low	85 Å²	85	95.9 Å²	95.9	37%	0.37	48%	0.476	S	S	.	.	H	α-helix	trans	-64.7	-19.4	172.5	-71.5	-177.7	178	-147.8	0	114.1	I505 H507 S512	I505-K509 WeakPolarHBondContact O-CG 3.37Å; I505-K509 PolarHBondContact O-N 3.5Å; H507-K509 PolarHBondContact O-N 3.26Å; K509-S512 VanDerWaalsContact CA-OG 3.31Å; K509-S512 WeakPolarHBondContact CA-OG 3.21Å
510	I	80.8	Confident	65.4	Low	80 Å²	80	102.2 Å²	102.2	41%	0.41	50%	0.498	S	S	.	.	H	α-helix	trans	-74.7	-43	175.2	-55	173	0	0	0	109.2	H507 Q508 S512 G513	H507-I510 WeakPolarHBondContact O-CB 3.36Å; H507-I510 WeakPolarHBondContact O-CG1 3.45Å; H507-I510 PolarHBondContact O-N 2.87Å; Q508-I510 PolarHBondContact O-N 3.43Å; I510-S512 VanDerWaalsContact C-N 3.3Å; I510-S512 PolarHBondContact O-N 3.26Å; I510-G513 PolarHBondContact O-N 2.63Å
511	H	76.6	Confident	62.8	Low	83 Å²	83	108.3 Å²	108.3	38%	0.384	52%	0.522	S	S	.	.	H	α-helix	trans	-66.8	-31.1	178	-60.7	-46.7	0	0	0	113.3	C491 D493 C494 H507 Q508 G513	C491-H511 PolarHBondContact SG-CD2 2.82Å; C491-H511 PolarHBondContact SG-NE2 3.05Å; D493-H511 IonicContact OD2-CD2 3.06Å; D493-H511 PolarHBondContact OD2-CD2 2.69Å; C494-H511 PolarHBondContact SG-NE2 3.27Å; C494-H511 VanDerWaalsContact SG-NE2 3.37Å; H507-H511 AromaticContact CD2-NE2 3.86Å; H507-H511 AromaticContact CE1-CE1 3.84Å; H507-H511 AromaticContact CE1-NE2 3.43Å; H507-H511 PolarHBondContact CE1-NE2 2.78Å; H507-H511 AromaticContact NE2-CD2 3.9Å; H507-H511 AromaticContact NE2-CE1 3.86Å; H507-H511 AromaticContact NE2-NE2 3.05Å; H507-H511 PolarHBondContact NE2-NE2 3.15Å; Q508-H511 PolarHBondContact O-N 2.84Å; H511-G513 VanDerWaalsContact C-N 3.34Å
512	S	70.6	Confident	60	Low	73 Å²	73	102.5 Å²	102.5	51%	0.51	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-0.4	-179.4	32.3	0	0	0	0	114	Q508 K509 I510 E514	Q508-S512 PolarHBondContact O-N 3.39Å; Q508-S512 PolarHBondContact O-OG 3.24Å; K509-S512 VanDerWaalsContact CA-OG 3.31Å; K509-S512 WeakPolarHBondContact CA-OG 3.21Å; I510-S512 VanDerWaalsContact C-N 3.3Å; I510-S512 PolarHBondContact O-N 3.26Å; S512-E514 PolarHBondContact O-N 3.11Å
513	G	57.9	Low	57.3	Low	57 Å²	57	104.8 Å²	104.8	59%	0.588	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	10.8	178.5	0	0	0	0	0	114.8	I510 H511 T515	I510-G513 PolarHBondContact O-N 2.63Å; H511-G513 VanDerWaalsContact C-N 3.34Å; G513-T515 VanDerWaalsContact C-N 3.29Å; G513-T515 PolarHBondContact O-N 2.86Å
514	E	47	Very low	54.6	Low	130 Å²	130	107.1 Å²	107.1	61%	0.607	55%	0.552	S	S	*	*			trans	-70.4	85.6	178.3	-75.9	-168.9	167.5	0	0	109.9	S512 R516	S512-E514 PolarHBondContact O-N 3.11Å; E514-R516 PolarHBondContact O-N 3.34Å; E514-R516 VanDerWaalsContact O-N 3.17Å
515	T	41.7	Very low	51.5	Low	104 Å²	104	116.1 Å²	116.1	64%	0.638	59%	0.591	S	S	*	*			trans	-54.8	122.8	166.6	54.9	0	0	0	0	108.5	G513 K517	G513-T515 VanDerWaalsContact C-N 3.29Å; G513-T515 PolarHBondContact O-N 2.86Å; T515-K517 PolarHBondContact O-N 3.1Å
516	R	41.7	Very low	48.8	Very low	135 Å²	135	118.3 Å²	118.3	51%	0.509	61%	0.607	S	S	.	*			trans	-62	104.1	170.3	-71	-164.8	-177.4	-170.9	1.6	107.5	E514 C518	E514-R516 PolarHBondContact O-N 3.34Å; E514-R516 VanDerWaalsContact O-N 3.17Å; R516-C518 PolarHBondContact O-N 2.94Å
517	K	32.4	Very low	46.3	Very low	199 Å²	199	123.7 Å²	123.7	87%	0.865	63%	0.632	S	S	*	*			trans	-57.6	107.4	155.8	-76.4	-176.9	179.9	176.9	0	106.2	T515 R519	T515-K517 PolarHBondContact O-N 3.1Å; K517-R519 PolarHBondContact O-N 3.45Å
518	C	27.6	Very low	43.6	Very low	108 Å²	108	125.9 Å²	125.9	73%	0.73	66%	0.66	S	S	*	*			trans	-59.9	105.9	170.6	-166.4	0	0	0	0	106.2	R516 K520	R516-C518 PolarHBondContact O-N 2.94Å; C518-K520 VanDerWaalsContact C-N 3.35Å; C518-K520 PolarHBondContact O-N 3.07Å
519	R	28	Very low	41.1	Very low	235 Å²	235	128.1 Å²	128.1	89%	0.887	68%	0.684	S	S	*	*			trans	-64.7	104.4	169	-163.2	178.2	-171.6	-170.7	2.4	105	K517 R521	K517-R519 PolarHBondContact O-N 3.45Å; R519-R521 PolarHBondContact O-N 3.16Å
520	K	28.9	Very low	38.4	Very low	177 Å²	177	129.8 Å²	129.8	77%	0.77	71%	0.706	S	S	*	*			trans	-45.7	118.4	165.3	-73.5	-176.2	176.4	-177.8	0	106.1	C518 G522	C518-K520 VanDerWaalsContact C-N 3.35Å; C518-K520 PolarHBondContact O-N 3.07Å; K520-G522 PolarHBondContact O-N 3.43Å
521	R	29.7	Very low	35.8	Very low	256 Å²	256	134.2 Å²	134.2	97%	0.966	73%	0.73	S	S	*	*			trans	-69.6	87.2	155.6	-80.1	-173.1	-177.1	-156.5	1	104.8	R519	R519-R521 PolarHBondContact O-N 3.16Å
522	G	27.7	Very low	33.6	Very low	49 Å²	49	136.4 Å²	136.4	51%	0.505	75%	0.749	S	S	.	*			trans	-63.5	155.8	157.2	0	0	0	0	0	108.9	K520	K520-G522 PolarHBondContact O-N 3.43Å
523	P	30.8	Very low	31.6	Very low	125 Å²	125	138.5 Å²	138.5	81%	0.812	76%	0.761	S	S	*	*	S	Bend	trans	-56.1	147.5	173.6	20.1	-22.7	0	0	0	109.5	F525	P523-F525 PolarHBondContact O-N 3.06Å
524	A	27.1	Very low	30.1	Very low	96 Å²	96	143.6 Å²	143.6	79%	0.793	78%	0.775	S	S	*	*			trans	-43	113.3	-175	0	0	0	0	0	111.8	V526	A524-V526 PolarHBondContact O-N 2.96Å
525	F	23.2	Very low	29.2	Very low	205 Å²	205	140.9 Å²	140.9	90%	0.899	78%	0.782	S	S	*	*			trans	-75.2	108.7	163.9	-120.3	-95	0	0	0	107	P523	P523-F525 PolarHBondContact O-N 3.06Å
526	V	28.3	Very low	28.6	Very low	121 Å²	121	145.2 Å²	145.2	73%	0.733	80%	0.795	S	S	*	*			trans	-61.2	129.9	162.2	179.3	0	0	0	0	106.7	A524 G528	A524-V526 PolarHBondContact O-N 2.96Å; V526-G528 PolarHBondContact O-N 3.49Å
527	H	26	Very low	27.8	Very low	188 Å²	188	146.6 Å²	146.6	87%	0.87	81%	0.81	S	S	*	*			trans	-61.4	110.2	169.2	-99.4	-98.7	0	0	0	108.1
528	G	26.4	Very low	27.8	Very low	67 Å²	67	142.2 Å²	142.2	69%	0.691	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-71.9	126.4	164.7	0	0	0	0	0	109.3	V526	V526-G528 PolarHBondContact O-N 3.49Å
529	S	28.4	Very low	27.6	Very low	118 Å²	118	143.5 Å²	143.5	83%	0.825	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-60.7	135	166.2	-51.4	0	0	0	0	109.8	L531	S529-L531 PolarHBondContact O-N 3.2Å
530	S	26.7	Very low	27.5	Very low	119 Å²	119	136.2 Å²	136.2	83%	0.832	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-60.9	126.6	170.7	-60.1	0	0	0	0	110.3
531	L	25.9	Very low	27.2	Very low	173 Å²	173	135 Å²	135	91%	0.906	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-67.9	126.7	163.6	-69.7	158.5	0	0	0	108.5	S529	S529-L531 PolarHBondContact O-N 3.2Å
532	T	29.7	Very low	27.1	Very low	130 Å²	130	129.9 Å²	129.9	80%	0.798	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-97	130.5	156.8	49.3	0	0	0	0	108	D534	T532-D534 PolarHBondContact O-N 3.37Å
533	P	28.9	Very low	26.9	Very low	116 Å²	116	135 Å²	135	75%	0.753	80%	0.798	S	S	*	*			trans	-84.2	108.2	169.4	31.3	-23.5	0	0	0	107.6
534	D	26.1	Very low	26.6	Very low	164 Å²	164	133.7 Å²	133.7	88%	0.877	79%	0.791	S	S	*	*			trans	-174.2	120.9	139.9	-90.3	-25.9	0	0	0	108.9	T532	T532-D534 PolarHBondContact O-N 3.37Å
535	G	28.9	Very low	26.5	Very low	73 Å²	73	140.4 Å²	140.4	75%	0.753	80%	0.796	S	S	*	*			trans	-76.7	139.8	-175.8	0	0	0	0	0	112.2
536	Q	27.7	Very low	26.5	Very low	196 Å²	196	134.8 Å²	134.8	92%	0.916	79%	0.787	S	S	*	*			trans	-161.1	124.4	143.1	-104.7	162.5	28	0	0	108.7
537	I	26.5	Very low	26.2	Very low	163 Å²	163	139.2 Å²	139.2	84%	0.836	80%	0.797	S	S	*	*			trans	-96.3	135.7	168.1	-65.7	169.8	0	0	0	105.6
538	P	31	Very low	26.3	Very low	107 Å²	107	135.6 Å²	135.6	70%	0.695	79%	0.793	S	S	*	*				-150.8	139.9	100.1	35.7	-14.5	0	0	0	117.8
539	T	24.6	Very low	26.2	Very low	135 Å²	135	141.9 Å²	141.9	83%	0.828	80%	0.804	S	S	*	*			trans	59.1	125.8	132.3	65	0	0	0	0	121.1
540	G	25.5	Very low	25.9	Very low	83 Å²	83	139.9 Å²	139.9	86%	0.856	80%	0.802	S	S	*	*			trans	168.9	91.1	162	0	0	0	0	0	114.3
541	E	23	Very low	25.8	Very low	152 Å²	152	138.5 Å²	138.5	71%	0.71	80%	0.798	S	S	*	*			trans	-53.5	151.3	175.7	-85.1	-171.3	140	0	0	117.8
542	K	26.3	Very low	26	Very low	147 Å²	147	138.3 Å²	138.3	64%	0.639	80%	0.798	S	S	*	*			trans	70.6	140	143.9	-66.7	166	-173.4	155.4	0	118
543	H	24.3	Very low	25.7	Very low	157 Å²	157	138.7 Å²	138.7	73%	0.727	79%	0.794	S	S	*	*			cis	-165.7	145.2	24.1	-109.5	175.1	0	0	0	111.3
544	S	23.9	Very low	25.6	Very low	97 Å²	97	141 Å²	141	68%	0.678	80%	0.798	S	S	*	*			trans	48.4	134.9	132.4	-19.6	0	0	0	0	120.6
545	R	25.4	Very low	25.5	Very low	238 Å²	238	140 Å²	140	90%	0.898	79%	0.792	S	S	*	*			cis	-170.2	125.8	49.9	-109.6	169.1	171.9	153.5	-3.5	107.4
546	A	23.1	Very low	25.2	Very low	86 Å²	86	146.8 Å²	146.8	71%	0.711	80%	0.795	S	S	*	*				73.6	110.8	90.8	0	0	0	0	0	115.8
547	F	23	Very low	24.8	Very low	215 Å²	215	148.8 Å²	148.8	94%	0.943	80%	0.795	S	S	*	*			trans	-137	137.9	135.3	-98.5	-81	0	0	0	109.5
548	S	26.4	Very low	24.6	Very low	111 Å²	111	147 Å²	147	78%	0.776	79%	0.791	S	S	*	*			trans	-70.2	142.4	-160.7	42.8	0	0	0	0	116.2
549	H	25	Very low	24.3	Very low	199 Å²	199	146.9 Å²	146.9	92%	0.921	79%	0.788	S	S	*	*			trans	-64.2	151.5	161.9	-100.7	-137.5	0	0	0	112.6
550	G	22.6	Very low	24.1	Very low	77 Å²	77	149.4 Å²	149.4	79%	0.794	79%	0.79	S	S	*	*			trans	130.5	83.1	136.5	0	0	0	0	0	117.2
551	A	24.8	Very low	24.1	Very low	90 Å²	90	150.5 Å²	150.5	74%	0.744	78%	0.78	S	S	*	*			trans	-156.3	106	139	0	0	0	0	0	109.4	L553	A551-L553 PolarHBondContact O-N 3.02Å
552	N	29	Very low	24.2	Very low	169 Å²	169	146.5 Å²	146.5	90%	0.904	78%	0.781	S	S	*	*			trans	-60.6	110.2	161.4	-96.6	-59.9	0	0	0	108.3
553	L	24.1	Very low	24.1	Very low	137 Å²	137	147.1 Å²	147.1	72%	0.717	79%	0.785	S	S	*	*			trans	-131.5	115.7	153.7	-112.4	109.1	0	0	0	108.4	A551 L555	A551-L553 PolarHBondContact O-N 3.02Å; L553-L555 VanDerWaalsContact C-N 3.25Å; L553-L555 PolarHBondContact O-N 3.46Å
554	I	27.4	Very low	24	Very low	164 Å²	164	147.7 Å²	147.7	84%	0.841	79%	0.786	S	S	*	*			trans	-58	92.3	161.8	-63.7	172.1	0	0	0	106.6	R556	I554-R556 VanDerWaalsContact C-N 3.26Å; I554-R556 PolarHBondContact O-N 3.25Å
555	L	23.3	Very low	24	Very low	143 Å²	143	148.7 Å²	148.7	75%	0.749	79%	0.793	S	S	*	*			trans	-81.9	85.1	169.4	-87.6	164.5	0	0	0	108.7	L553 W557	L553-L555 VanDerWaalsContact C-N 3.25Å; L553-L555 PolarHBondContact O-N 3.46Å; L555-W557 PolarHBondContact O-N 3.34Å
556	R	22.1	Very low	23.8	Very low	216 Å²	216	146.9 Å²	146.9	82%	0.815	79%	0.792	S	S	*	*			trans	-28	119.3	148.1	-155.1	172.3	-179.8	154	-1.7	109.9	I554 T558	I554-R556 VanDerWaalsContact C-N 3.26Å; I554-R556 PolarHBondContact O-N 3.25Å; R556-T558 PolarHBondContact O-N 3.17Å
557	W	20.2	Very low	23.7	Very low	239 Å²	239	146 Å²	146	91%	0.905	79%	0.791	S	S	*	*			trans	-61.3	101	172.4	-79.7	43.7	0	0	0	109.2	L555 V559	L555-W557 PolarHBondContact O-N 3.34Å; W557-V559 PolarHBondContact O-N 3.5Å
558	T	22.5	Very low	23.7	Very low	124 Å²	124	141.2 Å²	141.2	76%	0.761	78%	0.783	S	S	*	*			trans	-80.9	96.8	159.1	43.9	0	0	0	0	107.7	R556 H560	R556-T558 PolarHBondContact O-N 3.17Å; T558-H560 PolarHBondContact O-N 2.77Å
559	V	23.7	Very low	23.6	Very low	105 Å²	105	142.5 Å²	142.5	64%	0.636	78%	0.781	S	S	*	*			trans	-62.6	103.4	163.9	177	0	0	0	0	107	W557 T561	W557-V559 PolarHBondContact O-N 3.5Å; V559-T561 VanDerWaalsContact C-N 3.32Å; V559-T561 HydrophobicContact CG1-CG2 3.91Å; V559-T561 PolarHBondContact O-N 3.35Å
560	H	21.3	Very low	23.5	Very low	188 Å²	188	141.8 Å²	141.8	87%	0.87	78%	0.778	S	S	*	*			trans	-67.5	98.3	158.3	-99.1	-56.4	0	0	0	107.4	T558 G562	T558-H560 PolarHBondContact O-N 2.77Å; H560-G562 PolarHBondContact O-N 3.01Å
561	T	25.1	Very low	23.7	Very low	106 Å²	106	148.4 Å²	148.4	65%	0.65	78%	0.781	S	S	*	*			trans	-67.3	79.4	164.2	46.5	0	0	0	0	108.8	V559 E563	V559-T561 VanDerWaalsContact C-N 3.32Å; V559-T561 HydrophobicContact CG1-CG2 3.91Å; V559-T561 PolarHBondContact O-N 3.35Å; T561-E563 VanDerWaalsContact C-N 3.34Å; T561-E563 PolarHBondContact O-N 3.02Å
562	G	23.8	Very low	23.6	Very low	69 Å²	69	147.7 Å²	147.7	71%	0.711	78%	0.782	S	S	*	*			trans	-83.1	82.8	159.7	0	0	0	0	0	108.6	H560 K564	H560-G562 PolarHBondContact O-N 3.01Å; G562-K564 PolarHBondContact O-N 3.37Å; G562-K564 VanDerWaalsContact O-N 3.09Å
563	E	24.2	Very low	23.4	Very low	159 Å²	159	149 Å²	149	74%	0.743	78%	0.78	S	S	*	*			trans	-58.2	109.8	172	-69.7	-179.2	151.3	0	0	109.9	T561	T561-E563 VanDerWaalsContact C-N 3.34Å; T561-E563 PolarHBondContact O-N 3.02Å
564	K	23.9	Very low	23.3	Very low	170 Å²	170	147.2 Å²	147.2	74%	0.739	78%	0.784	S	S	*	*			trans	-118.7	92.4	155.9	-78.9	-177.4	-179.5	171.6	0	106.7	G562 F566	G562-K564 PolarHBondContact O-N 3.37Å; G562-K564 VanDerWaalsContact O-N 3.09Å; K564-F566 PolarHBondContact O-N 2.82Å
565	S	23.4	Very low	23.1	Very low	118 Å²	118	149.1 Å²	149.1	83%	0.825	79%	0.787	S	S	*	*			trans	-55.5	116.7	169.6	41.6	0	0	0	0	110	G567	S565-G567 PolarHBondContact O-N 3.4Å
566	F	20.8	Very low	23.1	Very low	200 Å²	200	147.6 Å²	147.6	88%	0.877	79%	0.788	S	S	*	*			trans	-83.7	98.6	160.8	-80.9	-91.2	0	0	0	106.9	K564	K564-F566 PolarHBondContact O-N 2.82Å
567	G	21.7	Very low	23.4	Very low	67 Å²	67	143.3 Å²	143.3	69%	0.691	79%	0.789	S	S	*	*			trans	-62.8	132.5	174.8	0	0	0	0	0	111.8	S565	S565-G567 PolarHBondContact O-N 3.4Å
568	C	21.8	Very low	23.7	Very low	115 Å²	115	138.4 Å²	138.4	78%	0.777	79%	0.785	S	S	*	*			trans	-75.8	145.9	163.7	-72.4	0	0	0	0	109.7	E570	C568-E570 PolarHBondContact O-N 2.8Å
569	N	24.3	Very low	23.9	Very low	137 Å²	137	138.4 Å²	138.4	73%	0.733	79%	0.79	S	S	*	*			trans	-85.1	113.4	176.3	-50.4	2.4	0	0	0	107.7
570	E	23.6	Very low	24.2	Very low	184 Å²	184	142.2 Å²	142.2	86%	0.86	80%	0.801	S	S	*	*			trans	-77.7	127	168.6	-66.9	-172.8	148	0	0	109.9	C568	C568-E570 PolarHBondContact O-N 2.8Å
571	Y	27.2	Very low	24.3	Very low	217 Å²	217	138.5 Å²	138.5	85%	0.851	79%	0.793	S	S	*	*			trans	-127.8	90.8	155.9	-78.6	-78.7	0	0	0	107.7
572	G	23.3	Very low	24.5	Very low	74 Å²	74	138.8 Å²	138.8	76%	0.763	80%	0.795	S	S	*	*			trans	-98.6	114.1	157.2	0	0	0	0	0	109
573	K	24.4	Very low	25	Very low	197 Å²	197	143.2 Å²	143.2	86%	0.857	80%	0.797	S	S	*	*			trans	-132.6	128.7	148.5	-86.5	-167	176.8	-175.5	0	107.5
574	A	21.2	Very low	25.2	Very low	99 Å²	99	143.4 Å²	143.4	82%	0.818	80%	0.804	S	S	*	*			trans	-83	145.1	174.9	0	0	0	0	0	110.7
575	F	22.9	Very low	25.5	Very low	205 Å²	205	143.3 Å²	143.3	90%	0.899	81%	0.806	S	S	*	*			trans	-128.4	140.6	158.3	-85.2	-83.7	0	0	0	108.4
576	S	23.1	Very low	25.9	Very low	111 Å²	111	145.6 Å²	145.6	78%	0.776	80%	0.801	S	S	*	*			trans	-72.1	158.6	175.6	-55.5	0	0	0	0	112
577	P	28.3	Very low	26.5	Very low	126 Å²	126	144.4 Å²	144.4	82%	0.818	80%	0.8	S	S	*	*			trans	-92.7	119.5	-168.5	34	-27.8	0	0	0	111.9
578	T	27	Very low	27.1	Very low	136 Å²	136	149.3 Å²	149.3	83%	0.834	80%	0.804	S	S	*	*			trans	-152.8	88.2	161.7	6.2	0	0	0	0	110.4
579	S	27.3	Very low	27.5	Very low	123 Å²	123	148.9 Å²	148.9	86%	0.86	81%	0.81	S	S	*	*			trans	165.4	133.8	141.7	37.6	0	0	0	0	109.3
580	Q	28.9	Very low	28.2	Very low	186 Å²	186	145.5 Å²	145.5	87%	0.869	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-64.8	157.4	178.4	-79.5	-173.1	-48.7	0	0	112.3
581	P	25.1	Very low	29.1	Very low	109 Å²	109	143.9 Å²	143.9	71%	0.708	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-80	141	-168.1	32.3	-32.4	0	0	0	112.3
582	T	28.8	Very low	30.3	Very low	112 Å²	112	139.2 Å²	139.2	69%	0.687	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-85.4	143.7	163.7	50.1	0	0	0	0	110.1	D584	T582-D584 PolarHBondContact O-N 3.11Å
583	E	33.8	Very low	31.4	Very low	163 Å²	163	138.5 Å²	138.5	76%	0.762	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-63.5	0.7	-169.4	-86.1	-138.2	125.9	0	0	116.7	Q585	E583-Q585 VanDerWaalsContact C-N 3.29Å; E583-Q585 PolarHBondContact O-N 2.94Å
584	D	28.8	Very low	32.5	Very low	163 Å²	163	130.7 Å²	130.7	87%	0.872	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-86.5	11.3	179.6	-72.7	-32.2	0	0	0	114.5	T582	T582-D584 PolarHBondContact O-N 3.11Å
585	Q	30.8	Very low	34.2	Very low	167 Å²	167	133.1 Å²	133.1	78%	0.78	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-103.8	19	176.2	-76.2	-171	-14.5	0	0	114.9	E583	E583-Q585 VanDerWaalsContact C-N 3.29Å; E583-Q585 PolarHBondContact O-N 2.94Å
586	K	31.5	Very low	35.7	Very low	167 Å²	167	123.5 Å²	123.5	73%	0.726	68%	0.681	S	S	*	*			trans	-115.5	57	177.4	-76.4	-177.2	-177.3	164.5	0	113.3
587	M	33.3	Very low	37.3	Very low	175 Å²	175	126.1 Å²	126.1	86%	0.862	68%	0.681	S	S	*	*	S	Bend	trans	-147.6	132.7	148.8	-73.2	-149.5	-169.9	0	0	111.7
588	H	33.3	Very low	38.7	Very low	169 Å²	169	126.5 Å²	126.5	78%	0.782	67%	0.672	S	S	*	*			trans	79.2	44.8	-172.9	-54.4	-60	0	0	0	117.9
589	A	31.5	Very low	40.2	Very low	107 Å²	107	122.5 Å²	122.5	88%	0.884	65%	0.649	S	S	*	*			trans	-77.5	118.6	146.9	0	0	0	0	0	109.3
590	G	38.9	Very low	41.4	Very low	65 Å²	65	119.1 Å²	119.1	67%	0.67	63%	0.633	S	S	*	*			trans	115.2	6	149	0	0	0	0	0	119.7	K592	G590-K592 PolarHBondContact O-N 2.85Å; G590-K592 VanDerWaalsContact O-N 3.08Å
591	E	42.5	Very low	42.9	Very low	150 Å²	150	114.2 Å²	114.2	70%	0.701	61%	0.613	S	S	*	*			trans	-76.7	107.9	175.5	-69.6	-163	174.5	0	0	111.9	P593	E591-P593 VanDerWaalsContact C-CD 3.46Å; E591-P593 WeakPolarHBondContact O-CD 3.42Å
592	K	51.7	Low	44.3	Very low	119 Å²	119	110.3 Å²	110.3	52%	0.517	59%	0.59	S	S	.	*			trans	-107.5	80.7	177.5	-78.9	163.6	157.1	-165.8	0	108.6	G590 Y594 A602 F603	G590-K592 PolarHBondContact O-N 2.85Å; G590-K592 VanDerWaalsContact O-N 3.08Å; K592-Y594 PolarHBondContact O-N 2.95Å; K592-A602 VanDerWaalsContact CB-C 3.47Å; K592-A602 HydrophobicContact CB-CB 3.36Å; K592-A602 HydrophobicContact CD-CB 4.02Å; K592-A602 WeakPolarHBondContact CD-O 3.48Å; K592-A602 WeakPolarHBondContact CE-O 3.46Å; K592-A602 HydrophobicContact CG-CB 4.28Å; K592-F603 CarbonylContact C-O 3.54Å; K592-F603 VanDerWaalsContact CA-O 3.3Å; K592-F603 WeakPolarHBondContact CA-O 3.48Å
593	P	46	Very low	45.8	Very low	59 Å²	59	106.9 Å²	106.9	38%	0.383	57%	0.565	S	S	.	*			trans	-72.6	-11.7	-169.1	27.3	-34.8	0	0	0	114	E591	E591-P593 VanDerWaalsContact C-CD 3.46Å; E591-P593 WeakPolarHBondContact O-CD 3.42Å
594	Y	48.6	Very low	46.4	Very low	33 Å²	33	103.5 Å²	103.5	13%	0.129	56%	0.56	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.2	100.3	-179.4	-59.8	-86.7	0	0	0	110	K592 A602 F603 G605 N606 L609	K592-Y594 PolarHBondContact O-N 2.95Å; Y594-A602 CarbonylContact O-C 3.57Å; Y594-A602 WeakPolarHBondContact O-CA 3.42Å; Y594-F603 WeakPolarHBondContact CB-O 3.42Å; Y594-F603 WeakPolarHBondContact CD2-O 3.41Å; Y594-F603 PolarHBondContact N-O 2.76Å; Y594-F603 PolarHBondContact O-N 2.85Å; Y594-G605 VanDerWaalsContact CD2-C 3.4Å; Y594-G605 VanDerWaalsContact CD2-CA 3.42Å; Y594-G605 VanDerWaalsContact CE2-CA 3.47Å; Y594-N606 HydrophobicContact CD1-CB 3.97Å; Y594-N606 HydrophobicContact CE1-CB 3.62Å; Y594-L609 HydrophobicContact CD1-CD2 4.5Å
595	K	56.7	Low	47.6	Very low	151 Å²	151	96.4 Å²	96.4	66%	0.657	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	131.9	178.6	-64	-175	-178.7	-178.1	0	111.5	N601 A602	K595-N601 CarbonylContact C-O 3.33Å; K595-N601 WeakPolarHBondContact CA-O 3.49Å; K595-A602 HydrophobicContact CG-CB 4.07Å
596	C	54.8	Low	48.3	Very low	2 Å²	2	90.9 Å²	90.9	1%	0.014	50%	0.501	C	S	.	.			trans	-73.5	123.2	169.2	-176	0	0	0	0	109.2	E598 C599 G600 N601 F603 L609 H616	C596-E598 VanDerWaalsContact C-N 3.28Å; C596-E598 PolarHBondContact O-N 3.35Å; C596-C599 VanDerWaalsContact SG-SG 3.61Å; C596-G600 WeakPolarHBondContact O-CA 3.47Å; C596-G600 PolarHBondContact O-N 2.99Å; C596-N601 PolarHBondContact N-O 3.44Å; C596-F603 HydrophobicContact CB-CE2 4.13Å; C596-L609 HydrophobicContact CB-CD1 3.65Å; C596-H616 VanDerWaalsContact SG-CD2 3.55Å; C596-H616 PolarHBondContact SG-NE2 3.17Å; C596-H616 VanDerWaalsContact SG-NE2 3.36Å
597	Q	56.4	Low	49	Very low	167 Å²	167	86.9 Å²	86.9	78%	0.78	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-18.8	-177.6	-74.7	-177.4	-47.7	0	0	113.6
598	E	56.3	Low	49.9	Very low	134 Å²	134	80.6 Å²	80.6	63%	0.626	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-31.2	-176.7	-67.2	179.4	163.2	0	0	113.2	C596 H616	C596-E598 VanDerWaalsContact C-N 3.28Å; C596-E598 PolarHBondContact O-N 3.35Å; E598-H616 WeakPolarHBondContact OE2-CB 3.2Å; E598-H616 IonicContact OE2-CD2 3.28Å; E598-H616 PolarHBondContact OE2-CD2 2.78Å; E598-H616 VanDerWaalsContact OE2-CD2 3.28Å; E598-H616 IonicContact OE2-CG 3.26Å; E598-H616 VanDerWaalsContact OE2-CG 3.26Å
599	C	60.3	Low	51.1	Low	52 Å²	52	73.2 Å²	73.2	35%	0.351	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129	1.2	-178	67.7	0	0	0	0	114.3	C596 N601 H612 H616	C596-C599 VanDerWaalsContact SG-SG 3.61Å; C599-N601 PolarHBondContact O-N 3.2Å; C599-N601 VanDerWaalsContact O-N 3.13Å; C599-N601 PolarHBondContact SG-ND2 3.4Å; C599-N601 VanDerWaalsContact SG-ND2 3.43Å; C599-H612 PolarHBondContact SG-NE2 3.22Å; C599-H616 VanDerWaalsContact SG-CE1 3.54Å; C599-H616 PolarHBondContact SG-NE2 3.31Å
600	G	52.5	Low	52.2	Low	52 Å²	52	72.3 Å²	72.3	54%	0.536	41%	0.411	S	S	.	.			trans	75	-6.9	179.5	0	0	0	0	0	115.8	C596 A602	C596-G600 WeakPolarHBondContact O-CA 3.47Å; C596-G600 PolarHBondContact O-N 2.99Å; G600-A602 PolarHBondContact O-N 3.45Å
601	N	60.1	Low	53.1	Low	82 Å²	82	74.8 Å²	74.8	44%	0.439	40%	0.4	S	S	.	.			trans	-61.3	133.2	-176.6	-76	-28.2	0	0	0	112.4	K595 C596 C599 F603 H612	K595-N601 CarbonylContact C-O 3.33Å; K595-N601 WeakPolarHBondContact CA-O 3.49Å; C596-N601 PolarHBondContact N-O 3.44Å; C599-N601 PolarHBondContact O-N 3.2Å; C599-N601 VanDerWaalsContact O-N 3.13Å; C599-N601 PolarHBondContact SG-ND2 3.4Å; C599-N601 VanDerWaalsContact SG-ND2 3.43Å; N601-F603 HydrophobicContact CB-CE2 3.56Å; N601-F603 HydrophobicContact CB-CZ 3.69Å; N601-F603 WeakPolarHBondContact O-CD2 3.42Å; N601-F603 WeakPolarHBondContact O-CE2 3.42Å; N601-H612 PolarHBondContact ND2-CE1 3.08Å; N601-H612 PolarHBondContact ND2-NE2 3.15Å
602	A	52.9	Low	54.1	Low	27 Å²	27	69.4 Å²	69.4	22%	0.223	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	136.2	-178.3	0	0	0	0	0	110.7	K592 Y594 K595 G600	K592-A602 VanDerWaalsContact CB-C 3.47Å; K592-A602 HydrophobicContact CB-CB 3.36Å; K592-A602 HydrophobicContact CD-CB 4.02Å; K592-A602 WeakPolarHBondContact CD-O 3.48Å; K592-A602 WeakPolarHBondContact CE-O 3.46Å; K592-A602 HydrophobicContact CG-CB 4.28Å; Y594-A602 CarbonylContact O-C 3.57Å; Y594-A602 WeakPolarHBondContact O-CA 3.42Å; K595-A602 HydrophobicContact CG-CB 4.07Å; G600-A602 PolarHBondContact O-N 3.45Å
603	F	60.3	Low	54.5	Low	41 Å²	41	67 Å²	67	18%	0.18	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	150.5	-177.9	-59.2	-87.5	0	0	0	111.6	K592 Y594 C596 N601 G605 L609 H612	K592-F603 CarbonylContact C-O 3.54Å; K592-F603 VanDerWaalsContact CA-O 3.3Å; K592-F603 WeakPolarHBondContact CA-O 3.48Å; Y594-F603 WeakPolarHBondContact CB-O 3.42Å; Y594-F603 WeakPolarHBondContact CD2-O 3.41Å; Y594-F603 PolarHBondContact N-O 2.76Å; Y594-F603 PolarHBondContact O-N 2.85Å; C596-F603 HydrophobicContact CB-CE2 4.13Å; N601-F603 HydrophobicContact CB-CE2 3.56Å; N601-F603 HydrophobicContact CB-CZ 3.69Å; N601-F603 WeakPolarHBondContact O-CD2 3.42Å; N601-F603 WeakPolarHBondContact O-CE2 3.42Å; F603-G605 VanDerWaalsContact C-N 3.3Å; F603-G605 PolarHBondContact O-N 3.18Å; F603-L609 HydrophobicContact CB-CB 4.29Å; F603-L609 HydrophobicContact CD2-CB 4.13Å; F603-L609 HydrophobicContact CD2-CD1 3.77Å; F603-L609 HydrophobicContact CE2-CD1 4.09Å; F603-L609 HydrophobicContact CG-CB 4.36Å; F603-H612 HydrophobicContact CE1-CB 3.85Å; F603-H612 AromaticContact CE1-CG 3.95Å; F603-H612 HydrophobicContact CE2-CB 3.94Å; F603-H612 AromaticContact CE2-CD2 3.33Å; F603-H612 WeakPolarHBondContact CE2-CD2 3.45Å; F603-H612 AromaticContact CE2-CG 3.71Å; F603-H612 HydrophobicContact CZ-CB 3.46Å; F603-H612 VanDerWaalsContact CZ-CB 3.46Å; F603-H612 AromaticContact CZ-CD2 3.2Å; F603-H612 WeakPolarHBondContact CZ-CD2 3.25Å; F603-H612 AromaticContact CZ-CG 3.16Å; F603-H612 AromaticContact CZ-ND1 3.71Å; F603-H612 AromaticContact CZ-NE2 3.73Å
604	S	47.8	Very low	55.1	Low	91 Å²	91	66.8 Å²	66.8	64%	0.636	36%	0.363	S	S	*	.	S	Bend	trans	-78.1	-10.3	177.8	53.6	0	0	0	0	113.8
605	G	53.6	Low	55.5	Low	15 Å²	15	68.2 Å²	68.2	16%	0.155	38%	0.375	C	S	.	.	S	Bend	trans	-150.6	153.5	-176.2	0	0	0	0	0	114.5	Y594 F603 S607 T608 L609	Y594-G605 VanDerWaalsContact CD2-C 3.4Å; Y594-G605 VanDerWaalsContact CD2-CA 3.42Å; Y594-G605 VanDerWaalsContact CE2-CA 3.47Å; F603-G605 VanDerWaalsContact C-N 3.3Å; F603-G605 PolarHBondContact O-N 3.18Å; G605-S607 PolarHBondContact O-N 3.24Å; G605-T608 PolarHBondContact N-OG1 2.78Å; G605-T608 PolarHBondContact O-N 3.06Å; G605-T608 PolarHBondContact O-OG1 3.05Å; G605-L609 PolarHBondContact O-N 2.84Å
606	N	44.7	Very low	55.5	Low	51 Å²	51	64.5 Å²	64.5	27%	0.273	36%	0.36	S	S	.	.	H	α-helix	trans	-67.9	-33.5	178.2	-165.5	36	0	0	0	112.7	Y594 T608 L609 I610	Y594-N606 HydrophobicContact CD1-CB 3.97Å; Y594-N606 HydrophobicContact CE1-CB 3.62Å; N606-T608 VanDerWaalsContact C-N 3.32Å; N606-L609 PolarHBondContact O-N 2.86Å; N606-I610 WeakPolarHBondContact O-CB 3.44Å; N606-I610 WeakPolarHBondContact O-CG1 3.24Å; N606-I610 PolarHBondContact O-N 3.45Å
607	S	46.2	Very low	55.4	Low	83 Å²	83	69.3 Å²	69.3	58%	0.58	39%	0.39	S	S	*	.	H	α-helix	trans	-72.1	-25.4	178.2	55.7	0	0	0	0	113.1	G605 R611	G605-S607 PolarHBondContact O-N 3.24Å; S607-R611 WeakPolarHBondContact O-CB 3.44Å; S607-R611 PolarHBondContact O-N 3.36Å
608	T	53.7	Low	55.1	Low	42 Å²	42	64 Å²	64	26%	0.258	38%	0.38	S	S	.	.	H	α-helix	trans	-82.2	-38	172.6	41.9	0	0	0	0	111.2	G605 N606 R611 H612	G605-T608 PolarHBondContact N-OG1 2.78Å; G605-T608 PolarHBondContact O-N 3.06Å; G605-T608 PolarHBondContact O-OG1 3.05Å; N606-T608 VanDerWaalsContact C-N 3.32Å; T608-R611 PolarHBondContact O-N 3.31Å; T608-H612 WeakPolarHBondContact O-CB 3.39Å; T608-H612 PolarHBondContact O-N 2.84Å
609	L	56.8	Low	54.7	Low	14 Å²	14	59 Å²	59	7%	0.073	37%	0.365	C	S	.	.	H	α-helix	trans	-60.8	-50.8	170.6	173.1	62.4	0	0	0	112.2	Y594 C596 F603 G605 N606 R611 H612 Q613	Y594-L609 HydrophobicContact CD1-CD2 4.5Å; C596-L609 HydrophobicContact CB-CD1 3.65Å; F603-L609 HydrophobicContact CB-CB 4.29Å; F603-L609 HydrophobicContact CD2-CB 4.13Å; F603-L609 HydrophobicContact CD2-CD1 3.77Å; F603-L609 HydrophobicContact CE2-CD1 4.09Å; F603-L609 HydrophobicContact CG-CB 4.36Å; G605-L609 PolarHBondContact O-N 2.84Å; N606-L609 PolarHBondContact O-N 2.86Å; L609-R611 PolarHBondContact O-N 2.91Å; L609-H612 CarbonylContact O-C 3.54Å; L609-H612 PolarHBondContact O-N 3.01Å; L609-H612 VanDerWaalsContact O-N 3.1Å; L609-Q613 HydrophobicContact CD1-CG 4.07Å; L609-Q613 HydrophobicContact CG-CG 4.44Å; L609-Q613 WeakPolarHBondContact O-CG 3.42Å; L609-Q613 PolarHBondContact O-N 3.14Å
610	I	55.3	Low	54.5	Low	89 Å²	89	62.7 Å²	62.7	46%	0.456	38%	0.375	S	S	.	.	H	α-helix	trans	-59.4	-39.7	179.5	-70.4	167.8	0	0	0	110.5	N606 Q613 V614	N606-I610 WeakPolarHBondContact O-CB 3.44Å; N606-I610 WeakPolarHBondContact O-CG1 3.24Å; N606-I610 PolarHBondContact O-N 3.45Å; I610-Q613 PolarHBondContact O-N 2.78Å; I610-V614 WeakPolarHBondContact O-CG2 3.39Å; I610-V614 PolarHBondContact O-N 3.36Å
611	R	58.3	Low	54.3	Low	117 Å²	117	64.6 Å²	64.6	44%	0.442	38%	0.377	S	S	.	.	H	α-helix	trans	-65.9	-37.5	176.4	-166.3	-172.8	-37.7	168.9	8.4	112.7	S607 T608 L609	S607-R611 WeakPolarHBondContact O-CB 3.44Å; S607-R611 PolarHBondContact O-N 3.36Å; T608-R611 PolarHBondContact O-N 3.31Å; L609-R611 PolarHBondContact O-N 2.91Å
612	H	63.7	Low	53.6	Low	36 Å²	36	62.5 Å²	62.5	17%	0.167	37%	0.369	C	S	.	.	H	α-helix	trans	-70.8	-35.1	173.9	179	67.6	0	0	0	112.4	C599 N601 F603 T608 L609 V614 T615 H616	C599-H612 PolarHBondContact SG-NE2 3.22Å; N601-H612 PolarHBondContact ND2-CE1 3.08Å; N601-H612 PolarHBondContact ND2-NE2 3.15Å; F603-H612 HydrophobicContact CE1-CB 3.85Å; F603-H612 AromaticContact CE1-CG 3.95Å; F603-H612 HydrophobicContact CE2-CB 3.94Å; F603-H612 AromaticContact CE2-CD2 3.33Å; F603-H612 WeakPolarHBondContact CE2-CD2 3.45Å; F603-H612 AromaticContact CE2-CG 3.71Å; F603-H612 HydrophobicContact CZ-CB 3.46Å; F603-H612 VanDerWaalsContact CZ-CB 3.46Å; F603-H612 AromaticContact CZ-CD2 3.2Å; F603-H612 WeakPolarHBondContact CZ-CD2 3.25Å; F603-H612 AromaticContact CZ-CG 3.16Å; F603-H612 AromaticContact CZ-ND1 3.71Å; F603-H612 AromaticContact CZ-NE2 3.73Å; T608-H612 WeakPolarHBondContact O-CB 3.39Å; T608-H612 PolarHBondContact O-N 2.84Å; L609-H612 CarbonylContact O-C 3.54Å; L609-H612 PolarHBondContact O-N 3.01Å; L609-H612 VanDerWaalsContact O-N 3.1Å; H612-V614 PolarHBondContact O-N 3.04Å; H612-T615 PolarHBondContact O-N 3.38Å; H612-T615 PolarHBondContact O-OG1 3.41Å; H612-H616 AromaticContact CD2-NE2 3.66Å; H612-H616 AromaticContact CE1-NE2 3.86Å; H612-H616 AromaticContact NE2-CE1 3.76Å; H612-H616 AromaticContact NE2-NE2 3.21Å; H612-H616 PolarHBondContact NE2-NE2 2.97Å
613	Q	59.3	Low	53.3	Low	70 Å²	70	66.1 Å²	66.1	33%	0.327	38%	0.381	S	S	.	.	H	α-helix	trans	-64.3	-27.7	176.2	-73.2	172	-35.4	0	0	112.8	L609 I610 T615 H616	L609-Q613 HydrophobicContact CD1-CG 4.07Å; L609-Q613 HydrophobicContact CG-CG 4.44Å; L609-Q613 WeakPolarHBondContact O-CG 3.42Å; L609-Q613 PolarHBondContact O-N 3.14Å; I610-Q613 PolarHBondContact O-N 2.78Å; Q613-T615 PolarHBondContact O-N 3.19Å; Q613-H616 PolarHBondContact O-N 3.04Å
614	V	58.2	Low	52.6	Low	53 Å²	53	64.3 Å²	64.3	32%	0.321	37%	0.373	S	S	.	.	H	α-helix	trans	-64.8	-24	172.9	176.6	0	0	0	0	112	I610 H612 T617 G619	I610-V614 WeakPolarHBondContact O-CG2 3.39Å; I610-V614 PolarHBondContact O-N 3.36Å; H612-V614 PolarHBondContact O-N 3.04Å; V614-T617 PolarHBondContact O-OG1 3.47Å; V614-T617 VanDerWaalsContact O-OG1 3.13Å; V614-G619 VanDerWaalsContact CG1-O 3.29Å; V614-G619 WeakPolarHBondContact CG1-O 3.5Å; V614-G619 PolarHBondContact O-N 3.44Å
615	T	57.3	Low	52.4	Low	63 Å²	63	63.9 Å²	63.9	39%	0.387	37%	0.37	S	S	.	.	H	α-helix	trans	-74.7	-25.4	176.7	66.8	0	0	0	0	113.4	H612 Q613	H612-T615 PolarHBondContact O-N 3.38Å; H612-T615 PolarHBondContact O-OG1 3.41Å; Q613-T615 PolarHBondContact O-N 3.19Å
616	H	56.7	Low	51.8	Low	73 Å²	73	67.9 Å²	67.9	34%	0.338	39%	0.391	S	S	.	.	H	α-helix	trans	-80.2	-29.6	177.2	-62.4	-49.2	0	0	0	113	C596 E598 C599 H612 Q613 G618	C596-H616 VanDerWaalsContact SG-CD2 3.55Å; C596-H616 PolarHBondContact SG-NE2 3.17Å; C596-H616 VanDerWaalsContact SG-NE2 3.36Å; E598-H616 WeakPolarHBondContact OE2-CB 3.2Å; E598-H616 IonicContact OE2-CD2 3.28Å; E598-H616 PolarHBondContact OE2-CD2 2.78Å; E598-H616 VanDerWaalsContact OE2-CD2 3.28Å; E598-H616 IonicContact OE2-CG 3.26Å; E598-H616 VanDerWaalsContact OE2-CG 3.26Å; C599-H616 VanDerWaalsContact SG-CE1 3.54Å; C599-H616 PolarHBondContact SG-NE2 3.31Å; H612-H616 AromaticContact CD2-NE2 3.66Å; H612-H616 AromaticContact CE1-NE2 3.86Å; H612-H616 AromaticContact NE2-CE1 3.76Å; H612-H616 AromaticContact NE2-NE2 3.21Å; H612-H616 PolarHBondContact NE2-NE2 2.97Å; Q613-H616 PolarHBondContact O-N 3.04Å; H616-G618 PolarHBondContact O-N 3.47Å
617	T	53.6	Low	52.1	Low	103 Å²	103	68.3 Å²	68.3	63%	0.632	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	2.9	176.2	52.4	0	0	0	0	113.2	V614 G619	V614-T617 PolarHBondContact O-OG1 3.47Å; V614-T617 VanDerWaalsContact O-OG1 3.13Å; T617-G619 PolarHBondContact O-N 3.47Å; T617-G619 VanDerWaalsContact O-N 3.13Å
618	G	49.4	Very low	52.3	Low	57 Å²	57	67.4 Å²	67.4	59%	0.588	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	7.8	-177.1	0	0	0	0	0	114.3	H616 K620	H616-G618 PolarHBondContact O-N 3.47Å; G618-K620 PolarHBondContact O-N 3.2Å
619	G	47.6	Very low	52.1	Low	29 Å²	29	71.6 Å²	71.6	30%	0.299	42%	0.416	S	S	.	.			trans	-68.3	112.9	-178.6	0	0	0	0	0	111	V614 T617 P621	V614-G619 VanDerWaalsContact CG1-O 3.29Å; V614-G619 WeakPolarHBondContact CG1-O 3.5Å; V614-G619 PolarHBondContact O-N 3.44Å; T617-G619 PolarHBondContact O-N 3.47Å; T617-G619 VanDerWaalsContact O-N 3.13Å; G619-P621 WeakPolarHBondContact O-CD 3.4Å
620	K	56.3	Low	51.7	Low	129 Å²	129	72.5 Å²	72.5	56%	0.561	43%	0.425	S	S	*	.			trans	-108.6	84.6	173.5	-69.3	167.3	163.5	-156.3	0	108.8	G618 C622 A630 F631	G618-K620 PolarHBondContact O-N 3.2Å; K620-C622 VanDerWaalsContact C-N 3.26Å; K620-C622 PolarHBondContact O-N 3.27Å; K620-A630 HydrophobicContact CB-CB 3.5Å; K620-A630 HydrophobicContact CD-CB 3.71Å; K620-A630 VanDerWaalsContact CD-O 3.22Å; K620-A630 WeakPolarHBondContact CD-O 3.37Å; K620-A630 WeakPolarHBondContact CE-O 3.42Å; K620-A630 HydrophobicContact CG-CB 4.22Å; K620-A630 PolarHBondContact NZ-O 3.06Å; K620-F631 CarbonylContact C-O 3.32Å; K620-F631 VanDerWaalsContact CA-O 3.31Å; K620-F631 WeakPolarHBondContact CA-O 3.39Å
621	P	49.1	Very low	51.6	Low	91 Å²	91	69.9 Å²	69.9	59%	0.591	41%	0.411	S	S	*	.			trans	-72.2	-19.1	-171.1	28.8	-35.5	0	0	0	113.5	G619	G619-P621 WeakPolarHBondContact O-CD 3.4Å
622	C	44.4	Very low	51.1	Low	39 Å²	39	66 Å²	66	26%	0.264	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	122.1	178.2	-56.6	0	0	0	0	109	K620 A630 F631	K620-C622 VanDerWaalsContact C-N 3.26Å; K620-C622 PolarHBondContact O-N 3.27Å; C622-A630 CarbonylContact O-C 3.26Å; C622-A630 WeakPolarHBondContact O-CA 3.11Å; C622-F631 PolarHBondContact N-O 3.13Å; C622-F631 PolarHBondContact O-N 3.08Å
623	H	47.6	Very low	50.5	Low	103 Å²	103	67.7 Å²	67.7	48%	0.477	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	134.9	177.8	60.4	-75.5	0	0	0	109.5	S625	H623-S625 PolarHBondContact O-N 3.16Å
624	C	45.6	Very low	49.7	Very low	3 Å²	3	67.2 Å²	67.2	2%	0.02	41%	0.414	C	S	.	.			trans	-75.8	114.5	168.6	-179.1	0	0	0	0	108	V626 C627 G628 K629 F631	C624-V626 PolarHBondContact O-N 2.96Å; C624-V626 VanDerWaalsContact O-N 3.09Å; C624-C627 VanDerWaalsContact CB-SG 3.54Å; C624-G628 WeakPolarHBondContact O-CA 3.49Å; C624-G628 PolarHBondContact O-N 3.14Å; C624-K629 PolarHBondContact N-O 2.84Å; C624-F631 HydrophobicContact CB-CE2 4.37Å
625	S	42.3	Very low	49.3	Very low	82 Å²	82	68.7 Å²	68.7	57%	0.573	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-16	-179.6	45.8	0	0	0	0	114.3	H623 H644	H623-S625 PolarHBondContact O-N 3.16Å; S625-H644 PolarHBondContact OG-O 3.23Å
626	V	41.5	Very low	48.9	Very low	98 Å²	98	70.2 Å²	70.2	59%	0.594	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-43.1	-176.7	179.7	0	0	0	0	112.7	C624 H644	C624-V626 PolarHBondContact O-N 2.96Å; C624-V626 VanDerWaalsContact O-N 3.09Å; V626-H644 HydrophobicContact CB-CB 4.39Å; V626-H644 HydrophobicContact CG2-CB 3.77Å
627	C	52	Low	48.7	Very low	61 Å²	61	67.3 Å²	67.3	41%	0.412	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-0.8	-179	73.7	0	0	0	0	114.3	C624 K629	C624-C627 VanDerWaalsContact CB-SG 3.54Å; C627-K629 PolarHBondContact O-N 3.08Å
628	G	48.8	Very low	48.7	Very low	63 Å²	63	65.6 Å²	65.6	65%	0.649	41%	0.406	S	S	*	.			trans	67.5	-0.4	177.5	0	0	0	0	0	115	C624 A630	C624-G628 WeakPolarHBondContact O-CA 3.49Å; C624-G628 PolarHBondContact O-N 3.14Å; G628-A630 PolarHBondContact O-N 3.16Å
629	K	50.5	Low	48.5	Very low	130 Å²	130	66.9 Å²	66.9	57%	0.565	40%	0.404	S	S	*	.			trans	-71.2	129.2	179.2	-68.9	-177.6	-179	178.5	0	109.9	C624 C627 F631	C624-K629 PolarHBondContact N-O 2.84Å; C627-K629 PolarHBondContact O-N 3.08Å; K629-F631 HydrophobicContact CB-CE2 3.83Å; K629-F631 HydrophobicContact CB-CZ 3.83Å; K629-F631 WeakPolarHBondContact O-CD2 3.43Å; K629-F631 VanDerWaalsContact O-CE2 3.22Å; K629-F631 WeakPolarHBondContact O-CE2 3.29Å
630	A	49.4	Very low	48.5	Very low	33 Å²	33	69.5 Å²	69.5	27%	0.273	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	136	-178.4	0	0	0	0	0	110.5	K620 C622 G628	K620-A630 HydrophobicContact CB-CB 3.5Å; K620-A630 HydrophobicContact CD-CB 3.71Å; K620-A630 VanDerWaalsContact CD-O 3.22Å; K620-A630 WeakPolarHBondContact CD-O 3.37Å; K620-A630 WeakPolarHBondContact CE-O 3.42Å; K620-A630 HydrophobicContact CG-CB 4.22Å; K620-A630 PolarHBondContact NZ-O 3.06Å; C622-A630 CarbonylContact O-C 3.26Å; C622-A630 WeakPolarHBondContact O-CA 3.11Å; G628-A630 PolarHBondContact O-N 3.16Å
631	F	53.3	Low	48.1	Very low	34 Å²	34	65.2 Å²	65.2	15%	0.149	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	156.2	-171.1	-56.8	-89.2	0	0	0	111.2	K620 C622 C624 K629 Q636 L637	K620-F631 CarbonylContact C-O 3.32Å; K620-F631 VanDerWaalsContact CA-O 3.31Å; K620-F631 WeakPolarHBondContact CA-O 3.39Å; C622-F631 PolarHBondContact N-O 3.13Å; C622-F631 PolarHBondContact O-N 3.08Å; C624-F631 HydrophobicContact CB-CE2 4.37Å; K629-F631 HydrophobicContact CB-CE2 3.83Å; K629-F631 HydrophobicContact CB-CZ 3.83Å; K629-F631 WeakPolarHBondContact O-CD2 3.43Å; K629-F631 VanDerWaalsContact O-CE2 3.22Å; K629-F631 WeakPolarHBondContact O-CE2 3.29Å; F631-Q636 HydrophobicContact CD1-CB 4.23Å; F631-L637 HydrophobicContact CD2-CD2 3.75Å; F631-L637 HydrophobicContact CE2-CD2 3.58Å; F631-L637 HydrophobicContact CZ-CD2 4.26Å
632	S	45.8	Very low	48	Very low	36 Å²	36	63.1 Å²	63.1	25%	0.252	38%	0.38	S	S	.	.	S	Bend	trans	-85.3	-17.3	177.1	57.2	0	0	0	0	113.1	Q636	S632-Q636 PolarHBondContact OG-OE1 3.14Å
633	Q	51.1	Low	47.9	Very low	71 Å²	71	64.6 Å²	64.6	33%	0.332	39%	0.388	S	S	.	.			trans	-142.9	146.7	179.8	-53.1	-176.9	27.9	0	0	111	S635 Q636	Q633-S635 VanDerWaalsContact C-N 3.31Å; Q633-S635 PolarHBondContact O-N 2.81Å; Q633-S635 PolarHBondContact OE1-OG 3.22Å; Q633-Q636 HydrophobicContact CB-CG 4.17Å; Q633-Q636 PolarHBondContact O-N 3.34Å
634	S	44.4	Very low	47.7	Very low	61 Å²	61	64.8 Å²	64.8	43%	0.427	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-69	-27.7	174.2	57.4	0	0	0	0	113	Q636 L637	S634-Q636 PolarHBondContact O-N 2.79Å; S634-L637 WeakPolarHBondContact O-CG 3.49Å; S634-L637 PolarHBondContact O-N 2.64Å
635	S	48.1	Very low	47.3	Very low	84 Å²	84	67.5 Å²	67.5	59%	0.587	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-67.7	-9.2	175.8	53.3	0	0	0	0	114.6	Q633	Q633-S635 VanDerWaalsContact C-N 3.31Å; Q633-S635 PolarHBondContact O-N 2.81Å; Q633-S635 PolarHBondContact OE1-OG 3.22Å
636	Q	49.4	Very low	47	Very low	95 Å²	95	66.9 Å²	66.9	44%	0.444	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-91.6	-0.5	178	-69.4	-179	-17.9	0	0	113.5	F631 S632 Q633 S634	F631-Q636 HydrophobicContact CD1-CB 4.23Å; S632-Q636 PolarHBondContact OG-OE1 3.14Å; Q633-Q636 HydrophobicContact CB-CG 4.17Å; Q633-Q636 PolarHBondContact O-N 3.34Å; S634-Q636 PolarHBondContact O-N 2.79Å
637	L	53.6	Low	46.6	Very low	11 Å²	11	66.7 Å²	66.7	6%	0.058	40%	0.404	C	S	.	.	S	Bend	trans	-73.7	129.8	172.5	-66.4	165.9	0	0	0	109.5	F631 S634 Q641 Q642 V645	F631-L637 HydrophobicContact CD2-CD2 3.75Å; F631-L637 HydrophobicContact CE2-CD2 3.58Å; F631-L637 HydrophobicContact CZ-CD2 4.26Å; S634-L637 WeakPolarHBondContact O-CG 3.49Å; S634-L637 PolarHBondContact O-N 2.64Å; L637-Q641 HydrophobicContact CB-CB 4.15Å; L637-Q641 HydrophobicContact CD2-CB 4.02Å; L637-Q642 HydrophobicContact CB-CG 3.71Å; L637-Q642 PolarHBondContact O-NE2 3.29Å; L637-V645 HydrophobicContact CD1-CG2 4.19Å
638	T	52.4	Low	45.5	Very low	67 Å²	67	73.7 Å²	73.7	41%	0.411	43%	0.428	S	S	.	.			trans	-65.6	158.2	170.9	63.9	0	0	0	0	110.4	P640 Q641 Q642	T638-P640 VanDerWaalsContact C-CD 3.46Å; T638-P640 VanDerWaalsContact C-N 3.32Å; T638-Q641 CarbonylContact O-C 3.57Å; T638-Q641 WeakPolarHBondContact O-CA 3.37Å; T638-Q641 WeakPolarHBondContact O-CB 3.38Å; T638-Q641 PolarHBondContact O-N 2.84Å; T638-Q641 WeakPolarHBondContact OG1-CG 3.44Å; T638-Q641 PolarHBondContact OG1-OE1 3.39Å; T638-Q641 VanDerWaalsContact OG1-OE1 3.08Å; T638-Q642 PolarHBondContact O-N 2.94Å
639	P	45.8	Very low	44.6	Very low	85 Å²	85	73.2 Å²	73.2	55%	0.552	41%	0.413	S	S	*	.	H	α-helix	trans	-54.1	-37.8	-178.7	-23.7	31.9	0	0	0	114.9	Q641 Q642	P639-Q641 VanDerWaalsContact C-N 3.26Å; P639-Q641 PolarHBondContact O-N 3.32Å; P639-Q642 PolarHBondContact O-N 3.37Å
640	P	46.9	Very low	43.7	Very low	83 Å²	83	72 Å²	72	54%	0.539	43%	0.427	S	S	.	.	H	α-helix	trans	-67.8	-20.7	170.8	-19.6	32.5	0	0	0	114.3	T638 T643 H644	T638-P640 VanDerWaalsContact C-CD 3.46Å; T638-P640 VanDerWaalsContact C-N 3.32Å; P640-T643 PolarHBondContact O-OG1 3.48Å; P640-H644 PolarHBondContact O-CD2 3.04Å
641	Q	47.1	Very low	43	Very low	40 Å²	40	75.1 Å²	75.1	19%	0.187	44%	0.439	C	S	.	.	H	α-helix	trans	-89.2	-21.7	178	-66.2	167.4	-15	0	0	112.2	L637 T638 P639 V645	L637-Q641 HydrophobicContact CB-CB 4.15Å; L637-Q641 HydrophobicContact CD2-CB 4.02Å; T638-Q641 CarbonylContact O-C 3.57Å; T638-Q641 WeakPolarHBondContact O-CA 3.37Å; T638-Q641 WeakPolarHBondContact O-CB 3.38Å; T638-Q641 PolarHBondContact O-N 2.84Å; T638-Q641 WeakPolarHBondContact OG1-CG 3.44Å; T638-Q641 PolarHBondContact OG1-OE1 3.39Å; T638-Q641 VanDerWaalsContact OG1-OE1 3.08Å; P639-Q641 VanDerWaalsContact C-N 3.26Å; P639-Q641 PolarHBondContact O-N 3.32Å; Q641-V645 WeakPolarHBondContact O-CG2 3.38Å
642	Q	47.4	Very low	42	Very low	47 Å²	47	78.9 Å²	78.9	22%	0.22	46%	0.461	C	S	.	.	H	α-helix	trans	-72	-37.6	173.9	-70.4	174.6	-11.7	0	0	112	L637 T638 P639 H644 V645 E647	L637-Q642 HydrophobicContact CB-CG 3.71Å; L637-Q642 PolarHBondContact O-NE2 3.29Å; T638-Q642 PolarHBondContact O-N 2.94Å; P639-Q642 PolarHBondContact O-N 3.37Å; Q642-H644 VanDerWaalsContact C-N 3.27Å; Q642-H644 PolarHBondContact O-N 3.4Å; Q642-V645 PolarHBondContact O-N 2.76Å; Q642-E647 CarbonylContact C-O 3.58Å; Q642-E647 VanDerWaalsContact C-O 3.28Å; Q642-E647 HydrophobicContact CB-CB 4.32Å; Q642-E647 PolarHBondContact O-N 2.99Å; Q642-E647 VanDerWaalsContact O-N 3.13Å
643	T	43.7	Very low	41.6	Very low	70 Å²	70	82.9 Å²	82.9	43%	0.429	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-61.4	-32.6	176.8	48.3	0	0	0	0	113.2	P640 P649	P640-T643 PolarHBondContact O-OG1 3.48Å; T643-P649 VanDerWaalsContact CG2-CD 3.44Å; T643-P649 HydrophobicContact CG2-CG 3.56Å
644	H	43.6	Very low	40.9	Very low	106 Å²	106	82.2 Å²	82.2	49%	0.491	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-80.2	-16.4	179.7	-68.8	-57.3	0	0	0	114.2	S625 V626 P640 Q642	S625-H644 PolarHBondContact OG-O 3.23Å; V626-H644 HydrophobicContact CB-CB 4.39Å; V626-H644 HydrophobicContact CG2-CB 3.77Å; P640-H644 PolarHBondContact O-CD2 3.04Å; Q642-H644 VanDerWaalsContact C-N 3.27Å; Q642-H644 PolarHBondContact O-N 3.4Å
645	V	35.6	Very low	40.4	Very low	61 Å²	61	81.2 Å²	81.2	37%	0.37	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-98.7	10	178.1	-172.8	0	0	0	0	110.9	L637 Q641 Q642 E647	L637-V645 HydrophobicContact CD1-CG2 4.19Å; Q641-V645 WeakPolarHBondContact O-CG2 3.38Å; Q642-V645 PolarHBondContact O-N 2.76Å; V645-E647 VanDerWaalsContact C-N 3.27Å; V645-E647 PolarHBondContact O-N 2.99Å
646	G	36.3	Very low	39.7	Very low	68 Å²	68	82.6 Å²	82.6	70%	0.701	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	8.4	179.9	0	0	0	0	0	114.4	K648	G646-K648 PolarHBondContact O-N 3.07Å
647	E	34	Very low	39.1	Very low	95 Å²	95	87.2 Å²	87.2	44%	0.444	49%	0.493	S	S	.	.			trans	-85.7	108.9	167.9	-72.6	-173	162.6	0	0	108.7	Q642 V645 P649	Q642-E647 CarbonylContact C-O 3.58Å; Q642-E647 VanDerWaalsContact C-O 3.28Å; Q642-E647 HydrophobicContact CB-CB 4.32Å; Q642-E647 PolarHBondContact O-N 2.99Å; Q642-E647 VanDerWaalsContact O-N 3.13Å; V645-E647 VanDerWaalsContact C-N 3.27Å; V645-E647 PolarHBondContact O-N 2.99Å; E647-P649 WeakPolarHBondContact O-CD 3.28Å
648	K	28.5	Very low	38.1	Very low	207 Å²	207	94.5 Å²	94.5	90%	0.9	52%	0.521	S	S	*	.			trans	-61.9	120.6	171.3	-78.9	-179.6	176.3	176.6	0	108.8	G646 A650	G646-K648 PolarHBondContact O-N 3.07Å; K648-A650 PolarHBondContact O-N 2.94Å
649	P	30.4	Very low	37.1	Very low	54 Å²	54	98.3 Å²	98.3	35%	0.351	53%	0.532	S	S	.	.			trans	-66.2	138.1	170.4	27.2	-32.2	0	0	0	109.1	T643 E647 L651	T643-P649 VanDerWaalsContact CG2-CD 3.44Å; T643-P649 HydrophobicContact CG2-CG 3.56Å; E647-P649 WeakPolarHBondContact O-CD 3.28Å; P649-L651 PolarHBondContact O-N 3.3Å
650	A	30.9	Very low	36.7	Very low	104 Å²	104	99.8 Å²	99.8	86%	0.86	53%	0.534	S	S	*	.			trans	-65.9	101.3	171.2	0	0	0	0	0	109.1	K648 N652	K648-A650 PolarHBondContact O-N 2.94Å; A650-N652 PolarHBondContact O-N 2.83Å
651	L	33.9	Very low	36	Very low	99 Å²	99	101.9 Å²	101.9	52%	0.518	54%	0.537	S	S	.	.			trans	-63.2	117.7	169.8	-80.8	158.9	0	0	0	109.1	P649	P649-L651 PolarHBondContact O-N 3.3Å
652	N	33.3	Very low	35.4	Very low	113 Å²	113	103.2 Å²	103.2	60%	0.604	55%	0.545	S	S	*	.			trans	-56.7	147.9	167.7	43.8	3.4	0	0	0	111.6	A650 G654 S655	A650-N652 PolarHBondContact O-N 2.83Å; N652-G654 PolarHBondContact O-N 3.1Å; N652-S655 PolarHBondContact O-N 3.07Å; N652-S655 PolarHBondContact OD1-OG 2.87Å
653	D	37.3	Very low	34.6	Very low	119 Å²	119	107.9 Å²	107.9	64%	0.636	56%	0.564	S	S	*	*	H	α-helix	trans	-63.2	-20.7	-163.7	-145.4	27.1	0	0	0	114.3
654	G	36.3	Very low	34.3	Very low	57 Å²	57	110.8 Å²	110.8	59%	0.588	57%	0.571	S	S	*	*	H	α-helix	trans	-70.3	-34.3	172.9	0	0	0	0	0	114.1	N652 K656 R657	N652-G654 PolarHBondContact O-N 3.1Å; G654-K656 VanDerWaalsContact C-N 3.33Å; G654-K656 PolarHBondContact O-N 3.18Å; G654-R657 PolarHBondContact O-N 3.14Å
655	S	33.7	Very low	33.9	Very low	41 Å²	41	110.5 Å²	110.5	29%	0.287	57%	0.572	S	S	.	*	H	α-helix	trans	-76.7	-21.8	-176.9	-52.5	0	0	0	0	112.5	N652 F659	N652-S655 PolarHBondContact O-N 3.07Å; N652-S655 PolarHBondContact OD1-OG 2.87Å; S655-F659 PolarHBondContact O-N 3.48Å
656	K	33.6	Very low	33.7	Very low	113 Å²	113	115.2 Å²	115.2	49%	0.491	59%	0.588	S	S	.	*	H	α-helix	trans	-73	-32.4	174.2	-70.7	178.3	-176.9	170.3	0	112.5	G654 I660	G654-K656 VanDerWaalsContact C-N 3.33Å; G654-K656 PolarHBondContact O-N 3.18Å; K656-I660 VanDerWaalsContact O-CG1 3.27Å; K656-I660 WeakPolarHBondContact O-CG1 3.48Å; K656-I660 PolarHBondContact O-N 3.2Å; K656-I660 VanDerWaalsContact O-N 3.17Å
657	R	37.3	Very low	33.8	Very low	191 Å²	191	119 Å²	119	72%	0.721	59%	0.587	S	S	*	*	H	α-helix	trans	-69.5	-38.2	176.1	-71.3	-174.8	-179.5	-176.1	-0	112	G654 I660 Q661	G654-R657 PolarHBondContact O-N 3.14Å; R657-I660 PolarHBondContact O-N 2.77Å; R657-Q661 PolarHBondContact O-N 3.12Å; R657-Q661 VanDerWaalsContact O-N 3.08Å
658	Y	31.8	Very low	34	Very low	164 Å²	164	121.6 Å²	121.6	64%	0.643	60%	0.599	S	S	*	*	H	α-helix	trans	-66.2	-39.7	177.6	-161	-101.4	0	0	0	112.6	Q661 I662	Y658-Q661 PolarHBondContact O-N 3.41Å; Y658-I662 HydrophobicContact CD1-CD1 3.83Å; Y658-I662 HydrophobicContact CE1-CD1 3.47Å; Y658-I662 VanDerWaalsContact CE1-CD1 3.47Å; Y658-I662 HydrophobicContact CE1-CG1 4.45Å; Y658-I662 PolarHBondContact O-N 2.74Å; Y658-I662 VanDerWaalsContact O-N 3.15Å
659	F	31	Very low	34.5	Very low	147 Å²	147	121.9 Å²	121.9	65%	0.645	60%	0.595	S	S	*	*	H	α-helix	trans	-71.3	-32.4	176.5	-102.8	-85.3	0	0	0	113.8	S655 K663	S655-F659 PolarHBondContact O-N 3.48Å; F659-K663 WeakPolarHBondContact O-CB 3.37Å; F659-K663 PolarHBondContact O-N 3.3Å; F659-K663 VanDerWaalsContact O-N 3.08Å
660	I	38.2	Very low	34.9	Very low	117 Å²	117	127 Å²	127	60%	0.6	61%	0.614	S	S	*	*	H	α-helix	trans	-69.8	-37.4	174.3	-68.6	169.8	0	0	0	110.5	K656 R657 K663 K664	K656-I660 VanDerWaalsContact O-CG1 3.27Å; K656-I660 WeakPolarHBondContact O-CG1 3.48Å; K656-I660 PolarHBondContact O-N 3.2Å; K656-I660 VanDerWaalsContact O-N 3.17Å; R657-I660 PolarHBondContact O-N 2.77Å; I660-K663 PolarHBondContact O-N 2.86Å; I660-K664 WeakPolarHBondContact O-CB 3.15Å; I660-K664 PolarHBondContact O-N 2.88Å; I660-K664 VanDerWaalsContact O-N 3.08Å
661	Q	31.6	Very low	35	Very low	127 Å²	127	135.6 Å²	135.6	59%	0.593	63%	0.632	S	S	*	*	H	α-helix	trans	-64.4	-43.7	176.3	-154.1	81	8.7	0	0	111.9	R657 Y658 K664 I665	R657-Q661 PolarHBondContact O-N 3.12Å; R657-Q661 VanDerWaalsContact O-N 3.08Å; Y658-Q661 PolarHBondContact O-N 3.41Å; Q661-K664 PolarHBondContact O-N 2.94Å; Q661-I665 HydrophobicContact CG-CD1 4.38Å; Q661-I665 WeakPolarHBondContact O-CD1 3.39Å; Q661-I665 VanDerWaalsContact O-CG1 3.26Å; Q661-I665 WeakPolarHBondContact O-CG1 3.45Å; Q661-I665 PolarHBondContact O-N 2.89Å; Q661-I665 VanDerWaalsContact O-N 3.1Å
662	I	34.8	Very low	35	Very low	68 Å²	68	137.5 Å²	137.5	35%	0.349	64%	0.638	S	S	.	*	H	α-helix	trans	-68.6	-37	178.2	-68.6	178.6	0	0	0	111.8	Y658 K664 I665 F666	Y658-I662 HydrophobicContact CD1-CD1 3.83Å; Y658-I662 HydrophobicContact CE1-CD1 3.47Å; Y658-I662 VanDerWaalsContact CE1-CD1 3.47Å; Y658-I662 HydrophobicContact CE1-CG1 4.45Å; Y658-I662 PolarHBondContact O-N 2.74Å; Y658-I662 VanDerWaalsContact O-N 3.15Å; I662-K664 VanDerWaalsContact C-N 3.32Å; I662-K664 PolarHBondContact O-N 3.04Å; I662-I665 PolarHBondContact O-N 3.29Å; I662-F666 HydrophobicContact CG2-CD2 4.18Å; I662-F666 PolarHBondContact O-N 3.39Å
663	K	32.2	Very low	35.1	Very low	145 Å²	145	138.7 Å²	138.7	63%	0.63	64%	0.64	S	S	*	*	H	α-helix	trans	-68.9	-31.8	178	-141.8	-179.9	-174	-172.7	0	112.4	F659 I660 Q667	F659-K663 WeakPolarHBondContact O-CB 3.37Å; F659-K663 PolarHBondContact O-N 3.3Å; F659-K663 VanDerWaalsContact O-N 3.08Å; I660-K663 PolarHBondContact O-N 2.86Å; K663-Q667 WeakPolarHBondContact O-CB 3.39Å; K663-Q667 WeakPolarHBondContact O-CG 3.45Å; K663-Q667 PolarHBondContact O-N 3.49Å; K663-Q667 VanDerWaalsContact O-N 3.12Å
664	K	35.3	Very low	35	Very low	130 Å²	130	139.8 Å²	139.8	57%	0.565	64%	0.64	S	S	*	*	H	α-helix	trans	-71	-40.5	173.8	-143	179.2	-177.7	-170.7	0	111.9	I660 Q661 I662 F666 Q667 E668	I660-K664 WeakPolarHBondContact O-CB 3.15Å; I660-K664 PolarHBondContact O-N 2.88Å; I660-K664 VanDerWaalsContact O-N 3.08Å; Q661-K664 PolarHBondContact O-N 2.94Å; I662-K664 VanDerWaalsContact C-N 3.32Å; I662-K664 PolarHBondContact O-N 3.04Å; K664-F666 VanDerWaalsContact C-N 3.32Å; K664-F666 PolarHBondContact O-N 3.03Å; K664-Q667 PolarHBondContact O-N 3.21Å; K664-E668 PolarHBondContact O-N 3.36Å
665	I	36.1	Very low	34.9	Very low	101 Å²	101	144.7 Å²	144.7	52%	0.518	64%	0.643	S	S	.	*	H	α-helix	trans	-65.6	-32.1	175.1	-66.9	165.1	0	0	0	112.1	Q661 I662	Q661-I665 HydrophobicContact CG-CD1 4.38Å; Q661-I665 WeakPolarHBondContact O-CD1 3.39Å; Q661-I665 VanDerWaalsContact O-CG1 3.26Å; Q661-I665 WeakPolarHBondContact O-CG1 3.45Å; Q661-I665 PolarHBondContact O-N 2.89Å; Q661-I665 VanDerWaalsContact O-N 3.1Å; I662-I665 PolarHBondContact O-N 3.29Å
666	F	32.2	Very low	35	Very low	160 Å²	160	151.2 Å²	151.2	70%	0.702	67%	0.665	S	S	*	*	H	α-helix	trans	-80.7	-26	175.6	-101.1	-90	0	0	0	114.2	I662 K664	I662-F666 HydrophobicContact CG2-CD2 4.18Å; I662-F666 PolarHBondContact O-N 3.39Å; K664-F666 VanDerWaalsContact C-N 3.32Å; K664-F666 PolarHBondContact O-N 3.03Å
667	Q	36.7	Very low	35.1	Very low	147 Å²	147	153.7 Å²	153.7	69%	0.687	68%	0.677	S	S	*	*	H	α-helix	trans	-83.9	-19	178.3	-79.5	-179	-51.3	0	0	113.8	K663 K664	K663-Q667 WeakPolarHBondContact O-CB 3.39Å; K663-Q667 WeakPolarHBondContact O-CG 3.45Å; K663-Q667 PolarHBondContact O-N 3.49Å; K663-Q667 VanDerWaalsContact O-N 3.12Å; K664-Q667 PolarHBondContact O-N 3.21Å
668	E	38.8	Very low	34.9	Very low	149 Å²	149	151.1 Å²	151.1	70%	0.696	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	6.6	177	-71	173.3	-175.4	0	0	113.5	K664	K664-E668 PolarHBondContact O-N 3.36Å
669	R	38.8	Very low	35.2	Very low	213 Å²	213	150.1 Å²	150.1	80%	0.804	68%	0.676	S	S	*	*	S	Bend	trans	-121.6	8.1	-178.8	-103.6	-175.3	-179.7	174.2	0.9	116.6
670	H	38.7	Very low	35.5	Very low	162 Å²	162	150.3 Å²	150.3	75%	0.75	68%	0.679	S	S	*	*			trans	-143.5	105.9	168.9	-87.8	-79.9	0	0	0	111.1
671	F	33.2	Very low	35.3	Very low	285 Å²	285	153.4 Å²	153.4	100%	1.25	69%	0.686	S	S	*	*			trans	65.6	0	172	-87.3	-87.5	0	0	0	118.4

Retrieved 671 of 671 residues in 499.7 ms (Link to these results)

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