A0A093K5M3_STRCA Loading...

Methyltransferase-like protein 22

Protein N-lysine methyltransferase. Trimethylates KIN at Lys-135 (in vitro).

AlphaFold DB , UniProt , Accession A0A093K5M3, Species STRCA (Struthio camelus australis), Gene n/a, Length 393 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.2	Very low	37.5	Very low	248 Å²	248	162.5 Å²	162.5	100%	1.222	85%	0.846	S	S	*	*				0	101.7	0	-91.2	170	166.8	0	0	106.7
2	V	34.5	Very low	38	Very low	144 Å²	144	161 Å²	161	87%	0.873	84%	0.84	S	S	*	*			trans	-127.6	114	168.9	-178.1	0	0	0	0	103.5	L4	V2-L4 PolarHBondContact O-N 3.33Å
3	D	31	Very low	37.7	Very low	164 Å²	164	158.8 Å²	158.8	88%	0.877	83%	0.829	S	S	*	*			trans	-56.9	130	-178.1	-95.1	-40.1	0	0	0	110.6	A5	D3-A5 PolarHBondContact O-N 3.17Å
4	L	36.8	Very low	37.4	Very low	167 Å²	167	154.6 Å²	154.6	87%	0.874	81%	0.813	S	S	*	*			trans	-75	107.2	167.3	-79.5	155.6	0	0	0	106.9	V2 E6	V2-L4 PolarHBondContact O-N 3.33Å; L4-E6 PolarHBondContact O-N 3.38Å; L4-E6 VanDerWaalsContact O-N 3.16Å
5	A	38.5	Very low	37.1	Very low	97 Å²	97	154.3 Å²	154.3	80%	0.802	80%	0.803	S	S	*	*			trans	-58.9	116.7	167.9	0	0	0	0	0	108.8	D3 K7	D3-A5 PolarHBondContact O-N 3.17Å; A5-K7 PolarHBondContact O-N 3.17Å
6	E	38.9	Very low	37.5	Very low	187 Å²	187	156.9 Å²	156.9	87%	0.874	81%	0.806	S	S	*	*			trans	-55.4	119.4	169.8	-72.9	175.5	150.4	0	0	108.6	L4 E8	L4-E6 PolarHBondContact O-N 3.38Å; L4-E6 VanDerWaalsContact O-N 3.16Å; E6-E8 PolarHBondContact O-N 3.18Å; E6-E8 VanDerWaalsContact O-N 3.17Å
7	K	36.9	Very low	37.9	Very low	194 Å²	194	152.8 Å²	152.8	84%	0.843	80%	0.795	S	S	*	*			trans	-64	109	159.7	-90.4	177.8	169.4	-179.3	0	106.3	A5 N9	A5-K7 PolarHBondContact O-N 3.17Å; K7-N9 PolarHBondContact O-N 3.4Å
8	E	39.9	Very low	39.3	Very low	186 Å²	186	150.8 Å²	150.8	87%	0.869	79%	0.785	S	S	*	*			trans	-59.3	103.5	160.4	-79.7	-176.7	150.2	0	0	107.7	E6 M10	E6-E8 PolarHBondContact O-N 3.18Å; E6-E8 VanDerWaalsContact O-N 3.17Å; E8-M10 PolarHBondContact O-N 3.01Å
9	N	34.4	Very low	40.9	Very low	120 Å²	120	147.2 Å²	147.2	64%	0.642	77%	0.77	S	S	*	*			trans	-63.6	114.1	161.9	-104.6	18.5	0	0	0	106.6	K7 D11	K7-N9 PolarHBondContact O-N 3.4Å; N9-D11 HydrophobicContact CB-CB 4.43Å; N9-D11 PolarHBondContact ND2-OD2 3.19Å; N9-D11 PolarHBondContact O-N 3.44Å
10	M	36.9	Very low	42.6	Very low	169 Å²	169	141.6 Å²	141.6	83%	0.833	74%	0.742	S	S	*	*			trans	-69.5	53.9	162.4	-85.3	-81.3	-61.4	0	0	110.2	E8	E8-M10 PolarHBondContact O-N 3.01Å
11	D	44.3	Very low	44	Very low	111 Å²	111	139.7 Å²	139.7	59%	0.594	73%	0.732	S	S	*	*			trans	-102.3	126.1	169.5	-73.7	-33	0	0	0	107.8	N9	N9-D11 HydrophobicContact CB-CB 4.43Å; N9-D11 PolarHBondContact ND2-OD2 3.19Å; N9-D11 PolarHBondContact O-N 3.44Å
12	N	43.6	Very low	45.3	Very low	145 Å²	145	127.9 Å²	127.9	78%	0.775	67%	0.674	S	S	*	*			trans	96.6	61.4	-179.4	-51.3	-30.3	0	0	0	115.6	T14	N12-T14 PolarHBondContact O-N 3.36Å
13	L	34.2	Very low	46.5	Very low	133 Å²	133	126.2 Å²	126.2	70%	0.696	66%	0.661	S	S	*	*			trans	-68	85.6	139.8	-132.4	103.4	0	0	0	107.2	F15	L13-F15 HydrophobicContact CD2-CD2 4.21Å; L13-F15 HydrophobicContact CD2-CE2 3.62Å; L13-F15 HydrophobicContact CD2-CZ 4.16Å; L13-F15 PolarHBondContact O-N 3.47Å; L13-F15 VanDerWaalsContact O-N 3.12Å
14	T	33.6	Very low	48	Very low	100 Å²	100	118.8 Å²	118.8	61%	0.613	62%	0.621	S	S	*	*			trans	-75.6	98.3	173.4	-25.1	0	0	0	0	107.3	N12 K16	N12-T14 PolarHBondContact O-N 3.36Å; T14-K16 PolarHBondContact O-N 3.42Å; T14-K16 VanDerWaalsContact O-N 3.1Å
15	F	33.5	Very low	49.2	Very low	149 Å²	149	114.6 Å²	114.6	65%	0.654	60%	0.597	S	S	*	*			trans	-60.6	112.8	161.6	-84.9	-91.4	0	0	0	106.7	L13 S17	L13-F15 HydrophobicContact CD2-CD2 4.21Å; L13-F15 HydrophobicContact CD2-CE2 3.62Å; L13-F15 HydrophobicContact CD2-CZ 4.16Å; L13-F15 PolarHBondContact O-N 3.47Å; L13-F15 VanDerWaalsContact O-N 3.12Å; F15-S17 PolarHBondContact O-N 3.46Å
16	K	42.3	Very low	49.9	Very low	196 Å²	196	111.7 Å²	111.7	85%	0.852	57%	0.568	S	S	*	*	S	Bend	trans	-85.9	13.6	-175.1	-77.2	-171.9	176.1	-178.8	0	113.3	T14	T14-K16 PolarHBondContact O-N 3.42Å; T14-K16 VanDerWaalsContact O-N 3.1Å
17	S	45.6	Very low	50.1	Low	88 Å²	88	110.4 Å²	110.4	62%	0.615	56%	0.561	S	S	*	*			trans	-148.3	75.1	-179.6	61.3	0	0	0	0	110.4	F15 T19	F15-S17 PolarHBondContact O-N 3.46Å; S17-T19 PolarHBondContact O-N 3.48Å
18	D	62.9	Low	50.7	Low	117 Å²	117	103.4 Å²	103.4	63%	0.626	54%	0.536	S	S	*	.			trans	-78	57.5	170.2	-64	-30	0	0	0	109.9	V20 P167	D18-V20 PolarHBondContact O-N 3.05Å; D18-P167 WeakPolarHBondContact O-CA 3.38Å
19	T	69.3	Low	50.8	Low	82 Å²	82	99.9 Å²	99.9	50%	0.503	53%	0.529	S	S	.	.			trans	-82.3	117.6	175.5	-55.7	0	0	0	0	108.9	S17 L21 A165 T166	S17-T19 PolarHBondContact O-N 3.48Å; T19-L21 HydrophobicContact CG2-CD2 4.38Å; T19-A165 HydrophobicContact CG2-CB 3.67Å; T19-T166 CarbonylContact C-O 3.55Å; T19-T166 WeakPolarHBondContact CA-O 3.01Å
20	V	74.3	Confident	51.6	Low	34 Å²	34	101.9 Å²	101.9	21%	0.206	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	135.3	172.9	179.6	0	0	0	0	108.4	D18 A165 T166 L168 V171 Q174 W176	D18-V20 PolarHBondContact O-N 3.05Å; V20-A165 WeakPolarHBondContact O-CA 3.39Å; V20-T166 PolarHBondContact N-O 3.01Å; V20-T166 PolarHBondContact O-N 3.38Å; V20-T166 VanDerWaalsContact O-N 3.11Å; V20-L168 HydrophobicContact CG2-CB 4.43Å; V20-L168 HydrophobicContact CG2-CD1 4.07Å; V20-V171 HydrophobicContact CB-CG1 3.83Å; V20-V171 HydrophobicContact CG1-CG1 3.81Å; V20-V171 HydrophobicContact CG2-CG1 3.98Å; V20-Q174 PolarHBondContact O-NE2 2.8Å; V20-W176 HydrophobicContact CG1-CH2 3.45Å; V20-W176 VanDerWaalsContact CG1-CH2 3.45Å; V20-W176 HydrophobicContact CG1-CZ2 3.82Å
21	L	73.2	Confident	52.4	Low	102 Å²	102	98 Å²	98	53%	0.534	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	142.5	175.7	-61.4	174.8	0	0	0	109.7	T19 A165	T19-L21 HydrophobicContact CG2-CD2 4.38Å; L21-A165 HydrophobicContact CD2-CB 3.48Å; L21-A165 VanDerWaalsContact CD2-CB 3.48Å
22	S	67.1	Low	52.9	Low	0 Å²	0	101 Å²	101	0%	0	52%	0.522	C	S	.	.			trans	-94	125.6	172.4	41.1	0	0	0	0	109.6	V24 H25 Q174 V175	S22-V24 PolarHBondContact O-N 3.31Å; S22-H25 PolarHBondContact O-CE1 2.77Å; S22-H25 PolarHBondContact O-ND1 3.3Å; S22-H25 PolarHBondContact O-NE2 2.78Å; S22-Q174 PolarHBondContact OG-OE1 3.02Å; S22-V175 VanDerWaalsContact CB-O 3.25Å; S22-V175 WeakPolarHBondContact CB-O 3.34Å
23	D	60.4	Low	53.7	Low	110 Å²	110	100.3 Å²	100.3	59%	0.588	51%	0.514	S	S	*	.	S	Bend	trans	-73.5	12.4	178.3	-66.9	-35.8	0	0	0	113.7	R177	D23-R177 PolarHBondContact O-NH2 3.43Å
24	V	62.1	Low	55.5	Low	8 Å²	8	95.7 Å²	95.7	5%	0.048	49%	0.489	C	S	.	.			trans	-100.8	88.9	173.8	-179.7	0	0	0	0	108.4	S22 F50 V175 R177 F180	S22-V24 PolarHBondContact O-N 3.31Å; V24-F50 HydrophobicContact CG1-CE1 4.12Å; V24-F50 HydrophobicContact CG1-CZ 4.5Å; V24-V175 HydrophobicContact CG1-CB 4.5Å; V24-V175 HydrophobicContact CG1-CG1 4.18Å; V24-R177 HydrophobicContact CG2-CB 4.37Å; V24-R177 HydrophobicContact CG2-CG 3.44Å; V24-R177 VanDerWaalsContact CG2-CG 3.44Å; V24-F180 HydrophobicContact CB-CE2 4.39Å; V24-F180 HydrophobicContact CG1-CD2 4.25Å; V24-F180 HydrophobicContact CG1-CE2 3.26Å; V24-F180 HydrophobicContact CG1-CZ 3.68Å; V24-F180 HydrophobicContact CG2-CD2 4.48Å; V24-F180 HydrophobicContact CG2-CE2 4.21Å
25	H	60.9	Low	57.9	Low	79 Å²	79	94.9 Å²	94.9	37%	0.366	48%	0.48	S	S	.	.			trans	-118.5	104.8	172	-59.2	-42.2	0	0	0	109	S22 H27	S22-H25 PolarHBondContact O-CE1 2.77Å; S22-H25 PolarHBondContact O-ND1 3.3Å; S22-H25 PolarHBondContact O-NE2 2.78Å; H25-H27 PolarHBondContact O-N 2.88Å
26	L	54.1	Low	60.4	Low	36 Å²	36	89.3 Å²	89.3	19%	0.188	46%	0.458	C	S	.	.			trans	-75.3	93.9	168.5	-81.2	-175.6	0	0	0	109.5	C28 Y49 F50	L26-C28 PolarHBondContact O-N 3.31Å; L26-C28 VanDerWaalsContact O-N 3.1Å; L26-Y49 WeakPolarHBondContact CD1-O 3.44Å; L26-F50 HydrophobicContact CB-CE1 4.43Å; L26-F50 HydrophobicContact CD1-CB 4.26Å; L26-F50 HydrophobicContact CD1-CD1 3.07Å; L26-F50 HydrophobicContact CD1-CD2 4.33Å; L26-F50 HydrophobicContact CD1-CE1 3.15Å; L26-F50 HydrophobicContact CD1-CE2 4.43Å; L26-F50 HydrophobicContact CD1-CG 3.67Å; L26-F50 HydrophobicContact CD1-CZ 3.9Å; L26-F50 HydrophobicContact CG-CD1 3.85Å; L26-F50 HydrophobicContact CG-CE1 3.5Å; L26-F50 HydrophobicContact CG-CZ 4.31Å
27	H	42.8	Very low	62.6	Low	160 Å²	160	82.1 Å²	82.1	74%	0.741	43%	0.425	S	S	*	.			trans	-72.8	93.8	159.8	-87.5	-70.4	0	0	0	108.9	H25 P29	H25-H27 PolarHBondContact O-N 2.88Å; H27-P29 VanDerWaalsContact O-CD 3.22Å; H27-P29 WeakPolarHBondContact O-CD 3.23Å
28	C	49.2	Very low	64.6	Low	47 Å²	47	80.4 Å²	80.4	32%	0.318	41%	0.409	S	S	.	.			trans	-66.7	114.9	156.9	-72	0	0	0	0	107.4	L26 N30	L26-C28 PolarHBondContact O-N 3.31Å; L26-C28 VanDerWaalsContact O-N 3.1Å; C28-N30 PolarHBondContact O-N 3.06Å
29	P	42.1	Very low	65.7	Low	112 Å²	112	75.2 Å²	75.2	73%	0.727	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	126.2	173.1	-14.8	28.9	0	0	0	107.5	H27	H27-P29 VanDerWaalsContact O-CD 3.22Å; H27-P29 WeakPolarHBondContact O-CD 3.23Å
30	N	50.3	Low	66.3	Low	162 Å²	162	73.7 Å²	73.7	87%	0.866	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.5	5.7	173.9	-47	-35.5	0	0	0	119.3	C28	C28-N30 PolarHBondContact O-N 3.06Å
31	K	55	Low	66.6	Low	88 Å²	88	76.3 Å²	76.3	38%	0.383	39%	0.392	S	S	.	.			trans	-88.8	120.4	166	-77.9	-159	171.7	-162	0	110.7	L34 Y49	K31-L34 HydrophobicContact CB-CD2 4.3Å; K31-Y49 HydrophobicContact CD-CE2 4.45Å; K31-Y49 VanDerWaalsContact NZ-CE2 3.32Å; K31-Y49 PolarHBondContact NZ-OH 3.17Å
32	R	54.4	Low	67.1	Low	174 Å²	174	73.3 Å²	73.3	66%	0.657	39%	0.386	S	S	*	.	S	Bend	trans	-85.9	-11.8	-176.3	-67.6	-177.5	179.1	173.8	1	113.8	D131	R32-D131 IonicContact CZ-OD2 3.69Å; R32-D131 VanDerWaalsContact CZ-OD2 3.32Å; R32-D131 IonicContact NH1-OD2 3.64Å; R32-D131 PolarHBondContact NH1-OD2 3.18Å; R32-D131 IonicContact NH2-OD2 2.92Å; R32-D131 PolarHBondContact NH2-OD2 3.46Å
33	H	60.5	Low	68.1	Low	130 Å²	130	74.6 Å²	74.6	60%	0.602	39%	0.392	S	S	*	.			trans	-138.4	99.8	-175.5	-54.9	-64.7	0	0	0	109.8
34	L	72.1	Confident	69.4	Low	36 Å²	36	71.6 Å²	71.6	19%	0.188	38%	0.379	C	S	.	.			trans	-103	-30.8	175.1	-67.5	173.8	0	0	0	111.9	K31 V36 F46 L47	K31-L34 HydrophobicContact CB-CD2 4.3Å; L34-V36 PolarHBondContact O-N 3.04Å; L34-F46 HydrophobicContact CB-CD1 3.94Å; L34-F46 CarbonylContact O-C 3.57Å; L34-F46 WeakPolarHBondContact O-CA 3.27Å; L34-L47 PolarHBondContact O-N 3.23Å
35	M	84.1	Confident	70.8	Confident	83 Å²	83	71.2 Å²	71.2	41%	0.409	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	121.4	174.9	-177.2	178.6	56.2	0	0	108.9	P44 V45 F46 L138	M35-P44 HydrophobicContact CG-CB 4.11Å; M35-P44 HydrophobicContact SD-CB 3.57Å; M35-P44 VanDerWaalsContact SD-CB 3.57Å; M35-V45 CarbonylContact C-O 3.59Å; M35-V45 WeakPolarHBondContact CA-O 3.48Å; M35-F46 HydrophobicContact CB-CD1 3.92Å; M35-F46 HydrophobicContact CB-CE1 3.79Å; M35-F46 HydrophobicContact CB-CZ 4.46Å; M35-F46 HydrophobicContact CG-CE1 4.49Å; M35-L138 HydrophobicContact CE-CD1 3.27Å; M35-L138 HydrophobicContact CE-CG 4.35Å; M35-L138 HydrophobicContact CG-CD1 3.79Å; M35-L138 HydrophobicContact SD-CD1 3.54Å; M35-L138 VanDerWaalsContact SD-CD1 3.54Å
36	V	86	Confident	72.2	Confident	32 Å²	32	69.2 Å²	69.2	19%	0.194	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-31.8	-173.5	-70.7	0	0	0	0	112.7	L34 V45 L47 E161	L34-V36 PolarHBondContact O-N 3.04Å; V36-V45 HydrophobicContact CG2-CB 4.5Å; V36-V45 HydrophobicContact CG2-CG1 4.14Å; V36-V45 WeakPolarHBondContact CG2-O 3.19Å; V36-V45 PolarHBondContact N-O 3.2Å; V36-L47 HydrophobicContact CG1-CB 3.61Å; V36-L47 HydrophobicContact CG1-CD2 4.48Å; V36-L47 HydrophobicContact CG2-CB 4.22Å; V36-E161 WeakPolarHBondContact CG2-OE1 3.2Å
37	R	88.6	Confident	73.9	Confident	45 Å²	45	68.7 Å²	68.7	17%	0.17	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	173.2	179.8	65.9	-169.6	176.8	87	-1.7	112.2	V45 E161	R37-V45 HydrophobicContact CG-CB 3.85Å; R37-V45 HydrophobicContact CG-CG1 4.3Å; R37-V45 HydrophobicContact CG-CG2 4.22Å; R37-V45 PolarHBondContact O-N 3.01Å; R37-E161 IonicContact CZ-OE2 3.42Å; R37-E161 VanDerWaalsContact CZ-OE2 3.3Å; R37-E161 IonicContact NE-OE1 2.77Å; R37-E161 IonicContact NE-OE2 3.91Å; R37-E161 PolarHBondContact NE-OE2 2.97Å; R37-E161 IonicContact NH2-OE2 3.36Å; R37-E161 PolarHBondContact NH2-OE2 3.34Å
38	L	88.1	Confident	76.1	Confident	52 Å²	52	61.2 Å²	61.2	27%	0.272	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	139.5	162.7	-61.9	177.7	0	0	0	109.2	Q43 P44 L138	L38-Q43 WeakPolarHBondContact CA-O 3.08Å; L38-P44 HydrophobicContact CD2-CB 4.39Å; L38-L138 HydrophobicContact CG-CB 4.49Å; L38-L138 HydrophobicContact CG-CD1 4.39Å
39	N	85.1	Confident	78	Confident	8 Å²	8	62.1 Å²	62.1	4%	0.043	33%	0.327	C	S	.	.			trans	-75.4	179.9	171.3	73.1	5.2	0	0	0	111.8	V41 G42 Q43 V45	N39-V41 PolarHBondContact O-N 3.18Å; N39-V41 WeakPolarHBondContact OD1-CG2 3.29Å; N39-V41 PolarHBondContact OD1-N 3.09Å; N39-G42 PolarHBondContact O-N 3.5Å; N39-G42 PolarHBondContact OD1-N 3.41Å; N39-Q43 PolarHBondContact N-O 2.99Å; N39-Q43 PolarHBondContact ND2-OE1 3.11Å; N39-Q43 WeakPolarHBondContact OD1-CB 3.32Å; N39-Q43 PolarHBondContact OD1-N 3.48Å; N39-V45 HydrophobicContact CB-CG2 3.92Å
40	A	81.8	Confident	80.3	Confident	50 Å²	50	57.1 Å²	57.1	41%	0.413	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-34.6	-176.8	0	0	0	0	0	112.8	R140	A40-R140 VanDerWaalsContact O-CZ 3.29Å; A40-R140 PolarHBondContact O-NE 3.3Å; A40-R140 PolarHBondContact O-NH2 3.41Å
41	V	81.4	Confident	82.1	Confident	88 Å²	88	55 Å²	55	53%	0.533	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	2.6	178.8	-61.8	0	0	0	0	114.1	N39 Q43	N39-V41 PolarHBondContact O-N 3.18Å; N39-V41 WeakPolarHBondContact OD1-CG2 3.29Å; N39-V41 PolarHBondContact OD1-N 3.09Å; V41-Q43 HydrophobicContact CG2-CG 3.89Å
42	G	84.2	Confident	83.8	Confident	39 Å²	39	50.9 Å²	50.9	40%	0.402	26%	0.259	S	S	.	.	S	Bend	trans	84.6	12.6	176.4	0	0	0	0	0	115.2	N39	N39-G42 PolarHBondContact O-N 3.5Å; N39-G42 PolarHBondContact OD1-N 3.41Å
43	Q	86.9	Confident	85.4	Confident	27 Å²	27	45.7 Å²	45.7	13%	0.126	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-76.4	141.7	172.2	-63.3	161	-26.3	0	0	110.3	L38 N39 V41 V45 T163 D170	L38-Q43 WeakPolarHBondContact CA-O 3.08Å; N39-Q43 PolarHBondContact N-O 2.99Å; N39-Q43 PolarHBondContact ND2-OE1 3.11Å; N39-Q43 WeakPolarHBondContact OD1-CB 3.32Å; N39-Q43 PolarHBondContact OD1-N 3.48Å; V41-Q43 HydrophobicContact CG2-CG 3.89Å; Q43-V45 PolarHBondContact O-N 2.78Å; Q43-T163 HydrophobicContact CB-CG2 4.32Å; Q43-D170 PolarHBondContact NE2-OD2 3.22Å; Q43-D170 PolarHBondContact OE1-OD2 2.88Å
44	P	88.9	Confident	86.6	Confident	47 Å²	47	43.5 Å²	43.5	31%	0.305	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	126.4	177.4	29.5	-34.1	0	0	0	111.4	M35 L38 F46	M35-P44 HydrophobicContact CG-CB 4.11Å; M35-P44 HydrophobicContact SD-CB 3.57Å; M35-P44 VanDerWaalsContact SD-CB 3.57Å; L38-P44 HydrophobicContact CD2-CB 4.39Å; P44-F46 HydrophobicContact CB-CE2 3.75Å; P44-F46 HydrophobicContact CB-CZ 3.95Å; P44-F46 HydrophobicContact CG-CE2 3.87Å; P44-F46 HydrophobicContact CG-CZ 4.21Å; P44-F46 WeakPolarHBondContact O-CE2 3.35Å
45	V	90.6	Very high	86.1	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.5	174.9	179.8	0	0	0	0	108.9	M35 V36 R37 N39 Q43 E161 T163 M231	M35-V45 CarbonylContact C-O 3.59Å; M35-V45 WeakPolarHBondContact CA-O 3.48Å; V36-V45 HydrophobicContact CG2-CB 4.5Å; V36-V45 HydrophobicContact CG2-CG1 4.14Å; V36-V45 WeakPolarHBondContact CG2-O 3.19Å; V36-V45 PolarHBondContact N-O 3.2Å; R37-V45 HydrophobicContact CG-CB 3.85Å; R37-V45 HydrophobicContact CG-CG1 4.3Å; R37-V45 HydrophobicContact CG-CG2 4.22Å; R37-V45 PolarHBondContact O-N 3.01Å; N39-V45 HydrophobicContact CB-CG2 3.92Å; Q43-V45 PolarHBondContact O-N 2.78Å; V45-E161 HydrophobicContact CG1-CB 3.84Å; V45-E161 HydrophobicContact CG1-CG 4.22Å; V45-T163 HydrophobicContact CG2-CG2 4.41Å; V45-M231 HydrophobicContact CG2-CE 4.27Å
46	F	90.3	Very high	84.4	Confident	38 Å²	38	47.8 Å²	47.8	17%	0.167	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.2	-177.9	-59	-96.7	0	0	0	110.7	L34 M35 P44 E161 H162 M164	L34-F46 HydrophobicContact CB-CD1 3.94Å; L34-F46 CarbonylContact O-C 3.57Å; L34-F46 WeakPolarHBondContact O-CA 3.27Å; M35-F46 HydrophobicContact CB-CD1 3.92Å; M35-F46 HydrophobicContact CB-CE1 3.79Å; M35-F46 HydrophobicContact CB-CZ 4.46Å; M35-F46 HydrophobicContact CG-CE1 4.49Å; P44-F46 HydrophobicContact CB-CE2 3.75Å; P44-F46 HydrophobicContact CB-CZ 3.95Å; P44-F46 HydrophobicContact CG-CE2 3.87Å; P44-F46 HydrophobicContact CG-CZ 4.21Å; P44-F46 WeakPolarHBondContact O-CE2 3.35Å; F46-E161 CarbonylContact O-C 3.51Å; F46-E161 VanDerWaalsContact O-CA 3.25Å; F46-E161 WeakPolarHBondContact O-CA 3.47Å; F46-H162 PolarHBondContact N-O 2.88Å; F46-H162 PolarHBondContact O-N 3.44Å; F46-M164 HydrophobicContact CB-CE 4.05Å; F46-M164 HydrophobicContact CD1-CE 3.82Å; F46-M164 HydrophobicContact CD1-SD 4.06Å; F46-M164 HydrophobicContact CD2-CB 4.27Å; F46-M164 HydrophobicContact CD2-CE 4.35Å; F46-M164 HydrophobicContact CD2-CG 3.69Å; F46-M164 HydrophobicContact CD2-SD 4.09Å; F46-M164 HydrophobicContact CE1-CE 4.34Å; F46-M164 HydrophobicContact CE1-SD 4.04Å; F46-M164 HydrophobicContact CE2-CB 4.05Å; F46-M164 HydrophobicContact CE2-CG 3.87Å; F46-M164 HydrophobicContact CE2-SD 4.06Å; F46-M164 HydrophobicContact CG-CE 3.82Å; F46-M164 HydrophobicContact CG-CG 4.12Å; F46-M164 HydrophobicContact CG-SD 4.09Å; F46-M164 HydrophobicContact CZ-CG 4.45Å; F46-M164 HydrophobicContact CZ-SD 4.04Å
47	L	90.4	Very high	82.5	Confident	25 Å²	25	52.4 Å²	52.4	13%	0.131	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	117	171.8	-178.8	61.7	0	0	0	110.1	L34 V36 Y49 K159 E161 L238	L34-L47 PolarHBondContact O-N 3.23Å; V36-L47 HydrophobicContact CG1-CB 3.61Å; V36-L47 HydrophobicContact CG1-CD2 4.48Å; V36-L47 HydrophobicContact CG2-CB 4.22Å; L47-Y49 HydrophobicContact CD2-CE2 4.31Å; L47-Y49 WeakPolarHBondContact CD2-OH 3.34Å; L47-Y49 HydrophobicContact CG-CE2 4.11Å; L47-K159 HydrophobicContact CD1-CB 4.22Å; L47-E161 HydrophobicContact CD1-CG 4.07Å; L47-L238 HydrophobicContact CD1-CD1 4.05Å
48	S	88.7	Confident	80.3	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.014	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	150.9	177.7	-68.4	0	0	0	0	112.2	K159 I160 H162	S48-K159 WeakPolarHBondContact O-CA 3.48Å; S48-I160 PolarHBondContact N-O 3.39Å; S48-I160 PolarHBondContact O-N 2.67Å; S48-H162 WeakPolarHBondContact CB-NE2 3.46Å; S48-H162 PolarHBondContact OG-NE2 2.76Å
49	Y	89.4	Confident	77.9	Confident	67 Å²	67	61.1 Å²	61.1	26%	0.263	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	107.7	-174.4	-59.9	-98.8	0	0	0	109.8	L26 K31 L47 V157 V158 K159	L26-Y49 WeakPolarHBondContact CD1-O 3.44Å; K31-Y49 HydrophobicContact CD-CE2 4.45Å; K31-Y49 VanDerWaalsContact NZ-CE2 3.32Å; K31-Y49 PolarHBondContact NZ-OH 3.17Å; L47-Y49 HydrophobicContact CD2-CE2 4.31Å; L47-Y49 WeakPolarHBondContact CD2-OH 3.34Å; L47-Y49 HydrophobicContact CG-CE2 4.11Å; Y49-V157 HydrophobicContact CD1-CG1 4Å; Y49-V157 HydrophobicContact CG-CG1 4.46Å; Y49-V158 CarbonylContact C-O 3.59Å; Y49-K159 HydrophobicContact CD1-CG 3.89Å; Y49-K159 HydrophobicContact CE1-CD 4.16Å; Y49-K159 HydrophobicContact CE1-CG 4.02Å
50	F	88.9	Confident	75.5	Confident	6 Å²	6	62.9 Å²	62.9	3%	0.026	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	110.5	-179.4	-58	-88.2	0	0	0	109.9	V24 L26 V157 V158 I160 F180 L374	V24-F50 HydrophobicContact CG1-CE1 4.12Å; V24-F50 HydrophobicContact CG1-CZ 4.5Å; L26-F50 HydrophobicContact CB-CE1 4.43Å; L26-F50 HydrophobicContact CD1-CB 4.26Å; L26-F50 HydrophobicContact CD1-CD1 3.07Å; L26-F50 HydrophobicContact CD1-CD2 4.33Å; L26-F50 HydrophobicContact CD1-CE1 3.15Å; L26-F50 HydrophobicContact CD1-CE2 4.43Å; L26-F50 HydrophobicContact CD1-CG 3.67Å; L26-F50 HydrophobicContact CD1-CZ 3.9Å; L26-F50 HydrophobicContact CG-CD1 3.85Å; L26-F50 HydrophobicContact CG-CE1 3.5Å; L26-F50 HydrophobicContact CG-CZ 4.31Å; F50-V157 WeakPolarHBondContact O-CA 3.14Å; F50-V158 HydrophobicContact CB-CB 4.27Å; F50-V158 PolarHBondContact N-O 3Å; F50-V158 PolarHBondContact O-N 3.32Å; F50-I160 HydrophobicContact CD2-CB 4.32Å; F50-I160 HydrophobicContact CD2-CG1 3.89Å; F50-I160 HydrophobicContact CE2-CB 3.9Å; F50-I160 HydrophobicContact CE2-CG1 3.9Å; F50-F180 HydrophobicContact CD1-CE1 4.08Å; F50-F180 AromaticContact CD1-CE2 3.94Å; F50-F180 HydrophobicContact CD1-CE2 3.94Å; F50-F180 AromaticContact CD1-CZ 3.38Å; F50-F180 HydrophobicContact CD1-CZ 3.38Å; F50-F180 HydrophobicContact CE1-CE1 4.14Å; F50-F180 AromaticContact CE1-CE2 3.7Å; F50-F180 HydrophobicContact CE1-CE2 3.7Å; F50-F180 AromaticContact CE1-CZ 3.14Å; F50-F180 HydrophobicContact CE1-CZ 3.14Å; F50-F180 HydrophobicContact CE2-CZ 4.44Å; F50-F180 HydrophobicContact CG-CZ 4.21Å; F50-F180 AromaticContact CZ-CZ 3.73Å; F50-F180 HydrophobicContact CZ-CZ 3.73Å; F50-L374 HydrophobicContact CB-CD2 3.8Å
51	K	88.6	Confident	73.5	Confident	117 Å²	117	63.8 Å²	63.8	51%	0.509	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	127	177.8	-173.1	177.1	-179.2	178.9	0	110.6	D156	K51-D156 CarbonylContact C-O 3.43Å
52	L	90.6	Very high	71.6	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.016	34%	0.34	C	S	.	.			trans	-77.7	125.1	171.2	-62	174	0	0	0	109.8	W54 D156 V158 L187 I211 M214 F373 L374	L52-W54 HydrophobicContact CB-CH2 4.23Å; L52-W54 HydrophobicContact CB-CZ2 3.81Å; L52-W54 HydrophobicContact CD1-CH2 3.8Å; L52-W54 HydrophobicContact CD1-CZ2 3.52Å; L52-W54 HydrophobicContact CG-CH2 4.49Å; L52-W54 HydrophobicContact CG-CZ2 4.26Å; L52-D156 HydrophobicContact CB-CB 4.34Å; L52-D156 WeakPolarHBondContact CB-O 3.46Å; L52-D156 PolarHBondContact N-O 3.28Å; L52-V158 HydrophobicContact CD1-CG2 4.09Å; L52-V158 HydrophobicContact CD2-CG2 4.29Å; L52-V158 HydrophobicContact CG-CG2 4.16Å; L52-L187 HydrophobicContact CD2-CD1 3.9Å; L52-I211 HydrophobicContact CD2-CD1 3.89Å; L52-M214 HydrophobicContact CD1-CE 3.74Å; L52-M214 HydrophobicContact CD1-SD 4.03Å; L52-F373 CarbonylContact C-O 3.52Å; L52-F373 WeakPolarHBondContact CA-O 3.13Å; L52-L374 HydrophobicContact CD2-CD2 3.75Å; L52-L374 HydrophobicContact CD2-CG 4.17Å
53	L	89.2	Confident	69.3	Low	64 Å²	64	70.2 Å²	70.2	34%	0.335	35%	0.35	S	S	.	.			trans	-96.3	93.3	179.4	-57.1	-179.2	0	0	0	109.1	N55 F373 I375	L53-N55 PolarHBondContact O-N 2.96Å; L53-F373 WeakPolarHBondContact CB-O 3.45Å; L53-F373 PolarHBondContact N-O 2.89Å; L53-F373 WeakPolarHBondContact O-CD1 3.43Å; L53-I375 HydrophobicContact CD1-CD1 4.37Å; L53-I375 HydrophobicContact CD1-CG1 3.79Å; L53-I375 HydrophobicContact CG-CG1 4.4Å
54	W	85.1	Confident	66.8	Low	84 Å²	84	73.5 Å²	73.5	32%	0.318	37%	0.368	S	S	.	.			trans	-77.3	109.9	171.1	-51	123.2	0	0	0	109.6	L52 T56 D156 L187 M214 F373	L52-W54 HydrophobicContact CB-CH2 4.23Å; L52-W54 HydrophobicContact CB-CZ2 3.81Å; L52-W54 HydrophobicContact CD1-CH2 3.8Å; L52-W54 HydrophobicContact CD1-CZ2 3.52Å; L52-W54 HydrophobicContact CG-CH2 4.49Å; L52-W54 HydrophobicContact CG-CZ2 4.26Å; W54-T56 PolarHBondContact O-N 3.1Å; W54-D156 VanDerWaalsContact CD1-CG 3.47Å; W54-D156 PolarHBondContact NE1-OD1 2.71Å; W54-L187 HydrophobicContact CH2-CD1 4.35Å; W54-L187 HydrophobicContact CH2-CD2 3.98Å; W54-L187 HydrophobicContact CZ3-CD1 4.23Å; W54-L187 HydrophobicContact CZ3-CD2 4.06Å; W54-M214 HydrophobicContact CH2-CE 4.01Å; W54-M214 HydrophobicContact CZ2-CE 4.05Å; W54-F373 HydrophobicContact CE3-CD1 4.08Å; W54-F373 HydrophobicContact CE3-CE1 4.35Å; W54-F373 HydrophobicContact CZ3-CD1 4.18Å
55	N	62	Low	64.4	Low	83 Å²	83	76 Å²	76	44%	0.444	38%	0.383	S	S	.	.			trans	-62.2	110.9	167.8	-82	-14.1	0	0	0	108.6	L53 D57 N58	L53-N55 PolarHBondContact O-N 2.96Å; N55-D57 PolarHBondContact O-N 3.33Å; N55-N58 PolarHBondContact O-N 3.44Å
56	T	46.8	Very low	61.8	Low	127 Å²	127	86 Å²	86	78%	0.779	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-13.9	-177.5	-4.3	0	0	0	0	112.5	W54	W54-T56 PolarHBondContact O-N 3.1Å
57	D	46.1	Very low	59.1	Low	128 Å²	128	91.1 Å²	91.1	68%	0.684	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-17.4	-177.3	-63.9	-31.1	0	0	0	114.5	N55 S61	N55-D57 PolarHBondContact O-N 3.33Å; D57-S61 PolarHBondContact O-N 2.95Å
58	N	43.9	Very low	56.3	Low	86 Å²	86	93.9 Å²	93.9	46%	0.46	47%	0.471	S	S	.	.	H	α-helix	trans	-78.4	-28.4	-178.7	-81.8	-10.2	0	0	0	113.4	N55 A60 S61	N55-N58 PolarHBondContact O-N 3.44Å; N58-A60 VanDerWaalsContact C-N 3.29Å; N58-A60 PolarHBondContact O-N 3.18Å; N58-S61 PolarHBondContact O-N 3.2Å
59	W	37.7	Very low	53.6	Low	194 Å²	194	99.7 Å²	99.7	74%	0.735	51%	0.507	S	S	*	.	H	α-helix	trans	-73.8	-23.3	175.9	-157.8	-91.8	0	0	0	112.6
60	A	34.5	Very low	51	Low	46 Å²	46	102 Å²	102	38%	0.38	53%	0.528	S	S	.	.	H	α-helix	trans	-78.1	-34.1	174.3	0	0	0	0	0	111.8	N58 E62 K63 N64	N58-A60 VanDerWaalsContact C-N 3.29Å; N58-A60 PolarHBondContact O-N 3.18Å; A60-E62 PolarHBondContact O-N 3.32Å; A60-K63 PolarHBondContact O-N 3.48Å; A60-N64 WeakPolarHBondContact O-CB 2.97Å; A60-N64 PolarHBondContact O-N 2.78Å; A60-N64 PolarHBondContact O-ND2 2.93Å; A60-N64 VanDerWaalsContact O-ND2 3.17Å
61	S	40.2	Very low	48.1	Very low	68 Å²	68	110.5 Å²	110.5	48%	0.476	57%	0.568	S	S	.	*	H	α-helix	trans	-65.9	-35.8	179.9	-160.1	0	0	0	0	112.7	D57 N58 K63 N64 V65	D57-S61 PolarHBondContact O-N 2.95Å; N58-S61 PolarHBondContact O-N 3.2Å; S61-K63 PolarHBondContact O-N 3.31Å; S61-N64 PolarHBondContact O-N 3.3Å; S61-V65 VanDerWaalsContact O-CG2 3.27Å; S61-V65 WeakPolarHBondContact O-CG2 3.34Å; S61-V65 PolarHBondContact O-N 3.29Å
62	E	41.2	Very low	45.2	Very low	123 Å²	123	113 Å²	113	58%	0.575	58%	0.579	S	S	*	*	H	α-helix	trans	-71.9	-26.8	177.7	-71.9	-172.8	168	0	0	114.3	A60	A60-E62 PolarHBondContact O-N 3.32Å
63	K	35.7	Very low	42.2	Very low	140 Å²	140	119.2 Å²	119.2	61%	0.609	61%	0.607	S	S	*	*	H	α-helix	trans	-80.2	-39.2	171.9	-82.4	-174.2	174.4	-177.5	0	112.1	A60 S61 V65 R66 E67	A60-K63 PolarHBondContact O-N 3.48Å; S61-K63 PolarHBondContact O-N 3.31Å; K63-V65 VanDerWaalsContact C-N 3.33Å; K63-V65 PolarHBondContact O-N 3.19Å; K63-R66 PolarHBondContact O-N 3.37Å; K63-E67 PolarHBondContact O-N 3.21Å
64	N	33.5	Very low	39.1	Very low	95 Å²	95	124.2 Å²	124.2	51%	0.508	63%	0.629	S	S	.	*	H	α-helix	trans	-71.7	-24.9	-176.7	-68.9	-20.3	0	0	0	113.4	A60 S61 R66 A68	A60-N64 WeakPolarHBondContact O-CB 2.97Å; A60-N64 PolarHBondContact O-N 2.78Å; A60-N64 PolarHBondContact O-ND2 2.93Å; A60-N64 VanDerWaalsContact O-ND2 3.17Å; S61-N64 PolarHBondContact O-N 3.3Å; N64-R66 VanDerWaalsContact C-N 3.32Å; N64-A68 VanDerWaalsContact O-CB 3.23Å; N64-A68 WeakPolarHBondContact O-CB 3.41Å; N64-A68 PolarHBondContact O-N 3.35Å
65	V	39	Very low	36.3	Very low	101 Å²	101	128.8 Å²	128.8	61%	0.612	65%	0.654	S	S	*	*	H	α-helix	trans	-72.4	-25.4	173.8	174.2	0	0	0	0	112.2	S61 K63	S61-V65 VanDerWaalsContact O-CG2 3.27Å; S61-V65 WeakPolarHBondContact O-CG2 3.34Å; S61-V65 PolarHBondContact O-N 3.29Å; K63-V65 VanDerWaalsContact C-N 3.33Å; K63-V65 PolarHBondContact O-N 3.19Å
66	R	36.5	Very low	34.4	Very low	210 Å²	210	129.5 Å²	129.5	79%	0.792	66%	0.664	S	S	*	*	H	α-helix	trans	-86.1	-20.1	177.9	-69.2	-172.4	178.6	-171.1	1.8	113.9	K63 N64	K63-R66 PolarHBondContact O-N 3.37Å; N64-R66 VanDerWaalsContact C-N 3.32Å
67	E	32.8	Very low	33.2	Very low	145 Å²	145	134.6 Å²	134.6	68%	0.678	67%	0.669	S	S	*	*	H	α-helix	trans	-96.8	-20.6	176.9	-75.7	177.6	165.9	0	0	113.2	K63 T69	K63-E67 PolarHBondContact O-N 3.21Å; E67-T69 VanDerWaalsContact C-N 3.32Å; E67-T69 PolarHBondContact O-N 2.8Å
68	A	31.8	Very low	32.2	Very low	82 Å²	82	134.7 Å²	134.7	68%	0.678	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	2.8	-179.1	0	0	0	0	0	115.6	N64	N64-A68 VanDerWaalsContact O-CB 3.23Å; N64-A68 WeakPolarHBondContact O-CB 3.41Å; N64-A68 PolarHBondContact O-N 3.35Å
69	T	33	Very low	31.2	Very low	125 Å²	125	133.5 Å²	133.5	77%	0.767	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	2.2	177.2	41.8	0	0	0	0	114.5	E67	E67-T69 VanDerWaalsContact C-N 3.32Å; E67-T69 PolarHBondContact O-N 2.8Å
70	T	33.4	Very low	30.6	Very low	116 Å²	116	133.2 Å²	133.2	71%	0.712	70%	0.695	S	S	*	*	S	Bend	trans	-115.9	4.1	-176.9	14.9	0	0	0	0	116.7
71	E	29.2	Very low	30.1	Very low	184 Å²	184	139.4 Å²	139.4	86%	0.86	72%	0.716	S	S	*	*			trans	-135	78.5	174.5	-67.3	-170.1	173.7	0	0	111
72	K	26.9	Very low	29.5	Very low	169 Å²	169	144.3 Å²	144.3	74%	0.735	74%	0.736	S	S	*	*			trans	-61	142.8	155.7	-103.8	-178.8	165.4	-134.6	0	109.5
73	E	27.2	Very low	28.6	Very low	133 Å²	133	144.2 Å²	144.2	62%	0.621	75%	0.748	S	S	*	*			trans	64	99.1	137.6	-64.1	165	-171.7	0	0	116.2
74	H	25.7	Very low	28.2	Very low	169 Å²	169	144.2 Å²	144.2	78%	0.782	75%	0.754	S	S	*	*				-172.5	122.9	120.3	-92.1	-40.1	0	0	0	112.3
75	Q	24.9	Very low	27.8	Very low	180 Å²	180	149 Å²	149	84%	0.841	77%	0.771	S	S	*	*			trans	58.8	151.4	141.1	-69.2	177	0	0	0	118.9
76	C	21.8	Very low	27.2	Very low	99 Å²	99	148 Å²	148	67%	0.669	78%	0.781	S	S	*	*			cis	-177.5	134.3	-21.8	-164.9	0	0	0	0	103.5
77	R	23	Very low	26.8	Very low	233 Å²	233	148.6 Å²	148.6	88%	0.879	78%	0.783	S	S	*	*			trans	54.9	143.6	145.1	-80	179.1	165.7	176.8	-5	122.8
78	S	23.8	Very low	26.5	Very low	131 Å²	131	149.6 Å²	149.6	92%	0.916	79%	0.793	S	S	*	*			trans	86.5	133.5	155.5	-157.8	0	0	0	0	114.6
79	G	23.4	Very low	26.3	Very low	61 Å²	61	149.9 Å²	149.9	63%	0.629	79%	0.79	S	S	*	*			cis	168.2	157.8	3.5	0	0	0	0	0	108.5
80	E	25.3	Very low	26.1	Very low	187 Å²	187	152.5 Å²	152.5	87%	0.874	80%	0.798	S	S	*	*			trans	63.1	113.3	158.4	-64.1	175.7	168	0	0	119
81	E	24.8	Very low	25.9	Very low	176 Å²	176	155.2 Å²	155.2	82%	0.822	80%	0.8	S	S	*	*				60.2	116	86.9	-97.9	-172.3	179.8	0	0	114.9
82	L	25.8	Very low	25.9	Very low	172 Å²	172	154.2 Å²	154.2	90%	0.901	80%	0.801	S	S	*	*				179.3	138	119.1	-91.8	162.3	0	0	0	112.3
83	C	23.4	Very low	26	Very low	121 Å²	121	154.2 Å²	154.2	82%	0.818	80%	0.803	S	S	*	*			trans	-71.6	158	171.8	-52.6	0	0	0	0	112.3
84	D	26.1	Very low	26.2	Very low	139 Å²	139	159.4 Å²	159.4	74%	0.743	82%	0.817	S	S	*	*				-172.4	159.9	104.8	-151.5	6.1	0	0	0	112.9
85	K	26.9	Very low	26.4	Very low	196 Å²	196	160.1 Å²	160.1	85%	0.852	82%	0.821	S	S	*	*			trans	-65.3	158.7	-170.1	-63	155.4	-179.2	166.7	0	115.5
86	G	25.7	Very low	26.8	Very low	81 Å²	81	159 Å²	159	84%	0.835	82%	0.82	S	S	*	*			trans	-169	81.4	163.4	0	0	0	0	0	113.3
87	R	27.1	Very low	27.4	Very low	222 Å²	222	161.5 Å²	161.5	84%	0.838	83%	0.827	S	S	*	*			trans	-64.7	142.2	175.1	-159.7	-176.1	-155.8	-151	5.9	110.8
88	N	27.5	Very low	28.2	Very low	166 Å²	166	156.3 Å²	156.3	89%	0.888	82%	0.821	S	S	*	*			trans	-167.7	119.9	131.2	-93.2	-17	0	0	0	113.4
89	S	27.2	Very low	28.9	Very low	87 Å²	87	159.7 Å²	159.7	61%	0.608	82%	0.819	S	S	*	*			trans	-92.6	137.8	176.8	47.7	0	0	0	0	111
90	L	29.7	Very low	30	Very low	180 Å²	180	158.9 Å²	158.9	94%	0.942	81%	0.811	S	S	*	*			trans	-121	105.7	161.6	-88.6	153.4	0	0	0	108.5
91	K	27.9	Very low	30.9	Very low	174 Å²	174	155.7 Å²	155.7	76%	0.757	80%	0.799	S	S	*	*			trans	-88.6	128.7	168.4	-71.9	179.7	172	-173.7	0	107.6
92	N	29	Very low	32	Very low	162 Å²	162	156.3 Å²	156.3	87%	0.866	80%	0.802	S	S	*	*			trans	-111.5	109.6	160.1	-91.7	-11.3	0	0	0	107.8
93	E	29.7	Very low	33.5	Very low	169 Å²	169	152.3 Å²	152.3	79%	0.79	79%	0.794	S	S	*	*			trans	-72	127.3	171.9	-69.7	170.8	161.5	0	0	109
94	R	31.7	Very low	35.1	Very low	243 Å²	243	150.6 Å²	150.6	92%	0.917	78%	0.776	S	S	*	*			trans	-106.4	101	161.5	-84.9	-175.3	176.7	-176.2	-0.5	107.1	L96	R94-L96 PolarHBondContact O-N 2.97Å
95	E	29.6	Very low	36.8	Very low	184 Å²	184	148.3 Å²	148.3	86%	0.86	76%	0.763	S	S	*	*			trans	-67.6	115.3	165.8	-72.9	-179	145.5	0	0	109	N97	E95-N97 PolarHBondContact O-N 3.24Å
96	L	32.8	Very low	39.1	Very low	157 Å²	157	142 Å²	142	82%	0.822	74%	0.739	S	S	*	*			trans	-82.3	108	169.5	-90.7	150.6	0	0	0	108.4	R94 T98	R94-L96 PolarHBondContact O-N 2.97Å; L96-T98 PolarHBondContact O-N 3.26Å; L96-T98 VanDerWaalsContact O-N 3.15Å
97	N	35.2	Very low	41.1	Very low	150 Å²	150	146.9 Å²	146.9	80%	0.802	75%	0.746	S	S	*	*			trans	-76.3	93.1	176.1	-128	-16	0	0	0	109.2	E95 K99	E95-N97 PolarHBondContact O-N 3.24Å; N97-K99 PolarHBondContact O-N 2.98Å; N97-K99 VanDerWaalsContact O-N 3.17Å
98	T	39.2	Very low	43.4	Very low	125 Å²	125	142.1 Å²	142.1	77%	0.767	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	18.4	-175.8	32.4	0	0	0	0	115.2	L96	L96-T98 PolarHBondContact O-N 3.26Å; L96-T98 VanDerWaalsContact O-N 3.15Å
99	K	39.5	Very low	45.3	Very low	202 Å²	202	136.3 Å²	136.3	88%	0.878	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	9.5	-175.4	-85.3	-173.9	173.8	-178.2	0	116	N97	N97-K99 PolarHBondContact O-N 2.98Å; N97-K99 VanDerWaalsContact O-N 3.17Å
100	G	45.5	Very low	47.6	Very low	43 Å²	43	137.1 Å²	137.1	44%	0.443	71%	0.714	S	S	.	*	S	Bend	trans	-115.2	-6.1	-175.5	0	0	0	0	0	116.8
101	L	45.1	Very low	49.5	Very low	120 Å²	120	133.6 Å²	133.6	63%	0.628	70%	0.695	S	S	*	*	S	Bend	trans	-85	-22	-172.7	-96	87.8	0	0	0	114.6	A103	L101-A103 PolarHBondContact O-N 3.49Å
102	E	48.4	Very low	50.9	Low	190 Å²	190	131 Å²	131	89%	0.888	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-10.6	-179.3	-72.8	178.4	165.2	0	0	113.6
103	A	55.9	Low	52.3	Low	88 Å²	88	129.2 Å²	129.2	73%	0.727	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	9.1	-175.5	0	0	0	0	0	114	L101	L101-A103 PolarHBondContact O-N 3.49Å
104	L	57.3	Low	53.5	Low	85 Å²	85	126.9 Å²	126.9	45%	0.445	68%	0.678	S	S	.	*	S	Bend	trans	-126	17.9	-176.5	-67.4	172.8	0	0	0	112.1	L111 E112	L104-L111 HydrophobicContact CB-CD2 3.86Å; L104-L111 CarbonylContact O-C 3.58Å; L104-L111 VanDerWaalsContact O-CA 3.25Å; L104-L111 WeakPolarHBondContact O-CA 3.4Å; L104-E112 PolarHBondContact O-N 2.9Å
105	L	61.4	Low	54.3	Low	90 Å²	90	126.4 Å²	126.4	47%	0.471	68%	0.676	S	S	.	*	B	Isolated β-bridge	trans	-102.9	133.7	177.5	-59.6	175.9	0	0	0	109.6	D110 L111	L105-D110 CarbonylContact C-O 3.56Å; L105-D110 WeakPolarHBondContact CA-O 3.35Å; L105-L111 HydrophobicContact CD2-CD2 3.96Å; L105-L111 HydrophobicContact CD2-CG 3.96Å
106	D	76.7	Confident	55.3	Low	64 Å²	64	128.7 Å²	128.7	34%	0.342	68%	0.677	S	S	.	*			trans	-83.4	-177.1	170.4	63.4	4.9	0	0	0	111.4	D108 G109 D110	D106-D108 PolarHBondContact O-N 3.15Å; D106-D108 VanDerWaalsContact O-N 3.15Å; D106-G109 PolarHBondContact O-N 3.03Å; D106-G109 VanDerWaalsContact O-N 3.07Å; D106-G109 PolarHBondContact OD1-N 3.27Å; D106-D110 PolarHBondContact N-O 3.08Å; D106-D110 WeakPolarHBondContact OD1-CA 3.31Å; D106-D110 PolarHBondContact OD1-N 3.37Å; D106-D110 VanDerWaalsContact OD1-O 3.08Å
107	D	67.8	Low	56	Low	184 Å²	184	126.8 Å²	126.8	98%	0.984	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-16.7	-168.8	-75.8	-26	0	0	0	114.3
108	D	74.6	Confident	56.3	Low	122 Å²	122	126 Å²	126	65%	0.652	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-1.9	175.4	68.4	12.6	0	0	0	114	D106 D110	D106-D108 PolarHBondContact O-N 3.15Å; D106-D108 VanDerWaalsContact O-N 3.15Å; D108-D110 PolarHBondContact OD1-N 3.03Å
109	G	68.4	Low	56.8	Low	43 Å²	43	123 Å²	123	44%	0.443	65%	0.649	S	S	.	*	S	Bend	trans	94.4	13.8	173.8	0	0	0	0	0	114.5	D106	D106-G109 PolarHBondContact O-N 3.03Å; D106-G109 VanDerWaalsContact O-N 3.07Å; D106-G109 PolarHBondContact OD1-N 3.27Å
110	D	73.7	Confident	57.3	Low	105 Å²	105	117.4 Å²	117.4	56%	0.561	64%	0.64	S	S	*	*			trans	-87.5	157.1	173.2	-78.9	-13	0	0	0	111.8	L105 D106 D108 E112	L105-D110 CarbonylContact C-O 3.56Å; L105-D110 WeakPolarHBondContact CA-O 3.35Å; D106-D110 PolarHBondContact N-O 3.08Å; D106-D110 WeakPolarHBondContact OD1-CA 3.31Å; D106-D110 PolarHBondContact OD1-N 3.37Å; D106-D110 VanDerWaalsContact OD1-O 3.08Å; D108-D110 PolarHBondContact OD1-N 3.03Å; D110-E112 PolarHBondContact O-N 2.66Å
111	L	70.1	Confident	57.6	Low	105 Å²	105	118.9 Å²	118.9	55%	0.55	64%	0.644	S	S	.	*	B	Isolated β-bridge	trans	-76	117	179	-82.1	159.8	0	0	0	111.3	L104 L105 V113	L104-L111 HydrophobicContact CB-CD2 3.86Å; L104-L111 CarbonylContact O-C 3.58Å; L104-L111 VanDerWaalsContact O-CA 3.25Å; L104-L111 WeakPolarHBondContact O-CA 3.4Å; L105-L111 HydrophobicContact CD2-CD2 3.96Å; L105-L111 HydrophobicContact CD2-CG 3.96Å; L111-V113 WeakPolarHBondContact O-CG2 3.46Å; L111-V113 PolarHBondContact O-N 2.88Å
112	E	57.5	Low	57.8	Low	119 Å²	119	116.2 Å²	116.2	56%	0.556	63%	0.63	S	S	*	*			trans	-72.9	89.9	177.5	-154.1	-174.9	-156.8	0	0	110.6	L104 D110 V114	L104-E112 PolarHBondContact O-N 2.9Å; D110-E112 PolarHBondContact O-N 2.66Å; E112-V114 PolarHBondContact O-N 2.8Å
113	V	57.8	Low	57.8	Low	125 Å²	125	112 Å²	112	76%	0.758	61%	0.614	S	S	*	*			trans	-84.7	94.5	-179.1	-164.3	0	0	0	0	110.6	L111 R115	L111-V113 WeakPolarHBondContact O-CG2 3.46Å; L111-V113 PolarHBondContact O-N 2.88Å; V113-R115 PolarHBondContact O-N 3.06Å; V113-R115 VanDerWaalsContact O-N 3.11Å
114	V	55.8	Low	57.5	Low	121 Å²	121	115.2 Å²	115.2	73%	0.733	61%	0.613	S	S	*	*			trans	-66	112.7	172.4	-170.9	0	0	0	0	109.3	E112 R116	E112-V114 PolarHBondContact O-N 2.8Å; V114-R116 PolarHBondContact O-N 2.67Å
115	R	49.3	Very low	57.1	Low	232 Å²	232	115.5 Å²	115.5	88%	0.875	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-59.4	124.3	173.5	-73.4	-174.9	179.5	150.6	2.1	109.4	V113	V113-R115 PolarHBondContact O-N 3.06Å; V113-R115 VanDerWaalsContact O-N 3.11Å
116	R	49.9	Very low	56.5	Low	233 Å²	233	114.6 Å²	114.6	88%	0.879	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-56.1	127.4	176.1	-153.6	178.5	-165.7	176.8	2.5	108.6	V114 Q118	V114-R116 PolarHBondContact O-N 2.67Å; R116-Q118 PolarHBondContact O-N 2.76Å; R116-Q118 VanDerWaalsContact O-N 3.1Å
117	P	46.4	Very low	55.1	Low	116 Å²	116	117.8 Å²	117.8	75%	0.753	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-62.9	117.4	176.7	22	-29.3	0	0	0	108.8	S119	P117-S119 PolarHBondContact O-N 2.78Å
118	Q	42.9	Very low	54.3	Low	134 Å²	134	116.2 Å²	116.2	63%	0.626	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-70.2	122.7	176.4	-78.8	173.5	-27.3	0	0	109.1	R116	R116-Q118 PolarHBondContact O-N 2.76Å; R116-Q118 VanDerWaalsContact O-N 3.1Å
119	S	48.4	Very low	53.1	Low	62 Å²	62	117.3 Å²	117.3	43%	0.434	63%	0.625	S	S	.	*	P	Polyproline II helix	trans	-76.7	146.5	167.5	0.8	0	0	0	0	108.7	P117 S121 D122	P117-S119 PolarHBondContact O-N 2.78Å; S119-S121 PolarHBondContact O-N 3.33Å; S119-D122 WeakPolarHBondContact CB-OD2 3.45Å; S119-D122 PolarHBondContact N-OD2 3.26Å; S119-D122 WeakPolarHBondContact O-CB 3.41Å; S119-D122 PolarHBondContact O-N 2.72Å; S119-D122 PolarHBondContact OG-OD2 3.27Å
120	A	51.3	Low	52.1	Low	84 Å²	84	123.3 Å²	123.3	69%	0.694	63%	0.634	S	S	*	*	H	α-helix	trans	-58	-18.6	178.6	0	0	0	0	0	113.9
121	S	51.9	Low	51.1	Low	75 Å²	75	123.3 Å²	123.3	52%	0.524	63%	0.634	S	S	.	*	H	α-helix	trans	-76.8	-16.2	172.3	56.6	0	0	0	0	114.6	S119 V125	S119-S121 PolarHBondContact O-N 3.33Å; S121-V125 WeakPolarHBondContact O-CG2 3.35Å
122	D	49.1	Very low	50.1	Low	64 Å²	64	126 Å²	126	34%	0.342	64%	0.641	S	S	.	*	H	α-helix	trans	-80.8	-26.1	-179.7	-59.7	-37.7	0	0	0	111.6	S119 E126	S119-D122 WeakPolarHBondContact CB-OD2 3.45Å; S119-D122 PolarHBondContact N-OD2 3.26Å; S119-D122 WeakPolarHBondContact O-CB 3.41Å; S119-D122 PolarHBondContact O-N 2.72Å; S119-D122 PolarHBondContact OG-OD2 3.27Å; D122-E126 WeakPolarHBondContact O-CB 3.33Å; D122-E126 PolarHBondContact O-N 2.93Å
123	L	48.9	Very low	49.6	Very low	102 Å²	102	125.9 Å²	125.9	53%	0.534	65%	0.649	S	S	.	*	H	α-helix	trans	-69.1	-35.4	178.4	-68.6	170.4	0	0	0	112.5	D127	L123-D127 PolarHBondContact O-N 3.35Å
124	E	49.4	Very low	49	Very low	154 Å²	154	128 Å²	128	72%	0.72	64%	0.644	S	S	*	*	H	α-helix	trans	-79.3	-22.7	-179.8	-66.7	-173.6	167.4	0	0	113
125	V	48.9	Very low	48.2	Very low	92 Å²	92	128 Å²	128	56%	0.558	65%	0.646	S	S	*	*	H	α-helix	trans	-92.6	-31.2	179.7	-171.9	0	0	0	0	111.7	S121	S121-V125 WeakPolarHBondContact O-CG2 3.35Å
126	E	48.3	Very low	48.5	Very low	71 Å²	71	121.1 Å²	121.1	33%	0.332	63%	0.63	S	S	.	*	H	α-helix	trans	-72.1	-33.8	173.5	-82.4	-167.1	110.3	0	0	113.1	D122 L128 L129 R130	D122-E126 WeakPolarHBondContact O-CB 3.33Å; D122-E126 PolarHBondContact O-N 2.93Å; E126-L128 PolarHBondContact O-N 3.11Å; E126-L129 PolarHBondContact O-N 2.76Å; E126-R130 PolarHBondContact O-N 3.25Å; E126-R130 IonicContact OE1-CZ 2.74Å; E126-R130 IonicContact OE1-NE 2.96Å; E126-R130 IonicContact OE1-NH2 3.04Å; E126-R130 PolarHBondContact OE1-NH2 2.8Å
127	D	46.4	Very low	48.8	Very low	130 Å²	130	116.8 Å²	116.8	70%	0.695	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-17.5	-179.1	-114.1	4	0	0	0	113.6	L123	L123-D127 PolarHBondContact O-N 3.35Å
128	L	50.6	Low	49.3	Very low	151 Å²	151	113 Å²	113	79%	0.791	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-9.8	176.4	-71	171.1	0	0	0	113.6	E126	E126-L128 PolarHBondContact O-N 3.11Å
129	L	50.8	Low	50.1	Low	146 Å²	146	112.3 Å²	112.3	76%	0.764	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.2	-9.6	-176	-71.8	172.5	0	0	0	114.3	E126	E126-L129 PolarHBondContact O-N 2.76Å
130	R	47.6	Very low	50.3	Low	168 Å²	168	118.4 Å²	118.4	63%	0.634	61%	0.608	S	S	*	*	S	Bend	trans	-90.2	111.2	170.7	-68.5	-175.4	-173.8	-146.5	5.7	109.1	E126 K132	E126-R130 PolarHBondContact O-N 3.25Å; E126-R130 IonicContact OE1-CZ 2.74Å; E126-R130 IonicContact OE1-NE 2.96Å; E126-R130 IonicContact OE1-NH2 3.04Å; E126-R130 PolarHBondContact OE1-NH2 2.8Å; R130-K132 PolarHBondContact O-N 3.11Å; R130-K132 VanDerWaalsContact O-N 3.12Å
131	D	52.8	Low	50.2	Low	105 Å²	105	116 Å²	116	56%	0.561	59%	0.591	S	S	*	*			trans	-51.9	121.5	166.4	-76.5	-40.5	0	0	0	108.5	R32 V133	R32-D131 IonicContact CZ-OD2 3.69Å; R32-D131 VanDerWaalsContact CZ-OD2 3.32Å; R32-D131 IonicContact NH1-OD2 3.64Å; R32-D131 PolarHBondContact NH1-OD2 3.18Å; R32-D131 IonicContact NH2-OD2 2.92Å; R32-D131 PolarHBondContact NH2-OD2 3.46Å; D131-V133 PolarHBondContact O-N 3.42Å
132	K	47.6	Very low	50	Low	162 Å²	162	121.4 Å²	121.4	70%	0.704	61%	0.608	S	S	*	*			trans	-61.8	104.2	174.2	-79.2	179	178.4	173.9	0	108.3	R130 Y134	R130-K132 PolarHBondContact O-N 3.11Å; R130-K132 VanDerWaalsContact O-N 3.12Å; K132-Y134 HydrophobicContact CB-CE2 3.91Å; K132-Y134 WeakPolarHBondContact O-CD2 3.42Å; K132-Y134 PolarHBondContact O-N 2.81Å
133	V	47.1	Very low	49.8	Very low	117 Å²	117	125 Å²	125	71%	0.709	63%	0.627	S	S	*	*			trans	-79.6	109.4	171.5	-176.9	0	0	0	0	107.4	D131	D131-V133 PolarHBondContact O-N 3.42Å
134	Y	45	Very low	49.6	Very low	169 Å²	169	122.4 Å²	122.4	66%	0.663	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-80.7	135.6	171.7	-63.5	-87.7	0	0	0	108.8	K132 V136	K132-Y134 HydrophobicContact CB-CE2 3.91Å; K132-Y134 WeakPolarHBondContact O-CD2 3.42Å; K132-Y134 PolarHBondContact O-N 2.81Å; Y134-V136 PolarHBondContact O-N 2.82Å; Y134-V136 VanDerWaalsContact O-N 3.15Å
135	P	39.3	Very low	49.4	Very low	120 Å²	120	120.6 Å²	120.6	78%	0.779	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-63	119.2	173.3	26	-31.9	0	0	0	108.8	I137	P135-I137 PolarHBondContact O-N 2.82Å
136	V	55	Low	49.1	Very low	88 Å²	88	125 Å²	125	53%	0.533	63%	0.625	S	S	.	*	P	Polyproline II helix	trans	-78.2	118	171.5	-178.8	0	0	0	0	107.4	Y134 L138	Y134-V136 PolarHBondContact O-N 2.82Å; Y134-V136 VanDerWaalsContact O-N 3.15Å; V136-L138 HydrophobicContact CG1-CD2 3.99Å; V136-L138 PolarHBondContact O-N 2.93Å
137	I	58.2	Low	48.9	Very low	142 Å²	142	127.2 Å²	127.2	73%	0.728	64%	0.64	S	S	*	*			trans	-77.4	102.7	169.5	-59.1	174.7	0	0	0	106.2	P135	P135-I137 PolarHBondContact O-N 2.82Å
138	L	56.9	Low	48.8	Very low	38 Å²	38	130 Å²	130	20%	0.199	65%	0.649	C	S	.	*			trans	-71.1	133.6	173.5	-67.5	-177.7	0	0	0	110.2	M35 L38 V136 F145	M35-L138 HydrophobicContact CE-CD1 3.27Å; M35-L138 HydrophobicContact CE-CG 4.35Å; M35-L138 HydrophobicContact CG-CD1 3.79Å; M35-L138 HydrophobicContact SD-CD1 3.54Å; M35-L138 VanDerWaalsContact SD-CD1 3.54Å; L38-L138 HydrophobicContact CG-CB 4.49Å; L38-L138 HydrophobicContact CG-CD1 4.39Å; V136-L138 HydrophobicContact CG1-CD2 3.99Å; V136-L138 PolarHBondContact O-N 2.93Å; L138-F145 HydrophobicContact CD2-CE2 4.5Å
139	M	59.3	Low	48.5	Very low	119 Å²	119	129.8 Å²	129.8	59%	0.586	64%	0.643	S	S	*	*			trans	-82.7	149.3	173.9	-60.8	-64.2	-76.3	0	0	110
140	R	51.2	Low	48.1	Very low	189 Å²	189	132.2 Å²	132.2	71%	0.713	65%	0.651	S	S	*	*	B	Isolated β-bridge	trans	-92.7	109.4	172.3	-172	-178.8	-176.2	-172.5	0.6	107.6	A40	A40-R140 VanDerWaalsContact O-CZ 3.29Å; A40-R140 PolarHBondContact O-NE 3.3Å; A40-R140 PolarHBondContact O-NH2 3.41Å
141	G	50.6	Low	47.9	Very low	33 Å²	33	133.3 Å²	133.3	34%	0.34	66%	0.663	S	S	.	*	S	Bend	trans	102.7	143.4	173	0	0	0	0	0	116.5	D143	G141-D143 VanDerWaalsContact C-N 3.27Å; G141-D143 PolarHBondContact O-N 2.81Å
142	E	47.6	Very low	47.2	Very low	190 Å²	190	133.1 Å²	133.1	89%	0.888	67%	0.67	S	S	*	*	S	Bend	trans	36.2	-26	163.8	-65.6	178.1	-174.8	0	0	123.1	A144	E142-A144 PolarHBondContact O-N 3.25Å
143	D	43.9	Very low	47.2	Very low	138 Å²	138	131 Å²	131	74%	0.738	68%	0.676	S	S	*	*			trans	-93	86.9	-179.6	-67.5	-32.7	0	0	0	109.8	G141 F145	G141-D143 VanDerWaalsContact C-N 3.27Å; G141-D143 PolarHBondContact O-N 2.81Å; D143-F145 PolarHBondContact O-N 2.92Å
144	A	45.8	Very low	47.5	Very low	49 Å²	49	127.8 Å²	127.8	41%	0.405	66%	0.657	S	S	.	*			trans	-60.2	127.4	164.8	0	0	0	0	0	108.5	E142 E146	E142-A144 PolarHBondContact O-N 3.25Å; A144-E146 PolarHBondContact O-N 3.46Å; A144-E146 VanDerWaalsContact O-N 3.08Å
145	F	44.4	Very low	48.6	Very low	116 Å²	116	122.2 Å²	122.2	51%	0.509	64%	0.643	S	S	.	*			trans	-54.9	118.4	170.9	-70	-90	0	0	0	108.5	L138 D143 D147	L138-F145 HydrophobicContact CD2-CE2 4.5Å; D143-F145 PolarHBondContact O-N 2.92Å; F145-D147 PolarHBondContact O-N 2.94Å
146	E	42.3	Very low	50.8	Low	183 Å²	183	118.6 Å²	118.6	86%	0.855	62%	0.618	S	S	*	*			trans	-66.7	82.6	161.8	-70	-176.4	170.5	0	0	106.8	A144 E148	A144-E146 PolarHBondContact O-N 3.46Å; A144-E146 VanDerWaalsContact O-N 3.08Å; E146-E148 VanDerWaalsContact C-N 3.33Å; E146-E148 PolarHBondContact O-N 2.75Å
147	D	43.9	Very low	52.4	Low	119 Å²	119	115.6 Å²	115.6	64%	0.636	60%	0.599	S	S	*	*			trans	-63.9	100.8	167.3	-82.7	-23.1	0	0	0	107.1	F145 E149	F145-D147 PolarHBondContact O-N 2.94Å; D147-E149 PolarHBondContact O-N 2.88Å
148	E	44.8	Very low	54.1	Low	189 Å²	189	109 Å²	109	88%	0.883	57%	0.566	S	S	*	*			trans	-64.4	63.2	162.7	-71.5	-171.7	166.3	0	0	109.8	E146	E146-E148 VanDerWaalsContact C-N 3.33Å; E146-E148 PolarHBondContact O-N 2.75Å
149	E	44.7	Very low	55.8	Low	146 Å²	146	110.8 Å²	110.8	68%	0.682	57%	0.572	S	S	*	*			trans	-108.2	84.8	168.6	-77	-165.8	166.5	0	0	109.5	D147 E151	D147-E149 PolarHBondContact O-N 2.88Å; E149-E151 PolarHBondContact O-N 2.88Å
150	Q	41.4	Very low	57.5	Low	196 Å²	196	105.1 Å²	105.1	92%	0.916	54%	0.544	S	S	*	.			trans	31.2	82.5	150.4	-149.9	161.4	42.9	0	0	114.5	S152	Q150-S152 PolarHBondContact O-N 3.16Å
151	E	43.2	Very low	59.6	Low	192 Å²	192	96.3 Å²	96.3	90%	0.897	51%	0.511	S	S	*	.			trans	-51.3	93.4	174.3	-74	-175.1	142.1	0	0	111.5	E149 S153	E149-E151 PolarHBondContact O-N 2.88Å; E151-S153 PolarHBondContact O-N 2.81Å
152	S	39.9	Very low	61.6	Low	101 Å²	101	94.8 Å²	94.8	71%	0.706	50%	0.495	S	S	*	.			trans	-71.2	111.7	148.6	110.2	0	0	0	0	104.9	Q150 C154	Q150-S152 PolarHBondContact O-N 3.16Å; S152-C154 PolarHBondContact O-N 3.49Å
153	S	46	Very low	63.7	Low	118 Å²	118	85.8 Å²	85.8	83%	0.825	45%	0.453	S	S	*	.			trans	-64.2	62.8	173.4	63.3	0	0	0	0	110.9	E151 S155	E151-S153 PolarHBondContact O-N 2.81Å; S153-S155 PolarHBondContact O-N 3.36Å; S153-S155 VanDerWaalsContact O-N 3.1Å
154	C	54.7	Low	65.6	Low	48 Å²	48	80.9 Å²	80.9	32%	0.324	43%	0.426	S	S	.	.			trans	-79.3	98.1	178.1	-163.2	0	0	0	0	107.2	S152 D156 V157	S152-C154 PolarHBondContact O-N 3.49Å; C154-D156 PolarHBondContact O-N 2.82Å; C154-V157 HydrophobicContact CB-CG2 3.97Å
155	S	66.7	Low	67.5	Low	52 Å²	52	80.3 Å²	80.3	36%	0.364	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-1	179.8	56.6	0	0	0	0	114.7	S153 L242	S153-S155 PolarHBondContact O-N 3.36Å; S153-S155 VanDerWaalsContact O-N 3.1Å; S155-L242 WeakPolarHBondContact O-CD2 3.4Å
156	D	85.5	Confident	69.5	Low	45 Å²	45	74.9 Å²	74.9	24%	0.241	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	23.1	-166.1	-54.4	-27.2	0	0	0	111.4	K51 L52 W54 C154	K51-D156 CarbonylContact C-O 3.43Å; L52-D156 HydrophobicContact CB-CB 4.34Å; L52-D156 WeakPolarHBondContact CB-O 3.46Å; L52-D156 PolarHBondContact N-O 3.28Å; W54-D156 VanDerWaalsContact CD1-CG 3.47Å; W54-D156 PolarHBondContact NE1-OD1 2.71Å; C154-D156 PolarHBondContact O-N 2.82Å
157	V	90.3	Very high	71.6	Confident	24 Å²	24	68.2 Å²	68.2	15%	0.145	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	123.9	-178.4	177.5	0	0	0	0	110.6	Y49 F50 C154	Y49-V157 HydrophobicContact CD1-CG1 4Å; Y49-V157 HydrophobicContact CG-CG1 4.46Å; F50-V157 WeakPolarHBondContact O-CA 3.14Å; C154-V157 HydrophobicContact CB-CG2 3.97Å
158	V	92.6	Very high	73.5	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.024	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	123.2	171.6	-174.7	0	0	0	0	109.1	Y49 F50 L52 I160 I210 I211 N239 L242	Y49-V158 CarbonylContact C-O 3.59Å; F50-V158 HydrophobicContact CB-CB 4.27Å; F50-V158 PolarHBondContact N-O 3Å; F50-V158 PolarHBondContact O-N 3.32Å; L52-V158 HydrophobicContact CD1-CG2 4.09Å; L52-V158 HydrophobicContact CD2-CG2 4.29Å; L52-V158 HydrophobicContact CG-CG2 4.16Å; V158-I160 HydrophobicContact CG1-CD1 3.81Å; V158-I160 HydrophobicContact CG1-CG1 3.97Å; V158-I210 HydrophobicContact CG1-CG2 4.02Å; V158-I211 HydrophobicContact CG2-CD1 3.82Å; V158-N239 VanDerWaalsContact CA-OD1 3.26Å; V158-N239 WeakPolarHBondContact CA-OD1 3.37Å; V158-L242 HydrophobicContact CG2-CD1 3.76Å
159	K	93.5	Very high	75.5	Confident	75 Å²	75	65.5 Å²	65.5	33%	0.326	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	125.5	179.1	-63.3	-178.9	-173.7	177.6	0	109.9	L47 S48 Y49 L238 N239	L47-K159 HydrophobicContact CD1-CB 4.22Å; S48-K159 WeakPolarHBondContact O-CA 3.48Å; Y49-K159 HydrophobicContact CD1-CG 3.89Å; Y49-K159 HydrophobicContact CE1-CD 4.16Å; Y49-K159 HydrophobicContact CE1-CG 4.02Å; K159-L238 HydrophobicContact CB-CB 4.18Å; K159-L238 HydrophobicContact CB-CD1 4.36Å; K159-N239 PolarHBondContact N-OD1 3.48Å; K159-N239 PolarHBondContact O-ND2 3.17Å
160	I	94.7	Very high	77.7	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	120.8	-177.4	-56.2	-69.8	0	0	0	109.5	S48 F50 V158 H162 V175 T205 V207 I210 N235	S48-I160 PolarHBondContact N-O 3.39Å; S48-I160 PolarHBondContact O-N 2.67Å; F50-I160 HydrophobicContact CD2-CB 4.32Å; F50-I160 HydrophobicContact CD2-CG1 3.89Å; F50-I160 HydrophobicContact CE2-CB 3.9Å; F50-I160 HydrophobicContact CE2-CG1 3.9Å; V158-I160 HydrophobicContact CG1-CD1 3.81Å; V158-I160 HydrophobicContact CG1-CG1 3.97Å; I160-H162 HydrophobicContact CG2-CB 4.28Å; I160-V175 HydrophobicContact CG2-CG2 3.89Å; I160-T205 HydrophobicContact CG2-CG2 4.41Å; I160-V207 HydrophobicContact CD1-CG2 3.62Å; I160-V207 HydrophobicContact CG1-CG2 3.75Å; I160-V207 HydrophobicContact CG2-CG2 4.07Å; I160-I210 HydrophobicContact CD1-CD1 3.58Å; I160-N235 HydrophobicContact CD1-CB 4.3Å
161	E	94.3	Very high	80	Confident	5 Å²	5	51.1 Å²	51.1	2%	0.023	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	130.2	158.2	-68.7	-158.7	154.5	0	0	110.2	V36 R37 V45 F46 L47 M231 H234 N235 L238	V36-E161 WeakPolarHBondContact CG2-OE1 3.2Å; R37-E161 IonicContact CZ-OE2 3.42Å; R37-E161 VanDerWaalsContact CZ-OE2 3.3Å; R37-E161 IonicContact NE-OE1 2.77Å; R37-E161 IonicContact NE-OE2 3.91Å; R37-E161 PolarHBondContact NE-OE2 2.97Å; R37-E161 IonicContact NH2-OE2 3.36Å; R37-E161 PolarHBondContact NH2-OE2 3.34Å; V45-E161 HydrophobicContact CG1-CB 3.84Å; V45-E161 HydrophobicContact CG1-CG 4.22Å; F46-E161 CarbonylContact O-C 3.51Å; F46-E161 VanDerWaalsContact O-CA 3.25Å; F46-E161 WeakPolarHBondContact O-CA 3.47Å; L47-E161 HydrophobicContact CD1-CG 4.07Å; E161-M231 HydrophobicContact CB-CG 4.47Å; E161-H234 IonicContact OE1-NE2 3.39Å; E161-H234 IonicContact OE2-CD2 2.72Å; E161-H234 PolarHBondContact OE2-CD2 2.8Å; E161-H234 IonicContact OE2-NE2 3.83Å; E161-N235 WeakPolarHBondContact CB-OD1 3.43Å; E161-N235 PolarHBondContact N-OD1 2.89Å; E161-N235 PolarHBondContact O-ND2 2.93Å; E161-L238 HydrophobicContact CG-CD1 4.25Å
162	H	93.4	Very high	82.4	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	167.2	177.5	67.4	102.6	0	0	0	111.1	F46 S48 I160 K173 V175 T205	F46-H162 PolarHBondContact N-O 2.88Å; F46-H162 PolarHBondContact O-N 3.44Å; S48-H162 WeakPolarHBondContact CB-NE2 3.46Å; S48-H162 PolarHBondContact OG-NE2 2.76Å; I160-H162 HydrophobicContact CG2-CB 4.28Å; H162-K173 CarbonylContact C-O 3.59Å; H162-K173 WeakPolarHBondContact CA-O 3.26Å; H162-K173 VanDerWaalsContact CB-O 3.32Å; H162-K173 WeakPolarHBondContact CB-O 3.43Å; H162-V175 HydrophobicContact CB-CG2 3.85Å; H162-T205 HydrophobicContact CB-CG2 3.8Å
163	T	91.1	Very high	85	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.223	C	C	.	.			trans	-101.2	138.8	169.2	56.1	0	0	0	0	109.3	Q43 V45 T166 K173 Q174 M231	Q43-T163 HydrophobicContact CB-CG2 4.32Å; V45-T163 HydrophobicContact CG2-CG2 4.41Å; T163-T166 HydrophobicContact CG2-CG2 4.47Å; T163-T166 WeakPolarHBondContact OG1-CG2 3.24Å; T163-K173 HydrophobicContact CG2-CB 4.1Å; T163-K173 HydrophobicContact CG2-CD 4.44Å; T163-K173 PolarHBondContact N-O 3.49Å; T163-K173 WeakPolarHBondContact OG1-CB 2.94Å; T163-K173 PolarHBondContact OG1-O 3.11Å; T163-Q174 WeakPolarHBondContact O-CA 3.22Å; T163-Q174 VanDerWaalsContact O-CG 3.3Å; T163-Q174 WeakPolarHBondContact O-CG 2.75Å; T163-M231 HydrophobicContact CG2-CE 4.29Å
164	M	84.7	Confident	87.3	Confident	36 Å²	36	32.8 Å²	32.8	18%	0.177	19%	0.185	C	C	.	.	S	Bend	trans	-84.1	-19.6	179.3	-69.6	-178.1	177	0	0	113.4	F46 Q174	F46-M164 HydrophobicContact CB-CE 4.05Å; F46-M164 HydrophobicContact CD1-CE 3.82Å; F46-M164 HydrophobicContact CD1-SD 4.06Å; F46-M164 HydrophobicContact CD2-CB 4.27Å; F46-M164 HydrophobicContact CD2-CE 4.35Å; F46-M164 HydrophobicContact CD2-CG 3.69Å; F46-M164 HydrophobicContact CD2-SD 4.09Å; F46-M164 HydrophobicContact CE1-CE 4.34Å; F46-M164 HydrophobicContact CE1-SD 4.04Å; F46-M164 HydrophobicContact CE2-CB 4.05Å; F46-M164 HydrophobicContact CE2-CG 3.87Å; F46-M164 HydrophobicContact CE2-SD 4.06Å; F46-M164 HydrophobicContact CG-CE 3.82Å; F46-M164 HydrophobicContact CG-CG 4.12Å; F46-M164 HydrophobicContact CG-SD 4.09Å; F46-M164 HydrophobicContact CZ-CG 4.45Å; F46-M164 HydrophobicContact CZ-SD 4.04Å; M164-Q174 PolarHBondContact O-OE1 2.91Å
165	A	84.5	Confident	89.1	Confident	36 Å²	36	30.5 Å²	30.5	30%	0.298	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	123.9	-171.8	0	0	0	0	0	109.4	T19 V20 L21	T19-A165 HydrophobicContact CG2-CB 3.67Å; V20-A165 WeakPolarHBondContact O-CA 3.39Å; L21-A165 HydrophobicContact CD2-CB 3.48Å; L21-A165 VanDerWaalsContact CD2-CB 3.48Å
166	T	86.5	Confident	90.4	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.012	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	159.1	-178.1	67.3	0	0	0	0	111.5	T19 V20 T163 D170 V171 K173 Q174	T19-T166 CarbonylContact C-O 3.55Å; T19-T166 WeakPolarHBondContact CA-O 3.01Å; V20-T166 PolarHBondContact N-O 3.01Å; V20-T166 PolarHBondContact O-N 3.38Å; V20-T166 VanDerWaalsContact O-N 3.11Å; T163-T166 HydrophobicContact CG2-CG2 4.47Å; T163-T166 WeakPolarHBondContact OG1-CG2 3.24Å; T166-D170 HydrophobicContact CG2-CB 4.09Å; T166-D170 PolarHBondContact OG1-O 3.15Å; T166-V171 WeakPolarHBondContact OG1-CA 3.33Å; T166-V171 PolarHBondContact OG1-N 2.86Å; T166-K173 HydrophobicContact CG2-CB 4.34Å; T166-Q174 HydrophobicContact CG2-CG 3.9Å; T166-Q174 PolarHBondContact OG1-NE2 2.88Å
167	P	87.1	Confident	90.9	Very high	43 Å²	43	28.7 Å²	28.7	28%	0.279	15%	0.151	S	C	.	.			trans	-61.6	164.5	158.5	29.3	-33.6	0	0	0	110.7	D18 E169 D170 V171	D18-P167 WeakPolarHBondContact O-CA 3.38Å; P167-E169 VanDerWaalsContact C-N 3.26Å; P167-E169 HydrophobicContact CB-CG 4.12Å; P167-E169 HydrophobicContact CG-CG 3.91Å; P167-E169 PolarHBondContact O-N 3.29Å; P167-D170 HydrophobicContact CG-CB 3.99Å; P167-D170 PolarHBondContact O-N 3.09Å; P167-V171 PolarHBondContact O-N 3.24Å
168	L	84.9	Confident	91.2	Very high	80 Å²	80	27.5 Å²	27.5	42%	0.419	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-58.2	-37.2	-177.7	-172.6	63.2	0	0	0	112.8	V20 D170 V171 Y294	V20-L168 HydrophobicContact CG2-CB 4.43Å; V20-L168 HydrophobicContact CG2-CD1 4.07Å; L168-D170 PolarHBondContact O-N 3.29Å; L168-V171 HydrophobicContact CD1-CG1 4.11Å; L168-V171 WeakPolarHBondContact O-CG1 3.49Å; L168-V171 VanDerWaalsContact O-CG2 3.26Å; L168-V171 WeakPolarHBondContact O-CG2 3.27Å; L168-V171 PolarHBondContact O-N 2.77Å; L168-Y294 HydrophobicContact CD1-CD2 4.09Å; L168-Y294 HydrophobicContact CD1-CE2 4.37Å
169	E	86.6	Confident	91.4	Very high	171 Å²	171	28 Å²	28	80%	0.799	15%	0.148	S	C	*	.	G	3₁₀ helix	trans	-63.4	-17.8	177.3	63.4	-164.5	-163.3	0	0	114.2	P167	P167-E169 VanDerWaalsContact C-N 3.26Å; P167-E169 HydrophobicContact CB-CG 4.12Å; P167-E169 HydrophobicContact CG-CG 3.91Å; P167-E169 PolarHBondContact O-N 3.29Å
170	D	89.7	Confident	91.5	Very high	34 Å²	34	24.4 Å²	24.4	18%	0.182	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-114.1	10	-174.3	-88.9	-29.4	0	0	0	113.1	Q43 T166 P167 L168 G172 K173	Q43-D170 PolarHBondContact NE2-OD2 3.22Å; Q43-D170 PolarHBondContact OE1-OD2 2.88Å; T166-D170 HydrophobicContact CG2-CB 4.09Å; T166-D170 PolarHBondContact OG1-O 3.15Å; P167-D170 HydrophobicContact CG-CB 3.99Å; P167-D170 PolarHBondContact O-N 3.09Å; L168-D170 PolarHBondContact O-N 3.29Å; D170-G172 PolarHBondContact O-N 2.81Å; D170-K173 HydrophobicContact CB-CD 4.12Å; D170-K173 WeakPolarHBondContact O-CB 3.37Å; D170-K173 PolarHBondContact O-N 2.83Å; D170-K173 VanDerWaalsContact OD1-CE 3.31Å; D170-K173 WeakPolarHBondContact OD1-CE 3.08Å; D170-K173 IonicContact OD1-NZ 2.61Å; D170-K173 PolarHBondContact OD1-NZ 3.33Å; D170-K173 IonicContact OD2-NZ 2.94Å; D170-K173 PolarHBondContact OD2-NZ 3.21Å
171	V	91	Very high	91.7	Very high	6 Å²	6	24.4 Å²	24.4	4%	0.036	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-61.3	-18.9	-175.7	-68.1	0	0	0	0	114.2	V20 T166 P167 L168 K173 Q174 W176 Y294	V20-V171 HydrophobicContact CB-CG1 3.83Å; V20-V171 HydrophobicContact CG1-CG1 3.81Å; V20-V171 HydrophobicContact CG2-CG1 3.98Å; T166-V171 WeakPolarHBondContact OG1-CA 3.33Å; T166-V171 PolarHBondContact OG1-N 2.86Å; P167-V171 PolarHBondContact O-N 3.24Å; L168-V171 HydrophobicContact CD1-CG1 4.11Å; L168-V171 WeakPolarHBondContact O-CG1 3.49Å; L168-V171 VanDerWaalsContact O-CG2 3.26Å; L168-V171 WeakPolarHBondContact O-CG2 3.27Å; L168-V171 PolarHBondContact O-N 2.77Å; V171-K173 PolarHBondContact O-N 2.81Å; V171-Q174 PolarHBondContact O-N 3.11Å; V171-Q174 VanDerWaalsContact O-N 3.14Å; V171-W176 HydrophobicContact CB-CZ2 3.99Å; V171-W176 HydrophobicContact CG1-CZ2 4.18Å; V171-W176 PolarHBondContact O-NE1 3.39Å; V171-Y294 HydrophobicContact CG2-CE1 4.21Å; V171-Y294 HydrophobicContact CG2-CE2 4.33Å
172	G	92.6	Very high	91.9	Very high	18 Å²	18	24.2 Å²	24.2	19%	0.186	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-63.1	-22.4	172.5	0	0	0	0	0	113.5	D170 Q174 G204 T205 L228	D170-G172 PolarHBondContact O-N 2.81Å; G172-Q174 PolarHBondContact O-N 2.85Å; G172-G204 CarbonylContact O-C 3.6Å; G172-G204 WeakPolarHBondContact O-CA 3.03Å; G172-T205 PolarHBondContact O-N 2.98Å; G172-L228 VanDerWaalsContact C-CD1 3.48Å; G172-L228 WeakPolarHBondContact O-CD1 3.5Å
173	K	93.9	Very high	92.1	Very high	6 Å²	6	24.2 Å²	24.2	3%	0.026	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-75.9	-8.2	176.2	-62.6	169.6	178.8	161.6	0	113	H162 T163 T166 D170 V171 T205 L228 M231	H162-K173 CarbonylContact C-O 3.59Å; H162-K173 WeakPolarHBondContact CA-O 3.26Å; H162-K173 VanDerWaalsContact CB-O 3.32Å; H162-K173 WeakPolarHBondContact CB-O 3.43Å; T163-K173 HydrophobicContact CG2-CB 4.1Å; T163-K173 HydrophobicContact CG2-CD 4.44Å; T163-K173 PolarHBondContact N-O 3.49Å; T163-K173 WeakPolarHBondContact OG1-CB 2.94Å; T163-K173 PolarHBondContact OG1-O 3.11Å; T166-K173 HydrophobicContact CG2-CB 4.34Å; D170-K173 HydrophobicContact CB-CD 4.12Å; D170-K173 WeakPolarHBondContact O-CB 3.37Å; D170-K173 PolarHBondContact O-N 2.83Å; D170-K173 VanDerWaalsContact OD1-CE 3.31Å; D170-K173 WeakPolarHBondContact OD1-CE 3.08Å; D170-K173 IonicContact OD1-NZ 2.61Å; D170-K173 PolarHBondContact OD1-NZ 3.33Å; D170-K173 IonicContact OD2-NZ 2.94Å; D170-K173 PolarHBondContact OD2-NZ 3.21Å; V171-K173 PolarHBondContact O-N 2.81Å; K173-T205 WeakPolarHBondContact O-CG2 3.5Å; K173-L228 HydrophobicContact CB-CD1 4.47Å; K173-L228 HydrophobicContact CG-CD1 3.91Å; K173-M231 HydrophobicContact CB-CE 4.24Å; K173-M231 HydrophobicContact CB-SD 4.22Å; K173-M231 HydrophobicContact CG-CE 4.25Å; K173-M231 HydrophobicContact CG-SD 4.46Å
174	Q	93.9	Very high	92.4	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.009	13%	0.132	C	C	.	.	S	Bend	trans	-96.9	165.3	178.5	-45.8	-162	35.5	0	0	112	V20 S22 T163 M164 T166 V171 G172 W176 T205	V20-Q174 PolarHBondContact O-NE2 2.8Å; S22-Q174 PolarHBondContact OG-OE1 3.02Å; T163-Q174 WeakPolarHBondContact O-CA 3.22Å; T163-Q174 VanDerWaalsContact O-CG 3.3Å; T163-Q174 WeakPolarHBondContact O-CG 2.75Å; M164-Q174 PolarHBondContact O-OE1 2.91Å; T166-Q174 HydrophobicContact CG2-CG 3.9Å; T166-Q174 PolarHBondContact OG1-NE2 2.88Å; V171-Q174 PolarHBondContact O-N 3.11Å; V171-Q174 VanDerWaalsContact O-N 3.14Å; G172-Q174 PolarHBondContact O-N 2.85Å; Q174-W176 HydrophobicContact CB-CZ2 4.38Å; Q174-T205 WeakPolarHBondContact O-CG2 3.24Å
175	V	93.4	Very high	93	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.006	13%	0.127	C	C	.	.			trans	-102.4	125.3	172.7	-177.2	0	0	0	0	110.1	S22 V24 I160 H162 F180 T205 V207	S22-V175 VanDerWaalsContact CB-O 3.25Å; S22-V175 WeakPolarHBondContact CB-O 3.34Å; V24-V175 HydrophobicContact CG1-CB 4.5Å; V24-V175 HydrophobicContact CG1-CG1 4.18Å; I160-V175 HydrophobicContact CG2-CG2 3.89Å; H162-V175 HydrophobicContact CB-CG2 3.85Å; V175-F180 HydrophobicContact CG1-CD1 4.46Å; V175-F180 HydrophobicContact CG1-CE1 3.58Å; V175-F180 HydrophobicContact CG1-CE2 4.29Å; V175-F180 HydrophobicContact CG1-CZ 3.44Å; V175-F180 VanDerWaalsContact CG1-CZ 3.44Å; V175-T205 HydrophobicContact CG2-CG2 4.08Å; V175-V207 HydrophobicContact CG1-CG2 4.16Å; V175-V207 HydrophobicContact CG2-CG2 4.22Å
176	W	94.8	Very high	93.7	Very high	32 Å²	32	21.8 Å²	21.8	12%	0.121	11%	0.113	C	C	.	.			trans	-109.5	150.3	-176.3	-62.6	98.7	0	0	0	112.7	V20 V171 Q174 G178 A179 D291	V20-W176 HydrophobicContact CG1-CH2 3.45Å; V20-W176 VanDerWaalsContact CG1-CH2 3.45Å; V20-W176 HydrophobicContact CG1-CZ2 3.82Å; V171-W176 HydrophobicContact CB-CZ2 3.99Å; V171-W176 HydrophobicContact CG1-CZ2 4.18Å; V171-W176 PolarHBondContact O-NE1 3.39Å; Q174-W176 HydrophobicContact CB-CZ2 4.38Å; W176-G178 VanDerWaalsContact C-N 3.28Å; W176-G178 PolarHBondContact O-N 3.28Å; W176-A179 WeakPolarHBondContact O-CB 3.28Å; W176-A179 PolarHBondContact O-N 3.26Å; W176-D291 HydrophobicContact CB-CB 3.81Å; W176-D291 WeakPolarHBondContact CB-OD2 3.46Å; W176-D291 HydrophobicContact CG-CB 4.22Å
177	R	94.9	Very high	94.1	Very high	26 Å²	26	22 Å²	22	10%	0.098	11%	0.114	C	C	.	.	H	α-helix	trans	-63.5	-32.4	-173.7	-68.4	179.9	173.7	-158.8	-6.3	112.7	D23 V24 A179 F180 L181 E324 Y376 E377 L382	D23-R177 PolarHBondContact O-NH2 3.43Å; V24-R177 HydrophobicContact CG2-CB 4.37Å; V24-R177 HydrophobicContact CG2-CG 3.44Å; V24-R177 VanDerWaalsContact CG2-CG 3.44Å; R177-A179 VanDerWaalsContact C-N 3.27Å; R177-A179 PolarHBondContact O-N 2.95Å; R177-F180 PolarHBondContact O-N 2.98Å; R177-F180 VanDerWaalsContact O-N 3.12Å; R177-L181 PolarHBondContact O-N 2.71Å; R177-E324 WeakPolarHBondContact CD-OE1 3.46Å; R177-E324 WeakPolarHBondContact CD-OE2 3.49Å; R177-Y376 HydrophobicContact CB-CD2 4.41Å; R177-E377 IonicContact CZ-OE2 3.02Å; R177-E377 IonicContact NH1-OE2 3.73Å; R177-E377 PolarHBondContact NH1-OE2 3.22Å; R177-E377 IonicContact NH2-OE2 2.72Å; R177-E377 PolarHBondContact NH2-OE2 3.11Å; R177-L382 HydrophobicContact CB-CD1 4.3Å; R177-L382 HydrophobicContact CB-CD2 4.07Å
178	G	96.4	Very high	94.6	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.2	-32.4	174.4	0	0	0	0	0	112.8	W176 F180 L181 L182 D291 S322	W176-G178 VanDerWaalsContact C-N 3.28Å; W176-G178 PolarHBondContact O-N 3.28Å; G178-F180 VanDerWaalsContact C-N 3.28Å; G178-F180 PolarHBondContact O-N 3.48Å; G178-L181 PolarHBondContact O-N 3.13Å; G178-L182 WeakPolarHBondContact O-CB 3.49Å; G178-L182 PolarHBondContact O-N 2.94Å; G178-D291 WeakPolarHBondContact CA-OD2 3.41Å; G178-D291 PolarHBondContact N-OD2 3.06Å; G178-S322 VanDerWaalsContact CA-OG 3.22Å; G178-S322 WeakPolarHBondContact CA-OG 3.46Å; G178-S322 VanDerWaalsContact O-CB 3.24Å; G178-S322 WeakPolarHBondContact O-CB 3.15Å; G178-S322 PolarHBondContact O-OG 2.8Å
179	A	97.2	Very high	95.2	Very high	13 Å²	13	23.8 Å²	23.8	11%	0.107	11%	0.114	C	C	.	.	H	α-helix	trans	-64	-36.4	174.4	0	0	0	0	0	111.4	W176 R177 A183 V207 A290	W176-A179 WeakPolarHBondContact O-CB 3.28Å; W176-A179 PolarHBondContact O-N 3.26Å; R177-A179 VanDerWaalsContact C-N 3.27Å; R177-A179 PolarHBondContact O-N 2.95Å; A179-A183 VanDerWaalsContact O-CB 3.29Å; A179-A183 WeakPolarHBondContact O-CB 3.29Å; A179-A183 PolarHBondContact O-N 3.06Å; A179-V207 HydrophobicContact CB-CG1 4.34Å; A179-A290 HydrophobicContact CB-CB 4.16Å
180	F	96.4	Very high	95.6	Very high	1 Å²	1	19.6 Å²	19.6	0%	0.004	9%	0.091	C	C	.	.	H	α-helix	trans	-74.6	-37.4	175.3	-65.8	-16.4	0	0	0	113.6	V24 F50 V175 R177 G178 L182 A183 D184 V207 L374 Y376	V24-F180 HydrophobicContact CB-CE2 4.39Å; V24-F180 HydrophobicContact CG1-CD2 4.25Å; V24-F180 HydrophobicContact CG1-CE2 3.26Å; V24-F180 HydrophobicContact CG1-CZ 3.68Å; V24-F180 HydrophobicContact CG2-CD2 4.48Å; V24-F180 HydrophobicContact CG2-CE2 4.21Å; F50-F180 HydrophobicContact CD1-CE1 4.08Å; F50-F180 AromaticContact CD1-CE2 3.94Å; F50-F180 HydrophobicContact CD1-CE2 3.94Å; F50-F180 AromaticContact CD1-CZ 3.38Å; F50-F180 HydrophobicContact CD1-CZ 3.38Å; F50-F180 HydrophobicContact CE1-CE1 4.14Å; F50-F180 AromaticContact CE1-CE2 3.7Å; F50-F180 HydrophobicContact CE1-CE2 3.7Å; F50-F180 AromaticContact CE1-CZ 3.14Å; F50-F180 HydrophobicContact CE1-CZ 3.14Å; F50-F180 HydrophobicContact CE2-CZ 4.44Å; F50-F180 HydrophobicContact CG-CZ 4.21Å; F50-F180 AromaticContact CZ-CZ 3.73Å; F50-F180 HydrophobicContact CZ-CZ 3.73Å; V175-F180 HydrophobicContact CG1-CD1 4.46Å; V175-F180 HydrophobicContact CG1-CE1 3.58Å; V175-F180 HydrophobicContact CG1-CE2 4.29Å; V175-F180 HydrophobicContact CG1-CZ 3.44Å; V175-F180 VanDerWaalsContact CG1-CZ 3.44Å; R177-F180 PolarHBondContact O-N 2.98Å; R177-F180 VanDerWaalsContact O-N 3.12Å; G178-F180 VanDerWaalsContact C-N 3.28Å; G178-F180 PolarHBondContact O-N 3.48Å; F180-L182 VanDerWaalsContact C-N 3.3Å; F180-L182 PolarHBondContact O-N 3.42Å; F180-A183 WeakPolarHBondContact O-CB 3.29Å; F180-A183 PolarHBondContact O-N 2.86Å; F180-D184 WeakPolarHBondContact O-CB 3.24Å; F180-D184 PolarHBondContact O-N 2.85Å; F180-V207 HydrophobicContact CD1-CG1 3.74Å; F180-V207 HydrophobicContact CE1-CG1 3.61Å; F180-L374 HydrophobicContact CB-CD1 4.19Å; F180-L374 HydrophobicContact CD1-CD1 3.77Å; F180-L374 HydrophobicContact CE1-CD1 4.45Å; F180-L374 HydrophobicContact CG-CD1 4.11Å; F180-Y376 HydrophobicContact CB-CD1 3.68Å; F180-Y376 HydrophobicContact CB-CD2 4.12Å; F180-Y376 HydrophobicContact CB-CE1 3.66Å; F180-Y376 HydrophobicContact CB-CE2 4.08Å; F180-Y376 HydrophobicContact CB-CG 3.96Å; F180-Y376 AromaticContact CD2-CD1 3.87Å; F180-Y376 HydrophobicContact CD2-CD1 3.87Å; F180-Y376 HydrophobicContact CD2-CD2 4.22Å; F180-Y376 AromaticContact CD2-CG 3.64Å; F180-Y376 HydrophobicContact CD2-CG 3.64Å; F180-Y376 HydrophobicContact CG-CD1 4.22Å; F180-Y376 HydrophobicContact CG-CG 4.32Å
181	L	97.9	Very high	95.8	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-59.8	-45	173.1	-175.3	72.3	0	0	0	111.3	R177 G178 D184 Y185 S322 L368 F370 Y376 R378 L382 L384	R177-L181 PolarHBondContact O-N 2.71Å; G178-L181 PolarHBondContact O-N 3.13Å; L181-D184 PolarHBondContact O-N 3.21Å; L181-Y185 PolarHBondContact O-N 2.99Å; L181-Y185 VanDerWaalsContact O-N 3.11Å; L181-S322 WeakPolarHBondContact CD2-OG 3.32Å; L181-L368 HydrophobicContact CD1-CD1 3.99Å; L181-L368 HydrophobicContact CD1-CD2 4.05Å; L181-L368 HydrophobicContact CD2-CD1 4.22Å; L181-L368 HydrophobicContact CD2-CD2 4.07Å; L181-L368 HydrophobicContact CG-CD2 4.42Å; L181-F370 HydrophobicContact CD1-CE2 4.33Å; L181-F370 HydrophobicContact CD1-CZ 3.89Å; L181-F370 HydrophobicContact CG-CZ 4.39Å; L181-Y376 VanDerWaalsContact CA-OH 3.28Å; L181-Y376 WeakPolarHBondContact CA-OH 3.31Å; L181-Y376 WeakPolarHBondContact CD1-OH 3.25Å; L181-Y376 PolarHBondContact N-OH 3.23Å; L181-R378 HydrophobicContact CD1-CG 4.1Å; L181-L382 HydrophobicContact CB-CD2 4.43Å; L181-L382 HydrophobicContact CD2-CB 3.96Å; L181-L382 HydrophobicContact CD2-CD2 4.27Å; L181-L384 HydrophobicContact CD2-CB 4.09Å
182	L	98.3	Very high	96.1	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-63.2	-44.7	175.3	-177	59.4	0	0	0	111.4	G178 F180 D184 Y185 I186 A208 M288 A290 L384	G178-L182 WeakPolarHBondContact O-CB 3.49Å; G178-L182 PolarHBondContact O-N 2.94Å; F180-L182 VanDerWaalsContact C-N 3.3Å; F180-L182 PolarHBondContact O-N 3.42Å; L182-D184 PolarHBondContact O-N 3.48Å; L182-Y185 PolarHBondContact O-N 3.33Å; L182-I186 HydrophobicContact CD1-CD1 4.42Å; L182-I186 HydrophobicContact CG-CD1 3.97Å; L182-I186 WeakPolarHBondContact O-CD1 3.29Å; L182-I186 VanDerWaalsContact O-CG1 3.25Å; L182-I186 WeakPolarHBondContact O-CG1 3.42Å; L182-I186 PolarHBondContact O-N 3.27Å; L182-A208 HydrophobicContact CD2-CB 4.05Å; L182-A208 HydrophobicContact CG-CB 4.5Å; L182-M288 HydrophobicContact CD2-CB 3.97Å; L182-M288 HydrophobicContact CD2-CG 4.22Å; L182-M288 HydrophobicContact CD2-SD 4.02Å; L182-A290 HydrophobicContact CD2-CB 4.06Å; L182-L384 HydrophobicContact CD1-CD1 4.06Å
183	A	97.8	Very high	96.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-57.8	-45.5	175.9	0	0	0	0	0	112.9	A179 F180 Y185 I186 L187 I211 L374	A179-A183 VanDerWaalsContact O-CB 3.29Å; A179-A183 WeakPolarHBondContact O-CB 3.29Å; A179-A183 PolarHBondContact O-N 3.06Å; F180-A183 WeakPolarHBondContact O-CB 3.29Å; F180-A183 PolarHBondContact O-N 2.86Å; A183-Y185 VanDerWaalsContact C-N 3.3Å; A183-Y185 PolarHBondContact O-N 2.85Å; A183-I186 WeakPolarHBondContact O-CB 3.42Å; A183-I186 PolarHBondContact O-N 3.39Å; A183-L187 WeakPolarHBondContact O-CG 3.28Å; A183-L187 PolarHBondContact O-N 2.97Å; A183-I211 HydrophobicContact CB-CB 4.07Å; A183-I211 HydrophobicContact CB-CG1 3.84Å; A183-I211 HydrophobicContact CB-CG2 3.93Å; A183-L374 HydrophobicContact CB-CD1 3.62Å
184	D	97.4	Very high	96.4	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.6	-42.4	175.7	-82.4	-13.8	0	0	0	111.5	F180 L181 L182 L187 F188 F370 Q372 F373 L374 Y376 R378	F180-D184 WeakPolarHBondContact O-CB 3.24Å; F180-D184 PolarHBondContact O-N 2.85Å; L181-D184 PolarHBondContact O-N 3.21Å; L182-D184 PolarHBondContact O-N 3.48Å; D184-L187 PolarHBondContact O-N 3.47Å; D184-F188 WeakPolarHBondContact O-CB 3.24Å; D184-F188 PolarHBondContact O-N 2.9Å; D184-F370 HydrophobicContact CB-CD2 4.14Å; D184-F370 HydrophobicContact CB-CE2 3.67Å; D184-Q372 WeakPolarHBondContact OD2-CA 3.26Å; D184-Q372 WeakPolarHBondContact OD2-CG 3.34Å; D184-F373 HydrophobicContact CB-CD2 4.37Å; D184-F373 WeakPolarHBondContact OD1-CA 3.42Å; D184-F373 WeakPolarHBondContact OD1-CB 3.49Å; D184-F373 PolarHBondContact OD1-N 3.23Å; D184-L374 PolarHBondContact OD1-N 2.99Å; D184-L374 VanDerWaalsContact OD1-N 3.11Å; D184-Y376 VanDerWaalsContact OD2-CE1 3.27Å; D184-Y376 WeakPolarHBondContact OD2-CE1 3.26Å; D184-Y376 PolarHBondContact OD2-OH 2.96Å; D184-R378 IonicContact OD2-CZ 3.13Å; D184-R378 IonicContact OD2-NH2 2.66Å; D184-R378 PolarHBondContact OD2-NH2 3.25Å
185	Y	98.2	Very high	96.3	Very high	21 Å²	21	36.5 Å²	36.5	8%	0.082	18%	0.176	C	C	.	.	H	α-helix	trans	-65.6	-40.2	177.7	-176.4	-104.7	0	0	0	112.3	L181 L182 A183 F188 K189 F193 Y320 I366 F370 L384	L181-Y185 PolarHBondContact O-N 2.99Å; L181-Y185 VanDerWaalsContact O-N 3.11Å; L182-Y185 PolarHBondContact O-N 3.33Å; A183-Y185 VanDerWaalsContact C-N 3.3Å; A183-Y185 PolarHBondContact O-N 2.85Å; Y185-F188 PolarHBondContact O-N 2.89Å; Y185-K189 HydrophobicContact CD2-CG 4.29Å; Y185-K189 HydrophobicContact CE1-CG 4.26Å; Y185-K189 HydrophobicContact CE2-CG 3.75Å; Y185-K189 PolarHBondContact O-N 3.37Å; Y185-F193 HydrophobicContact CD1-CE2 4.24Å; Y185-F193 HydrophobicContact CD1-CZ 4.13Å; Y185-F193 HydrophobicContact CE1-CE2 4.2Å; Y185-F193 AromaticContact CE1-CZ 3.91Å; Y185-F193 HydrophobicContact CE1-CZ 3.91Å; Y185-Y320 HydrophobicContact CD1-CD1 4.39Å; Y185-Y320 HydrophobicContact CD1-CE1 4.39Å; Y185-Y320 AromaticContact CE1-CD1 3.84Å; Y185-Y320 HydrophobicContact CE1-CD1 3.84Å; Y185-Y320 AromaticContact CE1-CE1 3.45Å; Y185-Y320 HydrophobicContact CE1-CE1 3.45Å; Y185-Y320 VanDerWaalsContact CE1-CE1 3.45Å; Y185-I366 HydrophobicContact CD2-CG2 4.26Å; Y185-I366 HydrophobicContact CE1-CD1 4.07Å; Y185-I366 HydrophobicContact CE2-CD1 4.16Å; Y185-I366 HydrophobicContact CE2-CG2 3.79Å; Y185-F370 AromaticContact CD2-CD1 3.97Å; Y185-F370 HydrophobicContact CD2-CD1 3.97Å; Y185-F370 AromaticContact CD2-CE1 3.77Å; Y185-F370 HydrophobicContact CD2-CE1 3.77Å; Y185-F370 HydrophobicContact CD2-CG 4.47Å; Y185-F370 HydrophobicContact CD2-CZ 4.15Å; Y185-F370 HydrophobicContact CG-CZ 4.47Å; Y185-L384 HydrophobicContact CD1-CD2 3.84Å; Y185-L384 HydrophobicContact CD2-CD2 3.6Å; Y185-L384 HydrophobicContact CE1-CD2 4.39Å; Y185-L384 HydrophobicContact CE2-CD2 4.19Å; Y185-L384 HydrophobicContact CG-CD2 3.41Å; Y185-L384 VanDerWaalsContact CG-CD2 3.41Å
186	I	98	Very high	96.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.9	-48.2	174.6	-67.9	161.4	0	0	0	110.6	L182 A183 F188 K189 R190 F193 I211 M212 V215 M288	L182-I186 HydrophobicContact CD1-CD1 4.42Å; L182-I186 HydrophobicContact CG-CD1 3.97Å; L182-I186 WeakPolarHBondContact O-CD1 3.29Å; L182-I186 VanDerWaalsContact O-CG1 3.25Å; L182-I186 WeakPolarHBondContact O-CG1 3.42Å; L182-I186 PolarHBondContact O-N 3.27Å; A183-I186 WeakPolarHBondContact O-CB 3.42Å; A183-I186 PolarHBondContact O-N 3.39Å; I186-F188 VanDerWaalsContact C-N 3.3Å; I186-F188 PolarHBondContact O-N 2.8Å; I186-K189 CarbonylContact O-C 3.56Å; I186-K189 PolarHBondContact O-N 3.12Å; I186-R190 PolarHBondContact O-N 2.78Å; I186-F193 HydrophobicContact CB-CD2 4.43Å; I186-F193 HydrophobicContact CB-CE2 4.39Å; I186-F193 HydrophobicContact CG1-CD2 4.48Å; I186-F193 HydrophobicContact CG1-CE2 4.19Å; I186-F193 HydrophobicContact CG1-CZ 4.48Å; I186-F193 HydrophobicContact CG2-CD2 4.22Å; I186-I211 HydrophobicContact CB-CG2 4.26Å; I186-I211 HydrophobicContact CG2-CG2 4.09Å; I186-M212 HydrophobicContact CD1-CB 4.19Å; I186-M212 HydrophobicContact CD1-CE 3.6Å; I186-M212 HydrophobicContact CD1-SD 4.46Å; I186-M212 HydrophobicContact CG1-CE 3.61Å; I186-M212 HydrophobicContact CG1-SD 4.46Å; I186-M212 HydrophobicContact CG2-CE 4.25Å; I186-M212 HydrophobicContact CG2-SD 4Å; I186-V215 HydrophobicContact CG2-CG2 4.29Å; I186-M288 HydrophobicContact CD1-SD 4.05Å
187	L	96.3	Very high	96.7	Very high	7 Å²	7	36.2 Å²	36.2	4%	0.037	18%	0.178	C	C	.	.	H	α-helix	trans	-69.7	-25.7	178.5	-67.6	176.7	0	0	0	113.1	L52 W54 A183 D184 R190 I211 F373	L52-L187 HydrophobicContact CD2-CD1 3.9Å; W54-L187 HydrophobicContact CH2-CD1 4.35Å; W54-L187 HydrophobicContact CH2-CD2 3.98Å; W54-L187 HydrophobicContact CZ3-CD1 4.23Å; W54-L187 HydrophobicContact CZ3-CD2 4.06Å; A183-L187 WeakPolarHBondContact O-CG 3.28Å; A183-L187 PolarHBondContact O-N 2.97Å; D184-L187 PolarHBondContact O-N 3.47Å; L187-R190 WeakPolarHBondContact O-CD 3.22Å; L187-R190 WeakPolarHBondContact O-CG 3.34Å; L187-I211 HydrophobicContact CD1-CG2 4.09Å; L187-I211 HydrophobicContact CD2-CG2 3.94Å; L187-I211 HydrophobicContact CG-CG2 3.69Å; L187-F373 HydrophobicContact CB-CD1 4.24Å; L187-F373 HydrophobicContact CB-CD2 3.65Å; L187-F373 HydrophobicContact CB-CE1 4.36Å; L187-F373 HydrophobicContact CB-CE2 3.78Å; L187-F373 HydrophobicContact CB-CG 3.88Å; L187-F373 HydrophobicContact CB-CZ 4.14Å; L187-F373 HydrophobicContact CD1-CB 3.64Å; L187-F373 HydrophobicContact CD1-CD1 4.37Å; L187-F373 HydrophobicContact CD1-CD2 4.32Å; L187-F373 HydrophobicContact CD1-CG 3.87Å
188	F	96.9	Very high	96.9	Very high	78 Å²	78	35 Å²	35	34%	0.342	17%	0.173	S	C	.	.	H	α-helix	trans	-75.9	-37.1	172.5	-176.6	-115.7	0	0	0	112.6	D184 Y185 I186 F370 F373	D184-F188 WeakPolarHBondContact O-CB 3.24Å; D184-F188 PolarHBondContact O-N 2.9Å; Y185-F188 PolarHBondContact O-N 2.89Å; I186-F188 VanDerWaalsContact C-N 3.3Å; I186-F188 PolarHBondContact O-N 2.8Å; F188-F370 HydrophobicContact CB-CB 4.06Å; F188-F370 HydrophobicContact CB-CD2 4.46Å; F188-F370 HydrophobicContact CB-CG 4.49Å; F188-F370 HydrophobicContact CD1-CB 3.36Å; F188-F370 HydrophobicContact CD1-CG 4.18Å; F188-F370 HydrophobicContact CD2-CB 3.83Å; F188-F370 HydrophobicContact CE1-CB 3.6Å; F188-F370 HydrophobicContact CE2-CB 4.05Å; F188-F370 HydrophobicContact CG-CB 3.48Å; F188-F370 VanDerWaalsContact CG-CB 3.48Å; F188-F370 HydrophobicContact CG-CG 4.35Å; F188-F370 HydrophobicContact CZ-CB 3.94Å; F188-F373 HydrophobicContact CB-CE2 4.06Å
189	K	96.6	Very high	97	Very high	82 Å²	82	35 Å²	35	36%	0.357	17%	0.173	S	C	.	.	S	Bend	trans	-108.7	37.9	-176.2	-65.3	-59.2	-168.2	-176.8	0	113.1	Y185 I186 D191 V192 F193	Y185-K189 HydrophobicContact CD2-CG 4.29Å; Y185-K189 HydrophobicContact CE1-CG 4.26Å; Y185-K189 HydrophobicContact CE2-CG 3.75Å; Y185-K189 PolarHBondContact O-N 3.37Å; I186-K189 CarbonylContact O-C 3.56Å; I186-K189 PolarHBondContact O-N 3.12Å; K189-D191 PolarHBondContact O-N 2.96Å; K189-V192 HydrophobicContact CB-CB 4.27Å; K189-V192 HydrophobicContact CB-CG2 4.07Å; K189-V192 WeakPolarHBondContact O-CB 3.29Å; K189-V192 PolarHBondContact O-N 2.84Å; K189-F193 HydrophobicContact CB-CD2 4.3Å; K189-F193 HydrophobicContact CB-CE2 3.84Å; K189-F193 VanDerWaalsContact O-CD2 3.29Å; K189-F193 WeakPolarHBondContact O-CD2 3.49Å
190	R	95.3	Very high	97.1	Very high	84 Å²	84	34.5 Å²	34.5	32%	0.317	17%	0.169	S	C	.	.	H	α-helix	trans	-51.5	-39.9	-173.5	-61.5	179.2	75.7	145.2	4.4	113.8	I186 L187 V192 F193 R194 V215	I186-R190 PolarHBondContact O-N 2.78Å; L187-R190 WeakPolarHBondContact O-CD 3.22Å; L187-R190 WeakPolarHBondContact O-CG 3.34Å; R190-V192 PolarHBondContact O-N 2.81Å; R190-F193 PolarHBondContact O-N 3.39Å; R190-R194 PolarHBondContact O-N 2.9Å; R190-V215 HydrophobicContact CB-CG1 3.91Å; R190-V215 HydrophobicContact CB-CG2 4.39Å; R190-V215 HydrophobicContact CG-CG1 4.43Å; R190-V215 HydrophobicContact CG-CG2 4.05Å; R190-V215 WeakPolarHBondContact O-CG1 3.24Å
191	D	95.5	Very high	97.2	Very high	106 Å²	106	34.4 Å²	34.4	57%	0.567	17%	0.169	S	C	*	.	H	α-helix	trans	-65.1	-27.8	-179.5	-67.6	-42.3	0	0	0	113.4	K189 R194	K189-D191 PolarHBondContact O-N 2.96Å; D191-R194 IonicContact OD1-CZ 3.02Å; D191-R194 IonicContact OD1-NH1 3.32Å; D191-R194 PolarHBondContact OD1-NH1 2.95Å; D191-R194 IonicContact OD1-NH2 2.68Å
192	V	96.4	Very high	97.2	Very high	79 Å²	79	35 Å²	35	48%	0.479	17%	0.174	S	C	.	.	H	α-helix	trans	-69.5	-37	176.5	177.8	0	0	0	0	110.9	K189 R190	K189-V192 HydrophobicContact CB-CB 4.27Å; K189-V192 HydrophobicContact CB-CG2 4.07Å; K189-V192 WeakPolarHBondContact O-CB 3.29Å; K189-V192 PolarHBondContact O-N 2.84Å; R190-V192 PolarHBondContact O-N 2.81Å
193	F	97.4	Very high	97.2	Very high	1 Å²	1	35.3 Å²	35.3	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-93.2	-8.4	-175.1	-59.1	-66.8	0	0	0	113.4	Y185 I186 K189 R190 S195 C196 M212 V215 A216 V286 Y320	Y185-F193 HydrophobicContact CD1-CE2 4.24Å; Y185-F193 HydrophobicContact CD1-CZ 4.13Å; Y185-F193 HydrophobicContact CE1-CE2 4.2Å; Y185-F193 AromaticContact CE1-CZ 3.91Å; Y185-F193 HydrophobicContact CE1-CZ 3.91Å; I186-F193 HydrophobicContact CB-CD2 4.43Å; I186-F193 HydrophobicContact CB-CE2 4.39Å; I186-F193 HydrophobicContact CG1-CD2 4.48Å; I186-F193 HydrophobicContact CG1-CE2 4.19Å; I186-F193 HydrophobicContact CG1-CZ 4.48Å; I186-F193 HydrophobicContact CG2-CD2 4.22Å; K189-F193 HydrophobicContact CB-CD2 4.3Å; K189-F193 HydrophobicContact CB-CE2 3.84Å; K189-F193 VanDerWaalsContact O-CD2 3.29Å; K189-F193 WeakPolarHBondContact O-CD2 3.49Å; R190-F193 PolarHBondContact O-N 3.39Å; F193-S195 PolarHBondContact O-N 3.03Å; F193-C196 WeakPolarHBondContact O-CB 3.3Å; F193-C196 PolarHBondContact O-N 3.44Å; F193-M212 HydrophobicContact CB-CE 4.49Å; F193-M212 HydrophobicContact CB-SD 3.85Å; F193-M212 HydrophobicContact CD1-CE 3.65Å; F193-M212 HydrophobicContact CD1-SD 4.08Å; F193-M212 HydrophobicContact CE1-CE 3.93Å; F193-M212 HydrophobicContact CG-CE 4.01Å; F193-M212 HydrophobicContact CG-SD 4Å; F193-V215 HydrophobicContact CB-CG1 3.91Å; F193-A216 WeakPolarHBondContact O-CA 3.39Å; F193-V286 HydrophobicContact CD1-CG1 4.27Å; F193-V286 HydrophobicContact CD1-CG2 4.21Å; F193-V286 HydrophobicContact CE1-CG1 4.01Å; F193-V286 HydrophobicContact CE1-CG2 4.42Å; F193-Y320 HydrophobicContact CE1-CD2 4.05Å; F193-Y320 AromaticContact CE1-CE2 3.51Å; F193-Y320 HydrophobicContact CE1-CE2 3.51Å; F193-Y320 AromaticContact CE1-CZ 3.98Å; F193-Y320 HydrophobicContact CZ-CD2 4.34Å; F193-Y320 HydrophobicContact CZ-CE1 4.45Å; F193-Y320 AromaticContact CZ-CE2 3.85Å; F193-Y320 HydrophobicContact CZ-CE2 3.85Å; F193-Y320 AromaticContact CZ-CZ 3.9Å
194	R	95.6	Very high	97.1	Very high	148 Å²	148	35.7 Å²	35.7	56%	0.558	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	131.1	-178.5	-175.4	178.4	-79.5	138.1	0.5	110.1	R190 D191 C196	R190-R194 PolarHBondContact O-N 2.9Å; D191-R194 IonicContact OD1-CZ 3.02Å; D191-R194 IonicContact OD1-NH1 3.32Å; D191-R194 PolarHBondContact OD1-NH1 2.95Å; D191-R194 IonicContact OD1-NH2 2.68Å; R194-C196 PolarHBondContact O-N 2.84Å
195	S	92.4	Very high	97.1	Very high	86 Å²	86	36 Å²	36	60%	0.601	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.5	7	178.7	-53	0	0	0	0	116	F193	F193-S195 PolarHBondContact O-N 3.03Å
196	C	96.9	Very high	97.1	Very high	18 Å²	18	35 Å²	35	12%	0.122	18%	0.18	C	C	.	.			trans	-70.2	151.7	174.9	-69.3	0	0	0	0	111.8	F193 R194 V198 K217 R218 V286	F193-C196 WeakPolarHBondContact O-CB 3.3Å; F193-C196 PolarHBondContact O-N 3.44Å; R194-C196 PolarHBondContact O-N 2.84Å; C196-V198 HydrophobicContact CB-CG2 4.02Å; C196-K217 PolarHBondContact O-N 2.84Å; C196-R218 PolarHBondContact O-N 3.3Å; C196-V286 HydrophobicContact CB-CG2 4.2Å
197	T	98.4	Very high	97.1	Very high	9 Å²	9	35.2 Å²	35.2	6%	0.055	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	126.1	155	-61.2	0	0	0	0	107.5	R218 Y220 H283 C284 T285 V286	T197-R218 CarbonylContact C-O 3.52Å; T197-R218 WeakPolarHBondContact CA-O 3.49Å; T197-R218 HydrophobicContact CG2-CB 4.43Å; T197-Y220 HydrophobicContact CG2-CD2 4.12Å; T197-Y220 HydrophobicContact CG2-CE2 3.9Å; T197-H283 WeakPolarHBondContact CB-O 3.35Å; T197-C284 WeakPolarHBondContact O-CA 3.01Å; T197-T285 PolarHBondContact O-N 3.15Å; T197-T285 VanDerWaalsContact O-N 3.11Å; T197-V286 PolarHBondContact O-N 3.47Å
198	V	98.8	Very high	97.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	141.2	-173	-171.8	0	0	0	0	110	C196 M212 A216 R218 V219 Y220 V286 M288	C196-V198 HydrophobicContact CB-CG2 4.02Å; V198-M212 HydrophobicContact CB-CG 4.14Å; V198-M212 HydrophobicContact CG1-CE 4.14Å; V198-M212 HydrophobicContact CG1-CG 4.1Å; V198-M212 HydrophobicContact CG2-CE 4.3Å; V198-M212 HydrophobicContact CG2-CG 3.82Å; V198-M212 HydrophobicContact CG2-SD 3.9Å; V198-A216 HydrophobicContact CG2-CB 3.74Å; V198-R218 PolarHBondContact N-O 2.91Å; V198-V219 HydrophobicContact CB-CG1 4.34Å; V198-V219 HydrophobicContact CB-CG2 4.34Å; V198-V219 CarbonylContact O-C 3.54Å; V198-V219 WeakPolarHBondContact O-CA 3.41Å; V198-Y220 PolarHBondContact O-N 3.23Å; V198-V286 CarbonylContact C-O 3.54Å; V198-V286 VanDerWaalsContact CA-O 3.28Å; V198-V286 WeakPolarHBondContact CA-O 3.44Å; V198-V286 HydrophobicContact CG1-CB 4.19Å; V198-V286 HydrophobicContact CG1-CG1 4.02Å; V198-V286 HydrophobicContact CG2-CB 4.1Å; V198-M288 HydrophobicContact CG1-CE 4.2Å; V198-M288 HydrophobicContact CG1-CG 4.12Å; V198-M288 HydrophobicContact CG1-SD 4.05Å
199	L	98.9	Very high	97.3	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.1	166.9	177.2	68.2	0	0	0	109.5	L201 T222 W272 L280 V286 I287 M288 I309	L199-L201 HydrophobicContact CD2-CD2 3.89Å; L199-L201 HydrophobicContact CG-CD2 4.14Å; L199-T222 HydrophobicContact CD1-CG2 3.56Å; L199-W272 HydrophobicContact CD1-CH2 4.18Å; L199-L280 HydrophobicContact CB-CD1 3.96Å; L199-L280 HydrophobicContact CD1-CD1 4.22Å; L199-L280 HydrophobicContact CD2-CD1 4.35Å; L199-L280 HydrophobicContact CD2-CD2 4.4Å; L199-L280 HydrophobicContact CG-CD1 4.42Å; L199-V286 PolarHBondContact N-O 3.23Å; L199-I287 HydrophobicContact CB-CG1 4.33Å; L199-I287 CarbonylContact O-C 3.5Å; L199-I287 VanDerWaalsContact O-CA 3.25Å; L199-I287 WeakPolarHBondContact O-CA 3.4Å; L199-M288 PolarHBondContact O-N 3.36Å; L199-I309 HydrophobicContact CD2-CD1 3.62Å; L199-I309 HydrophobicContact CD2-CG2 4.1Å
200	E	98.9	Very high	97.4	Very high	3 Å²	3	27.3 Å²	27.3	1%	0.014	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	126.7	168.5	-170.3	169.3	-152.2	0	0	110	G203 A208 S209 Y220 T222 M288	E200-G203 VanDerWaalsContact CD-CA 3.48Å; E200-A208 WeakPolarHBondContact OE1-CB 3.49Å; E200-S209 WeakPolarHBondContact OE2-CB 3.36Å; E200-S209 PolarHBondContact OE2-N 2.72Å; E200-S209 VanDerWaalsContact OE2-N 3.15Å; E200-S209 PolarHBondContact OE2-OG 2.47Å; E200-Y220 PolarHBondContact N-O 3.18Å; E200-T222 WeakPolarHBondContact O-CB 3.42Å; E200-T222 PolarHBondContact O-N 2.95Å; E200-T222 VanDerWaalsContact O-N 3.09Å; E200-T222 PolarHBondContact O-OG1 3.39Å; E200-M288 CarbonylContact C-O 3.58Å; E200-M288 VanDerWaalsContact CA-O 3.29Å; E200-M288 WeakPolarHBondContact CA-O 3.44Å; E200-M288 HydrophobicContact CB-CE 3.85Å; E200-M288 HydrophobicContact CB-CG 4.04Å; E200-M288 HydrophobicContact CG-CE 4.04Å; E200-M288 HydrophobicContact CG-CG 4.01Å
201	L	98.8	Very high	97.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	120.8	172.5	-57.3	175.7	0	0	0	108.3	L199 L255 W257 I287 M288 A289 M302 L306 I309	L199-L201 HydrophobicContact CD2-CD2 3.89Å; L199-L201 HydrophobicContact CG-CD2 4.14Å; L201-L255 HydrophobicContact CD2-CD2 3.48Å; L201-L255 VanDerWaalsContact CD2-CD2 3.48Å; L201-W257 HydrophobicContact CB-CZ2 3.96Å; L201-I287 HydrophobicContact CD1-CG2 3.87Å; L201-I287 HydrophobicContact CG-CG2 4.01Å; L201-M288 PolarHBondContact N-O 2.96Å; L201-A289 HydrophobicContact CB-CB 4.19Å; L201-A289 WeakPolarHBondContact O-CB 3.08Å; L201-M302 HydrophobicContact CD1-CG 4.19Å; L201-M302 HydrophobicContact CD1-SD 3.64Å; L201-L306 HydrophobicContact CD1-CD1 4.34Å; L201-I309 HydrophobicContact CD2-CD1 4.44Å
202	G	98.3	Very high	97.6	Very high	12 Å²	12	18.3 Å²	18.3	12%	0.124	11%	0.105	C	C	.	.	S	Bend	trans	69.9	53.1	178.4	0	0	0	0	0	111.5	G204 T222 D223	G202-G204 PolarHBondContact O-N 2.84Å; G202-T222 CarbonylContact C-O 3.55Å; G202-T222 WeakPolarHBondContact CA-O 3.4Å; G202-T222 PolarHBondContact N-O 2.86Å; G202-D223 VanDerWaalsContact C-OD2 3.22Å; G202-D223 WeakPolarHBondContact CA-OD2 3.33Å
203	G	97.6	Very high	97.7	Very high	8 Å²	8	14.6 Å²	14.6	8%	0.082	8%	0.082	C	C	.	.			trans	-70.9	-14.4	-174.8	0	0	0	0	0	114.4	E200 T205 G206 T222 D223	E200-G203 VanDerWaalsContact CD-CA 3.48Å; G203-T205 PolarHBondContact O-N 3.15Å; G203-G206 WeakPolarHBondContact O-CA 3.35Å; G203-G206 PolarHBondContact O-N 3.47Å; G203-T222 PolarHBondContact N-O 3.26Å; G203-D223 PolarHBondContact N-OD2 2.78Å
204	G	97.6	Very high	97.6	Very high	8 Å²	8	15 Å²	15	8%	0.082	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	-121.3	179.3	0	0	0	0	0	112	G172 G202 G206 D223 C232	G172-G204 CarbonylContact O-C 3.6Å; G172-G204 WeakPolarHBondContact O-CA 3.03Å; G202-G204 PolarHBondContact O-N 2.84Å; G204-G206 PolarHBondContact O-N 2.96Å; G204-G206 VanDerWaalsContact O-N 3.14Å; G204-D223 WeakPolarHBondContact CA-OD2 3.34Å; G204-D223 PolarHBondContact N-OD2 3.15Å; G204-C232 WeakPolarHBondContact O-CB 3.35Å
205	T	97.3	Very high	97.7	Very high	5 Å²	5	8.6 Å²	8.6	3%	0.031	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-12	176.3	55.5	0	0	0	0	114.8	I160 H162 G172 K173 Q174 V175 G203 V207 M231 N235	I160-T205 HydrophobicContact CG2-CG2 4.41Å; H162-T205 HydrophobicContact CB-CG2 3.8Å; G172-T205 PolarHBondContact O-N 2.98Å; K173-T205 WeakPolarHBondContact O-CG2 3.5Å; Q174-T205 WeakPolarHBondContact O-CG2 3.24Å; V175-T205 HydrophobicContact CG2-CG2 4.08Å; G203-T205 PolarHBondContact O-N 3.15Å; T205-V207 WeakPolarHBondContact OG1-CG2 3.3Å; T205-M231 HydrophobicContact CG2-SD 4.38Å; T205-N235 WeakPolarHBondContact O-CB 3.45Å; T205-N235 PolarHBondContact O-ND2 2.93Å
206	G	98.1	Very high	97.9	Very high	0 Å²	0	4.5 Å²	4.5	0%	0	3%	0.033	C	C	.	.	S	Bend	trans	86	8.3	177.8	0	0	0	0	0	114.8	G203 G204 A208 S209 I210 C232	G203-G206 WeakPolarHBondContact O-CA 3.35Å; G203-G206 PolarHBondContact O-N 3.47Å; G204-G206 PolarHBondContact O-N 2.96Å; G204-G206 VanDerWaalsContact O-N 3.14Å; G206-A208 PolarHBondContact O-N 3.01Å; G206-S209 CarbonylContact O-C 3.46Å; G206-S209 WeakPolarHBondContact O-CB 3.42Å; G206-S209 PolarHBondContact O-N 3.38Å; G206-I210 WeakPolarHBondContact O-CD1 3.28Å; G206-I210 VanDerWaalsContact O-CG1 3.27Å; G206-I210 WeakPolarHBondContact O-CG1 3.22Å; G206-I210 PolarHBondContact O-N 3.45Å; G206-C232 VanDerWaalsContact CA-SG 3.59Å
207	V	97.4	Very high	98	Very high	5 Å²	5	9.6 Å²	9.6	3%	0.03	5%	0.053	C	C	.	.	H	α-helix	trans	-51.7	-53.9	-177.2	165	0	0	0	0	112.5	I160 V175 A179 F180 T205 I210 I211	I160-V207 HydrophobicContact CD1-CG2 3.62Å; I160-V207 HydrophobicContact CG1-CG2 3.75Å; I160-V207 HydrophobicContact CG2-CG2 4.07Å; V175-V207 HydrophobicContact CG1-CG2 4.16Å; V175-V207 HydrophobicContact CG2-CG2 4.22Å; A179-V207 HydrophobicContact CB-CG1 4.34Å; F180-V207 HydrophobicContact CD1-CG1 3.74Å; F180-V207 HydrophobicContact CE1-CG1 3.61Å; T205-V207 WeakPolarHBondContact OG1-CG2 3.3Å; V207-I210 PolarHBondContact O-N 2.83Å; V207-I211 WeakPolarHBondContact O-CG1 3.49Å; V207-I211 PolarHBondContact O-N 3.48Å; V207-I211 VanDerWaalsContact O-N 3.16Å
208	A	98.3	Very high	98	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.008	6%	0.06	C	C	.	.	H	α-helix	trans	-70.4	-36.7	-177.3	0	0	0	0	0	111.1	L182 E200 G206 I210 I211 M212 M288	L182-A208 HydrophobicContact CD2-CB 4.05Å; L182-A208 HydrophobicContact CG-CB 4.5Å; E200-A208 WeakPolarHBondContact OE1-CB 3.49Å; G206-A208 PolarHBondContact O-N 3.01Å; A208-I210 PolarHBondContact O-N 2.73Å; A208-I211 PolarHBondContact O-N 2.83Å; A208-M212 VanDerWaalsContact O-CB 3.29Å; A208-M212 WeakPolarHBondContact O-CB 3.39Å; A208-M212 PolarHBondContact O-N 2.94Å; A208-M288 HydrophobicContact CB-CE 4.45Å
209	S	98.6	Very high	98	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-56	-45	168.5	-92.1	0	0	0	0	113.9	E200 G206 I211 M212 G213 V219 C221 I250	E200-S209 WeakPolarHBondContact OE2-CB 3.36Å; E200-S209 PolarHBondContact OE2-N 2.72Å; E200-S209 VanDerWaalsContact OE2-N 3.15Å; E200-S209 PolarHBondContact OE2-OG 2.47Å; G206-S209 CarbonylContact O-C 3.46Å; G206-S209 WeakPolarHBondContact O-CB 3.42Å; G206-S209 PolarHBondContact O-N 3.38Å; S209-I211 PolarHBondContact O-N 3.36Å; S209-M212 PolarHBondContact O-N 3.42Å; S209-G213 PolarHBondContact O-N 3.12Å; S209-V219 VanDerWaalsContact OG-CG1 3.3Å; S209-V219 WeakPolarHBondContact OG-CG1 3.4Å; S209-C221 WeakPolarHBondContact OG-CB 3.24Å; S209-C221 PolarHBondContact OG-SG 3.12Å; S209-I250 WeakPolarHBondContact O-CD1 3.22Å
210	I	98.5	Very high	98	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.9	-46.9	178.8	-71.9	157.4	0	0	0	110.2	V158 I160 G206 V207 A208 G213 M214 N235 V236 N239 I250	V158-I210 HydrophobicContact CG1-CG2 4.02Å; I160-I210 HydrophobicContact CD1-CD1 3.58Å; G206-I210 WeakPolarHBondContact O-CD1 3.28Å; G206-I210 VanDerWaalsContact O-CG1 3.27Å; G206-I210 WeakPolarHBondContact O-CG1 3.22Å; G206-I210 PolarHBondContact O-N 3.45Å; V207-I210 PolarHBondContact O-N 2.83Å; A208-I210 PolarHBondContact O-N 2.73Å; I210-G213 PolarHBondContact O-N 3.3Å; I210-M214 PolarHBondContact O-N 2.75Å; I210-N235 HydrophobicContact CD1-CB 3.97Å; I210-V236 HydrophobicContact CG1-CG2 4.23Å; I210-N239 HydrophobicContact CG1-CB 4.47Å; I210-N239 HydrophobicContact CG2-CB 3.57Å; I210-I250 HydrophobicContact CG1-CD1 4.39Å
211	I	97.9	Very high	98	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.005	6%	0.06	C	C	.	.	H	α-helix	trans	-64.5	-42.4	177.1	-63.2	-64.5	0	0	0	111.3	L52 V158 A183 I186 L187 V207 A208 S209 G213 M214	L52-I211 HydrophobicContact CD2-CD1 3.89Å; V158-I211 HydrophobicContact CG2-CD1 3.82Å; A183-I211 HydrophobicContact CB-CB 4.07Å; A183-I211 HydrophobicContact CB-CG1 3.84Å; A183-I211 HydrophobicContact CB-CG2 3.93Å; I186-I211 HydrophobicContact CB-CG2 4.26Å; I186-I211 HydrophobicContact CG2-CG2 4.09Å; L187-I211 HydrophobicContact CD1-CG2 4.09Å; L187-I211 HydrophobicContact CD2-CG2 3.94Å; L187-I211 HydrophobicContact CG-CG2 3.69Å; V207-I211 WeakPolarHBondContact O-CG1 3.49Å; V207-I211 PolarHBondContact O-N 3.48Å; V207-I211 VanDerWaalsContact O-N 3.16Å; A208-I211 PolarHBondContact O-N 2.83Å; S209-I211 PolarHBondContact O-N 3.36Å; I211-G213 VanDerWaalsContact C-N 3.3Å; I211-G213 PolarHBondContact O-N 3.14Å; I211-M214 HydrophobicContact CD1-SD 3.96Å; I211-M214 WeakPolarHBondContact O-CB 3.22Å; I211-M214 PolarHBondContact O-N 3.39Å
212	M	98.4	Very high	98	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.005	6%	0.06	C	C	.	.	H	α-helix	trans	-61.4	-39.4	174.6	-175.1	60.2	83.2	0	0	111.7	I186 F193 V198 A208 S209 M214 V215 A216 V219 M288	I186-M212 HydrophobicContact CD1-CB 4.19Å; I186-M212 HydrophobicContact CD1-CE 3.6Å; I186-M212 HydrophobicContact CD1-SD 4.46Å; I186-M212 HydrophobicContact CG1-CE 3.61Å; I186-M212 HydrophobicContact CG1-SD 4.46Å; I186-M212 HydrophobicContact CG2-CE 4.25Å; I186-M212 HydrophobicContact CG2-SD 4Å; F193-M212 HydrophobicContact CB-CE 4.49Å; F193-M212 HydrophobicContact CB-SD 3.85Å; F193-M212 HydrophobicContact CD1-CE 3.65Å; F193-M212 HydrophobicContact CD1-SD 4.08Å; F193-M212 HydrophobicContact CE1-CE 3.93Å; F193-M212 HydrophobicContact CG-CE 4.01Å; F193-M212 HydrophobicContact CG-SD 4Å; V198-M212 HydrophobicContact CB-CG 4.14Å; V198-M212 HydrophobicContact CG1-CE 4.14Å; V198-M212 HydrophobicContact CG1-CG 4.1Å; V198-M212 HydrophobicContact CG2-CE 4.3Å; V198-M212 HydrophobicContact CG2-CG 3.82Å; V198-M212 HydrophobicContact CG2-SD 3.9Å; A208-M212 VanDerWaalsContact O-CB 3.29Å; A208-M212 WeakPolarHBondContact O-CB 3.39Å; A208-M212 PolarHBondContact O-N 2.94Å; S209-M212 PolarHBondContact O-N 3.42Å; M212-M214 PolarHBondContact O-N 2.75Å; M212-V215 PolarHBondContact O-N 2.79Å; M212-A216 HydrophobicContact CG-CB 3.88Å; M212-A216 WeakPolarHBondContact O-CB 3.42Å; M212-A216 PolarHBondContact O-N 3.16Å; M212-A216 HydrophobicContact SD-CB 3.93Å; M212-V219 HydrophobicContact CB-CG2 4.01Å; M212-V219 HydrophobicContact CG-CG2 3.61Å; M212-M288 HydrophobicContact CB-CE 3.7Å; M212-M288 HydrophobicContact CB-SD 4.36Å; M212-M288 HydrophobicContact CE-CE 4.39Å; M212-M288 HydrophobicContact CE-SD 3.53Å; M212-M288 VanDerWaalsContact CE-SD 3.53Å; M212-M288 HydrophobicContact CG-CE 4.03Å; M212-M288 HydrophobicContact CG-SD 4.38Å
213	G	97.8	Very high	98	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-63.6	-19.6	177.1	0	0	0	0	0	114.1	S209 I210 I211 V215 G248	S209-G213 PolarHBondContact O-N 3.12Å; I210-G213 PolarHBondContact O-N 3.3Å; I211-G213 VanDerWaalsContact C-N 3.3Å; I211-G213 PolarHBondContact O-N 3.14Å; G213-V215 PolarHBondContact O-N 2.92Å; G213-G248 WeakPolarHBondContact O-CA 3.42Å
214	M	96.1	Very high	97.9	Very high	10 Å²	10	15 Å²	15	5%	0.049	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-8.8	171.3	-57.3	173.6	66	0	0	113.3	L52 W54 I210 I211 M212 L242	L52-M214 HydrophobicContact CD1-CE 3.74Å; L52-M214 HydrophobicContact CD1-SD 4.03Å; W54-M214 HydrophobicContact CH2-CE 4.01Å; W54-M214 HydrophobicContact CZ2-CE 4.05Å; I210-M214 PolarHBondContact O-N 2.75Å; I211-M214 HydrophobicContact CD1-SD 3.96Å; I211-M214 WeakPolarHBondContact O-CB 3.22Å; I211-M214 PolarHBondContact O-N 3.39Å; M212-M214 PolarHBondContact O-N 2.75Å; M214-L242 HydrophobicContact CE-CB 4.28Å; M214-L242 HydrophobicContact CE-CD2 4.41Å; M214-L242 HydrophobicContact CG-CB 3.99Å; M214-L242 HydrophobicContact SD-CB 4.2Å; M214-L242 HydrophobicContact SD-CD1 4.38Å
215	V	96.6	Very high	97.7	Very high	13 Å²	13	16.5 Å²	16.5	8%	0.079	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.7	-47.2	-169.8	-172.8	0	0	0	0	112.6	I186 R190 F193 M212 G213	I186-V215 HydrophobicContact CG2-CG2 4.29Å; R190-V215 HydrophobicContact CB-CG1 3.91Å; R190-V215 HydrophobicContact CB-CG2 4.39Å; R190-V215 HydrophobicContact CG-CG1 4.43Å; R190-V215 HydrophobicContact CG-CG2 4.05Å; R190-V215 WeakPolarHBondContact O-CG1 3.24Å; F193-V215 HydrophobicContact CB-CG1 3.91Å; M212-V215 PolarHBondContact O-N 2.79Å; G213-V215 PolarHBondContact O-N 2.92Å
216	A	97.8	Very high	97.6	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.008	12%	0.118	C	C	.	.	S	Bend	trans	-74.7	159.9	-178.8	0	0	0	0	0	112	F193 V198 M212 V219 G248	F193-A216 WeakPolarHBondContact O-CA 3.39Å; V198-A216 HydrophobicContact CG2-CB 3.74Å; M212-A216 HydrophobicContact CG-CB 3.88Å; M212-A216 WeakPolarHBondContact O-CB 3.42Å; M212-A216 PolarHBondContact O-N 3.16Å; M212-A216 HydrophobicContact SD-CB 3.93Å; A216-V219 HydrophobicContact CB-CG2 4.08Å; A216-G248 WeakPolarHBondContact O-CA 3.36Å
217	K	97.5	Very high	97.4	Very high	124 Å²	124	25.6 Å²	25.6	54%	0.539	14%	0.136	S	C	.	.	S	Bend	trans	-72.8	-43.3	173.6	173.4	-179.2	178	-173.4	0	111	C196 E249	C196-K217 PolarHBondContact O-N 2.84Å; K217-E249 PolarHBondContact O-N 3.07Å; K217-E249 VanDerWaalsContact O-N 3.15Å
218	R	98.3	Very high	97.3	Very high	52 Å²	52	26 Å²	26	20%	0.196	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	139.5	-177.8	-177.3	171	-70.7	170.6	-5.5	110.8	C196 T197 V198 Y220 E249 N279	C196-R218 PolarHBondContact O-N 3.3Å; T197-R218 CarbonylContact C-O 3.52Å; T197-R218 WeakPolarHBondContact CA-O 3.49Å; T197-R218 HydrophobicContact CG2-CB 4.43Å; V198-R218 PolarHBondContact N-O 2.91Å; R218-Y220 HydrophobicContact CG-CD2 4.46Å; R218-Y220 HydrophobicContact CG-CE2 4.08Å; R218-E249 CarbonylContact C-O 3.59Å; R218-E249 VanDerWaalsContact CA-O 3.26Å; R218-E249 WeakPolarHBondContact CA-O 3.12Å; R218-E249 IonicContact CZ-OE2 3.58Å; R218-E249 IonicContact NE-OE2 3.98Å; R218-E249 PolarHBondContact NE-OE2 2.83Å; R218-E249 IonicContact NH2-OE1 3.55Å; R218-E249 IonicContact NH2-OE2 3.75Å; R218-E249 PolarHBondContact NH2-OE2 2.85Å; R218-N279 VanDerWaalsContact NH1-CG 3.27Å; R218-N279 PolarHBondContact NH1-OD1 2.92Å
219	V	98.8	Very high	97.3	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.9	174	-170.6	0	0	0	0	108.7	V198 S209 M212 A216 E249 I250 K251 M288	V198-V219 HydrophobicContact CB-CG1 4.34Å; V198-V219 HydrophobicContact CB-CG2 4.34Å; V198-V219 CarbonylContact O-C 3.54Å; V198-V219 WeakPolarHBondContact O-CA 3.41Å; S209-V219 VanDerWaalsContact OG-CG1 3.3Å; S209-V219 WeakPolarHBondContact OG-CG1 3.4Å; M212-V219 HydrophobicContact CB-CG2 4.01Å; M212-V219 HydrophobicContact CG-CG2 3.61Å; A216-V219 HydrophobicContact CB-CG2 4.08Å; V219-E249 PolarHBondContact N-O 3.22Å; V219-I250 HydrophobicContact CB-CG1 4.2Å; V219-I250 HydrophobicContact CB-CG2 4.4Å; V219-I250 HydrophobicContact CG2-CG1 4.45Å; V219-I250 CarbonylContact O-C 3.55Å; V219-I250 WeakPolarHBondContact O-CA 3.29Å; V219-K251 PolarHBondContact O-N 2.91Å; V219-M288 HydrophobicContact CG1-CE 4.33Å
220	Y	98.8	Very high	97.2	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	103.8	164.7	-68.9	-80.4	0	0	0	107.5	T197 V198 E200 R218 K251 W272 E276 N279 L280	T197-Y220 HydrophobicContact CG2-CD2 4.12Å; T197-Y220 HydrophobicContact CG2-CE2 3.9Å; V198-Y220 PolarHBondContact O-N 3.23Å; E200-Y220 PolarHBondContact N-O 3.18Å; R218-Y220 HydrophobicContact CG-CD2 4.46Å; R218-Y220 HydrophobicContact CG-CE2 4.08Å; Y220-K251 CarbonylContact C-O 3.59Å; Y220-K251 WeakPolarHBondContact CA-O 3.49Å; Y220-K251 HydrophobicContact CD1-CB 3.94Å; Y220-K251 HydrophobicContact CD1-CD 4.4Å; Y220-K251 HydrophobicContact CE1-CB 4.16Å; Y220-K251 HydrophobicContact CE1-CD 3.77Å; Y220-K251 HydrophobicContact CE1-CG 4.49Å; Y220-W272 HydrophobicContact CD1-CE3 4.42Å; Y220-W272 AromaticContact CD1-CH2 3.62Å; Y220-W272 HydrophobicContact CD1-CH2 3.62Å; Y220-W272 AromaticContact CD1-CZ3 3.44Å; Y220-W272 HydrophobicContact CD1-CZ3 3.44Å; Y220-W272 VanDerWaalsContact CD1-CZ3 3.44Å; Y220-W272 HydrophobicContact CE1-CE3 4.46Å; Y220-W272 HydrophobicContact CE1-CH2 4.36Å; Y220-W272 AromaticContact CE1-CZ3 3.72Å; Y220-W272 HydrophobicContact CE1-CZ3 3.72Å; Y220-W272 AromaticContact CG-CH2 3.77Å; Y220-W272 HydrophobicContact CG-CH2 3.77Å; Y220-W272 AromaticContact CG-CZ3 3.9Å; Y220-W272 HydrophobicContact CG-CZ3 3.9Å; Y220-E276 HydrophobicContact CE1-CB 4.06Å; Y220-E276 HydrophobicContact CE1-CG 4.17Å; Y220-N279 PolarHBondContact OH-OD1 2.84Å; Y220-N279 VanDerWaalsContact OH-OD1 3.13Å; Y220-L280 HydrophobicContact CD2-CD1 3.87Å; Y220-L280 HydrophobicContact CE2-CB 4.4Å; Y220-L280 HydrophobicContact CE2-CD1 4.35Å
221	C	98.8	Very high	97.1	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.014	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	120	175.8	-172	0	0	0	0	108.2	S209 C232 I250 K251 V252 K253	S209-C221 WeakPolarHBondContact OG-CB 3.24Å; S209-C221 PolarHBondContact OG-SG 3.12Å; C221-C232 PolarHBondContact SG-SG 3.43Å; C221-I250 HydrophobicContact CB-CG2 4.09Å; C221-K251 PolarHBondContact N-O 2.95Å; C221-V252 HydrophobicContact CB-CG2 4.43Å; C221-V252 WeakPolarHBondContact O-CA 3.43Å; C221-K253 PolarHBondContact O-N 3.21Å
222	T	98.8	Very high	97.1	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.006	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	141.8	-173.8	76.1	0	0	0	0	113.4	L199 E200 G202 G203 K253 L255 W272	L199-T222 HydrophobicContact CD1-CG2 3.56Å; E200-T222 WeakPolarHBondContact O-CB 3.42Å; E200-T222 PolarHBondContact O-N 2.95Å; E200-T222 VanDerWaalsContact O-N 3.09Å; E200-T222 PolarHBondContact O-OG1 3.39Å; G202-T222 CarbonylContact C-O 3.55Å; G202-T222 WeakPolarHBondContact CA-O 3.4Å; G202-T222 PolarHBondContact N-O 2.86Å; G203-T222 PolarHBondContact N-O 3.26Å; T222-K253 VanDerWaalsContact CA-O 3.23Å; T222-K253 WeakPolarHBondContact CA-O 3.21Å; T222-K253 HydrophobicContact CG2-CB 4.46Å; T222-L255 HydrophobicContact CG2-CB 4.09Å; T222-L255 HydrophobicContact CG2-CD2 4.42Å; T222-W272 HydrophobicContact CG2-CH2 4.19Å; T222-W272 HydrophobicContact CG2-CZ2 3.6Å
223	D	98.3	Very high	97.1	Very high	25 Å²	25	33 Å²	33	13%	0.134	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	-169.9	174.5	-141.7	-60.2	0	0	0	109.9	G202 G203 G204 L228 L229 K253 E254 L255	G202-D223 VanDerWaalsContact C-OD2 3.22Å; G202-D223 WeakPolarHBondContact CA-OD2 3.33Å; G203-D223 PolarHBondContact N-OD2 2.78Å; G204-D223 WeakPolarHBondContact CA-OD2 3.34Å; G204-D223 PolarHBondContact N-OD2 3.15Å; D223-L228 HydrophobicContact CB-CD2 4.09Å; D223-L228 VanDerWaalsContact CG-CD2 3.48Å; D223-L228 WeakPolarHBondContact OD1-CD2 3.36Å; D223-L229 HydrophobicContact CB-CD2 3.92Å; D223-K253 PolarHBondContact N-O 2.89Å; D223-E254 CarbonylContact O-C 3.43Å; D223-E254 WeakPolarHBondContact O-CA 3.48Å; D223-L255 PolarHBondContact O-N 3.45Å
224	V	96	Very high	97.1	Very high	65 Å²	65	36.1 Å²	36.1	39%	0.394	19%	0.192	S	C	.	.	S	Bend	trans	-121.4	151.7	174.3	-58.3	0	0	0	0	111.7	D256	V224-D256 VanDerWaalsContact CG1-CA 3.45Å; V224-D256 HydrophobicContact CG1-CB 3.76Å
225	G	94.5	Very high	97.2	Very high	41 Å²	41	35.6 Å²	35.6	42%	0.423	19%	0.19	S	C	.	.			trans	91.9	119.1	178	0	0	0	0	0	112.9	D227 L228 L229	G225-D227 VanDerWaalsContact C-N 3.33Å; G225-D227 PolarHBondContact O-N 2.86Å; G225-L228 PolarHBondContact O-N 2.76Å; G225-L228 VanDerWaalsContact O-N 3.09Å; G225-L229 WeakPolarHBondContact O-CG 3.11Å; G225-L229 PolarHBondContact O-N 2.76Å
226	E	94.6	Very high	97.3	Very high	125 Å²	125	36 Å²	36	58%	0.584	19%	0.192	S	C	*	.	H	α-helix	trans	-56.1	-44.2	-176.7	-172.3	179.9	166.6	0	0	112.6	L228 L229 A230 P269 Y270	E226-L228 VanDerWaalsContact C-N 3.3Å; E226-L228 PolarHBondContact O-N 2.92Å; E226-L229 PolarHBondContact O-N 3.33Å; E226-A230 VanDerWaalsContact O-CB 3.31Å; E226-A230 WeakPolarHBondContact O-CB 3.45Å; E226-A230 PolarHBondContact O-N 2.86Å; E226-P269 HydrophobicContact CG-CB 4.27Å; E226-P269 HydrophobicContact CG-CG 4.49Å; E226-Y270 HydrophobicContact CG-CE2 4.31Å
227	D	93.7	Very high	97.3	Very high	70 Å²	70	39 Å²	39	37%	0.374	22%	0.216	S	C	.	.	H	α-helix	trans	-59.3	-38.6	177.6	-81.1	-9.1	0	0	0	112.9	G225 M231	G225-D227 VanDerWaalsContact C-N 3.33Å; G225-D227 PolarHBondContact O-N 2.86Å; D227-M231 PolarHBondContact O-N 2.89Å
228	L	95.7	Very high	97.2	Very high	13 Å²	13	35.2 Å²	35.2	7%	0.068	20%	0.202	C	C	.	.	H	α-helix	trans	-74.5	-44.3	179.1	174.6	57.3	0	0	0	110.8	G172 K173 D223 G225 E226 A230 M231 C232	G172-L228 VanDerWaalsContact C-CD1 3.48Å; G172-L228 WeakPolarHBondContact O-CD1 3.5Å; K173-L228 HydrophobicContact CB-CD1 4.47Å; K173-L228 HydrophobicContact CG-CD1 3.91Å; D223-L228 HydrophobicContact CB-CD2 4.09Å; D223-L228 VanDerWaalsContact CG-CD2 3.48Å; D223-L228 WeakPolarHBondContact OD1-CD2 3.36Å; G225-L228 PolarHBondContact O-N 2.76Å; G225-L228 VanDerWaalsContact O-N 3.09Å; E226-L228 VanDerWaalsContact C-N 3.3Å; E226-L228 PolarHBondContact O-N 2.92Å; L228-A230 VanDerWaalsContact C-N 3.31Å; L228-A230 PolarHBondContact O-N 3.28Å; L228-M231 WeakPolarHBondContact O-CB 3.25Å; L228-M231 PolarHBondContact O-N 3.5Å; L228-C232 WeakPolarHBondContact O-CB 3.34Å; L228-C232 PolarHBondContact O-N 2.93Å
229	L	97.8	Very high	97.1	Very high	3 Å²	3	32.8 Å²	32.8	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-63.1	-38.6	177.5	-66.3	169	0	0	0	111.4	D223 G225 E226 C232 E233 V252 E254 Y270	D223-L229 HydrophobicContact CB-CD2 3.92Å; G225-L229 WeakPolarHBondContact O-CG 3.11Å; G225-L229 PolarHBondContact O-N 2.76Å; E226-L229 PolarHBondContact O-N 3.33Å; L229-C232 WeakPolarHBondContact O-CB 3.01Å; L229-C232 PolarHBondContact O-N 3.02Å; L229-E233 WeakPolarHBondContact O-CB 3.46Å; L229-E233 PolarHBondContact O-N 3.36Å; L229-V252 HydrophobicContact CB-CG1 4.07Å; L229-V252 HydrophobicContact CD2-CG1 3.66Å; L229-V252 HydrophobicContact CG-CG1 4.48Å; L229-E254 HydrophobicContact CD1-CB 3.95Å; L229-E254 HydrophobicContact CD1-CG 4.46Å; L229-Y270 HydrophobicContact CB-CD1 4.03Å; L229-Y270 HydrophobicContact CB-CD2 3.57Å; L229-Y270 HydrophobicContact CB-CE1 4.14Å; L229-Y270 HydrophobicContact CB-CE2 3.67Å; L229-Y270 HydrophobicContact CB-CG 3.77Å; L229-Y270 HydrophobicContact CD1-CD2 3.86Å; L229-Y270 HydrophobicContact CD1-CG 3.86Å; L229-Y270 HydrophobicContact CG-CD2 4.36Å; L229-Y270 HydrophobicContact CG-CG 4.37Å
230	A	96.9	Very high	97	Very high	42 Å²	42	38.3 Å²	38.3	35%	0.347	22%	0.217	S	C	.	.	H	α-helix	trans	-64.6	-41.3	173.3	0	0	0	0	0	112.8	E226 L228 C232 E233 H234 Y270	E226-A230 VanDerWaalsContact O-CB 3.31Å; E226-A230 WeakPolarHBondContact O-CB 3.45Å; E226-A230 PolarHBondContact O-N 2.86Å; L228-A230 VanDerWaalsContact C-N 3.31Å; L228-A230 PolarHBondContact O-N 3.28Å; A230-C232 VanDerWaalsContact C-N 3.35Å; A230-E233 PolarHBondContact O-N 3.33Å; A230-H234 WeakPolarHBondContact O-CB 3.42Å; A230-H234 PolarHBondContact O-N 3.36Å; A230-Y270 WeakPolarHBondContact CA-OH 3.29Å
231	M	96.2	Very high	96.6	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.02	23%	0.233	C	C	.	.	H	α-helix	trans	-61.3	-44.3	172.2	179.9	-174.9	-67.7	0	0	111.5	V45 E161 T163 K173 T205 D227 L228 H234 N235	V45-M231 HydrophobicContact CG2-CE 4.27Å; E161-M231 HydrophobicContact CB-CG 4.47Å; T163-M231 HydrophobicContact CG2-CE 4.29Å; K173-M231 HydrophobicContact CB-CE 4.24Å; K173-M231 HydrophobicContact CB-SD 4.22Å; K173-M231 HydrophobicContact CG-CE 4.25Å; K173-M231 HydrophobicContact CG-SD 4.46Å; T205-M231 HydrophobicContact CG2-SD 4.38Å; D227-M231 PolarHBondContact O-N 2.89Å; L228-M231 WeakPolarHBondContact O-CB 3.25Å; L228-M231 PolarHBondContact O-N 3.5Å; M231-H234 PolarHBondContact O-N 2.61Å; M231-N235 VanDerWaalsContact O-CG 3.31Å; M231-N235 PolarHBondContact O-N 3.27Å; M231-N235 PolarHBondContact O-ND2 2.78Å
232	C	98.3	Very high	96.3	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.02	23%	0.232	C	C	.	.	H	α-helix	trans	-62.1	-46.1	177.5	-174.9	0	0	0	0	111.7	G204 G206 C221 L228 L229 A230 H234 N235 V236 V252	G204-C232 WeakPolarHBondContact O-CB 3.35Å; G206-C232 VanDerWaalsContact CA-SG 3.59Å; C221-C232 PolarHBondContact SG-SG 3.43Å; L228-C232 WeakPolarHBondContact O-CB 3.34Å; L228-C232 PolarHBondContact O-N 2.93Å; L229-C232 WeakPolarHBondContact O-CB 3.01Å; L229-C232 PolarHBondContact O-N 3.02Å; A230-C232 VanDerWaalsContact C-N 3.35Å; C232-H234 VanDerWaalsContact C-N 3.33Å; C232-H234 PolarHBondContact O-N 3.13Å; C232-N235 WeakPolarHBondContact O-CB 3.46Å; C232-N235 PolarHBondContact O-N 3.25Å; C232-V236 WeakPolarHBondContact O-CG2 3.18Å; C232-V236 PolarHBondContact O-N 3.27Å; C232-V252 HydrophobicContact CB-CG1 4.21Å; C232-V252 HydrophobicContact CB-CG2 4.48Å
233	E	98.4	Very high	96.1	Very high	99 Å²	99	42 Å²	42	46%	0.463	23%	0.234	S	C	.	.	H	α-helix	trans	-62.2	-40.7	176.5	-176.4	170.8	-132.8	0	0	111.9	L229 A230 V236 A237 V252 Y270	L229-E233 WeakPolarHBondContact O-CB 3.46Å; L229-E233 PolarHBondContact O-N 3.36Å; A230-E233 PolarHBondContact O-N 3.33Å; E233-V236 WeakPolarHBondContact O-CB 3.27Å; E233-V236 PolarHBondContact O-N 3.17Å; E233-A237 PolarHBondContact O-N 3.1Å; E233-V252 HydrophobicContact CB-CB 4.37Å; E233-V252 HydrophobicContact CB-CG2 4.14Å; E233-Y270 HydrophobicContact CB-CE1 4.23Å; E233-Y270 VanDerWaalsContact OE2-CE1 3.31Å; E233-Y270 WeakPolarHBondContact OE2-CE1 3.49Å; E233-Y270 PolarHBondContact OE2-OH 3.14Å
234	H	97.5	Very high	95.7	Very high	65 Å²	65	46.2 Å²	46.2	30%	0.301	25%	0.253	S	S	.	.	H	α-helix	trans	-60.8	-44.8	173.2	-173.8	74.9	0	0	0	111.7	E161 A230 M231 C232 V236 A237 L238	E161-H234 IonicContact OE1-NE2 3.39Å; E161-H234 IonicContact OE2-CD2 2.72Å; E161-H234 PolarHBondContact OE2-CD2 2.8Å; E161-H234 IonicContact OE2-NE2 3.83Å; A230-H234 WeakPolarHBondContact O-CB 3.42Å; A230-H234 PolarHBondContact O-N 3.36Å; M231-H234 PolarHBondContact O-N 2.61Å; C232-H234 VanDerWaalsContact C-N 3.33Å; C232-H234 PolarHBondContact O-N 3.13Å; H234-V236 VanDerWaalsContact C-N 3.34Å; H234-V236 PolarHBondContact O-N 3.27Å; H234-A237 WeakPolarHBondContact O-CB 3.4Å; H234-A237 PolarHBondContact O-N 2.94Å; H234-A237 VanDerWaalsContact O-N 3.12Å; H234-L238 WeakPolarHBondContact O-CG 3.37Å; H234-L238 PolarHBondContact O-N 3.02Å
235	N	98.2	Very high	95.2	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-40.2	175.1	-72.8	-24.7	0	0	0	112.3	I160 E161 T205 I210 M231 C232 A237 L238 N239	I160-N235 HydrophobicContact CD1-CB 4.3Å; E161-N235 WeakPolarHBondContact CB-OD1 3.43Å; E161-N235 PolarHBondContact N-OD1 2.89Å; E161-N235 PolarHBondContact O-ND2 2.93Å; T205-N235 WeakPolarHBondContact O-CB 3.45Å; T205-N235 PolarHBondContact O-ND2 2.93Å; I210-N235 HydrophobicContact CD1-CB 3.97Å; M231-N235 VanDerWaalsContact O-CG 3.31Å; M231-N235 PolarHBondContact O-N 3.27Å; M231-N235 PolarHBondContact O-ND2 2.78Å; C232-N235 WeakPolarHBondContact O-CB 3.46Å; C232-N235 PolarHBondContact O-N 3.25Å; N235-A237 VanDerWaalsContact C-N 3.31Å; N235-A237 PolarHBondContact O-N 3.05Å; N235-L238 PolarHBondContact O-N 2.83Å; N235-N239 PolarHBondContact O-N 2.7Å; N235-N239 PolarHBondContact O-ND2 3.48Å
236	V	98.3	Very high	94.6	Very high	21 Å²	21	48.5 Å²	48.5	13%	0.127	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-44	173	170.3	0	0	0	0	110.6	I210 C232 E233 H234 N239 K240 I243 I250 V252	I210-V236 HydrophobicContact CG1-CG2 4.23Å; C232-V236 WeakPolarHBondContact O-CG2 3.18Å; C232-V236 PolarHBondContact O-N 3.27Å; E233-V236 WeakPolarHBondContact O-CB 3.27Å; E233-V236 PolarHBondContact O-N 3.17Å; H234-V236 VanDerWaalsContact C-N 3.34Å; H234-V236 PolarHBondContact O-N 3.27Å; V236-N239 CarbonylContact O-C 3.54Å; V236-N239 PolarHBondContact O-N 3.32Å; V236-K240 PolarHBondContact O-N 3.26Å; V236-K240 VanDerWaalsContact O-N 3.11Å; V236-I243 HydrophobicContact CG1-CD1 4.02Å; V236-I250 HydrophobicContact CG1-CB 3.96Å; V236-I250 HydrophobicContact CG1-CD1 4.4Å; V236-I250 HydrophobicContact CG1-CG2 4.36Å; V236-I250 HydrophobicContact CG2-CB 4.3Å; V236-I250 HydrophobicContact CG2-CD1 4.28Å; V236-I250 HydrophobicContact CG2-CG2 3.83Å; V236-V252 HydrophobicContact CG2-CG2 4.15Å
237	A	97.8	Very high	94.4	Very high	63 Å²	63	53.3 Å²	53.3	52%	0.521	27%	0.269	S	S	.	.	H	α-helix	trans	-63.4	-43.3	178.1	0	0	0	0	0	112.7	E233 H234 N235 N239 K240	E233-A237 PolarHBondContact O-N 3.1Å; H234-A237 WeakPolarHBondContact O-CB 3.4Å; H234-A237 PolarHBondContact O-N 2.94Å; H234-A237 VanDerWaalsContact O-N 3.12Å; N235-A237 VanDerWaalsContact C-N 3.31Å; N235-A237 PolarHBondContact O-N 3.05Å; A237-N239 PolarHBondContact O-N 2.78Å; A237-N239 VanDerWaalsContact O-N 3.15Å; A237-K240 WeakPolarHBondContact O-CB 3.41Å; A237-K240 PolarHBondContact O-N 2.8Å
238	L	95.9	Very high	94.5	Very high	46 Å²	46	50.6 Å²	50.6	24%	0.241	26%	0.258	C	S	.	.	H	α-helix	trans	-58.1	-27.9	176.2	-71.2	176.8	0	0	0	113	L47 K159 E161 H234 N235	L47-L238 HydrophobicContact CD1-CD1 4.05Å; K159-L238 HydrophobicContact CB-CB 4.18Å; K159-L238 HydrophobicContact CB-CD1 4.36Å; E161-L238 HydrophobicContact CG-CD1 4.25Å; H234-L238 WeakPolarHBondContact O-CG 3.37Å; H234-L238 PolarHBondContact O-N 3.02Å; N235-L238 PolarHBondContact O-N 2.83Å
239	N	97	Very high	94.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	12.5	-176.4	-61.9	-73.1	0	0	0	113.9	V158 K159 I210 N235 V236 A237 H241 L242 I243	V158-N239 VanDerWaalsContact CA-OD1 3.26Å; V158-N239 WeakPolarHBondContact CA-OD1 3.37Å; K159-N239 PolarHBondContact N-OD1 3.48Å; K159-N239 PolarHBondContact O-ND2 3.17Å; I210-N239 HydrophobicContact CG1-CB 4.47Å; I210-N239 HydrophobicContact CG2-CB 3.57Å; N235-N239 PolarHBondContact O-N 2.7Å; N235-N239 PolarHBondContact O-ND2 3.48Å; V236-N239 CarbonylContact O-C 3.54Å; V236-N239 PolarHBondContact O-N 3.32Å; A237-N239 PolarHBondContact O-N 2.78Å; A237-N239 VanDerWaalsContact O-N 3.15Å; N239-H241 PolarHBondContact O-N 2.87Å; N239-H241 VanDerWaalsContact O-N 3.09Å; N239-L242 HydrophobicContact CB-CD1 4.34Å; N239-L242 WeakPolarHBondContact O-CB 3.42Å; N239-L242 PolarHBondContact O-N 3.46Å; N239-I243 PolarHBondContact O-N 2.9Å
240	K	94.9	Very high	94.6	Very high	116 Å²	116	54.4 Å²	54.4	50%	0.504	28%	0.276	S	S	.	.	H	α-helix	trans	-51.4	-38.2	-179	-178	172	174	176.9	0	113.1	V236 A237 L242 I243 E244	V236-K240 PolarHBondContact O-N 3.26Å; V236-K240 VanDerWaalsContact O-N 3.11Å; A237-K240 WeakPolarHBondContact O-CB 3.41Å; A237-K240 PolarHBondContact O-N 2.8Å; K240-L242 VanDerWaalsContact C-N 3.28Å; K240-L242 PolarHBondContact O-N 3.17Å; K240-I243 PolarHBondContact O-N 3.43Å; K240-E244 VanDerWaalsContact CE-CD 3.45Å; K240-E244 WeakPolarHBondContact CE-OE1 3.42Å; K240-E244 HydrophobicContact CG-CG 4Å; K240-E244 IonicContact NZ-OE1 2.77Å; K240-E244 WeakPolarHBondContact O-CB 3.49Å; K240-E244 WeakPolarHBondContact O-CG 3.35Å; K240-E244 PolarHBondContact O-N 3Å
241	H	91.9	Very high	94.7	Very high	72 Å²	72	54.9 Å²	54.9	33%	0.333	27%	0.27	S	S	.	.	H	α-helix	trans	-59	-33.1	177.5	68.4	-79.5	0	0	0	114	N239 Q245	N239-H241 PolarHBondContact O-N 2.87Å; N239-H241 VanDerWaalsContact O-N 3.09Å; H241-Q245 WeakPolarHBondContact O-CG 3.46Å
242	L	92.7	Very high	94.8	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-76.6	-39.8	176.4	-58.9	177.1	0	0	0	111.5	S155 V158 M214 N239 K240 G246	S155-L242 WeakPolarHBondContact O-CD2 3.4Å; V158-L242 HydrophobicContact CG2-CD1 3.76Å; M214-L242 HydrophobicContact CE-CB 4.28Å; M214-L242 HydrophobicContact CE-CD2 4.41Å; M214-L242 HydrophobicContact CG-CB 3.99Å; M214-L242 HydrophobicContact SD-CB 4.2Å; M214-L242 HydrophobicContact SD-CD1 4.38Å; N239-L242 HydrophobicContact CB-CD1 4.34Å; N239-L242 WeakPolarHBondContact O-CB 3.42Å; N239-L242 PolarHBondContact O-N 3.46Å; K240-L242 VanDerWaalsContact C-N 3.28Å; K240-L242 PolarHBondContact O-N 3.17Å; L242-G246 PolarHBondContact O-N 3.23Å
243	I	93.8	Very high	94.8	Very high	8 Å²	8	56.6 Å²	56.6	4%	0.041	28%	0.278	C	S	.	.	H	α-helix	trans	-70	-44.5	-176.7	-61.1	159.9	0	0	0	110.2	V236 N239 K240 Q245 G246 R247 G248 I250	V236-I243 HydrophobicContact CG1-CD1 4.02Å; N239-I243 PolarHBondContact O-N 2.9Å; K240-I243 PolarHBondContact O-N 3.43Å; I243-Q245 VanDerWaalsContact C-N 3.33Å; I243-Q245 PolarHBondContact O-N 2.88Å; I243-G246 CarbonylContact O-C 3.47Å; I243-G246 WeakPolarHBondContact O-CA 3.44Å; I243-G246 PolarHBondContact O-N 2.92Å; I243-G246 VanDerWaalsContact O-N 3.09Å; I243-R247 PolarHBondContact O-N 2.68Å; I243-R247 VanDerWaalsContact O-N 3.11Å; I243-G248 WeakPolarHBondContact CG2-O 3.4Å; I243-G248 PolarHBondContact O-N 3.17Å; I243-G248 VanDerWaalsContact O-N 3.08Å; I243-I250 HydrophobicContact CD1-CD1 3.49Å; I243-I250 VanDerWaalsContact CD1-CD1 3.49Å; I243-I250 HydrophobicContact CD1-CG1 4.17Å; I243-I250 HydrophobicContact CG1-CD1 3.97Å; I243-I250 HydrophobicContact CG2-CG1 4.32Å
244	E	89.4	Confident	94.8	Very high	113 Å²	113	53.3 Å²	53.3	53%	0.528	26%	0.263	S	S	.	.	H	α-helix	trans	-66.5	-32.3	180	-72.7	-175.8	153.3	0	0	112.8	K240 G246 R247	K240-E244 VanDerWaalsContact CE-CD 3.45Å; K240-E244 WeakPolarHBondContact CE-OE1 3.42Å; K240-E244 HydrophobicContact CG-CG 4Å; K240-E244 IonicContact NZ-OE1 2.77Å; K240-E244 WeakPolarHBondContact O-CB 3.49Å; K240-E244 WeakPolarHBondContact O-CG 3.35Å; K240-E244 PolarHBondContact O-N 3Å; E244-G246 VanDerWaalsContact C-N 3.26Å; E244-G246 PolarHBondContact O-N 3.11Å; E244-R247 PolarHBondContact O-N 3.38Å
245	Q	86.6	Confident	94.8	Very high	124 Å²	124	50.4 Å²	50.4	58%	0.579	25%	0.249	S	C	*	.	H	α-helix	trans	-59.9	-39.1	171.5	-74.7	170.5	11	0	0	111.8	H241 I243 R247	H241-Q245 WeakPolarHBondContact O-CG 3.46Å; I243-Q245 VanDerWaalsContact C-N 3.33Å; I243-Q245 PolarHBondContact O-N 2.88Å; Q245-R247 VanDerWaalsContact C-N 3.25Å; Q245-R247 PolarHBondContact O-N 3.42Å
246	G	81.9	Confident	94.8	Very high	31 Å²	31	52.2 Å²	52.2	32%	0.32	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-8.1	173.5	0	0	0	0	0	114.3	L242 I243 E244 G248	L242-G246 PolarHBondContact O-N 3.23Å; I243-G246 CarbonylContact O-C 3.47Å; I243-G246 WeakPolarHBondContact O-CA 3.44Å; I243-G246 PolarHBondContact O-N 2.92Å; I243-G246 VanDerWaalsContact O-N 3.09Å; E244-G246 VanDerWaalsContact C-N 3.26Å; E244-G246 PolarHBondContact O-N 3.11Å; G246-G248 PolarHBondContact O-N 3.02Å
247	R	90.6	Very high	94.8	Very high	225 Å²	225	52.6 Å²	52.6	85%	0.849	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	27.3	-169.1	-51.4	179.7	178.9	-165.1	-1.7	113	I243 E244 Q245	I243-R247 PolarHBondContact O-N 2.68Å; I243-R247 VanDerWaalsContact O-N 3.11Å; E244-R247 PolarHBondContact O-N 3.38Å; Q245-R247 VanDerWaalsContact C-N 3.25Å; Q245-R247 PolarHBondContact O-N 3.42Å
248	G	94.4	Very high	94.7	Very high	13 Å²	13	55 Å²	55	13%	0.134	26%	0.262	C	S	.	.			trans	-81.6	167	176	0	0	0	0	0	111.9	G213 A216 I243 G246	G213-G248 WeakPolarHBondContact O-CA 3.42Å; A216-G248 WeakPolarHBondContact O-CA 3.36Å; I243-G248 WeakPolarHBondContact CG2-O 3.4Å; I243-G248 PolarHBondContact O-N 3.17Å; I243-G248 VanDerWaalsContact O-N 3.08Å; G246-G248 PolarHBondContact O-N 3.02Å
249	E	97.2	Very high	94.6	Very high	74 Å²	74	57.2 Å²	57.2	35%	0.346	27%	0.27	S	S	.	.			trans	-135.3	133.2	172.6	-178.6	-173	-171.4	0	0	107.9	K217 R218 V219 K251	K217-E249 PolarHBondContact O-N 3.07Å; K217-E249 VanDerWaalsContact O-N 3.15Å; R218-E249 CarbonylContact C-O 3.59Å; R218-E249 VanDerWaalsContact CA-O 3.26Å; R218-E249 WeakPolarHBondContact CA-O 3.12Å; R218-E249 IonicContact CZ-OE2 3.58Å; R218-E249 IonicContact NE-OE2 3.98Å; R218-E249 PolarHBondContact NE-OE2 2.83Å; R218-E249 IonicContact NH2-OE1 3.55Å; R218-E249 IonicContact NH2-OE2 3.75Å; R218-E249 PolarHBondContact NH2-OE2 2.85Å; V219-E249 PolarHBondContact N-O 3.22Å; E249-K251 HydrophobicContact CG-CG 4.5Å; E249-K251 WeakPolarHBondContact OE1-CE 3.48Å
250	I	98.6	Very high	94.3	Very high	23 Å²	23	63.6 Å²	63.6	12%	0.118	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	133.6	174	-53.1	-178.8	0	0	0	108.2	S209 I210 V219 C221 V236 I243	S209-I250 WeakPolarHBondContact O-CD1 3.22Å; I210-I250 HydrophobicContact CG1-CD1 4.39Å; V219-I250 HydrophobicContact CB-CG1 4.2Å; V219-I250 HydrophobicContact CB-CG2 4.4Å; V219-I250 HydrophobicContact CG2-CG1 4.45Å; V219-I250 CarbonylContact O-C 3.55Å; V219-I250 WeakPolarHBondContact O-CA 3.29Å; C221-I250 HydrophobicContact CB-CG2 4.09Å; V236-I250 HydrophobicContact CG1-CB 3.96Å; V236-I250 HydrophobicContact CG1-CD1 4.4Å; V236-I250 HydrophobicContact CG1-CG2 4.36Å; V236-I250 HydrophobicContact CG2-CB 4.3Å; V236-I250 HydrophobicContact CG2-CD1 4.28Å; V236-I250 HydrophobicContact CG2-CG2 3.83Å; I243-I250 HydrophobicContact CD1-CD1 3.49Å; I243-I250 VanDerWaalsContact CD1-CD1 3.49Å; I243-I250 HydrophobicContact CD1-CG1 4.17Å; I243-I250 HydrophobicContact CG1-CD1 3.97Å; I243-I250 HydrophobicContact CG2-CG1 4.32Å
251	K	98.5	Very high	94	Very high	51 Å²	51	65.6 Å²	65.6	22%	0.222	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	119.2	173.7	-67.1	-170.7	164.2	-156.5	0	109.1	V219 Y220 C221 E249 E276	V219-K251 PolarHBondContact O-N 2.91Å; Y220-K251 CarbonylContact C-O 3.59Å; Y220-K251 WeakPolarHBondContact CA-O 3.49Å; Y220-K251 HydrophobicContact CD1-CB 3.94Å; Y220-K251 HydrophobicContact CD1-CD 4.4Å; Y220-K251 HydrophobicContact CE1-CB 4.16Å; Y220-K251 HydrophobicContact CE1-CD 3.77Å; Y220-K251 HydrophobicContact CE1-CG 4.49Å; C221-K251 PolarHBondContact N-O 2.95Å; E249-K251 HydrophobicContact CG-CG 4.5Å; E249-K251 WeakPolarHBondContact OE1-CE 3.48Å; K251-E276 HydrophobicContact CD-CG 4.45Å; K251-E276 WeakPolarHBondContact CD-OE1 3.15Å; K251-E276 IonicContact NZ-OE1 2.8Å; K251-E276 PolarHBondContact NZ-OE1 3.2Å
252	V	98.7	Very high	94.2	Very high	13 Å²	13	63.4 Å²	63.4	8%	0.079	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	128.3	174.1	-177.6	0	0	0	0	108.7	C221 L229 C232 E233 V236 Y270	C221-V252 HydrophobicContact CB-CG2 4.43Å; C221-V252 WeakPolarHBondContact O-CA 3.43Å; L229-V252 HydrophobicContact CB-CG1 4.07Å; L229-V252 HydrophobicContact CD2-CG1 3.66Å; L229-V252 HydrophobicContact CG-CG1 4.48Å; C232-V252 HydrophobicContact CB-CG1 4.21Å; C232-V252 HydrophobicContact CB-CG2 4.48Å; E233-V252 HydrophobicContact CB-CB 4.37Å; E233-V252 HydrophobicContact CB-CG2 4.14Å; V236-V252 HydrophobicContact CG2-CG2 4.15Å; V252-Y270 HydrophobicContact CB-CD1 4.33Å; V252-Y270 HydrophobicContact CB-CE1 4.42Å; V252-Y270 HydrophobicContact CG1-CD1 4.02Å; V252-Y270 HydrophobicContact CG1-CE1 4.17Å
253	K	98.6	Very high	94.2	Very high	30 Å²	30	65 Å²	65	13%	0.13	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	150	-175.5	-65.4	-64.9	-178.9	175	0	112.1	C221 T222 D223 Y270 S271 W272 E276	C221-K253 PolarHBondContact O-N 3.21Å; T222-K253 VanDerWaalsContact CA-O 3.23Å; T222-K253 WeakPolarHBondContact CA-O 3.21Å; T222-K253 HydrophobicContact CG2-CB 4.46Å; D223-K253 PolarHBondContact N-O 2.89Å; K253-Y270 WeakPolarHBondContact CA-O 3.47Å; K253-Y270 WeakPolarHBondContact CD-O 3.37Å; K253-S271 WeakPolarHBondContact CD-O 3.16Å; K253-S271 PolarHBondContact NZ-O 2.83Å; K253-W272 HydrophobicContact CB-CD2 4.13Å; K253-W272 VanDerWaalsContact CB-CE2 3.48Å; K253-W272 HydrophobicContact CB-CH2 4.39Å; K253-W272 HydrophobicContact CB-CZ2 3.65Å; K253-W272 HydrophobicContact CG-CD2 4.11Å; K253-W272 HydrophobicContact CG-CE3 4.41Å; K253-W272 HydrophobicContact CG-CH2 4.43Å; K253-W272 HydrophobicContact CG-CZ2 4.12Å; K253-E276 VanDerWaalsContact CE-CD 3.46Å; K253-E276 VanDerWaalsContact CE-OE1 3.29Å; K253-E276 WeakPolarHBondContact CE-OE1 3.44Å; K253-E276 VanDerWaalsContact CE-OE2 3.22Å; K253-E276 WeakPolarHBondContact CE-OE2 3Å; K253-E276 IonicContact NZ-OE1 3.48Å; K253-E276 PolarHBondContact NZ-OE1 3.48Å; K253-E276 IonicContact NZ-OE2 2.67Å; K253-E276 PolarHBondContact NZ-OE2 3.33Å
254	E	98.3	Very high	94.3	Very high	31 Å²	31	67.1 Å²	67.1	15%	0.145	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	130.6	171.9	-174.9	-173.1	141.4	0	0	110.2	D223 L229 K259 Y270 W272	D223-E254 CarbonylContact O-C 3.43Å; D223-E254 WeakPolarHBondContact O-CA 3.48Å; L229-E254 HydrophobicContact CD1-CB 3.95Å; L229-E254 HydrophobicContact CD1-CG 4.46Å; E254-K259 IonicContact OE1-NZ 2.75Å; E254-K259 PolarHBondContact OE1-NZ 2.76Å; E254-Y270 PolarHBondContact N-O 2.94Å; E254-W272 PolarHBondContact O-NE1 2.64Å
255	L	98.4	Very high	94.5	Very high	3 Å²	3	65.6 Å²	65.6	2%	0.016	32%	0.324	C	S	.	.			trans	-139.6	97.5	164.4	-177.4	61.9	0	0	0	109.8	L201 T222 D223 W257 F262 T305 I309	L201-L255 HydrophobicContact CD2-CD2 3.48Å; L201-L255 VanDerWaalsContact CD2-CD2 3.48Å; T222-L255 HydrophobicContact CG2-CB 4.09Å; T222-L255 HydrophobicContact CG2-CD2 4.42Å; D223-L255 PolarHBondContact O-N 3.45Å; L255-W257 PolarHBondContact O-N 3.44Å; L255-F262 HydrophobicContact CD1-CD1 3.85Å; L255-F262 HydrophobicContact CD1-CE1 3.8Å; L255-F262 HydrophobicContact CD2-CE1 4.5Å; L255-T305 HydrophobicContact CD2-CG2 4.16Å; L255-T305 HydrophobicContact CG-CG2 4.49Å; L255-I309 HydrophobicContact CD2-CD1 4.13Å
256	D	97.4	Very high	94.7	Very high	39 Å²	39	65 Å²	65	21%	0.209	33%	0.331	C	S	.	.			trans	-82.9	113.6	174	-174.3	-11.2	0	0	0	110.7	V224 L258 K259	V224-D256 VanDerWaalsContact CG1-CA 3.45Å; V224-D256 HydrophobicContact CG1-CB 3.76Å; D256-L258 PolarHBondContact O-N 3.48Å; D256-L258 VanDerWaalsContact OD1-CB 3.31Å; D256-L258 WeakPolarHBondContact OD1-CB 3.5Å; D256-L258 PolarHBondContact OD1-N 2.91Å; D256-K259 HydrophobicContact CB-CB 4.31Å; D256-K259 HydrophobicContact CB-CD 3.87Å; D256-K259 HydrophobicContact CB-CG 3.95Å; D256-K259 PolarHBondContact O-N 3.46Å; D256-K259 WeakPolarHBondContact OD2-CE 3.49Å; D256-K259 IonicContact OD2-NZ 3.02Å
257	W	97.8	Very high	95.3	Very high	29 Å²	29	71.5 Å²	71.5	11%	0.11	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-19.7	-179.9	-55.2	-25.5	0	0	0	113.4	L201 L255 V292 A301 M302 T305	L201-W257 HydrophobicContact CB-CZ2 3.96Å; L255-W257 PolarHBondContact O-N 3.44Å; W257-V292 HydrophobicContact CH2-CB 3.79Å; W257-V292 HydrophobicContact CH2-CG1 3.87Å; W257-V292 HydrophobicContact CZ2-CG1 4.45Å; W257-V292 HydrophobicContact CZ3-CB 4.47Å; W257-A301 HydrophobicContact CB-CB 3.84Å; W257-M302 HydrophobicContact CD2-CB 3.8Å; W257-M302 HydrophobicContact CD2-CG 3.97Å; W257-M302 HydrophobicContact CE3-CB 3.67Å; W257-M302 HydrophobicContact CE3-CG 4.12Å; W257-M302 HydrophobicContact CG-CB 4.35Å; W257-M302 HydrophobicContact CH2-CB 4.46Å; W257-M302 HydrophobicContact CH2-CG 4.12Å; W257-M302 HydrophobicContact CZ2-CG 3.93Å; W257-M302 HydrophobicContact CZ3-CB 4.02Å; W257-M302 HydrophobicContact CZ3-CG 4.2Å; W257-T305 WeakPolarHBondContact CA-OG1 3.43Å; W257-T305 PolarHBondContact O-OG1 3.08Å
258	L	96.3	Very high	95.4	Very high	113 Å²	113	62.8 Å²	62.8	59%	0.592	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-8.2	175.8	-56.7	176.5	0	0	0	112.2	D256 A301	D256-L258 PolarHBondContact O-N 3.48Å; D256-L258 VanDerWaalsContact OD1-CB 3.31Å; D256-L258 WeakPolarHBondContact OD1-CB 3.5Å; D256-L258 PolarHBondContact OD1-N 2.91Å; L258-A301 HydrophobicContact CD2-CB 3.68Å
259	K	94.8	Very high	95.4	Very high	93 Å²	93	65 Å²	65	40%	0.404	34%	0.336	S	S	.	.	S	Bend	trans	-101.3	150.1	174.9	-62.2	179.6	-167.3	159.2	0	111.7	E254 D256 R308	E254-K259 IonicContact OE1-NZ 2.75Å; E254-K259 PolarHBondContact OE1-NZ 2.76Å; D256-K259 HydrophobicContact CB-CB 4.31Å; D256-K259 HydrophobicContact CB-CD 3.87Å; D256-K259 HydrophobicContact CB-CG 3.95Å; D256-K259 PolarHBondContact O-N 3.46Å; D256-K259 WeakPolarHBondContact OD2-CE 3.49Å; D256-K259 IonicContact OD2-NZ 3.02Å; K259-R308 PolarHBondContact O-NH1 3.16Å; K259-R308 VanDerWaalsContact O-NH1 3.13Å; K259-R308 PolarHBondContact O-NH2 3.43Å
260	D	89	Confident	95.5	Very high	133 Å²	133	63.5 Å²	63.5	71%	0.711	33%	0.328	S	S	*	.	S	Bend	trans	-82.8	-18.8	-176	-78.1	-34	0	0	0	114.6	R308	D260-R308 VanDerWaalsContact C-CZ 3.45Å; D260-R308 VanDerWaalsContact CA-NH1 3.25Å; D260-R308 WeakPolarHBondContact O-CD 3.46Å; D260-R308 PolarHBondContact O-NE 3.29Å; D260-R308 PolarHBondContact O-NH1 3.06Å; D260-R308 VanDerWaalsContact O-NH1 3.09Å; D260-R308 IonicContact OD1-NH1 2.71Å
261	E	90.2	Very high	95.4	Very high	158 Å²	158	63.2 Å²	63.2	74%	0.738	33%	0.328	S	S	*	.	S	Bend	trans	-134.3	157.2	-172.4	-63.4	-174.9	170.8	0	0	111.4	C263	E261-C263 PolarHBondContact O-N 3.38Å
262	F	94.4	Very high	95.4	Very high	27 Å²	27	60.9 Å²	60.9	12%	0.118	32%	0.318	C	S	.	.			trans	-64	132.4	167.6	-66.4	-82.7	0	0	0	108.8	L255 T264 W272 V277 L280 H281 I309	L255-F262 HydrophobicContact CD1-CD1 3.85Å; L255-F262 HydrophobicContact CD1-CE1 3.8Å; L255-F262 HydrophobicContact CD2-CE1 4.5Å; F262-T264 HydrophobicContact CB-CG2 4.46Å; F262-T264 PolarHBondContact O-N 2.89Å; F262-T264 VanDerWaalsContact O-N 3.15Å; F262-W272 HydrophobicContact CB-CB 4.32Å; F262-W272 HydrophobicContact CB-CG 4.12Å; F262-W272 AromaticContact CD1-CD1 3.91Å; F262-W272 AromaticContact CD1-CD2 3.79Å; F262-W272 HydrophobicContact CD1-CD2 3.79Å; F262-W272 AromaticContact CD1-CE2 3.56Å; F262-W272 HydrophobicContact CD1-CE3 4.41Å; F262-W272 HydrophobicContact CD1-CG 4.01Å; F262-W272 HydrophobicContact CD1-CZ2 4Å; F262-W272 AromaticContact CD1-NE1 3.63Å; F262-W272 HydrophobicContact CE1-CD2 4.35Å; F262-W272 AromaticContact CE1-CE2 3.94Å; F262-W272 HydrophobicContact CE1-CH2 4.23Å; F262-W272 AromaticContact CE1-CZ2 3.89Å; F262-W272 HydrophobicContact CE1-CZ2 3.89Å; F262-W272 HydrophobicContact CG-CG 4.44Å; F262-V277 HydrophobicContact CB-CG2 3.96Å; F262-V277 HydrophobicContact CD2-CG1 3.88Å; F262-V277 HydrophobicContact CD2-CG2 4.17Å; F262-V277 HydrophobicContact CE2-CG1 4.18Å; F262-V277 HydrophobicContact CG-CG2 4.01Å; F262-L280 HydrophobicContact CE1-CD2 3.93Å; F262-L280 HydrophobicContact CE2-CD2 4.43Å; F262-L280 HydrophobicContact CZ-CD2 3.54Å; F262-H281 AromaticContact CE2-NE2 3.72Å; F262-I309 HydrophobicContact CZ-CD1 4.1Å; F262-I309 HydrophobicContact CZ-CG1 4.1Å
263	C	93.9	Very high	95.3	Very high	33 Å²	33	62.7 Å²	62.7	22%	0.223	33%	0.331	C	S	.	.			trans	-68.5	111.8	172.4	-177.9	0	0	0	0	108.9	E261 S271 W272	E261-C263 PolarHBondContact O-N 3.38Å; C263-S271 WeakPolarHBondContact O-CB 3.3Å; C263-W272 PolarHBondContact O-N 3.25Å
264	T	95.4	Very high	95.3	Very high	54 Å²	54	67.5 Å²	67.5	33%	0.331	35%	0.354	S	S	.	.			trans	-110.1	15.8	178.4	61.5	0	0	0	0	114.2	F262 P266 W272 E274 V277	F262-T264 HydrophobicContact CB-CG2 4.46Å; F262-T264 PolarHBondContact O-N 2.89Å; F262-T264 VanDerWaalsContact O-N 3.15Å; T264-P266 VanDerWaalsContact O-CD 3.23Å; T264-P266 WeakPolarHBondContact O-CD 3.39Å; T264-W272 WeakPolarHBondContact CA-O 3.29Å; T264-W272 WeakPolarHBondContact CB-O 3.42Å; T264-W272 HydrophobicContact CG2-CB 4.18Å; T264-W272 WeakPolarHBondContact CG2-O 3.25Å; T264-E274 PolarHBondContact OG1-OE1 3.24Å; T264-V277 HydrophobicContact CG2-CG2 4.25Å
265	D	94.1	Very high	95.2	Very high	80 Å²	80	69.5 Å²	69.5	43%	0.428	38%	0.376	S	S	.	.			trans	-72.1	113.2	175.5	-177	2.1	0	0	0	110.9	E267 T268 S271	D265-E267 PolarHBondContact O-N 2.74Å; D265-E267 VanDerWaalsContact O-N 3.13Å; D265-E267 PolarHBondContact OD1-N 2.89Å; D265-E267 VanDerWaalsContact OD1-N 3.09Å; D265-T268 PolarHBondContact O-N 2.9Å; D265-T268 PolarHBondContact OD2-OG1 3.41Å; D265-S271 WeakPolarHBondContact O-CB 3.49Å; D265-S271 PolarHBondContact O-OG 2.86Å
266	P	91.3	Very high	95.2	Very high	111 Å²	111	70.3 Å²	70.3	72%	0.721	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.1	-178.3	-21.1	34.2	0	0	0	114.4	T264 T268	T264-P266 VanDerWaalsContact O-CD 3.23Å; T264-P266 WeakPolarHBondContact O-CD 3.39Å; P266-T268 VanDerWaalsContact C-N 3.34Å
267	E	92.9	Very high	95.2	Very high	168 Å²	168	69.2 Å²	69.2	79%	0.785	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-16	178.1	-58.8	-61	136.7	0	0	112.4	D265	D265-E267 PolarHBondContact O-N 2.74Å; D265-E267 VanDerWaalsContact O-N 3.13Å; D265-E267 PolarHBondContact OD1-N 2.89Å; D265-E267 VanDerWaalsContact OD1-N 3.09Å
268	T	93.6	Very high	95.2	Very high	42 Å²	42	70 Å²	70	26%	0.258	39%	0.388	S	S	.	.	S	Bend	trans	-85.1	125.3	177.1	-61.3	0	0	0	0	109.8	D265 P266 S271	D265-T268 PolarHBondContact O-N 2.9Å; D265-T268 PolarHBondContact OD2-OG1 3.41Å; P266-T268 VanDerWaalsContact C-N 3.34Å; T268-S271 VanDerWaalsContact O-CB 3.25Å; T268-S271 WeakPolarHBondContact O-CB 3.12Å; T268-S271 PolarHBondContact O-N 2.77Å; T268-S271 PolarHBondContact O-OG 3.09Å; T268-S271 VanDerWaalsContact O-OG 3.08Å
269	P	94.9	Very high	95.3	Very high	59 Å²	59	66.3 Å²	66.3	38%	0.383	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	144.4	173.8	-26	34.7	0	0	0	111.8	E226 S271	E226-P269 HydrophobicContact CG-CB 4.27Å; E226-P269 HydrophobicContact CG-CG 4.49Å; P269-S271 PolarHBondContact O-N 3.39Å
270	Y	97.6	Very high	95.5	Very high	44 Å²	44	61.9 Å²	61.9	17%	0.173	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	14.6	179.4	-56	-76.5	0	0	0	115.8	E226 L229 A230 E233 V252 K253 E254	E226-Y270 HydrophobicContact CG-CE2 4.31Å; L229-Y270 HydrophobicContact CB-CD1 4.03Å; L229-Y270 HydrophobicContact CB-CD2 3.57Å; L229-Y270 HydrophobicContact CB-CE1 4.14Å; L229-Y270 HydrophobicContact CB-CE2 3.67Å; L229-Y270 HydrophobicContact CB-CG 3.77Å; L229-Y270 HydrophobicContact CD1-CD2 3.86Å; L229-Y270 HydrophobicContact CD1-CG 3.86Å; L229-Y270 HydrophobicContact CG-CD2 4.36Å; L229-Y270 HydrophobicContact CG-CG 4.37Å; A230-Y270 WeakPolarHBondContact CA-OH 3.29Å; E233-Y270 HydrophobicContact CB-CE1 4.23Å; E233-Y270 VanDerWaalsContact OE2-CE1 3.31Å; E233-Y270 WeakPolarHBondContact OE2-CE1 3.49Å; E233-Y270 PolarHBondContact OE2-OH 3.14Å; V252-Y270 HydrophobicContact CB-CD1 4.33Å; V252-Y270 HydrophobicContact CB-CE1 4.42Å; V252-Y270 HydrophobicContact CG1-CD1 4.02Å; V252-Y270 HydrophobicContact CG1-CE1 4.17Å; K253-Y270 WeakPolarHBondContact CA-O 3.47Å; K253-Y270 WeakPolarHBondContact CD-O 3.37Å; E254-Y270 PolarHBondContact N-O 2.94Å
271	S	97.3	Very high	95.9	Very high	16 Å²	16	57.2 Å²	57.2	11%	0.112	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-63.6	156.2	174.7	67.2	0	0	0	0	112.5	K253 C263 D265 T268 P269	K253-S271 WeakPolarHBondContact CD-O 3.16Å; K253-S271 PolarHBondContact NZ-O 2.83Å; C263-S271 WeakPolarHBondContact O-CB 3.3Å; D265-S271 WeakPolarHBondContact O-CB 3.49Å; D265-S271 PolarHBondContact O-OG 2.86Å; T268-S271 VanDerWaalsContact O-CB 3.25Å; T268-S271 WeakPolarHBondContact O-CB 3.12Å; T268-S271 PolarHBondContact O-N 2.77Å; T268-S271 PolarHBondContact O-OG 3.09Å; T268-S271 VanDerWaalsContact O-OG 3.08Å; P269-S271 PolarHBondContact O-N 3.39Å
272	W	98.4	Very high	96.3	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.008	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-82.8	140.4	175.9	-67.3	77	0	0	0	110.7	L199 Y220 T222 K253 E254 F262 C263 T264 E276 V277 L280	L199-W272 HydrophobicContact CD1-CH2 4.18Å; Y220-W272 HydrophobicContact CD1-CE3 4.42Å; Y220-W272 AromaticContact CD1-CH2 3.62Å; Y220-W272 HydrophobicContact CD1-CH2 3.62Å; Y220-W272 AromaticContact CD1-CZ3 3.44Å; Y220-W272 HydrophobicContact CD1-CZ3 3.44Å; Y220-W272 VanDerWaalsContact CD1-CZ3 3.44Å; Y220-W272 HydrophobicContact CE1-CE3 4.46Å; Y220-W272 HydrophobicContact CE1-CH2 4.36Å; Y220-W272 AromaticContact CE1-CZ3 3.72Å; Y220-W272 HydrophobicContact CE1-CZ3 3.72Å; Y220-W272 AromaticContact CG-CH2 3.77Å; Y220-W272 HydrophobicContact CG-CH2 3.77Å; Y220-W272 AromaticContact CG-CZ3 3.9Å; Y220-W272 HydrophobicContact CG-CZ3 3.9Å; T222-W272 HydrophobicContact CG2-CH2 4.19Å; T222-W272 HydrophobicContact CG2-CZ2 3.6Å; K253-W272 HydrophobicContact CB-CD2 4.13Å; K253-W272 VanDerWaalsContact CB-CE2 3.48Å; K253-W272 HydrophobicContact CB-CH2 4.39Å; K253-W272 HydrophobicContact CB-CZ2 3.65Å; K253-W272 HydrophobicContact CG-CD2 4.11Å; K253-W272 HydrophobicContact CG-CE3 4.41Å; K253-W272 HydrophobicContact CG-CH2 4.43Å; K253-W272 HydrophobicContact CG-CZ2 4.12Å; E254-W272 PolarHBondContact O-NE1 2.64Å; F262-W272 HydrophobicContact CB-CB 4.32Å; F262-W272 HydrophobicContact CB-CG 4.12Å; F262-W272 AromaticContact CD1-CD1 3.91Å; F262-W272 AromaticContact CD1-CD2 3.79Å; F262-W272 HydrophobicContact CD1-CD2 3.79Å; F262-W272 AromaticContact CD1-CE2 3.56Å; F262-W272 HydrophobicContact CD1-CE3 4.41Å; F262-W272 HydrophobicContact CD1-CG 4.01Å; F262-W272 HydrophobicContact CD1-CZ2 4Å; F262-W272 AromaticContact CD1-NE1 3.63Å; F262-W272 HydrophobicContact CE1-CD2 4.35Å; F262-W272 AromaticContact CE1-CE2 3.94Å; F262-W272 HydrophobicContact CE1-CH2 4.23Å; F262-W272 AromaticContact CE1-CZ2 3.89Å; F262-W272 HydrophobicContact CE1-CZ2 3.89Å; F262-W272 HydrophobicContact CG-CG 4.44Å; C263-W272 PolarHBondContact O-N 3.25Å; T264-W272 WeakPolarHBondContact CA-O 3.29Å; T264-W272 WeakPolarHBondContact CB-O 3.42Å; T264-W272 HydrophobicContact CG2-CB 4.18Å; T264-W272 WeakPolarHBondContact CG2-O 3.25Å; W272-E276 HydrophobicContact CE3-CB 3.92Å; W272-E276 HydrophobicContact CZ3-CB 4.44Å; W272-V277 HydrophobicContact CB-CG2 3.77Å; W272-V277 HydrophobicContact CD2-CG2 4.41Å; W272-V277 HydrophobicContact CE3-CG2 4.18Å; W272-V277 HydrophobicContact CG-CG2 4.29Å; W272-L280 HydrophobicContact CH2-CD2 4.16Å; W272-L280 HydrophobicContact CZ3-CB 4.49Å; W272-L280 HydrophobicContact CZ3-CD2 4.19Å
273	S	97.8	Very high	96.4	Very high	51 Å²	51	55.1 Å²	55.1	36%	0.357	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-84.7	151.6	161.2	61.8	0	0	0	0	110.8	A275 E276 V277	S273-A275 PolarHBondContact O-N 2.88Å; S273-A275 VanDerWaalsContact O-N 3.13Å; S273-E276 WeakPolarHBondContact CB-OE2 3.25Å; S273-E276 PolarHBondContact N-OE2 2.72Å; S273-E276 WeakPolarHBondContact O-CA 3.48Å; S273-E276 WeakPolarHBondContact O-CB 3.43Å; S273-E276 PolarHBondContact O-N 2.77Å; S273-E276 WeakPolarHBondContact OG-CB 3.35Å; S273-E276 WeakPolarHBondContact OG-CG 3.18Å; S273-E276 PolarHBondContact OG-N 2.94Å; S273-E276 PolarHBondContact OG-OE2 3.02Å; S273-V277 PolarHBondContact O-N 3.35Å
274	E	96.9	Very high	96.6	Very high	131 Å²	131	53.6 Å²	53.6	61%	0.612	30%	0.304	S	S	*	.	H	α-helix	trans	-52.4	-35.9	172.4	-65.3	-60.3	151.3	0	0	112.4	T264 E276 A278	T264-E274 PolarHBondContact OG1-OE1 3.24Å; E274-E276 VanDerWaalsContact C-N 3.35Å; E274-E276 PolarHBondContact O-N 3.08Å; E274-A278 VanDerWaalsContact O-CB 3.3Å; E274-A278 WeakPolarHBondContact O-CB 3.44Å; E274-A278 PolarHBondContact O-N 2.93Å
275	A	97.6	Very high	96.7	Very high	74 Å²	74	53.1 Å²	53.1	61%	0.612	30%	0.302	S	S	*	.	H	α-helix	trans	-67.6	-33.3	176.5	0	0	0	0	0	112.8	S273 N279	S273-A275 PolarHBondContact O-N 2.88Å; S273-A275 VanDerWaalsContact O-N 3.13Å; A275-N279 VanDerWaalsContact O-CB 3.24Å; A275-N279 WeakPolarHBondContact O-CB 3.38Å; A275-N279 PolarHBondContact O-N 3.45Å
276	E	98	Very high	96.9	Very high	19 Å²	19	49.6 Å²	49.6	9%	0.089	28%	0.283	C	S	.	.	H	α-helix	trans	-74.4	-42.2	176.1	-73.7	162.2	148.8	0	0	111.6	Y220 K251 K253 W272 S273 E274 N279 L280	Y220-E276 HydrophobicContact CE1-CB 4.06Å; Y220-E276 HydrophobicContact CE1-CG 4.17Å; K251-E276 HydrophobicContact CD-CG 4.45Å; K251-E276 WeakPolarHBondContact CD-OE1 3.15Å; K251-E276 IonicContact NZ-OE1 2.8Å; K251-E276 PolarHBondContact NZ-OE1 3.2Å; K253-E276 VanDerWaalsContact CE-CD 3.46Å; K253-E276 VanDerWaalsContact CE-OE1 3.29Å; K253-E276 WeakPolarHBondContact CE-OE1 3.44Å; K253-E276 VanDerWaalsContact CE-OE2 3.22Å; K253-E276 WeakPolarHBondContact CE-OE2 3Å; K253-E276 IonicContact NZ-OE1 3.48Å; K253-E276 PolarHBondContact NZ-OE1 3.48Å; K253-E276 IonicContact NZ-OE2 2.67Å; K253-E276 PolarHBondContact NZ-OE2 3.33Å; W272-E276 HydrophobicContact CE3-CB 3.92Å; W272-E276 HydrophobicContact CZ3-CB 4.44Å; S273-E276 WeakPolarHBondContact CB-OE2 3.25Å; S273-E276 PolarHBondContact N-OE2 2.72Å; S273-E276 WeakPolarHBondContact O-CA 3.48Å; S273-E276 WeakPolarHBondContact O-CB 3.43Å; S273-E276 PolarHBondContact O-N 2.77Å; S273-E276 WeakPolarHBondContact OG-CB 3.35Å; S273-E276 WeakPolarHBondContact OG-CG 3.18Å; S273-E276 PolarHBondContact OG-N 2.94Å; S273-E276 PolarHBondContact OG-OE2 3.02Å; E274-E276 VanDerWaalsContact C-N 3.35Å; E274-E276 PolarHBondContact O-N 3.08Å; E276-N279 WeakPolarHBondContact O-CB 3.34Å; E276-N279 PolarHBondContact O-N 3.39Å; E276-L280 WeakPolarHBondContact O-CB 3.12Å; E276-L280 PolarHBondContact O-N 3.28Å
277	V	98.1	Very high	97.3	Very high	16 Å²	16	44.3 Å²	44.3	10%	0.097	25%	0.249	C	C	.	.	H	α-helix	trans	-60.5	-47.2	173.9	179.1	0	0	0	0	110.3	F262 T264 W272 S273 N279 L280 H281	F262-V277 HydrophobicContact CB-CG2 3.96Å; F262-V277 HydrophobicContact CD2-CG1 3.88Å; F262-V277 HydrophobicContact CD2-CG2 4.17Å; F262-V277 HydrophobicContact CE2-CG1 4.18Å; F262-V277 HydrophobicContact CG-CG2 4.01Å; T264-V277 HydrophobicContact CG2-CG2 4.25Å; W272-V277 HydrophobicContact CB-CG2 3.77Å; W272-V277 HydrophobicContact CD2-CG2 4.41Å; W272-V277 HydrophobicContact CE3-CG2 4.18Å; W272-V277 HydrophobicContact CG-CG2 4.29Å; S273-V277 PolarHBondContact O-N 3.35Å; V277-N279 VanDerWaalsContact C-N 3.33Å; V277-N279 PolarHBondContact O-N 3.45Å; V277-L280 WeakPolarHBondContact O-CB 3.43Å; V277-L280 PolarHBondContact O-N 2.87Å; V277-H281 PolarHBondContact O-N 2.95Å
278	A	97.8	Very high	97.6	Very high	47 Å²	47	36.4 Å²	36.4	39%	0.388	21%	0.212	S	C	.	.	H	α-helix	trans	-60.9	-41.6	174.9	0	0	0	0	0	111.9	E274 L280 H281 D282	E274-A278 VanDerWaalsContact O-CB 3.3Å; E274-A278 WeakPolarHBondContact O-CB 3.44Å; E274-A278 PolarHBondContact O-N 2.93Å; A278-L280 PolarHBondContact O-N 2.92Å; A278-H281 PolarHBondContact O-N 2.71Å; A278-D282 VanDerWaalsContact O-CB 3.24Å; A278-D282 WeakPolarHBondContact O-CB 3.37Å; A278-D282 PolarHBondContact O-N 3.07Å
279	N	98.1	Very high	97.8	Very high	34 Å²	34	34.4 Å²	34.4	18%	0.182	20%	0.199	C	C	.	.	H	α-helix	trans	-62.3	-43	177.3	-174.5	-104.7	0	0	0	112.3	R218 Y220 A275 E276 V277 D282 H283	R218-N279 VanDerWaalsContact NH1-CG 3.27Å; R218-N279 PolarHBondContact NH1-OD1 2.92Å; Y220-N279 PolarHBondContact OH-OD1 2.84Å; Y220-N279 VanDerWaalsContact OH-OD1 3.13Å; A275-N279 VanDerWaalsContact O-CB 3.24Å; A275-N279 WeakPolarHBondContact O-CB 3.38Å; A275-N279 PolarHBondContact O-N 3.45Å; E276-N279 WeakPolarHBondContact O-CB 3.34Å; E276-N279 PolarHBondContact O-N 3.39Å; V277-N279 VanDerWaalsContact C-N 3.33Å; V277-N279 PolarHBondContact O-N 3.45Å; N279-D282 PolarHBondContact O-N 3.2Å; N279-H283 PolarHBondContact ND2-ND1 2.74Å; N279-H283 WeakPolarHBondContact O-CB 3.35Å; N279-H283 PolarHBondContact O-N 3.03Å; N279-H283 PolarHBondContact O-ND1 3.08Å
280	L	98.2	Very high	98	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-58.5	-54.8	175.8	178.7	73.9	0	0	0	110.2	L199 Y220 F262 W272 E276 V277 A278 D282 H283 C284	L199-L280 HydrophobicContact CB-CD1 3.96Å; L199-L280 HydrophobicContact CD1-CD1 4.22Å; L199-L280 HydrophobicContact CD2-CD1 4.35Å; L199-L280 HydrophobicContact CD2-CD2 4.4Å; L199-L280 HydrophobicContact CG-CD1 4.42Å; Y220-L280 HydrophobicContact CD2-CD1 3.87Å; Y220-L280 HydrophobicContact CE2-CB 4.4Å; Y220-L280 HydrophobicContact CE2-CD1 4.35Å; F262-L280 HydrophobicContact CE1-CD2 3.93Å; F262-L280 HydrophobicContact CE2-CD2 4.43Å; F262-L280 HydrophobicContact CZ-CD2 3.54Å; W272-L280 HydrophobicContact CH2-CD2 4.16Å; W272-L280 HydrophobicContact CZ3-CB 4.49Å; W272-L280 HydrophobicContact CZ3-CD2 4.19Å; E276-L280 WeakPolarHBondContact O-CB 3.12Å; E276-L280 PolarHBondContact O-N 3.28Å; V277-L280 WeakPolarHBondContact O-CB 3.43Å; V277-L280 PolarHBondContact O-N 2.87Å; A278-L280 PolarHBondContact O-N 2.92Å; L280-D282 PolarHBondContact O-N 2.72Å; L280-H283 PolarHBondContact O-N 3.26Å; L280-C284 HydrophobicContact CD1-CB 3.83Å; L280-C284 HydrophobicContact CG-CB 4.35Å; L280-C284 WeakPolarHBondContact O-CB 3.43Å; L280-C284 PolarHBondContact O-N 3.27Å
281	H	97.4	Very high	97.9	Very high	36 Å²	36	30.7 Å²	30.7	17%	0.167	18%	0.181	C	C	.	.	H	α-helix	trans	-60	-35	179.9	-66.6	166.2	0	0	0	113	F262 V277 A278 L313 K314	F262-H281 AromaticContact CE2-NE2 3.72Å; V277-H281 PolarHBondContact O-N 2.95Å; A278-H281 PolarHBondContact O-N 2.71Å; H281-L313 CarbonylContact O-C 3.54Å; H281-L313 WeakPolarHBondContact O-CA 3.32Å; H281-K314 PolarHBondContact O-N 3.34Å
282	D	97.7	Very high	97.9	Very high	55 Å²	55	30.3 Å²	30.3	29%	0.294	18%	0.178	S	C	.	.	H	α-helix	trans	-80.2	-29.5	-176.3	-76.2	6.3	0	0	0	114	A278 N279 L280 K314 N315	A278-D282 VanDerWaalsContact O-CB 3.24Å; A278-D282 WeakPolarHBondContact O-CB 3.37Å; A278-D282 PolarHBondContact O-N 3.07Å; N279-D282 PolarHBondContact O-N 3.2Å; L280-D282 PolarHBondContact O-N 2.72Å; D282-K314 HydrophobicContact CB-CD 4.44Å; D282-K314 WeakPolarHBondContact OD1-CD 3.45Å; D282-K314 WeakPolarHBondContact OD1-CE 3.41Å; D282-K314 IonicContact OD1-NZ 3.68Å; D282-K314 PolarHBondContact OD1-NZ 3.09Å; D282-K314 IonicContact OD2-NZ 2.67Å; D282-K314 PolarHBondContact OD2-NZ 3.31Å; D282-N315 PolarHBondContact O-ND2 3.32Å
283	H	97.8	Very high	97.7	Very high	86 Å²	86	30.8 Å²	30.8	40%	0.398	18%	0.18	S	C	.	.	H	α-helix	trans	-128.4	-13.9	-166.5	-55.4	88.5	0	0	0	114.9	T197 N279 L280 T285	T197-H283 WeakPolarHBondContact CB-O 3.35Å; N279-H283 PolarHBondContact ND2-ND1 2.74Å; N279-H283 WeakPolarHBondContact O-CB 3.35Å; N279-H283 PolarHBondContact O-N 3.03Å; N279-H283 PolarHBondContact O-ND1 3.08Å; L280-H283 PolarHBondContact O-N 3.26Å; H283-T285 PolarHBondContact O-N 2.78Å
284	C	98.2	Very high	97.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	126.3	179.8	-171	0	0	0	0	110.3	T197 L280 V286 L313	T197-C284 WeakPolarHBondContact O-CA 3.01Å; L280-C284 HydrophobicContact CD1-CB 3.83Å; L280-C284 HydrophobicContact CG-CB 4.35Å; L280-C284 WeakPolarHBondContact O-CB 3.43Å; L280-C284 PolarHBondContact O-N 3.27Å; C284-V286 PolarHBondContact SG-O 3.46Å; C284-V286 VanDerWaalsContact SG-O 3.34Å; C284-L313 HydrophobicContact CB-CD1 4.16Å; C284-L313 HydrophobicContact CB-CD2 3.79Å
285	T	97.9	Very high	97.4	Very high	44 Å²	44	28.1 Å²	28.1	27%	0.27	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	-13.9	178.8	44.9	0	0	0	0	111.9	T197 H283 N315 C317 T318	T197-T285 PolarHBondContact O-N 3.15Å; T197-T285 VanDerWaalsContact O-N 3.11Å; H283-T285 PolarHBondContact O-N 2.78Å; T285-N315 HydrophobicContact CG2-CB 4.39Å; T285-C317 CarbonylContact O-C 3.59Å; T285-C317 VanDerWaalsContact O-CA 3.29Å; T285-C317 WeakPolarHBondContact O-CA 3.01Å; T285-T318 PolarHBondContact O-N 3.06Å
286	V	98.7	Very high	97.3	Very high	7 Å²	7	27.8 Å²	27.8	4%	0.042	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	131.9	179	-179.3	0	0	0	0	109.5	F193 C196 T197 V198 L199 C284 T318 Y320	F193-V286 HydrophobicContact CD1-CG1 4.27Å; F193-V286 HydrophobicContact CD1-CG2 4.21Å; F193-V286 HydrophobicContact CE1-CG1 4.01Å; F193-V286 HydrophobicContact CE1-CG2 4.42Å; C196-V286 HydrophobicContact CB-CG2 4.2Å; T197-V286 PolarHBondContact O-N 3.47Å; V198-V286 CarbonylContact C-O 3.54Å; V198-V286 VanDerWaalsContact CA-O 3.28Å; V198-V286 WeakPolarHBondContact CA-O 3.44Å; V198-V286 HydrophobicContact CG1-CB 4.19Å; V198-V286 HydrophobicContact CG1-CG1 4.02Å; V198-V286 HydrophobicContact CG2-CB 4.1Å; L199-V286 PolarHBondContact N-O 3.23Å; C284-V286 PolarHBondContact SG-O 3.46Å; C284-V286 VanDerWaalsContact SG-O 3.34Å; V286-T318 CarbonylContact C-O 3.53Å; V286-T318 VanDerWaalsContact CA-O 3.24Å; V286-T318 WeakPolarHBondContact CA-O 3.33Å; V286-Y320 HydrophobicContact CG1-CD2 3.81Å; V286-Y320 HydrophobicContact CG1-CE2 3.93Å
287	I	98.8	Very high	97.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	144	167.3	-56.9	176.7	0	0	0	107.2	L199 L201 L306 I309 T310 T318 V319 Y320	L199-I287 HydrophobicContact CB-CG1 4.33Å; L199-I287 CarbonylContact O-C 3.5Å; L199-I287 VanDerWaalsContact O-CA 3.25Å; L199-I287 WeakPolarHBondContact O-CA 3.4Å; L201-I287 HydrophobicContact CD1-CG2 3.87Å; L201-I287 HydrophobicContact CG-CG2 4.01Å; I287-L306 HydrophobicContact CB-CD1 4.46Å; I287-L306 HydrophobicContact CD1-CD1 3.73Å; I287-L306 HydrophobicContact CG2-CD1 3.99Å; I287-I309 HydrophobicContact CD1-CG2 4.03Å; I287-T310 HydrophobicContact CD1-CG2 4.09Å; I287-T318 PolarHBondContact N-O 2.89Å; I287-V319 HydrophobicContact CB-CB 4.42Å; I287-V319 HydrophobicContact CB-CG1 4.01Å; I287-V319 HydrophobicContact CB-CG2 4.23Å; I287-V319 HydrophobicContact CG2-CG1 4.07Å; I287-V319 CarbonylContact O-C 3.58Å; I287-V319 WeakPolarHBondContact O-CA 3.35Å; I287-Y320 PolarHBondContact O-N 2.99Å
288	M	98.8	Very high	97.1	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	151.7	176.1	66	-176.6	-173.1	0	0	112.2	L182 I186 V198 L199 E200 L201 A208 M212 V219 Y320	L182-M288 HydrophobicContact CD2-CB 3.97Å; L182-M288 HydrophobicContact CD2-CG 4.22Å; L182-M288 HydrophobicContact CD2-SD 4.02Å; I186-M288 HydrophobicContact CD1-SD 4.05Å; V198-M288 HydrophobicContact CG1-CE 4.2Å; V198-M288 HydrophobicContact CG1-CG 4.12Å; V198-M288 HydrophobicContact CG1-SD 4.05Å; L199-M288 PolarHBondContact O-N 3.36Å; E200-M288 CarbonylContact C-O 3.58Å; E200-M288 VanDerWaalsContact CA-O 3.29Å; E200-M288 WeakPolarHBondContact CA-O 3.44Å; E200-M288 HydrophobicContact CB-CE 3.85Å; E200-M288 HydrophobicContact CB-CG 4.04Å; E200-M288 HydrophobicContact CG-CE 4.04Å; E200-M288 HydrophobicContact CG-CG 4.01Å; L201-M288 PolarHBondContact N-O 2.96Å; A208-M288 HydrophobicContact CB-CE 4.45Å; M212-M288 HydrophobicContact CB-CE 3.7Å; M212-M288 HydrophobicContact CB-SD 4.36Å; M212-M288 HydrophobicContact CE-CE 4.39Å; M212-M288 HydrophobicContact CE-SD 3.53Å; M212-M288 VanDerWaalsContact CE-SD 3.53Å; M212-M288 HydrophobicContact CG-CE 4.03Å; M212-M288 HydrophobicContact CG-SD 4.38Å; V219-M288 HydrophobicContact CG1-CE 4.33Å; M288-Y320 CarbonylContact C-O 3.57Å; M288-Y320 VanDerWaalsContact CA-O 3.24Å; M288-Y320 WeakPolarHBondContact CA-O 3.33Å
289	A	98.7	Very high	97.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	143.6	171	0	0	0	0	0	109.9	L201 V292 Y320 F321 S322	L201-A289 HydrophobicContact CB-CB 4.19Å; L201-A289 WeakPolarHBondContact O-CB 3.08Å; A289-V292 HydrophobicContact CB-CG1 4.09Å; A289-V292 HydrophobicContact CB-CG2 3.71Å; A289-Y320 PolarHBondContact N-O 3.48Å; A289-F321 HydrophobicContact CB-CD1 4.04Å; A289-F321 HydrophobicContact CB-CE1 4.35Å; A289-F321 WeakPolarHBondContact O-CA 3.35Å; A289-S322 PolarHBondContact O-N 3.13Å
290	A	98.2	Very high	97.1	Very high	12 Å²	12	32.3 Å²	32.3	10%	0.099	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	123.6	-178.8	0	0	0	0	0	111.2	A179 L182 V292 S322	A179-A290 HydrophobicContact CB-CB 4.16Å; L182-A290 HydrophobicContact CD2-CB 4.06Å; A290-V292 PolarHBondContact O-N 3.46Å; A290-S322 WeakPolarHBondContact CA-O 3.3Å
291	D	95.8	Very high	97.1	Very high	13 Å²	13	32.3 Å²	32.3	7%	0.07	17%	0.167	C	C	.	.	S	Bend	trans	54.2	33.5	178.1	-70.4	-30.5	0	0	0	115.5	W176 G178 S322 I323 E324	W176-D291 HydrophobicContact CB-CB 3.81Å; W176-D291 WeakPolarHBondContact CB-OD2 3.46Å; W176-D291 HydrophobicContact CG-CB 4.22Å; G178-D291 WeakPolarHBondContact CA-OD2 3.41Å; G178-D291 PolarHBondContact N-OD2 3.06Å; D291-S322 PolarHBondContact N-O 3.09Å; D291-I323 VanDerWaalsContact OD1-CA 3.29Å; D291-I323 WeakPolarHBondContact OD1-CA 3.32Å; D291-E324 PolarHBondContact OD1-N 2.92Å
292	V	96.5	Very high	97.1	Very high	8 Å²	8	30.7 Å²	30.7	5%	0.048	16%	0.159	C	C	.	.			trans	-85.3	-5.9	178.4	-62.9	0	0	0	0	114.3	W257 A289 A290 Y294	W257-V292 HydrophobicContact CH2-CB 3.79Å; W257-V292 HydrophobicContact CH2-CG1 3.87Å; W257-V292 HydrophobicContact CZ2-CG1 4.45Å; W257-V292 HydrophobicContact CZ3-CB 4.47Å; A289-V292 HydrophobicContact CB-CG1 4.09Å; A289-V292 HydrophobicContact CB-CG2 3.71Å; A290-V292 PolarHBondContact O-N 3.46Å; V292-Y294 PolarHBondContact O-N 3.47Å
293	F	96.1	Very high	97.1	Very high	13 Å²	13	28.6 Å²	28.6	6%	0.057	15%	0.148	C	C	.	.			trans	-101.7	82.4	-172.1	-53.5	-70.3	0	0	0	111.4	T299 M302 F303 F321 I323 F344	F293-T299 HydrophobicContact CD1-CG2 3.71Å; F293-T299 HydrophobicContact CE1-CG2 4.2Å; F293-M302 HydrophobicContact CD1-CE 4.39Å; F293-M302 HydrophobicContact CE1-CE 3.22Å; F293-M302 HydrophobicContact CZ-CE 3.51Å; F293-F303 HydrophobicContact CE1-CD2 4.44Å; F293-F303 AromaticContact CE1-CE2 3.66Å; F293-F303 HydrophobicContact CE1-CE2 3.66Å; F293-F303 HydrophobicContact CE1-CZ 4.29Å; F293-F303 HydrophobicContact CZ-CE2 4.32Å; F293-F321 HydrophobicContact CE2-CB 4.06Å; F293-F321 HydrophobicContact CE2-CD1 4.11Å; F293-F321 HydrophobicContact CE2-CG 4.15Å; F293-F321 HydrophobicContact CZ-CB 4.45Å; F293-F321 AromaticContact CZ-CD1 3.79Å; F293-F321 HydrophobicContact CZ-CD1 3.79Å; F293-F321 HydrophobicContact CZ-CE1 4.09Å; F293-F321 HydrophobicContact CZ-CG 4.04Å; F293-I323 HydrophobicContact CB-CD1 3.61Å; F293-I323 HydrophobicContact CB-CG1 4.45Å; F293-I323 HydrophobicContact CD2-CB 4.23Å; F293-I323 HydrophobicContact CD2-CD1 3.66Å; F293-I323 HydrophobicContact CD2-CG1 4.15Å; F293-I323 HydrophobicContact CG-CD1 3.99Å; F293-F344 HydrophobicContact CB-CB 4.23Å; F293-F344 HydrophobicContact CD1-CB 4.15Å; F293-F344 AromaticContact CD1-CD2 3.62Å; F293-F344 HydrophobicContact CD1-CD2 3.62Å; F293-F344 HydrophobicContact CD1-CE2 4.4Å; F293-F344 HydrophobicContact CD1-CG 4.16Å; F293-F344 AromaticContact CD2-CD2 3.9Å; F293-F344 HydrophobicContact CD2-CD2 3.9Å; F293-F344 HydrophobicContact CD2-CE2 4.11Å; F293-F344 HydrophobicContact CD2-CG 4.26Å; F293-F344 AromaticContact CE1-CD2 3.43Å; F293-F344 HydrophobicContact CE1-CD2 3.43Å; F293-F344 VanDerWaalsContact CE1-CD2 3.43Å; F293-F344 AromaticContact CE1-CE2 3.87Å; F293-F344 HydrophobicContact CE1-CE2 3.87Å; F293-F344 HydrophobicContact CE1-CG 4.39Å; F293-F344 AromaticContact CE2-CD2 3.74Å; F293-F344 HydrophobicContact CE2-CD2 3.74Å; F293-F344 AromaticContact CE2-CE2 3.56Å; F293-F344 HydrophobicContact CE2-CE2 3.56Å; F293-F344 HydrophobicContact CE2-CZ 4.21Å; F293-F344 HydrophobicContact CG-CB 4.16Å; F293-F344 AromaticContact CG-CD2 3.83Å; F293-F344 HydrophobicContact CG-CD2 3.83Å; F293-F344 HydrophobicContact CG-CE2 4.48Å; F293-F344 HydrophobicContact CG-CG 4.06Å; F293-F344 AromaticContact CZ-CD2 3.49Å; F293-F344 HydrophobicContact CZ-CD2 3.49Å; F293-F344 VanDerWaalsContact CZ-CD2 3.49Å; F293-F344 AromaticContact CZ-CE2 3.42Å; F293-F344 HydrophobicContact CZ-CE2 3.42Å; F293-F344 VanDerWaalsContact CZ-CE2 3.42Å; F293-F344 HydrophobicContact CZ-CZ 4.45Å
294	Y	92.4	Very high	97.1	Very high	68 Å²	68	31.1 Å²	31.1	27%	0.267	15%	0.154	S	C	.	.	S	Bend	trans	-133.3	-9.3	-178.7	60.2	-94.4	0	0	0	114	L168 V171 V292 L298 R326	L168-Y294 HydrophobicContact CD1-CD2 4.09Å; L168-Y294 HydrophobicContact CD1-CE2 4.37Å; V171-Y294 HydrophobicContact CG2-CE1 4.21Å; V171-Y294 HydrophobicContact CG2-CE2 4.33Å; V292-Y294 PolarHBondContact O-N 3.47Å; Y294-L298 HydrophobicContact CE2-CD1 3.8Å; Y294-L298 WeakPolarHBondContact OH-CD1 3.49Å; Y294-R326 VanDerWaalsContact CB-NH1 3.33Å
295	D	94.3	Very high	97.1	Very high	58 Å²	58	31.1 Å²	31.1	31%	0.31	15%	0.154	S	C	.	.			trans	-140.2	137.3	178.8	176.6	-87.7	0	0	0	108.9	D297 L298 T299	D295-D297 WeakPolarHBondContact OD1-CB 3.23Å; D295-D297 PolarHBondContact OD1-N 3.02Å; D295-L298 HydrophobicContact CB-CB 4.14Å; D295-L298 HydrophobicContact CB-CD1 4.06Å; D295-L298 HydrophobicContact CB-CG 4.18Å; D295-L298 PolarHBondContact OD1-N 3.13Å; D295-T299 VanDerWaalsContact O-CB 3.25Å; D295-T299 WeakPolarHBondContact O-CB 3.43Å; D295-T299 PolarHBondContact O-N 3.03Å; D295-T299 PolarHBondContact O-OG1 2.9Å
296	D	95.3	Very high	97	Very high	67 Å²	67	29.1 Å²	29.1	36%	0.358	14%	0.142	S	C	.	.	H	α-helix	trans	-71.2	-38.7	-171.9	-71.3	-7.2	0	0	0	112	T299 D300 H343	D296-T299 PolarHBondContact O-N 2.93Å; D296-D300 WeakPolarHBondContact O-CB 3.36Å; D296-D300 PolarHBondContact O-N 3.4Å; D296-H343 PolarHBondContact O-NE2 2.93Å; D296-H343 VanDerWaalsContact OD1-CB 3.27Å; D296-H343 WeakPolarHBondContact OD1-CB 3.29Å; D296-H343 IonicContact OD1-CD2 3.81Å; D296-H343 PolarHBondContact OD1-CD2 3.36Å; D296-H343 IonicContact OD1-CG 2.98Å
297	D	96.3	Very high	96.9	Very high	116 Å²	116	33 Å²	33	62%	0.62	16%	0.156	S	C	*	.	H	α-helix	trans	-69.7	-40.4	-180	-72.1	-34.8	0	0	0	111.1	D295 A301	D295-D297 WeakPolarHBondContact OD1-CB 3.23Å; D295-D297 PolarHBondContact OD1-N 3.02Å; D297-A301 WeakPolarHBondContact O-CB 3.35Å; D297-A301 PolarHBondContact O-N 3Å
298	L	96.6	Very high	96.7	Very high	43 Å²	43	35.3 Å²	35.3	23%	0.225	17%	0.165	C	C	.	.	H	α-helix	trans	-66.9	-38.9	173.2	-68.8	-179.4	0	0	0	111.9	Y294 D295 A301 M302	Y294-L298 HydrophobicContact CE2-CD1 3.8Å; Y294-L298 WeakPolarHBondContact OH-CD1 3.49Å; D295-L298 HydrophobicContact CB-CB 4.14Å; D295-L298 HydrophobicContact CB-CD1 4.06Å; D295-L298 HydrophobicContact CB-CG 4.18Å; D295-L298 PolarHBondContact OD1-N 3.13Å; L298-A301 PolarHBondContact O-N 3.28Å; L298-M302 WeakPolarHBondContact O-CB 3.31Å; L298-M302 PolarHBondContact O-N 3.2Å
299	T	97.9	Very high	96.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.7	-47.1	176.4	-62.4	0	0	0	0	110.3	F293 D295 D296 A301 M302 F303 F344 I347	F293-T299 HydrophobicContact CD1-CG2 3.71Å; F293-T299 HydrophobicContact CE1-CG2 4.2Å; D295-T299 VanDerWaalsContact O-CB 3.25Å; D295-T299 WeakPolarHBondContact O-CB 3.43Å; D295-T299 PolarHBondContact O-N 3.03Å; D295-T299 PolarHBondContact O-OG1 2.9Å; D296-T299 PolarHBondContact O-N 2.93Å; T299-A301 PolarHBondContact O-N 2.86Å; T299-M302 PolarHBondContact O-N 3.4Å; T299-F303 HydrophobicContact CG2-CD2 4.12Å; T299-F303 HydrophobicContact CG2-CE2 4.11Å; T299-F303 WeakPolarHBondContact O-CD2 3.35Å; T299-F303 PolarHBondContact O-N 3.27Å; T299-F303 VanDerWaalsContact O-N 3.08Å; T299-F344 HydrophobicContact CG2-CB 4.41Å; T299-I347 HydrophobicContact CG2-CD1 3.73Å
300	D	97.9	Very high	96.5	Very high	52 Å²	52	35.4 Å²	35.4	28%	0.278	17%	0.165	S	C	.	.	H	α-helix	trans	-57.5	-46.3	173.6	-83.1	12.2	0	0	0	112.4	D296 F303 R304 H343 I347	D296-D300 WeakPolarHBondContact O-CB 3.36Å; D296-D300 PolarHBondContact O-N 3.4Å; D300-F303 PolarHBondContact O-N 2.95Å; D300-R304 WeakPolarHBondContact O-CG 3.43Å; D300-R304 PolarHBondContact O-N 2.94Å; D300-H343 IonicContact OD1-CD2 3.33Å; D300-H343 IonicContact OD1-CE1 3.53Å; D300-H343 PolarHBondContact OD1-CE1 3.4Å; D300-H343 IonicContact OD1-NE2 2.92Å; D300-H343 PolarHBondContact OD1-NE2 3.39Å; D300-I347 WeakPolarHBondContact OD1-CD1 3.4Å
301	A	98.1	Very high	96.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-64	-41	179.5	0	0	0	0	0	112.6	W257 L258 D297 L298 T299 R304 T305	W257-A301 HydrophobicContact CB-CB 3.84Å; L258-A301 HydrophobicContact CD2-CB 3.68Å; D297-A301 WeakPolarHBondContact O-CB 3.35Å; D297-A301 PolarHBondContact O-N 3Å; L298-A301 PolarHBondContact O-N 3.28Å; T299-A301 PolarHBondContact O-N 2.86Å; A301-R304 VanDerWaalsContact CA-NH2 3.34Å; A301-R304 PolarHBondContact O-N 3.35Å; A301-T305 WeakPolarHBondContact O-CB 3.2Å; A301-T305 PolarHBondContact O-N 3.33Å; A301-T305 PolarHBondContact O-OG1 3.12Å
302	M	97.9	Very high	96.2	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-62.2	-47.5	176.5	-169.4	-73.8	-67.9	0	0	110.6	L201 W257 F293 L298 T299 R304 T305 L306 F321	L201-M302 HydrophobicContact CD1-CG 4.19Å; L201-M302 HydrophobicContact CD1-SD 3.64Å; W257-M302 HydrophobicContact CD2-CB 3.8Å; W257-M302 HydrophobicContact CD2-CG 3.97Å; W257-M302 HydrophobicContact CE3-CB 3.67Å; W257-M302 HydrophobicContact CE3-CG 4.12Å; W257-M302 HydrophobicContact CG-CB 4.35Å; W257-M302 HydrophobicContact CH2-CB 4.46Å; W257-M302 HydrophobicContact CH2-CG 4.12Å; W257-M302 HydrophobicContact CZ2-CG 3.93Å; W257-M302 HydrophobicContact CZ3-CB 4.02Å; W257-M302 HydrophobicContact CZ3-CG 4.2Å; F293-M302 HydrophobicContact CD1-CE 4.39Å; F293-M302 HydrophobicContact CE1-CE 3.22Å; F293-M302 HydrophobicContact CZ-CE 3.51Å; L298-M302 WeakPolarHBondContact O-CB 3.31Å; L298-M302 PolarHBondContact O-N 3.2Å; T299-M302 PolarHBondContact O-N 3.4Å; M302-R304 PolarHBondContact O-N 3.27Å; M302-T305 CarbonylContact O-C 3.57Å; M302-T305 WeakPolarHBondContact O-CB 3.35Å; M302-T305 PolarHBondContact O-N 2.86Å; M302-T305 VanDerWaalsContact O-N 3.13Å; M302-L306 WeakPolarHBondContact O-CB 3.25Å; M302-L306 PolarHBondContact O-N 3.34Å; M302-L306 HydrophobicContact SD-CB 4.26Å; M302-F321 HydrophobicContact CE-CE1 3.94Å; M302-F321 HydrophobicContact CE-CZ 4.22Å; M302-F321 HydrophobicContact SD-CE1 4.43Å
303	F	97.6	Very high	96.1	Very high	12 Å²	12	39 Å²	39	5%	0.053	18%	0.182	C	C	.	.	H	α-helix	trans	-66.2	-34.4	178.6	-85.3	-82.4	0	0	0	113.2	F293 T299 D300 L306 Y307 F321 F344 I347 L348 L351	F293-F303 HydrophobicContact CE1-CD2 4.44Å; F293-F303 AromaticContact CE1-CE2 3.66Å; F293-F303 HydrophobicContact CE1-CE2 3.66Å; F293-F303 HydrophobicContact CE1-CZ 4.29Å; F293-F303 HydrophobicContact CZ-CE2 4.32Å; T299-F303 HydrophobicContact CG2-CD2 4.12Å; T299-F303 HydrophobicContact CG2-CE2 4.11Å; T299-F303 WeakPolarHBondContact O-CD2 3.35Å; T299-F303 PolarHBondContact O-N 3.27Å; T299-F303 VanDerWaalsContact O-N 3.08Å; D300-F303 PolarHBondContact O-N 2.95Å; F303-L306 HydrophobicContact CD1-CD2 4.07Å; F303-L306 HydrophobicContact CE1-CD2 4.3Å; F303-L306 PolarHBondContact O-N 3.35Å; F303-Y307 WeakPolarHBondContact O-CB 3.03Å; F303-Y307 PolarHBondContact O-N 2.87Å; F303-F321 HydrophobicContact CE1-CE2 4.23Å; F303-F321 HydrophobicContact CE1-CZ 4.23Å; F303-F321 HydrophobicContact CZ-CE2 4.23Å; F303-F321 HydrophobicContact CZ-CZ 4.33Å; F303-F344 AromaticContact CE2-CD2 3.96Å; F303-F344 HydrophobicContact CE2-CD2 3.96Å; F303-F344 HydrophobicContact CE2-CE2 4.4Å; F303-F344 HydrophobicContact CZ-CD2 4.01Å; F303-F344 HydrophobicContact CZ-CE2 4.03Å; F303-I347 HydrophobicContact CB-CG2 3.83Å; F303-I347 HydrophobicContact CD1-CG2 3.8Å; F303-I347 HydrophobicContact CD2-CB 4.14Å; F303-I347 HydrophobicContact CD2-CD1 4.08Å; F303-I347 HydrophobicContact CD2-CG2 3.51Å; F303-I347 HydrophobicContact CE1-CG2 4.19Å; F303-I347 HydrophobicContact CE2-CB 4.18Å; F303-I347 HydrophobicContact CE2-CG2 3.92Å; F303-I347 HydrophobicContact CG-CG2 3.44Å; F303-I347 VanDerWaalsContact CG-CG2 3.44Å; F303-I347 HydrophobicContact CZ-CG2 4.25Å; F303-L348 HydrophobicContact CE1-CD1 4.32Å; F303-L348 HydrophobicContact CZ-CB 4.43Å; F303-L348 HydrophobicContact CZ-CD1 4.41Å; F303-L351 HydrophobicContact CD1-CD2 4.06Å; F303-L351 HydrophobicContact CE1-CD2 3.88Å
304	R	97.1	Very high	96	Very high	139 Å²	139	45.1 Å²	45.1	53%	0.525	21%	0.208	S	C	.	.	H	α-helix	trans	-61.6	-44.2	169.6	-74.5	-171.4	-65.5	-91.3	0.9	111.7	D300 A301 M302 Y307 R308	D300-R304 WeakPolarHBondContact O-CG 3.43Å; D300-R304 PolarHBondContact O-N 2.94Å; A301-R304 VanDerWaalsContact CA-NH2 3.34Å; A301-R304 PolarHBondContact O-N 3.35Å; M302-R304 PolarHBondContact O-N 3.27Å; R304-Y307 PolarHBondContact O-N 3.36Å; R304-R308 WeakPolarHBondContact O-CB 3.2Å; R304-R308 PolarHBondContact O-N 3.28Å
305	T	98	Very high	96	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.7	-45.6	176.8	-64.5	0	0	0	0	111.3	L255 W257 A301 M302 Y307 R308 I309	L255-T305 HydrophobicContact CD2-CG2 4.16Å; L255-T305 HydrophobicContact CG-CG2 4.49Å; W257-T305 WeakPolarHBondContact CA-OG1 3.43Å; W257-T305 PolarHBondContact O-OG1 3.08Å; A301-T305 WeakPolarHBondContact O-CB 3.2Å; A301-T305 PolarHBondContact O-N 3.33Å; A301-T305 PolarHBondContact O-OG1 3.12Å; M302-T305 CarbonylContact O-C 3.57Å; M302-T305 WeakPolarHBondContact O-CB 3.35Å; M302-T305 PolarHBondContact O-N 2.86Å; M302-T305 VanDerWaalsContact O-N 3.13Å; T305-Y307 PolarHBondContact O-N 3.14Å; T305-R308 WeakPolarHBondContact O-CB 3.44Å; T305-R308 PolarHBondContact O-N 3.47Å; T305-I309 HydrophobicContact CG2-CD1 3.73Å; T305-I309 HydrophobicContact CG2-CG1 4.37Å; T305-I309 VanDerWaalsContact O-CG1 3.29Å; T305-I309 WeakPolarHBondContact O-CG1 3.41Å; T305-I309 PolarHBondContact O-N 3.45Å
306	L	97.2	Very high	96	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-56.4	-52.3	175.3	179.6	69.4	0	0	0	110.6	L201 I287 M302 F303 R308 I309 T310 V319 F321 L351	L201-L306 HydrophobicContact CD1-CD1 4.34Å; I287-L306 HydrophobicContact CB-CD1 4.46Å; I287-L306 HydrophobicContact CD1-CD1 3.73Å; I287-L306 HydrophobicContact CG2-CD1 3.99Å; M302-L306 WeakPolarHBondContact O-CB 3.25Å; M302-L306 PolarHBondContact O-N 3.34Å; M302-L306 HydrophobicContact SD-CB 4.26Å; F303-L306 HydrophobicContact CD1-CD2 4.07Å; F303-L306 HydrophobicContact CE1-CD2 4.3Å; F303-L306 PolarHBondContact O-N 3.35Å; L306-R308 VanDerWaalsContact C-N 3.32Å; L306-R308 PolarHBondContact O-N 2.93Å; L306-I309 PolarHBondContact O-N 3.48Å; L306-I309 VanDerWaalsContact O-N 3.16Å; L306-T310 HydrophobicContact CD1-CG2 4.16Å; L306-T310 HydrophobicContact CG-CG2 4.35Å; L306-T310 WeakPolarHBondContact O-CG2 3.23Å; L306-T310 PolarHBondContact O-N 2.8Å; L306-T310 PolarHBondContact O-OG1 3.43Å; L306-V319 HydrophobicContact CD1-CG1 4.02Å; L306-V319 HydrophobicContact CD1-CG2 3.92Å; L306-V319 HydrophobicContact CD2-CG1 4.45Å; L306-F321 HydrophobicContact CD2-CZ 3.79Å; L306-L351 HydrophobicContact CD2-CD2 4.4Å
307	Y	95.7	Very high	96.1	Very high	88 Å²	88	42.1 Å²	42.1	35%	0.345	20%	0.202	S	C	.	.	H	α-helix	trans	-55.8	-46.9	177.5	179.5	-89	0	0	0	111.5	F303 R304 T305 I309 T310 H311 L354 Y361	F303-Y307 WeakPolarHBondContact O-CB 3.03Å; F303-Y307 PolarHBondContact O-N 2.87Å; R304-Y307 PolarHBondContact O-N 3.36Å; T305-Y307 PolarHBondContact O-N 3.14Å; Y307-I309 PolarHBondContact O-N 3.13Å; Y307-T310 PolarHBondContact O-OG1 2.85Å; Y307-H311 AromaticContact CD1-ND1 3.9Å; Y307-H311 AromaticContact CD2-CE1 3.46Å; Y307-H311 VanDerWaalsContact CD2-CE1 3.46Å; Y307-H311 WeakPolarHBondContact CD2-CE1 3.33Å; Y307-H311 AromaticContact CD2-ND1 3.83Å; Y307-H311 AromaticContact CE1-CE1 3.68Å; Y307-H311 AromaticContact CE1-ND1 3.82Å; Y307-H311 AromaticContact CE1-NE2 3.84Å; Y307-H311 AromaticContact CE2-CE1 3.01Å; Y307-H311 WeakPolarHBondContact CE2-CE1 3.5Å; Y307-H311 AromaticContact CE2-ND1 3.77Å; Y307-H311 AromaticContact CE2-NE2 3.56Å; Y307-H311 AromaticContact CG-CE1 3.97Å; Y307-H311 AromaticContact CG-ND1 3.91Å; Y307-H311 AromaticContact CZ-CD2 3.96Å; Y307-H311 AromaticContact CZ-CE1 3.14Å; Y307-H311 AromaticContact CZ-ND1 3.77Å; Y307-H311 AromaticContact CZ-NE2 3.24Å; Y307-H311 WeakPolarHBondContact O-CB 3.47Å; Y307-H311 VanDerWaalsContact O-CG 3.32Å; Y307-H311 PolarHBondContact O-N 3.03Å; Y307-H311 VanDerWaalsContact O-N 3.12Å; Y307-H311 PolarHBondContact O-ND1 3.38Å; Y307-H311 PolarHBondContact OH-NE2 3.04Å; Y307-H311 VanDerWaalsContact OH-NE2 3.15Å; Y307-L354 HydrophobicContact CD2-CD2 4.28Å; Y307-L354 HydrophobicContact CE2-CD2 3.62Å; Y307-Y361 HydrophobicContact CD2-CE2 4.5Å
308	R	95.4	Very high	96.2	Very high	49 Å²	49	38.1 Å²	38.1	19%	0.185	18%	0.182	C	C	.	.	H	α-helix	trans	-59	-46.2	176.9	178.5	177.3	66.8	-137.3	10.9	111.6	K259 D260 R304 T305 L306 N312	K259-R308 PolarHBondContact O-NH1 3.16Å; K259-R308 VanDerWaalsContact O-NH1 3.13Å; K259-R308 PolarHBondContact O-NH2 3.43Å; D260-R308 VanDerWaalsContact C-CZ 3.45Å; D260-R308 VanDerWaalsContact CA-NH1 3.25Å; D260-R308 WeakPolarHBondContact O-CD 3.46Å; D260-R308 PolarHBondContact O-NE 3.29Å; D260-R308 PolarHBondContact O-NH1 3.06Å; D260-R308 VanDerWaalsContact O-NH1 3.09Å; D260-R308 IonicContact OD1-NH1 2.71Å; R304-R308 WeakPolarHBondContact O-CB 3.2Å; R304-R308 PolarHBondContact O-N 3.28Å; T305-R308 WeakPolarHBondContact O-CB 3.44Å; T305-R308 PolarHBondContact O-N 3.47Å; L306-R308 VanDerWaalsContact C-N 3.32Å; L306-R308 PolarHBondContact O-N 2.93Å; R308-N312 PolarHBondContact O-N 3.49Å; R308-N312 PolarHBondContact O-ND2 2.96Å
309	I	96.2	Very high	96.3	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-66.1	-52.5	-177.8	-69.3	173.3	0	0	0	110.2	L199 L201 L255 F262 I287 T305 L306 Y307 H311 N312 L313	L199-I309 HydrophobicContact CD2-CD1 3.62Å; L199-I309 HydrophobicContact CD2-CG2 4.1Å; L201-I309 HydrophobicContact CD2-CD1 4.44Å; L255-I309 HydrophobicContact CD2-CD1 4.13Å; F262-I309 HydrophobicContact CZ-CD1 4.1Å; F262-I309 HydrophobicContact CZ-CG1 4.1Å; I287-I309 HydrophobicContact CD1-CG2 4.03Å; T305-I309 HydrophobicContact CG2-CD1 3.73Å; T305-I309 HydrophobicContact CG2-CG1 4.37Å; T305-I309 VanDerWaalsContact O-CG1 3.29Å; T305-I309 WeakPolarHBondContact O-CG1 3.41Å; T305-I309 PolarHBondContact O-N 3.45Å; L306-I309 PolarHBondContact O-N 3.48Å; L306-I309 VanDerWaalsContact O-N 3.16Å; Y307-I309 PolarHBondContact O-N 3.13Å; I309-H311 PolarHBondContact O-N 2.93Å; I309-H311 VanDerWaalsContact O-N 3.16Å; I309-N312 PolarHBondContact O-N 3.4Å; I309-L313 HydrophobicContact CG2-CD2 4.11Å; I309-L313 HydrophobicContact CG2-CG 4.38Å; I309-L313 WeakPolarHBondContact O-CG 3.45Å; I309-L313 PolarHBondContact O-N 3.18Å; I309-L313 VanDerWaalsContact O-N 3.14Å
310	T	95.3	Very high	96.3	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-56.7	-35.2	-179.2	57.5	0	0	0	0	112.2	I287 L306 Y307 N312 L313 Y361 A389	I287-T310 HydrophobicContact CD1-CG2 4.09Å; L306-T310 HydrophobicContact CD1-CG2 4.16Å; L306-T310 HydrophobicContact CG-CG2 4.35Å; L306-T310 WeakPolarHBondContact O-CG2 3.23Å; L306-T310 PolarHBondContact O-N 2.8Å; L306-T310 PolarHBondContact O-OG1 3.43Å; Y307-T310 PolarHBondContact O-OG1 2.85Å; T310-N312 VanDerWaalsContact C-N 3.29Å; T310-N312 PolarHBondContact O-N 3.21Å; T310-L313 PolarHBondContact O-N 3.44Å; T310-Y361 HydrophobicContact CG2-CE1 4.5Å; T310-Y361 PolarHBondContact OG1-OH 2.76Å; T310-A389 HydrophobicContact CG2-CB 4.26Å
311	H	93.6	Very high	96.4	Very high	21 Å²	21	34 Å²	34	10%	0.097	16%	0.159	C	C	.	.	H	α-helix	trans	-69.2	-23.5	177.5	-82.7	63.7	0	0	0	114.9	Y307 I309 D356 K358 Y361	Y307-H311 AromaticContact CD1-ND1 3.9Å; Y307-H311 AromaticContact CD2-CE1 3.46Å; Y307-H311 VanDerWaalsContact CD2-CE1 3.46Å; Y307-H311 WeakPolarHBondContact CD2-CE1 3.33Å; Y307-H311 AromaticContact CD2-ND1 3.83Å; Y307-H311 AromaticContact CE1-CE1 3.68Å; Y307-H311 AromaticContact CE1-ND1 3.82Å; Y307-H311 AromaticContact CE1-NE2 3.84Å; Y307-H311 AromaticContact CE2-CE1 3.01Å; Y307-H311 WeakPolarHBondContact CE2-CE1 3.5Å; Y307-H311 AromaticContact CE2-ND1 3.77Å; Y307-H311 AromaticContact CE2-NE2 3.56Å; Y307-H311 AromaticContact CG-CE1 3.97Å; Y307-H311 AromaticContact CG-ND1 3.91Å; Y307-H311 AromaticContact CZ-CD2 3.96Å; Y307-H311 AromaticContact CZ-CE1 3.14Å; Y307-H311 AromaticContact CZ-ND1 3.77Å; Y307-H311 AromaticContact CZ-NE2 3.24Å; Y307-H311 WeakPolarHBondContact O-CB 3.47Å; Y307-H311 VanDerWaalsContact O-CG 3.32Å; Y307-H311 PolarHBondContact O-N 3.03Å; Y307-H311 VanDerWaalsContact O-N 3.12Å; Y307-H311 PolarHBondContact O-ND1 3.38Å; Y307-H311 PolarHBondContact OH-NE2 3.04Å; Y307-H311 VanDerWaalsContact OH-NE2 3.15Å; I309-H311 PolarHBondContact O-N 2.93Å; I309-H311 VanDerWaalsContact O-N 3.16Å; H311-D356 IonicContact CE1-OD2 3.06Å; H311-D356 IonicContact NE2-OD2 3.86Å; H311-D356 PolarHBondContact NE2-OD2 2.86Å; H311-K358 PolarHBondContact O-NZ 2.84Å; H311-Y361 PolarHBondContact CE1-OH 3.48Å
312	N	94.8	Very high	96.4	Very high	87 Å²	87	34 Å²	34	47%	0.465	16%	0.159	S	C	.	.	H	α-helix	trans	-97.7	-9.3	179.1	-73.3	-67	0	0	0	112.5	R308 I309 T310	R308-N312 PolarHBondContact O-N 3.49Å; R308-N312 PolarHBondContact O-ND2 2.96Å; I309-N312 PolarHBondContact O-N 3.4Å; T310-N312 VanDerWaalsContact C-N 3.29Å; T310-N312 PolarHBondContact O-N 3.21Å
313	L	95.5	Very high	96.3	Very high	2 Å²	2	34 Å²	34	1%	0.01	16%	0.16	C	C	.	.			trans	-70.1	138.8	175.5	-60.4	-171.6	0	0	0	111.4	H281 C284 I309 T310 N315 C317 W391	H281-L313 CarbonylContact O-C 3.54Å; H281-L313 WeakPolarHBondContact O-CA 3.32Å; C284-L313 HydrophobicContact CB-CD1 4.16Å; C284-L313 HydrophobicContact CB-CD2 3.79Å; I309-L313 HydrophobicContact CG2-CD2 4.11Å; I309-L313 HydrophobicContact CG2-CG 4.38Å; I309-L313 WeakPolarHBondContact O-CG 3.45Å; I309-L313 PolarHBondContact O-N 3.18Å; I309-L313 VanDerWaalsContact O-N 3.14Å; T310-L313 PolarHBondContact O-N 3.44Å; L313-N315 VanDerWaalsContact C-N 3.29Å; L313-N315 PolarHBondContact O-N 2.97Å; L313-C317 HydrophobicContact CD1-CB 3.7Å; L313-W391 WeakPolarHBondContact O-CZ2 3.46Å; L313-W391 PolarHBondContact O-NE1 2.85Å
314	K	93.9	Very high	96.2	Very high	140 Å²	140	34.9 Å²	34.9	61%	0.609	16%	0.164	S	C	*	.	S	Bend	trans	-74.5	-20.3	173.9	-71.5	-173.3	178.4	157.5	0	113.7	H281 D282	H281-K314 PolarHBondContact O-N 3.34Å; D282-K314 HydrophobicContact CB-CD 4.44Å; D282-K314 WeakPolarHBondContact OD1-CD 3.45Å; D282-K314 WeakPolarHBondContact OD1-CE 3.41Å; D282-K314 IonicContact OD1-NZ 3.68Å; D282-K314 PolarHBondContact OD1-NZ 3.09Å; D282-K314 IonicContact OD2-NZ 2.67Å; D282-K314 PolarHBondContact OD2-NZ 3.31Å
315	N	91.8	Very high	96	Very high	70 Å²	70	30.9 Å²	30.9	37%	0.374	15%	0.15	S	C	.	.	S	Bend	trans	-116.3	156.2	-177.3	-55.7	-62.4	0	0	0	110.2	D282 T285 L313	D282-N315 PolarHBondContact O-ND2 3.32Å; T285-N315 HydrophobicContact CG2-CB 4.39Å; L313-N315 VanDerWaalsContact C-N 3.29Å; L313-N315 PolarHBondContact O-N 2.97Å
316	S	94.4	Very high	95.6	Very high	57 Å²	57	34.4 Å²	34.4	40%	0.399	16%	0.163	S	C	.	.			trans	-60.4	145.9	162.8	-53.9	0	0	0	0	109.2	A389 W391	S316-A389 VanDerWaalsContact CA-O 3.31Å; S316-A389 WeakPolarHBondContact CA-O 3.5Å; S316-A389 WeakPolarHBondContact CB-O 3.25Å; S316-W391 PolarHBondContact OG-N 2.93Å
317	C	96.7	Very high	95.2	Very high	4 Å²	4	39 Å²	39	3%	0.027	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	156.8	-178.4	75.9	0	0	0	0	111.8	T285 L313 A389	T285-C317 CarbonylContact O-C 3.59Å; T285-C317 VanDerWaalsContact O-CA 3.29Å; T285-C317 WeakPolarHBondContact O-CA 3.01Å; L313-C317 HydrophobicContact CD1-CB 3.7Å; C317-A389 PolarHBondContact N-O 3.22Å; C317-A389 PolarHBondContact O-N 2.95Å
318	T	98.3	Very high	94.8	Very high	32 Å²	32	39.5 Å²	39.5	20%	0.196	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128	172.2	-56.5	0	0	0	0	109.4	T285 V286 I287 Y320 K386 V387	T285-T318 PolarHBondContact O-N 3.06Å; V286-T318 CarbonylContact C-O 3.53Å; V286-T318 VanDerWaalsContact CA-O 3.24Å; V286-T318 WeakPolarHBondContact CA-O 3.33Å; I287-T318 PolarHBondContact N-O 2.89Å; T318-Y320 HydrophobicContact CG2-CD2 4.22Å; T318-Y320 HydrophobicContact CG2-CE1 4.26Å; T318-Y320 HydrophobicContact CG2-CE2 3.5Å; T318-K386 HydrophobicContact CG2-CD 3.74Å; T318-K386 VanDerWaalsContact CG2-CE 3.47Å; T318-K386 HydrophobicContact CG2-CG 3.63Å; T318-V387 CarbonylContact C-O 3.6Å; T318-V387 WeakPolarHBondContact CA-O 3.43Å
319	V	98.7	Very high	94.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	135.5	178.1	-165.3	0	0	0	0	109.1	I287 L306 F321 K386 V387	I287-V319 HydrophobicContact CB-CB 4.42Å; I287-V319 HydrophobicContact CB-CG1 4.01Å; I287-V319 HydrophobicContact CB-CG2 4.23Å; I287-V319 HydrophobicContact CG2-CG1 4.07Å; I287-V319 CarbonylContact O-C 3.58Å; I287-V319 WeakPolarHBondContact O-CA 3.35Å; L306-V319 HydrophobicContact CD1-CG1 4.02Å; L306-V319 HydrophobicContact CD1-CG2 3.92Å; L306-V319 HydrophobicContact CD2-CG1 4.45Å; V319-F321 HydrophobicContact CB-CZ 4.42Å; V319-F321 HydrophobicContact CG1-CD1 4.2Å; V319-F321 HydrophobicContact CG1-CE1 3.52Å; V319-F321 HydrophobicContact CG1-CE2 4.03Å; V319-F321 HydrophobicContact CG1-CZ 3.43Å; V319-F321 VanDerWaalsContact CG1-CZ 3.43Å; V319-K386 CarbonylContact O-C 3.56Å; V319-K386 WeakPolarHBondContact O-CA 3.25Å; V319-V387 HydrophobicContact CB-CB 4.07Å; V319-V387 HydrophobicContact CG2-CB 4.42Å; V319-V387 PolarHBondContact N-O 3.17Å; V319-V387 PolarHBondContact O-N 2.84Å
320	Y	98.8	Very high	93.7	Very high	7 Å²	7	43.9 Å²	43.9	3%	0.027	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.2	174.8	-64.9	-86.5	0	0	0	110.4	Y185 F193 V286 I287 M288 A289 T318 I366 W385 K386	Y185-Y320 HydrophobicContact CD1-CD1 4.39Å; Y185-Y320 HydrophobicContact CD1-CE1 4.39Å; Y185-Y320 AromaticContact CE1-CD1 3.84Å; Y185-Y320 HydrophobicContact CE1-CD1 3.84Å; Y185-Y320 AromaticContact CE1-CE1 3.45Å; Y185-Y320 HydrophobicContact CE1-CE1 3.45Å; Y185-Y320 VanDerWaalsContact CE1-CE1 3.45Å; F193-Y320 HydrophobicContact CE1-CD2 4.05Å; F193-Y320 AromaticContact CE1-CE2 3.51Å; F193-Y320 HydrophobicContact CE1-CE2 3.51Å; F193-Y320 AromaticContact CE1-CZ 3.98Å; F193-Y320 HydrophobicContact CZ-CD2 4.34Å; F193-Y320 HydrophobicContact CZ-CE1 4.45Å; F193-Y320 AromaticContact CZ-CE2 3.85Å; F193-Y320 HydrophobicContact CZ-CE2 3.85Å; F193-Y320 AromaticContact CZ-CZ 3.9Å; V286-Y320 HydrophobicContact CG1-CD2 3.81Å; V286-Y320 HydrophobicContact CG1-CE2 3.93Å; I287-Y320 PolarHBondContact O-N 2.99Å; M288-Y320 CarbonylContact C-O 3.57Å; M288-Y320 VanDerWaalsContact CA-O 3.24Å; M288-Y320 WeakPolarHBondContact CA-O 3.33Å; A289-Y320 PolarHBondContact N-O 3.48Å; T318-Y320 HydrophobicContact CG2-CD2 4.22Å; T318-Y320 HydrophobicContact CG2-CE1 4.26Å; T318-Y320 HydrophobicContact CG2-CE2 3.5Å; Y320-I366 HydrophobicContact CD1-CD1 3.89Å; Y320-I366 HydrophobicContact CE1-CD1 3.88Å; Y320-W385 WeakPolarHBondContact CA-O 3.48Å; Y320-K386 HydrophobicContact CD1-CB 4.15Å; Y320-K386 HydrophobicContact CE1-CB 4.06Å; Y320-K386 HydrophobicContact CE1-CD 3.75Å; Y320-K386 HydrophobicContact CE1-CG 4.06Å
321	F	98.7	Very high	93.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.6	174.7	-58.4	-54	0	0	0	109.9	A289 F293 M302 F303 L306 V319 F344 L348 L384 W385 V387	A289-F321 HydrophobicContact CB-CD1 4.04Å; A289-F321 HydrophobicContact CB-CE1 4.35Å; A289-F321 WeakPolarHBondContact O-CA 3.35Å; F293-F321 HydrophobicContact CE2-CB 4.06Å; F293-F321 HydrophobicContact CE2-CD1 4.11Å; F293-F321 HydrophobicContact CE2-CG 4.15Å; F293-F321 HydrophobicContact CZ-CB 4.45Å; F293-F321 AromaticContact CZ-CD1 3.79Å; F293-F321 HydrophobicContact CZ-CD1 3.79Å; F293-F321 HydrophobicContact CZ-CE1 4.09Å; F293-F321 HydrophobicContact CZ-CG 4.04Å; M302-F321 HydrophobicContact CE-CE1 3.94Å; M302-F321 HydrophobicContact CE-CZ 4.22Å; M302-F321 HydrophobicContact SD-CE1 4.43Å; F303-F321 HydrophobicContact CE1-CE2 4.23Å; F303-F321 HydrophobicContact CE1-CZ 4.23Å; F303-F321 HydrophobicContact CZ-CE2 4.23Å; F303-F321 HydrophobicContact CZ-CZ 4.33Å; L306-F321 HydrophobicContact CD2-CZ 3.79Å; V319-F321 HydrophobicContact CB-CZ 4.42Å; V319-F321 HydrophobicContact CG1-CD1 4.2Å; V319-F321 HydrophobicContact CG1-CE1 3.52Å; V319-F321 HydrophobicContact CG1-CE2 4.03Å; V319-F321 HydrophobicContact CG1-CZ 3.43Å; V319-F321 VanDerWaalsContact CG1-CZ 3.43Å; F321-F344 HydrophobicContact CB-CZ 4.49Å; F321-F344 HydrophobicContact CD2-CE2 4.16Å; F321-F344 HydrophobicContact CD2-CZ 4.44Å; F321-F344 HydrophobicContact CG-CE2 4.46Å; F321-L348 HydrophobicContact CE2-CD1 4.29Å; F321-L384 CarbonylContact O-C 3.47Å; F321-L384 WeakPolarHBondContact O-CA 3.48Å; F321-W385 HydrophobicContact CB-CB 4.24Å; F321-W385 PolarHBondContact N-O 3.07Å; F321-W385 PolarHBondContact O-N 3.15Å; F321-V387 HydrophobicContact CD2-CG2 4.07Å; F321-V387 HydrophobicContact CE2-CG2 3.7Å
322	S	98.3	Very high	92.7	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	136.9	165.2	-171.5	0	0	0	0	109.8	G178 L181 A289 A290 D291 E383	G178-S322 VanDerWaalsContact CA-OG 3.22Å; G178-S322 WeakPolarHBondContact CA-OG 3.46Å; G178-S322 VanDerWaalsContact O-CB 3.24Å; G178-S322 WeakPolarHBondContact O-CB 3.15Å; G178-S322 PolarHBondContact O-OG 2.8Å; L181-S322 WeakPolarHBondContact CD2-OG 3.32Å; A289-S322 PolarHBondContact O-N 3.13Å; A290-S322 WeakPolarHBondContact CA-O 3.3Å; D291-S322 PolarHBondContact N-O 3.09Å; S322-E383 WeakPolarHBondContact CA-O 3.37Å
323	I	96.8	Very high	92.2	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.015	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	136.7	-178.3	-172	173.9	0	0	0	111	D291 F293 Y341 F344 L382 E383	D291-I323 VanDerWaalsContact OD1-CA 3.29Å; D291-I323 WeakPolarHBondContact OD1-CA 3.32Å; F293-I323 HydrophobicContact CB-CD1 3.61Å; F293-I323 HydrophobicContact CB-CG1 4.45Å; F293-I323 HydrophobicContact CD2-CB 4.23Å; F293-I323 HydrophobicContact CD2-CD1 3.66Å; F293-I323 HydrophobicContact CD2-CG1 4.15Å; F293-I323 HydrophobicContact CG-CD1 3.99Å; I323-Y341 HydrophobicContact CD1-CD2 3.84Å; I323-Y341 HydrophobicContact CG2-CE2 4.4Å; I323-F344 HydrophobicContact CD1-CD1 3.88Å; I323-F344 HydrophobicContact CD1-CE1 4.3Å; I323-F344 HydrophobicContact CD1-CG 4.26Å; I323-F344 HydrophobicContact CG2-CE1 4.25Å; I323-L382 CarbonylContact O-C 3.57Å; I323-L382 WeakPolarHBondContact O-CA 3.48Å; I323-E383 HydrophobicContact CG2-CB 4.02Å; I323-E383 PolarHBondContact N-O 3.49Å; I323-E383 PolarHBondContact O-N 3.36Å
324	E	95.2	Very high	91.8	Very high	30 Å²	30	66.4 Å²	66.4	14%	0.14	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.6	163.3	-173	165.2	-145.6	0	0	110.7	R177 D291 R326 T379 Q381 L382	R177-E324 WeakPolarHBondContact CD-OE1 3.46Å; R177-E324 WeakPolarHBondContact CD-OE2 3.49Å; D291-E324 PolarHBondContact OD1-N 2.92Å; E324-R326 PolarHBondContact O-N 3.15Å; E324-T379 PolarHBondContact OE1-OG1 3.1Å; E324-T379 VanDerWaalsContact OE1-OG1 3.05Å; E324-Q381 HydrophobicContact CG-CB 4.13Å; E324-L382 HydrophobicContact CB-CD2 3.78Å; E324-L382 HydrophobicContact CB-CG 4.43Å; E324-L382 HydrophobicContact CG-CD2 4.3Å; E324-L382 HydrophobicContact CG-CG 4.45Å
325	K	93.9	Very high	91.7	Very high	55 Å²	55	64.4 Å²	64.4	24%	0.239	31%	0.313	C	S	.	.			trans	-66	117.9	175.2	-67.2	170.2	-175	165.3	0	111	Y341 Q381 E383	K325-Y341 HydrophobicContact CD-CD2 4.42Å; K325-Y341 HydrophobicContact CD-CE1 4.45Å; K325-Y341 HydrophobicContact CD-CE2 4.31Å; K325-Y341 HydrophobicContact CG-CD1 4.36Å; K325-Y341 HydrophobicContact CG-CD2 3.6Å; K325-Y341 HydrophobicContact CG-CE2 3.87Å; K325-Y341 HydrophobicContact CG-CG 3.9Å; K325-Q381 HydrophobicContact CB-CB 3.94Å; K325-Q381 HydrophobicContact CB-CG 4.15Å; K325-Q381 WeakPolarHBondContact CG-O 3.19Å; K325-Q381 PolarHBondContact N-O 2.96Å; K325-E383 VanDerWaalsContact CE-CD 3.44Å; K325-E383 WeakPolarHBondContact CE-OE1 3.33Å; K325-E383 IonicContact NZ-OE1 3.3Å; K325-E383 PolarHBondContact NZ-OE1 3.12Å
326	R	89.6	Confident	91.5	Very high	73 Å²	73	65 Å²	65	28%	0.275	32%	0.319	S	S	.	.			trans	-91.6	105.9	172.4	-63.4	-170.7	-179	148.7	3.1	110.7	Y294 E324 C338	Y294-R326 VanDerWaalsContact CB-NH1 3.33Å; E324-R326 PolarHBondContact O-N 3.15Å; R326-C338 PolarHBondContact O-SG 2.77Å
327	L	88.7	Confident	91.3	Very high	99 Å²	99	63.5 Å²	63.5	52%	0.518	31%	0.308	S	S	.	.			trans	-86.9	112.1	179.6	-62.5	172.2	0	0	0	109.4	V336 C338 Q381	L327-V336 HydrophobicContact CB-CG1 3.83Å; L327-V336 HydrophobicContact CD2-CG1 4.28Å; L327-C338 HydrophobicContact CD2-CB 4.08Å; L327-Q381 HydrophobicContact CD1-CG 4.4Å
328	N	86.2	Confident	91	Very high	99 Å²	99	64 Å²	64	53%	0.529	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.5	-178.3	-66	-45.8	0	0	0	110.1	T330 T337	N328-T330 PolarHBondContact O-N 3.37Å; N328-T337 PolarHBondContact N-O 2.89Å; N328-T337 PolarHBondContact O-N 2.89Å
329	F	87.1	Confident	90.6	Very high	119 Å²	119	66.1 Å²	66.1	52%	0.522	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	120.5	167	-173.3	-89	0	0	0	109	L331 M334 D335 V336	F329-L331 HydrophobicContact CE1-CD2 4.42Å; F329-M334 VanDerWaalsContact CE2-C 3.42Å; F329-M334 WeakPolarHBondContact CE2-O 3.46Å; F329-M334 HydrophobicContact CZ-CB 4.46Å; F329-M334 WeakPolarHBondContact CZ-O 3.44Å; F329-D335 WeakPolarHBondContact CA-O 3.44Å; F329-V336 HydrophobicContact CD2-CG2 4.32Å
330	T	80.6	Confident	90.4	Very high	23 Å²	23	67.2 Å²	67.2	14%	0.141	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.3	-179.6	58.2	0	0	0	0	110.8	N328 R332 H333 M334 D335 T337	N328-T330 PolarHBondContact O-N 3.37Å; T330-R332 PolarHBondContact O-N 3.04Å; T330-H333 PolarHBondContact O-N 3.13Å; T330-H333 WeakPolarHBondContact OG1-CB 3.38Å; T330-H333 PolarHBondContact OG1-ND1 3.15Å; T330-H333 VanDerWaalsContact OG1-ND1 3.13Å; T330-M334 WeakPolarHBondContact O-CA 3.41Å; T330-M334 PolarHBondContact O-N 3.09Å; T330-D335 PolarHBondContact N-O 3.07Å; T330-T337 WeakPolarHBondContact CG2-OG1 3.49Å; T330-T337 PolarHBondContact OG1-OG1 3.28Å
331	L	85.1	Confident	90.2	Very high	145 Å²	145	68.3 Å²	68.3	76%	0.759	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-29	175.9	-65.1	178.3	0	0	0	112.2	F329	F329-L331 HydrophobicContact CE1-CD2 4.42Å
332	R	83.4	Confident	90	Very high	211 Å²	211	72.1 Å²	72.1	80%	0.796	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-43.1	177.7	-178.5	177.8	179.7	178.2	1	112.2	T330	T330-R332 PolarHBondContact O-N 3.04Å
333	H	83.8	Confident	90	Very high	95 Å²	95	74.2 Å²	74.2	44%	0.44	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-11.9	-176.9	-58.4	102.4	0	0	0	112.6	T330 D335 T337 E339	T330-H333 PolarHBondContact O-N 3.13Å; T330-H333 WeakPolarHBondContact OG1-CB 3.38Å; T330-H333 PolarHBondContact OG1-ND1 3.15Å; T330-H333 VanDerWaalsContact OG1-ND1 3.13Å; H333-D335 PolarHBondContact O-N 3.35Å; H333-T337 HydrophobicContact CB-CG2 3.88Å; H333-E339 IonicContact CE1-OE1 3.33Å; H333-E339 PolarHBondContact CE1-OE1 3.13Å; H333-E339 IonicContact ND1-OE1 2.8Å; H333-E339 PolarHBondContact ND1-OE1 2.86Å
334	M	87.9	Confident	90	Very high	132 Å²	132	74.1 Å²	74.1	65%	0.65	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	34.2	-172.6	-63.7	-70	-69.5	0	0	111.8	F329 T330	F329-M334 VanDerWaalsContact CE2-C 3.42Å; F329-M334 WeakPolarHBondContact CE2-O 3.46Å; F329-M334 HydrophobicContact CZ-CB 4.46Å; F329-M334 WeakPolarHBondContact CZ-O 3.44Å; T330-M334 WeakPolarHBondContact O-CA 3.41Å; T330-M334 PolarHBondContact O-N 3.09Å
335	D	91.1	Very high	90.1	Very high	99 Å²	99	75 Å²	75	53%	0.529	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	165.9	-175.1	-158.2	1.1	0	0	0	110.8	F329 T330 H333 T337	F329-D335 WeakPolarHBondContact CA-O 3.44Å; T330-D335 PolarHBondContact N-O 3.07Å; H333-D335 PolarHBondContact O-N 3.35Å; D335-T337 PolarHBondContact O-N 3.3Å
336	V	88.9	Confident	90.3	Very high	82 Å²	82	76.8 Å²	76.8	50%	0.497	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	118.1	171.5	-180	0	0	0	0	109.1	L327 F329	L327-V336 HydrophobicContact CB-CG1 3.83Å; L327-V336 HydrophobicContact CD2-CG1 4.28Å; F329-V336 HydrophobicContact CD2-CG2 4.32Å
337	T	88.8	Confident	90.7	Very high	26 Å²	26	74.5 Å²	74.5	16%	0.16	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	163.8	178.4	64.1	0	0	0	0	111.2	N328 T330 H333 D335	N328-T337 PolarHBondContact N-O 2.89Å; N328-T337 PolarHBondContact O-N 2.89Å; T330-T337 WeakPolarHBondContact CG2-OG1 3.49Å; T330-T337 PolarHBondContact OG1-OG1 3.28Å; H333-T337 HydrophobicContact CB-CG2 3.88Å; D335-T337 PolarHBondContact O-N 3.3Å
338	C	91.2	Very high	91	Very high	13 Å²	13	69.8 Å²	69.8	9%	0.088	34%	0.344	C	S	.	.			trans	-130.2	63.6	176.2	-156.4	0	0	0	0	108.2	R326 L327 Y341 N342	R326-C338 PolarHBondContact O-SG 2.77Å; L327-C338 HydrophobicContact CD2-CB 4.08Å; C338-Y341 PolarHBondContact O-N 3.04Å; C338-Y341 WeakPolarHBondContact SG-CB 3.45Å; C338-N342 WeakPolarHBondContact O-CB 3.45Å; C338-N342 PolarHBondContact O-N 2.79Å; C338-N342 PolarHBondContact O-ND2 3.33Å
339	E	90.8	Very high	91.5	Very high	77 Å²	77	68.2 Å²	68.2	36%	0.36	34%	0.336	S	S	.	.	H	α-helix	trans	-60	-51.7	-165.9	-66.5	-176.4	171.8	0	0	112.6	H333 Y341 N342 H343	H333-E339 IonicContact CE1-OE1 3.33Å; H333-E339 PolarHBondContact CE1-OE1 3.13Å; H333-E339 IonicContact ND1-OE1 2.8Å; H333-E339 PolarHBondContact ND1-OE1 2.86Å; E339-Y341 VanDerWaalsContact C-N 3.3Å; E339-Y341 PolarHBondContact O-N 3.45Å; E339-N342 WeakPolarHBondContact O-CB 3.38Å; E339-N342 PolarHBondContact O-N 3.11Å; E339-N342 VanDerWaalsContact O-N 3.07Å; E339-H343 PolarHBondContact O-N 3.39Å
340	A	92.6	Very high	91.9	Very high	24 Å²	24	67.4 Å²	67.4	20%	0.198	34%	0.337	C	S	.	.	H	α-helix	trans	-58.8	-39.4	178	0	0	0	0	0	112.8	H343 F344	A340-H343 PolarHBondContact O-N 3.36Å; A340-F344 WeakPolarHBondContact O-CB 3.48Å; A340-F344 PolarHBondContact O-N 3.41Å
341	Y	95.3	Very high	92.6	Very high	29 Å²	29	66.9 Å²	66.9	11%	0.114	33%	0.333	C	S	.	.	H	α-helix	trans	-66.7	-42.5	175.1	173.7	-93.5	0	0	0	111.8	I323 K325 C338 E339 H343 F344 R345 E383	I323-Y341 HydrophobicContact CD1-CD2 3.84Å; I323-Y341 HydrophobicContact CG2-CE2 4.4Å; K325-Y341 HydrophobicContact CD-CD2 4.42Å; K325-Y341 HydrophobicContact CD-CE1 4.45Å; K325-Y341 HydrophobicContact CD-CE2 4.31Å; K325-Y341 HydrophobicContact CG-CD1 4.36Å; K325-Y341 HydrophobicContact CG-CD2 3.6Å; K325-Y341 HydrophobicContact CG-CE2 3.87Å; K325-Y341 HydrophobicContact CG-CG 3.9Å; C338-Y341 PolarHBondContact O-N 3.04Å; C338-Y341 WeakPolarHBondContact SG-CB 3.45Å; E339-Y341 VanDerWaalsContact C-N 3.3Å; E339-Y341 PolarHBondContact O-N 3.45Å; Y341-H343 VanDerWaalsContact C-N 3.3Å; Y341-H343 PolarHBondContact O-N 3.42Å; Y341-F344 HydrophobicContact CD2-CD1 4.2Å; Y341-F344 HydrophobicContact CE2-CD1 4.27Å; Y341-F344 HydrophobicContact CE2-CE1 4.41Å; Y341-F344 WeakPolarHBondContact O-CB 3.21Å; Y341-F344 PolarHBondContact O-N 3.24Å; Y341-R345 HydrophobicContact CD1-CG 4.04Å; Y341-R345 HydrophobicContact CD2-CG 4.47Å; Y341-R345 HydrophobicContact CE1-CG 3.48Å; Y341-R345 VanDerWaalsContact CE1-CG 3.48Å; Y341-R345 HydrophobicContact CE2-CG 3.95Å; Y341-R345 HydrophobicContact CG-CG 4.48Å; Y341-R345 WeakPolarHBondContact O-CB 3.31Å; Y341-R345 WeakPolarHBondContact O-CG 3.39Å; Y341-R345 PolarHBondContact O-N 2.83Å; Y341-R345 WeakPolarHBondContact OH-CD 3.33Å; Y341-E383 WeakPolarHBondContact CE2-OE2 3.45Å; Y341-E383 PolarHBondContact OH-OE1 3.37Å; Y341-E383 PolarHBondContact OH-OE2 3.1Å
342	N	95.4	Very high	93.1	Very high	80 Å²	80	64.2 Å²	64.2	43%	0.428	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-41.1	177.6	-70.2	-22.8	0	0	0	110.8	C338 E339 R345 N346	C338-N342 WeakPolarHBondContact O-CB 3.45Å; C338-N342 PolarHBondContact O-N 2.79Å; C338-N342 PolarHBondContact O-ND2 3.33Å; E339-N342 WeakPolarHBondContact O-CB 3.38Å; E339-N342 PolarHBondContact O-N 3.11Å; E339-N342 VanDerWaalsContact O-N 3.07Å; N342-R345 PolarHBondContact O-N 2.66Å; N342-N346 PolarHBondContact O-N 3.45Å; N342-N346 PolarHBondContact O-ND2 2.94Å
343	H	97	Very high	93.5	Very high	45 Å²	45	57.9 Å²	57.9	21%	0.208	31%	0.305	C	S	.	.	H	α-helix	trans	-61.7	-51	174.4	-170.7	59.5	0	0	0	111.7	D296 D300 E339 A340 Y341 R345 N346 I347	D296-H343 PolarHBondContact O-NE2 2.93Å; D296-H343 VanDerWaalsContact OD1-CB 3.27Å; D296-H343 WeakPolarHBondContact OD1-CB 3.29Å; D296-H343 IonicContact OD1-CD2 3.81Å; D296-H343 PolarHBondContact OD1-CD2 3.36Å; D296-H343 IonicContact OD1-CG 2.98Å; D300-H343 IonicContact OD1-CD2 3.33Å; D300-H343 IonicContact OD1-CE1 3.53Å; D300-H343 PolarHBondContact OD1-CE1 3.4Å; D300-H343 IonicContact OD1-NE2 2.92Å; D300-H343 PolarHBondContact OD1-NE2 3.39Å; E339-H343 PolarHBondContact O-N 3.39Å; A340-H343 PolarHBondContact O-N 3.36Å; Y341-H343 VanDerWaalsContact C-N 3.3Å; Y341-H343 PolarHBondContact O-N 3.42Å; H343-R345 VanDerWaalsContact C-N 3.3Å; H343-R345 PolarHBondContact O-N 3.17Å; H343-N346 WeakPolarHBondContact O-CB 3.45Å; H343-N346 PolarHBondContact O-N 3.21Å; H343-I347 PolarHBondContact O-N 2.75Å
344	F	97.5	Very high	93.9	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-50.1	-48.3	172.1	157.9	-107.9	0	0	0	112.4	F293 T299 F303 F321 I323 A340 Y341 N346 I347 L348 W385	F293-F344 HydrophobicContact CB-CB 4.23Å; F293-F344 HydrophobicContact CD1-CB 4.15Å; F293-F344 AromaticContact CD1-CD2 3.62Å; F293-F344 HydrophobicContact CD1-CD2 3.62Å; F293-F344 HydrophobicContact CD1-CE2 4.4Å; F293-F344 HydrophobicContact CD1-CG 4.16Å; F293-F344 AromaticContact CD2-CD2 3.9Å; F293-F344 HydrophobicContact CD2-CD2 3.9Å; F293-F344 HydrophobicContact CD2-CE2 4.11Å; F293-F344 HydrophobicContact CD2-CG 4.26Å; F293-F344 AromaticContact CE1-CD2 3.43Å; F293-F344 HydrophobicContact CE1-CD2 3.43Å; F293-F344 VanDerWaalsContact CE1-CD2 3.43Å; F293-F344 AromaticContact CE1-CE2 3.87Å; F293-F344 HydrophobicContact CE1-CE2 3.87Å; F293-F344 HydrophobicContact CE1-CG 4.39Å; F293-F344 AromaticContact CE2-CD2 3.74Å; F293-F344 HydrophobicContact CE2-CD2 3.74Å; F293-F344 AromaticContact CE2-CE2 3.56Å; F293-F344 HydrophobicContact CE2-CE2 3.56Å; F293-F344 HydrophobicContact CE2-CZ 4.21Å; F293-F344 HydrophobicContact CG-CB 4.16Å; F293-F344 AromaticContact CG-CD2 3.83Å; F293-F344 HydrophobicContact CG-CD2 3.83Å; F293-F344 HydrophobicContact CG-CE2 4.48Å; F293-F344 HydrophobicContact CG-CG 4.06Å; F293-F344 AromaticContact CZ-CD2 3.49Å; F293-F344 HydrophobicContact CZ-CD2 3.49Å; F293-F344 VanDerWaalsContact CZ-CD2 3.49Å; F293-F344 AromaticContact CZ-CE2 3.42Å; F293-F344 HydrophobicContact CZ-CE2 3.42Å; F293-F344 VanDerWaalsContact CZ-CE2 3.42Å; F293-F344 HydrophobicContact CZ-CZ 4.45Å; T299-F344 HydrophobicContact CG2-CB 4.41Å; F303-F344 AromaticContact CE2-CD2 3.96Å; F303-F344 HydrophobicContact CE2-CD2 3.96Å; F303-F344 HydrophobicContact CE2-CE2 4.4Å; F303-F344 HydrophobicContact CZ-CD2 4.01Å; F303-F344 HydrophobicContact CZ-CE2 4.03Å; F321-F344 HydrophobicContact CB-CZ 4.49Å; F321-F344 HydrophobicContact CD2-CE2 4.16Å; F321-F344 HydrophobicContact CD2-CZ 4.44Å; F321-F344 HydrophobicContact CG-CE2 4.46Å; I323-F344 HydrophobicContact CD1-CD1 3.88Å; I323-F344 HydrophobicContact CD1-CE1 4.3Å; I323-F344 HydrophobicContact CD1-CG 4.26Å; I323-F344 HydrophobicContact CG2-CE1 4.25Å; A340-F344 WeakPolarHBondContact O-CB 3.48Å; A340-F344 PolarHBondContact O-N 3.41Å; Y341-F344 HydrophobicContact CD2-CD1 4.2Å; Y341-F344 HydrophobicContact CE2-CD1 4.27Å; Y341-F344 HydrophobicContact CE2-CE1 4.41Å; Y341-F344 WeakPolarHBondContact O-CB 3.21Å; Y341-F344 PolarHBondContact O-N 3.24Å; F344-N346 VanDerWaalsContact C-N 3.34Å; F344-N346 PolarHBondContact O-N 3.47Å; F344-I347 PolarHBondContact O-N 3.39Å; F344-L348 HydrophobicContact CE1-CD2 4.16Å; F344-L348 HydrophobicContact CE2-CB 4.46Å; F344-L348 HydrophobicContact CE2-CD2 3.98Å; F344-L348 HydrophobicContact CZ-CD2 3.55Å; F344-L348 VanDerWaalsContact O-CB 3.25Å; F344-L348 WeakPolarHBondContact O-CB 3.39Å; F344-L348 PolarHBondContact O-N 3.49Å; F344-W385 HydrophobicContact CZ-CG 4.35Å
345	R	97.6	Very high	93.6	Very high	49 Å²	49	59.7 Å²	59.7	19%	0.185	31%	0.314	C	S	.	.	H	α-helix	trans	-64.5	-37.5	179.5	-72.9	-64.3	-61.5	133.1	13.3	112.5	Y341 N342 H343 L348 N349	Y341-R345 HydrophobicContact CD1-CG 4.04Å; Y341-R345 HydrophobicContact CD2-CG 4.47Å; Y341-R345 HydrophobicContact CE1-CG 3.48Å; Y341-R345 VanDerWaalsContact CE1-CG 3.48Å; Y341-R345 HydrophobicContact CE2-CG 3.95Å; Y341-R345 HydrophobicContact CG-CG 4.48Å; Y341-R345 WeakPolarHBondContact O-CB 3.31Å; Y341-R345 WeakPolarHBondContact O-CG 3.39Å; Y341-R345 PolarHBondContact O-N 2.83Å; Y341-R345 WeakPolarHBondContact OH-CD 3.33Å; N342-R345 PolarHBondContact O-N 2.66Å; H343-R345 VanDerWaalsContact C-N 3.3Å; H343-R345 PolarHBondContact O-N 3.17Å; R345-L348 VanDerWaalsContact NH1-CD2 3.34Å; R345-L348 PolarHBondContact O-N 3.03Å; R345-N349 PolarHBondContact NH2-OD1 3.15Å; R345-N349 PolarHBondContact O-N 3.29Å; R345-N349 PolarHBondContact O-ND2 2.96Å; R345-N349 VanDerWaalsContact O-ND2 3.13Å
346	N	97.6	Very high	93	Very high	92 Å²	92	56.6 Å²	56.6	49%	0.492	30%	0.297	S	S	.	.	H	α-helix	trans	-63.5	-50.7	175.8	-69	-23.6	0	0	0	110.8	N342 H343 F344 L348 N349 D350	N342-N346 PolarHBondContact O-N 3.45Å; N342-N346 PolarHBondContact O-ND2 2.94Å; H343-N346 WeakPolarHBondContact O-CB 3.45Å; H343-N346 PolarHBondContact O-N 3.21Å; F344-N346 VanDerWaalsContact C-N 3.34Å; F344-N346 PolarHBondContact O-N 3.47Å; N346-L348 VanDerWaalsContact C-N 3.28Å; N346-L348 PolarHBondContact O-N 2.89Å; N346-N349 WeakPolarHBondContact O-CB 3.25Å; N346-N349 PolarHBondContact O-N 2.99Å; N346-N349 VanDerWaalsContact O-N 3.17Å; N346-D350 PolarHBondContact O-N 3.43Å
347	I	97.3	Very high	92.6	Very high	25 Å²	25	64.1 Å²	64.1	13%	0.128	32%	0.317	C	S	.	.	H	α-helix	trans	-61.7	-39.4	177.6	-57.6	-179.4	0	0	0	111.4	T299 D300 F303 H343 F344 N349 D350 L351	T299-I347 HydrophobicContact CG2-CD1 3.73Å; D300-I347 WeakPolarHBondContact OD1-CD1 3.4Å; F303-I347 HydrophobicContact CB-CG2 3.83Å; F303-I347 HydrophobicContact CD1-CG2 3.8Å; F303-I347 HydrophobicContact CD2-CB 4.14Å; F303-I347 HydrophobicContact CD2-CD1 4.08Å; F303-I347 HydrophobicContact CD2-CG2 3.51Å; F303-I347 HydrophobicContact CE1-CG2 4.19Å; F303-I347 HydrophobicContact CE2-CB 4.18Å; F303-I347 HydrophobicContact CE2-CG2 3.92Å; F303-I347 HydrophobicContact CG-CG2 3.44Å; F303-I347 VanDerWaalsContact CG-CG2 3.44Å; F303-I347 HydrophobicContact CZ-CG2 4.25Å; H343-I347 PolarHBondContact O-N 2.75Å; F344-I347 PolarHBondContact O-N 3.39Å; I347-N349 VanDerWaalsContact C-N 3.31Å; I347-N349 PolarHBondContact O-N 2.82Å; I347-D350 WeakPolarHBondContact O-CB 3.46Å; I347-D350 PolarHBondContact O-N 2.82Å; I347-D350 VanDerWaalsContact O-N 3.17Å; I347-L351 WeakPolarHBondContact O-CB 3.27Å; I347-L351 PolarHBondContact O-N 3.04Å
348	L	96.5	Very high	92.5	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-64.2	-37.3	179.1	-174	57.9	0	0	0	111.8	F303 F321 F344 R345 N346 E352 V363 W385 V387	F303-L348 HydrophobicContact CE1-CD1 4.32Å; F303-L348 HydrophobicContact CZ-CB 4.43Å; F303-L348 HydrophobicContact CZ-CD1 4.41Å; F321-L348 HydrophobicContact CE2-CD1 4.29Å; F344-L348 HydrophobicContact CE1-CD2 4.16Å; F344-L348 HydrophobicContact CE2-CB 4.46Å; F344-L348 HydrophobicContact CE2-CD2 3.98Å; F344-L348 HydrophobicContact CZ-CD2 3.55Å; F344-L348 VanDerWaalsContact O-CB 3.25Å; F344-L348 WeakPolarHBondContact O-CB 3.39Å; F344-L348 PolarHBondContact O-N 3.49Å; R345-L348 VanDerWaalsContact NH1-CD2 3.34Å; R345-L348 PolarHBondContact O-N 3.03Å; N346-L348 VanDerWaalsContact C-N 3.28Å; N346-L348 PolarHBondContact O-N 2.89Å; L348-E352 PolarHBondContact O-N 2.74Å; L348-V363 HydrophobicContact CD1-CB 4.46Å; L348-V363 HydrophobicContact CD1-CG1 3.9Å; L348-V363 HydrophobicContact CD1-CG2 3.65Å; L348-V363 HydrophobicContact CD2-CG1 3.75Å; L348-V363 HydrophobicContact CG-CG1 3.72Å; L348-V363 HydrophobicContact CG-CG2 4.08Å; L348-W385 HydrophobicContact CD2-CD2 4.09Å; L348-W385 HydrophobicContact CD2-CE3 4.03Å; L348-W385 HydrophobicContact CD2-CG 4.34Å; L348-V387 HydrophobicContact CD1-CG2 3.7Å
349	N	96.8	Very high	92.5	Very high	66 Å²	66	66.2 Å²	66.2	35%	0.353	32%	0.322	S	S	.	.	H	α-helix	trans	-68.6	-40.4	171.6	-63.8	-28.4	0	0	0	111.6	R345 N346 I347 L351 E352 S353	R345-N349 PolarHBondContact NH2-OD1 3.15Å; R345-N349 PolarHBondContact O-N 3.29Å; R345-N349 PolarHBondContact O-ND2 2.96Å; R345-N349 VanDerWaalsContact O-ND2 3.13Å; N346-N349 WeakPolarHBondContact O-CB 3.25Å; N346-N349 PolarHBondContact O-N 2.99Å; N346-N349 VanDerWaalsContact O-N 3.17Å; I347-N349 VanDerWaalsContact C-N 3.31Å; I347-N349 PolarHBondContact O-N 2.82Å; N349-L351 VanDerWaalsContact C-N 3.31Å; N349-L351 PolarHBondContact O-N 3.2Å; N349-E352 PolarHBondContact O-N 3.04Å; N349-S353 WeakPolarHBondContact O-CB 3.46Å; N349-S353 PolarHBondContact O-N 3.18Å; N349-S353 PolarHBondContact O-OG 2.8Å
350	D	95.5	Very high	92.7	Very high	102 Å²	102	67.4 Å²	67.4	55%	0.545	33%	0.326	S	S	.	.	H	α-helix	trans	-61.4	-42.3	176.5	-71.6	-16.7	0	0	0	110.9	N346 I347 E352 S353 L354	N346-D350 PolarHBondContact O-N 3.43Å; I347-D350 WeakPolarHBondContact O-CB 3.46Å; I347-D350 PolarHBondContact O-N 2.82Å; I347-D350 VanDerWaalsContact O-N 3.17Å; D350-E352 PolarHBondContact O-N 2.88Å; D350-S353 WeakPolarHBondContact CA-OG 3.44Å; D350-S353 CarbonylContact O-C 3.35Å; D350-S353 PolarHBondContact O-N 3.17Å; D350-S353 PolarHBondContact O-OG 2.98Å; D350-L354 PolarHBondContact O-N 3.38Å
351	L	94.8	Very high	92.8	Very high	13 Å²	13	66.6 Å²	66.6	7%	0.068	32%	0.318	C	S	.	.	H	α-helix	trans	-60.5	-42.6	175.3	-175.8	68.5	0	0	0	112	F303 L306 I347 N349 L354 Y361 V387	F303-L351 HydrophobicContact CD1-CD2 4.06Å; F303-L351 HydrophobicContact CE1-CD2 3.88Å; L306-L351 HydrophobicContact CD2-CD2 4.4Å; I347-L351 WeakPolarHBondContact O-CB 3.27Å; I347-L351 PolarHBondContact O-N 3.04Å; N349-L351 VanDerWaalsContact C-N 3.31Å; N349-L351 PolarHBondContact O-N 3.2Å; L351-L354 WeakPolarHBondContact O-CB 3.11Å; L351-L354 PolarHBondContact O-N 3.17Å; L351-Y361 HydrophobicContact CD1-CD1 4.13Å; L351-Y361 HydrophobicContact CD1-CD2 3.81Å; L351-Y361 HydrophobicContact CD1-CE1 4.16Å; L351-Y361 HydrophobicContact CD1-CE2 3.87Å; L351-Y361 HydrophobicContact CD1-CG 3.95Å; L351-Y361 HydrophobicContact CD2-CD1 4.12Å; L351-Y361 HydrophobicContact CD2-CG 4.35Å; L351-Y361 HydrophobicContact CG-CD1 4.08Å; L351-Y361 HydrophobicContact CG-CD2 4.13Å; L351-Y361 HydrophobicContact CG-CG 3.83Å; L351-V387 HydrophobicContact CD2-CG1 4.25Å
352	E	94.6	Very high	92.9	Very high	88 Å²	88	67.3 Å²	67.3	41%	0.411	33%	0.326	S	S	.	.	H	α-helix	trans	-66.8	-38.4	175.7	-175.6	168.6	-126.6	0	0	112.4	L348 N349 D350 L354 V363	L348-E352 PolarHBondContact O-N 2.74Å; N349-E352 PolarHBondContact O-N 3.04Å; D350-E352 PolarHBondContact O-N 2.88Å; E352-L354 PolarHBondContact O-N 3.25Å; E352-V363 HydrophobicContact CB-CB 4.49Å; E352-V363 HydrophobicContact CB-CG2 3.85Å; E352-V363 HydrophobicContact CG-CG2 4.37Å; E352-V363 PolarHBondContact OE1-N 2.97Å
353	S	93.2	Very high	93	Very high	79 Å²	79	64.4 Å²	64.4	55%	0.552	31%	0.311	S	S	*	.	H	α-helix	trans	-77.1	-7.9	179.1	78.6	0	0	0	0	113.7	N349 D350 Q355	N349-S353 WeakPolarHBondContact O-CB 3.46Å; N349-S353 PolarHBondContact O-N 3.18Å; N349-S353 PolarHBondContact O-OG 2.8Å; D350-S353 WeakPolarHBondContact CA-OG 3.44Å; D350-S353 CarbonylContact O-C 3.35Å; D350-S353 PolarHBondContact O-N 3.17Å; D350-S353 PolarHBondContact O-OG 2.98Å; S353-Q355 PolarHBondContact O-N 3.43Å; S353-Q355 VanDerWaalsContact O-N 3.11Å
354	L	91	Very high	93	Very high	70 Å²	70	65.7 Å²	65.7	37%	0.366	32%	0.317	S	S	.	.			trans	-61.8	113.9	-174.3	-164.7	99.1	0	0	0	110.5	Y307 D350 L351 E352 D356 Y361	Y307-L354 HydrophobicContact CD2-CD2 4.28Å; Y307-L354 HydrophobicContact CE2-CD2 3.62Å; D350-L354 PolarHBondContact O-N 3.38Å; L351-L354 WeakPolarHBondContact O-CB 3.11Å; L351-L354 PolarHBondContact O-N 3.17Å; E352-L354 PolarHBondContact O-N 3.25Å; L354-D356 HydrophobicContact CD2-CB 3.62Å; L354-D356 HydrophobicContact CG-CB 4.42Å; L354-D356 PolarHBondContact O-N 2.68Å; L354-Y361 HydrophobicContact CD2-CD2 4.44Å; L354-Y361 HydrophobicContact CD2-CE2 4.15Å
355	Q	82.6	Confident	93.1	Very high	194 Å²	194	70 Å²	70	91%	0.907	35%	0.345	S	S	*	.			trans	-84.8	68.3	174.3	-65	-175.2	10.1	0	0	110.3	S353	S353-Q355 PolarHBondContact O-N 3.43Å; S353-Q355 VanDerWaalsContact O-N 3.11Å
356	D	78.6	Confident	93.1	Very high	34 Å²	34	69 Å²	69	18%	0.182	34%	0.343	C	S	.	.			trans	-83.3	140.6	169.6	176.9	24.4	0	0	0	110.3	H311 L354 K358 M359 L392	H311-D356 IonicContact CE1-OD2 3.06Å; H311-D356 IonicContact NE2-OD2 3.86Å; H311-D356 PolarHBondContact NE2-OD2 2.86Å; L354-D356 HydrophobicContact CD2-CB 3.62Å; L354-D356 HydrophobicContact CG-CB 4.42Å; L354-D356 PolarHBondContact O-N 2.68Å; D356-K358 VanDerWaalsContact C-N 3.27Å; D356-K358 PolarHBondContact OD1-N 2.98Å; D356-K358 WeakPolarHBondContact OD2-CB 2.91Å; D356-M359 WeakPolarHBondContact OD2-CB 3.37Å; D356-M359 PolarHBondContact OD2-N 2.94Å; D356-L392 VanDerWaalsContact O-CD1 3.24Å; D356-L392 WeakPolarHBondContact O-CD1 3.49Å
357	R	79.6	Confident	93	Very high	241 Å²	241	72.4 Å²	72.4	91%	0.909	35%	0.353	S	S	*	.	S	Bend	trans	-79	-15.6	177.3	-65.1	-177.4	179.8	178.8	0.6	112.1
358	K	86.6	Confident	93	Very high	82 Å²	82	73.4 Å²	73.4	36%	0.357	36%	0.358	S	S	.	.	S	Bend	trans	-102.9	-45.5	-173.2	-161.8	-163.6	-151.2	-160.6	0	112.1	H311 D356 W391 L392	H311-K358 PolarHBondContact O-NZ 2.84Å; D356-K358 VanDerWaalsContact C-N 3.27Å; D356-K358 PolarHBondContact OD1-N 2.98Å; D356-K358 WeakPolarHBondContact OD2-CB 2.91Å; K358-W391 HydrophobicContact CD-CE3 4.41Å; K358-W391 HydrophobicContact CD-CH2 3.68Å; K358-W391 HydrophobicContact CD-CZ3 3.53Å; K358-W391 HydrophobicContact CG-CE3 3.81Å; K358-W391 HydrophobicContact CG-CH2 3.99Å; K358-W391 HydrophobicContact CG-CZ3 3.29Å; K358-W391 VanDerWaalsContact NZ-CH2 3.35Å; K358-L392 PolarHBondContact O-N 3.47Å
359	M	91.1	Very high	92.8	Very high	1 Å²	1	79.7 Å²	79.7	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	146.3	-175.8	-67.6	-66.2	-64	0	0	111.8	D356 Y361 A389 E390 W391	D356-M359 WeakPolarHBondContact OD2-CB 3.37Å; D356-M359 PolarHBondContact OD2-N 2.94Å; M359-Y361 HydrophobicContact CB-CE2 3.98Å; M359-A389 HydrophobicContact CE-CB 3.56Å; M359-A389 WeakPolarHBondContact CE-O 3.49Å; M359-E390 CarbonylContact C-O 3.58Å; M359-E390 WeakPolarHBondContact CA-O 3.2Å; M359-W391 HydrophobicContact SD-CB 4.41Å; M359-W391 HydrophobicContact SD-CD2 3.6Å; M359-W391 VanDerWaalsContact SD-CD2 3.6Å; M359-W391 HydrophobicContact SD-CE3 4.19Å; M359-W391 HydrophobicContact SD-CG 3.73Å; M359-W391 HydrophobicContact SD-CZ2 4.22Å
360	K	94.6	Very high	92.7	Very high	102 Å²	102	77.3 Å²	77.3	44%	0.443	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.1	167.4	-178.2	-176.3	175	-164.4	0	109.2	E390 L392	K360-E390 PolarHBondContact N-O 3.43Å; K360-E390 PolarHBondContact O-N 3.16Å; K360-L392 HydrophobicContact CB-CD1 4.34Å; K360-L392 HydrophobicContact CB-CD2 3.81Å; K360-L392 HydrophobicContact CB-CG 4.04Å; K360-L392 HydrophobicContact CD-CD2 4.42Å
361	Y	96.3	Very high	92.6	Very high	6 Å²	6	74.3 Å²	74.3	2%	0.024	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	140.4	172.8	-60.9	-85.2	0	0	0	109.9	Y307 T310 H311 L351 L354 M359 V387 I388 A389	Y307-Y361 HydrophobicContact CD2-CE2 4.5Å; T310-Y361 HydrophobicContact CG2-CE1 4.5Å; T310-Y361 PolarHBondContact OG1-OH 2.76Å; H311-Y361 PolarHBondContact CE1-OH 3.48Å; L351-Y361 HydrophobicContact CD1-CD1 4.13Å; L351-Y361 HydrophobicContact CD1-CD2 3.81Å; L351-Y361 HydrophobicContact CD1-CE1 4.16Å; L351-Y361 HydrophobicContact CD1-CE2 3.87Å; L351-Y361 HydrophobicContact CD1-CG 3.95Å; L351-Y361 HydrophobicContact CD2-CD1 4.12Å; L351-Y361 HydrophobicContact CD2-CG 4.35Å; L351-Y361 HydrophobicContact CG-CD1 4.08Å; L351-Y361 HydrophobicContact CG-CD2 4.13Å; L351-Y361 HydrophobicContact CG-CG 3.83Å; L354-Y361 HydrophobicContact CD2-CD2 4.44Å; L354-Y361 HydrophobicContact CD2-CE2 4.15Å; M359-Y361 HydrophobicContact CB-CE2 3.98Å; Y361-V387 HydrophobicContact CD1-CG1 4.05Å; Y361-I388 CarbonylContact C-O 3.57Å; Y361-I388 VanDerWaalsContact CA-O 3.29Å; Y361-I388 WeakPolarHBondContact CA-O 3.39Å; Y361-A389 HydrophobicContact CD1-CB 3.72Å; Y361-A389 HydrophobicContact CE1-CB 3.5Å
362	T	97.1	Very high	92.5	Very high	45 Å²	45	76.9 Å²	76.9	28%	0.276	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	127.4	172.1	-61.9	0	0	0	0	108.1	V387 I388	T362-V387 CarbonylContact O-C 3.6Å; T362-V387 VanDerWaalsContact O-CA 3.28Å; T362-V387 WeakPolarHBondContact O-CA 3.45Å; T362-I388 PolarHBondContact N-O 2.94Å; T362-I388 PolarHBondContact O-N 2.93Å
363	V	97.8	Very high	92.4	Very high	18 Å²	18	73.3 Å²	73.3	11%	0.109	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	128.6	-173.8	179	0	0	0	0	109.4	L348 E352 W385 V387	L348-V363 HydrophobicContact CD1-CB 4.46Å; L348-V363 HydrophobicContact CD1-CG1 3.9Å; L348-V363 HydrophobicContact CD1-CG2 3.65Å; L348-V363 HydrophobicContact CD2-CG1 3.75Å; L348-V363 HydrophobicContact CG-CG1 3.72Å; L348-V363 HydrophobicContact CG-CG2 4.08Å; E352-V363 HydrophobicContact CB-CB 4.49Å; E352-V363 HydrophobicContact CB-CG2 3.85Å; E352-V363 HydrophobicContact CG-CG2 4.37Å; E352-V363 PolarHBondContact OE1-N 2.97Å; V363-W385 HydrophobicContact CG1-CE3 3.81Å; V363-W385 HydrophobicContact CG1-CZ3 4.15Å; V363-V387 HydrophobicContact CG1-CG2 4.49Å; V363-V387 HydrophobicContact CG2-CG1 4.06Å; V363-V387 HydrophobicContact CG2-CG2 4.07Å
364	E	97.4	Very high	92.3	Very high	73 Å²	73	69.7 Å²	69.7	34%	0.341	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	130.9	176.6	64.6	-175.3	-177.1	0	0	111.7	K386	E364-K386 HydrophobicContact CG-CB 3.81Å; E364-K386 HydrophobicContact CG-CD 4.35Å; E364-K386 HydrophobicContact CG-CG 4.01Å; E364-K386 PolarHBondContact N-O 3.23Å; E364-K386 PolarHBondContact O-N 3Å; E364-K386 WeakPolarHBondContact OE1-CD 3.39Å; E364-K386 WeakPolarHBondContact OE1-CE 3.47Å; E364-K386 IonicContact OE1-NZ 3.41Å; E364-K386 PolarHBondContact OE1-NZ 2.86Å
365	P	97.8	Very high	92.2	Very high	90 Å²	90	71.2 Å²	71.2	58%	0.584	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	138.3	168.1	29.5	-31.5	0	0	0	109.8	W385	P365-W385 HydrophobicContact CB-CD2 4.37Å; P365-W385 HydrophobicContact CB-CE3 3.92Å; P365-W385 HydrophobicContact CB-CH2 3.95Å; P365-W385 HydrophobicContact CB-CZ2 4.4Å; P365-W385 HydrophobicContact CB-CZ3 3.7Å; P365-W385 HydrophobicContact CG-CH2 4.4Å; P365-W385 HydrophobicContact CG-CZ3 4.05Å
366	I	98.1	Very high	92.5	Very high	28 Å²	28	63.2 Å²	63.2	14%	0.144	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.1	174.2	-65.8	167.2	0	0	0	108.7	Y185 Y320 F370 L384 K386	Y185-I366 HydrophobicContact CD2-CG2 4.26Å; Y185-I366 HydrophobicContact CE1-CD1 4.07Å; Y185-I366 HydrophobicContact CE2-CD1 4.16Å; Y185-I366 HydrophobicContact CE2-CG2 3.79Å; Y320-I366 HydrophobicContact CD1-CD1 3.89Å; Y320-I366 HydrophobicContact CE1-CD1 3.88Å; I366-F370 HydrophobicContact CG2-CE1 4.48Å; I366-L384 HydrophobicContact CB-CB 4.18Å; I366-L384 HydrophobicContact CB-CD2 4.03Å; I366-L384 HydrophobicContact CB-CG 4.11Å; I366-L384 HydrophobicContact CD1-CD2 3.81Å; I366-L384 HydrophobicContact CD1-CG 3.88Å; I366-L384 HydrophobicContact CG2-CD2 3.91Å; I366-L384 PolarHBondContact N-O 3.29Å; I366-K386 HydrophobicContact CD1-CB 3.65Å; I366-K386 HydrophobicContact CG1-CB 4.02Å
367	K	96.8	Very high	93	Very high	164 Å²	164	67.3 Å²	67.3	71%	0.713	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-66.1	135	170.7	-65.5	-173.7	178.6	-175.9	0	110.2	D369	K367-D369 PolarHBondContact O-N 2.76Å
368	L	95.7	Very high	93.6	Very high	45 Å²	45	58.8 Å²	58.8	24%	0.236	29%	0.289	C	S	.	.			trans	-79.7	31.6	-178.3	-51.4	-172.3	0	0	0	113.4	L181 F370 R378 L382 L384	L181-L368 HydrophobicContact CD1-CD1 3.99Å; L181-L368 HydrophobicContact CD1-CD2 4.05Å; L181-L368 HydrophobicContact CD2-CD1 4.22Å; L181-L368 HydrophobicContact CD2-CD2 4.07Å; L181-L368 HydrophobicContact CG-CD2 4.42Å; L368-F370 HydrophobicContact CB-CE1 4.3Å; L368-F370 HydrophobicContact CD2-CE1 3.78Å; L368-F370 HydrophobicContact CD2-CZ 4.03Å; L368-F370 PolarHBondContact O-N 2.71Å; L368-R378 PolarHBondContact O-NH1 3.24Å; L368-L382 HydrophobicContact CD1-CB 4.47Å; L368-L382 WeakPolarHBondContact CD1-O 3.07Å; L368-L384 HydrophobicContact CD2-CB 3.75Å
369	D	93.6	Very high	93.9	Very high	132 Å²	132	55.9 Å²	55.9	71%	0.706	28%	0.279	S	S	*	.			trans	-83.5	49.7	-178.5	-59.5	-27.3	0	0	0	110.9	K367	K367-D369 PolarHBondContact O-N 2.76Å
370	F	94.5	Very high	94	Very high	16 Å²	16	64.3 Å²	64.3	7%	0.07	32%	0.318	C	S	.	.	S	Bend	trans	-136.2	156.9	-179.8	56.7	-96.2	0	0	0	112.5	L181 D184 Y185 F188 I366 L368 R378 L384	L181-F370 HydrophobicContact CD1-CE2 4.33Å; L181-F370 HydrophobicContact CD1-CZ 3.89Å; L181-F370 HydrophobicContact CG-CZ 4.39Å; D184-F370 HydrophobicContact CB-CD2 4.14Å; D184-F370 HydrophobicContact CB-CE2 3.67Å; Y185-F370 AromaticContact CD2-CD1 3.97Å; Y185-F370 HydrophobicContact CD2-CD1 3.97Å; Y185-F370 AromaticContact CD2-CE1 3.77Å; Y185-F370 HydrophobicContact CD2-CE1 3.77Å; Y185-F370 HydrophobicContact CD2-CG 4.47Å; Y185-F370 HydrophobicContact CD2-CZ 4.15Å; Y185-F370 HydrophobicContact CG-CZ 4.47Å; F188-F370 HydrophobicContact CB-CB 4.06Å; F188-F370 HydrophobicContact CB-CD2 4.46Å; F188-F370 HydrophobicContact CB-CG 4.49Å; F188-F370 HydrophobicContact CD1-CB 3.36Å; F188-F370 HydrophobicContact CD1-CG 4.18Å; F188-F370 HydrophobicContact CD2-CB 3.83Å; F188-F370 HydrophobicContact CE1-CB 3.6Å; F188-F370 HydrophobicContact CE2-CB 4.05Å; F188-F370 HydrophobicContact CG-CB 3.48Å; F188-F370 VanDerWaalsContact CG-CB 3.48Å; F188-F370 HydrophobicContact CG-CG 4.35Å; F188-F370 HydrophobicContact CZ-CB 3.94Å; I366-F370 HydrophobicContact CG2-CE1 4.48Å; L368-F370 HydrophobicContact CB-CE1 4.3Å; L368-F370 HydrophobicContact CD2-CE1 3.78Å; L368-F370 HydrophobicContact CD2-CZ 4.03Å; L368-F370 PolarHBondContact O-N 2.71Å; F370-R378 PolarHBondContact O-NH1 3.05Å; F370-L384 HydrophobicContact CE1-CD2 4.18Å; F370-L384 HydrophobicContact CZ-CD2 4.22Å
371	C	93.1	Very high	94	Very high	39 Å²	39	62.6 Å²	62.6	26%	0.264	31%	0.312	S	S	.	.			trans	-59	150.8	-176.9	-66.5	0	0	0	0	112	F373 R378	C371-F373 HydrophobicContact CB-CD2 4.48Å; C371-F373 HydrophobicContact CB-CE2 3.89Å; C371-F373 HydrophobicContact CB-CZ 4.04Å; C371-R378 PolarHBondContact O-NH2 2.98Å
372	Q	93	Very high	94	Very high	68 Å²	68	62.6 Å²	62.6	32%	0.318	31%	0.312	S	S	.	.			trans	-101.1	117.8	172.1	177.1	168	-21.9	0	0	109	D184 L374 Y376	D184-Q372 WeakPolarHBondContact OD2-CA 3.26Å; D184-Q372 WeakPolarHBondContact OD2-CG 3.34Å; Q372-L374 WeakPolarHBondContact CG-O 3.34Å; Q372-L374 PolarHBondContact NE2-O 3.32Å; Q372-Y376 HydrophobicContact CG-CD1 4.44Å; Q372-Y376 HydrophobicContact CG-CE1 4Å; Q372-Y376 PolarHBondContact NE2-O 2.73Å
373	F	93.1	Very high	94.1	Very high	12 Å²	12	62.2 Å²	62.2	5%	0.053	31%	0.307	C	S	.	.			trans	-99.3	-22	-178	-62.8	-91.3	0	0	0	111.7	L52 L53 W54 D184 L187 F188 C371	L52-F373 CarbonylContact C-O 3.52Å; L52-F373 WeakPolarHBondContact CA-O 3.13Å; L53-F373 WeakPolarHBondContact CB-O 3.45Å; L53-F373 PolarHBondContact N-O 2.89Å; L53-F373 WeakPolarHBondContact O-CD1 3.43Å; W54-F373 HydrophobicContact CE3-CD1 4.08Å; W54-F373 HydrophobicContact CE3-CE1 4.35Å; W54-F373 HydrophobicContact CZ3-CD1 4.18Å; D184-F373 HydrophobicContact CB-CD2 4.37Å; D184-F373 WeakPolarHBondContact OD1-CA 3.42Å; D184-F373 WeakPolarHBondContact OD1-CB 3.49Å; D184-F373 PolarHBondContact OD1-N 3.23Å; L187-F373 HydrophobicContact CB-CD1 4.24Å; L187-F373 HydrophobicContact CB-CD2 3.65Å; L187-F373 HydrophobicContact CB-CE1 4.36Å; L187-F373 HydrophobicContact CB-CE2 3.78Å; L187-F373 HydrophobicContact CB-CG 3.88Å; L187-F373 HydrophobicContact CB-CZ 4.14Å; L187-F373 HydrophobicContact CD1-CB 3.64Å; L187-F373 HydrophobicContact CD1-CD1 4.37Å; L187-F373 HydrophobicContact CD1-CD2 4.32Å; L187-F373 HydrophobicContact CD1-CG 3.87Å; F188-F373 HydrophobicContact CB-CE2 4.06Å; C371-F373 HydrophobicContact CB-CD2 4.48Å; C371-F373 HydrophobicContact CB-CE2 3.89Å; C371-F373 HydrophobicContact CB-CZ 4.04Å
374	L	90.9	Very high	94.1	Very high	3 Å²	3	61.5 Å²	61.5	2%	0.016	30%	0.303	C	S	.	.	S	Bend	trans	-109.3	147.3	176.8	-70.4	160.7	0	0	0	110.8	F50 L52 F180 A183 D184 Q372 Y376	F50-L374 HydrophobicContact CB-CD2 3.8Å; L52-L374 HydrophobicContact CD2-CD2 3.75Å; L52-L374 HydrophobicContact CD2-CG 4.17Å; F180-L374 HydrophobicContact CB-CD1 4.19Å; F180-L374 HydrophobicContact CD1-CD1 3.77Å; F180-L374 HydrophobicContact CE1-CD1 4.45Å; F180-L374 HydrophobicContact CG-CD1 4.11Å; A183-L374 HydrophobicContact CB-CD1 3.62Å; D184-L374 PolarHBondContact OD1-N 2.99Å; D184-L374 VanDerWaalsContact OD1-N 3.11Å; Q372-L374 WeakPolarHBondContact CG-O 3.34Å; Q372-L374 PolarHBondContact NE2-O 3.32Å; L374-Y376 HydrophobicContact CB-CD1 4.16Å; L374-Y376 HydrophobicContact CB-CE1 4.47Å; L374-Y376 WeakPolarHBondContact O-CD1 3.31Å; L374-Y376 PolarHBondContact O-N 3.38Å
375	I	87.6	Confident	94.2	Very high	102 Å²	102	59 Å²	59	52%	0.523	29%	0.29	S	S	.	.			trans	-84.8	108	177	-58.7	174	0	0	0	109.3	L53	L53-I375 HydrophobicContact CD1-CD1 4.37Å; L53-I375 HydrophobicContact CD1-CG1 3.79Å; L53-I375 HydrophobicContact CG-CG1 4.4Å
376	Y	89.8	Confident	94.2	Very high	26 Å²	26	56.7 Å²	56.7	10%	0.102	27%	0.271	C	S	.	.	S	Bend	trans	-159.7	169.7	172.3	72	-72.9	0	0	0	109.3	R177 F180 L181 D184 Q372 L374 R378 L382	R177-Y376 HydrophobicContact CB-CD2 4.41Å; F180-Y376 HydrophobicContact CB-CD1 3.68Å; F180-Y376 HydrophobicContact CB-CD2 4.12Å; F180-Y376 HydrophobicContact CB-CE1 3.66Å; F180-Y376 HydrophobicContact CB-CE2 4.08Å; F180-Y376 HydrophobicContact CB-CG 3.96Å; F180-Y376 AromaticContact CD2-CD1 3.87Å; F180-Y376 HydrophobicContact CD2-CD1 3.87Å; F180-Y376 HydrophobicContact CD2-CD2 4.22Å; F180-Y376 AromaticContact CD2-CG 3.64Å; F180-Y376 HydrophobicContact CD2-CG 3.64Å; F180-Y376 HydrophobicContact CG-CD1 4.22Å; F180-Y376 HydrophobicContact CG-CG 4.32Å; L181-Y376 VanDerWaalsContact CA-OH 3.28Å; L181-Y376 WeakPolarHBondContact CA-OH 3.31Å; L181-Y376 WeakPolarHBondContact CD1-OH 3.25Å; L181-Y376 PolarHBondContact N-OH 3.23Å; D184-Y376 VanDerWaalsContact OD2-CE1 3.27Å; D184-Y376 WeakPolarHBondContact OD2-CE1 3.26Å; D184-Y376 PolarHBondContact OD2-OH 2.96Å; Q372-Y376 HydrophobicContact CG-CD1 4.44Å; Q372-Y376 HydrophobicContact CG-CE1 4Å; Q372-Y376 PolarHBondContact NE2-O 2.73Å; L374-Y376 HydrophobicContact CB-CD1 4.16Å; L374-Y376 HydrophobicContact CB-CE1 4.47Å; L374-Y376 WeakPolarHBondContact O-CD1 3.31Å; L374-Y376 PolarHBondContact O-N 3.38Å; Y376-R378 HydrophobicContact CE2-CB 4.17Å; Y376-R378 PolarHBondContact OH-NE 2.81Å; Y376-L382 HydrophobicContact CE2-CD1 3.9Å
377	E	89.8	Confident	94.2	Very high	121 Å²	121	55.3 Å²	55.3	57%	0.565	26%	0.264	S	S	*	.			trans	-86.5	114.5	174.5	-179.6	-177.5	-152.6	0	0	109.9	R177 T379	R177-E377 IonicContact CZ-OE2 3.02Å; R177-E377 IonicContact NH1-OE2 3.73Å; R177-E377 PolarHBondContact NH1-OE2 3.22Å; R177-E377 IonicContact NH2-OE2 2.72Å; R177-E377 PolarHBondContact NH2-OE2 3.11Å; E377-T379 HydrophobicContact CG-CG2 4Å; E377-T379 PolarHBondContact O-N 3.13Å
378	R	90.9	Very high	94.3	Very high	61 Å²	61	49.2 Å²	49.2	23%	0.23	24%	0.239	C	C	.	.			trans	-84.1	91.1	172.9	-168.5	-177.7	-67.8	177.6	0.2	109.3	L181 D184 L368 F370 C371 Y376 L382	L181-R378 HydrophobicContact CD1-CG 4.1Å; D184-R378 IonicContact OD2-CZ 3.13Å; D184-R378 IonicContact OD2-NH2 2.66Å; D184-R378 PolarHBondContact OD2-NH2 3.25Å; L368-R378 PolarHBondContact O-NH1 3.24Å; F370-R378 PolarHBondContact O-NH1 3.05Å; C371-R378 PolarHBondContact O-NH2 2.98Å; Y376-R378 HydrophobicContact CE2-CB 4.17Å; Y376-R378 PolarHBondContact OH-NE 2.81Å; R378-L382 HydrophobicContact CB-CD1 4.46Å; R378-L382 HydrophobicContact CG-CD1 4.04Å
379	T	92.5	Very high	94.3	Very high	21 Å²	21	47.1 Å²	47.1	13%	0.129	23%	0.227	C	C	.	.			trans	-70.6	162.7	-178.7	62.3	0	0	0	0	112.5	E324 E377 Q381 L382	E324-T379 PolarHBondContact OE1-OG1 3.1Å; E324-T379 VanDerWaalsContact OE1-OG1 3.05Å; E377-T379 HydrophobicContact CG-CG2 4Å; E377-T379 PolarHBondContact O-N 3.13Å; T379-Q381 PolarHBondContact O-N 2.97Å; T379-L382 PolarHBondContact O-N 3.02Å
380	E	93.6	Very high	94.3	Very high	179 Å²	179	45 Å²	45	84%	0.836	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-14.9	172.6	-61.2	-177.2	170.5	0	0	112.6	L382	E380-L382 VanDerWaalsContact C-N 3.33Å
381	Q	95.3	Very high	94.1	Very high	65 Å²	65	48.1 Å²	48.1	30%	0.304	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-15.1	178.8	-73.2	69.4	38.3	0	0	112.6	E324 K325 L327 T379	E324-Q381 HydrophobicContact CG-CB 4.13Å; K325-Q381 HydrophobicContact CB-CB 3.94Å; K325-Q381 HydrophobicContact CB-CG 4.15Å; K325-Q381 WeakPolarHBondContact CG-O 3.19Å; K325-Q381 PolarHBondContact N-O 2.96Å; L327-Q381 HydrophobicContact CD1-CG 4.4Å; T379-Q381 PolarHBondContact O-N 2.97Å
382	L	96.6	Very high	93.6	Very high	6 Å²	6	50 Å²	50	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	132.4	176	-79.2	168.2	0	0	0	111.3	R177 L181 I323 E324 L368 Y376 R378 T379 E380	R177-L382 HydrophobicContact CB-CD1 4.3Å; R177-L382 HydrophobicContact CB-CD2 4.07Å; L181-L382 HydrophobicContact CB-CD2 4.43Å; L181-L382 HydrophobicContact CD2-CB 3.96Å; L181-L382 HydrophobicContact CD2-CD2 4.27Å; I323-L382 CarbonylContact O-C 3.57Å; I323-L382 WeakPolarHBondContact O-CA 3.48Å; E324-L382 HydrophobicContact CB-CD2 3.78Å; E324-L382 HydrophobicContact CB-CG 4.43Å; E324-L382 HydrophobicContact CG-CD2 4.3Å; E324-L382 HydrophobicContact CG-CG 4.45Å; L368-L382 HydrophobicContact CD1-CB 4.47Å; L368-L382 WeakPolarHBondContact CD1-O 3.07Å; Y376-L382 HydrophobicContact CE2-CD1 3.9Å; R378-L382 HydrophobicContact CB-CD1 4.46Å; R378-L382 HydrophobicContact CG-CD1 4.04Å; T379-L382 PolarHBondContact O-N 3.02Å; E380-L382 VanDerWaalsContact C-N 3.33Å
383	E	97.9	Very high	92.4	Very high	38 Å²	38	56.8 Å²	56.8	18%	0.178	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	149.2	174.4	-64.8	-169.8	168.2	0	0	111.3	S322 I323 K325 Y341 W385	S322-E383 WeakPolarHBondContact CA-O 3.37Å; I323-E383 HydrophobicContact CG2-CB 4.02Å; I323-E383 PolarHBondContact N-O 3.49Å; I323-E383 PolarHBondContact O-N 3.36Å; K325-E383 VanDerWaalsContact CE-CD 3.44Å; K325-E383 WeakPolarHBondContact CE-OE1 3.33Å; K325-E383 IonicContact NZ-OE1 3.3Å; K325-E383 PolarHBondContact NZ-OE1 3.12Å; Y341-E383 WeakPolarHBondContact CE2-OE2 3.45Å; Y341-E383 PolarHBondContact OH-OE1 3.37Å; Y341-E383 PolarHBondContact OH-OE2 3.1Å; E383-W385 VanDerWaalsContact OE2-CE2 3.31Å; E383-W385 VanDerWaalsContact OE2-CZ2 3.3Å; E383-W385 WeakPolarHBondContact OE2-CZ2 3.47Å; E383-W385 PolarHBondContact OE2-NE1 3Å
384	L	98.5	Very high	92.3	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.8	173.2	-173.3	68.3	0	0	0	108.7	L181 L182 Y185 F321 I366 L368 F370	L181-L384 HydrophobicContact CD2-CB 4.09Å; L182-L384 HydrophobicContact CD1-CD1 4.06Å; Y185-L384 HydrophobicContact CD1-CD2 3.84Å; Y185-L384 HydrophobicContact CD2-CD2 3.6Å; Y185-L384 HydrophobicContact CE1-CD2 4.39Å; Y185-L384 HydrophobicContact CE2-CD2 4.19Å; Y185-L384 HydrophobicContact CG-CD2 3.41Å; Y185-L384 VanDerWaalsContact CG-CD2 3.41Å; F321-L384 CarbonylContact O-C 3.47Å; F321-L384 WeakPolarHBondContact O-CA 3.48Å; I366-L384 HydrophobicContact CB-CB 4.18Å; I366-L384 HydrophobicContact CB-CD2 4.03Å; I366-L384 HydrophobicContact CB-CG 4.11Å; I366-L384 HydrophobicContact CD1-CD2 3.81Å; I366-L384 HydrophobicContact CD1-CG 3.88Å; I366-L384 HydrophobicContact CG2-CD2 3.91Å; I366-L384 PolarHBondContact N-O 3.29Å; L368-L384 HydrophobicContact CD2-CB 3.75Å; F370-L384 HydrophobicContact CE1-CD2 4.18Å; F370-L384 HydrophobicContact CZ-CD2 4.22Å
385	W	98.6	Very high	92.4	Very high	21 Å²	21	62 Å²	62	8%	0.08	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.2	-178.9	-65.1	84.9	0	0	0	110	Y320 F321 F344 L348 V363 P365 E383	Y320-W385 WeakPolarHBondContact CA-O 3.48Å; F321-W385 HydrophobicContact CB-CB 4.24Å; F321-W385 PolarHBondContact N-O 3.07Å; F321-W385 PolarHBondContact O-N 3.15Å; F344-W385 HydrophobicContact CZ-CG 4.35Å; L348-W385 HydrophobicContact CD2-CD2 4.09Å; L348-W385 HydrophobicContact CD2-CE3 4.03Å; L348-W385 HydrophobicContact CD2-CG 4.34Å; V363-W385 HydrophobicContact CG1-CE3 3.81Å; V363-W385 HydrophobicContact CG1-CZ3 4.15Å; P365-W385 HydrophobicContact CB-CD2 4.37Å; P365-W385 HydrophobicContact CB-CE3 3.92Å; P365-W385 HydrophobicContact CB-CH2 3.95Å; P365-W385 HydrophobicContact CB-CZ2 4.4Å; P365-W385 HydrophobicContact CB-CZ3 3.7Å; P365-W385 HydrophobicContact CG-CH2 4.4Å; P365-W385 HydrophobicContact CG-CZ3 4.05Å; E383-W385 VanDerWaalsContact OE2-CE2 3.31Å; E383-W385 VanDerWaalsContact OE2-CZ2 3.3Å; E383-W385 WeakPolarHBondContact OE2-CZ2 3.47Å; E383-W385 PolarHBondContact OE2-NE1 3Å
386	K	98.5	Very high	92.7	Very high	41 Å²	41	59.8 Å²	59.8	18%	0.178	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	132	172.2	167.6	169.1	165.2	-137.3	0	109.4	T318 V319 Y320 E364 I366 I388	T318-K386 HydrophobicContact CG2-CD 3.74Å; T318-K386 VanDerWaalsContact CG2-CE 3.47Å; T318-K386 HydrophobicContact CG2-CG 3.63Å; V319-K386 CarbonylContact O-C 3.56Å; V319-K386 WeakPolarHBondContact O-CA 3.25Å; Y320-K386 HydrophobicContact CD1-CB 4.15Å; Y320-K386 HydrophobicContact CE1-CB 4.06Å; Y320-K386 HydrophobicContact CE1-CD 3.75Å; Y320-K386 HydrophobicContact CE1-CG 4.06Å; E364-K386 HydrophobicContact CG-CB 3.81Å; E364-K386 HydrophobicContact CG-CD 4.35Å; E364-K386 HydrophobicContact CG-CG 4.01Å; E364-K386 PolarHBondContact N-O 3.23Å; E364-K386 PolarHBondContact O-N 3Å; E364-K386 WeakPolarHBondContact OE1-CD 3.39Å; E364-K386 WeakPolarHBondContact OE1-CE 3.47Å; E364-K386 IonicContact OE1-NZ 3.41Å; E364-K386 PolarHBondContact OE1-NZ 2.86Å; I366-K386 HydrophobicContact CD1-CB 3.65Å; I366-K386 HydrophobicContact CG1-CB 4.02Å; K386-I388 HydrophobicContact CG-CG1 4.36Å
387	V	98.4	Very high	92.8	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	124.5	173.5	-171.4	0	0	0	0	108.5	T318 V319 F321 L348 L351 Y361 T362 V363	T318-V387 CarbonylContact C-O 3.6Å; T318-V387 WeakPolarHBondContact CA-O 3.43Å; V319-V387 HydrophobicContact CB-CB 4.07Å; V319-V387 HydrophobicContact CG2-CB 4.42Å; V319-V387 PolarHBondContact N-O 3.17Å; V319-V387 PolarHBondContact O-N 2.84Å; F321-V387 HydrophobicContact CD2-CG2 4.07Å; F321-V387 HydrophobicContact CE2-CG2 3.7Å; L348-V387 HydrophobicContact CD1-CG2 3.7Å; L351-V387 HydrophobicContact CD2-CG1 4.25Å; Y361-V387 HydrophobicContact CD1-CG1 4.05Å; T362-V387 CarbonylContact O-C 3.6Å; T362-V387 VanDerWaalsContact O-CA 3.28Å; T362-V387 WeakPolarHBondContact O-CA 3.45Å; V363-V387 HydrophobicContact CG1-CG2 4.49Å; V363-V387 HydrophobicContact CG2-CG1 4.06Å; V363-V387 HydrophobicContact CG2-CG2 4.07Å
388	I	97.7	Very high	93	Very high	36 Å²	36	58.1 Å²	58.1	19%	0.185	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	119.6	175.6	-53.4	174.9	0	0	0	107.2	Y361 T362 K386 E390	Y361-I388 CarbonylContact C-O 3.57Å; Y361-I388 VanDerWaalsContact CA-O 3.29Å; Y361-I388 WeakPolarHBondContact CA-O 3.39Å; T362-I388 PolarHBondContact N-O 2.94Å; T362-I388 PolarHBondContact O-N 2.93Å; K386-I388 HydrophobicContact CG-CG1 4.36Å; I388-E390 HydrophobicContact CG2-CG 3.82Å
389	A	96.3	Very high	93.2	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	103.8	176	0	0	0	0	0	108.9	T310 S316 C317 M359 Y361	T310-A389 HydrophobicContact CG2-CB 4.26Å; S316-A389 VanDerWaalsContact CA-O 3.31Å; S316-A389 WeakPolarHBondContact CA-O 3.5Å; S316-A389 WeakPolarHBondContact CB-O 3.25Å; C317-A389 PolarHBondContact N-O 3.22Å; C317-A389 PolarHBondContact O-N 2.95Å; M359-A389 HydrophobicContact CE-CB 3.56Å; M359-A389 WeakPolarHBondContact CE-O 3.49Å; Y361-A389 HydrophobicContact CD1-CB 3.72Å; Y361-A389 HydrophobicContact CE1-CB 3.5Å
390	E	94.5	Very high	93.2	Very high	88 Å²	88	60.5 Å²	60.5	41%	0.411	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	139.2	-175.9	-81.5	170.7	167.8	0	0	112	M359 K360 I388	M359-E390 CarbonylContact C-O 3.58Å; M359-E390 WeakPolarHBondContact CA-O 3.2Å; K360-E390 PolarHBondContact N-O 3.43Å; K360-E390 PolarHBondContact O-N 3.16Å; I388-E390 HydrophobicContact CG2-CG 3.82Å
391	W	89.1	Confident	93.2	Very high	81 Å²	81	51.4 Å²	51.4	31%	0.307	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	128.6	169.6	-76.1	88.1	0	0	0	111.2	L313 S316 K358 M359 T393	L313-W391 WeakPolarHBondContact O-CZ2 3.46Å; L313-W391 PolarHBondContact O-NE1 2.85Å; S316-W391 PolarHBondContact OG-N 2.93Å; K358-W391 HydrophobicContact CD-CE3 4.41Å; K358-W391 HydrophobicContact CD-CH2 3.68Å; K358-W391 HydrophobicContact CD-CZ3 3.53Å; K358-W391 HydrophobicContact CG-CE3 3.81Å; K358-W391 HydrophobicContact CG-CH2 3.99Å; K358-W391 HydrophobicContact CG-CZ3 3.29Å; K358-W391 VanDerWaalsContact NZ-CH2 3.35Å; M359-W391 HydrophobicContact SD-CB 4.41Å; M359-W391 HydrophobicContact SD-CD2 3.6Å; M359-W391 VanDerWaalsContact SD-CD2 3.6Å; M359-W391 HydrophobicContact SD-CE3 4.19Å; M359-W391 HydrophobicContact SD-CG 3.73Å; M359-W391 HydrophobicContact SD-CZ2 4.22Å; W391-T393 PolarHBondContact O-N 3.32Å
392	L	83.8	Confident	93	Very high	80 Å²	80	50.3 Å²	50.3	42%	0.419	26%	0.257	S	S	.	.			trans	-79.8	104.5	169.9	-67.2	172.6	0	0	0	108.1	D356 K358 K360	D356-L392 VanDerWaalsContact O-CD1 3.24Å; D356-L392 WeakPolarHBondContact O-CD1 3.49Å; K358-L392 PolarHBondContact O-N 3.47Å; K360-L392 HydrophobicContact CB-CD1 4.34Å; K360-L392 HydrophobicContact CB-CD2 3.81Å; K360-L392 HydrophobicContact CB-CG 4.04Å; K360-L392 HydrophobicContact CD-CD2 4.42Å
393	T	66.3	Low	92.7	Very high	210 Å²	210	54.3 Å²	54.3	100%	1.288	28%	0.278	S	S	*	.			trans	-68.9	0	176.7	49.8	0	0	0	0	113.4	W391	W391-T393 PolarHBondContact O-N 3.32Å

Retrieved 393 of 393 residues in 86.6 ms (Link to these results)

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