X2JDC2_DROME Loading...

Fringe-like glycosyltransferase domain-containing protein

AlphaFold DB , UniProt , Accession X2JDC2, Species DROME (Drosophila melanogaster, Fruit fly), Gene Dmel\CG9109, Length 546 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	44.6	Very low	235 Å²	235	141.9 Å²	141.9	100%	1.158	76%	0.761	S	S	*	*				0	106.1	0	-71.1	-170.9	169.9	0	0	108.6
2	P	43.2	Very low	44.4	Very low	123 Å²	123	140.1 Å²	140.1	80%	0.799	75%	0.75	S	S	*	*			trans	-97.4	102.9	-173.7	33.9	-25.1	0	0	0	111.1
3	T	44.7	Very low	44	Very low	137 Å²	137	135.5 Å²	135.5	84%	0.84	73%	0.734	S	S	*	*			trans	-117.5	54.2	170.4	30.5	0	0	0	0	110.4
4	R	47.3	Very low	43.7	Very low	238 Å²	238	134.4 Å²	134.4	90%	0.898	73%	0.727	S	S	*	*	S	Bend	trans	-135.8	8.6	173.6	-78.2	-163.6	173.1	-176.1	-1.3	116.1
5	I	49.4	Very low	43.3	Very low	135 Å²	135	129.9 Å²	129.9	69%	0.692	72%	0.715	S	S	*	*	S	Bend	trans	-103.2	-12.7	-177.2	-65.7	172.4	0	0	0	113.6	V7	I5-V7 PolarHBondContact O-N 3.5Å
6	C	46.7	Very low	43	Very low	124 Å²	124	127.3 Å²	127.3	84%	0.838	71%	0.709	S	S	*	*	S	Bend	trans	-84.3	-7.2	-176.7	-76.3	0	0	0	0	116.5
7	V	49	Very low	42.6	Very low	111 Å²	111	128.2 Å²	128.2	67%	0.673	71%	0.711	S	S	*	*	S	Bend	trans	-91.1	-19.8	-176	-177.3	0	0	0	0	112.8	I5	I5-V7 PolarHBondContact O-N 3.5Å
8	L	44.1	Very low	42.3	Very low	135 Å²	135	127.2 Å²	127.2	71%	0.707	71%	0.713	S	S	*	*	H	α-helix	trans	-81.9	-24.3	179.9	-115.5	85.5	0	0	0	114.2
9	F	41.1	Very low	42.1	Very low	161 Å²	161	125.9 Å²	125.9	71%	0.706	71%	0.712	S	S	*	*	H	α-helix	trans	-81	-17.8	179	-99	-85.5	0	0	0	114
10	G	41.7	Very low	42.1	Very low	42 Å²	42	122.6 Å²	122.6	43%	0.433	71%	0.707	S	S	.	*	H	α-helix	trans	-77.4	-27.9	175.6	0	0	0	0	0	114.3
11	L	44.5	Very low	42.5	Very low	120 Å²	120	120.6 Å²	120.6	63%	0.628	70%	0.7	S	S	*	*	H	α-helix	trans	-82.2	-27.1	-179.6	-84.7	149.5	0	0	0	113.2	A15	L11-A15 PolarHBondContact O-N 3.24Å
12	L	41.8	Very low	43.5	Very low	120 Å²	120	117.7 Å²	117.7	63%	0.628	69%	0.69	S	S	*	*	H	α-helix	trans	-75.4	-28.8	174.4	-89.1	143.2	0	0	0	113	S16	L12-S16 PolarHBondContact O-N 3.42Å
13	C	39.7	Very low	45.3	Very low	81 Å²	81	118.4 Å²	118.4	55%	0.547	68%	0.68	S	S	.	*	H	α-helix	trans	-74.1	-31.2	174.1	-71.7	0	0	0	0	112.7
14	L	39.3	Very low	47.4	Very low	120 Å²	120	114 Å²	114	63%	0.628	65%	0.654	S	S	*	*	H	α-helix	trans	-78.9	-26.5	176.5	-78.6	159.4	0	0	0	113.2	S16	L14-S16 VanDerWaalsContact C-N 3.32Å
15	A	38.5	Very low	49.5	Very low	66 Å²	66	103.1 Å²	103.1	55%	0.545	62%	0.616	S	S	.	*	H	α-helix	trans	-71.2	-27.3	171.7	0	0	0	0	0	112.8	L11	L11-A15 PolarHBondContact O-N 3.24Å
16	S	37.6	Very low	51.7	Low	89 Å²	89	97 Å²	97	62%	0.622	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-17.6	176.9	178	0	0	0	0	114.2	L12 L14	L12-S16 PolarHBondContact O-N 3.42Å; L14-S16 VanDerWaalsContact C-N 3.32Å
17	L	36.3	Very low	54.1	Low	142 Å²	142	91.1 Å²	91.1	74%	0.743	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-6.4	177.7	-85	141.5	0	0	0	113
18	C	37.4	Very low	56.3	Low	110 Å²	110	85.9 Å²	85.9	74%	0.743	51%	0.512	S	S	*	.			trans	-96.8	1.6	174.1	-70.6	0	0	0	0	113.7	G20	C18-G20 PolarHBondContact O-N 3.03Å
19	C	37.5	Very low	58.8	Low	104 Å²	104	79.4 Å²	79.4	70%	0.703	48%	0.479	S	S	*	.	S	Bend	trans	-70.8	82.6	159.7	-77.8	0	0	0	0	107.8	S21	C19-S21 PolarHBondContact O-N 2.87Å
20	G	43.5	Very low	61.4	Low	59 Å²	59	71.8 Å²	71.8	61%	0.608	45%	0.445	S	S	*	.			trans	-45	119.9	161.8	0	0	0	0	0	107.1	C18 N22	C18-G20 PolarHBondContact O-N 3.03Å; G20-N22 PolarHBondContact O-N 2.7Å
21	S	49	Very low	64	Low	81 Å²	81	69.8 Å²	69.8	57%	0.566	42%	0.424	S	S	*	.			trans	-36.8	113.2	179.7	156.6	0	0	0	0	109.2	C19 K23	C19-S21 PolarHBondContact O-N 2.87Å; S21-K23 PolarHBondContact O-N 2.94Å; S21-K23 WeakPolarHBondContact OG-CB 3.28Å; S21-K23 VanDerWaalsContact OG-CD 3.28Å; S21-K23 WeakPolarHBondContact OG-CD 3.47Å; S21-K23 WeakPolarHBondContact OG-CG 3.18Å
22	N	62.2	Low	66.3	Low	174 Å²	174	65 Å²	65	93%	0.93	40%	0.402	S	S	*	.			trans	-63.7	27.2	-179.6	-114.6	10	0	0	0	113.1	G20	G20-N22 PolarHBondContact O-N 2.7Å
23	K	80.7	Confident	68.8	Low	138 Å²	138	59.4 Å²	59.4	60%	0.6	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-84.6	136.5	-179.7	-71.3	179.2	-172.8	179.1	0	107.6	S21	S21-K23 PolarHBondContact O-N 2.94Å; S21-K23 WeakPolarHBondContact OG-CB 3.28Å; S21-K23 VanDerWaalsContact OG-CD 3.28Å; S21-K23 WeakPolarHBondContact OG-CD 3.47Å; S21-K23 WeakPolarHBondContact OG-CG 3.18Å
24	P	88.4	Confident	71.2	Confident	45 Å²	45	56.4 Å²	56.4	29%	0.292	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-53.3	143.1	174.6	18.5	-30.8	0	0	0	111.8	E66 D67 V69	P24-E66 WeakPolarHBondContact CB-O 3.45Å; P24-D67 CarbonylContact C-O 3.35Å; P24-D67 VanDerWaalsContact CA-O 3.23Å; P24-D67 WeakPolarHBondContact CA-O 3.37Å; P24-D67 VanDerWaalsContact CB-C 3.48Å; P24-D67 WeakPolarHBondContact CB-O 3.48Å; P24-V69 HydrophobicContact CB-CG2 3.95Å; P24-V69 HydrophobicContact CG-CG2 3.5Å; P24-V69 VanDerWaalsContact CG-CG2 3.5Å
25	G	91.7	Very high	73.5	Confident	9 Å²	9	54.3 Å²	54.3	9%	0.093	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	146.2	170.6	0	0	0	0	0	110.8	D67 F68 V69 E103	G25-D67 PolarHBondContact N-O 3.16Å; G25-F68 CarbonylContact O-C 3.04Å; G25-F68 VanDerWaalsContact O-CA 3.26Å; G25-F68 WeakPolarHBondContact O-CA 3.41Å; G25-V69 PolarHBondContact O-N 2.98Å; G25-E103 WeakPolarHBondContact CA-OE2 3.03Å
26	E	95.3	Very high	75.7	Confident	6 Å²	6	54.6 Å²	54.6	3%	0.028	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	126.8	-179.1	-178.3	-177.4	119	0	0	110.7	V69 K71 R101 T102 E103 W104	E26-V69 WeakPolarHBondContact CA-O 3.43Å; E26-K71 HydrophobicContact CG-CD 4.14Å; E26-K71 HydrophobicContact CG-CG 4.34Å; E26-K71 WeakPolarHBondContact OE1-CD 3.41Å; E26-K71 WeakPolarHBondContact OE1-CE 3.34Å; E26-K71 IonicContact OE1-NZ 2.8Å; E26-K71 PolarHBondContact OE1-NZ 2.76Å; E26-K71 WeakPolarHBondContact OE2-CE 3.34Å; E26-K71 IonicContact OE2-NZ 2.77Å; E26-K71 PolarHBondContact OE2-NZ 3.02Å; E26-R101 WeakPolarHBondContact CB-O 3.46Å; E26-R101 PolarHBondContact N-O 2.99Å; E26-R101 VanDerWaalsContact N-O 3.16Å; E26-T102 CarbonylContact O-C 3.59Å; E26-T102 WeakPolarHBondContact O-CA 3.38Å; E26-T102 PolarHBondContact OE1-OG1 3.42Å; E26-E103 PolarHBondContact O-N 2.84Å; E26-W104 PolarHBondContact O-N 3.23Å
27	V	96.7	Very high	77.7	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	119.9	170.7	-177.1	0	0	0	0	107.8	F68 V69 L70 K71 W104 I106 L121 L124	V27-F68 HydrophobicContact CG2-CB 4.25Å; V27-F68 HydrophobicContact CG2-CD1 3.53Å; V27-F68 HydrophobicContact CG2-CE1 3.99Å; V27-F68 HydrophobicContact CG2-CG 3.89Å; V27-V69 PolarHBondContact N-O 3.14Å; V27-L70 HydrophobicContact CB-CD1 4.12Å; V27-L70 HydrophobicContact CG1-CD1 3.97Å; V27-L70 WeakPolarHBondContact O-CA 3.48Å; V27-K71 PolarHBondContact O-N 3.16Å; V27-W104 HydrophobicContact CG1-CB 4.18Å; V27-W104 HydrophobicContact CG2-CB 4.19Å; V27-I106 HydrophobicContact CG1-CD1 3.64Å; V27-I106 HydrophobicContact CG1-CG1 4.29Å; V27-L121 HydrophobicContact CB-CD2 4.34Å; V27-L121 HydrophobicContact CG1-CD2 4.23Å; V27-L121 HydrophobicContact CG2-CD2 3.89Å; V27-L124 HydrophobicContact CG1-CD1 4.04Å; V27-L124 HydrophobicContact CG2-CD1 4.24Å
28	L	95.9	Very high	79.7	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	116	176	174.8	67.7	0	0	0	109.7	V30 K71 H73 V97 T102 W104 I105 I106	L28-V30 HydrophobicContact CD1-CG2 4.39Å; L28-V30 HydrophobicContact CD2-CG2 3.75Å; L28-V30 HydrophobicContact CG-CG2 3.77Å; L28-K71 HydrophobicContact CD1-CB 3.91Å; L28-H73 HydrophobicContact CD1-CB 4.07Å; L28-V97 HydrophobicContact CD1-CG1 3.87Å; L28-V97 HydrophobicContact CD2-CG1 3.77Å; L28-V97 HydrophobicContact CG-CG1 4.46Å; L28-T102 HydrophobicContact CB-CG2 3.73Å; L28-W104 PolarHBondContact N-O 3.02Å; L28-I105 HydrophobicContact CB-CG1 4.21Å; L28-I105 HydrophobicContact CD2-CG1 4.27Å; L28-I105 CarbonylContact O-C 3.59Å; L28-I105 WeakPolarHBondContact O-CA 3.4Å; L28-I106 PolarHBondContact O-N 3.22Å
29	L	96.9	Very high	81.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	113.6	169	-170.1	148.9	0	0	0	109.1	I31 V51 L70 K71 V72 H73 I106 V114	L29-I31 HydrophobicContact CD2-CD1 3.92Å; L29-I31 HydrophobicContact CD2-CG1 3.49Å; L29-I31 VanDerWaalsContact CD2-CG1 3.49Å; L29-V51 HydrophobicContact CD1-CG1 4.22Å; L29-V51 HydrophobicContact CD1-CG2 4.05Å; L29-L70 HydrophobicContact CB-CD1 4.31Å; L29-K71 PolarHBondContact N-O 3.48Å; L29-V72 HydrophobicContact CD2-CG1 4.17Å; L29-V72 WeakPolarHBondContact O-CA 3.39Å; L29-H73 PolarHBondContact O-N 3.33Å; L29-I106 CarbonylContact C-O 3.57Å; L29-I106 WeakPolarHBondContact CA-O 3.48Å; L29-I106 HydrophobicContact CB-CB 4.4Å; L29-I106 HydrophobicContact CD1-CB 4.36Å; L29-I106 HydrophobicContact CD1-CD1 4.31Å; L29-I106 HydrophobicContact CD1-CG2 4.21Å; L29-I106 HydrophobicContact CG-CB 4.18Å; L29-I106 HydrophobicContact CG-CG2 4.32Å; L29-V114 HydrophobicContact CD1-CG2 4.21Å
30	V	95.1	Very high	84.3	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	129.1	176.7	-177.7	0	0	0	0	109	L28 H73 M75 L91 I105 I106 W107 C108	L28-V30 HydrophobicContact CD1-CG2 4.39Å; L28-V30 HydrophobicContact CD2-CG2 3.75Å; L28-V30 HydrophobicContact CG-CG2 3.77Å; V30-H73 CarbonylContact C-O 3.49Å; V30-H73 WeakPolarHBondContact CA-O 3.17Å; V30-M75 HydrophobicContact CG1-CB 4Å; V30-L91 HydrophobicContact CG2-CD1 4.46Å; V30-L91 HydrophobicContact CG2-CD2 4.47Å; V30-I105 HydrophobicContact CG2-CG2 4.08Å; V30-I106 PolarHBondContact N-O 3.26Å; V30-W107 HydrophobicContact CB-CE3 4.01Å; V30-W107 HydrophobicContact CB-CZ3 4.38Å; V30-W107 HydrophobicContact CG1-CD2 4.45Å; V30-W107 HydrophobicContact CG1-CE3 3.96Å; V30-W107 HydrophobicContact CG1-CH2 4.32Å; V30-W107 HydrophobicContact CG1-CZ3 3.9Å; V30-W107 HydrophobicContact CG2-CE3 4.43Å; V30-C108 PolarHBondContact O-N 3.43Å
31	I	95.6	Very high	86.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	102.8	173.1	-53.9	173.2	0	0	0	107.8	L29 C33 C44 L47 V72 H73 V74 M75 C108	L29-I31 HydrophobicContact CD2-CD1 3.92Å; L29-I31 HydrophobicContact CD2-CG1 3.49Å; L29-I31 VanDerWaalsContact CD2-CG1 3.49Å; I31-C33 PolarHBondContact O-N 2.78Å; I31-C44 HydrophobicContact CG2-CB 3.95Å; I31-L47 HydrophobicContact CD1-CB 4.08Å; I31-L47 HydrophobicContact CD1-CD2 3.92Å; I31-L47 HydrophobicContact CD1-CG 3.76Å; I31-L47 HydrophobicContact CG1-CD2 3.96Å; I31-L47 HydrophobicContact CG1-CG 4.34Å; I31-L47 HydrophobicContact CG2-CD2 4.04Å; I31-V72 HydrophobicContact CD1-CG1 4.19Å; I31-H73 PolarHBondContact N-O 2.96Å; I31-V74 HydrophobicContact CD1-CG2 4.28Å; I31-M75 PolarHBondContact O-N 3.09Å; I31-C108 HydrophobicContact CG1-CB 4.39Å
32	A	93.4	Very high	88.5	Confident	20 Å²	20	51.5 Å²	51.5	17%	0.165	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	112.2	174.4	0	0	0	0	0	109.7	M75 W107 C108	A32-M75 HydrophobicContact CB-CE 4.03Å; A32-W107 HydrophobicContact CB-CZ2 3.88Å; A32-C108 PolarHBondContact N-O 3.17Å
33	C	93.3	Very high	90	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.014	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	107.8	-169.7	-158.7	0	0	0	0	111.5	I31 C44 V74 M75 E77	I31-C33 PolarHBondContact O-N 2.78Å; C33-C44 WeakPolarHBondContact CA-SG 3.38Å; C33-C44 HydrophobicContact CB-CB 3.89Å; C33-C44 WeakPolarHBondContact CB-SG 3.46Å; C33-C44 WeakPolarHBondContact SG-CB 3.41Å; C33-C44 CovalentContact SG-SG 2.04Å; C33-C44 PolarHBondContact SG-SG 3.11Å; C33-V74 HydrophobicContact CB-CG1 4.12Å; C33-M75 PolarHBondContact N-O 3.32Å; C33-E77 PolarHBondContact O-N 2.89Å
34	P	91.1	Very high	90.8	Very high	19 Å²	19	38.1 Å²	38.1	12%	0.123	20%	0.201	C	C	.	.			trans	-71	152.5	178.2	31.4	-34.3	0	0	0	110.7	H36 A40	P34-H36 PolarHBondContact O-N 2.89Å; P34-A40 HydrophobicContact CG-CB 3.7Å
35	P	88.3	Confident	91.1	Very high	75 Å²	75	40.8 Å²	40.8	49%	0.487	21%	0.212	S	C	.	.	S	Bend	trans	-71.8	-24.4	179.6	30.4	-35.9	0	0	0	112.1
36	H	84.9	Confident	91.3	Very high	73 Å²	73	43 Å²	43	34%	0.338	23%	0.23	S	C	.	.			trans	-137.1	151.6	-177.9	-60.4	-71.7	0	0	0	111	P34 I454	P34-H36 PolarHBondContact O-N 2.89Å; H36-I454 HydrophobicContact CB-CB 4.43Å; H36-I454 HydrophobicContact CB-CG1 4.06Å; H36-I454 HydrophobicContact CB-CG2 3.78Å
37	P	79	Confident	91.4	Very high	37 Å²	37	42.9 Å²	42.9	24%	0.24	23%	0.229	C	C	.	.	S	Bend	cis	-66.1	162.7	-8.6	30.6	-36.1	0	0	0	111.6	Q39 A40	P37-Q39 PolarHBondContact O-N 2.8Å; P37-A40 VanDerWaalsContact O-CB 3.25Å; P37-A40 WeakPolarHBondContact O-CB 3.42Å; P37-A40 PolarHBondContact O-N 3.02Å
38	Q	78.4	Confident	91.5	Very high	168 Å²	168	43.7 Å²	43.7	79%	0.785	24%	0.235	S	C	*	.	H	α-helix	trans	-55	-31.1	-177.5	-171.7	178.8	4.7	0	0	112.8	A40 R41	Q38-A40 VanDerWaalsContact C-N 3.26Å; Q38-A40 PolarHBondContact O-N 3.34Å; Q38-R41 PolarHBondContact O-N 2.77Å
39	Q	83.2	Confident	91.6	Very high	98 Å²	98	48.9 Å²	48.9	46%	0.458	26%	0.259	S	S	.	.	H	α-helix	trans	-58.6	-34.8	174.9	-175.8	57.9	43.3	0	0	112.9	P37 R41 S42 D43	P37-Q39 PolarHBondContact O-N 2.8Å; Q39-R41 PolarHBondContact O-N 3.23Å; Q39-S42 WeakPolarHBondContact O-CA 3.23Å; Q39-S42 WeakPolarHBondContact O-CB 3.47Å; Q39-S42 PolarHBondContact O-N 3.12Å; Q39-D43 PolarHBondContact NE2-OD1 2.98Å; Q39-D43 PolarHBondContact O-N 3.46Å
40	A	88.3	Confident	91.6	Very high	1 Å²	1	52 Å²	52	1%	0.008	28%	0.276	C	S	.	.	H	α-helix	trans	-58.9	-36.3	-179	0	0	0	0	0	111.5	P34 P37 Q38 S42 D43 C44 H110	P34-A40 HydrophobicContact CG-CB 3.7Å; P37-A40 VanDerWaalsContact O-CB 3.25Å; P37-A40 WeakPolarHBondContact O-CB 3.42Å; P37-A40 PolarHBondContact O-N 3.02Å; Q38-A40 VanDerWaalsContact C-N 3.26Å; Q38-A40 PolarHBondContact O-N 3.34Å; A40-S42 PolarHBondContact O-N 3.16Å; A40-D43 PolarHBondContact O-N 3.01Å; A40-C44 PolarHBondContact O-N 2.78Å; A40-C44 PolarHBondContact O-SG 2.92Å; A40-H110 HydrophobicContact CB-CB 4.19Å
41	R	89.8	Confident	91.8	Very high	153 Å²	153	52 Å²	52	58%	0.577	28%	0.276	S	S	*	.	H	α-helix	trans	-61.7	-43.4	175.3	-172.6	177.7	-178.5	177.4	1.6	112.1	Q38 Q39 D43 C44 L45	Q38-R41 PolarHBondContact O-N 2.77Å; Q39-R41 PolarHBondContact O-N 3.23Å; R41-D43 VanDerWaalsContact C-N 3.3Å; R41-D43 PolarHBondContact O-N 3.1Å; R41-C44 PolarHBondContact O-N 2.96Å; R41-L45 WeakPolarHBondContact O-CG 3.43Å; R41-L45 PolarHBondContact O-N 3.31Å; R41-L45 VanDerWaalsContact O-N 3.13Å
42	S	91.1	Very high	91.9	Very high	63 Å²	63	55.8 Å²	55.8	44%	0.441	30%	0.295	S	S	.	.	H	α-helix	trans	-62.5	-40.1	175	-60.2	0	0	0	0	111.1	Q39 A40 L45 A46	Q39-S42 WeakPolarHBondContact O-CA 3.23Å; Q39-S42 WeakPolarHBondContact O-CB 3.47Å; Q39-S42 PolarHBondContact O-N 3.12Å; A40-S42 PolarHBondContact O-N 3.16Å; S42-L45 PolarHBondContact O-N 3.2Å; S42-A46 WeakPolarHBondContact O-CB 3.48Å; S42-A46 PolarHBondContact O-N 3.24Å
43	D	93.7	Very high	92.2	Very high	31 Å²	31	59.7 Å²	59.7	17%	0.166	31%	0.31	C	S	.	.	H	α-helix	trans	-67.9	-38.9	179.4	-59.6	-23.7	0	0	0	112.1	Q39 A40 R41 A46 L47 H110	Q39-D43 PolarHBondContact NE2-OD1 2.98Å; Q39-D43 PolarHBondContact O-N 3.46Å; A40-D43 PolarHBondContact O-N 3.01Å; R41-D43 VanDerWaalsContact C-N 3.3Å; R41-D43 PolarHBondContact O-N 3.1Å; D43-A46 PolarHBondContact O-N 3.08Å; D43-L47 WeakPolarHBondContact O-CB 3.44Å; D43-L47 PolarHBondContact O-N 2.8Å; D43-H110 HydrophobicContact CB-CB 4.35Å; D43-H110 WeakPolarHBondContact CB-O 3.36Å
44	C	95.7	Very high	92.4	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.5	-44.8	172.8	-56.7	0	0	0	0	111.9	I31 C33 A40 R41 L47 S48 V74 H110	I31-C44 HydrophobicContact CG2-CB 3.95Å; C33-C44 WeakPolarHBondContact CA-SG 3.38Å; C33-C44 HydrophobicContact CB-CB 3.89Å; C33-C44 WeakPolarHBondContact CB-SG 3.46Å; C33-C44 WeakPolarHBondContact SG-CB 3.41Å; C33-C44 CovalentContact SG-SG 2.04Å; C33-C44 PolarHBondContact SG-SG 3.11Å; A40-C44 PolarHBondContact O-N 2.78Å; A40-C44 PolarHBondContact O-SG 2.92Å; R41-C44 PolarHBondContact O-N 2.96Å; C44-L47 PolarHBondContact O-N 2.66Å; C44-S48 PolarHBondContact O-N 2.61Å; C44-V74 HydrophobicContact CB-CG1 4.33Å; C44-H110 VanDerWaalsContact SG-CB 3.53Å
45	L	95.5	Very high	92.7	Very high	100 Å²	100	62 Å²	62	52%	0.524	32%	0.319	S	S	.	.	H	α-helix	trans	-65.9	-42.3	178.5	-69.6	173.3	0	0	0	111.1	R41 S42 L47 S48 H49	R41-L45 WeakPolarHBondContact O-CG 3.43Å; R41-L45 PolarHBondContact O-N 3.31Å; R41-L45 VanDerWaalsContact O-N 3.13Å; S42-L45 PolarHBondContact O-N 3.2Å; L45-L47 PolarHBondContact O-N 2.91Å; L45-S48 PolarHBondContact O-N 3.05Å; L45-H49 WeakPolarHBondContact O-CB 3.11Å; L45-H49 PolarHBondContact O-N 3.09Å
46	A	96.2	Very high	93.2	Very high	56 Å²	56	66.8 Å²	66.8	46%	0.463	33%	0.327	S	S	.	.	H	α-helix	trans	-61.3	-43	175.9	0	0	0	0	0	111.7	S42 D43 H49 N50	S42-A46 WeakPolarHBondContact O-CB 3.48Å; S42-A46 PolarHBondContact O-N 3.24Å; D43-A46 PolarHBondContact O-N 3.08Å; A46-H49 PolarHBondContact O-N 3.21Å; A46-N50 VanDerWaalsContact O-CB 3.23Å; A46-N50 WeakPolarHBondContact O-CB 3.42Å; A46-N50 PolarHBondContact O-N 3.46Å
47	L	97.6	Very high	93.8	Very high	3 Å²	3	66.1 Å²	66.1	2%	0.016	34%	0.335	C	S	.	.	H	α-helix	trans	-62.8	-46.3	174.9	179.3	59.7	0	0	0	111.7	I31 D43 C44 L45 H49 N50 V51 C108 T112 V114	I31-L47 HydrophobicContact CD1-CB 4.08Å; I31-L47 HydrophobicContact CD1-CD2 3.92Å; I31-L47 HydrophobicContact CD1-CG 3.76Å; I31-L47 HydrophobicContact CG1-CD2 3.96Å; I31-L47 HydrophobicContact CG1-CG 4.34Å; I31-L47 HydrophobicContact CG2-CD2 4.04Å; D43-L47 WeakPolarHBondContact O-CB 3.44Å; D43-L47 PolarHBondContact O-N 2.8Å; C44-L47 PolarHBondContact O-N 2.66Å; L45-L47 PolarHBondContact O-N 2.91Å; L47-H49 VanDerWaalsContact C-N 3.35Å; L47-H49 PolarHBondContact O-N 3.17Å; L47-N50 PolarHBondContact O-N 3.22Å; L47-V51 HydrophobicContact CD1-CG2 4.34Å; L47-V51 WeakPolarHBondContact O-CG2 3.4Å; L47-V51 PolarHBondContact O-N 3.14Å; L47-C108 HydrophobicContact CD2-CB 3.86Å; L47-T112 WeakPolarHBondContact CD1-O 3.32Å; L47-V114 HydrophobicContact CD1-CG2 4.1Å
48	S	98	Very high	94.7	Very high	18 Å²	18	65.4 Å²	65.4	13%	0.126	33%	0.329	C	S	.	.	H	α-helix	trans	-58.9	-46.8	176.9	-173.6	0	0	0	0	111.5	C44 L45 V51 L52 V72	C44-S48 PolarHBondContact O-N 2.61Å; L45-S48 PolarHBondContact O-N 3.05Å; S48-V51 PolarHBondContact O-N 3.09Å; S48-L52 VanDerWaalsContact O-CG 3.29Å; S48-L52 WeakPolarHBondContact O-CG 3.35Å; S48-L52 PolarHBondContact O-N 3.21Å; S48-L52 VanDerWaalsContact O-N 3.14Å; S48-V72 WeakPolarHBondContact OG-CG1 3.23Å
49	H	98.1	Very high	95.6	Very high	110 Å²	110	62.3 Å²	62.3	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-63	-47.1	179.4	-170.2	-105.2	0	0	0	111.2	L45 A46 L47 V51 L52 E53	L45-H49 WeakPolarHBondContact O-CB 3.11Å; L45-H49 PolarHBondContact O-N 3.09Å; A46-H49 PolarHBondContact O-N 3.21Å; L47-H49 VanDerWaalsContact C-N 3.35Å; L47-H49 PolarHBondContact O-N 3.17Å; H49-V51 VanDerWaalsContact C-N 3.32Å; H49-V51 PolarHBondContact O-N 3.38Å; H49-L52 PolarHBondContact O-N 2.85Å; H49-E53 IonicContact CE1-OE1 2.74Å; H49-E53 PolarHBondContact CE1-OE1 2.89Å; H49-E53 IonicContact CE1-OE2 3.44Å; H49-E53 PolarHBondContact CE1-OE2 3.18Å; H49-E53 IonicContact ND1-OE1 3.5Å; H49-E53 PolarHBondContact ND1-OE1 3.38Å; H49-E53 IonicContact ND1-OE2 3.59Å; H49-E53 PolarHBondContact ND1-OE2 3.19Å; H49-E53 VanDerWaalsContact ND1-OE2 3.09Å; H49-E53 IonicContact NE2-OE1 3.58Å; H49-E53 WeakPolarHBondContact O-CB 3.5Å; H49-E53 WeakPolarHBondContact O-CG 3.42Å; H49-E53 PolarHBondContact O-N 2.85Å
50	N	98.2	Very high	96.2	Very high	65 Å²	65	64.3 Å²	64.3	35%	0.348	33%	0.327	S	S	.	.	H	α-helix	trans	-57.8	-42.7	179.6	178.3	-96.2	0	0	0	112.5	A46 L47 Q54	A46-N50 VanDerWaalsContact O-CB 3.23Å; A46-N50 WeakPolarHBondContact O-CB 3.42Å; A46-N50 PolarHBondContact O-N 3.46Å; L47-N50 PolarHBondContact O-N 3.22Å; N50-Q54 WeakPolarHBondContact O-CG 3.36Å; N50-Q54 PolarHBondContact O-N 3.19Å; N50-Q54 PolarHBondContact OD1-NE2 3.45Å
51	V	98.5	Very high	96.6	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-66	-44.3	177.3	171.9	0	0	0	0	111.5	L29 L47 S48 H49 Q54 Q55 L70 V72 V114 L117	L29-V51 HydrophobicContact CD1-CG1 4.22Å; L29-V51 HydrophobicContact CD1-CG2 4.05Å; L47-V51 HydrophobicContact CD1-CG2 4.34Å; L47-V51 WeakPolarHBondContact O-CG2 3.4Å; L47-V51 PolarHBondContact O-N 3.14Å; S48-V51 PolarHBondContact O-N 3.09Å; H49-V51 VanDerWaalsContact C-N 3.32Å; H49-V51 PolarHBondContact O-N 3.38Å; V51-Q54 PolarHBondContact O-N 2.88Å; V51-Q55 PolarHBondContact O-N 2.86Å; V51-L70 HydrophobicContact CG1-CD2 3.74Å; V51-V72 HydrophobicContact CB-CG2 4.47Å; V51-V72 HydrophobicContact CG1-CG2 3.75Å; V51-V114 HydrophobicContact CG2-CB 4.11Å; V51-V114 HydrophobicContact CG2-CG2 3.78Å; V51-L117 HydrophobicContact CG1-CD1 4.47Å; V51-L117 HydrophobicContact CG1-CD2 4.36Å
52	L	98.2	Very high	96.9	Very high	79 Å²	79	63.3 Å²	63.3	41%	0.414	36%	0.359	S	S	.	.	H	α-helix	trans	-67.2	-36.3	179.8	-68.5	171.8	0	0	0	112.3	S48 H49 Q55 R56 V72	S48-L52 VanDerWaalsContact O-CG 3.29Å; S48-L52 WeakPolarHBondContact O-CG 3.35Å; S48-L52 PolarHBondContact O-N 3.21Å; S48-L52 VanDerWaalsContact O-N 3.14Å; H49-L52 PolarHBondContact O-N 2.85Å; L52-Q55 PolarHBondContact O-N 2.93Å; L52-R56 WeakPolarHBondContact O-CB 3.45Å; L52-R56 PolarHBondContact O-N 2.83Å; L52-V72 HydrophobicContact CD2-CB 4.27Å; L52-V72 HydrophobicContact CD2-CG2 3.83Å; L52-V72 HydrophobicContact CG-CG2 4.25Å
53	E	98.3	Very high	97.1	Very high	102 Å²	102	63.9 Å²	63.9	48%	0.477	36%	0.356	S	S	.	.	H	α-helix	trans	-64.5	-44.1	172.6	-76.1	-176.3	133.2	0	0	111.7	H49 Q55 R56 A57	H49-E53 IonicContact CE1-OE1 2.74Å; H49-E53 PolarHBondContact CE1-OE1 2.89Å; H49-E53 IonicContact CE1-OE2 3.44Å; H49-E53 PolarHBondContact CE1-OE2 3.18Å; H49-E53 IonicContact ND1-OE1 3.5Å; H49-E53 PolarHBondContact ND1-OE1 3.38Å; H49-E53 IonicContact ND1-OE2 3.59Å; H49-E53 PolarHBondContact ND1-OE2 3.19Å; H49-E53 VanDerWaalsContact ND1-OE2 3.09Å; H49-E53 IonicContact NE2-OE1 3.58Å; H49-E53 WeakPolarHBondContact O-CB 3.5Å; H49-E53 WeakPolarHBondContact O-CG 3.42Å; H49-E53 PolarHBondContact O-N 2.85Å; E53-Q55 VanDerWaalsContact C-N 3.34Å; E53-Q55 PolarHBondContact O-N 3.22Å; E53-R56 PolarHBondContact O-N 2.97Å; E53-A57 WeakPolarHBondContact O-CB 3.12Å; E53-A57 PolarHBondContact O-N 3.23Å
54	Q	98.3	Very high	97	Very high	40 Å²	40	63.7 Å²	63.7	19%	0.187	35%	0.354	C	S	.	.	H	α-helix	trans	-59.7	-45.3	174.1	-74.7	-176.3	62.1	0	0	111.3	N50 V51 A57 L58 V114 L117	N50-Q54 WeakPolarHBondContact O-CG 3.36Å; N50-Q54 PolarHBondContact O-N 3.19Å; N50-Q54 PolarHBondContact OD1-NE2 3.45Å; V51-Q54 PolarHBondContact O-N 2.88Å; Q54-A57 PolarHBondContact O-N 3.29Å; Q54-L58 WeakPolarHBondContact O-CG 3.49Å; Q54-L58 PolarHBondContact O-N 3.46Å; Q54-V114 PolarHBondContact NE2-O 3.47Å; Q54-L117 HydrophobicContact CB-CB 4.02Å; Q54-L117 HydrophobicContact CB-CD2 4.25Å
55	Q	97.7	Very high	96.8	Very high	30 Å²	30	64.5 Å²	64.5	14%	0.14	36%	0.359	C	S	.	.	H	α-helix	trans	-56.7	-52.7	175	175	178.6	1.6	0	0	111.1	V51 L52 E53 A57 L58 E59 F64 L70 L117	V51-Q55 PolarHBondContact O-N 2.86Å; L52-Q55 PolarHBondContact O-N 2.93Å; E53-Q55 VanDerWaalsContact C-N 3.34Å; E53-Q55 PolarHBondContact O-N 3.22Å; Q55-A57 VanDerWaalsContact C-N 3.29Å; Q55-A57 PolarHBondContact O-N 3.14Å; Q55-L58 WeakPolarHBondContact O-CB 3.35Å; Q55-L58 PolarHBondContact O-N 2.87Å; Q55-L58 VanDerWaalsContact O-N 3.09Å; Q55-E59 HydrophobicContact CG-CG 4.31Å; Q55-E59 WeakPolarHBondContact CG-OE1 3.26Å; Q55-E59 PolarHBondContact NE2-OE1 3Å; Q55-E59 WeakPolarHBondContact O-CG 3.45Å; Q55-E59 PolarHBondContact O-N 3.35Å; Q55-F64 HydrophobicContact CB-CE2 4.37Å; Q55-F64 HydrophobicContact CG-CD2 4.12Å; Q55-F64 HydrophobicContact CG-CE2 3.82Å; Q55-F64 HydrophobicContact CG-CZ 4.48Å; Q55-L70 HydrophobicContact CB-CD2 4.45Å; Q55-L117 HydrophobicContact CB-CD2 3.84Å
56	R	97.7	Very high	96.5	Very high	175 Å²	175	68.6 Å²	68.6	66%	0.66	38%	0.376	S	S	*	.	H	α-helix	trans	-58.4	-41.4	-179.5	-175.4	178.4	-178.7	161.6	1.6	112	L52 E53 E59 L60	L52-R56 WeakPolarHBondContact O-CB 3.45Å; L52-R56 PolarHBondContact O-N 2.83Å; E53-R56 PolarHBondContact O-N 2.97Å; R56-E59 PolarHBondContact O-N 3.42Å; R56-L60 HydrophobicContact CG-CD1 4.15Å; R56-L60 WeakPolarHBondContact O-CB 3.01Å; R56-L60 VanDerWaalsContact O-CG 3.28Å; R56-L60 WeakPolarHBondContact O-CG 3.12Å; R56-L60 PolarHBondContact O-N 2.89Å
57	A	98.1	Very high	96.3	Very high	60 Å²	60	68.7 Å²	68.7	50%	0.496	37%	0.368	S	S	.	.	H	α-helix	trans	-64.2	-40.6	177	0	0	0	0	0	112.1	E53 Q54 Q55 A61	E53-A57 WeakPolarHBondContact O-CB 3.12Å; E53-A57 PolarHBondContact O-N 3.23Å; Q54-A57 PolarHBondContact O-N 3.29Å; Q55-A57 VanDerWaalsContact C-N 3.29Å; Q55-A57 PolarHBondContact O-N 3.14Å; A57-A61 WeakPolarHBondContact O-CB 3.44Å; A57-A61 PolarHBondContact O-N 2.9Å; A57-A61 VanDerWaalsContact O-N 3.11Å
58	L	97.9	Very high	96.1	Very high	22 Å²	22	69 Å²	69	12%	0.115	37%	0.37	C	S	.	.	H	α-helix	trans	-67.9	-39.9	176.6	-67.5	169.2	0	0	0	112.3	Q54 Q55 A61 G62 I63 F64 L117 R118	Q54-L58 WeakPolarHBondContact O-CG 3.49Å; Q54-L58 PolarHBondContact O-N 3.46Å; Q55-L58 WeakPolarHBondContact O-CB 3.35Å; Q55-L58 PolarHBondContact O-N 2.87Å; Q55-L58 VanDerWaalsContact O-N 3.09Å; L58-A61 PolarHBondContact O-N 3.36Å; L58-G62 PolarHBondContact O-N 3.26Å; L58-G62 VanDerWaalsContact O-N 3.16Å; L58-I63 HydrophobicContact CB-CG1 4.41Å; L58-I63 HydrophobicContact CD2-CD1 3.64Å; L58-I63 HydrophobicContact CD2-CG1 3.81Å; L58-I63 WeakPolarHBondContact O-CG1 3.48Å; L58-I63 PolarHBondContact O-N 3.5Å; L58-F64 HydrophobicContact CB-CB 3.93Å; L58-F64 HydrophobicContact CB-CD2 3.96Å; L58-F64 HydrophobicContact CB-CG 4.46Å; L58-F64 HydrophobicContact CD1-CD2 4.13Å; L58-F64 PolarHBondContact O-N 3.3Å; L58-F64 VanDerWaalsContact O-N 3.13Å; L58-L117 HydrophobicContact CD1-CB 4.37Å; L58-L117 HydrophobicContact CD1-CD2 4.3Å; L58-L117 HydrophobicContact CD1-CG 4.38Å; L58-R118 HydrophobicContact CD1-CB 3.8Å; L58-R118 HydrophobicContact CD2-CB 3.81Å; L58-R118 HydrophobicContact CD2-CG 4.37Å; L58-R118 HydrophobicContact CG-CB 4.48Å
59	E	96.5	Very high	96	Very high	102 Å²	102	71.4 Å²	71.4	48%	0.477	38%	0.383	S	S	.	.	H	α-helix	trans	-64.2	-47	176	-73.2	172.3	175.3	0	0	111.2	Q55 R56 A61 G62 F64	Q55-E59 HydrophobicContact CG-CG 4.31Å; Q55-E59 WeakPolarHBondContact CG-OE1 3.26Å; Q55-E59 PolarHBondContact NE2-OE1 3Å; Q55-E59 WeakPolarHBondContact O-CG 3.45Å; Q55-E59 PolarHBondContact O-N 3.35Å; R56-E59 PolarHBondContact O-N 3.42Å; E59-A61 VanDerWaalsContact C-N 3.25Å; E59-A61 PolarHBondContact O-N 2.76Å; E59-G62 PolarHBondContact O-N 2.74Å; E59-F64 HydrophobicContact CG-CB 3.89Å; E59-F64 HydrophobicContact CG-CD2 4.4Å; E59-F64 HydrophobicContact CG-CG 4.07Å
60	L	97.1	Very high	95.9	Very high	140 Å²	140	66.7 Å²	66.7	73%	0.733	36%	0.362	S	S	*	.	H	α-helix	trans	-61.2	-34.1	176.5	-75.2	171.5	0	0	0	112.8	R56 G62	R56-L60 HydrophobicContact CG-CD1 4.15Å; R56-L60 WeakPolarHBondContact O-CB 3.01Å; R56-L60 VanDerWaalsContact O-CG 3.28Å; R56-L60 WeakPolarHBondContact O-CG 3.12Å; R56-L60 PolarHBondContact O-N 2.89Å; L60-G62 VanDerWaalsContact C-N 3.29Å
61	A	97.1	Very high	95.7	Very high	64 Å²	64	66.8 Å²	66.8	53%	0.529	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-1.6	176.4	0	0	0	0	0	113.5	A57 L58 E59 I63	A57-A61 WeakPolarHBondContact O-CB 3.44Å; A57-A61 PolarHBondContact O-N 2.9Å; A57-A61 VanDerWaalsContact O-N 3.11Å; L58-A61 PolarHBondContact O-N 3.36Å; E59-A61 VanDerWaalsContact C-N 3.25Å; E59-A61 PolarHBondContact O-N 2.76Å; A61-I63 HydrophobicContact CB-CD1 3.94Å; A61-I63 HydrophobicContact CB-CG1 3.73Å; A61-I63 PolarHBondContact O-N 3.04Å
62	G	95.1	Very high	95.6	Very high	70 Å²	70	68.6 Å²	68.6	72%	0.722	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	24.8	-179.6	0	0	0	0	0	114	L58 E59 L60	L58-G62 PolarHBondContact O-N 3.26Å; L58-G62 VanDerWaalsContact O-N 3.16Å; E59-G62 PolarHBondContact O-N 2.74Å; L60-G62 VanDerWaalsContact C-N 3.29Å
63	I	95	Very high	95.4	Very high	74 Å²	74	66.9 Å²	66.9	38%	0.379	36%	0.36	S	S	.	.			trans	-121.9	7.2	-176.5	56.8	170.5	0	0	0	112.5	L58 A61	L58-I63 HydrophobicContact CB-CG1 4.41Å; L58-I63 HydrophobicContact CD2-CD1 3.64Å; L58-I63 HydrophobicContact CD2-CG1 3.81Å; L58-I63 WeakPolarHBondContact O-CG1 3.48Å; L58-I63 PolarHBondContact O-N 3.5Å; A61-I63 HydrophobicContact CB-CD1 3.94Å; A61-I63 HydrophobicContact CB-CG1 3.73Å; A61-I63 PolarHBondContact O-N 3.04Å
64	F	93.4	Very high	95.2	Very high	28 Å²	28	63.7 Å²	63.7	12%	0.123	35%	0.347	C	S	.	.	S	Bend	trans	-67.3	132	167.5	-169.6	-90.1	0	0	0	108.8	Q55 L58 E59 E66 F68 L70 L117 L121	Q55-F64 HydrophobicContact CB-CE2 4.37Å; Q55-F64 HydrophobicContact CG-CD2 4.12Å; Q55-F64 HydrophobicContact CG-CE2 3.82Å; Q55-F64 HydrophobicContact CG-CZ 4.48Å; L58-F64 HydrophobicContact CB-CB 3.93Å; L58-F64 HydrophobicContact CB-CD2 3.96Å; L58-F64 HydrophobicContact CB-CG 4.46Å; L58-F64 HydrophobicContact CD1-CD2 4.13Å; L58-F64 PolarHBondContact O-N 3.3Å; L58-F64 VanDerWaalsContact O-N 3.13Å; E59-F64 HydrophobicContact CG-CB 3.89Å; E59-F64 HydrophobicContact CG-CD2 4.4Å; E59-F64 HydrophobicContact CG-CG 4.07Å; F64-E66 PolarHBondContact O-N 3.28Å; F64-F68 WeakPolarHBondContact CE1-O 3.5Å; F64-L70 HydrophobicContact CZ-CB 4.17Å; F64-L117 HydrophobicContact CE2-CD2 4.33Å; F64-L121 HydrophobicContact CE2-CD1 3.8Å; F64-L121 HydrophobicContact CZ-CD1 3.84Å
65	P	91.1	Very high	94.8	Very high	16 Å²	16	62.9 Å²	62.9	10%	0.104	34%	0.344	C	S	.	.			trans	-66.7	122.4	-176.6	-19.4	30.9	0	0	0	114	D67 F68 L121 R125	P65-D67 WeakPolarHBondContact CB-OD1 3.38Å; P65-D67 PolarHBondContact O-N 3.3Å; P65-F68 HydrophobicContact CB-CD2 4.25Å; P65-F68 PolarHBondContact O-N 3.13Å; P65-L121 HydrophobicContact CG-CB 4.21Å; P65-L121 HydrophobicContact CG-CD1 4.09Å; P65-R125 VanDerWaalsContact CG-NH2 3.31Å
66	E	89.4	Confident	94.4	Very high	186 Å²	186	66.3 Å²	66.3	87%	0.869	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-16.5	-177.5	-61	-174.1	170.2	0	0	113.8	P24 F64 F68	P24-E66 WeakPolarHBondContact CB-O 3.45Å; F64-E66 PolarHBondContact O-N 3.28Å; E66-F68 PolarHBondContact O-N 2.57Å
67	D	91	Very high	93.7	Very high	59 Å²	59	59.9 Å²	59.9	32%	0.316	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-9.6	177.2	61.1	-38	0	0	0	113.3	P24 G25 P65 R125	P24-D67 CarbonylContact C-O 3.35Å; P24-D67 VanDerWaalsContact CA-O 3.23Å; P24-D67 WeakPolarHBondContact CA-O 3.37Å; P24-D67 VanDerWaalsContact CB-C 3.48Å; P24-D67 WeakPolarHBondContact CB-O 3.48Å; G25-D67 PolarHBondContact N-O 3.16Å; P65-D67 WeakPolarHBondContact CB-OD1 3.38Å; P65-D67 PolarHBondContact O-N 3.3Å; D67-R125 IonicContact OD1-CZ 2.74Å; D67-R125 IonicContact OD1-NE 3.03Å; D67-R125 PolarHBondContact OD1-NE 3.29Å; D67-R125 IonicContact OD1-NH2 3.96Å; D67-R125 PolarHBondContact OD1-NH2 3.29Å; D67-R125 IonicContact OD2-CZ 3.73Å; D67-R125 IonicContact OD2-NE 3.1Å; D67-R125 PolarHBondContact OD2-NE 3.21Å; D67-R125 IonicContact OD2-NH2 3.06Å
68	F	94.4	Very high	92.6	Very high	10 Å²	10	60.8 Å²	60.8	4%	0.044	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	151.1	-177.8	-66.8	-55.1	0	0	0	114.5	G25 V27 F64 P65 E66 W104 L121 L124 R125	G25-F68 CarbonylContact O-C 3.04Å; G25-F68 VanDerWaalsContact O-CA 3.26Å; G25-F68 WeakPolarHBondContact O-CA 3.41Å; V27-F68 HydrophobicContact CG2-CB 4.25Å; V27-F68 HydrophobicContact CG2-CD1 3.53Å; V27-F68 HydrophobicContact CG2-CE1 3.99Å; V27-F68 HydrophobicContact CG2-CG 3.89Å; F64-F68 WeakPolarHBondContact CE1-O 3.5Å; P65-F68 HydrophobicContact CB-CD2 4.25Å; P65-F68 PolarHBondContact O-N 3.13Å; E66-F68 PolarHBondContact O-N 2.57Å; F68-W104 AromaticContact CE1-CD1 3.98Å; F68-L121 HydrophobicContact CD2-CB 4.07Å; F68-L121 HydrophobicContact CD2-CD2 4.1Å; F68-L121 HydrophobicContact CD2-CG 4.47Å; F68-L121 HydrophobicContact CE2-CB 4.25Å; F68-L121 HydrophobicContact CG-CD2 4.43Å; F68-L124 HydrophobicContact CZ-CB 4.31Å; F68-R125 HydrophobicContact CE2-CB 4.25Å; F68-R125 HydrophobicContact CZ-CB 4.39Å
69	V	94.4	Very high	91.1	Very high	67 Å²	67	66.4 Å²	66.4	41%	0.406	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	124.8	160	170	0	0	0	0	107.6	P24 G25 E26 V27	P24-V69 HydrophobicContact CB-CG2 3.95Å; P24-V69 HydrophobicContact CG-CG2 3.5Å; P24-V69 VanDerWaalsContact CG-CG2 3.5Å; G25-V69 PolarHBondContact O-N 2.98Å; E26-V69 WeakPolarHBondContact CA-O 3.43Å; V27-V69 PolarHBondContact N-O 3.14Å
70	L	95.8	Very high	89.7	Confident	12 Å²	12	62.4 Å²	62.4	6%	0.063	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	132.3	176.8	-176.3	66.5	0	0	0	110.9	V27 L29 V51 Q55 F64 V72 L117	V27-L70 HydrophobicContact CB-CD1 4.12Å; V27-L70 HydrophobicContact CG1-CD1 3.97Å; V27-L70 WeakPolarHBondContact O-CA 3.48Å; L29-L70 HydrophobicContact CB-CD1 4.31Å; V51-L70 HydrophobicContact CG1-CD2 3.74Å; Q55-L70 HydrophobicContact CB-CD2 4.45Å; F64-L70 HydrophobicContact CZ-CB 4.17Å; L70-V72 HydrophobicContact CD2-CG2 4.23Å; L70-V72 HydrophobicContact CG-CG2 4.26Å; L70-L117 HydrophobicContact CD2-CD1 3.89Å; L70-L117 HydrophobicContact CD2-CD2 3.68Å; L70-L117 HydrophobicContact CD2-CG 4.41Å
71	K	95.2	Very high	88.5	Confident	67 Å²	67	56.3 Å²	56.3	29%	0.291	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.1	164.6	-68.7	-177.1	-177.4	166.6	0	109.3	E26 V27 L28 L29 R96	E26-K71 HydrophobicContact CG-CD 4.14Å; E26-K71 HydrophobicContact CG-CG 4.34Å; E26-K71 WeakPolarHBondContact OE1-CD 3.41Å; E26-K71 WeakPolarHBondContact OE1-CE 3.34Å; E26-K71 IonicContact OE1-NZ 2.8Å; E26-K71 PolarHBondContact OE1-NZ 2.76Å; E26-K71 WeakPolarHBondContact OE2-CE 3.34Å; E26-K71 IonicContact OE2-NZ 2.77Å; E26-K71 PolarHBondContact OE2-NZ 3.02Å; V27-K71 PolarHBondContact O-N 3.16Å; L28-K71 HydrophobicContact CD1-CB 3.91Å; L29-K71 PolarHBondContact N-O 3.48Å; K71-R96 PolarHBondContact NZ-O 3.22Å; K71-R96 VanDerWaalsContact NZ-O 3.11Å
72	V	95.8	Very high	88	Confident	37 Å²	37	55.9 Å²	55.9	22%	0.224	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.9	172.8	-177	0	0	0	0	108.6	L29 I31 S48 V51 L52 L70	L29-V72 HydrophobicContact CD2-CG1 4.17Å; L29-V72 WeakPolarHBondContact O-CA 3.39Å; I31-V72 HydrophobicContact CD1-CG1 4.19Å; S48-V72 WeakPolarHBondContact OG-CG1 3.23Å; V51-V72 HydrophobicContact CB-CG2 4.47Å; V51-V72 HydrophobicContact CG1-CG2 3.75Å; L52-V72 HydrophobicContact CD2-CB 4.27Å; L52-V72 HydrophobicContact CD2-CG2 3.83Å; L52-V72 HydrophobicContact CG-CG2 4.25Å; L70-V72 HydrophobicContact CD2-CG2 4.23Å; L70-V72 HydrophobicContact CG-CG2 4.26Å
73	H	93.9	Very high	87.8	Confident	44 Å²	44	52.9 Å²	52.9	20%	0.204	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	114.9	-179.9	-178.1	68.1	0	0	0	110.5	L28 L29 V30 I31 M75 V97	L28-H73 HydrophobicContact CD1-CB 4.07Å; L29-H73 PolarHBondContact O-N 3.33Å; V30-H73 CarbonylContact C-O 3.49Å; V30-H73 WeakPolarHBondContact CA-O 3.17Å; I31-H73 PolarHBondContact N-O 2.96Å; H73-M75 PolarHBondContact O-N 2.81Å; H73-V97 HydrophobicContact CB-CG1 4.16Å
74	V	93.7	Very high	87.6	Confident	35 Å²	35	49.6 Å²	49.6	21%	0.212	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	110.1	170.7	-177.9	0	0	0	0	108.2	I31 C33 C44	I31-V74 HydrophobicContact CD1-CG2 4.28Å; C33-V74 HydrophobicContact CB-CG1 4.12Å; C44-V74 HydrophobicContact CB-CG1 4.33Å
75	M	90.7	Very high	87.4	Confident	23 Å²	23	49.6 Å²	49.6	11%	0.113	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	109	178.8	-173.7	-173.5	73.1	0	0	108.7	V30 I31 A32 C33 H73 A87 W107	V30-M75 HydrophobicContact CG1-CB 4Å; I31-M75 PolarHBondContact O-N 3.09Å; A32-M75 HydrophobicContact CB-CE 4.03Å; C33-M75 PolarHBondContact N-O 3.32Å; H73-M75 PolarHBondContact O-N 2.81Å; M75-A87 HydrophobicContact CE-CB 3.74Å; M75-A87 HydrophobicContact SD-CB 4.04Å; M75-W107 HydrophobicContact CE-CH2 3.43Å; M75-W107 VanDerWaalsContact CE-CH2 3.43Å; M75-W107 HydrophobicContact CE-CZ2 3.58Å; M75-W107 HydrophobicContact SD-CH2 3.97Å
76	H	90	Very high	87.2	Confident	102 Å²	102	49.9 Å²	49.9	47%	0.472	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	129.6	170.3	-66	-69.5	0	0	0	109.3	L78	H76-L78 PolarHBondContact O-N 3.13Å; H76-L78 VanDerWaalsContact O-N 3.17Å
77	E	82.8	Confident	87	Confident	39 Å²	39	41.2 Å²	41.2	18%	0.182	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-53.8	122.1	175.5	-174.7	-174.5	126.6	0	0	108.8	C33 W82 R395	C33-E77 PolarHBondContact O-N 2.89Å; E77-W82 HydrophobicContact CG-CB 4.23Å; E77-R395 IonicContact OE1-CZ 3.31Å; E77-R395 IonicContact OE1-NH1 3.44Å; E77-R395 PolarHBondContact OE1-NH1 3.32Å; E77-R395 IonicContact OE1-NH2 2.72Å; E77-R395 IonicContact OE2-CZ 3.43Å; E77-R395 IonicContact OE2-NH1 3.39Å; E77-R395 IonicContact OE2-NH2 2.87Å; E77-R395 PolarHBondContact OE2-NH2 3Å
78	L	73.4	Confident	86.9	Confident	79 Å²	79	38.5 Å²	38.5	41%	0.414	19%	0.191	S	C	.	.	P	Polyproline II helix	trans	-77.5	152.7	174.1	-63.6	171.6	0	0	0	108.5	H76 N80 S81 H90	H76-L78 PolarHBondContact O-N 3.13Å; H76-L78 VanDerWaalsContact O-N 3.17Å; L78-N80 PolarHBondContact O-N 3.16Å; L78-S81 PolarHBondContact O-N 3.41Å; L78-H90 HydrophobicContact CD1-CB 3.67Å; L78-H90 WeakPolarHBondContact CD1-CD2 3.14Å; L78-H90 WeakPolarHBondContact CD1-NE2 3.28Å
79	F	66.7	Low	86.4	Confident	140 Å²	140	39.7 Å²	39.7	61%	0.614	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.1	118.2	-177.5	-167.2	-96.3	0	0	0	109.8	S81 Q447	F79-S81 PolarHBondContact O-N 2.98Å; F79-Q447 HydrophobicContact CE1-CG 4.09Å; F79-Q447 HydrophobicContact CZ-CG 4.04Å
80	N	66.6	Low	85.7	Confident	18 Å²	18	40.2 Å²	40.2	10%	0.096	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	-0.3	-177.9	-59	-20	0	0	0	118.7	L78 W82 L400 G405 N407 Q447	L78-N80 PolarHBondContact O-N 3.16Å; N80-W82 PolarHBondContact O-N 3.31Å; N80-L400 HydrophobicContact CB-CD2 4.12Å; N80-L400 WeakPolarHBondContact O-CD1 3.32Å; N80-L400 WeakPolarHBondContact O-CD2 3.39Å; N80-G405 PolarHBondContact ND2-O 3.15Å; N80-N407 WeakPolarHBondContact CA-ND2 3.44Å; N80-N407 PolarHBondContact OD1-ND2 2.85Å; N80-Q447 PolarHBondContact ND2-NE2 3.09Å; N80-Q447 PolarHBondContact ND2-OE1 3.37Å; N80-Q447 PolarHBondContact OD1-OE1 3.24Å
81	S	73.7	Confident	85	Confident	13 Å²	13	39.8 Å²	39.8	9%	0.091	20%	0.195	C	C	.	.			trans	-104.2	64.4	-177.7	-53.6	0	0	0	0	113.2	L78 F79	L78-S81 PolarHBondContact O-N 3.41Å; F79-S81 PolarHBondContact O-N 2.98Å
82	W	86.4	Confident	84.4	Confident	55 Å²	55	41.4 Å²	41.4	21%	0.208	20%	0.2	C	C	.	.			trans	-89.2	-14.8	-179.8	65.7	-91.4	0	0	0	114.7	E77 N80 A199 N407	E77-W82 HydrophobicContact CG-CB 4.23Å; N80-W82 PolarHBondContact O-N 3.31Å; W82-A199 HydrophobicContact CE3-CB 4.15Å; W82-A199 HydrophobicContact CH2-CB 4.34Å; W82-A199 HydrophobicContact CZ3-CB 3.59Å; W82-N407 PolarHBondContact NE1-OD1 3.04Å
83	T	90.2	Very high	83.7	Confident	6 Å²	6	43.7 Å²	43.7	4%	0.037	22%	0.222	C	C	.	.	S	Bend	trans	-83.3	154.3	171.2	86.3	0	0	0	0	110	L85 D86 A87 A199 L400	T83-L85 VanDerWaalsContact C-N 3.27Å; T83-L85 PolarHBondContact O-N 3.46Å; T83-L85 PolarHBondContact OG1-N 2.84Å; T83-D86 WeakPolarHBondContact CB-OD2 3.49Å; T83-D86 WeakPolarHBondContact CG2-OD2 3.43Å; T83-D86 PolarHBondContact O-N 2.79Å; T83-D86 PolarHBondContact OG1-N 3.18Å; T83-D86 PolarHBondContact OG1-OD2 3.31Å; T83-A87 PolarHBondContact O-N 3.5Å; T83-A199 HydrophobicContact CG2-CB 4.16Å; T83-L400 HydrophobicContact CG2-CD1 4.11Å
84	M	90.6	Very high	83	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.025	23%	0.232	C	C	.	.	H	α-helix	trans	-62.7	-38.3	175.6	-169.1	-175.8	108.8	0	0	111.3	D86 A87 L88 W107 F170 L175 L178 L203	M84-D86 VanDerWaalsContact C-N 3.34Å; M84-D86 PolarHBondContact O-N 2.98Å; M84-A87 PolarHBondContact O-N 3.04Å; M84-L88 HydrophobicContact CE-CD1 4.03Å; M84-L88 HydrophobicContact CE-CD2 4.44Å; M84-L88 HydrophobicContact CE-CG 4.42Å; M84-L88 WeakPolarHBondContact O-CG 3.03Å; M84-L88 PolarHBondContact O-N 3.25Å; M84-W107 HydrophobicContact CB-CZ2 4.29Å; M84-W107 HydrophobicContact CG-CD2 4.1Å; M84-W107 HydrophobicContact CG-CE3 4.14Å; M84-W107 HydrophobicContact CG-CH2 3.89Å; M84-W107 HydrophobicContact CG-CZ2 3.86Å; M84-W107 HydrophobicContact CG-CZ3 4.03Å; M84-W107 HydrophobicContact SD-CD2 4.16Å; M84-W107 HydrophobicContact SD-CE3 4.29Å; M84-W107 HydrophobicContact SD-CG 4.43Å; M84-F170 HydrophobicContact CE-CD1 4.49Å; M84-F170 HydrophobicContact CE-CE1 3.75Å; M84-F170 HydrophobicContact CE-CE2 4.04Å; M84-F170 HydrophobicContact CE-CZ 3.49Å; M84-F170 VanDerWaalsContact CE-CZ 3.49Å; M84-F170 HydrophobicContact SD-CE1 4.28Å; M84-F170 HydrophobicContact SD-CE2 3.63Å; M84-F170 HydrophobicContact SD-CZ 3.41Å; M84-F170 WeakPolarHBondContact SD-CZ 3.26Å; M84-L175 HydrophobicContact CE-CD1 3.73Å; M84-L178 HydrophobicContact CE-CD1 4.13Å; M84-L203 HydrophobicContact CB-CD1 4.5Å; M84-L203 HydrophobicContact CE-CD1 3.45Å; M84-L203 VanDerWaalsContact CE-CD1 3.45Å; M84-L203 HydrophobicContact CE-CD2 4.32Å; M84-L203 HydrophobicContact SD-CD1 4.01Å; M84-L203 HydrophobicContact SD-CD2 3.86Å
85	L	89.9	Confident	81.7	Confident	28 Å²	28	47.9 Å²	47.9	15%	0.147	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-40.8	-177.2	-63.5	175	0	0	0	111.6	T83 A87 L88 P89 V182 L203 F206	T83-L85 VanDerWaalsContact C-N 3.27Å; T83-L85 PolarHBondContact O-N 3.46Å; T83-L85 PolarHBondContact OG1-N 2.84Å; L85-A87 VanDerWaalsContact C-N 3.32Å; L85-L88 HydrophobicContact CD2-CD1 4.42Å; L85-L88 PolarHBondContact O-N 3.18Å; L85-P89 WeakPolarHBondContact O-CD 3.5Å; L85-V182 HydrophobicContact CD2-CG1 4.23Å; L85-L203 HydrophobicContact CD2-CD1 4Å; L85-L203 HydrophobicContact CG-CD1 4.43Å; L85-F206 HydrophobicContact CD1-CB 3.65Å; L85-F206 HydrophobicContact CD1-CD1 4.3Å; L85-F206 HydrophobicContact CD1-CD2 4Å; L85-F206 HydrophobicContact CD1-CG 3.72Å; L85-F206 HydrophobicContact CD2-CB 4.27Å; L85-F206 HydrophobicContact CD2-CD1 3.58Å; L85-F206 HydrophobicContact CD2-CE1 4.06Å; L85-F206 HydrophobicContact CD2-CG 3.89Å; L85-F206 HydrophobicContact CG-CG 4.49Å
86	D	86.6	Confident	81	Confident	23 Å²	23	57.8 Å²	57.8	12%	0.123	29%	0.289	C	S	.	.	H	α-helix	trans	-74.3	-24.5	178.1	-56.2	-49.1	0	0	0	112.6	T83 M84 P89 H90 L400	T83-D86 WeakPolarHBondContact CB-OD2 3.49Å; T83-D86 WeakPolarHBondContact CG2-OD2 3.43Å; T83-D86 PolarHBondContact O-N 2.79Å; T83-D86 PolarHBondContact OG1-N 3.18Å; T83-D86 PolarHBondContact OG1-OD2 3.31Å; M84-D86 VanDerWaalsContact C-N 3.34Å; M84-D86 PolarHBondContact O-N 2.98Å; D86-P89 WeakPolarHBondContact O-CD 3.33Å; D86-H90 PolarHBondContact O-ND1 2.82Å; D86-L400 WeakPolarHBondContact OD2-CB 3.43Å
87	A	86.1	Confident	80.5	Confident	4 Å²	4	53.7 Å²	53.7	3%	0.033	27%	0.271	C	S	.	.	H	α-helix	trans	-81.7	-25.2	177.2	0	0	0	0	0	113.4	M75 T83 M84 L85 H90 L91 W107	M75-A87 HydrophobicContact CE-CB 3.74Å; M75-A87 HydrophobicContact SD-CB 4.04Å; T83-A87 PolarHBondContact O-N 3.5Å; M84-A87 PolarHBondContact O-N 3.04Å; L85-A87 VanDerWaalsContact C-N 3.32Å; A87-H90 WeakPolarHBondContact O-CB 3.1Å; A87-H90 PolarHBondContact O-N 2.83Å; A87-L91 PolarHBondContact O-N 3Å; A87-L91 VanDerWaalsContact O-N 3.14Å; A87-W107 HydrophobicContact CB-CH2 4.04Å
88	L	87.7	Confident	80.5	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-58.8	-42	-175.6	-82.1	175.6	0	0	0	115.1	M84 L85 H90 L91 R92 L175 L178 V182	M84-L88 HydrophobicContact CE-CD1 4.03Å; M84-L88 HydrophobicContact CE-CD2 4.44Å; M84-L88 HydrophobicContact CE-CG 4.42Å; M84-L88 WeakPolarHBondContact O-CG 3.03Å; M84-L88 PolarHBondContact O-N 3.25Å; L85-L88 HydrophobicContact CD2-CD1 4.42Å; L85-L88 PolarHBondContact O-N 3.18Å; L88-H90 PolarHBondContact O-N 3.2Å; L88-L91 PolarHBondContact O-N 3.19Å; L88-R92 WeakPolarHBondContact O-CB 3.34Å; L88-R92 PolarHBondContact O-N 3.49Å; L88-L175 HydrophobicContact CD2-CD1 3.67Å; L88-L175 HydrophobicContact CD2-CD2 4.41Å; L88-L175 HydrophobicContact CD2-CG 3.89Å; L88-L178 HydrophobicContact CD1-CB 3.63Å; L88-V182 HydrophobicContact CB-CG2 3.64Å; L88-V182 HydrophobicContact CD1-CG2 4.15Å
89	P	83.6	Confident	80.9	Confident	36 Å²	36	49.8 Å²	49.8	23%	0.234	26%	0.256	C	S	.	.	H	α-helix	trans	-59.1	-37.3	177.9	-25.3	36.2	0	0	0	112.1	L85 D86 R92 A93 V182	L85-P89 WeakPolarHBondContact O-CD 3.5Å; D86-P89 WeakPolarHBondContact O-CD 3.33Å; P89-R92 PolarHBondContact O-N 2.82Å; P89-A93 PolarHBondContact O-N 3.44Å; P89-V182 HydrophobicContact CG-CG2 3.98Å
90	H	81	Confident	81.7	Confident	78 Å²	78	47.1 Å²	47.1	36%	0.361	26%	0.26	S	S	.	.	H	α-helix	trans	-68.8	-43.5	177.9	-61.4	99.4	0	0	0	111.9	L78 D86 A87 L88 R92 A93 Q94	L78-H90 HydrophobicContact CD1-CB 3.67Å; L78-H90 WeakPolarHBondContact CD1-CD2 3.14Å; L78-H90 WeakPolarHBondContact CD1-NE2 3.28Å; D86-H90 PolarHBondContact O-ND1 2.82Å; A87-H90 WeakPolarHBondContact O-CB 3.1Å; A87-H90 PolarHBondContact O-N 2.83Å; L88-H90 PolarHBondContact O-N 3.2Å; H90-R92 VanDerWaalsContact C-N 3.31Å; H90-R92 PolarHBondContact O-N 2.68Å; H90-A93 PolarHBondContact O-N 2.77Å; H90-Q94 WeakPolarHBondContact O-CG 3.49Å; H90-Q94 PolarHBondContact O-N 3.42Å
91	L	81	Confident	82.7	Confident	2 Å²	2	53 Å²	53	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-62.4	-40.4	175.9	-169.5	70.7	0	0	0	111.5	V30 A87 L88 Q94 V97 L98 W107 L175	V30-L91 HydrophobicContact CG2-CD1 4.46Å; V30-L91 HydrophobicContact CG2-CD2 4.47Å; A87-L91 PolarHBondContact O-N 3Å; A87-L91 VanDerWaalsContact O-N 3.14Å; L88-L91 PolarHBondContact O-N 3.19Å; L91-Q94 PolarHBondContact O-N 3.42Å; L91-V97 HydrophobicContact CD1-CB 4.27Å; L91-V97 HydrophobicContact CD1-CG1 3.49Å; L91-V97 VanDerWaalsContact CD1-CG1 3.49Å; L91-V97 HydrophobicContact CG-CG1 4.47Å; L91-L98 HydrophobicContact CG-CB 4.41Å; L91-W107 HydrophobicContact CD2-CZ3 4.29Å; L91-L175 HydrophobicContact CD2-CD2 4.11Å
92	R	81.9	Confident	83.6	Confident	102 Å²	102	52.4 Å²	52.4	39%	0.385	28%	0.277	S	S	.	.	H	α-helix	trans	-63.5	-44	177.4	-172.9	-150.2	175.7	86.2	3.1	112.4	L88 P89 H90 Q94 A179 D180	L88-R92 WeakPolarHBondContact O-CB 3.34Å; L88-R92 PolarHBondContact O-N 3.49Å; P89-R92 PolarHBondContact O-N 2.82Å; H90-R92 VanDerWaalsContact C-N 3.31Å; H90-R92 PolarHBondContact O-N 2.68Å; R92-Q94 PolarHBondContact O-N 2.88Å; R92-A179 HydrophobicContact CB-CB 3.96Å; R92-A179 HydrophobicContact CG-CB 4.05Å; R92-A179 PolarHBondContact NH1-O 3.32Å; R92-D180 IonicContact CZ-OD1 3.57Å; R92-D180 VanDerWaalsContact NH1-CG 3.32Å; R92-D180 IonicContact NH1-OD1 3.13Å; R92-D180 PolarHBondContact NH1-OD1 3.43Å; R92-D180 IonicContact NH2-OD1 2.73Å; R92-D180 PolarHBondContact NH2-OD1 2.9Å
93	A	80.6	Confident	84.1	Confident	84 Å²	84	53.2 Å²	53.2	69%	0.694	28%	0.283	S	S	*	.	H	α-helix	trans	-61.1	-23.4	178.8	0	0	0	0	0	112.2	P89 H90 A95	P89-A93 PolarHBondContact O-N 3.44Å; H90-A93 PolarHBondContact O-N 2.77Å; A93-A95 PolarHBondContact O-N 3.01Å
94	Q	79.2	Confident	84.4	Confident	89 Å²	89	53 Å²	53	42%	0.416	28%	0.282	S	S	.	.			trans	-89.2	76.1	175	-61.1	-179.5	15.3	0	0	110.9	H90 L91 R92 R96 V97 L98	H90-Q94 WeakPolarHBondContact O-CG 3.49Å; H90-Q94 PolarHBondContact O-N 3.42Å; L91-Q94 PolarHBondContact O-N 3.42Å; R92-Q94 PolarHBondContact O-N 2.88Å; Q94-R96 PolarHBondContact O-N 3.47Å; Q94-V97 HydrophobicContact CB-CB 4.15Å; Q94-V97 HydrophobicContact CB-CG2 3.85Å; Q94-V97 WeakPolarHBondContact O-CA 3.48Å; Q94-V97 WeakPolarHBondContact O-CB 3.42Å; Q94-V97 PolarHBondContact O-N 3.11Å; Q94-L98 PolarHBondContact O-N 2.79Å
95	A	68	Low	84.7	Confident	79 Å²	79	52.8 Å²	52.8	65%	0.653	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-18.2	-179.2	0	0	0	0	0	114.9	A93 V97	A93-A95 PolarHBondContact O-N 3.01Å; A95-V97 VanDerWaalsContact C-N 3.31Å
96	R	74.9	Confident	85	Confident	231 Å²	231	51.5 Å²	51.5	87%	0.872	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-24.7	173.1	-67.4	-175.8	176.3	177.7	-0.6	113.1	K71 Q94	K71-R96 PolarHBondContact NZ-O 3.22Å; K71-R96 VanDerWaalsContact NZ-O 3.11Å; Q94-R96 PolarHBondContact O-N 3.47Å
97	V	79.9	Confident	85.5	Confident	16 Å²	16	50.9 Å²	50.9	10%	0.097	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-59.3	-176.2	-175.3	0	0	0	0	110.4	L28 H73 L91 Q94 A95	L28-V97 HydrophobicContact CD1-CG1 3.87Å; L28-V97 HydrophobicContact CD2-CG1 3.77Å; L28-V97 HydrophobicContact CG-CG1 4.46Å; H73-V97 HydrophobicContact CB-CG1 4.16Å; L91-V97 HydrophobicContact CD1-CB 4.27Å; L91-V97 HydrophobicContact CD1-CG1 3.49Å; L91-V97 VanDerWaalsContact CD1-CG1 3.49Å; L91-V97 HydrophobicContact CG-CG1 4.47Å; Q94-V97 HydrophobicContact CB-CB 4.15Å; Q94-V97 HydrophobicContact CB-CG2 3.85Å; Q94-V97 WeakPolarHBondContact O-CA 3.48Å; Q94-V97 WeakPolarHBondContact O-CB 3.42Å; Q94-V97 PolarHBondContact O-N 3.11Å; A95-V97 VanDerWaalsContact C-N 3.31Å
98	L	82.9	Confident	86.1	Confident	16 Å²	16	50.7 Å²	50.7	8%	0.084	27%	0.268	C	S	.	.	S	Bend	trans	-103.5	101.5	177.7	-173.4	63.5	0	0	0	110.7	L91 Q94 T102 I105 L175 R176	L91-L98 HydrophobicContact CG-CB 4.41Å; Q94-L98 PolarHBondContact O-N 2.79Å; L98-T102 HydrophobicContact CD1-CG2 4Å; L98-I105 HydrophobicContact CD1-CD1 4.09Å; L98-I105 HydrophobicContact CD1-CG1 4.24Å; L98-L175 HydrophobicContact CD1-CD2 4.11Å; L98-L175 HydrophobicContact CD2-CD2 4.27Å; L98-R176 HydrophobicContact CD2-CG 4.21Å; L98-R176 HydrophobicContact CG-CG 4.29Å
99	G	81.8	Confident	86.4	Confident	19 Å²	19	53.3 Å²	53.3	20%	0.196	28%	0.28	C	S	.	.			trans	-107.8	170	-176.9	0	0	0	0	0	113.7	R101 T102	G99-R101 PolarHBondContact O-N 2.96Å; G99-R101 VanDerWaalsContact O-N 3.12Å; G99-T102 PolarHBondContact N-OG1 3.43Å; G99-T102 WeakPolarHBondContact O-CB 3.37Å; G99-T102 PolarHBondContact O-N 3.22Å; G99-T102 VanDerWaalsContact O-N 3.1Å; G99-T102 PolarHBondContact O-OG1 3.03Å
100	A	83.8	Confident	86.9	Confident	85 Å²	85	52.8 Å²	52.8	70%	0.702	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.7	175.5	0	0	0	0	0	114
101	R	88.1	Confident	87.4	Confident	141 Å²	141	49.4 Å²	49.4	53%	0.532	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-6.9	178	-61.9	-170.2	-61.8	159.6	2	113.9	E26 G99 E103	E26-R101 WeakPolarHBondContact CB-O 3.46Å; E26-R101 PolarHBondContact N-O 2.99Å; E26-R101 VanDerWaalsContact N-O 3.16Å; G99-R101 PolarHBondContact O-N 2.96Å; G99-R101 VanDerWaalsContact O-N 3.12Å; R101-E103 PolarHBondContact O-N 3.12Å; R101-E103 VanDerWaalsContact O-N 3.08Å
102	T	92.5	Very high	88.2	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	108.7	176.2	-47.3	0	0	0	0	107.8	E26 L28 L98 G99 I105 G172	E26-T102 CarbonylContact O-C 3.59Å; E26-T102 WeakPolarHBondContact O-CA 3.38Å; E26-T102 PolarHBondContact OE1-OG1 3.42Å; L28-T102 HydrophobicContact CB-CG2 3.73Å; L98-T102 HydrophobicContact CD1-CG2 4Å; G99-T102 PolarHBondContact N-OG1 3.43Å; G99-T102 WeakPolarHBondContact O-CB 3.37Å; G99-T102 PolarHBondContact O-N 3.22Å; G99-T102 VanDerWaalsContact O-N 3.1Å; G99-T102 PolarHBondContact O-OG1 3.03Å; T102-I105 HydrophobicContact CG2-CD1 3.8Å; T102-I105 HydrophobicContact CG2-CG1 3.81Å; T102-G172 WeakPolarHBondContact O-CA 3.48Å
103	E	95.4	Very high	88.9	Confident	71 Å²	71	47.3 Å²	47.3	33%	0.332	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-31.1	-178	-70.1	-163.8	146	0	0	111.7	G25 E26 R101 P129 G172	G25-E103 WeakPolarHBondContact CA-OE2 3.03Å; E26-E103 PolarHBondContact O-N 2.84Å; R101-E103 PolarHBondContact O-N 3.12Å; R101-E103 VanDerWaalsContact O-N 3.08Å; E103-P129 HydrophobicContact CB-CB 3.77Å; E103-P129 HydrophobicContact CB-CG 4.49Å; E103-P129 HydrophobicContact CG-CB 4.25Å; E103-G172 PolarHBondContact O-N 2.7Å
104	W	97.1	Very high	89.7	Confident	3 Å²	3	43.5 Å²	43.5	1%	0.011	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	142.4	-177.6	-64.6	102.3	0	0	0	110.8	E26 V27 L28 F68 L124 Q127 P129 Y135 V169 F170 T171	E26-W104 PolarHBondContact O-N 3.23Å; V27-W104 HydrophobicContact CG1-CB 4.18Å; V27-W104 HydrophobicContact CG2-CB 4.19Å; L28-W104 PolarHBondContact N-O 3.02Å; F68-W104 AromaticContact CE1-CD1 3.98Å; W104-L124 HydrophobicContact CB-CD1 3.89Å; W104-L124 HydrophobicContact CD2-CB 4.16Å; W104-L124 HydrophobicContact CD2-CD1 4.28Å; W104-L124 HydrophobicContact CD2-CD2 3.99Å; W104-L124 HydrophobicContact CD2-CG 4.35Å; W104-L124 HydrophobicContact CE3-CD2 3.9Å; W104-L124 HydrophobicContact CG-CB 4.26Å; W104-L124 HydrophobicContact CG-CD1 3.82Å; W104-L124 HydrophobicContact CG-CD2 4.4Å; W104-L124 HydrophobicContact CG-CG 4.37Å; W104-L124 WeakPolarHBondContact CZ2-O 3.36Å; W104-L124 HydrophobicContact CZ3-CD2 4.33Å; W104-Q127 HydrophobicContact CH2-CB 3.41Å; W104-Q127 VanDerWaalsContact CH2-CB 3.41Å; W104-Q127 HydrophobicContact CH2-CG 4.33Å; W104-Q127 HydrophobicContact CZ2-CB 3.68Å; W104-P129 HydrophobicContact CZ2-CB 3.94Å; W104-Y135 HydrophobicContact CH2-CE2 4.32Å; W104-Y135 HydrophobicContact CZ3-CD2 4.43Å; W104-Y135 AromaticContact CZ3-CE2 3.94Å; W104-Y135 HydrophobicContact CZ3-CE2 3.94Å; W104-V169 HydrophobicContact CE3-CG1 3.79Å; W104-V169 HydrophobicContact CZ3-CG1 4.19Å; W104-F170 WeakPolarHBondContact CA-O 3.21Å; W104-T171 HydrophobicContact CE3-CG2 4.25Å; W104-T171 HydrophobicContact CH2-CG2 3.76Å; W104-T171 HydrophobicContact CZ3-CG2 3.52Å
105	I	96.2	Very high	90.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.4	170	-58.7	90.5	0	0	0	108.9	L28 V30 L98 T102 V169 F170 G172 L175	L28-I105 HydrophobicContact CB-CG1 4.21Å; L28-I105 HydrophobicContact CD2-CG1 4.27Å; L28-I105 CarbonylContact O-C 3.59Å; L28-I105 WeakPolarHBondContact O-CA 3.4Å; V30-I105 HydrophobicContact CG2-CG2 4.08Å; L98-I105 HydrophobicContact CD1-CD1 4.09Å; L98-I105 HydrophobicContact CD1-CG1 4.24Å; T102-I105 HydrophobicContact CG2-CD1 3.8Å; T102-I105 HydrophobicContact CG2-CG1 3.81Å; I105-V169 CarbonylContact O-C 3.48Å; I105-V169 VanDerWaalsContact O-CA 3.29Å; I105-V169 WeakPolarHBondContact O-CA 3.25Å; I105-F170 HydrophobicContact CB-CB 4.43Å; I105-F170 PolarHBondContact N-O 3.3Å; I105-F170 PolarHBondContact O-N 2.84Å; I105-G172 VanDerWaalsContact CD1-CA 3.45Å; I105-L175 HydrophobicContact CB-CD2 3.82Å; I105-L175 HydrophobicContact CD1-CB 3.74Å; I105-L175 HydrophobicContact CD1-CD2 3.56Å; I105-L175 HydrophobicContact CD1-CG 4.29Å; I105-L175 HydrophobicContact CG1-CD2 3.42Å; I105-L175 VanDerWaalsContact CG1-CD2 3.42Å; I105-L175 HydrophobicContact CG2-CD2 3.82Å
106	I	97.6	Very high	91.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	106.5	172.8	-55.6	156.7	0	0	0	106.4	V27 L28 L29 V30 L120 L124 V169 L249	V27-I106 HydrophobicContact CG1-CD1 3.64Å; V27-I106 HydrophobicContact CG1-CG1 4.29Å; L28-I106 PolarHBondContact O-N 3.22Å; L29-I106 CarbonylContact C-O 3.57Å; L29-I106 WeakPolarHBondContact CA-O 3.48Å; L29-I106 HydrophobicContact CB-CB 4.4Å; L29-I106 HydrophobicContact CD1-CB 4.36Å; L29-I106 HydrophobicContact CD1-CD1 4.31Å; L29-I106 HydrophobicContact CD1-CG2 4.21Å; L29-I106 HydrophobicContact CG-CB 4.18Å; L29-I106 HydrophobicContact CG-CG2 4.32Å; V30-I106 PolarHBondContact N-O 3.26Å; I106-L120 HydrophobicContact CD1-CD2 3.58Å; I106-L120 HydrophobicContact CD1-CG 4.22Å; I106-L120 HydrophobicContact CG1-CD2 4.35Å; I106-L120 HydrophobicContact CG2-CD2 4.43Å; I106-L124 HydrophobicContact CD1-CD1 4.36Å; I106-V169 HydrophobicContact CG1-CG2 4.24Å; I106-V169 HydrophobicContact CG2-CG2 4.46Å; I106-L249 HydrophobicContact CG2-CD1 4.04Å; I106-L249 HydrophobicContact CG2-CD2 4.47Å
107	W	96.6	Very high	92.9	Very high	11 Å²	11	29.6 Å²	29.6	4%	0.042	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.9	177.9	-169.1	-79.9	0	0	0	110	V30 A32 M75 M84 A87 L91 G167 V168 F170	V30-W107 HydrophobicContact CB-CE3 4.01Å; V30-W107 HydrophobicContact CB-CZ3 4.38Å; V30-W107 HydrophobicContact CG1-CD2 4.45Å; V30-W107 HydrophobicContact CG1-CE3 3.96Å; V30-W107 HydrophobicContact CG1-CH2 4.32Å; V30-W107 HydrophobicContact CG1-CZ3 3.9Å; V30-W107 HydrophobicContact CG2-CE3 4.43Å; A32-W107 HydrophobicContact CB-CZ2 3.88Å; M75-W107 HydrophobicContact CE-CH2 3.43Å; M75-W107 VanDerWaalsContact CE-CH2 3.43Å; M75-W107 HydrophobicContact CE-CZ2 3.58Å; M75-W107 HydrophobicContact SD-CH2 3.97Å; M84-W107 HydrophobicContact CB-CZ2 4.29Å; M84-W107 HydrophobicContact CG-CD2 4.1Å; M84-W107 HydrophobicContact CG-CE3 4.14Å; M84-W107 HydrophobicContact CG-CH2 3.89Å; M84-W107 HydrophobicContact CG-CZ2 3.86Å; M84-W107 HydrophobicContact CG-CZ3 4.03Å; M84-W107 HydrophobicContact SD-CD2 4.16Å; M84-W107 HydrophobicContact SD-CE3 4.29Å; M84-W107 HydrophobicContact SD-CG 4.43Å; A87-W107 HydrophobicContact CB-CH2 4.04Å; L91-W107 HydrophobicContact CD2-CZ3 4.29Å; W107-G167 CarbonylContact O-C 3.57Å; W107-G167 WeakPolarHBondContact O-CA 3.43Å; W107-V168 PolarHBondContact N-O 3.03Å; W107-V168 PolarHBondContact O-N 3.47Å; W107-F170 HydrophobicContact CB-CD2 4.48Å; W107-F170 HydrophobicContact CB-CE2 4.03Å
108	C	97.5	Very high	93.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	149.3	-179.9	-66.1	0	0	0	0	110.5	V30 I31 A32 L47 T112	V30-C108 PolarHBondContact O-N 3.43Å; I31-C108 HydrophobicContact CG1-CB 4.39Å; A32-C108 PolarHBondContact N-O 3.17Å; L47-C108 HydrophobicContact CD2-CB 3.86Å; C108-T112 HydrophobicContact CB-CG2 4.03Å
109	Q	94.9	Very high	94.3	Very high	55 Å²	55	33.2 Å²	33.2	26%	0.257	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	171.1	162.5	-67.9	-174.6	-24.3	0	0	110.1	N111 T112 L164 S165	Q109-N111 PolarHBondContact O-N 3.46Å; Q109-N111 VanDerWaalsContact O-N 3.17Å; Q109-T112 PolarHBondContact N-OG1 2.63Å; Q109-T112 WeakPolarHBondContact O-CB 3.34Å; Q109-T112 PolarHBondContact O-N 3.06Å; Q109-T112 PolarHBondContact O-OG1 3Å; Q109-L164 HydrophobicContact CG-CB 4.5Å; Q109-S165 VanDerWaalsContact OE1-CA 3.26Å
110	H	93.1	Very high	95	Very high	25 Å²	25	32.3 Å²	32.3	12%	0.116	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-32.4	177.6	65.7	-79.4	0	0	0	113.9	A40 D43 C44 R113	A40-H110 HydrophobicContact CB-CB 4.19Å; D43-H110 HydrophobicContact CB-CB 4.35Å; D43-H110 WeakPolarHBondContact CB-O 3.36Å; C44-H110 VanDerWaalsContact SG-CB 3.53Å; H110-R113 PolarHBondContact O-NH1 3.45Å
111	N	93	Very high	95.6	Very high	7 Å²	7	28.3 Å²	28.3	4%	0.037	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	6.6	178.6	65.5	-11.4	0	0	0	114.1	Q109 S165 Q252	Q109-N111 PolarHBondContact O-N 3.46Å; Q109-N111 VanDerWaalsContact O-N 3.17Å; N111-S165 WeakPolarHBondContact OD1-CB 3.29Å; N111-Q252 WeakPolarHBondContact O-CB 3.2Å; N111-Q252 PolarHBondContact O-N 2.76Å
112	T	96.7	Very high	96	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	149.9	170.4	-53.7	0	0	0	0	110.6	L47 C108 Q109 S165 L249 H250	L47-T112 WeakPolarHBondContact CD1-O 3.32Å; C108-T112 HydrophobicContact CB-CG2 4.03Å; Q109-T112 PolarHBondContact N-OG1 2.63Å; Q109-T112 WeakPolarHBondContact O-CB 3.34Å; Q109-T112 PolarHBondContact O-N 3.06Å; Q109-T112 PolarHBondContact O-OG1 3Å; T112-S165 WeakPolarHBondContact CA-O 3.14Å; T112-S165 WeakPolarHBondContact CB-O 3.45Å; T112-S165 PolarHBondContact OG1-O 2.88Å; T112-L249 HydrophobicContact CG2-CD2 4.4Å; T112-H250 CarbonylContact C-O 3.5Å
113	R	96.8	Very high	96.1	Very high	60 Å²	60	25.3 Å²	25.3	23%	0.226	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	141	174.4	-61.6	-65.6	175.7	-106.3	6.1	110.6	H110 L249 H250 Q252	H110-R113 PolarHBondContact O-NH1 3.45Å; R113-L249 WeakPolarHBondContact O-CA 3.44Å; R113-H250 VanDerWaalsContact CB-CE1 3.43Å; R113-H250 WeakPolarHBondContact CB-CE1 3.42Å; R113-H250 PolarHBondContact N-O 3.17Å; R113-H250 PolarHBondContact O-N 3.45Å; R113-H250 VanDerWaalsContact O-N 3.17Å; R113-Q252 HydrophobicContact CG-CB 3.83Å
114	V	97.5	Very high	96.1	Very high	4 Å²	4	22 Å²	22	2%	0.024	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	100.6	174.1	-173.1	0	0	0	0	108.7	L29 L47 V51 Q54 L117 L120 L248 L249	L29-V114 HydrophobicContact CD1-CG2 4.21Å; L47-V114 HydrophobicContact CD1-CG2 4.1Å; V51-V114 HydrophobicContact CG2-CB 4.11Å; V51-V114 HydrophobicContact CG2-CG2 3.78Å; Q54-V114 PolarHBondContact NE2-O 3.47Å; V114-L117 HydrophobicContact CG1-CB 4.49Å; V114-L120 HydrophobicContact CG1-CD2 4.29Å; V114-L248 CarbonylContact C-O 3.58Å; V114-L248 WeakPolarHBondContact CA-O 3.39Å; V114-L249 HydrophobicContact CB-CD2 4.33Å; V114-L249 HydrophobicContact CG1-CD2 4.41Å; V114-L249 HydrophobicContact CG2-CD2 3.69Å
115	S	95.8	Very high	96	Very high	65 Å²	65	27 Å²	27	46%	0.455	13%	0.129	S	C	.	.	S	Bend	trans	-74.5	-30.1	-176.5	-46.2	0	0	0	0	113	C247 L248 H250	S115-C247 WeakPolarHBondContact CB-O 3.47Å; S115-C247 PolarHBondContact OG-O 3Å; S115-L248 PolarHBondContact N-O 2.93Å; S115-H250 PolarHBondContact OG-CD2 2.87Å; S115-H250 PolarHBondContact OG-NE2 2.99Å
116	S	95.9	Very high	95.9	Very high	42 Å²	42	34.8 Å²	34.8	29%	0.294	16%	0.159	S	C	.	.			trans	-152.4	105.7	175.7	175.4	0	0	0	0	111	R118 G119 L120	S116-R118 VanDerWaalsContact C-N 3.33Å; S116-R118 PolarHBondContact O-N 3.47Å; S116-G119 PolarHBondContact O-N 2.84Å; S116-G119 PolarHBondContact OG-N 3.18Å; S116-G119 VanDerWaalsContact OG-N 3.09Å; S116-L120 WeakPolarHBondContact O-CB 3.44Å; S116-L120 PolarHBondContact O-N 3.31Å
117	L	97.7	Very high	95.7	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.3	-43.8	175.3	176.5	61.4	0	0	0	111.1	V51 Q54 Q55 L58 F64 L70 V114 G119 L120 L121	V51-L117 HydrophobicContact CG1-CD1 4.47Å; V51-L117 HydrophobicContact CG1-CD2 4.36Å; Q54-L117 HydrophobicContact CB-CB 4.02Å; Q54-L117 HydrophobicContact CB-CD2 4.25Å; Q55-L117 HydrophobicContact CB-CD2 3.84Å; L58-L117 HydrophobicContact CD1-CB 4.37Å; L58-L117 HydrophobicContact CD1-CD2 4.3Å; L58-L117 HydrophobicContact CD1-CG 4.38Å; F64-L117 HydrophobicContact CE2-CD2 4.33Å; L70-L117 HydrophobicContact CD2-CD1 3.89Å; L70-L117 HydrophobicContact CD2-CD2 3.68Å; L70-L117 HydrophobicContact CD2-CG 4.41Å; V114-L117 HydrophobicContact CG1-CB 4.49Å; L117-G119 PolarHBondContact O-N 3.45Å; L117-L120 WeakPolarHBondContact O-CB 3.48Å; L117-L120 PolarHBondContact O-N 3.32Å; L117-L121 HydrophobicContact CD1-CD1 4.35Å; L117-L121 HydrophobicContact CD1-CG 4.22Å; L117-L121 HydrophobicContact CG-CD1 4.27Å; L117-L121 WeakPolarHBondContact O-CG 3.24Å; L117-L121 PolarHBondContact O-N 3.41Å
118	R	96.2	Very high	95.6	Very high	98 Å²	98	41.6 Å²	41.6	37%	0.37	19%	0.194	S	C	.	.	H	α-helix	trans	-59.7	-49.5	177.7	177.6	177.5	170	170.3	5.1	111.6	L58 S116 L120 L121 E122	L58-R118 HydrophobicContact CD1-CB 3.8Å; L58-R118 HydrophobicContact CD2-CB 3.81Å; L58-R118 HydrophobicContact CD2-CG 4.37Å; L58-R118 HydrophobicContact CG-CB 4.48Å; S116-R118 VanDerWaalsContact C-N 3.33Å; S116-R118 PolarHBondContact O-N 3.47Å; R118-L120 PolarHBondContact O-N 2.92Å; R118-L121 PolarHBondContact O-N 3.01Å; R118-E122 HydrophobicContact CG-CG 4.5Å; R118-E122 WeakPolarHBondContact CG-OE1 3.42Å; R118-E122 IonicContact CZ-OE1 2.89Å; R118-E122 IonicContact NE-OE1 3.83Å; R118-E122 PolarHBondContact NE-OE1 3.04Å; R118-E122 IonicContact NH2-OE1 3.79Å; R118-E122 WeakPolarHBondContact O-CG 3.09Å; R118-E122 PolarHBondContact O-N 3.14Å
119	G	95.7	Very high	95.4	Very high	11 Å²	11	42.9 Å²	42.9	11%	0.113	20%	0.203	C	C	.	.	H	α-helix	trans	-58.8	-38.7	178.3	0	0	0	0	0	111.1	S116 L117 E122 Q123 L248	S116-G119 PolarHBondContact O-N 2.84Å; S116-G119 PolarHBondContact OG-N 3.18Å; S116-G119 VanDerWaalsContact OG-N 3.09Å; L117-G119 PolarHBondContact O-N 3.45Å; G119-E122 PolarHBondContact O-N 2.93Å; G119-Q123 WeakPolarHBondContact O-CG 3.49Å; G119-Q123 PolarHBondContact O-N 2.9Å; G119-Q123 VanDerWaalsContact O-N 3.12Å; G119-L248 VanDerWaalsContact C-CD1 3.41Å; G119-L248 WeakPolarHBondContact O-CD1 3.17Å
120	L	96.8	Very high	95.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.5	-49.8	178.9	-176	58.6	0	0	0	111.1	I106 V114 S116 L117 R118 E122 Q123 L124 Y232 L249	I106-L120 HydrophobicContact CD1-CD2 3.58Å; I106-L120 HydrophobicContact CD1-CG 4.22Å; I106-L120 HydrophobicContact CG1-CD2 4.35Å; I106-L120 HydrophobicContact CG2-CD2 4.43Å; V114-L120 HydrophobicContact CG1-CD2 4.29Å; S116-L120 WeakPolarHBondContact O-CB 3.44Å; S116-L120 PolarHBondContact O-N 3.31Å; L117-L120 WeakPolarHBondContact O-CB 3.48Å; L117-L120 PolarHBondContact O-N 3.32Å; R118-L120 PolarHBondContact O-N 2.92Å; L120-E122 VanDerWaalsContact C-N 3.29Å; L120-E122 PolarHBondContact O-N 3.49Å; L120-Q123 WeakPolarHBondContact O-CB 3.41Å; L120-Q123 PolarHBondContact O-N 3.11Å; L120-L124 WeakPolarHBondContact O-CG 3.29Å; L120-L124 PolarHBondContact O-N 3Å; L120-L124 VanDerWaalsContact O-N 3.11Å; L120-Y232 HydrophobicContact CD1-CD2 4.05Å; L120-Y232 HydrophobicContact CD1-CE2 3.73Å; L120-L249 HydrophobicContact CD1-CD1 3.96Å; L120-L249 HydrophobicContact CD1-CG 4.14Å; L120-L249 HydrophobicContact CD2-CD1 4.17Å; L120-L249 HydrophobicContact CD2-CD2 3.96Å; L120-L249 HydrophobicContact CD2-CG 4.08Å
121	L	96.9	Very high	95.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-37.8	176.9	-64.3	177.6	0	0	0	112.2	V27 F64 P65 F68 L117 R118 Q123 L124 R125	V27-L121 HydrophobicContact CB-CD2 4.34Å; V27-L121 HydrophobicContact CG1-CD2 4.23Å; V27-L121 HydrophobicContact CG2-CD2 3.89Å; F64-L121 HydrophobicContact CE2-CD1 3.8Å; F64-L121 HydrophobicContact CZ-CD1 3.84Å; P65-L121 HydrophobicContact CG-CB 4.21Å; P65-L121 HydrophobicContact CG-CD1 4.09Å; F68-L121 HydrophobicContact CD2-CB 4.07Å; F68-L121 HydrophobicContact CD2-CD2 4.1Å; F68-L121 HydrophobicContact CD2-CG 4.47Å; F68-L121 HydrophobicContact CE2-CB 4.25Å; F68-L121 HydrophobicContact CG-CD2 4.43Å; L117-L121 HydrophobicContact CD1-CD1 4.35Å; L117-L121 HydrophobicContact CD1-CG 4.22Å; L117-L121 HydrophobicContact CG-CD1 4.27Å; L117-L121 WeakPolarHBondContact O-CG 3.24Å; L117-L121 PolarHBondContact O-N 3.41Å; R118-L121 PolarHBondContact O-N 3.01Å; L121-Q123 VanDerWaalsContact C-N 3.31Å; L121-Q123 PolarHBondContact O-N 3.36Å; L121-L124 HydrophobicContact CD2-CD1 4.32Å; L121-L124 PolarHBondContact O-N 3.42Å; L121-R125 PolarHBondContact O-N 2.89Å
122	E	95.3	Very high	95.3	Very high	55 Å²	55	53.6 Å²	53.6	26%	0.257	24%	0.244	S	C	.	.	H	α-helix	trans	-64.2	-32.4	174.6	-73.8	173.8	-175.3	0	0	113	R118 G119 L120 R126	R118-E122 HydrophobicContact CG-CG 4.5Å; R118-E122 WeakPolarHBondContact CG-OE1 3.42Å; R118-E122 IonicContact CZ-OE1 2.89Å; R118-E122 IonicContact NE-OE1 3.83Å; R118-E122 PolarHBondContact NE-OE1 3.04Å; R118-E122 IonicContact NH2-OE1 3.79Å; R118-E122 WeakPolarHBondContact O-CG 3.09Å; R118-E122 PolarHBondContact O-N 3.14Å; G119-E122 PolarHBondContact O-N 2.93Å; L120-E122 VanDerWaalsContact C-N 3.29Å; L120-E122 PolarHBondContact O-N 3.49Å; E122-R126 WeakPolarHBondContact O-CG 3.3Å
123	Q	95.2	Very high	95.3	Very high	25 Å²	25	53.7 Å²	53.7	12%	0.117	24%	0.244	C	C	.	.	H	α-helix	trans	-69.5	-41.4	172	-65.8	-60.1	-38.1	0	0	111.5	G119 L120 L121 R125 R126 Y232 L248	G119-Q123 WeakPolarHBondContact O-CG 3.49Å; G119-Q123 PolarHBondContact O-N 2.9Å; G119-Q123 VanDerWaalsContact O-N 3.12Å; L120-Q123 WeakPolarHBondContact O-CB 3.41Å; L120-Q123 PolarHBondContact O-N 3.11Å; L121-Q123 VanDerWaalsContact C-N 3.31Å; L121-Q123 PolarHBondContact O-N 3.36Å; Q123-R125 VanDerWaalsContact C-N 3.34Å; Q123-R125 PolarHBondContact O-N 3.17Å; Q123-R126 PolarHBondContact O-N 2.81Å; Q123-Y232 HydrophobicContact CB-CD1 4.04Å; Q123-Y232 HydrophobicContact CB-CE1 3.84Å; Q123-Y232 HydrophobicContact CB-CE2 4.44Å; Q123-Y232 HydrophobicContact CB-CG 4.43Å; Q123-Y232 HydrophobicContact CG-CD1 3.68Å; Q123-Y232 HydrophobicContact CG-CD2 4.37Å; Q123-Y232 HydrophobicContact CG-CE1 4.03Å; Q123-Y232 HydrophobicContact CG-CG 3.87Å; Q123-L248 HydrophobicContact CG-CD1 3.64Å
124	L	96.1	Very high	95.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.3	-41.2	178.5	-58.8	-175.2	0	0	0	111.8	V27 F68 W104 I106 L120 L121 R126 Q127 V169	V27-L124 HydrophobicContact CG1-CD1 4.04Å; V27-L124 HydrophobicContact CG2-CD1 4.24Å; F68-L124 HydrophobicContact CZ-CB 4.31Å; W104-L124 HydrophobicContact CB-CD1 3.89Å; W104-L124 HydrophobicContact CD2-CB 4.16Å; W104-L124 HydrophobicContact CD2-CD1 4.28Å; W104-L124 HydrophobicContact CD2-CD2 3.99Å; W104-L124 HydrophobicContact CD2-CG 4.35Å; W104-L124 HydrophobicContact CE3-CD2 3.9Å; W104-L124 HydrophobicContact CG-CB 4.26Å; W104-L124 HydrophobicContact CG-CD1 3.82Å; W104-L124 HydrophobicContact CG-CD2 4.4Å; W104-L124 HydrophobicContact CG-CG 4.37Å; W104-L124 WeakPolarHBondContact CZ2-O 3.36Å; W104-L124 HydrophobicContact CZ3-CD2 4.33Å; I106-L124 HydrophobicContact CD1-CD1 4.36Å; L120-L124 WeakPolarHBondContact O-CG 3.29Å; L120-L124 PolarHBondContact O-N 3Å; L120-L124 VanDerWaalsContact O-N 3.11Å; L121-L124 HydrophobicContact CD2-CD1 4.32Å; L121-L124 PolarHBondContact O-N 3.42Å; L124-R126 PolarHBondContact O-N 2.86Å; L124-R126 VanDerWaalsContact O-N 3.12Å; L124-Q127 PolarHBondContact O-N 3.31Å; L124-V169 HydrophobicContact CD2-CG1 3.6Å
125	R	94.4	Very high	95.4	Very high	109 Å²	109	51.1 Å²	51.1	41%	0.411	23%	0.234	S	C	.	.	H	α-helix	trans	-57.5	-27.5	177.5	-169.4	-177.1	-59.7	109.3	21.8	113.6	P65 D67 F68 L121 Q123 Q127	P65-R125 VanDerWaalsContact CG-NH2 3.31Å; D67-R125 IonicContact OD1-CZ 2.74Å; D67-R125 IonicContact OD1-NE 3.03Å; D67-R125 PolarHBondContact OD1-NE 3.29Å; D67-R125 IonicContact OD1-NH2 3.96Å; D67-R125 PolarHBondContact OD1-NH2 3.29Å; D67-R125 IonicContact OD2-CZ 3.73Å; D67-R125 IonicContact OD2-NE 3.1Å; D67-R125 PolarHBondContact OD2-NE 3.21Å; D67-R125 IonicContact OD2-NH2 3.06Å; F68-R125 HydrophobicContact CE2-CB 4.25Å; F68-R125 HydrophobicContact CZ-CB 4.39Å; L121-R125 PolarHBondContact O-N 2.89Å; Q123-R125 VanDerWaalsContact C-N 3.34Å; Q123-R125 PolarHBondContact O-N 3.17Å; R125-Q127 VanDerWaalsContact C-N 3.26Å; R125-Q127 PolarHBondContact O-N 2.92Å
126	R	94	Very high	95.5	Very high	163 Å²	163	48 Å²	48	62%	0.615	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-7.2	-179.6	-63.7	170.7	-170.8	179.5	1.7	113.1	E122 Q123 L124	E122-R126 WeakPolarHBondContact O-CG 3.3Å; Q123-R126 PolarHBondContact O-N 2.81Å; L124-R126 PolarHBondContact O-N 2.86Å; L124-R126 VanDerWaalsContact O-N 3.12Å
127	Q	94.5	Very high	95.5	Very high	67 Å²	67	47.4 Å²	47.4	31%	0.313	21%	0.205	S	C	.	.	S	Bend	trans	-109.9	161.6	-175.6	-58	-66.1	-32.1	0	0	110.7	W104 L124 R125 P129 Y135	W104-Q127 HydrophobicContact CH2-CB 3.41Å; W104-Q127 VanDerWaalsContact CH2-CB 3.41Å; W104-Q127 HydrophobicContact CH2-CG 4.33Å; W104-Q127 HydrophobicContact CZ2-CB 3.68Å; L124-Q127 PolarHBondContact O-N 3.31Å; R125-Q127 VanDerWaalsContact C-N 3.26Å; R125-Q127 PolarHBondContact O-N 2.92Å; Q127-P129 VanDerWaalsContact O-CD 3.32Å; Q127-P129 WeakPolarHBondContact O-CD 3.39Å; Q127-Y135 HydrophobicContact CG-CE1 4.39Å; Q127-Y135 PolarHBondContact OE1-OH 2.94Å
128	N	93.9	Very high	95.5	Very high	87 Å²	87	47.8 Å²	47.8	47%	0.465	21%	0.208	S	C	.	.			trans	-90.3	110.3	177.4	179.1	5.9	0	0	0	110.7	R130 E131	N128-R130 PolarHBondContact O-N 2.83Å; N128-R130 VanDerWaalsContact O-N 3.14Å; N128-R130 WeakPolarHBondContact OD1-CB 3.36Å; N128-R130 PolarHBondContact OD1-N 3.24Å; N128-E131 HydrophobicContact CB-CB 4.31Å; N128-E131 WeakPolarHBondContact O-CB 3.2Å; N128-E131 PolarHBondContact O-N 2.83Å; N128-E131 VanDerWaalsContact O-N 3.16Å
129	P	93.1	Very high	95.6	Very high	28 Å²	28	43.1 Å²	43.1	18%	0.182	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-12.4	-179.8	27.4	-34.7	0	0	0	114.1	E103 W104 Q127	E103-P129 HydrophobicContact CB-CB 3.77Å; E103-P129 HydrophobicContact CB-CG 4.49Å; E103-P129 HydrophobicContact CG-CB 4.25Å; W104-P129 HydrophobicContact CZ2-CB 3.94Å; Q127-P129 VanDerWaalsContact O-CD 3.32Å; Q127-P129 WeakPolarHBondContact O-CD 3.39Å
130	R	91.3	Very high	95.6	Very high	216 Å²	216	46.7 Å²	46.7	82%	0.815	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-15.1	176.5	-59.8	-173.3	179.2	179.4	1.1	113.5	N128	N128-R130 PolarHBondContact O-N 2.83Å; N128-R130 VanDerWaalsContact O-N 3.14Å; N128-R130 WeakPolarHBondContact OD1-CB 3.36Å; N128-R130 PolarHBondContact OD1-N 3.24Å
131	E	92.7	Very high	95.5	Very high	71 Å²	71	47 Å²	47	33%	0.332	20%	0.203	S	C	.	.	S	Bend	trans	-64.6	145.4	174.2	-169.8	-177.8	-175.7	0	0	109.7	N128 A133 T171 K228	N128-E131 HydrophobicContact CB-CB 4.31Å; N128-E131 WeakPolarHBondContact O-CB 3.2Å; N128-E131 PolarHBondContact O-N 2.83Å; N128-E131 VanDerWaalsContact O-N 3.16Å; E131-A133 HydrophobicContact CB-CB 4.41Å; E131-A133 HydrophobicContact CG-CB 4.04Å; E131-A133 PolarHBondContact O-N 3.43Å; E131-T171 WeakPolarHBondContact O-CB 3.39Å; E131-T171 VanDerWaalsContact O-CG2 3.23Å; E131-T171 WeakPolarHBondContact O-CG2 3.46Å; E131-T171 PolarHBondContact O-OG1 3.4Å; E131-K228 IonicContact OE1-NZ 2.97Å; E131-K228 PolarHBondContact OE1-NZ 3.41Å; E131-K228 IonicContact OE2-NZ 2.61Å; E131-K228 PolarHBondContact OE2-NZ 2.9Å
132	L	94.5	Very high	95.3	Very high	25 Å²	25	51 Å²	51	13%	0.131	24%	0.236	C	C	.	.			trans	-81.5	94.9	167.2	-57.7	179	0	0	0	108	A173 L174 V211 S212 P215 I225	L132-A173 HydrophobicContact CD2-CB 3.81Å; L132-L174 HydrophobicContact CB-CD1 4.48Å; L132-L174 HydrophobicContact CD2-CB 4.42Å; L132-V211 HydrophobicContact CD1-CG1 4.18Å; L132-S212 WeakPolarHBondContact CD1-O 3.12Å; L132-P215 HydrophobicContact CD1-CB 4.27Å; L132-I225 HydrophobicContact CB-CD1 3.39Å; L132-I225 HydrophobicContact CD1-CD1 4.29Å; L132-I225 HydrophobicContact CG-CD1 4.48Å; L132-I225 WeakPolarHBondContact O-CD1 3.34Å
133	A	96.2	Very high	95.2	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.008	24%	0.24	C	C	.	.			trans	-148.2	152.6	-173.7	0	0	0	0	0	112.4	E131 Y135 T171 L174 K228	E131-A133 HydrophobicContact CB-CB 4.41Å; E131-A133 HydrophobicContact CG-CB 4.04Å; E131-A133 PolarHBondContact O-N 3.43Å; A133-Y135 HydrophobicContact CB-CE2 3.8Å; A133-T171 HydrophobicContact CB-CG2 4.12Å; A133-T171 PolarHBondContact N-OG1 2.97Å; A133-T171 PolarHBondContact O-N 3.19Å; A133-T171 PolarHBondContact O-OG1 3.45Å; A133-L174 VanDerWaalsContact C-CD2 3.46Å; A133-L174 WeakPolarHBondContact O-CD2 2.97Å; A133-K228 HydrophobicContact CB-CD 4.29Å
134	F	98	Very high	95.1	Very high	1 Å²	1	51.9 Å²	51.9	0%	0.004	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	148.5	170.3	68.5	-61.4	0	0	0	110.2	V168 V169 F170 L174 I207 I225 L227 K228	F134-V168 HydrophobicContact CD2-CG1 4.27Å; F134-V169 CarbonylContact C-O 3.55Å; F134-V169 WeakPolarHBondContact CA-O 3.13Å; F134-F170 HydrophobicContact CB-CD1 3.48Å; F134-F170 VanDerWaalsContact CB-CD1 3.48Å; F134-F170 HydrophobicContact CB-CE1 3.69Å; F134-F170 HydrophobicContact CB-CG 4.21Å; F134-F170 HydrophobicContact CD2-CE1 4.08Å; F134-F170 HydrophobicContact CG-CD1 4.34Å; F134-F170 HydrophobicContact CG-CE1 4.12Å; F134-L174 HydrophobicContact CB-CD2 3.83Å; F134-L174 HydrophobicContact CD1-CD2 3.85Å; F134-L174 HydrophobicContact CG-CD2 4.16Å; F134-I207 HydrophobicContact CD1-CD1 4.12Å; F134-I207 HydrophobicContact CD1-CG2 4.28Å; F134-I207 HydrophobicContact CD2-CD1 4.04Å; F134-I207 HydrophobicContact CE1-CB 4.39Å; F134-I207 HydrophobicContact CE1-CD1 3.96Å; F134-I207 HydrophobicContact CE1-CG2 3.75Å; F134-I207 HydrophobicContact CE2-CD1 3.85Å; F134-I207 HydrophobicContact CG-CD1 4.18Å; F134-I207 HydrophobicContact CZ-CB 4.5Å; F134-I207 HydrophobicContact CZ-CD1 3.82Å; F134-I207 HydrophobicContact CZ-CG2 4.33Å; F134-I225 HydrophobicContact CD1-CG2 4.02Å; F134-I225 HydrophobicContact CE1-CG2 3.95Å; F134-L227 HydrophobicContact CD2-CB 4.43Å; F134-L227 HydrophobicContact CD2-CD1 3.41Å; F134-L227 VanDerWaalsContact CD2-CD1 3.41Å; F134-L227 HydrophobicContact CE1-CB 4.4Å; F134-L227 HydrophobicContact CE2-CB 3.72Å; F134-L227 HydrophobicContact CE2-CD1 3.47Å; F134-L227 VanDerWaalsContact CE2-CD1 3.47Å; F134-L227 HydrophobicContact CE2-CG 4.18Å; F134-L227 HydrophobicContact CG-CD1 4.16Å; F134-L227 VanDerWaalsContact CZ-CA 3.49Å; F134-L227 HydrophobicContact CZ-CB 3.7Å; F134-L227 HydrophobicContact CZ-CD1 4.24Å; F134-K228 PolarHBondContact O-N 2.83Å
135	Y	98.3	Very high	94.9	Very high	10 Å²	10	52 Å²	52	4%	0.039	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	140.9	-167.7	-55.2	-102.8	0	0	0	109.9	W104 Q127 A133 V168 V169 T171 K228	W104-Y135 HydrophobicContact CH2-CE2 4.32Å; W104-Y135 HydrophobicContact CZ3-CD2 4.43Å; W104-Y135 AromaticContact CZ3-CE2 3.94Å; W104-Y135 HydrophobicContact CZ3-CE2 3.94Å; Q127-Y135 HydrophobicContact CG-CE1 4.39Å; Q127-Y135 PolarHBondContact OE1-OH 2.94Å; A133-Y135 HydrophobicContact CB-CE2 3.8Å; Y135-V168 WeakPolarHBondContact O-CA 3.36Å; Y135-V168 WeakPolarHBondContact O-CG1 3.39Å; Y135-V169 PolarHBondContact N-O 3.41Å; Y135-V169 PolarHBondContact O-N 2.93Å; Y135-T171 HydrophobicContact CE2-CG2 4.48Å; Y135-K228 VanDerWaalsContact CA-O 3.27Å; Y135-K228 WeakPolarHBondContact CA-O 3.47Å; Y135-K228 HydrophobicContact CD1-CB 3.6Å; Y135-K228 HydrophobicContact CD1-CD 4.06Å; Y135-K228 HydrophobicContact CD1-CG 4.46Å; Y135-K228 HydrophobicContact CE1-CB 3.95Å; Y135-K228 HydrophobicContact CE1-CD 3.5Å; Y135-K228 HydrophobicContact CE1-CG 4.36Å; Y135-K228 HydrophobicContact CG-CB 4.24Å
136	G	98.1	Very high	94.8	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	177.1	-175.5	0	0	0	0	0	112.4	A138 K228 S229 A230	G136-A138 PolarHBondContact O-N 2.88Å; G136-K228 PolarHBondContact N-O 2.91Å; G136-K228 VanDerWaalsContact N-O 3.15Å; G136-S229 WeakPolarHBondContact O-CA 3.49Å; G136-A230 PolarHBondContact O-N 2.74Å
137	H	97.2	Very high	94.8	Very high	28 Å²	28	41.1 Å²	41.1	13%	0.13	21%	0.207	C	C	.	.			trans	-77	111.5	162.6	-171.9	77.9	0	0	0	108.3	L139 M163 A166 I233	H137-L139 PolarHBondContact O-N 3.46Å; H137-M163 HydrophobicContact CB-CB 4.18Å; H137-M163 PolarHBondContact O-N 3.13Å; H137-A166 HydrophobicContact CB-CB 4.3Å; H137-I233 HydrophobicContact CB-CG2 4.03Å; H137-I233 PolarHBondContact ND1-O 2.79Å
138	A	97.4	Very high	94.8	Very high	9 Å²	9	38.2 Å²	38.2	7%	0.074	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	122.5	-176.5	0	0	0	0	0	111.1	G136 Y140 P160 L227	G136-A138 PolarHBondContact O-N 2.88Å; A138-Y140 HydrophobicContact CB-CE2 3.89Å; A138-P160 HydrophobicContact CB-CB 3.9Å; A138-L227 HydrophobicContact CB-CD2 3.88Å
139	L	97.1	Very high	94.7	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	157.1	168.1	-58.1	178.2	0	0	0	109.7	H137 P160 Y161 M163 A468 E470 L471	H137-L139 PolarHBondContact O-N 3.46Å; L139-P160 WeakPolarHBondContact O-CA 3.42Å; L139-Y161 HydrophobicContact CB-CD2 3.76Å; L139-Y161 HydrophobicContact CB-CE1 4.35Å; L139-Y161 HydrophobicContact CB-CE2 3.41Å; L139-Y161 VanDerWaalsContact CB-CE2 3.41Å; L139-Y161 HydrophobicContact CB-CG 4.35Å; L139-Y161 HydrophobicContact CD1-CD2 4.13Å; L139-Y161 HydrophobicContact CD1-CE2 3.74Å; L139-Y161 HydrophobicContact CG-CD2 4.48Å; L139-Y161 HydrophobicContact CG-CE2 4.22Å; L139-Y161 PolarHBondContact N-O 3.01Å; L139-Y161 PolarHBondContact O-N 3.05Å; L139-Y161 VanDerWaalsContact O-N 3.14Å; L139-M163 HydrophobicContact CD1-CB 3.78Å; L139-M163 HydrophobicContact CD1-CG 4.16Å; L139-M163 HydrophobicContact CD2-CB 4.12Å; L139-M163 HydrophobicContact CD2-SD 4.41Å; L139-M163 HydrophobicContact CG-CB 3.88Å; L139-A468 HydrophobicContact CB-CB 4.18Å; L139-A468 HydrophobicContact CD1-CB 4.04Å; L139-A468 HydrophobicContact CD2-CB 4.11Å; L139-A468 HydrophobicContact CG-CB 4.34Å; L139-E470 HydrophobicContact CD2-CB 3.99Å; L139-E470 HydrophobicContact CD2-CG 4.22Å; L139-L471 HydrophobicContact CD1-CD1 3.86Å; L139-L471 HydrophobicContact CD1-CD2 4.15Å; L139-L471 HydrophobicContact CD1-CG 3.89Å
140	Y	96.3	Very high	94.6	Very high	85 Å²	85	41 Å²	41	33%	0.333	20%	0.2	S	C	.	.			trans	-142.8	148.2	179.2	-59.7	-89.3	0	0	0	110.1	A138 Q157 P160	A138-Y140 HydrophobicContact CB-CE2 3.89Å; Y140-Q157 WeakPolarHBondContact CD1-O 3.22Å; Y140-Q157 WeakPolarHBondContact CE1-O 3.45Å; Y140-P160 HydrophobicContact CD1-CB 4.43Å; Y140-P160 HydrophobicContact CE1-CB 3.66Å; Y140-P160 HydrophobicContact CE1-CG 4.38Å
141	D	95.5	Very high	94.4	Very high	8 Å²	8	31.5 Å²	31.5	4%	0.043	17%	0.166	C	C	.	.			trans	-76.4	129.6	173.1	-65.1	-19.2	0	0	0	110.4	E143 H148 P156 Q157 Y161	D141-E143 VanDerWaalsContact C-N 3.29Å; D141-E143 WeakPolarHBondContact CB-O 3.48Å; D141-E143 PolarHBondContact O-N 2.77Å; D141-H148 IonicContact OD1-CE1 3.35Å; D141-H148 PolarHBondContact OD1-CE1 3.09Å; D141-H148 IonicContact OD1-ND1 3.2Å; D141-H148 PolarHBondContact OD1-ND1 3.49Å; D141-H148 IonicContact OD2-CE1 2.77Å; D141-H148 IonicContact OD2-CG 2.68Å; D141-H148 IonicContact OD2-ND1 3.27Å; D141-H148 PolarHBondContact OD2-ND1 2.86Å; D141-P156 HydrophobicContact CB-CB 3.88Å; D141-P156 WeakPolarHBondContact O-CB 3.48Å; D141-Q157 PolarHBondContact O-NE2 2.91Å; D141-Y161 VanDerWaalsContact OD1-CE1 3.29Å; D141-Y161 WeakPolarHBondContact OD1-CE1 3.39Å; D141-Y161 PolarHBondContact OD1-OH 3.47Å
142	A	92.3	Very high	94.2	Very high	83 Å²	83	30.7 Å²	30.7	69%	0.686	17%	0.165	S	C	*	.	S	Bend	trans	-66.8	-34.4	175.7	0	0	0	0	0	111.8
143	E	93	Very high	94	Very high	73 Å²	73	36.6 Å²	36.6	34%	0.341	19%	0.186	S	C	.	.	S	Bend	trans	-145.8	170.1	176.1	62.5	173.5	-160.2	0	0	110.8	D141 T145 R463 Q465	D141-E143 VanDerWaalsContact C-N 3.29Å; D141-E143 WeakPolarHBondContact CB-O 3.48Å; D141-E143 PolarHBondContact O-N 2.77Å; E143-T145 PolarHBondContact O-N 2.97Å; E143-R463 IonicContact OE1-CZ 3.45Å; E143-R463 IonicContact OE1-NH1 3.53Å; E143-R463 PolarHBondContact OE1-NH1 3.49Å; E143-R463 IonicContact OE1-NH2 3.64Å; E143-R463 PolarHBondContact OE1-NH2 3.18Å; E143-Q465 VanDerWaalsContact OE1-CG 3.29Å; E143-Q465 WeakPolarHBondContact OE1-CG 3.28Å
144	A	93.1	Very high	93.8	Very high	26 Å²	26	44.9 Å²	44.9	22%	0.215	22%	0.222	C	C	.	.			trans	-60.8	114.3	176	0	0	0	0	0	110	F150 P156	A144-F150 HydrophobicContact CB-CD1 4.03Å; A144-F150 WeakPolarHBondContact O-CD1 3.43Å; A144-P156 HydrophobicContact CB-CG 4.43Å
145	T	93.1	Very high	93.6	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.012	24%	0.242	C	C	.	.			trans	-110.1	147.8	-172.2	-174.6	0	0	0	0	113.7	E143 I147 H148 H149 F150 D466	E143-T145 PolarHBondContact O-N 2.97Å; T145-I147 VanDerWaalsContact C-N 3.34Å; T145-I147 HydrophobicContact CG2-CG1 3.7Å; T145-H148 HydrophobicContact CG2-CB 3.88Å; T145-H148 PolarHBondContact O-N 3.02Å; T145-H149 PolarHBondContact O-N 3.39Å; T145-F150 WeakPolarHBondContact O-CA 3.42Å; T145-F150 PolarHBondContact O-N 3.03Å; T145-D466 VanDerWaalsContact OG1-CA 3.3Å; T145-D466 WeakPolarHBondContact OG1-CA 3.47Å; T145-D466 WeakPolarHBondContact OG1-CB 3.32Å; T145-D466 VanDerWaalsContact OG1-CG 3.29Å; T145-D466 PolarHBondContact OG1-O 2.76Å; T145-D466 PolarHBondContact OG1-OD1 3.4Å
146	I	91.7	Very high	93.3	Very high	35 Å²	35	49.2 Å²	49.2	18%	0.179	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-67	-32.5	177.2	-166	171.7	0	0	0	112.9	H148 H149 F150 A462 T538	I146-H148 PolarHBondContact O-N 3.29Å; I146-H149 PolarHBondContact O-N 3.18Å; I146-F150 HydrophobicContact CB-CE1 4.34Å; I146-F150 HydrophobicContact CB-CE2 4.19Å; I146-F150 HydrophobicContact CB-CZ 3.8Å; I146-F150 HydrophobicContact CG1-CE2 4.09Å; I146-F150 HydrophobicContact CG1-CZ 4.14Å; I146-A462 HydrophobicContact CG2-CB 4.14Å; I146-T538 HydrophobicContact CD1-CG2 4.47Å
147	I	93.7	Very high	93	Very high	9 Å²	9	54 Å²	54	5%	0.046	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-66.9	-19.7	-177.7	64.8	162.6	0	0	0	111.7	T145 I197 A462 D466 Y467	T145-I147 VanDerWaalsContact C-N 3.34Å; T145-I147 HydrophobicContact CG2-CG1 3.7Å; I147-I197 HydrophobicContact CB-CG2 4.05Å; I147-I197 WeakPolarHBondContact O-CG2 3.5Å; I147-A462 HydrophobicContact CG2-CB 3.92Å; I147-D466 WeakPolarHBondContact CD1-O 3.48Å; I147-D466 WeakPolarHBondContact CG1-O 3.38Å; I147-Y467 HydrophobicContact CD1-CD1 3.83Å; I147-Y467 HydrophobicContact CD1-CE1 3.91Å; I147-Y467 HydrophobicContact CG2-CE1 4.37Å
148	H	94.5	Very high	92.8	Very high	5 Å²	5	61.3 Å²	61.3	2%	0.023	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-109.6	23.3	172.9	-57	155.5	0	0	0	112.4	D141 T145 I146 F150 S151 Y161 D198 H201	D141-H148 IonicContact OD1-CE1 3.35Å; D141-H148 PolarHBondContact OD1-CE1 3.09Å; D141-H148 IonicContact OD1-ND1 3.2Å; D141-H148 PolarHBondContact OD1-ND1 3.49Å; D141-H148 IonicContact OD2-CE1 2.77Å; D141-H148 IonicContact OD2-CG 2.68Å; D141-H148 IonicContact OD2-ND1 3.27Å; D141-H148 PolarHBondContact OD2-ND1 2.86Å; T145-H148 HydrophobicContact CG2-CB 3.88Å; T145-H148 PolarHBondContact O-N 3.02Å; I146-H148 PolarHBondContact O-N 3.29Å; H148-F150 PolarHBondContact O-N 3.31Å; H148-F150 VanDerWaalsContact O-N 3.11Å; H148-S151 VanDerWaalsContact O-CB 3.22Å; H148-S151 WeakPolarHBondContact O-CB 3.49Å; H148-S151 PolarHBondContact O-N 3.49Å; H148-S151 PolarHBondContact O-OG 2.75Å; H148-Y161 AromaticContact CE1-CE1 3.84Å; H148-Y161 AromaticContact CE1-CZ 3.66Å; H148-D198 IonicContact CE1-OD2 2.66Å; H148-D198 IonicContact NE2-OD2 3.71Å; H148-D198 PolarHBondContact NE2-OD2 3.17Å; H148-D198 VanDerWaalsContact NE2-OD2 3.13Å; H148-H201 VanDerWaalsContact CD2-CB 3.45Å; H148-H201 WeakPolarHBondContact CD2-CB 3.44Å; H148-H201 AromaticContact CD2-CD2 3.84Å; H148-H201 AromaticContact CD2-CG 3.38Å; H148-H201 AromaticContact CD2-ND1 3.74Å; H148-H201 AromaticContact CE1-CD2 3.75Å; H148-H201 AromaticContact CE1-CG 3.85Å; H148-H201 AromaticContact CG-CD2 3.52Å; H148-H201 AromaticContact CG-CE1 3.98Å; H148-H201 AromaticContact CG-CG 3.53Å; H148-H201 AromaticContact CG-ND1 3.81Å; H148-H201 AromaticContact CG-NE2 3.85Å; H148-H201 AromaticContact ND1-CD2 3.44Å; H148-H201 PolarHBondContact ND1-CD2 3.25Å; H148-H201 AromaticContact ND1-CG 3.79Å; H148-H201 VanDerWaalsContact NE2-CB 3.26Å; H148-H201 WeakPolarHBondContact NE2-CB 3.42Å; H148-H201 AromaticContact NE2-CD2 3.99Å; H148-H201 AromaticContact NE2-CG 3.61Å
149	H	91.7	Very high	92.7	Very high	83 Å²	83	61.4 Å²	61.4	38%	0.384	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	34.4	179.1	-56.5	-73.7	0	0	0	114.3	T145 I146 S151	T145-H149 PolarHBondContact O-N 3.39Å; I146-H149 PolarHBondContact O-N 3.18Å; H149-S151 PolarHBondContact O-N 2.96Å; H149-S151 VanDerWaalsContact O-N 3.12Å
150	F	90.6	Very high	92.6	Very high	90 Å²	90	61.9 Å²	61.9	40%	0.395	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	29.1	-174.7	-52.4	-74.4	0	0	0	113.1	A144 T145 I146 H148 Y153	A144-F150 HydrophobicContact CB-CD1 4.03Å; A144-F150 WeakPolarHBondContact O-CD1 3.43Å; T145-F150 WeakPolarHBondContact O-CA 3.42Å; T145-F150 PolarHBondContact O-N 3.03Å; I146-F150 HydrophobicContact CB-CE1 4.34Å; I146-F150 HydrophobicContact CB-CE2 4.19Å; I146-F150 HydrophobicContact CB-CZ 3.8Å; I146-F150 HydrophobicContact CG1-CE2 4.09Å; I146-F150 HydrophobicContact CG1-CZ 4.14Å; H148-F150 PolarHBondContact O-N 3.31Å; H148-F150 VanDerWaalsContact O-N 3.11Å; F150-Y153 WeakPolarHBondContact O-CB 3.41Å; F150-Y153 PolarHBondContact O-N 3.05Å
151	S	87.6	Confident	92.7	Very high	17 Å²	17	57.9 Å²	57.9	12%	0.119	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	144.4	172.1	86.9	0	0	0	0	109.8	H148 H149 Y153 H201 R205	H148-S151 VanDerWaalsContact O-CB 3.22Å; H148-S151 WeakPolarHBondContact O-CB 3.49Å; H148-S151 PolarHBondContact O-N 3.49Å; H148-S151 PolarHBondContact O-OG 2.75Å; H149-S151 PolarHBondContact O-N 2.96Å; H149-S151 VanDerWaalsContact O-N 3.12Å; S151-Y153 PolarHBondContact O-N 3.19Å; S151-Y153 VanDerWaalsContact O-N 3.14Å; S151-H201 PolarHBondContact OG-CE1 2.73Å; S151-H201 PolarHBondContact OG-NE2 3.17Å; S151-R205 VanDerWaalsContact CB-NH1 3.35Å
152	N	88.5	Confident	92.8	Very high	55 Å²	55	57.5 Å²	57.5	29%	0.294	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	28.5	-176.7	-52.2	-63.7	0	0	0	114.2	K154 D155 P156 F159	N152-K154 PolarHBondContact O-N 2.58Å; N152-D155 CarbonylContact O-C 3.27Å; N152-D155 PolarHBondContact O-N 2.84Å; N152-P156 VanDerWaalsContact O-N 3.09Å; N152-F159 WeakPolarHBondContact ND2-CB 3.44Å
153	Y	90.5	Very high	93.1	Very high	148 Å²	148	53.5 Å²	53.5	58%	0.58	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-24.2	-175.6	71.5	-87.6	0	0	0	116	F150 S151	F150-Y153 WeakPolarHBondContact O-CB 3.41Å; F150-Y153 PolarHBondContact O-N 3.05Å; S151-Y153 PolarHBondContact O-N 3.19Å; S151-Y153 VanDerWaalsContact O-N 3.14Å
154	K	92.6	Very high	93.2	Very high	175 Å²	175	50.6 Å²	50.6	76%	0.761	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-29.3	176.7	-64.7	-172.9	-179.9	-179.8	0	112.9	N152	N152-K154 PolarHBondContact O-N 2.58Å
155	D	93.3	Very high	93.3	Very high	81 Å²	81	49.6 Å²	49.6	43%	0.433	23%	0.225	S	C	.	.			trans	-153.9	78.4	-178.3	-175.1	8.6	0	0	0	109.7	N152 Q157 R158	N152-D155 CarbonylContact O-C 3.27Å; N152-D155 PolarHBondContact O-N 2.84Å; D155-Q157 PolarHBondContact O-N 3.12Å; D155-Q157 VanDerWaalsContact O-N 3.16Å; D155-R158 HydrophobicContact CB-CB 4.19Å; D155-R158 WeakPolarHBondContact O-CB 3.49Å; D155-R158 PolarHBondContact O-N 3.35Å
156	P	91.3	Very high	93.5	Very high	21 Å²	21	49.5 Å²	49.5	14%	0.136	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-60.7	-24.6	-176.2	-25.2	36	0	0	0	113.3	D141 A144 N152 R158	D141-P156 HydrophobicContact CB-CB 3.88Å; D141-P156 WeakPolarHBondContact O-CB 3.48Å; A144-P156 HydrophobicContact CB-CG 4.43Å; N152-P156 VanDerWaalsContact O-N 3.09Å; P156-R158 PolarHBondContact O-N 3.41Å
157	Q	92.6	Very high	93.8	Very high	100 Å²	100	47.9 Å²	47.9	47%	0.467	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-77.6	-6.2	178.4	-66.6	-72.3	-49.5	0	0	113.1	Y140 D141 D155 F159	Y140-Q157 WeakPolarHBondContact CD1-O 3.22Å; Y140-Q157 WeakPolarHBondContact CE1-O 3.45Å; D141-Q157 PolarHBondContact O-NE2 2.91Å; D155-Q157 PolarHBondContact O-N 3.12Å; D155-Q157 VanDerWaalsContact O-N 3.16Å; Q157-F159 VanDerWaalsContact C-N 3.33Å; Q157-F159 PolarHBondContact O-N 3.39Å
158	R	92.1	Very high	94	Very high	183 Å²	183	47.4 Å²	47.4	69%	0.691	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-72.5	-24.6	-179.9	-173.1	171.1	174.3	171.4	-0.8	113.7	D155 P156 P160	D155-R158 HydrophobicContact CB-CB 4.19Å; D155-R158 WeakPolarHBondContact O-CB 3.49Å; D155-R158 PolarHBondContact O-N 3.35Å; P156-R158 PolarHBondContact O-N 3.41Å; R158-P160 WeakPolarHBondContact O-CD 3.43Å
159	F	94.8	Very high	94.2	Very high	10 Å²	10	47.2 Å²	47.2	4%	0.044	21%	0.213	C	C	.	.			trans	-115.8	99.8	-167.4	-164.2	-97.8	0	0	0	112	N152 Q157 H201 A204 R205 F208 L226	N152-F159 WeakPolarHBondContact ND2-CB 3.44Å; Q157-F159 VanDerWaalsContact C-N 3.33Å; Q157-F159 PolarHBondContact O-N 3.39Å; F159-H201 AromaticContact CD1-NE2 3.78Å; F159-A204 HydrophobicContact CE1-CB 3.83Å; F159-A204 HydrophobicContact CZ-CB 4.12Å; F159-R205 HydrophobicContact CE1-CB 4.26Å; F159-R205 HydrophobicContact CZ-CB 4.23Å; F159-F208 HydrophobicContact CE2-CB 3.84Å; F159-F208 HydrophobicContact CE2-CD1 4.1Å; F159-F208 HydrophobicContact CE2-CD2 4.14Å; F159-F208 AromaticContact CE2-CG 3.76Å; F159-F208 HydrophobicContact CE2-CG 3.76Å; F159-F208 HydrophobicContact CZ-CB 4.01Å; F159-F208 HydrophobicContact CZ-CG 4.42Å; F159-L226 HydrophobicContact CD2-CD2 3.96Å; F159-L226 HydrophobicContact CE2-CD2 3.8Å
160	P	97	Very high	94.5	Very high	10 Å²	10	43.2 Å²	43.2	7%	0.065	20%	0.195	C	C	.	.			trans	-77	136.2	177.2	29.6	-34.1	0	0	0	112	A138 L139 Y140 R158 L227	A138-P160 HydrophobicContact CB-CB 3.9Å; L139-P160 WeakPolarHBondContact O-CA 3.42Å; Y140-P160 HydrophobicContact CD1-CB 4.43Å; Y140-P160 HydrophobicContact CE1-CB 3.66Å; Y140-P160 HydrophobicContact CE1-CG 4.38Å; R158-P160 WeakPolarHBondContact O-CD 3.43Å; P160-L227 HydrophobicContact CB-CB 4.23Å; P160-L227 HydrophobicContact CB-CD2 4.37Å; P160-L227 HydrophobicContact CG-CB 4.18Å
161	Y	97.8	Very high	94.8	Very high	1 Å²	1	39 Å²	39	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	151	170.3	55.5	-87	0	0	0	111.2	L139 D141 H148 H201	L139-Y161 HydrophobicContact CB-CD2 3.76Å; L139-Y161 HydrophobicContact CB-CE1 4.35Å; L139-Y161 HydrophobicContact CB-CE2 3.41Å; L139-Y161 VanDerWaalsContact CB-CE2 3.41Å; L139-Y161 HydrophobicContact CB-CG 4.35Å; L139-Y161 HydrophobicContact CD1-CD2 4.13Å; L139-Y161 HydrophobicContact CD1-CE2 3.74Å; L139-Y161 HydrophobicContact CG-CD2 4.48Å; L139-Y161 HydrophobicContact CG-CE2 4.22Å; L139-Y161 PolarHBondContact N-O 3.01Å; L139-Y161 PolarHBondContact O-N 3.05Å; L139-Y161 VanDerWaalsContact O-N 3.14Å; D141-Y161 VanDerWaalsContact OD1-CE1 3.29Å; D141-Y161 WeakPolarHBondContact OD1-CE1 3.39Å; D141-Y161 PolarHBondContact OD1-OH 3.47Å; H148-Y161 AromaticContact CE1-CE1 3.84Å; H148-Y161 AromaticContact CE1-CZ 3.66Å; Y161-H201 HydrophobicContact CD1-CB 4.49Å; Y161-H201 AromaticContact CD1-CD2 3.85Å; Y161-H201 HydrophobicContact CD2-CB 4.42Å; Y161-H201 HydrophobicContact CG-CB 4.2Å
162	P	98.1	Very high	95	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	139.3	-169.8	29.7	-34.4	0	0	0	112.4	L164 V168 S200 L203 L227	P162-L164 HydrophobicContact CG-CD2 4.17Å; P162-L164 PolarHBondContact O-N 2.82Å; P162-V168 HydrophobicContact CB-CG1 4.36Å; P162-V168 HydrophobicContact CB-CG2 3.56Å; P162-V168 HydrophobicContact CG-CG2 4.08Å; P162-S200 WeakPolarHBondContact O-CB 3.29Å; P162-S200 PolarHBondContact O-OG 3.38Å; P162-L203 HydrophobicContact CG-CD2 4.24Å; P162-L227 HydrophobicContact CB-CD1 4.1Å; P162-L227 HydrophobicContact CB-CD2 3.91Å
163	M	96.9	Very high	95.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.165	C	C	.	.			trans	-71.4	93.3	164.2	-171.2	174.8	178	0	0	110.1	H137 L139 S165 A166 S235 A251 E470 L471 L474	H137-M163 HydrophobicContact CB-CB 4.18Å; H137-M163 PolarHBondContact O-N 3.13Å; L139-M163 HydrophobicContact CD1-CB 3.78Å; L139-M163 HydrophobicContact CD1-CG 4.16Å; L139-M163 HydrophobicContact CD2-CB 4.12Å; L139-M163 HydrophobicContact CD2-SD 4.41Å; L139-M163 HydrophobicContact CG-CB 3.88Å; M163-S165 WeakPolarHBondContact CE-OG 3.47Å; M163-S165 WeakPolarHBondContact CG-OG 3.24Å; M163-S165 PolarHBondContact O-N 3.46Å; M163-S165 VanDerWaalsContact O-N 3.16Å; M163-A166 HydrophobicContact CB-CB 4.17Å; M163-A166 HydrophobicContact CG-CB 4.12Å; M163-A166 WeakPolarHBondContact O-CB 3.26Å; M163-A166 PolarHBondContact O-N 2.76Å; M163-A166 HydrophobicContact SD-CB 4.24Å; M163-S235 VanDerWaalsContact SD-CA 3.59Å; M163-A251 HydrophobicContact CE-CB 3.92Å; M163-E470 HydrophobicContact SD-CB 4.31Å; M163-L471 HydrophobicContact CE-CD2 4.19Å; M163-L471 HydrophobicContact CG-CD2 3.99Å; M163-L474 HydrophobicContact CE-CB 4.49Å; M163-L474 HydrophobicContact CE-CD1 4.37Å; M163-L474 HydrophobicContact CE-CD2 3.98Å
164	L	96.6	Very high	95.4	Very high	11 Å²	11	29.6 Å²	29.6	6%	0.058	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-56.1	-34.8	-175	-66.6	179	0	0	0	113.8	Q109 P162 A166 G167 V168 A199 S200 L203	Q109-L164 HydrophobicContact CG-CB 4.5Å; P162-L164 HydrophobicContact CG-CD2 4.17Å; P162-L164 PolarHBondContact O-N 2.82Å; L164-A166 PolarHBondContact O-N 3.38Å; L164-G167 PolarHBondContact O-N 3.41Å; L164-V168 HydrophobicContact CD2-CG2 3.71Å; L164-A199 HydrophobicContact CD1-CB 4.05Å; L164-S200 WeakPolarHBondContact CG-OG 3.28Å; L164-L203 HydrophobicContact CD2-CD2 4.07Å
165	S	95.5	Very high	95.3	Very high	6 Å²	6	21.2 Å²	21.2	4%	0.042	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-65.9	-24.7	177.7	52	0	0	0	0	113.5	Q109 N111 T112 M163 G167 A251 L474	Q109-S165 VanDerWaalsContact OE1-CA 3.26Å; N111-S165 WeakPolarHBondContact OD1-CB 3.29Å; T112-S165 WeakPolarHBondContact CA-O 3.14Å; T112-S165 WeakPolarHBondContact CB-O 3.45Å; T112-S165 PolarHBondContact OG1-O 2.88Å; M163-S165 WeakPolarHBondContact CE-OG 3.47Å; M163-S165 WeakPolarHBondContact CG-OG 3.24Å; M163-S165 PolarHBondContact O-N 3.46Å; M163-S165 VanDerWaalsContact O-N 3.16Å; S165-G167 VanDerWaalsContact C-N 3.28Å; S165-A251 WeakPolarHBondContact O-CA 3.38Å; S165-A251 WeakPolarHBondContact O-CB 3.27Å; S165-L474 VanDerWaalsContact OG-CD2 3.27Å; S165-L474 WeakPolarHBondContact OG-CD2 3.31Å
166	A	96.7	Very high	95.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-81.4	-8.8	172.6	0	0	0	0	0	113.3	H137 M163 L164 I233 C234 L249 A251	H137-A166 HydrophobicContact CB-CB 4.3Å; M163-A166 HydrophobicContact CB-CB 4.17Å; M163-A166 HydrophobicContact CG-CB 4.12Å; M163-A166 WeakPolarHBondContact O-CB 3.26Å; M163-A166 PolarHBondContact O-N 2.76Å; M163-A166 HydrophobicContact SD-CB 4.24Å; L164-A166 PolarHBondContact O-N 3.38Å; A166-I233 HydrophobicContact CB-CG2 4Å; A166-C234 VanDerWaalsContact CB-O 3.23Å; A166-C234 WeakPolarHBondContact CB-O 3.09Å; A166-L249 WeakPolarHBondContact O-CB 3.39Å; A166-A251 HydrophobicContact CB-CB 4.45Å
167	G	97.6	Very high	95	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.105	C	C	.	.			trans	87.4	151.2	-174.1	0	0	0	0	0	113.3	W107 L164 S165	W107-G167 CarbonylContact O-C 3.57Å; W107-G167 WeakPolarHBondContact O-CA 3.43Å; L164-G167 PolarHBondContact O-N 3.41Å; S165-G167 VanDerWaalsContact C-N 3.28Å
168	V	98.2	Very high	94.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	138.8	179.1	-172.4	0	0	0	0	109.3	W107 F134 Y135 P162 L164 F170	W107-V168 PolarHBondContact N-O 3.03Å; W107-V168 PolarHBondContact O-N 3.47Å; F134-V168 HydrophobicContact CD2-CG1 4.27Å; Y135-V168 WeakPolarHBondContact O-CA 3.36Å; Y135-V168 WeakPolarHBondContact O-CG1 3.39Å; P162-V168 HydrophobicContact CB-CG1 4.36Å; P162-V168 HydrophobicContact CB-CG2 3.56Å; P162-V168 HydrophobicContact CG-CG2 4.08Å; L164-V168 HydrophobicContact CD2-CG2 3.71Å; V168-F170 HydrophobicContact CB-CE2 3.82Å; V168-F170 HydrophobicContact CB-CZ 4.19Å; V168-F170 HydrophobicContact CG1-CD2 4.23Å; V168-F170 HydrophobicContact CG1-CE1 4.26Å; V168-F170 HydrophobicContact CG1-CE2 3.52Å; V168-F170 HydrophobicContact CG1-CZ 3.52Å
169	V	98.3	Very high	94.8	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	128.4	177.4	178	0	0	0	0	109.3	W104 I105 I106 L124 F134 Y135 I233 L249	W104-V169 HydrophobicContact CE3-CG1 3.79Å; W104-V169 HydrophobicContact CZ3-CG1 4.19Å; I105-V169 CarbonylContact O-C 3.48Å; I105-V169 VanDerWaalsContact O-CA 3.29Å; I105-V169 WeakPolarHBondContact O-CA 3.25Å; I106-V169 HydrophobicContact CG1-CG2 4.24Å; I106-V169 HydrophobicContact CG2-CG2 4.46Å; L124-V169 HydrophobicContact CD2-CG1 3.6Å; F134-V169 CarbonylContact C-O 3.55Å; F134-V169 WeakPolarHBondContact CA-O 3.13Å; Y135-V169 PolarHBondContact N-O 3.41Å; Y135-V169 PolarHBondContact O-N 2.93Å; V169-I233 HydrophobicContact CG2-CD1 4.1Å; V169-L249 HydrophobicContact CG2-CD1 4.1Å
170	F	97.7	Very high	94.3	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	145.8	173.9	-59.6	-94.5	0	0	0	109.9	M84 W104 I105 W107 F134 V168 L174 L175 L178 L203 I207	M84-F170 HydrophobicContact CE-CD1 4.49Å; M84-F170 HydrophobicContact CE-CE1 3.75Å; M84-F170 HydrophobicContact CE-CE2 4.04Å; M84-F170 HydrophobicContact CE-CZ 3.49Å; M84-F170 VanDerWaalsContact CE-CZ 3.49Å; M84-F170 HydrophobicContact SD-CE1 4.28Å; M84-F170 HydrophobicContact SD-CE2 3.63Å; M84-F170 HydrophobicContact SD-CZ 3.41Å; M84-F170 WeakPolarHBondContact SD-CZ 3.26Å; W104-F170 WeakPolarHBondContact CA-O 3.21Å; I105-F170 HydrophobicContact CB-CB 4.43Å; I105-F170 PolarHBondContact N-O 3.3Å; I105-F170 PolarHBondContact O-N 2.84Å; W107-F170 HydrophobicContact CB-CD2 4.48Å; W107-F170 HydrophobicContact CB-CE2 4.03Å; F134-F170 HydrophobicContact CB-CD1 3.48Å; F134-F170 VanDerWaalsContact CB-CD1 3.48Å; F134-F170 HydrophobicContact CB-CE1 3.69Å; F134-F170 HydrophobicContact CB-CG 4.21Å; F134-F170 HydrophobicContact CD2-CE1 4.08Å; F134-F170 HydrophobicContact CG-CD1 4.34Å; F134-F170 HydrophobicContact CG-CE1 4.12Å; V168-F170 HydrophobicContact CB-CE2 3.82Å; V168-F170 HydrophobicContact CB-CZ 4.19Å; V168-F170 HydrophobicContact CG1-CD2 4.23Å; V168-F170 HydrophobicContact CG1-CE1 4.26Å; V168-F170 HydrophobicContact CG1-CE2 3.52Å; V168-F170 HydrophobicContact CG1-CZ 3.52Å; F170-L174 HydrophobicContact CD1-CD2 4.09Å; F170-L175 HydrophobicContact CB-CB 4.3Å; F170-L175 HydrophobicContact CB-CD1 4.33Å; F170-L175 HydrophobicContact CD1-CD1 4.26Å; F170-L175 HydrophobicContact CD2-CD1 4.23Å; F170-L175 HydrophobicContact CG-CD1 4.01Å; F170-L178 HydrophobicContact CE1-CD1 4.46Å; F170-L203 HydrophobicContact CZ-CD2 3.98Å; F170-I207 HydrophobicContact CE1-CD1 4.15Å
171	T	96.5	Very high	93.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	145.1	158.3	62.9	0	0	0	0	109.5	W104 E131 A133 Y135 A173 L174 L175	W104-T171 HydrophobicContact CE3-CG2 4.25Å; W104-T171 HydrophobicContact CH2-CG2 3.76Å; W104-T171 HydrophobicContact CZ3-CG2 3.52Å; E131-T171 WeakPolarHBondContact O-CB 3.39Å; E131-T171 VanDerWaalsContact O-CG2 3.23Å; E131-T171 WeakPolarHBondContact O-CG2 3.46Å; E131-T171 PolarHBondContact O-OG1 3.4Å; A133-T171 HydrophobicContact CB-CG2 4.12Å; A133-T171 PolarHBondContact N-OG1 2.97Å; A133-T171 PolarHBondContact O-N 3.19Å; A133-T171 PolarHBondContact O-OG1 3.45Å; Y135-T171 HydrophobicContact CE2-CG2 4.48Å; T171-A173 PolarHBondContact O-N 2.63Å; T171-L174 PolarHBondContact O-N 3.44Å; T171-L174 VanDerWaalsContact O-N 3.13Å; T171-L174 WeakPolarHBondContact OG1-CB 3.34Å; T171-L174 PolarHBondContact OG1-N 3.09Å; T171-L175 PolarHBondContact O-N 2.93Å
172	G	92.9	Very high	93.3	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-64.7	-25.1	177.1	0	0	0	0	0	113.1	T102 E103 I105 R176	T102-G172 WeakPolarHBondContact O-CA 3.48Å; E103-G172 PolarHBondContact O-N 2.7Å; I105-G172 VanDerWaalsContact CD1-CA 3.45Å; G172-R176 WeakPolarHBondContact O-CB 2.95Å; G172-R176 WeakPolarHBondContact O-CG 3.44Å; G172-R176 PolarHBondContact O-N 3.25Å; G172-R176 PolarHBondContact O-NE 2.95Å
173	A	91.9	Very high	92.5	Very high	23 Å²	23	16.4 Å²	16.4	19%	0.19	8%	0.081	C	C	.	.	H	α-helix	trans	-63.6	-48.8	170.3	0	0	0	0	0	111.6	L132 T171 R177	L132-A173 HydrophobicContact CD2-CB 3.81Å; T171-A173 PolarHBondContact O-N 2.63Å; A173-R177 PolarHBondContact O-N 3.14Å
174	L	94.3	Very high	91.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.2	-48	178.9	178.6	59.6	0	0	0	111.7	L132 A133 F134 F170 T171 R176 R177 L178 I207 V211 I225	L132-L174 HydrophobicContact CB-CD1 4.48Å; L132-L174 HydrophobicContact CD2-CB 4.42Å; A133-L174 VanDerWaalsContact C-CD2 3.46Å; A133-L174 WeakPolarHBondContact O-CD2 2.97Å; F134-L174 HydrophobicContact CB-CD2 3.83Å; F134-L174 HydrophobicContact CD1-CD2 3.85Å; F134-L174 HydrophobicContact CG-CD2 4.16Å; F170-L174 HydrophobicContact CD1-CD2 4.09Å; T171-L174 PolarHBondContact O-N 3.44Å; T171-L174 VanDerWaalsContact O-N 3.13Å; T171-L174 WeakPolarHBondContact OG1-CB 3.34Å; T171-L174 PolarHBondContact OG1-N 3.09Å; L174-R176 VanDerWaalsContact C-N 3.33Å; L174-R176 PolarHBondContact O-N 3.2Å; L174-R177 WeakPolarHBondContact O-CB 3.41Å; L174-R177 PolarHBondContact O-N 3.43Å; L174-R177 VanDerWaalsContact O-N 3.09Å; L174-L178 HydrophobicContact CD1-CD1 4.31Å; L174-L178 HydrophobicContact CD1-CD2 4.44Å; L174-L178 HydrophobicContact CD1-CG 4.12Å; L174-L178 HydrophobicContact CG-CD1 4.09Å; L174-L178 HydrophobicContact CG-CG 4.33Å; L174-L178 WeakPolarHBondContact O-CG 3.32Å; L174-L178 PolarHBondContact O-N 2.04Å; L174-I207 HydrophobicContact CD1-CG2 4.47Å; L174-V211 HydrophobicContact CD1-CG1 4.03Å; L174-V211 HydrophobicContact CD1-CG2 4.34Å; L174-I225 HydrophobicContact CD1-CD1 4.04Å
175	L	91.8	Very high	89.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.9	-39.1	-175.2	-161.4	76.7	0	0	0	112.6	M84 L88 L91 L98 I105 F170 T171 R177 L178 A179	M84-L175 HydrophobicContact CE-CD1 3.73Å; L88-L175 HydrophobicContact CD2-CD1 3.67Å; L88-L175 HydrophobicContact CD2-CD2 4.41Å; L88-L175 HydrophobicContact CD2-CG 3.89Å; L91-L175 HydrophobicContact CD2-CD2 4.11Å; L98-L175 HydrophobicContact CD1-CD2 4.11Å; L98-L175 HydrophobicContact CD2-CD2 4.27Å; I105-L175 HydrophobicContact CB-CD2 3.82Å; I105-L175 HydrophobicContact CD1-CB 3.74Å; I105-L175 HydrophobicContact CD1-CD2 3.56Å; I105-L175 HydrophobicContact CD1-CG 4.29Å; I105-L175 HydrophobicContact CG1-CD2 3.42Å; I105-L175 VanDerWaalsContact CG1-CD2 3.42Å; I105-L175 HydrophobicContact CG2-CD2 3.82Å; F170-L175 HydrophobicContact CB-CB 4.3Å; F170-L175 HydrophobicContact CB-CD1 4.33Å; F170-L175 HydrophobicContact CD1-CD1 4.26Å; F170-L175 HydrophobicContact CD2-CD1 4.23Å; F170-L175 HydrophobicContact CG-CD1 4.01Å; T171-L175 PolarHBondContact O-N 2.93Å; L175-R177 VanDerWaalsContact C-N 3.33Å; L175-R177 PolarHBondContact O-N 3.49Å; L175-L178 PolarHBondContact O-N 2.99Å; L175-A179 WeakPolarHBondContact O-CB 3.46Å; L175-A179 PolarHBondContact O-N 3.13Å
176	R	88.8	Confident	88.2	Confident	95 Å²	95	28.1 Å²	28.1	36%	0.358	17%	0.165	S	C	.	.	H	α-helix	trans	-61.7	-42.9	173.7	-77.7	179.9	-73	164.2	-11.9	111.4	L98 G172 L174 L178 A179 D180	L98-R176 HydrophobicContact CD2-CG 4.21Å; L98-R176 HydrophobicContact CG-CG 4.29Å; G172-R176 WeakPolarHBondContact O-CB 2.95Å; G172-R176 WeakPolarHBondContact O-CG 3.44Å; G172-R176 PolarHBondContact O-N 3.25Å; G172-R176 PolarHBondContact O-NE 2.95Å; L174-R176 VanDerWaalsContact C-N 3.33Å; L174-R176 PolarHBondContact O-N 3.2Å; R176-L178 VanDerWaalsContact C-N 3.34Å; R176-L178 PolarHBondContact O-N 3.5Å; R176-A179 CarbonylContact O-C 3.45Å; R176-A179 WeakPolarHBondContact O-CB 3.38Å; R176-A179 PolarHBondContact O-N 2.88Å; R176-D180 PolarHBondContact O-N 3.02Å
177	R	89.2	Confident	86.6	Confident	75 Å²	75	36.1 Å²	36.1	28%	0.283	20%	0.202	S	C	.	.	H	α-helix	trans	-61.6	-42	175.8	-176.5	58.4	177.1	-136.9	1.8	112	A173 L174 L175 D180 L181 V211	A173-R177 PolarHBondContact O-N 3.14Å; L174-R177 WeakPolarHBondContact O-CB 3.41Å; L174-R177 PolarHBondContact O-N 3.43Å; L174-R177 VanDerWaalsContact O-N 3.09Å; L175-R177 VanDerWaalsContact C-N 3.33Å; L175-R177 PolarHBondContact O-N 3.49Å; R177-D180 WeakPolarHBondContact O-CB 3.41Å; R177-D180 PolarHBondContact O-N 2.95Å; R177-L181 HydrophobicContact CG-CD1 4.28Å; R177-L181 WeakPolarHBondContact O-CG 3.23Å; R177-L181 PolarHBondContact O-N 2.91Å; R177-V211 HydrophobicContact CG-CG1 4.35Å
178	L	91.1	Very high	85.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-43.9	175.3	-65.4	174.1	0	0	0	111.5	M84 L88 F170 L174 L175 R176 D180 L181 V182 F206 I207 V211	M84-L178 HydrophobicContact CE-CD1 4.13Å; L88-L178 HydrophobicContact CD1-CB 3.63Å; F170-L178 HydrophobicContact CE1-CD1 4.46Å; L174-L178 HydrophobicContact CD1-CD1 4.31Å; L174-L178 HydrophobicContact CD1-CD2 4.44Å; L174-L178 HydrophobicContact CD1-CG 4.12Å; L174-L178 HydrophobicContact CG-CD1 4.09Å; L174-L178 HydrophobicContact CG-CG 4.33Å; L174-L178 WeakPolarHBondContact O-CG 3.32Å; L174-L178 PolarHBondContact O-N 2.04Å; L175-L178 PolarHBondContact O-N 2.99Å; R176-L178 VanDerWaalsContact C-N 3.34Å; R176-L178 PolarHBondContact O-N 3.5Å; L178-D180 PolarHBondContact O-N 3.42Å; L178-L181 PolarHBondContact O-N 3.38Å; L178-L181 VanDerWaalsContact O-N 3.14Å; L178-V182 WeakPolarHBondContact O-CG2 3.45Å; L178-V182 PolarHBondContact O-N 3.5Å; L178-F206 HydrophobicContact CD2-CD1 4.12Å; L178-F206 HydrophobicContact CD2-CE1 4.06Å; L178-I207 HydrophobicContact CD1-CD1 4.04Å; L178-I207 HydrophobicContact CD1-CG1 3.9Å; L178-I207 HydrophobicContact CD2-CG1 3.77Å; L178-I207 HydrophobicContact CG-CG1 4.47Å; L178-V211 HydrophobicContact CD2-CG2 3.71Å
179	A	88.3	Confident	84.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.8	-27.1	174.8	0	0	0	0	0	113.5	R92 L175 R176	R92-A179 HydrophobicContact CB-CB 3.96Å; R92-A179 HydrophobicContact CG-CB 4.05Å; R92-A179 PolarHBondContact NH1-O 3.32Å; L175-A179 WeakPolarHBondContact O-CB 3.46Å; L175-A179 PolarHBondContact O-N 3.13Å; R176-A179 CarbonylContact O-C 3.45Å; R176-A179 WeakPolarHBondContact O-CB 3.38Å; R176-A179 PolarHBondContact O-N 2.88Å
180	D	85.5	Confident	83	Confident	72 Å²	72	49.8 Å²	49.8	39%	0.385	28%	0.277	S	S	.	.	H	α-helix	trans	-71.7	-43.7	171.4	-70.3	-47.3	0	0	0	111.1	R92 R176 R177 L178	R92-D180 IonicContact CZ-OD1 3.57Å; R92-D180 VanDerWaalsContact NH1-CG 3.32Å; R92-D180 IonicContact NH1-OD1 3.13Å; R92-D180 PolarHBondContact NH1-OD1 3.43Å; R92-D180 IonicContact NH2-OD1 2.73Å; R92-D180 PolarHBondContact NH2-OD1 2.9Å; R176-D180 PolarHBondContact O-N 3.02Å; R177-D180 WeakPolarHBondContact O-CB 3.41Å; R177-D180 PolarHBondContact O-N 2.95Å; L178-D180 PolarHBondContact O-N 3.42Å
181	L	87.9	Confident	82.1	Confident	24 Å²	24	53.5 Å²	53.5	13%	0.126	30%	0.299	C	S	.	.	H	α-helix	trans	-68.2	-40.9	-176.1	-71.7	169	0	0	0	112.7	R177 L178 A183 I189 F206 N210 V211	R177-L181 HydrophobicContact CG-CD1 4.28Å; R177-L181 WeakPolarHBondContact O-CG 3.23Å; R177-L181 PolarHBondContact O-N 2.91Å; L178-L181 PolarHBondContact O-N 3.38Å; L178-L181 VanDerWaalsContact O-N 3.14Å; L181-A183 VanDerWaalsContact C-N 3.33Å; L181-I189 HydrophobicContact CB-CG2 4.22Å; L181-I189 HydrophobicContact CD2-CG2 4.29Å; L181-I189 WeakPolarHBondContact O-CG2 3.39Å; L181-F206 HydrophobicContact CB-CE1 4.4Å; L181-F206 HydrophobicContact CB-CZ 4.28Å; L181-N210 HydrophobicContact CD1-CB 4.26Å; L181-V211 HydrophobicContact CD1-CG2 3.79Å
182	V	86	Confident	81.1	Confident	27 Å²	27	58.8 Å²	58.8	16%	0.164	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-0.2	-178.3	-59.8	0	0	0	0	113.7	L85 L88 P89 L178 F206	L85-V182 HydrophobicContact CD2-CG1 4.23Å; L88-V182 HydrophobicContact CB-CG2 3.64Å; L88-V182 HydrophobicContact CD1-CG2 4.15Å; P89-V182 HydrophobicContact CG-CG2 3.98Å; L178-V182 WeakPolarHBondContact O-CG2 3.45Å; L178-V182 PolarHBondContact O-N 3.5Å; V182-F206 HydrophobicContact CG1-CE1 3.79Å; V182-F206 HydrophobicContact CG1-CE2 4.29Å; V182-F206 HydrophobicContact CG1-CZ 3.53Å
183	A	80.9	Confident	80.8	Confident	11 Å²	11	60.1 Å²	60.1	9%	0.091	33%	0.334	C	S	.	.	S	Bend	trans	-65.5	154.7	174.9	0	0	0	0	0	110.5	L181 S185 G186	L181-A183 VanDerWaalsContact C-N 3.33Å; A183-S185 PolarHBondContact O-N 3.44Å; A183-G186 WeakPolarHBondContact O-CA 3.42Å; A183-G186 PolarHBondContact O-N 3.46Å
184	P	71.9	Confident	80.7	Confident	137 Å²	137	61.7 Å²	61.7	89%	0.89	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-23.3	176.9	-26.5	34.4	0	0	0	114.4	G186	P184-G186 VanDerWaalsContact C-N 3.34Å
185	S	64.7	Low	80.6	Confident	101 Å²	101	62.3 Å²	62.3	71%	0.706	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-3.6	175.2	56.6	0	0	0	0	114.3	A183 Q187	A183-S185 PolarHBondContact O-N 3.44Å; S185-Q187 PolarHBondContact O-N 2.87Å
186	G	62	Low	80.7	Confident	26 Å²	26	63 Å²	63	27%	0.268	35%	0.346	S	S	.	.			trans	-65.4	113.3	-178.7	0	0	0	0	0	110.7	A183 P184	A183-G186 WeakPolarHBondContact O-CA 3.42Å; A183-G186 PolarHBondContact O-N 3.46Å; P184-G186 VanDerWaalsContact C-N 3.34Å
187	Q	62.3	Low	81	Confident	167 Å²	167	59.3 Å²	59.3	78%	0.78	33%	0.333	S	S	*	.			trans	-99	148.9	173.9	-68	-178.3	-14.4	0	0	109.9	S185	S185-Q187 PolarHBondContact O-N 2.87Å
188	N	66.9	Low	81.2	Confident	156 Å²	156	56.7 Å²	56.7	83%	0.834	33%	0.325	S	S	*	.	S	Bend	trans	66.1	34.5	174.3	-54.9	-24.9	0	0	0	116
189	I	78.1	Confident	81.4	Confident	62 Å²	62	57.2 Å²	57.2	32%	0.318	33%	0.329	S	S	.	.			trans	-83.8	136.6	168.9	59.3	171.1	0	0	0	111.1	L181 V191 F206 N210	L181-I189 HydrophobicContact CB-CG2 4.22Å; L181-I189 HydrophobicContact CD2-CG2 4.29Å; L181-I189 WeakPolarHBondContact O-CG2 3.39Å; I189-V191 HydrophobicContact CD1-CG2 3.82Å; I189-V191 HydrophobicContact CG1-CG2 4.13Å; I189-F206 HydrophobicContact CB-CE2 4.49Å; I189-F206 HydrophobicContact CG2-CZ 4.38Å; I189-N210 WeakPolarHBondContact CA-OD1 3.38Å
190	T	75.5	Confident	81.8	Confident	69 Å²	69	57.8 Å²	57.8	42%	0.423	33%	0.333	S	S	.	.			trans	-88.7	109.4	169	-53.5	0	0	0	0	108.2	N210	T190-N210 PolarHBondContact N-OD1 3.31Å; T190-N210 PolarHBondContact O-ND2 3.07Å
191	V	77.7	Confident	82.3	Confident	78 Å²	78	54.9 Å²	54.9	47%	0.473	32%	0.317	S	S	.	.			trans	-110.1	120.6	169.5	-178	0	0	0	0	107	I189 S193	I189-V191 HydrophobicContact CD1-CG2 3.82Å; I189-V191 HydrophobicContact CG1-CG2 4.13Å; V191-S193 VanDerWaalsContact C-N 3.35Å; V191-S193 VanDerWaalsContact CG1-O 3.26Å; V191-S193 WeakPolarHBondContact CG1-O 3.38Å
192	H	76.3	Confident	82.6	Confident	112 Å²	112	55.7 Å²	55.7	52%	0.519	32%	0.32	S	S	.	.			trans	-80.6	-17.1	-174.1	-67.7	-71.6	0	0	0	113.9	D209	H192-D209 IonicContact CD2-OD2 3.42Å; H192-D209 PolarHBondContact CD2-OD2 3.37Å; H192-D209 IonicContact CE1-OD2 3.59Å; H192-D209 IonicContact NE2-OD2 3.81Å; H192-D209 PolarHBondContact NE2-OD2 3.16Å
193	S	85	Confident	83.1	Confident	28 Å²	28	54.5 Å²	54.5	20%	0.196	31%	0.313	C	S	.	.			trans	-157.7	142	-170.4	-173.2	0	0	0	0	110.7	V191 F195	V191-S193 VanDerWaalsContact C-N 3.35Å; V191-S193 VanDerWaalsContact CG1-O 3.26Å; V191-S193 WeakPolarHBondContact CG1-O 3.38Å; S193-F195 PolarHBondContact O-N 3.49Å; S193-F195 WeakPolarHBondContact OG-CB 3.46Å; S193-F195 PolarHBondContact OG-N 2.91Å
194	D	89.8	Confident	83.8	Confident	55 Å²	55	54 Å²	54	29%	0.294	31%	0.309	S	S	.	.	S	Bend	trans	-75	-8.8	165.8	-75.2	-34.8	0	0	0	112.2	Y398 R399 H401	D194-Y398 HydrophobicContact CB-CD2 4.06Å; D194-Y398 HydrophobicContact CB-CE2 3.62Å; D194-Y398 CarbonylContact O-C 3.56Å; D194-R399 HydrophobicContact CB-CG 3.74Å; D194-R399 PolarHBondContact O-N 2.92Å; D194-H401 IonicContact OD1-CE1 2.66Å
195	F	92.5	Very high	84.8	Confident	14 Å²	14	50.4 Å²	50.4	6%	0.061	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	140.6	-179.4	-62.1	-92.1	0	0	0	111.6	S193 I197 G397 Y398 Y408 M440 L540 L544	S193-F195 PolarHBondContact O-N 3.49Å; S193-F195 WeakPolarHBondContact OG-CB 3.46Å; S193-F195 PolarHBondContact OG-N 2.91Å; F195-I197 HydrophobicContact CB-CD1 4.2Å; F195-I197 HydrophobicContact CB-CG1 4.09Å; F195-G397 CarbonylContact C-O 3.49Å; F195-G397 VanDerWaalsContact CA-O 3.3Å; F195-G397 WeakPolarHBondContact CA-O 3.29Å; F195-Y398 AromaticContact CD1-CD2 3.97Å; F195-Y398 HydrophobicContact CD1-CD2 3.97Å; F195-Y398 HydrophobicContact CD2-CD2 4.45Å; F195-Y398 AromaticContact CE1-CD2 3.67Å; F195-Y398 HydrophobicContact CE1-CD2 3.67Å; F195-Y398 HydrophobicContact CE1-CE2 4.26Å; F195-Y398 HydrophobicContact CE2-CD2 4.16Å; F195-Y398 HydrophobicContact CE2-CE2 4.08Å; F195-Y398 HydrophobicContact CG-CD2 4.35Å; F195-Y398 AromaticContact CZ-CD2 3.76Å; F195-Y398 HydrophobicContact CZ-CD2 3.76Å; F195-Y398 AromaticContact CZ-CE2 3.87Å; F195-Y398 HydrophobicContact CZ-CE2 3.87Å; F195-Y408 HydrophobicContact CD1-CE1 4.39Å; F195-Y408 WeakPolarHBondContact CD1-OH 3.49Å; F195-M440 HydrophobicContact CE1-CE 3.67Å; F195-M440 HydrophobicContact CE1-SD 3.75Å; F195-M440 HydrophobicContact CZ-CE 4.06Å; F195-M440 HydrophobicContact CZ-SD 4.11Å; F195-L540 HydrophobicContact CD1-CD2 3.97Å; F195-L540 HydrophobicContact CD2-CD2 3.61Å; F195-L540 HydrophobicContact CE1-CD2 4.01Å; F195-L540 HydrophobicContact CE2-CB 4.39Å; F195-L540 HydrophobicContact CE2-CD2 3.68Å; F195-L540 HydrophobicContact CG-CD2 3.77Å; F195-L540 HydrophobicContact CZ-CD2 3.88Å; F195-L544 HydrophobicContact CZ-CD1 4.46Å
196	S	94.1	Very high	86.2	Confident	13 Å²	13	46.5 Å²	46.5	9%	0.091	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	114.3	165.2	-58.5	0	0	0	0	109	E202 Y396 G397 L400	S196-E202 WeakPolarHBondContact CA-OE1 3.42Å; S196-Y396 CarbonylContact O-C 3.58Å; S196-Y396 VanDerWaalsContact O-CA 3.29Å; S196-Y396 WeakPolarHBondContact O-CA 3.39Å; S196-Y396 WeakPolarHBondContact O-CB 3.34Å; S196-G397 PolarHBondContact N-O 3.12Å; S196-G397 PolarHBondContact O-N 3.28Å; S196-L400 WeakPolarHBondContact OG-CD1 3.4Å
197	I	94.5	Very high	87.7	Confident	18 Å²	18	45.2 Å²	45.2	9%	0.092	24%	0.235	C	C	.	.	S	Bend	trans	-121	-56.3	-170.3	-64.9	179.6	0	0	0	109.9	I147 F195 E202 Y396	I147-I197 HydrophobicContact CB-CG2 4.05Å; I147-I197 WeakPolarHBondContact O-CG2 3.5Å; F195-I197 HydrophobicContact CB-CD1 4.2Å; F195-I197 HydrophobicContact CB-CG1 4.09Å; I197-E202 WeakPolarHBondContact CA-OE1 3.4Å; I197-E202 PolarHBondContact N-OE1 2.87Å; I197-Y396 HydrophobicContact CB-CD1 4.49Å; I197-Y396 HydrophobicContact CB-CE1 4.25Å; I197-Y396 HydrophobicContact CB-CE2 4.25Å; I197-Y396 HydrophobicContact CD1-CD2 4.37Å; I197-Y396 HydrophobicContact CD1-CE2 4.03Å; I197-Y396 HydrophobicContact CG1-CD1 4.49Å; I197-Y396 HydrophobicContact CG1-CD2 3.73Å; I197-Y396 HydrophobicContact CG1-CE1 4.46Å; I197-Y396 HydrophobicContact CG1-CE2 3.67Å; I197-Y396 HydrophobicContact CG1-CG 4.18Å; I197-Y396 HydrophobicContact CG2-CD1 4.48Å; I197-Y396 HydrophobicContact CG2-CE1 3.76Å; I197-Y396 HydrophobicContact CG2-CE2 3.95Å; I197-Y396 VanDerWaalsContact CG2-CZ 3.47Å; I197-Y396 WeakPolarHBondContact CG2-OH 3.31Å
198	D	95	Very high	89.2	Confident	21 Å²	21	40.1 Å²	40.1	11%	0.112	21%	0.21	C	C	.	.			trans	-130.1	96.7	177.5	-172.4	-26.5	0	0	0	109.5	H148 S200 H201 E202	H148-D198 IonicContact CE1-OD2 2.66Å; H148-D198 IonicContact NE2-OD2 3.71Å; H148-D198 PolarHBondContact NE2-OD2 3.17Å; H148-D198 VanDerWaalsContact NE2-OD2 3.13Å; D198-S200 PolarHBondContact O-N 2.88Å; D198-S200 VanDerWaalsContact O-N 3.08Å; D198-S200 WeakPolarHBondContact OD1-CA 3.3Å; D198-S200 WeakPolarHBondContact OD1-CB 3.49Å; D198-S200 PolarHBondContact OD1-N 3.48Å; D198-S200 PolarHBondContact OD1-OG 2.87Å; D198-H201 HydrophobicContact CB-CB 4.28Å; D198-H201 PolarHBondContact O-N 3.33Å; D198-H201 PolarHBondContact OD1-N 3.45Å; D198-E202 PolarHBondContact N-OE1 2.8Å; D198-E202 VanDerWaalsContact O-CB 3.28Å; D198-E202 WeakPolarHBondContact O-CB 3.4Å; D198-E202 VanDerWaalsContact O-CG 3.24Å; D198-E202 WeakPolarHBondContact O-CG 3.45Å; D198-E202 PolarHBondContact O-N 3.01Å
199	A	94.6	Very high	90.3	Very high	11 Å²	11	34.1 Å²	34.1	9%	0.091	18%	0.178	C	C	.	.	H	α-helix	trans	-57.6	-25.5	-179.7	0	0	0	0	0	113.6	W82 T83 L164 L203	W82-A199 HydrophobicContact CE3-CB 4.15Å; W82-A199 HydrophobicContact CH2-CB 4.34Å; W82-A199 HydrophobicContact CZ3-CB 3.59Å; T83-A199 HydrophobicContact CG2-CB 4.16Å; L164-A199 HydrophobicContact CD1-CB 4.05Å; A199-L203 WeakPolarHBondContact O-CB 3.48Å; A199-L203 PolarHBondContact O-N 2.99Å; A199-L203 VanDerWaalsContact O-N 3.13Å
200	S	96.2	Very high	90.9	Very high	11 Å²	11	31.5 Å²	31.5	8%	0.077	17%	0.165	C	C	.	.	H	α-helix	trans	-71.7	-53.6	178.7	-51.2	0	0	0	0	110.6	P162 L164 D198 A204	P162-S200 WeakPolarHBondContact O-CB 3.29Å; P162-S200 PolarHBondContact O-OG 3.38Å; L164-S200 WeakPolarHBondContact CG-OG 3.28Å; D198-S200 PolarHBondContact O-N 2.88Å; D198-S200 VanDerWaalsContact O-N 3.08Å; D198-S200 WeakPolarHBondContact OD1-CA 3.3Å; D198-S200 WeakPolarHBondContact OD1-CB 3.49Å; D198-S200 PolarHBondContact OD1-N 3.48Å; D198-S200 PolarHBondContact OD1-OG 2.87Å; S200-A204 PolarHBondContact O-N 3.03Å
201	H	96.1	Very high	91.6	Very high	11 Å²	11	28.3 Å²	28.3	5%	0.051	15%	0.146	C	C	.	.	H	α-helix	trans	-68.2	-41	179.3	-179.4	-82.7	0	0	0	111.5	H148 S151 F159 Y161 D198 L203 A204 R205	H148-H201 VanDerWaalsContact CD2-CB 3.45Å; H148-H201 WeakPolarHBondContact CD2-CB 3.44Å; H148-H201 AromaticContact CD2-CD2 3.84Å; H148-H201 AromaticContact CD2-CG 3.38Å; H148-H201 AromaticContact CD2-ND1 3.74Å; H148-H201 AromaticContact CE1-CD2 3.75Å; H148-H201 AromaticContact CE1-CG 3.85Å; H148-H201 AromaticContact CG-CD2 3.52Å; H148-H201 AromaticContact CG-CE1 3.98Å; H148-H201 AromaticContact CG-CG 3.53Å; H148-H201 AromaticContact CG-ND1 3.81Å; H148-H201 AromaticContact CG-NE2 3.85Å; H148-H201 AromaticContact ND1-CD2 3.44Å; H148-H201 PolarHBondContact ND1-CD2 3.25Å; H148-H201 AromaticContact ND1-CG 3.79Å; H148-H201 VanDerWaalsContact NE2-CB 3.26Å; H148-H201 WeakPolarHBondContact NE2-CB 3.42Å; H148-H201 AromaticContact NE2-CD2 3.99Å; H148-H201 AromaticContact NE2-CG 3.61Å; S151-H201 PolarHBondContact OG-CE1 2.73Å; S151-H201 PolarHBondContact OG-NE2 3.17Å; F159-H201 AromaticContact CD1-NE2 3.78Å; Y161-H201 HydrophobicContact CD1-CB 4.49Å; Y161-H201 AromaticContact CD1-CD2 3.85Å; Y161-H201 HydrophobicContact CD2-CB 4.42Å; Y161-H201 HydrophobicContact CG-CB 4.2Å; D198-H201 HydrophobicContact CB-CB 4.28Å; D198-H201 PolarHBondContact O-N 3.33Å; D198-H201 PolarHBondContact OD1-N 3.45Å; H201-L203 PolarHBondContact O-N 3.35Å; H201-A204 PolarHBondContact O-N 3.48Å; H201-R205 VanDerWaalsContact O-CB 3.24Å; H201-R205 WeakPolarHBondContact O-CB 3.24Å; H201-R205 PolarHBondContact O-N 2.85Å
202	E	94.7	Very high	92	Very high	42 Å²	42	25.3 Å²	25.3	20%	0.196	13%	0.128	C	C	.	.	H	α-helix	trans	-59.6	-44.4	176.6	-76	159.9	-159.1	0	0	112.5	S196 I197 D198 R205 F206	S196-E202 WeakPolarHBondContact CA-OE1 3.42Å; I197-E202 WeakPolarHBondContact CA-OE1 3.4Å; I197-E202 PolarHBondContact N-OE1 2.87Å; D198-E202 PolarHBondContact N-OE1 2.8Å; D198-E202 VanDerWaalsContact O-CB 3.28Å; D198-E202 WeakPolarHBondContact O-CB 3.4Å; D198-E202 VanDerWaalsContact O-CG 3.24Å; D198-E202 WeakPolarHBondContact O-CG 3.45Å; D198-E202 PolarHBondContact O-N 3.01Å; E202-R205 PolarHBondContact O-N 3.34Å; E202-F206 VanDerWaalsContact O-CB 3.24Å; E202-F206 WeakPolarHBondContact O-CB 3.14Å; E202-F206 PolarHBondContact O-N 2.94Å
203	L	95.2	Very high	92.4	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.01	13%	0.126	C	C	.	.	H	α-helix	trans	-59.4	-51.7	175.1	170	65.9	0	0	0	111.4	M84 L85 P162 L164 F170 A199 H201 R205 F206 I207	M84-L203 HydrophobicContact CB-CD1 4.5Å; M84-L203 HydrophobicContact CE-CD1 3.45Å; M84-L203 VanDerWaalsContact CE-CD1 3.45Å; M84-L203 HydrophobicContact CE-CD2 4.32Å; M84-L203 HydrophobicContact SD-CD1 4.01Å; M84-L203 HydrophobicContact SD-CD2 3.86Å; L85-L203 HydrophobicContact CD2-CD1 4Å; L85-L203 HydrophobicContact CG-CD1 4.43Å; P162-L203 HydrophobicContact CG-CD2 4.24Å; L164-L203 HydrophobicContact CD2-CD2 4.07Å; F170-L203 HydrophobicContact CZ-CD2 3.98Å; A199-L203 WeakPolarHBondContact O-CB 3.48Å; A199-L203 PolarHBondContact O-N 2.99Å; A199-L203 VanDerWaalsContact O-N 3.13Å; H201-L203 PolarHBondContact O-N 3.35Å; L203-R205 VanDerWaalsContact C-N 3.29Å; L203-R205 PolarHBondContact O-N 2.96Å; L203-F206 PolarHBondContact O-N 2.77Å; L203-I207 HydrophobicContact CD1-CD1 3.78Å; L203-I207 HydrophobicContact CD1-CG1 4.31Å; L203-I207 HydrophobicContact CG-CD1 4.02Å; L203-I207 VanDerWaalsContact O-CG1 3.3Å; L203-I207 WeakPolarHBondContact O-CG1 3.2Å; L203-I207 PolarHBondContact O-N 2.86Å
204	A	96.4	Very high	92.1	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-60.8	-42.6	-179.2	0	0	0	0	0	111.1	F159 S200 H201 I207 F208	F159-A204 HydrophobicContact CE1-CB 3.83Å; F159-A204 HydrophobicContact CZ-CB 4.12Å; S200-A204 PolarHBondContact O-N 3.03Å; H201-A204 PolarHBondContact O-N 3.48Å; A204-I207 PolarHBondContact O-N 2.87Å; A204-F208 WeakPolarHBondContact O-CB 3.48Å; A204-F208 PolarHBondContact O-N 3Å
205	R	93.8	Very high	91.1	Very high	60 Å²	60	26.7 Å²	26.7	23%	0.226	15%	0.145	C	C	.	.	H	α-helix	trans	-66.7	-44	179.3	-171.4	61.4	-173.3	-89.5	-9.3	112.3	S151 F159 H201 E202 L203 I207 F208 D209	S151-R205 VanDerWaalsContact CB-NH1 3.35Å; F159-R205 HydrophobicContact CE1-CB 4.26Å; F159-R205 HydrophobicContact CZ-CB 4.23Å; H201-R205 VanDerWaalsContact O-CB 3.24Å; H201-R205 WeakPolarHBondContact O-CB 3.24Å; H201-R205 PolarHBondContact O-N 2.85Å; E202-R205 PolarHBondContact O-N 3.34Å; L203-R205 VanDerWaalsContact C-N 3.29Å; L203-R205 PolarHBondContact O-N 2.96Å; R205-I207 VanDerWaalsContact C-N 3.33Å; R205-I207 PolarHBondContact O-N 2.83Å; R205-F208 PolarHBondContact O-N 2.99Å; R205-D209 VanDerWaalsContact CD-OD2 3.31Å; R205-D209 WeakPolarHBondContact CD-OD2 3.26Å; R205-D209 WeakPolarHBondContact CG-OD2 3.47Å; R205-D209 IonicContact CZ-OD2 3.05Å; R205-D209 IonicContact NE-OD1 3.8Å; R205-D209 PolarHBondContact NE-OD1 2.96Å; R205-D209 IonicContact NE-OD2 3.05Å; R205-D209 PolarHBondContact NE-OD2 3.25Å; R205-D209 IonicContact NH2-OD2 3.81Å; R205-D209 PolarHBondContact O-N 2.96Å
206	F	93	Very high	90.1	Very high	19 Å²	19	34.1 Å²	34.1	8%	0.083	18%	0.18	C	C	.	.	H	α-helix	trans	-58.5	-46	176.3	-177.3	-87.9	0	0	0	111.5	L85 L178 L181 V182 I189 E202 L203 D209 N210	L85-F206 HydrophobicContact CD1-CB 3.65Å; L85-F206 HydrophobicContact CD1-CD1 4.3Å; L85-F206 HydrophobicContact CD1-CD2 4Å; L85-F206 HydrophobicContact CD1-CG 3.72Å; L85-F206 HydrophobicContact CD2-CB 4.27Å; L85-F206 HydrophobicContact CD2-CD1 3.58Å; L85-F206 HydrophobicContact CD2-CE1 4.06Å; L85-F206 HydrophobicContact CD2-CG 3.89Å; L85-F206 HydrophobicContact CG-CG 4.49Å; L178-F206 HydrophobicContact CD2-CD1 4.12Å; L178-F206 HydrophobicContact CD2-CE1 4.06Å; L181-F206 HydrophobicContact CB-CE1 4.4Å; L181-F206 HydrophobicContact CB-CZ 4.28Å; V182-F206 HydrophobicContact CG1-CE1 3.79Å; V182-F206 HydrophobicContact CG1-CE2 4.29Å; V182-F206 HydrophobicContact CG1-CZ 3.53Å; I189-F206 HydrophobicContact CB-CE2 4.49Å; I189-F206 HydrophobicContact CG2-CZ 4.38Å; E202-F206 VanDerWaalsContact O-CB 3.24Å; E202-F206 WeakPolarHBondContact O-CB 3.14Å; E202-F206 PolarHBondContact O-N 2.94Å; L203-F206 PolarHBondContact O-N 2.77Å; F206-D209 PolarHBondContact O-N 2.93Å; F206-N210 WeakPolarHBondContact CD2-ND2 3.22Å; F206-N210 HydrophobicContact CE1-CB 4.3Å; F206-N210 HydrophobicContact CZ-CB 4.34Å; F206-N210 VanDerWaalsContact O-CB 3.26Å; F206-N210 WeakPolarHBondContact O-CB 3.45Å; F206-N210 PolarHBondContact O-N 3.17Å; F206-N210 PolarHBondContact O-ND2 2.83Å
207	I	94.3	Very high	88.8	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.9	-47.6	176.7	-67.6	164.7	0	0	0	110.6	F134 F170 L174 L178 L203 A204 R205 D209 V211 I225	F134-I207 HydrophobicContact CD1-CD1 4.12Å; F134-I207 HydrophobicContact CD1-CG2 4.28Å; F134-I207 HydrophobicContact CD2-CD1 4.04Å; F134-I207 HydrophobicContact CE1-CB 4.39Å; F134-I207 HydrophobicContact CE1-CD1 3.96Å; F134-I207 HydrophobicContact CE1-CG2 3.75Å; F134-I207 HydrophobicContact CE2-CD1 3.85Å; F134-I207 HydrophobicContact CG-CD1 4.18Å; F134-I207 HydrophobicContact CZ-CB 4.5Å; F134-I207 HydrophobicContact CZ-CD1 3.82Å; F134-I207 HydrophobicContact CZ-CG2 4.33Å; F170-I207 HydrophobicContact CE1-CD1 4.15Å; L174-I207 HydrophobicContact CD1-CG2 4.47Å; L178-I207 HydrophobicContact CD1-CD1 4.04Å; L178-I207 HydrophobicContact CD1-CG1 3.9Å; L178-I207 HydrophobicContact CD2-CG1 3.77Å; L178-I207 HydrophobicContact CG-CG1 4.47Å; L203-I207 HydrophobicContact CD1-CD1 3.78Å; L203-I207 HydrophobicContact CD1-CG1 4.31Å; L203-I207 HydrophobicContact CG-CD1 4.02Å; L203-I207 VanDerWaalsContact O-CG1 3.3Å; L203-I207 WeakPolarHBondContact O-CG1 3.2Å; L203-I207 PolarHBondContact O-N 2.86Å; A204-I207 PolarHBondContact O-N 2.87Å; R205-I207 VanDerWaalsContact C-N 3.33Å; R205-I207 PolarHBondContact O-N 2.83Å; I207-D209 PolarHBondContact O-N 3.33Å; I207-V211 HydrophobicContact CG2-CG2 4.42Å; I207-V211 WeakPolarHBondContact O-CB 3.22Å; I207-V211 PolarHBondContact O-N 3.36Å; I207-I225 HydrophobicContact CG2-CB 3.87Å; I207-I225 HydrophobicContact CG2-CG2 4.26Å
208	F	93.4	Very high	87.2	Confident	59 Å²	59	39.5 Å²	39.5	26%	0.259	21%	0.214	S	C	.	.	H	α-helix	trans	-62.2	-42.7	-178.6	-178.2	-97.8	0	0	0	112.3	F159 A204 R205 G224 L226	F159-F208 HydrophobicContact CE2-CB 3.84Å; F159-F208 HydrophobicContact CE2-CD1 4.1Å; F159-F208 HydrophobicContact CE2-CD2 4.14Å; F159-F208 AromaticContact CE2-CG 3.76Å; F159-F208 HydrophobicContact CE2-CG 3.76Å; F159-F208 HydrophobicContact CZ-CB 4.01Å; F159-F208 HydrophobicContact CZ-CG 4.42Å; A204-F208 WeakPolarHBondContact O-CB 3.48Å; A204-F208 PolarHBondContact O-N 3Å; R205-F208 PolarHBondContact O-N 2.99Å; F208-G224 VanDerWaalsContact CD2-CA 3.49Å; F208-G224 WeakPolarHBondContact O-CA 3.41Å; F208-L226 HydrophobicContact CD2-CD2 3.51Å; F208-L226 HydrophobicContact CD2-CG 4.03Å; F208-L226 HydrophobicContact CE2-CD2 3.79Å; F208-L226 HydrophobicContact CE2-CG 4.13Å; F208-L226 HydrophobicContact CG-CD2 4.43Å
209	D	90.4	Very high	85.4	Confident	31 Å²	31	42.3 Å²	42.3	17%	0.166	23%	0.232	C	C	.	.	H	α-helix	trans	-82.5	-25.3	-175.5	-65.2	-39.3	0	0	0	113.6	H192 R205 F206 I207 P220	H192-D209 IonicContact CD2-OD2 3.42Å; H192-D209 PolarHBondContact CD2-OD2 3.37Å; H192-D209 IonicContact CE1-OD2 3.59Å; H192-D209 IonicContact NE2-OD2 3.81Å; H192-D209 PolarHBondContact NE2-OD2 3.16Å; R205-D209 VanDerWaalsContact CD-OD2 3.31Å; R205-D209 WeakPolarHBondContact CD-OD2 3.26Å; R205-D209 WeakPolarHBondContact CG-OD2 3.47Å; R205-D209 IonicContact CZ-OD2 3.05Å; R205-D209 IonicContact NE-OD1 3.8Å; R205-D209 PolarHBondContact NE-OD1 2.96Å; R205-D209 IonicContact NE-OD2 3.05Å; R205-D209 PolarHBondContact NE-OD2 3.25Å; R205-D209 IonicContact NH2-OD2 3.81Å; R205-D209 PolarHBondContact O-N 2.96Å; F206-D209 PolarHBondContact O-N 2.93Å; I207-D209 PolarHBondContact O-N 3.33Å; D209-P220 WeakPolarHBondContact O-CB 3.43Å; D209-P220 WeakPolarHBondContact O-CG 3.37Å
210	N	90.4	Very high	83.5	Confident	7 Å²	7	44.9 Å²	44.9	4%	0.037	25%	0.248	C	C	.	.	H	α-helix	trans	-111.6	-10.5	-170.9	-65.2	-78.5	0	0	0	114.9	L181 I189 T190 F206	L181-N210 HydrophobicContact CD1-CB 4.26Å; I189-N210 WeakPolarHBondContact CA-OD1 3.38Å; T190-N210 PolarHBondContact N-OD1 3.31Å; T190-N210 PolarHBondContact O-ND2 3.07Å; F206-N210 WeakPolarHBondContact CD2-ND2 3.22Å; F206-N210 HydrophobicContact CE1-CB 4.3Å; F206-N210 HydrophobicContact CZ-CB 4.34Å; F206-N210 VanDerWaalsContact O-CB 3.26Å; F206-N210 WeakPolarHBondContact O-CB 3.45Å; F206-N210 PolarHBondContact O-N 3.17Å; F206-N210 PolarHBondContact O-ND2 2.83Å
211	V	90.2	Very high	81.4	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.012	28%	0.275	C	S	.	.			trans	-118.5	116.3	-177.1	-165.9	0	0	0	0	111	L132 L174 R177 L178 L181 I207 I225	L132-V211 HydrophobicContact CD1-CG1 4.18Å; L174-V211 HydrophobicContact CD1-CG1 4.03Å; L174-V211 HydrophobicContact CD1-CG2 4.34Å; R177-V211 HydrophobicContact CG-CG1 4.35Å; L178-V211 HydrophobicContact CD2-CG2 3.71Å; L181-V211 HydrophobicContact CD1-CG2 3.79Å; I207-V211 HydrophobicContact CG2-CG2 4.42Å; I207-V211 WeakPolarHBondContact O-CB 3.22Å; I207-V211 PolarHBondContact O-N 3.36Å; V211-I225 HydrophobicContact CB-CD1 3.96Å; V211-I225 HydrophobicContact CG1-CD1 3.44Å; V211-I225 VanDerWaalsContact CG1-CD1 3.44Å; V211-I225 HydrophobicContact CG1-CG1 4.47Å
212	S	86.7	Confident	79.5	Confident	15 Å²	15	55.6 Å²	55.6	11%	0.105	31%	0.313	C	S	.	.			trans	-68.5	136.3	169.3	177.3	0	0	0	0	110.5	L132 D214 I217	L132-S212 WeakPolarHBondContact CD1-O 3.12Å; S212-D214 PolarHBondContact O-N 2.68Å; S212-D214 PolarHBondContact OG-N 2.98Å; S212-D214 VanDerWaalsContact OG-N 3.17Å; S212-D214 PolarHBondContact OG-O 2.87Å; S212-I217 WeakPolarHBondContact CB-O 3.49Å
213	P	83	Confident	78.1	Confident	74 Å²	74	55.9 Å²	55.9	48%	0.481	33%	0.327	S	S	.	.	S	Bend	trans	-62.4	-28.7	169.9	-20.3	31.5	0	0	0	112.8	P215 G223 I225	P213-P215 WeakPolarHBondContact O-CD 3.35Å; P213-G223 WeakPolarHBondContact CD-O 3.2Å; P213-G223 WeakPolarHBondContact CG-O 3.37Å; P213-I225 HydrophobicContact CB-CG1 4.47Å; P213-I225 HydrophobicContact CG-CG1 4.33Å
214	D	79.2	Confident	77.7	Confident	66 Å²	66	56.4 Å²	56.4	35%	0.353	33%	0.333	S	S	.	.	S	Bend	trans	-81.2	113.9	173.4	-173.7	-18.7	0	0	0	109.7	S212 H216 I217	S212-D214 PolarHBondContact O-N 2.68Å; S212-D214 PolarHBondContact OG-N 2.98Å; S212-D214 VanDerWaalsContact OG-N 3.17Å; S212-D214 PolarHBondContact OG-O 2.87Å; D214-H216 PolarHBondContact O-N 3.23Å; D214-H216 VanDerWaalsContact O-N 3.16Å; D214-H216 WeakPolarHBondContact OD1-CB 3.49Å; D214-H216 IonicContact OD1-CD2 3.57Å; D214-H216 IonicContact OD1-CG 3.81Å; D214-H216 PolarHBondContact OD1-N 3.08Å; D214-I217 HydrophobicContact CB-CB 4.14Å; D214-I217 HydrophobicContact CB-CD1 3.81Å; D214-I217 HydrophobicContact CB-CG1 3.91Å; D214-I217 PolarHBondContact O-N 3.29Å; D214-I217 VanDerWaalsContact O-N 3.09Å; D214-I217 WeakPolarHBondContact OD2-CD1 3.35Å
215	P	68.9	Low	77.6	Confident	83 Å²	83	56.9 Å²	56.9	54%	0.539	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-16.3	-179.3	27.6	-34.7	0	0	0	113.7	L132 P213	L132-P215 HydrophobicContact CD1-CB 4.27Å; P213-P215 WeakPolarHBondContact O-CD 3.35Å
216	H	71.8	Confident	77.7	Confident	170 Å²	170	57.7 Å²	57.7	79%	0.787	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-11.8	176.9	-60.9	-65.2	0	0	0	113.4	D214	D214-H216 PolarHBondContact O-N 3.23Å; D214-H216 VanDerWaalsContact O-N 3.16Å; D214-H216 WeakPolarHBondContact OD1-CB 3.49Å; D214-H216 IonicContact OD1-CD2 3.57Å; D214-H216 IonicContact OD1-CG 3.81Å; D214-H216 PolarHBondContact OD1-N 3.08Å
217	I	67	Low	77.9	Confident	56 Å²	56	57.3 Å²	57.3	29%	0.287	34%	0.343	S	S	.	.			trans	-103.1	117.1	-179.2	-60.2	178.2	0	0	0	108.7	S212 D214 T219 I221	S212-I217 WeakPolarHBondContact CB-O 3.49Å; D214-I217 HydrophobicContact CB-CB 4.14Å; D214-I217 HydrophobicContact CB-CD1 3.81Å; D214-I217 HydrophobicContact CB-CG1 3.91Å; D214-I217 PolarHBondContact O-N 3.29Å; D214-I217 VanDerWaalsContact O-N 3.09Å; D214-I217 WeakPolarHBondContact OD2-CD1 3.35Å; I217-T219 WeakPolarHBondContact CG2-O 3.25Å; I217-I221 HydrophobicContact CG2-CD1 3.92Å; I217-I221 HydrophobicContact CG2-CG1 4.34Å
218	S	60.3	Low	78.1	Confident	89 Å²	89	60.7 Å²	60.7	62%	0.622	36%	0.357	S	S	*	.	S	Bend	trans	-82.4	-18.2	-178.5	48.8	0	0	0	0	114.3
219	T	58.3	Low	78.2	Confident	80 Å²	80	61.9 Å²	61.9	49%	0.491	37%	0.373	S	S	.	.	S	Bend	trans	-109.8	130	-179.6	52.8	0	0	0	0	110.8	I217 I221	I217-T219 WeakPolarHBondContact CG2-O 3.25Å; T219-I221 PolarHBondContact O-N 3.36Å
220	P	54.9	Low	78.4	Confident	64 Å²	64	60.6 Å²	60.6	42%	0.416	37%	0.367	S	S	.	.			trans	-66.2	100.3	179.7	11.1	-8.8	0	0	0	110.8	D209 S222	D209-P220 WeakPolarHBondContact O-CB 3.43Å; D209-P220 WeakPolarHBondContact O-CG 3.37Å; P220-S222 PolarHBondContact O-N 3.37Å
221	I	51.4	Low	78.5	Confident	125 Å²	125	63.3 Å²	63.3	64%	0.641	39%	0.386	S	S	*	.			trans	-91.5	86.6	173.5	-57.9	166.6	0	0	0	106.8	I217 T219	I217-I221 HydrophobicContact CG2-CD1 3.92Å; I217-I221 HydrophobicContact CG2-CG1 4.34Å; T219-I221 PolarHBondContact O-N 3.36Å
222	S	55.2	Low	78.7	Confident	123 Å²	123	63.5 Å²	63.5	86%	0.86	39%	0.387	S	S	*	.	S	Bend	trans	44.9	98.5	170.8	-174.6	0	0	0	0	116.5	P220	P220-S222 PolarHBondContact O-N 3.37Å
223	G	66.9	Low	79.2	Confident	47 Å²	47	62.8 Å²	62.8	49%	0.485	38%	0.382	S	S	.	.			trans	119.8	93.4	172.6	0	0	0	0	0	111.2	P213	P213-G223 WeakPolarHBondContact CD-O 3.2Å; P213-G223 WeakPolarHBondContact CG-O 3.37Å
224	G	86.5	Confident	79.8	Confident	13 Å²	13	59.2 Å²	59.2	13%	0.134	36%	0.359	C	S	.	.			trans	-80.3	174.8	-178.6	0	0	0	0	0	115	F208 L226	F208-G224 VanDerWaalsContact CD2-CA 3.49Å; F208-G224 WeakPolarHBondContact O-CA 3.41Å; G224-L226 PolarHBondContact O-N 3.21Å
225	I	94.1	Very high	80.4	Confident	12 Å²	12	56.5 Å²	56.5	6%	0.062	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-74.4	123.4	171.2	-58.2	168.4	0	0	0	109	L132 F134 L174 I207 V211 P213	L132-I225 HydrophobicContact CB-CD1 3.39Å; L132-I225 HydrophobicContact CD1-CD1 4.29Å; L132-I225 HydrophobicContact CG-CD1 4.48Å; L132-I225 WeakPolarHBondContact O-CD1 3.34Å; F134-I225 HydrophobicContact CD1-CG2 4.02Å; F134-I225 HydrophobicContact CE1-CG2 3.95Å; L174-I225 HydrophobicContact CD1-CD1 4.04Å; I207-I225 HydrophobicContact CG2-CB 3.87Å; I207-I225 HydrophobicContact CG2-CG2 4.26Å; V211-I225 HydrophobicContact CB-CD1 3.96Å; V211-I225 HydrophobicContact CG1-CD1 3.44Å; V211-I225 VanDerWaalsContact CG1-CD1 3.44Å; V211-I225 HydrophobicContact CG1-CG1 4.47Å; P213-I225 HydrophobicContact CB-CG1 4.47Å; P213-I225 HydrophobicContact CG-CG1 4.33Å
226	L	95.6	Very high	81.4	Confident	77 Å²	77	53.5 Å²	53.5	40%	0.403	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-95.9	154.3	173.1	-68.5	173	0	0	0	111.3	F159 F208 G224 K228	F159-L226 HydrophobicContact CD2-CD2 3.96Å; F159-L226 HydrophobicContact CE2-CD2 3.8Å; F208-L226 HydrophobicContact CD2-CD2 3.51Å; F208-L226 HydrophobicContact CD2-CG 4.03Å; F208-L226 HydrophobicContact CE2-CD2 3.79Å; F208-L226 HydrophobicContact CE2-CG 4.13Å; F208-L226 HydrophobicContact CG-CD2 4.43Å; G224-L226 PolarHBondContact O-N 3.21Å; L226-K228 PolarHBondContact O-N 2.91Å
227	L	97.9	Very high	81.9	Confident	11 Å²	11	48.6 Å²	48.6	6%	0.058	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-60	130.2	172.8	177.2	70.6	0	0	0	110.4	F134 A138 P160 P162	F134-L227 HydrophobicContact CD2-CB 4.43Å; F134-L227 HydrophobicContact CD2-CD1 3.41Å; F134-L227 VanDerWaalsContact CD2-CD1 3.41Å; F134-L227 HydrophobicContact CE1-CB 4.4Å; F134-L227 HydrophobicContact CE2-CB 3.72Å; F134-L227 HydrophobicContact CE2-CD1 3.47Å; F134-L227 VanDerWaalsContact CE2-CD1 3.47Å; F134-L227 HydrophobicContact CE2-CG 4.18Å; F134-L227 HydrophobicContact CG-CD1 4.16Å; F134-L227 VanDerWaalsContact CZ-CA 3.49Å; F134-L227 HydrophobicContact CZ-CB 3.7Å; F134-L227 HydrophobicContact CZ-CD1 4.24Å; A138-L227 HydrophobicContact CB-CD2 3.88Å; P160-L227 HydrophobicContact CB-CB 4.23Å; P160-L227 HydrophobicContact CB-CD2 4.37Å; P160-L227 HydrophobicContact CG-CB 4.18Å; P162-L227 HydrophobicContact CB-CD1 4.1Å; P162-L227 HydrophobicContact CB-CD2 3.91Å
228	K	97.1	Very high	82.4	Confident	70 Å²	70	51.6 Å²	51.6	30%	0.304	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	116.8	170.3	-64.3	-176.2	179.3	-173	0	110.1	E131 A133 F134 Y135 G136 L226 A230	E131-K228 IonicContact OE1-NZ 2.97Å; E131-K228 PolarHBondContact OE1-NZ 3.41Å; E131-K228 IonicContact OE2-NZ 2.61Å; E131-K228 PolarHBondContact OE2-NZ 2.9Å; A133-K228 HydrophobicContact CB-CD 4.29Å; F134-K228 PolarHBondContact O-N 2.83Å; Y135-K228 VanDerWaalsContact CA-O 3.27Å; Y135-K228 WeakPolarHBondContact CA-O 3.47Å; Y135-K228 HydrophobicContact CD1-CB 3.6Å; Y135-K228 HydrophobicContact CD1-CD 4.06Å; Y135-K228 HydrophobicContact CD1-CG 4.46Å; Y135-K228 HydrophobicContact CE1-CB 3.95Å; Y135-K228 HydrophobicContact CE1-CD 3.5Å; Y135-K228 HydrophobicContact CE1-CG 4.36Å; Y135-K228 HydrophobicContact CG-CB 4.24Å; G136-K228 PolarHBondContact N-O 2.91Å; G136-K228 VanDerWaalsContact N-O 3.15Å; L226-K228 PolarHBondContact O-N 2.91Å; K228-A230 PolarHBondContact O-N 3.49Å
229	S	95.8	Very high	82.6	Confident	84 Å²	84	49.2 Å²	49.2	59%	0.587	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65	117.3	175.7	-172.7	0	0	0	0	110.7	G136	G136-S229 WeakPolarHBondContact O-CA 3.49Å
230	A	95.4	Very high	82.9	Confident	5 Å²	5	48.8 Å²	48.8	4%	0.041	31%	0.31	C	S	.	.			trans	-99.4	115.8	-178.6	0	0	0	0	0	111.1	G136 K228 Y232 I233	G136-A230 PolarHBondContact O-N 2.74Å; K228-A230 PolarHBondContact O-N 3.49Å; A230-Y232 HydrophobicContact CB-CD1 4.12Å; A230-Y232 HydrophobicContact CB-CE1 3.72Å; A230-Y232 HydrophobicContact CB-CE2 4.27Å; A230-Y232 PolarHBondContact O-N 3.15Å; A230-I233 HydrophobicContact CB-CB 4.21Å; A230-I233 HydrophobicContact CB-CD1 3.8Å; A230-I233 HydrophobicContact CB-CG1 3.76Å; A230-I233 PolarHBondContact O-N 3.06Å; A230-I233 VanDerWaalsContact O-O 3.14Å
231	S	93.1	Very high	83.1	Confident	63 Å²	63	51 Å²	51	44%	0.441	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-10.3	-178.3	63.2	0	0	0	0	114.7	R243	S231-R243 PolarHBondContact O-NE 3.11Å; S231-R243 PolarHBondContact O-NH2 3.28Å
232	Y	94.4	Very high	83.8	Confident	6 Å²	6	53 Å²	53	2%	0.024	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-3.5	174.3	60.9	-94.8	0	0	0	113.6	L120 Q123 A230 L248 L249	L120-Y232 HydrophobicContact CD1-CD2 4.05Å; L120-Y232 HydrophobicContact CD1-CE2 3.73Å; Q123-Y232 HydrophobicContact CB-CD1 4.04Å; Q123-Y232 HydrophobicContact CB-CE1 3.84Å; Q123-Y232 HydrophobicContact CB-CE2 4.44Å; Q123-Y232 HydrophobicContact CB-CG 4.43Å; Q123-Y232 HydrophobicContact CG-CD1 3.68Å; Q123-Y232 HydrophobicContact CG-CD2 4.37Å; Q123-Y232 HydrophobicContact CG-CE1 4.03Å; Q123-Y232 HydrophobicContact CG-CG 3.87Å; A230-Y232 HydrophobicContact CB-CD1 4.12Å; A230-Y232 HydrophobicContact CB-CE1 3.72Å; A230-Y232 HydrophobicContact CB-CE2 4.27Å; A230-Y232 PolarHBondContact O-N 3.15Å; Y232-L248 HydrophobicContact CD2-CB 4.35Å; Y232-L248 HydrophobicContact CD2-CD1 4.11Å; Y232-L248 HydrophobicContact CG-CD1 4.06Å; Y232-L248 PolarHBondContact O-N 2.98Å; Y232-L249 PolarHBondContact O-N 3.19Å
233	I	96.2	Very high	84.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126.4	174	-50.6	-176.7	0	0	0	107.8	H137 A166 V169 A230 L249	H137-I233 HydrophobicContact CB-CG2 4.03Å; H137-I233 PolarHBondContact ND1-O 2.79Å; A166-I233 HydrophobicContact CB-CG2 4Å; V169-I233 HydrophobicContact CG2-CD1 4.1Å; A230-I233 HydrophobicContact CB-CB 4.21Å; A230-I233 HydrophobicContact CB-CD1 3.8Å; A230-I233 HydrophobicContact CB-CG1 3.76Å; A230-I233 PolarHBondContact O-N 3.06Å; A230-I233 VanDerWaalsContact O-O 3.14Å; I233-L249 WeakPolarHBondContact CA-O 3.05Å; I233-L249 HydrophobicContact CB-CB 4.48Å; I233-L249 HydrophobicContact CD1-CD1 4.04Å; I233-L249 HydrophobicContact CG1-CB 4.19Å; I233-L249 HydrophobicContact CG1-CD1 4.15Å; I233-L249 HydrophobicContact CG2-CB 4.09Å
234	C	94.8	Very high	84.9	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.8	-168.4	-57.6	0	0	0	0	111.5	A166 R243 C247 L249 H250	A166-C234 VanDerWaalsContact CB-O 3.23Å; A166-C234 WeakPolarHBondContact CB-O 3.09Å; C234-R243 PolarHBondContact SG-NH1 3.17Å; C234-R243 PolarHBondContact SG-NH2 2.72Å; C234-R243 VanDerWaalsContact SG-NH2 3.44Å; C234-C247 HydrophobicContact CB-CB 3.73Å; C234-C247 WeakPolarHBondContact CB-SG 3.42Å; C234-C247 WeakPolarHBondContact SG-CA 3.39Å; C234-C247 WeakPolarHBondContact SG-CB 3.23Å; C234-C247 CovalentContact SG-SG 2.03Å; C234-C247 PolarHBondContact SG-SG 3.36Å; C234-L249 PolarHBondContact N-O 3.21Å; C234-H250 HydrophobicContact CB-CB 4.16Å; C234-H250 WeakPolarHBondContact O-CA 3.42Å; C234-H250 WeakPolarHBondContact O-CB 3.37Å
235	S	93.6	Very high	84.7	Confident	9 Å²	9	60.3 Å²	60.3	6%	0.063	34%	0.336	C	S	.	.	S	Bend	trans	-61.7	-47.7	171.9	52.7	0	0	0	0	111.8	M163 S239 A251	M163-S235 VanDerWaalsContact SD-CA 3.59Å; S235-S239 WeakPolarHBondContact OG-CB 3.36Å; S235-A251 VanDerWaalsContact O-CB 3.23Å; S235-A251 WeakPolarHBondContact O-CB 3.23Å; S235-A251 PolarHBondContact O-N 3.04Å
236	T	90.1	Very high	84.4	Confident	20 Å²	20	64 Å²	64	12%	0.123	36%	0.361	C	S	.	.	S	Bend	trans	-138.9	161.7	177.5	65.2	0	0	0	0	110.2	T238 S239 P253	T236-T238 PolarHBondContact O-N 3.44Å; T236-T238 VanDerWaalsContact O-N 3.16Å; T236-S239 WeakPolarHBondContact O-CB 3.43Å; T236-S239 PolarHBondContact O-N 3.14Å; T236-S239 PolarHBondContact O-OG 3.24Å; T236-S239 WeakPolarHBondContact OG1-CB 3.28Å; T236-S239 PolarHBondContact OG1-N 3.4Å; T236-P253 HydrophobicContact CG2-CG 4.2Å
237	P	82	Confident	84.2	Confident	67 Å²	67	61.3 Å²	61.3	44%	0.435	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-22.3	-178.4	23.4	-31.8	0	0	0	113.2	H250	P237-H250 WeakPolarHBondContact CD-ND1 3.47Å
238	T	75.9	Confident	84.2	Confident	119 Å²	119	61 Å²	61	73%	0.73	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	9.3	-178.1	52.4	0	0	0	0	113.8	T236 V240	T236-T238 PolarHBondContact O-N 3.44Å; T236-T238 VanDerWaalsContact O-N 3.16Å; T238-V240 PolarHBondContact O-N 2.8Å
239	S	65.7	Low	84.2	Confident	38 Å²	38	57.7 Å²	57.7	27%	0.266	33%	0.332	S	S	.	.	S	Bend	trans	-55.7	-20.4	-170	50	0	0	0	0	115.8	S235 T236 R243	S235-S239 WeakPolarHBondContact OG-CB 3.36Å; T236-S239 WeakPolarHBondContact O-CB 3.43Å; T236-S239 PolarHBondContact O-N 3.14Å; T236-S239 PolarHBondContact O-OG 3.24Å; T236-S239 WeakPolarHBondContact OG1-CB 3.28Å; T236-S239 PolarHBondContact OG1-N 3.4Å; S239-R243 PolarHBondContact OG-NH1 3.48Å
240	V	63.5	Low	84.2	Confident	72 Å²	72	54.3 Å²	54.3	44%	0.436	31%	0.307	S	S	.	.	S	Bend	trans	-143.7	113.9	179.9	-169.3	0	0	0	0	111.6	T238 R243	T238-V240 PolarHBondContact O-N 2.8Å; V240-R243 HydrophobicContact CB-CB 4.24Å; V240-R243 HydrophobicContact CB-CG 4.04Å; V240-R243 HydrophobicContact CG1-CB 4.46Å; V240-R243 HydrophobicContact CG1-CG 4.3Å
241	P	60.4	Low	84.2	Confident	110 Å²	110	54.1 Å²	54.1	71%	0.714	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	138.5	167.1	-17.1	29.5	0	0	0	110.5	R243	P241-R243 PolarHBondContact O-N 2.89Å
242	N	65.8	Low	84.1	Confident	166 Å²	166	53.9 Å²	53.9	89%	0.888	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	31.9	178.5	-58.5	-26.4	0	0	0	116	K244	N242-K244 PolarHBondContact O-N 3.34Å
243	R	71.7	Confident	83.7	Confident	73 Å²	73	55.4 Å²	55.4	28%	0.275	31%	0.308	S	S	.	.			trans	-64.6	131.7	177.4	-144.4	179.6	168.8	132.3	-4.1	111	S231 C234 S239 V240 P241 L245	S231-R243 PolarHBondContact O-NE 3.11Å; S231-R243 PolarHBondContact O-NH2 3.28Å; C234-R243 PolarHBondContact SG-NH1 3.17Å; C234-R243 PolarHBondContact SG-NH2 2.72Å; C234-R243 VanDerWaalsContact SG-NH2 3.44Å; S239-R243 PolarHBondContact OG-NH1 3.48Å; V240-R243 HydrophobicContact CB-CB 4.24Å; V240-R243 HydrophobicContact CB-CG 4.04Å; V240-R243 HydrophobicContact CG1-CB 4.46Å; V240-R243 HydrophobicContact CG1-CG 4.3Å; P241-R243 PolarHBondContact O-N 2.89Å; R243-L245 VanDerWaalsContact C-N 3.32Å; R243-L245 WeakPolarHBondContact CD-O 3.45Å; R243-L245 WeakPolarHBondContact CG-O 3.23Å; R243-L245 PolarHBondContact O-N 3.47Å
244	K	73.9	Confident	82.7	Confident	205 Å²	205	59 Å²	59	89%	0.891	32%	0.324	S	S	*	.	S	Bend	trans	-67.8	-29.9	178.8	-69.6	-174.7	179.9	-179	0	113.5	N242	N242-K244 PolarHBondContact O-N 3.34Å
245	L	81.5	Confident	81.3	Confident	59 Å²	59	65.8 Å²	65.8	31%	0.309	36%	0.356	S	S	.	.	S	Bend	trans	-117.9	141.4	176.5	-80.2	93.3	0	0	0	110.1	R243	R243-L245 VanDerWaalsContact C-N 3.32Å; R243-L245 WeakPolarHBondContact CD-O 3.45Å; R243-L245 WeakPolarHBondContact CG-O 3.23Å; R243-L245 PolarHBondContact O-N 3.47Å
246	P	88.1	Confident	79.9	Confident	91 Å²	91	70 Å²	70	59%	0.591	38%	0.383	S	S	*	.			trans	-66	149.7	173.9	29.3	-34.6	0	0	0	111	L248	P246-L248 HydrophobicContact CG-CD2 4.11Å; P246-L248 PolarHBondContact O-N 3.21Å
247	C	92.3	Very high	78.3	Confident	19 Å²	19	70.3 Å²	70.3	13%	0.128	38%	0.384	C	S	.	.			trans	-70.2	118.4	166.5	-65.4	0	0	0	0	108.8	S115 C234	S115-C247 WeakPolarHBondContact CB-O 3.47Å; S115-C247 PolarHBondContact OG-O 3Å; C234-C247 HydrophobicContact CB-CB 3.73Å; C234-C247 WeakPolarHBondContact CB-SG 3.42Å; C234-C247 WeakPolarHBondContact SG-CA 3.39Å; C234-C247 WeakPolarHBondContact SG-CB 3.23Å; C234-C247 CovalentContact SG-SG 2.03Å; C234-C247 PolarHBondContact SG-SG 3.36Å
248	L	95.9	Very high	77.1	Confident	6 Å²	6	70.7 Å²	70.7	3%	0.031	39%	0.385	C	S	.	.	S	Bend	trans	-97.9	-34.9	179.4	-57.6	178.1	0	0	0	111.1	V114 S115 G119 Q123 Y232 P246	V114-L248 CarbonylContact C-O 3.58Å; V114-L248 WeakPolarHBondContact CA-O 3.39Å; S115-L248 PolarHBondContact N-O 2.93Å; G119-L248 VanDerWaalsContact C-CD1 3.41Å; G119-L248 WeakPolarHBondContact O-CD1 3.17Å; Q123-L248 HydrophobicContact CG-CD1 3.64Å; Y232-L248 HydrophobicContact CD2-CB 4.35Å; Y232-L248 HydrophobicContact CD2-CD1 4.11Å; Y232-L248 HydrophobicContact CG-CD1 4.06Å; Y232-L248 PolarHBondContact O-N 2.98Å; P246-L248 HydrophobicContact CG-CD2 4.11Å; P246-L248 PolarHBondContact O-N 3.21Å
249	L	97.2	Very high	76	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.8	170.2	-67.6	174.5	0	0	0	108.9	I106 T112 R113 V114 L120 A166 V169 Y232 I233 C234	I106-L249 HydrophobicContact CG2-CD1 4.04Å; I106-L249 HydrophobicContact CG2-CD2 4.47Å; T112-L249 HydrophobicContact CG2-CD2 4.4Å; R113-L249 WeakPolarHBondContact O-CA 3.44Å; V114-L249 HydrophobicContact CB-CD2 4.33Å; V114-L249 HydrophobicContact CG1-CD2 4.41Å; V114-L249 HydrophobicContact CG2-CD2 3.69Å; L120-L249 HydrophobicContact CD1-CD1 3.96Å; L120-L249 HydrophobicContact CD1-CG 4.14Å; L120-L249 HydrophobicContact CD2-CD1 4.17Å; L120-L249 HydrophobicContact CD2-CD2 3.96Å; L120-L249 HydrophobicContact CD2-CG 4.08Å; A166-L249 WeakPolarHBondContact O-CB 3.39Å; V169-L249 HydrophobicContact CG2-CD1 4.1Å; Y232-L249 PolarHBondContact O-N 3.19Å; I233-L249 WeakPolarHBondContact CA-O 3.05Å; I233-L249 HydrophobicContact CB-CB 4.48Å; I233-L249 HydrophobicContact CD1-CD1 4.04Å; I233-L249 HydrophobicContact CG1-CB 4.19Å; I233-L249 HydrophobicContact CG1-CD1 4.15Å; I233-L249 HydrophobicContact CG2-CB 4.09Å; C234-L249 PolarHBondContact N-O 3.21Å
250	H	96	Very high	75.5	Confident	13 Å²	13	69.8 Å²	69.8	6%	0.06	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	159.7	173.6	65.6	86.6	0	0	0	112.8	T112 R113 S115 C234 P237	T112-H250 CarbonylContact C-O 3.5Å; R113-H250 VanDerWaalsContact CB-CE1 3.43Å; R113-H250 WeakPolarHBondContact CB-CE1 3.42Å; R113-H250 PolarHBondContact N-O 3.17Å; R113-H250 PolarHBondContact O-N 3.45Å; R113-H250 VanDerWaalsContact O-N 3.17Å; S115-H250 PolarHBondContact OG-CD2 2.87Å; S115-H250 PolarHBondContact OG-NE2 2.99Å; C234-H250 HydrophobicContact CB-CB 4.16Å; C234-H250 WeakPolarHBondContact O-CA 3.42Å; C234-H250 WeakPolarHBondContact O-CB 3.37Å; P237-H250 WeakPolarHBondContact CD-ND1 3.47Å
251	A	95.1	Very high	75.5	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	143.2	169.3	0	0	0	0	0	109.6	M163 S165 A166 S235 L474	M163-A251 HydrophobicContact CE-CB 3.92Å; S165-A251 WeakPolarHBondContact O-CA 3.38Å; S165-A251 WeakPolarHBondContact O-CB 3.27Å; A166-A251 HydrophobicContact CB-CB 4.45Å; S235-A251 VanDerWaalsContact O-CB 3.23Å; S235-A251 WeakPolarHBondContact O-CB 3.23Å; S235-A251 PolarHBondContact O-N 3.04Å; A251-L474 HydrophobicContact CB-CD1 3.51Å; A251-L474 HydrophobicContact CB-CD2 4.04Å; A251-L474 HydrophobicContact CB-CG 4.46Å
252	Q	91.5	Very high	75.5	Confident	59 Å²	59	68.6 Å²	68.6	28%	0.276	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-95.2	117.8	168.6	-175.4	63.5	39.8	0	0	108	N111 R113	N111-Q252 WeakPolarHBondContact O-CB 3.2Å; N111-Q252 PolarHBondContact O-N 2.76Å; R113-Q252 HydrophobicContact CG-CB 3.83Å
253	P	86	Confident	75.2	Confident	38 Å²	38	70.5 Å²	70.5	25%	0.247	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-57.3	140.6	170.3	-22.5	33.1	0	0	0	110.9	T236 E255 L474	T236-P253 HydrophobicContact CG2-CG 4.2Å; P253-E255 PolarHBondContact O-N 2.88Å; P253-E255 VanDerWaalsContact O-N 3.16Å; P253-L474 WeakPolarHBondContact CA-O 3.49Å; P253-L474 HydrophobicContact CB-CD1 4.3Å; P253-L474 HydrophobicContact CG-CD1 4.16Å
254	E	75	Confident	74.6	Confident	74 Å²	74	74.6 Å²	74.6	35%	0.346	38%	0.383	S	S	.	.			trans	-71.6	110.6	171.5	-81	-175.1	176.6	0	0	109.2	L474 H475	E254-L474 PolarHBondContact N-O 2.85Å; E254-H475 VanDerWaalsContact CD-ND1 3.31Å; E254-H475 IonicContact OE1-CE1 2.72Å; E254-H475 IonicContact OE1-ND1 3.73Å; E254-H475 IonicContact OE2-CE1 3.58Å; E254-H475 IonicContact OE2-ND1 3.61Å; E254-H475 PolarHBondContact OE2-ND1 2.04Å; E254-H475 VanDerWaalsContact OE2-ND1 3.11Å
255	E	65.4	Low	74.3	Confident	144 Å²	144	67.6 Å²	67.6	67%	0.673	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-64.6	137.9	175.7	-74.7	-86.1	156.1	0	0	110.4	P253	P253-E255 PolarHBondContact O-N 2.88Å; P253-E255 VanDerWaalsContact O-N 3.16Å
256	P	63.9	Low	74.2	Confident	96 Å²	96	66.1 Å²	66.1	62%	0.623	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-55.3	146	168	-19.8	30.4	0	0	0	110.5	T258	P256-T258 PolarHBondContact O-N 3.32Å; P256-T258 VanDerWaalsContact O-N 3.07Å
257	L	58.4	Low	73.8	Confident	27 Å²	27	64.9 Å²	64.9	14%	0.141	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-52.7	120.2	176.5	-75.1	167.6	0	0	0	111.5	Q261 R262 C266 C382 R383	L257-Q261 HydrophobicContact CD2-CB 3.86Å; L257-R262 HydrophobicContact CB-CG 3.89Å; L257-R262 HydrophobicContact CD1-CG 4.41Å; L257-R262 PolarHBondContact O-NE 3.41Å; L257-R262 VanDerWaalsContact O-NE 3.1Å; L257-R262 PolarHBondContact O-NH2 2.92Å; L257-C266 VanDerWaalsContact CD1-SG 3.53Å; L257-C382 VanDerWaalsContact CD1-SG 3.54Å; L257-R383 HydrophobicContact CD1-CG 3.8Å; L257-R383 HydrophobicContact CD2-CG 4.47Å
258	T	56.4	Low	73.4	Confident	75 Å²	75	70.6 Å²	70.6	46%	0.46	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-62.7	156.5	172.1	62.8	0	0	0	0	110.3	P256 G260 Q261 R262	P256-T258 PolarHBondContact O-N 3.32Å; P256-T258 VanDerWaalsContact O-N 3.07Å; T258-G260 PolarHBondContact O-N 3.39Å; T258-Q261 PolarHBondContact O-N 3.32Å; T258-Q261 VanDerWaalsContact O-N 3.16Å; T258-Q261 VanDerWaalsContact OG1-CD 3.31Å; T258-Q261 VanDerWaalsContact OG1-CG 3.26Å; T258-Q261 WeakPolarHBondContact OG1-CG 3.48Å; T258-Q261 PolarHBondContact OG1-N 3.06Å; T258-Q261 PolarHBondContact OG1-OE1 3.21Å; T258-R262 WeakPolarHBondContact O-CG 3.4Å; T258-R262 PolarHBondContact O-N 2.94Å; T258-R262 VanDerWaalsContact O-N 3.12Å
259	L	52.4	Low	72.8	Confident	92 Å²	92	70.6 Å²	70.6	48%	0.482	37%	0.374	S	S	.	.	H	α-helix	trans	-56	-35.9	178.7	-164.9	72.5	0	0	0	112.4	R262 R263 T372	L259-R262 PolarHBondContact O-N 3.41Å; L259-R263 PolarHBondContact O-N 3.26Å; L259-T372 HydrophobicContact CD1-CG2 3.38Å
260	G	55.7	Low	72.1	Confident	46 Å²	46	72.7 Å²	72.7	47%	0.474	39%	0.387	S	S	.	.	H	α-helix	trans	-68	-44.9	177.4	0	0	0	0	0	113	T258 R262 R263 N264	T258-G260 PolarHBondContact O-N 3.39Å; G260-R262 PolarHBondContact O-N 2.99Å; G260-R263 PolarHBondContact O-N 2.89Å; G260-R263 VanDerWaalsContact O-N 3.12Å; G260-N264 PolarHBondContact O-N 3.25Å
261	Q	61.8	Low	71.5	Confident	97 Å²	97	72.9 Å²	72.9	45%	0.453	39%	0.393	S	S	.	.	H	α-helix	trans	-61.2	-34.7	176.5	-74	165.9	-46.8	0	0	111.8	L257 T258 R263 G265	L257-Q261 HydrophobicContact CD2-CB 3.86Å; T258-Q261 PolarHBondContact O-N 3.32Å; T258-Q261 VanDerWaalsContact O-N 3.16Å; T258-Q261 VanDerWaalsContact OG1-CD 3.31Å; T258-Q261 VanDerWaalsContact OG1-CG 3.26Å; T258-Q261 WeakPolarHBondContact OG1-CG 3.48Å; T258-Q261 PolarHBondContact OG1-N 3.06Å; T258-Q261 PolarHBondContact OG1-OE1 3.21Å; Q261-R263 VanDerWaalsContact C-N 3.32Å; Q261-R263 PolarHBondContact O-N 2.97Å; Q261-G265 PolarHBondContact O-N 3.5Å
262	R	60.6	Low	71.1	Confident	61 Å²	61	75.5 Å²	75.5	23%	0.23	41%	0.411	C	S	.	.	H	α-helix	trans	-65.8	-35	176.4	-65.6	-176.4	-157.6	-173	10	113.2	L257 T258 L259 G260 C266 T372	L257-R262 HydrophobicContact CB-CG 3.89Å; L257-R262 HydrophobicContact CD1-CG 4.41Å; L257-R262 PolarHBondContact O-NE 3.41Å; L257-R262 VanDerWaalsContact O-NE 3.1Å; L257-R262 PolarHBondContact O-NH2 2.92Å; T258-R262 WeakPolarHBondContact O-CG 3.4Å; T258-R262 PolarHBondContact O-N 2.94Å; T258-R262 VanDerWaalsContact O-N 3.12Å; L259-R262 PolarHBondContact O-N 3.41Å; G260-R262 PolarHBondContact O-N 2.99Å; R262-C266 WeakPolarHBondContact O-CB 3Å; R262-T372 PolarHBondContact NH1-O 2.7Å
263	R	59.3	Low	71.2	Confident	206 Å²	206	73.9 Å²	73.9	78%	0.777	40%	0.404	S	S	*	.	H	α-helix	trans	-70.7	-31.8	-178	-79.3	-176.8	168.2	-176.5	-3.5	113.3	L259 G260 Q261	L259-R263 PolarHBondContact O-N 3.26Å; G260-R263 PolarHBondContact O-N 2.89Å; G260-R263 VanDerWaalsContact O-N 3.12Å; Q261-R263 VanDerWaalsContact C-N 3.32Å; Q261-R263 PolarHBondContact O-N 2.97Å
264	N	60.8	Low	71.5	Confident	158 Å²	158	72.1 Å²	72.1	85%	0.845	39%	0.392	S	S	*	.	H	α-helix	trans	-114.1	1.5	-168.6	-69.1	-4.9	0	0	0	114.8	G260	G260-N264 PolarHBondContact O-N 3.25Å
265	G	67.3	Low	72.5	Confident	58 Å²	58	68.8 Å²	68.8	60%	0.598	38%	0.376	S	S	*	.	H	α-helix	trans	-156.9	15.9	-178.6	0	0	0	0	0	115.3	Q261	Q261-G265 PolarHBondContact O-N 3.5Å
266	C	78.3	Confident	74	Confident	29 Å²	29	61.9 Å²	61.9	20%	0.196	34%	0.344	C	S	.	.			trans	-122.4	127.3	176.7	-96.7	0	0	0	0	112.6	L257 R262 H268 C382	L257-C266 VanDerWaalsContact CD1-SG 3.53Å; R262-C266 WeakPolarHBondContact O-CB 3Å; C266-H268 PolarHBondContact O-N 3.45Å; C266-C382 CarbonylContact C-O 3.58Å; C266-C382 WeakPolarHBondContact CA-O 3.46Å; C266-C382 HydrophobicContact CB-CB 3.49Å; C266-C382 VanDerWaalsContact CB-CB 3.49Å; C266-C382 WeakPolarHBondContact CB-SG 3.24Å; C266-C382 WeakPolarHBondContact SG-CB 3.47Å; C266-C382 PolarHBondContact SG-O 3.49Å; C266-C382 CovalentContact SG-SG 2.06Å; C266-C382 PolarHBondContact SG-SG 3.23Å
267	E	80.5	Confident	75.6	Confident	64 Å²	64	57.3 Å²	57.3	30%	0.299	32%	0.315	S	S	.	.			trans	-72.2	120.6	167.4	-167	-175.5	165.6	0	0	108.5	T269 R350 C382 A386	E267-T269 PolarHBondContact O-N 3.25Å; E267-T269 PolarHBondContact O-OG1 2.78Å; E267-R350 VanDerWaalsContact CD-NH1 3.29Å; E267-R350 WeakPolarHBondContact OE1-CD 3.5Å; E267-R350 IonicContact OE1-CZ 2.86Å; E267-R350 IonicContact OE1-NE 3.65Å; E267-R350 IonicContact OE1-NH1 3.06Å; E267-R350 PolarHBondContact OE1-NH1 2.83Å; E267-C382 PolarHBondContact N-O 3.49Å; E267-C382 WeakPolarHBondContact O-CA 3.27Å; E267-C382 WeakPolarHBondContact O-CB 3.41Å; E267-A386 PolarHBondContact OE2-N 3.24Å
268	H	82.9	Confident	77.5	Confident	139 Å²	139	56 Å²	56	64%	0.644	31%	0.308	S	S	*	.			trans	-51.9	113.3	-178.7	172	-91.3	0	0	0	110.2	C266 H273 R350	C266-H268 PolarHBondContact O-N 3.45Å; H268-H273 AromaticContact CE1-CE1 3.93Å; H268-H273 AromaticContact ND1-CE1 3.79Å; H268-R350 PolarHBondContact O-NH1 2.93Å; H268-R350 VanDerWaalsContact O-NH1 3.12Å; H268-R350 PolarHBondContact O-NH2 2.81Å
269	T	83.8	Confident	79.4	Confident	6 Å²	6	53.3 Å²	53.3	4%	0.037	29%	0.289	C	S	.	.			trans	-133.6	135.9	-175.8	-59.3	0	0	0	0	110.1	E267 H273 R350 S378 L381	E267-T269 PolarHBondContact O-N 3.25Å; E267-T269 PolarHBondContact O-OG1 2.78Å; T269-H273 HydrophobicContact CG2-CB 4.48Å; T269-R350 PolarHBondContact OG1-NH2 3.38Å; T269-S378 WeakPolarHBondContact O-CB 3.39Å; T269-L381 HydrophobicContact CG2-CB 3.92Å; T269-L381 HydrophobicContact CG2-CD1 4.46Å
270	T	83.5	Confident	81.5	Confident	44 Å²	44	49.1 Å²	49.1	27%	0.27	27%	0.268	S	S	.	.			trans	-140.1	170.3	178.7	67	0	0	0	0	108.6	S272 H273 S378	T270-S272 PolarHBondContact O-N 3.18Å; T270-S272 PolarHBondContact OG1-N 3.34Å; T270-S272 PolarHBondContact OG1-OG 3.21Å; T270-H273 PolarHBondContact N-ND1 3.38Å; T270-H273 VanDerWaalsContact N-ND1 3.1Å; T270-H273 PolarHBondContact O-N 3.49Å; T270-H273 PolarHBondContact O-ND1 2.04Å; T270-H273 PolarHBondContact OG1-CE1 3.49Å; T270-H273 VanDerWaalsContact OG1-CE1 3.23Å; T270-H273 PolarHBondContact OG1-ND1 2.96Å; T270-S378 WeakPolarHBondContact CA-OG 3.23Å
271	G	82.4	Confident	83.5	Confident	17 Å²	17	47.3 Å²	47.3	18%	0.175	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-55.7	-22.6	176.3	0	0	0	0	0	114.9	H273 I274	G271-H273 PolarHBondContact O-N 3.31Å; G271-I274 PolarHBondContact O-N 3.43Å
272	S	87.6	Confident	85.1	Confident	56 Å²	56	44.7 Å²	44.7	39%	0.392	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-72.5	-15.7	176.3	63.9	0	0	0	0	114	T270 N302 I349	T270-S272 PolarHBondContact O-N 3.18Å; T270-S272 PolarHBondContact OG1-N 3.34Å; T270-S272 PolarHBondContact OG1-OG 3.21Å; S272-N302 PolarHBondContact O-ND2 3.11Å; S272-I349 WeakPolarHBondContact O-CD1 3.22Å
273	H	92.4	Very high	86.7	Confident	25 Å²	25	49.3 Å²	49.3	12%	0.116	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-94.1	0.6	177.6	-53.2	91.5	0	0	0	112.6	H268 T269 T270 G271 D348 R350 W351	H268-H273 AromaticContact CE1-CE1 3.93Å; H268-H273 AromaticContact ND1-CE1 3.79Å; T269-H273 HydrophobicContact CG2-CB 4.48Å; T270-H273 PolarHBondContact N-ND1 3.38Å; T270-H273 VanDerWaalsContact N-ND1 3.1Å; T270-H273 PolarHBondContact O-N 3.49Å; T270-H273 PolarHBondContact O-ND1 2.04Å; T270-H273 PolarHBondContact OG1-CE1 3.49Å; T270-H273 VanDerWaalsContact OG1-CE1 3.23Å; T270-H273 PolarHBondContact OG1-ND1 2.96Å; G271-H273 PolarHBondContact O-N 3.31Å; H273-D348 WeakPolarHBondContact CA-O 3.47Å; H273-D348 WeakPolarHBondContact CB-O 3.41Å; H273-D348 PolarHBondContact CD2-O 2.94Å; H273-D348 VanDerWaalsContact CD2-O 3.24Å; H273-R350 PolarHBondContact CD2-NH2 3.11Å; H273-R350 VanDerWaalsContact CD2-NH2 3.28Å; H273-R350 PolarHBondContact O-N 3.19Å; H273-W351 PolarHBondContact O-N 3.05Å
274	I	94.2	Very high	88.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	130.7	-175.6	-49.7	172.5	0	0	0	108	G271 F276 N302 W351 M353 V377 L381	G271-I274 PolarHBondContact O-N 3.43Å; I274-F276 HydrophobicContact CB-CE2 3.77Å; I274-F276 HydrophobicContact CB-CZ 3.88Å; I274-F276 HydrophobicContact CD1-CZ 4.22Å; I274-F276 HydrophobicContact CG2-CD1 4.4Å; I274-F276 HydrophobicContact CG2-CD2 4.22Å; I274-F276 HydrophobicContact CG2-CE1 3.95Å; I274-F276 HydrophobicContact CG2-CE2 3.76Å; I274-F276 HydrophobicContact CG2-CZ 3.61Å; I274-N302 WeakPolarHBondContact O-CB 3.44Å; I274-N302 PolarHBondContact O-ND2 3.07Å; I274-W351 WeakPolarHBondContact CA-O 3.46Å; I274-W351 HydrophobicContact CG1-CB 4.29Å; I274-W351 HydrophobicContact CG2-CB 4.37Å; I274-M353 HydrophobicContact CG2-CB 3.94Å; I274-V377 HydrophobicContact CD1-CG1 3.95Å; I274-L381 HydrophobicContact CD1-CD1 3.61Å; I274-L381 HydrophobicContact CG1-CD1 3.91Å
275	Y	95.8	Very high	90.1	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.016	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	120.8	169.4	-173.8	-84.9	0	0	0	109.8	A277 N302 R304 Y306 S339 D342 I343 W351 L352 M353	Y275-A277 HydrophobicContact CD1-CB 4.38Å; Y275-A277 HydrophobicContact CE1-CB 4.21Å; Y275-N302 CarbonylContact C-O 3.54Å; Y275-N302 WeakPolarHBondContact CA-O 3.32Å; Y275-N302 HydrophobicContact CD2-CB 4.2Å; Y275-R304 HydrophobicContact CE2-CG 4.38Å; Y275-R304 WeakPolarHBondContact OH-CG 2.97Å; Y275-Y306 HydrophobicContact CE1-CE2 4.4Å; Y275-Y306 PolarHBondContact OH-OH 2.88Å; Y275-S339 WeakPolarHBondContact CE1-OG 3.39Å; Y275-D342 HydrophobicContact CE2-CB 4.35Å; Y275-D342 WeakPolarHBondContact OH-CB 3.48Å; Y275-D342 PolarHBondContact OH-OD2 3.49Å; Y275-I343 HydrophobicContact CD1-CD1 4.14Å; Y275-I343 HydrophobicContact CD1-CG1 4.38Å; Y275-I343 HydrophobicContact CD2-CD1 4.13Å; Y275-I343 HydrophobicContact CD2-CG1 3.54Å; Y275-I343 HydrophobicContact CE2-CG1 3.95Å; Y275-I343 HydrophobicContact CG-CD1 3.79Å; Y275-I343 HydrophobicContact CG-CG1 3.76Å; Y275-W351 PolarHBondContact N-O 3.37Å; Y275-L352 HydrophobicContact CD1-CD1 4.25Å; Y275-L352 HydrophobicContact CD1-CG 4.41Å; Y275-L352 CarbonylContact O-C 3.54Å; Y275-L352 WeakPolarHBondContact O-CA 3.47Å; Y275-M353 PolarHBondContact O-N 3.36Å
276	F	96.3	Very high	91.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	112.6	-179.1	-61	-92.5	0	0	0	109.2	I274 I278 W296 A300 N302 R303 R304 M353 L361 L363	I274-F276 HydrophobicContact CB-CE2 3.77Å; I274-F276 HydrophobicContact CB-CZ 3.88Å; I274-F276 HydrophobicContact CD1-CZ 4.22Å; I274-F276 HydrophobicContact CG2-CD1 4.4Å; I274-F276 HydrophobicContact CG2-CD2 4.22Å; I274-F276 HydrophobicContact CG2-CE1 3.95Å; I274-F276 HydrophobicContact CG2-CE2 3.76Å; I274-F276 HydrophobicContact CG2-CZ 3.61Å; F276-I278 HydrophobicContact CB-CD1 4.01Å; F276-I278 WeakPolarHBondContact O-CD1 3.47Å; F276-W296 HydrophobicContact CB-CH2 4.47Å; F276-W296 HydrophobicContact CB-CZ3 4.27Å; F276-W296 HydrophobicContact CD1-CH2 4.32Å; F276-W296 AromaticContact CD1-CZ3 3.8Å; F276-W296 HydrophobicContact CD1-CZ3 3.8Å; F276-W296 HydrophobicContact CE1-CZ3 4.4Å; F276-W296 HydrophobicContact CG-CZ3 4.09Å; F276-A300 HydrophobicContact CD1-CB 4.45Å; F276-A300 HydrophobicContact CD2-CB 3.57Å; F276-A300 HydrophobicContact CE2-CB 3.71Å; F276-A300 HydrophobicContact CG-CB 3.96Å; F276-A300 HydrophobicContact CZ-CB 4.22Å; F276-N302 PolarHBondContact N-O 2.88Å; F276-R303 HydrophobicContact CB-CB 3.93Å; F276-R303 WeakPolarHBondContact O-CA 3.18Å; F276-R304 PolarHBondContact O-N 3.01Å; F276-M353 WeakPolarHBondContact CA-O 3.26Å; F276-M353 HydrophobicContact CD1-CB 3.96Å; F276-M353 HydrophobicContact CD1-CG 4.23Å; F276-M353 HydrophobicContact CD1-SD 4.14Å; F276-M353 HydrophobicContact CE1-CB 4.21Å; F276-M353 HydrophobicContact CE1-CG 4.39Å; F276-M353 HydrophobicContact CE1-SD 3.76Å; F276-L361 HydrophobicContact CD1-CD1 3.94Å; F276-L361 HydrophobicContact CE1-CD1 3.89Å; F276-L363 HydrophobicContact CD1-CD1 4.44Å; F276-L363 HydrophobicContact CE1-CD1 3.6Å; F276-L363 HydrophobicContact CE1-CD2 3.92Å; F276-L363 HydrophobicContact CE1-CG 4.34Å; F276-L363 HydrophobicContact CE2-CD1 4.27Å; F276-L363 HydrophobicContact CZ-CD1 3.49Å; F276-L363 VanDerWaalsContact CZ-CD1 3.49Å; F276-L363 HydrophobicContact CZ-CD2 3.76Å; F276-L363 HydrophobicContact CZ-CG 4.29Å
277	A	97.5	Very high	92.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	103.4	176	0	0	0	0	0	108.8	Y275 Y306 I335 L352 M353 L354 V355	Y275-A277 HydrophobicContact CD1-CB 4.38Å; Y275-A277 HydrophobicContact CE1-CB 4.21Å; A277-Y306 HydrophobicContact CB-CD2 4.29Å; A277-Y306 HydrophobicContact CB-CE2 3.85Å; A277-I335 HydrophobicContact CB-CG2 3.88Å; A277-L352 HydrophobicContact CB-CD1 4.5Å; A277-L352 HydrophobicContact CB-CD2 4.26Å; A277-L352 HydrophobicContact CB-CG 4.41Å; A277-M353 PolarHBondContact N-O 3.35Å; A277-L354 HydrophobicContact CB-CD1 4.34Å; A277-L354 WeakPolarHBondContact O-CA 3.36Å; A277-V355 PolarHBondContact O-N 2.89Å
278	I	97.5	Very high	92.8	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	115.6	-176.8	-55.7	90.3	0	0	0	109.2	F276 I292 W296 R303 R304 Y305 Y306 V355 D357	F276-I278 HydrophobicContact CB-CD1 4.01Å; F276-I278 WeakPolarHBondContact O-CD1 3.47Å; I278-I292 HydrophobicContact CG2-CD1 4.14Å; I278-W296 HydrophobicContact CD1-CH2 4.07Å; I278-W296 HydrophobicContact CG1-CH2 3.77Å; I278-W296 HydrophobicContact CG1-CZ2 4.3Å; I278-R303 HydrophobicContact CD1-CB 3.92Å; I278-R304 VanDerWaalsContact CD1-O 3.26Å; I278-R304 WeakPolarHBondContact CD1-O 3.22Å; I278-R304 PolarHBondContact N-O 3.44Å; I278-Y305 HydrophobicContact CB-CD1 3.72Å; I278-Y305 HydrophobicContact CB-CE1 4.06Å; I278-Y305 HydrophobicContact CD1-CD1 4.27Å; I278-Y305 HydrophobicContact CD1-CE1 4.11Å; I278-Y305 HydrophobicContact CG1-CD1 4.2Å; I278-Y305 HydrophobicContact CG1-CE1 4.07Å; I278-Y305 HydrophobicContact CG2-CD1 3.81Å; I278-Y305 HydrophobicContact CG2-CE1 4.05Å; I278-Y306 PolarHBondContact O-N 3.15Å; I278-V355 WeakPolarHBondContact CA-O 3.44Å; I278-V355 HydrophobicContact CB-CG2 4.31Å; I278-V355 HydrophobicContact CG1-CG2 3.74Å; I278-V355 HydrophobicContact CG2-CG2 4.45Å; I278-D357 HydrophobicContact CG2-CB 4.23Å
279	K	97.5	Very high	93.4	Very high	17 Å²	17	37.4 Å²	37.4	7%	0.074	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	119.7	174.6	-176.9	177.6	57	176.3	0	109	H328 I335 V355 D356 D357 D438	K279-H328 HydrophobicContact CD-CB 4.36Å; K279-I335 HydrophobicContact CB-CD1 3.74Å; K279-I335 HydrophobicContact CD-CD1 4.25Å; K279-I335 HydrophobicContact CG-CD1 3.68Å; K279-V355 PolarHBondContact N-O 2.03Å; K279-D356 WeakPolarHBondContact CE-OD1 2.98Å; K279-D356 IonicContact NZ-OD1 3.6Å; K279-D356 PolarHBondContact NZ-OD1 3.49Å; K279-D357 PolarHBondContact O-N 3.23Å; K279-D357 VanDerWaalsContact O-N 3.1Å; K279-D438 IonicContact NZ-OD1 3.25Å; K279-D438 IonicContact NZ-OD2 3.35Å; K279-D438 PolarHBondContact NZ-OD2 3.1Å
280	T	96.9	Very high	94	Very high	5 Å²	5	39 Å²	39	3%	0.031	20%	0.2	C	C	.	.			trans	-137	-178.7	177.3	-170.1	0	0	0	0	110.9	I289 Y306 K331 D357	T280-I289 HydrophobicContact CG2-CD1 4.25Å; T280-Y306 WeakPolarHBondContact CG2-O 3.32Å; T280-Y306 PolarHBondContact N-O 3Å; T280-K331 WeakPolarHBondContact O-CE 3.41Å; T280-K331 PolarHBondContact O-NZ 2.81Å; T280-D357 VanDerWaalsContact CA-OD2 3.31Å; T280-D357 WeakPolarHBondContact CA-OD2 3.43Å; T280-D357 VanDerWaalsContact CB-OD2 3.23Å; T280-D357 WeakPolarHBondContact CB-OD2 3Å; T280-D357 PolarHBondContact OG1-OD2 3.25Å
281	C	95.9	Very high	94.5	Very high	8 Å²	8	38 Å²	38	5%	0.054	19%	0.192	C	C	.	.			trans	-141.6	164.6	167.1	65.7	0	0	0	0	111.2	K283 F284 H285 S307 D308 N323	C281-K283 PolarHBondContact O-N 3.34Å; C281-F284 PolarHBondContact O-N 2.71Å; C281-F284 WeakPolarHBondContact SG-CD2 3.14Å; C281-H285 PolarHBondContact O-CD2 3.43Å; C281-S307 WeakPolarHBondContact CA-OG 3.31Å; C281-D308 WeakPolarHBondContact CA-OD1 3.18Å; C281-D308 WeakPolarHBondContact CB-OD1 3.38Å; C281-N323 HydrophobicContact CB-CB 4.29Å
282	A	95.5	Very high	95.1	Very high	42 Å²	42	37.2 Å²	37.2	35%	0.347	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-48.7	-35.2	-177.7	0	0	0	0	0	113.6	F284 S307 D308 V309	A282-F284 VanDerWaalsContact C-N 3.28Å; A282-F284 PolarHBondContact O-N 3.13Å; A282-S307 PolarHBondContact N-OG 2.9Å; A282-D308 PolarHBondContact N-OD1 3.33Å; A282-V309 HydrophobicContact CB-CB 4.04Å; A282-V309 HydrophobicContact CB-CG2 3.97Å
283	K	94.8	Very high	95.3	Very high	157 Å²	157	37.6 Å²	37.6	68%	0.683	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-57.1	-37.9	177.2	-178.7	-177.7	174.2	-176.3	0	113	C281	C281-K283 PolarHBondContact O-N 3.34Å
284	F	95.2	Very high	95.3	Very high	35 Å²	35	43.2 Å²	43.2	15%	0.154	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-99.9	-0.4	-169	-64.2	-48.2	0	0	0	114.4	C281 A282 K286 E287 R288 I289 D357	C281-F284 PolarHBondContact O-N 2.71Å; C281-F284 WeakPolarHBondContact SG-CD2 3.14Å; A282-F284 VanDerWaalsContact C-N 3.28Å; A282-F284 PolarHBondContact O-N 3.13Å; F284-K286 PolarHBondContact O-N 3.41Å; F284-E287 PolarHBondContact O-N 3.22Å; F284-R288 HydrophobicContact CB-CB 4.11Å; F284-R288 HydrophobicContact CB-CG 3.92Å; F284-R288 HydrophobicContact CD1-CG 3.96Å; F284-R288 VanDerWaalsContact CD1-NE 3.33Å; F284-R288 HydrophobicContact CG-CG 4.06Å; F284-R288 PolarHBondContact O-N 3.46Å; F284-I289 PolarHBondContact O-N 3.41Å; F284-D357 WeakPolarHBondContact CB-OD2 3.22Å; F284-D357 VanDerWaalsContact CD2-OD2 3.3Å; F284-D357 WeakPolarHBondContact CD2-OD2 3.4Å
285	H	95.9	Very high	95.2	Very high	12 Å²	12	43.6 Å²	43.6	6%	0.056	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-40.1	178.8	-72.4	-162.8	0	0	0	113.3	C281 P290 S307 V309 D311 I314	C281-H285 PolarHBondContact O-CD2 3.43Å; H285-P290 WeakPolarHBondContact O-CD 3.44Å; H285-S307 WeakPolarHBondContact NE2-CB 3.5Å; H285-S307 PolarHBondContact NE2-OG 2.92Å; H285-V309 PolarHBondContact CE1-O 3.13Å; H285-D311 IonicContact CE1-OD2 2.63Å; H285-D311 IonicContact CG-OD2 3.09Å; H285-D311 WeakPolarHBondContact ND1-CB 3.49Å; H285-D311 IonicContact ND1-OD2 3.44Å; H285-D311 PolarHBondContact ND1-OD2 3.35Å; H285-I314 HydrophobicContact CB-CD1 3.51Å; H285-I314 HydrophobicContact CB-CG1 4.38Å; H285-I314 VanDerWaalsContact CG-CD1 3.42Å
286	K	94.3	Very high	95	Very high	194 Å²	194	43.4 Å²	43.4	84%	0.843	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-22.7	-176.9	-64.4	-175.5	180	180	0	114.1	F284 P290	F284-K286 PolarHBondContact O-N 3.41Å; K286-P290 WeakPolarHBondContact O-CG 3.01Å
287	E	93.7	Very high	94.7	Very high	123 Å²	123	43.4 Å²	43.4	58%	0.575	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-51.3	-171.9	-170.8	-174.7	159.5	0	0	111.5	F284 I291	F284-E287 PolarHBondContact O-N 3.22Å; E287-I291 VanDerWaalsContact O-CD1 3.31Å; E287-I291 WeakPolarHBondContact O-CD1 3.29Å
288	R	96.1	Very high	94.1	Very high	41 Å²	41	46.9 Å²	46.9	16%	0.155	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-41.9	-170	-59.8	-174.8	176.9	-163.1	-13.5	113.3	F284 I291 I292 D357 D358 F483	F284-R288 HydrophobicContact CB-CB 4.11Å; F284-R288 HydrophobicContact CB-CG 3.92Å; F284-R288 HydrophobicContact CD1-CG 3.96Å; F284-R288 VanDerWaalsContact CD1-NE 3.33Å; F284-R288 HydrophobicContact CG-CG 4.06Å; F284-R288 PolarHBondContact O-N 3.46Å; R288-I291 WeakPolarHBondContact O-CB 3.43Å; R288-I291 PolarHBondContact O-N 2.94Å; R288-I292 PolarHBondContact O-N 3.18Å; R288-I292 VanDerWaalsContact O-N 3.15Å; R288-D357 HydrophobicContact CB-CB 4.36Å; R288-D357 WeakPolarHBondContact CB-O 3.41Å; R288-D357 VanDerWaalsContact CD-CG 3.49Å; R288-D357 WeakPolarHBondContact CD-OD1 3.43Å; R288-D357 IonicContact CZ-OD1 3.96Å; R288-D357 IonicContact NE-OD1 3.43Å; R288-D357 IonicContact NH1-OD1 3.67Å; R288-D357 PolarHBondContact NH1-OD1 3.22Å; R288-D358 IonicContact CZ-OD2 3.58Å; R288-D358 VanDerWaalsContact CZ-OD2 3.25Å; R288-D358 IonicContact NH1-OD1 2.78Å; R288-D358 PolarHBondContact NH1-OD1 3.46Å; R288-D358 IonicContact NH1-OD2 2.7Å; R288-D358 PolarHBondContact NH1-OD2 2.74Å; R288-D358 IonicContact NH2-OD2 3.66Å; R288-D358 PolarHBondContact NH2-OD2 3.03Å; R288-D358 VanDerWaalsContact NH2-OD2 3.14Å; R288-F483 HydrophobicContact CB-CD2 4.24Å; R288-F483 HydrophobicContact CB-CE2 4.1Å; R288-F483 HydrophobicContact CG-CD2 4.12Å; R288-F483 HydrophobicContact CG-CE2 4.47Å
289	I	95.4	Very high	93.5	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.2	-42.4	-177.7	-55.4	-53.4	0	0	0	112.8	T280 F284 I291 I292 E293 Y305 I314 D357	T280-I289 HydrophobicContact CG2-CD1 4.25Å; F284-I289 PolarHBondContact O-N 3.41Å; I289-I291 PolarHBondContact O-N 2.72Å; I289-I292 PolarHBondContact O-N 3.1Å; I289-I292 VanDerWaalsContact O-N 3.16Å; I289-E293 HydrophobicContact CG2-CG 4.43Å; I289-E293 PolarHBondContact O-N 2.83Å; I289-Y305 HydrophobicContact CD1-CD1 3.66Å; I289-Y305 HydrophobicContact CD1-CE1 3.86Å; I289-Y305 HydrophobicContact CD1-CG 4.46Å; I289-Y305 HydrophobicContact CG2-CD1 4.34Å; I289-Y305 HydrophobicContact CG2-CD2 4.49Å; I289-Y305 HydrophobicContact CG2-CE1 4.01Å; I289-Y305 HydrophobicContact CG2-CE2 4.15Å; I289-I314 HydrophobicContact CB-CD1 4.28Å; I289-I314 HydrophobicContact CG1-CD1 3.97Å; I289-I314 HydrophobicContact CG2-CB 4.13Å; I289-I314 HydrophobicContact CG2-CD1 4.2Å; I289-I314 HydrophobicContact CG2-CG2 3.94Å; I289-D357 HydrophobicContact CD1-CB 4.02Å
290	P	94.7	Very high	93.1	Very high	39 Å²	39	49.2 Å²	49.2	25%	0.253	24%	0.244	S	C	.	.	H	α-helix	trans	-62.2	-30.1	176.6	-26.1	37.8	0	0	0	113.7	H285 K286 R294	H285-P290 WeakPolarHBondContact O-CD 3.44Å; K286-P290 WeakPolarHBondContact O-CG 3.01Å; P290-R294 WeakPolarHBondContact O-CG 3.49Å; P290-R294 PolarHBondContact O-N 2.92Å; P290-R294 VanDerWaalsContact O-N 3.13Å; P290-R294 PolarHBondContact O-NH1 3.12Å
291	I	95.1	Very high	92.6	Very high	23 Å²	23	59 Å²	59	12%	0.118	28%	0.28	C	S	.	.	H	α-helix	trans	-70.4	-43.1	176.3	-61.5	169.7	0	0	0	109.9	E287 R288 I289 E293 R294 T295 F483 P488 E489	E287-I291 VanDerWaalsContact O-CD1 3.31Å; E287-I291 WeakPolarHBondContact O-CD1 3.29Å; R288-I291 WeakPolarHBondContact O-CB 3.43Å; R288-I291 PolarHBondContact O-N 2.94Å; I289-I291 PolarHBondContact O-N 2.72Å; I291-E293 VanDerWaalsContact C-N 3.35Å; I291-E293 PolarHBondContact O-N 2.85Å; I291-R294 PolarHBondContact O-N 3.03Å; I291-T295 WeakPolarHBondContact O-CG2 3.36Å; I291-T295 PolarHBondContact O-N 3.47Å; I291-T295 VanDerWaalsContact O-N 3.16Å; I291-T295 PolarHBondContact O-OG1 3.14Å; I291-F483 HydrophobicContact CB-CD2 4.44Å; I291-F483 HydrophobicContact CB-CE2 3.83Å; I291-F483 HydrophobicContact CB-CZ 4.41Å; I291-F483 HydrophobicContact CD1-CD2 3.86Å; I291-F483 HydrophobicContact CD1-CE2 4.12Å; I291-F483 HydrophobicContact CG2-CD2 4.3Å; I291-F483 HydrophobicContact CG2-CE2 3.72Å; I291-F483 HydrophobicContact CG2-CZ 3.9Å; I291-P488 HydrophobicContact CD1-CG 3.95Å; I291-P488 HydrophobicContact CG2-CB 3.91Å; I291-P488 HydrophobicContact CG2-CG 3.7Å; I291-E489 HydrophobicContact CG2-CG 4.25Å
292	I	94.3	Very high	92.4	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-58	-48	174	-73.8	175.4	0	0	0	110.7	I278 R288 I289 R294 T295 W296 A297 Y305 D357 F483	I278-I292 HydrophobicContact CG2-CD1 4.14Å; R288-I292 PolarHBondContact O-N 3.18Å; R288-I292 VanDerWaalsContact O-N 3.15Å; I289-I292 PolarHBondContact O-N 3.1Å; I289-I292 VanDerWaalsContact O-N 3.16Å; I292-R294 VanDerWaalsContact C-N 3.27Å; I292-R294 PolarHBondContact O-N 3.36Å; I292-T295 PolarHBondContact O-N 3.25Å; I292-T295 PolarHBondContact O-OG1 3.02Å; I292-T295 VanDerWaalsContact O-OG1 3.12Å; I292-W296 HydrophobicContact CD1-CZ2 4.45Å; I292-W296 HydrophobicContact CG2-CH2 4.36Å; I292-W296 HydrophobicContact CG2-CZ2 3.84Å; I292-W296 PolarHBondContact O-N 3.16Å; I292-A297 HydrophobicContact CG2-CB 3.57Å; I292-A297 WeakPolarHBondContact O-CB 3.42Å; I292-A297 PolarHBondContact O-N 3.07Å; I292-Y305 HydrophobicContact CG2-CE1 4.2Å; I292-Y305 WeakPolarHBondContact CG2-OH 3.45Å; I292-D357 HydrophobicContact CD1-CB 4.22Å; I292-D357 WeakPolarHBondContact CD1-O 3.34Å; I292-F483 HydrophobicContact CG1-CZ 4.19Å
293	E	92.7	Very high	92.3	Very high	65 Å²	65	61.9 Å²	61.9	30%	0.304	28%	0.284	S	S	.	.	H	α-helix	trans	-61.4	-31.1	178.9	-72.8	-66.8	156.4	0	0	113.4	I289 I291 R303 Y305	I289-E293 HydrophobicContact CG2-CG 4.43Å; I289-E293 PolarHBondContact O-N 2.83Å; I291-E293 VanDerWaalsContact C-N 3.35Å; I291-E293 PolarHBondContact O-N 2.85Å; E293-R303 VanDerWaalsContact CD-NH2 3.33Å; E293-R303 IonicContact OE1-CZ 2.93Å; E293-R303 IonicContact OE1-NE 3.64Å; E293-R303 PolarHBondContact OE1-NE 3.29Å; E293-R303 IonicContact OE1-NH2 3.25Å; E293-R303 PolarHBondContact OE1-NH2 3.33Å; E293-R303 IonicContact OE2-CZ 3.85Å; E293-R303 IonicContact OE2-NE 3.94Å; E293-R303 IonicContact OE2-NH2 3.49Å; E293-R303 PolarHBondContact OE2-NH2 3.44Å; E293-Y305 VanDerWaalsContact CD-OH 3.29Å; E293-Y305 VanDerWaalsContact OE1-CE2 3.25Å; E293-Y305 WeakPolarHBondContact OE1-CE2 3.48Å; E293-Y305 VanDerWaalsContact OE1-CZ 3.28Å; E293-Y305 PolarHBondContact OE1-OH 3.4Å
294	R	92	Very high	92.3	Very high	143 Å²	143	58.4 Å²	58.4	54%	0.54	27%	0.267	S	S	.	.	H	α-helix	trans	-83	-10.2	174.9	-72	-168.8	-59.4	-84.3	2.4	114.6	P290 I291 I292 E489	P290-R294 WeakPolarHBondContact O-CG 3.49Å; P290-R294 PolarHBondContact O-N 2.92Å; P290-R294 VanDerWaalsContact O-N 3.13Å; P290-R294 PolarHBondContact O-NH1 3.12Å; I291-R294 PolarHBondContact O-N 3.03Å; I292-R294 VanDerWaalsContact C-N 3.27Å; I292-R294 PolarHBondContact O-N 3.36Å; R294-E489 IonicContact CZ-OE1 3.2Å; R294-E489 IonicContact NE-OE1 2.78Å; R294-E489 PolarHBondContact NE-OE1 3.48Å; R294-E489 IonicContact NE-OE2 3.84Å; R294-E489 IonicContact NH2-OE1 3.61Å; R294-E489 PolarHBondContact NH2-OE1 3.07Å
295	T	92	Very high	92.4	Very high	7 Å²	7	56.9 Å²	56.9	4%	0.043	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-102.9	-175.8	54.5	0	0	0	0	111.4	I291 I292 L360 E489 Y492	I291-T295 WeakPolarHBondContact O-CG2 3.36Å; I291-T295 PolarHBondContact O-N 3.47Å; I291-T295 VanDerWaalsContact O-N 3.16Å; I291-T295 PolarHBondContact O-OG1 3.14Å; I292-T295 PolarHBondContact O-N 3.25Å; I292-T295 PolarHBondContact O-OG1 3.02Å; I292-T295 VanDerWaalsContact O-OG1 3.12Å; T295-L360 HydrophobicContact CG2-CD2 4.38Å; T295-E489 HydrophobicContact CG2-CG 4.19Å; T295-Y492 HydrophobicContact CG2-CD1 3.74Å; T295-Y492 HydrophobicContact CG2-CD2 4.48Å; T295-Y492 HydrophobicContact CG2-CE1 4.45Å; T295-Y492 HydrophobicContact CG2-CG 3.76Å; T295-Y492 PolarHBondContact O-OH 2.96Å
296	W	91.4	Very high	92.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-19.1	-170.2	61.7	-97.1	0	0	0	113.5	F276 I278 I292 A298 D299 A300 V355 T359 L361 L363 Y492	F276-W296 HydrophobicContact CB-CH2 4.47Å; F276-W296 HydrophobicContact CB-CZ3 4.27Å; F276-W296 HydrophobicContact CD1-CH2 4.32Å; F276-W296 AromaticContact CD1-CZ3 3.8Å; F276-W296 HydrophobicContact CD1-CZ3 3.8Å; F276-W296 HydrophobicContact CE1-CZ3 4.4Å; F276-W296 HydrophobicContact CG-CZ3 4.09Å; I278-W296 HydrophobicContact CD1-CH2 4.07Å; I278-W296 HydrophobicContact CG1-CH2 3.77Å; I278-W296 HydrophobicContact CG1-CZ2 4.3Å; I292-W296 HydrophobicContact CD1-CZ2 4.45Å; I292-W296 HydrophobicContact CG2-CH2 4.36Å; I292-W296 HydrophobicContact CG2-CZ2 3.84Å; I292-W296 PolarHBondContact O-N 3.16Å; W296-A298 PolarHBondContact O-N 3.12Å; W296-D299 PolarHBondContact O-N 3.21Å; W296-A300 HydrophobicContact CE3-CB 3.83Å; W296-A300 HydrophobicContact CZ3-CB 3.69Å; W296-A300 PolarHBondContact O-N 3.17Å; W296-V355 HydrophobicContact CH2-CG2 4.06Å; W296-V355 HydrophobicContact CZ2-CG2 4.11Å; W296-T359 PolarHBondContact NE1-O 3.31Å; W296-L361 HydrophobicContact CB-CB 4.13Å; W296-L361 WeakPolarHBondContact CB-O 2.75Å; W296-L361 HydrophobicContact CD2-CB 3.98Å; W296-L361 HydrophobicContact CD2-CD1 3.75Å; W296-L361 HydrophobicContact CD2-CG 3.84Å; W296-L361 HydrophobicContact CE3-CB 4.48Å; W296-L361 HydrophobicContact CE3-CD1 3.7Å; W296-L361 HydrophobicContact CE3-CG 4.31Å; W296-L361 HydrophobicContact CG-CB 3.82Å; W296-L361 HydrophobicContact CG-CD1 4.48Å; W296-L361 HydrophobicContact CG-CG 4.12Å; W296-L361 HydrophobicContact CH2-CD1 3.76Å; W296-L361 HydrophobicContact CZ2-CD1 3.82Å; W296-L361 HydrophobicContact CZ2-CG 4.14Å; W296-L361 HydrophobicContact CZ3-CD1 3.7Å; W296-L363 HydrophobicContact CB-CD1 4.39Å; W296-L363 HydrophobicContact CB-CG 4.49Å; W296-L363 HydrophobicContact CD2-CD1 4.43Å; W296-L363 HydrophobicContact CE3-CD1 3.6Å; W296-L363 HydrophobicContact CZ3-CD1 4.27Å; W296-Y492 HydrophobicContact CB-CE2 3.89Å
297	A	90.6	Very high	92.6	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-67.9	-20.5	-175.2	0	0	0	0	0	113.8	I292 D299 A300 R303	I292-A297 HydrophobicContact CG2-CB 3.57Å; I292-A297 WeakPolarHBondContact O-CB 3.42Å; I292-A297 PolarHBondContact O-N 3.07Å; A297-D299 PolarHBondContact O-N 2.83Å; A297-A300 PolarHBondContact O-N 3.38Å; A297-A300 VanDerWaalsContact O-N 3.1Å; A297-R303 PolarHBondContact O-NH1 3.06Å
298	A	85.1	Confident	92.7	Very high	74 Å²	74	43.2 Å²	43.2	61%	0.612	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-58.7	-33.4	171.2	0	0	0	0	0	112.5	W296	W296-A298 PolarHBondContact O-N 3.12Å
299	D	83.9	Confident	92.6	Very high	66 Å²	66	45 Å²	45	35%	0.353	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-91.6	-8.2	178.3	-67.3	-41.3	0	0	0	112.5	W296 A297 L363 H364	W296-D299 PolarHBondContact O-N 3.21Å; A297-D299 PolarHBondContact O-N 2.83Å; D299-L363 HydrophobicContact CB-CB 3.88Å; D299-H364 IonicContact OD2-CG 2.74Å; D299-H364 IonicContact OD2-ND1 3.99Å; D299-H364 PolarHBondContact OD2-ND1 3.16Å
300	A	89.4	Confident	92.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.242	C	C	.	.			trans	-99.5	85.5	-179.4	0	0	0	0	0	111.9	F276 W296 A297 R303 L363	F276-A300 HydrophobicContact CD1-CB 4.45Å; F276-A300 HydrophobicContact CD2-CB 3.57Å; F276-A300 HydrophobicContact CE2-CB 3.71Å; F276-A300 HydrophobicContact CG-CB 3.96Å; F276-A300 HydrophobicContact CZ-CB 4.22Å; W296-A300 HydrophobicContact CE3-CB 3.83Å; W296-A300 HydrophobicContact CZ3-CB 3.69Å; W296-A300 PolarHBondContact O-N 3.17Å; A297-A300 PolarHBondContact O-N 3.38Å; A297-A300 VanDerWaalsContact O-N 3.1Å; A300-R303 HydrophobicContact CB-CB 4.43Å; A300-R303 WeakPolarHBondContact O-CD 3.19Å; A300-R303 WeakPolarHBondContact O-CG 3.37Å; A300-R303 PolarHBondContact O-NH1 3.33Å; A300-L363 HydrophobicContact CB-CD1 3.8Å
301	R	86.5	Confident	92.3	Very high	210 Å²	210	48.9 Å²	48.9	79%	0.792	24%	0.244	S	C	*	.	S	Bend	trans	-66.3	-45.6	-176.9	-66.2	-172.4	178.7	-148.5	-0.7	113.6	R303	R301-R303 PolarHBondContact O-N 3.08Å
302	N	91.8	Very high	91.8	Very high	41 Å²	41	55 Å²	55	22%	0.219	28%	0.282	C	S	.	.	S	Bend	trans	-93.5	78.5	-179.2	-44	-61.2	0	0	0	109	S272 I274 Y275 F276 I349	S272-N302 PolarHBondContact O-ND2 3.11Å; I274-N302 WeakPolarHBondContact O-CB 3.44Å; I274-N302 PolarHBondContact O-ND2 3.07Å; Y275-N302 CarbonylContact C-O 3.54Å; Y275-N302 WeakPolarHBondContact CA-O 3.32Å; Y275-N302 HydrophobicContact CD2-CB 4.2Å; F276-N302 PolarHBondContact N-O 2.88Å; N302-I349 HydrophobicContact CB-CD1 4.02Å; N302-I349 VanDerWaalsContact ND2-CD1 3.3Å; N302-I349 WeakPolarHBondContact ND2-CD1 3.26Å
303	R	93.4	Very high	91.3	Very high	70 Å²	70	58.1 Å²	58.1	26%	0.264	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	147.5	-178.8	71.9	179.7	-178.8	-76.3	4.9	112.1	F276 I278 E293 A297 A300 R301	F276-R303 HydrophobicContact CB-CB 3.93Å; F276-R303 WeakPolarHBondContact O-CA 3.18Å; I278-R303 HydrophobicContact CD1-CB 3.92Å; E293-R303 VanDerWaalsContact CD-NH2 3.33Å; E293-R303 IonicContact OE1-CZ 2.93Å; E293-R303 IonicContact OE1-NE 3.64Å; E293-R303 PolarHBondContact OE1-NE 3.29Å; E293-R303 IonicContact OE1-NH2 3.25Å; E293-R303 PolarHBondContact OE1-NH2 3.33Å; E293-R303 IonicContact OE2-CZ 3.85Å; E293-R303 IonicContact OE2-NE 3.94Å; E293-R303 IonicContact OE2-NH2 3.49Å; E293-R303 PolarHBondContact OE2-NH2 3.44Å; A297-R303 PolarHBondContact O-NH1 3.06Å; A300-R303 HydrophobicContact CB-CB 4.43Å; A300-R303 WeakPolarHBondContact O-CD 3.19Å; A300-R303 WeakPolarHBondContact O-CG 3.37Å; A300-R303 PolarHBondContact O-NH1 3.33Å; R301-R303 PolarHBondContact O-N 3.08Å
304	R	95.2	Very high	90.6	Very high	84 Å²	84	56.5 Å²	56.5	32%	0.317	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	138.8	168.5	-72	-58.5	-171.4	-173.8	0.5	111.5	Y275 F276 I278 Y306 I317 D342	Y275-R304 HydrophobicContact CE2-CG 4.38Å; Y275-R304 WeakPolarHBondContact OH-CG 2.97Å; F276-R304 PolarHBondContact O-N 3.01Å; I278-R304 VanDerWaalsContact CD1-O 3.26Å; I278-R304 WeakPolarHBondContact CD1-O 3.22Å; I278-R304 PolarHBondContact N-O 3.44Å; R304-Y306 HydrophobicContact CB-CD2 4.26Å; R304-Y306 HydrophobicContact CB-CE1 4.4Å; R304-Y306 HydrophobicContact CB-CE2 3.69Å; R304-I317 HydrophobicContact CG-CD1 4.22Å; R304-D342 WeakPolarHBondContact CG-OD2 3.35Å; R304-D342 IonicContact CZ-OD2 3.87Å; R304-D342 IonicContact NE-OD2 2.96Å; R304-D342 PolarHBondContact NE-OD2 2.72Å; R304-D342 IonicContact NH2-OD1 3.03Å; R304-D342 IonicContact NH2-OD2 3.21Å
305	Y	96.9	Very high	90	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.008	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.4	166.9	-58.4	-71	0	0	0	108.9	I278 I289 I292 E293 A316 I317	I278-Y305 HydrophobicContact CB-CD1 3.72Å; I278-Y305 HydrophobicContact CB-CE1 4.06Å; I278-Y305 HydrophobicContact CD1-CD1 4.27Å; I278-Y305 HydrophobicContact CD1-CE1 4.11Å; I278-Y305 HydrophobicContact CG1-CD1 4.2Å; I278-Y305 HydrophobicContact CG1-CE1 4.07Å; I278-Y305 HydrophobicContact CG2-CD1 3.81Å; I278-Y305 HydrophobicContact CG2-CE1 4.05Å; I289-Y305 HydrophobicContact CD1-CD1 3.66Å; I289-Y305 HydrophobicContact CD1-CE1 3.86Å; I289-Y305 HydrophobicContact CD1-CG 4.46Å; I289-Y305 HydrophobicContact CG2-CD1 4.34Å; I289-Y305 HydrophobicContact CG2-CD2 4.49Å; I289-Y305 HydrophobicContact CG2-CE1 4.01Å; I289-Y305 HydrophobicContact CG2-CE2 4.15Å; I292-Y305 HydrophobicContact CG2-CE1 4.2Å; I292-Y305 WeakPolarHBondContact CG2-OH 3.45Å; E293-Y305 VanDerWaalsContact CD-OH 3.29Å; E293-Y305 VanDerWaalsContact OE1-CE2 3.25Å; E293-Y305 WeakPolarHBondContact OE1-CE2 3.48Å; E293-Y305 VanDerWaalsContact OE1-CZ 3.28Å; E293-Y305 PolarHBondContact OE1-OH 3.4Å; Y305-A316 CarbonylContact O-C 3.52Å; Y305-A316 VanDerWaalsContact O-CA 3.28Å; Y305-A316 WeakPolarHBondContact O-CA 3.48Å; Y305-I317 PolarHBondContact O-N 2.9Å
306	Y	97.3	Very high	89.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	121.5	178.2	-66.3	-77.5	0	0	0	110.3	Y275 A277 I278 T280 R304 I317 T319 I335 L338 S339	Y275-Y306 HydrophobicContact CE1-CE2 4.4Å; Y275-Y306 PolarHBondContact OH-OH 2.88Å; A277-Y306 HydrophobicContact CB-CD2 4.29Å; A277-Y306 HydrophobicContact CB-CE2 3.85Å; I278-Y306 PolarHBondContact O-N 3.15Å; T280-Y306 WeakPolarHBondContact CG2-O 3.32Å; T280-Y306 PolarHBondContact N-O 3Å; R304-Y306 HydrophobicContact CB-CD2 4.26Å; R304-Y306 HydrophobicContact CB-CE1 4.4Å; R304-Y306 HydrophobicContact CB-CE2 3.69Å; Y306-I317 WeakPolarHBondContact CA-O 3.45Å; Y306-I317 HydrophobicContact CD1-CB 4.1Å; Y306-I317 HydrophobicContact CD1-CG2 4.45Å; Y306-I317 HydrophobicContact CE1-CB 4.31Å; Y306-I317 HydrophobicContact CE1-CD1 4.37Å; Y306-T319 HydrophobicContact CD1-CG2 4.38Å; Y306-I335 VanDerWaalsContact CB-CG1 3.48Å; Y306-I335 HydrophobicContact CD1-CG1 4.4Å; Y306-I335 HydrophobicContact CD2-CB 4.36Å; Y306-I335 HydrophobicContact CD2-CG1 4.09Å; Y306-I335 HydrophobicContact CD2-CG2 3.62Å; Y306-I335 HydrophobicContact CE2-CG2 3.86Å; Y306-I335 HydrophobicContact CG-CB 4.41Å; Y306-I335 HydrophobicContact CG-CD1 4.4Å; Y306-I335 HydrophobicContact CG-CG1 3.77Å; Y306-I335 HydrophobicContact CG-CG2 4.16Å; Y306-L338 HydrophobicContact CD1-CB 4.45Å; Y306-L338 HydrophobicContact CD1-CD1 4.2Å; Y306-L338 HydrophobicContact CE1-CB 3.71Å; Y306-L338 HydrophobicContact CE1-CD1 4.22Å; Y306-S339 WeakPolarHBondContact CE2-OG 3.37Å; Y306-S339 WeakPolarHBondContact OH-CA 3.44Å; Y306-S339 WeakPolarHBondContact OH-CB 3.21Å; Y306-S339 PolarHBondContact OH-N 3.02Å; Y306-S339 PolarHBondContact OH-OG 3.46Å
307	S	97.1	Very high	89.7	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	169	-172.2	-168.7	0	0	0	0	111.4	C281 A282 H285 V309 I317 G318 T319	C281-S307 WeakPolarHBondContact CA-OG 3.31Å; A282-S307 PolarHBondContact N-OG 2.9Å; H285-S307 WeakPolarHBondContact NE2-CB 3.5Å; H285-S307 PolarHBondContact NE2-OG 2.92Å; S307-V309 VanDerWaalsContact C-N 3.31Å; S307-V309 VanDerWaalsContact CB-O 3.24Å; S307-V309 WeakPolarHBondContact CB-O 3.5Å; S307-V309 PolarHBondContact OG-N 3.05Å; S307-V309 PolarHBondContact OG-O 3.11Å; S307-I317 PolarHBondContact N-O 3.04Å; S307-G318 WeakPolarHBondContact O-CA 3.17Å; S307-T319 WeakPolarHBondContact O-CG2 3.32Å; S307-T319 PolarHBondContact O-N 2.85Å; S307-T319 PolarHBondContact O-OG1 3.07Å
308	D	95.7	Very high	89.9	Confident	43 Å²	43	57.7 Å²	57.7	23%	0.23	34%	0.336	C	S	.	.	S	Bend	trans	-73.6	-28.1	167.1	54.3	-53.6	0	0	0	111.3	C281 A282 I321 N323 K331	C281-D308 WeakPolarHBondContact CA-OD1 3.18Å; C281-D308 WeakPolarHBondContact CB-OD1 3.38Å; A282-D308 PolarHBondContact N-OD1 3.33Å; D308-I321 WeakPolarHBondContact CB-O 3.35Å; D308-N323 HydrophobicContact CB-CB 4.05Å; D308-K331 IonicContact OD1-NZ 3.45Å
309	V	95	Very high	90.4	Very high	77 Å²	77	54.9 Å²	54.9	47%	0.467	31%	0.311	S	S	.	.	S	Bend	trans	-123.8	129	177.5	-177.5	0	0	0	0	109.4	A282 H285 S307	A282-V309 HydrophobicContact CB-CB 4.04Å; A282-V309 HydrophobicContact CB-CG2 3.97Å; H285-V309 PolarHBondContact CE1-O 3.13Å; S307-V309 VanDerWaalsContact C-N 3.31Å; S307-V309 VanDerWaalsContact CB-O 3.24Å; S307-V309 WeakPolarHBondContact CB-O 3.5Å; S307-V309 PolarHBondContact OG-N 3.05Å; S307-V309 PolarHBondContact OG-O 3.11Å
310	A	93.2	Very high	90.9	Very high	68 Å²	68	55 Å²	55	56%	0.562	33%	0.329	S	S	*	.			trans	-68.2	143	174.4	0	0	0	0	0	110.8	A316	A310-A316 WeakPolarHBondContact CA-O 3.48Å
311	D	90.7	Very high	91.2	Very high	54 Å²	54	57.4 Å²	57.4	29%	0.289	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-140.7	117.9	178.8	-170.6	-24.1	0	0	0	109.4	H285 G313 I314 A316	H285-D311 IonicContact CE1-OD2 2.63Å; H285-D311 IonicContact CG-OD2 3.09Å; H285-D311 WeakPolarHBondContact ND1-CB 3.49Å; H285-D311 IonicContact ND1-OD2 3.44Å; H285-D311 PolarHBondContact ND1-OD2 3.35Å; D311-G313 VanDerWaalsContact C-N 3.31Å; D311-G313 PolarHBondContact OD1-N 3.16Å; D311-I314 HydrophobicContact CB-CD1 4.39Å; D311-I314 HydrophobicContact CB-CG1 3.96Å; D311-I314 CarbonylContact O-C 3.59Å; D311-A316 HydrophobicContact CB-CB 4.36Å; D311-A316 PolarHBondContact N-O 3.27Å; D311-A316 PolarHBondContact O-N 2.92Å; D311-A316 VanDerWaalsContact O-N 3.1Å
312	V	83.6	Confident	91.5	Very high	152 Å²	152	52.2 Å²	52.2	92%	0.921	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-21.3	-178.8	-74	0	0	0	0	112.7	I314	V312-I314 VanDerWaalsContact C-N 3.32Å
313	G	83.6	Confident	91.6	Very high	65 Å²	65	53 Å²	53	67%	0.67	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-21.7	179	0	0	0	0	0	113.7	D311	D311-G313 VanDerWaalsContact C-N 3.31Å; D311-G313 PolarHBondContact OD1-N 3.16Å
314	I	79.3	Confident	91.7	Very high	30 Å²	30	51.4 Å²	51.4	15%	0.154	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.3	93.5	174.3	43.3	139.4	0	0	0	106.9	H285 I289 D311 V312 A316	H285-I314 HydrophobicContact CB-CD1 3.51Å; H285-I314 HydrophobicContact CB-CG1 4.38Å; H285-I314 VanDerWaalsContact CG-CD1 3.42Å; I289-I314 HydrophobicContact CB-CD1 4.28Å; I289-I314 HydrophobicContact CG1-CD1 3.97Å; I289-I314 HydrophobicContact CG2-CB 4.13Å; I289-I314 HydrophobicContact CG2-CD1 4.2Å; I289-I314 HydrophobicContact CG2-CG2 3.94Å; D311-I314 HydrophobicContact CB-CD1 4.39Å; D311-I314 HydrophobicContact CB-CG1 3.96Å; D311-I314 CarbonylContact O-C 3.59Å; V312-I314 VanDerWaalsContact C-N 3.32Å; I314-A316 HydrophobicContact CD1-CB 4.43Å; I314-A316 WeakPolarHBondContact O-CA 3.44Å; I314-A316 WeakPolarHBondContact O-CB 3.48Å; I314-A316 PolarHBondContact O-N 3.48Å
315	P	79.1	Confident	91.5	Very high	79 Å²	79	56 Å²	56	51%	0.513	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	75.9	-154.4	25	-37.5	0	0	0	114.6
316	A	85.7	Confident	91.1	Very high	8 Å²	8	60 Å²	60	7%	0.066	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129.2	-167	0	0	0	0	0	108.5	Y305 A310 D311 I314	Y305-A316 CarbonylContact O-C 3.52Å; Y305-A316 VanDerWaalsContact O-CA 3.28Å; Y305-A316 WeakPolarHBondContact O-CA 3.48Å; A310-A316 WeakPolarHBondContact CA-O 3.48Å; D311-A316 HydrophobicContact CB-CB 4.36Å; D311-A316 PolarHBondContact N-O 3.27Å; D311-A316 PolarHBondContact O-N 2.92Å; D311-A316 VanDerWaalsContact O-N 3.1Å; I314-A316 HydrophobicContact CD1-CB 4.43Å; I314-A316 WeakPolarHBondContact O-CA 3.44Å; I314-A316 WeakPolarHBondContact O-CB 3.48Å; I314-A316 PolarHBondContact O-N 3.48Å
317	I	90.8	Very high	90.7	Very high	56 Å²	56	60.9 Å²	60.9	29%	0.287	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.6	-178.7	-60.3	177.2	0	0	0	108.2	R304 Y305 Y306 S307 T319	R304-I317 HydrophobicContact CG-CD1 4.22Å; Y305-I317 PolarHBondContact O-N 2.9Å; Y306-I317 WeakPolarHBondContact CA-O 3.45Å; Y306-I317 HydrophobicContact CD1-CB 4.1Å; Y306-I317 HydrophobicContact CD1-CG2 4.45Å; Y306-I317 HydrophobicContact CE1-CB 4.31Å; Y306-I317 HydrophobicContact CE1-CD1 4.37Å; S307-I317 PolarHBondContact N-O 3.04Å; I317-T319 PolarHBondContact O-N 3.12Å
318	G	93.8	Very high	90.7	Very high	32 Å²	32	63 Å²	63	33%	0.33	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	122.8	170.7	0	0	0	0	0	110.4	S307 G320	S307-G318 WeakPolarHBondContact O-CA 3.17Å; G318-G320 PolarHBondContact O-N 3.32Å
319	T	95.9	Very high	90.8	Very high	16 Å²	16	61 Å²	61	10%	0.098	39%	0.394	C	S	.	.			trans	-73.9	-15.2	176.7	53.9	0	0	0	0	113	Y306 S307 I317 I321 K331 I335 L338	Y306-T319 HydrophobicContact CD1-CG2 4.38Å; S307-T319 WeakPolarHBondContact O-CG2 3.32Å; S307-T319 PolarHBondContact O-N 2.85Å; S307-T319 PolarHBondContact O-OG1 3.07Å; I317-T319 PolarHBondContact O-N 3.12Å; T319-I321 PolarHBondContact O-N 3.4Å; T319-I321 PolarHBondContact OG1-N 3.18Å; T319-K331 HydrophobicContact CG2-CG 4.21Å; T319-I335 HydrophobicContact CG2-CG1 3.88Å; T319-L338 HydrophobicContact CG2-CD1 4.29Å
320	G	94.4	Very high	90.9	Very high	69 Å²	69	58.5 Å²	58.5	71%	0.711	38%	0.382	S	S	*	.	S	Bend	trans	73.7	1.5	-170	0	0	0	0	0	113.7	G318	G318-G320 PolarHBondContact O-N 3.32Å
321	I	95.4	Very high	91.1	Very high	49 Å²	49	55.4 Å²	55.4	25%	0.251	36%	0.356	S	S	.	.			trans	-105.8	121	179.1	-55.2	-57.6	0	0	0	109.1	D308 T319 A330 K331 A334	D308-I321 WeakPolarHBondContact CB-O 3.35Å; T319-I321 PolarHBondContact O-N 3.4Å; T319-I321 PolarHBondContact OG1-N 3.18Å; I321-A330 HydrophobicContact CG2-CB 4.24Å; I321-K331 HydrophobicContact CB-CB 4.47Å; I321-K331 HydrophobicContact CG2-CB 4.21Å; I321-A334 HydrophobicContact CG1-CB 3.89Å
322	P	94.3	Very high	91.4	Very high	101 Å²	101	53.1 Å²	53.1	66%	0.656	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-58.5	147.9	174.9	-24.1	33.9	0	0	0	112.2	V324	P322-V324 PolarHBondContact O-N 3.26Å
323	N	94	Very high	92.1	Very high	58 Å²	58	47.2 Å²	47.2	31%	0.31	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-70	132.2	175.1	-166.5	61.8	0	0	0	111.4	C281 D308	C281-N323 HydrophobicContact CB-CB 4.29Å; D308-N323 HydrophobicContact CB-CB 4.05Å
324	V	94.3	Very high	92.8	Very high	37 Å²	37	44.8 Å²	44.8	22%	0.224	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-103.5	164.6	171.8	-67	0	0	0	0	110.1	P322 T326 H328 A434	P322-V324 PolarHBondContact O-N 3.26Å; V324-T326 WeakPolarHBondContact CG2-O 3.33Å; V324-H328 WeakPolarHBondContact CG2-ND1 3.41Å; V324-H328 PolarHBondContact O-CE1 2.92Å; V324-A434 HydrophobicContact CG1-CB 4.32Å
325	Q	90.7	Very high	93.7	Very high	180 Å²	180	43.4 Å²	43.4	84%	0.841	27%	0.273	S	S	*	.	S	Bend	trans	-78.8	-26.9	-179	-66.2	-62.1	-30.4	0	0	113.5
326	T	89.6	Confident	94.6	Very high	85 Å²	85	39.6 Å²	39.6	52%	0.521	25%	0.249	S	C	.	.	S	Bend	trans	-140.4	156.2	-176.6	59.9	0	0	0	0	110.7	V324 H328 S435	V324-T326 WeakPolarHBondContact CG2-O 3.33Å; T326-H328 PolarHBondContact O-N 3.11Å; T326-H328 VanDerWaalsContact O-N 3.16Å; T326-S435 VanDerWaalsContact O-CA 3.31Å; T326-S435 WeakPolarHBondContact O-CA 3.23Å
327	G	89	Confident	95.1	Very high	20 Å²	20	45.2 Å²	45.2	21%	0.206	27%	0.273	C	S	.	.			trans	80.1	-91.5	173.5	0	0	0	0	0	112.8	S435 A436	G327-S435 WeakPolarHBondContact CA-O 3.48Å; G327-A436 CarbonylContact C-O 3.48Å; G327-A436 WeakPolarHBondContact CA-O 3.41Å
328	H	95.7	Very high	95.4	Very high	44 Å²	44	45 Å²	45	20%	0.204	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	86.8	18.1	-176	-41.4	-75	0	0	0	116.3	K279 V324 T326 A330 K331 T332 A434 A436	K279-H328 HydrophobicContact CD-CB 4.36Å; V324-H328 WeakPolarHBondContact CG2-ND1 3.41Å; V324-H328 PolarHBondContact O-CE1 2.92Å; T326-H328 PolarHBondContact O-N 3.11Å; T326-H328 VanDerWaalsContact O-N 3.16Å; H328-A330 PolarHBondContact O-N 3.1Å; H328-K331 HydrophobicContact CB-CB 4.26Å; H328-K331 WeakPolarHBondContact O-CB 3.49Å; H328-K331 PolarHBondContact O-N 3.29Å; H328-T332 PolarHBondContact O-N 3.2Å; H328-T332 PolarHBondContact O-OG1 3.19Å; H328-A434 CarbonylContact C-O 3.58Å; H328-A434 WeakPolarHBondContact CA-O 3.45Å; H328-A434 PolarHBondContact N-O 2.9Å; H328-A436 PolarHBondContact N-O 2.71Å
329	C	97.7	Very high	95.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-49.8	-52.1	-179.2	-172.6	0	0	0	0	113.4	K331 T332 M333 C431 A434 A436 D438	C329-K331 VanDerWaalsContact C-N 3.26Å; C329-K331 PolarHBondContact O-N 2.65Å; C329-T332 PolarHBondContact O-N 2.67Å; C329-T332 VanDerWaalsContact O-N 3.11Å; C329-M333 PolarHBondContact O-N 3.42Å; C329-C431 VanDerWaalsContact CA-SG 3.6Å; C329-C431 HydrophobicContact CB-CB 3.78Å; C329-C431 WeakPolarHBondContact CB-SG 3.41Å; C329-C431 PolarHBondContact O-SG 3.2Å; C329-C431 VanDerWaalsContact SG-CA 3.53Å; C329-C431 WeakPolarHBondContact SG-CB 3.43Å; C329-C431 CovalentContact SG-SG 2.04Å; C329-C431 PolarHBondContact SG-SG 3.13Å; C329-A434 PolarHBondContact N-O 3.03Å; C329-A436 HydrophobicContact CB-CB 3.96Å; C329-A436 VanDerWaalsContact CB-O 3.32Å; C329-A436 WeakPolarHBondContact CB-O 3.08Å; C329-A436 PolarHBondContact N-O 3.33Å; C329-D438 HydrophobicContact CB-CB 4.26Å
330	A	97.3	Very high	95.6	Very high	25 Å²	25	44.6 Å²	44.6	21%	0.207	26%	0.262	C	S	.	.	H	α-helix	trans	-61.9	-36.6	-178	0	0	0	0	0	112.2	I321 H328 A334 C431 A434	I321-A330 HydrophobicContact CG2-CB 4.24Å; H328-A330 PolarHBondContact O-N 3.1Å; A330-A334 WeakPolarHBondContact O-CB 3.47Å; A330-A334 PolarHBondContact O-N 3.07Å; A330-C431 PolarHBondContact N-SG 3.19Å; A330-C431 VanDerWaalsContact N-SG 3.4Å; A330-A434 HydrophobicContact CB-CB 3.86Å
331	K	97.2	Very high	95.6	Very high	4 Å²	4	49.7 Å²	49.7	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-44.3	175.7	-164.7	178.5	-159.7	171	0	110.4	T280 D308 T319 I321 H328 C329 A334 I335	T280-K331 WeakPolarHBondContact O-CE 3.41Å; T280-K331 PolarHBondContact O-NZ 2.81Å; D308-K331 IonicContact OD1-NZ 3.45Å; T319-K331 HydrophobicContact CG2-CG 4.21Å; I321-K331 HydrophobicContact CB-CB 4.47Å; I321-K331 HydrophobicContact CG2-CB 4.21Å; H328-K331 HydrophobicContact CB-CB 4.26Å; H328-K331 WeakPolarHBondContact O-CB 3.49Å; H328-K331 PolarHBondContact O-N 3.29Å; C329-K331 VanDerWaalsContact C-N 3.26Å; C329-K331 PolarHBondContact O-N 2.65Å; K331-A334 WeakPolarHBondContact O-CB 3.29Å; K331-A334 PolarHBondContact O-N 3.25Å; K331-I335 HydrophobicContact CG-CD1 4.22Å; K331-I335 WeakPolarHBondContact O-CG1 3.32Å; K331-I335 PolarHBondContact O-N 3.35Å
332	T	98	Very high	95.5	Very high	5 Å²	5	49.9 Å²	49.9	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-43.6	177.6	-63.7	0	0	0	0	111.9	H328 C329 A334 I335 L336 L354 D438	H328-T332 PolarHBondContact O-N 3.2Å; H328-T332 PolarHBondContact O-OG1 3.19Å; C329-T332 PolarHBondContact O-N 2.67Å; C329-T332 VanDerWaalsContact O-N 3.11Å; T332-A334 PolarHBondContact O-N 3.34Å; T332-I335 WeakPolarHBondContact O-CB 3.5Å; T332-I335 PolarHBondContact O-N 3.3Å; T332-L336 WeakPolarHBondContact O-CG 3.41Å; T332-L336 PolarHBondContact O-N 3.16Å; T332-L354 HydrophobicContact CG2-CD2 3.72Å; T332-D438 HydrophobicContact CG2-CB 4.27Å; T332-D438 PolarHBondContact OG1-OD2 2.56Å
333	M	98	Very high	95.6	Very high	29 Å²	29	45.3 Å²	45.3	14%	0.143	24%	0.236	C	C	.	.	H	α-helix	trans	-62.6	-41.8	174.4	-66.8	-59.8	179.1	0	0	112.3	C329 I335 L336 Q337 I425 C429 C431	C329-M333 PolarHBondContact O-N 3.42Å; M333-I335 VanDerWaalsContact C-N 3.33Å; M333-I335 PolarHBondContact O-N 3.23Å; M333-L336 PolarHBondContact O-N 3Å; M333-Q337 PolarHBondContact O-N 3.16Å; M333-I425 HydrophobicContact CE-CG2 4.47Å; M333-I425 HydrophobicContact SD-CG2 4.03Å; M333-C429 HydrophobicContact CE-CB 3.66Å; M333-C429 HydrophobicContact SD-CB 4.39Å; M333-C431 WeakPolarHBondContact CG-SG 3.33Å
334	A	97.8	Very high	95.3	Very high	14 Å²	14	44.8 Å²	44.8	12%	0.116	24%	0.244	C	C	.	.	H	α-helix	trans	-62	-40.4	174.6	0	0	0	0	0	111.9	I321 A330 K331 T332 Q337 L338	I321-A334 HydrophobicContact CG1-CB 3.89Å; A330-A334 WeakPolarHBondContact O-CB 3.47Å; A330-A334 PolarHBondContact O-N 3.07Å; K331-A334 WeakPolarHBondContact O-CB 3.29Å; K331-A334 PolarHBondContact O-N 3.25Å; T332-A334 PolarHBondContact O-N 3.34Å; A334-Q337 PolarHBondContact O-N 2.85Å; A334-L338 WeakPolarHBondContact O-CB 3.45Å; A334-L338 VanDerWaalsContact O-CG 3.26Å; A334-L338 WeakPolarHBondContact O-CG 3.39Å; A334-L338 PolarHBondContact O-N 3.2Å
335	I	98.2	Very high	94.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.7	-46.8	175.4	-73.3	170.5	0	0	0	111.3	A277 K279 Y306 T319 K331 T332 M333 L338 S339 L354	A277-I335 HydrophobicContact CB-CG2 3.88Å; K279-I335 HydrophobicContact CB-CD1 3.74Å; K279-I335 HydrophobicContact CD-CD1 4.25Å; K279-I335 HydrophobicContact CG-CD1 3.68Å; Y306-I335 VanDerWaalsContact CB-CG1 3.48Å; Y306-I335 HydrophobicContact CD1-CG1 4.4Å; Y306-I335 HydrophobicContact CD2-CB 4.36Å; Y306-I335 HydrophobicContact CD2-CG1 4.09Å; Y306-I335 HydrophobicContact CD2-CG2 3.62Å; Y306-I335 HydrophobicContact CE2-CG2 3.86Å; Y306-I335 HydrophobicContact CG-CB 4.41Å; Y306-I335 HydrophobicContact CG-CD1 4.4Å; Y306-I335 HydrophobicContact CG-CG1 3.77Å; Y306-I335 HydrophobicContact CG-CG2 4.16Å; T319-I335 HydrophobicContact CG2-CG1 3.88Å; K331-I335 HydrophobicContact CG-CD1 4.22Å; K331-I335 WeakPolarHBondContact O-CG1 3.32Å; K331-I335 PolarHBondContact O-N 3.35Å; T332-I335 WeakPolarHBondContact O-CB 3.5Å; T332-I335 PolarHBondContact O-N 3.3Å; M333-I335 VanDerWaalsContact C-N 3.33Å; M333-I335 PolarHBondContact O-N 3.23Å; I335-L338 PolarHBondContact O-N 3.14Å; I335-S339 VanDerWaalsContact O-CB 3.25Å; I335-S339 WeakPolarHBondContact O-CB 3.4Å; I335-S339 PolarHBondContact O-N 3.19Å; I335-S339 PolarHBondContact O-OG 3.09Å; I335-L354 HydrophobicContact CG2-CD1 3.98Å
336	L	98.3	Very high	93.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.4	-43	178.7	-64.9	177.5	0	0	0	111.3	T332 M333 S339 L340 L352 L417 V422 I425 V426	T332-L336 WeakPolarHBondContact O-CG 3.41Å; T332-L336 PolarHBondContact O-N 3.16Å; M333-L336 PolarHBondContact O-N 3Å; L336-S339 PolarHBondContact O-N 2.87Å; L336-L340 PolarHBondContact O-N 3.44Å; L336-L352 HydrophobicContact CD2-CD1 4.3Å; L336-L352 HydrophobicContact CD2-CD2 3.87Å; L336-L417 HydrophobicContact CD2-CD1 4.05Å; L336-V422 HydrophobicContact CB-CG1 4.31Å; L336-V422 HydrophobicContact CD2-CG1 4.3Å; L336-I425 HydrophobicContact CD1-CG2 3.64Å; L336-V426 HydrophobicContact CB-CG2 3.86Å
337	Q	97.5	Very high	93.3	Very high	126 Å²	126	51.9 Å²	51.9	59%	0.589	27%	0.27	S	S	*	.	H	α-helix	trans	-64.1	-45.2	177.3	-171.9	176.8	5.6	0	0	112.4	M333 A334 S339 L340 K341 V426	M333-Q337 PolarHBondContact O-N 3.16Å; A334-Q337 PolarHBondContact O-N 2.85Å; Q337-S339 VanDerWaalsContact C-N 3.34Å; Q337-L340 PolarHBondContact O-N 2.78Å; Q337-K341 PolarHBondContact O-N 3.37Å; Q337-V426 HydrophobicContact CB-CG1 4.21Å; Q337-V426 HydrophobicContact CB-CG2 4.4Å; Q337-V426 HydrophobicContact CG-CG1 4.15Å
338	L	96.8	Very high	93.4	Very high	52 Å²	52	56.5 Å²	56.5	27%	0.272	29%	0.291	S	S	.	.	H	α-helix	trans	-65.4	-38.1	176.7	-71.9	169.8	0	0	0	111.7	Y306 T319 A334 I335 K341 D342	Y306-L338 HydrophobicContact CD1-CB 4.45Å; Y306-L338 HydrophobicContact CD1-CD1 4.2Å; Y306-L338 HydrophobicContact CE1-CB 3.71Å; Y306-L338 HydrophobicContact CE1-CD1 4.22Å; T319-L338 HydrophobicContact CG2-CD1 4.29Å; A334-L338 WeakPolarHBondContact O-CB 3.45Å; A334-L338 VanDerWaalsContact O-CG 3.26Å; A334-L338 WeakPolarHBondContact O-CG 3.39Å; A334-L338 PolarHBondContact O-N 3.2Å; I335-L338 PolarHBondContact O-N 3.14Å; L338-K341 WeakPolarHBondContact O-CB 3.21Å; L338-K341 PolarHBondContact O-N 3.42Å; L338-K341 VanDerWaalsContact O-N 3.15Å; L338-D342 PolarHBondContact O-N 3.3Å
339	S	97	Very high	93.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64	-42.5	176.9	-59	0	0	0	0	111.6	Y275 Y306 I335 L336 Q337 K341 D342 I343 L352	Y275-S339 WeakPolarHBondContact CE1-OG 3.39Å; Y306-S339 WeakPolarHBondContact CE2-OG 3.37Å; Y306-S339 WeakPolarHBondContact OH-CA 3.44Å; Y306-S339 WeakPolarHBondContact OH-CB 3.21Å; Y306-S339 PolarHBondContact OH-N 3.02Å; Y306-S339 PolarHBondContact OH-OG 3.46Å; I335-S339 VanDerWaalsContact O-CB 3.25Å; I335-S339 WeakPolarHBondContact O-CB 3.4Å; I335-S339 PolarHBondContact O-N 3.19Å; I335-S339 PolarHBondContact O-OG 3.09Å; L336-S339 PolarHBondContact O-N 2.87Å; Q337-S339 VanDerWaalsContact C-N 3.34Å; S339-K341 PolarHBondContact O-N 3.05Å; S339-D342 PolarHBondContact O-N 3.47Å; S339-I343 WeakPolarHBondContact O-CB 3.46Å; S339-I343 WeakPolarHBondContact O-CD1 3.28Å; S339-I343 WeakPolarHBondContact O-CG1 3.09Å; S339-I343 PolarHBondContact O-N 2.66Å; S339-L352 VanDerWaalsContact CB-CD1 3.5Å
340	L	96.5	Very high	93.2	Very high	38 Å²	38	57 Å²	57	20%	0.199	29%	0.291	C	S	.	.	H	α-helix	trans	-59	-37.8	173.3	-74.6	179.9	0	0	0	112.3	L336 Q337 G344 L419 V422 R423 V426	L336-L340 PolarHBondContact O-N 3.44Å; Q337-L340 PolarHBondContact O-N 2.78Å; L340-G344 PolarHBondContact O-N 2.89Å; L340-L419 HydrophobicContact CD2-CD1 3.58Å; L340-V422 HydrophobicContact CD1-CG1 4.02Å; L340-V422 HydrophobicContact CD2-CB 4Å; L340-V422 HydrophobicContact CD2-CG1 3.62Å; L340-V422 HydrophobicContact CG-CB 4.49Å; L340-V422 HydrophobicContact CG-CG1 3.63Å; L340-R423 HydrophobicContact CD1-CG 4.17Å; L340-R423 HydrophobicContact CD2-CG 3.88Å; L340-V426 HydrophobicContact CD1-CB 3.96Å; L340-V426 HydrophobicContact CD1-CG1 4.31Å; L340-V426 HydrophobicContact CD1-CG2 3.73Å
341	K	95.3	Very high	93.2	Very high	176 Å²	176	55.8 Å²	55.8	77%	0.765	28%	0.281	S	S	*	.	H	α-helix	trans	-69.2	-43	177.9	-171.7	-178.7	177.5	-176.3	0	112.1	Q337 L338 S339 G344	Q337-K341 PolarHBondContact O-N 3.37Å; L338-K341 WeakPolarHBondContact O-CB 3.21Å; L338-K341 PolarHBondContact O-N 3.42Å; L338-K341 VanDerWaalsContact O-N 3.15Å; S339-K341 PolarHBondContact O-N 3.05Å; K341-G344 PolarHBondContact O-N 3.09Å
342	D	93.5	Very high	93.2	Very high	54 Å²	54	55.6 Å²	55.6	29%	0.289	28%	0.28	S	S	.	.	H	α-helix	trans	-68.8	-41.7	179.4	-161.9	40	0	0	0	111.7	Y275 R304 L338 S339 G344	Y275-D342 HydrophobicContact CE2-CB 4.35Å; Y275-D342 WeakPolarHBondContact OH-CB 3.48Å; Y275-D342 PolarHBondContact OH-OD2 3.49Å; R304-D342 WeakPolarHBondContact CG-OD2 3.35Å; R304-D342 IonicContact CZ-OD2 3.87Å; R304-D342 IonicContact NE-OD2 2.96Å; R304-D342 PolarHBondContact NE-OD2 2.72Å; R304-D342 IonicContact NH2-OD1 3.03Å; R304-D342 IonicContact NH2-OD2 3.21Å; L338-D342 PolarHBondContact O-N 3.3Å; S339-D342 PolarHBondContact O-N 3.47Å; D342-G344 VanDerWaalsContact C-N 3.3Å; D342-G344 PolarHBondContact O-N 3.23Å
343	I	95.1	Very high	93.2	Very high	5 Å²	5	55.4 Å²	55.4	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-60.1	-43.6	173.3	-66.4	164.9	0	0	0	109.9	Y275 S339 K345 Q346 I349 L352 L419	Y275-I343 HydrophobicContact CD1-CD1 4.14Å; Y275-I343 HydrophobicContact CD1-CG1 4.38Å; Y275-I343 HydrophobicContact CD2-CD1 4.13Å; Y275-I343 HydrophobicContact CD2-CG1 3.54Å; Y275-I343 HydrophobicContact CE2-CG1 3.95Å; Y275-I343 HydrophobicContact CG-CD1 3.79Å; Y275-I343 HydrophobicContact CG-CG1 3.76Å; S339-I343 WeakPolarHBondContact O-CB 3.46Å; S339-I343 WeakPolarHBondContact O-CD1 3.28Å; S339-I343 WeakPolarHBondContact O-CG1 3.09Å; S339-I343 PolarHBondContact O-N 2.66Å; I343-K345 PolarHBondContact O-N 3.11Å; I343-K345 VanDerWaalsContact O-N 3.09Å; I343-Q346 HydrophobicContact CG2-CB 4.5Å; I343-Q346 VanDerWaalsContact O-CB 3.23Å; I343-Q346 WeakPolarHBondContact O-CB 3.3Å; I343-Q346 VanDerWaalsContact O-CG 3.24Å; I343-Q346 WeakPolarHBondContact O-CG 3.43Å; I343-Q346 PolarHBondContact O-N 3.36Å; I343-I349 HydrophobicContact CD1-CG2 4Å; I343-I349 HydrophobicContact CG1-CG2 4.15Å; I343-I349 HydrophobicContact CG2-CB 3.92Å; I343-I349 HydrophobicContact CG2-CG1 4.37Å; I343-I349 HydrophobicContact CG2-CG2 4Å; I343-L352 HydrophobicContact CD1-CD1 4.49Å; I343-L419 HydrophobicContact CD1-CD1 3.9Å; I343-L419 HydrophobicContact CG2-CD2 4.16Å
344	G	88.4	Confident	93.2	Very high	47 Å²	47	54.3 Å²	54.3	49%	0.485	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	-115.1	171.6	0	0	0	0	0	113.3	L340 K341 D342	L340-G344 PolarHBondContact O-N 2.89Å; K341-G344 PolarHBondContact O-N 3.09Å; D342-G344 VanDerWaalsContact C-N 3.3Å; D342-G344 PolarHBondContact O-N 3.23Å
345	K	77	Confident	93.2	Very high	198 Å²	198	53.6 Å²	53.6	86%	0.861	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	13.5	177.8	-64.8	-173.2	-179.9	-179.3	0	113.5	I343 L347	I343-K345 PolarHBondContact O-N 3.11Å; I343-K345 VanDerWaalsContact O-N 3.09Å; K345-L347 WeakPolarHBondContact O-CG 3.43Å; K345-L347 PolarHBondContact O-N 3.42Å
346	Q	78.4	Confident	93.2	Very high	91 Å²	91	55 Å²	55	43%	0.425	28%	0.275	S	S	.	.			trans	-65.7	96	175.1	-65.5	178.6	20.1	0	0	109.1	I343 D348 I349	I343-Q346 HydrophobicContact CG2-CB 4.5Å; I343-Q346 VanDerWaalsContact O-CB 3.23Å; I343-Q346 WeakPolarHBondContact O-CB 3.3Å; I343-Q346 VanDerWaalsContact O-CG 3.24Å; I343-Q346 WeakPolarHBondContact O-CG 3.43Å; I343-Q346 PolarHBondContact O-N 3.36Å; Q346-D348 PolarHBondContact O-N 3.39Å; Q346-I349 HydrophobicContact CB-CG1 4.03Å; Q346-I349 PolarHBondContact O-N 3.06Å
347	L	76.7	Confident	93.1	Very high	161 Å²	161	55.2 Å²	55.2	84%	0.843	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-21.1	-171.3	-63.2	178.1	0	0	0	113.1	K345	K345-L347 WeakPolarHBondContact O-CG 3.43Å; K345-L347 PolarHBondContact O-N 3.42Å
348	D	90.6	Very high	93.1	Very high	118 Å²	118	49.9 Å²	49.9	63%	0.631	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-18.4	-177.1	-61.3	-25.8	0	0	0	113.3	H273 Q346 R350	H273-D348 WeakPolarHBondContact CA-O 3.47Å; H273-D348 WeakPolarHBondContact CB-O 3.41Å; H273-D348 PolarHBondContact CD2-O 2.94Å; H273-D348 VanDerWaalsContact CD2-O 3.24Å; Q346-D348 PolarHBondContact O-N 3.39Å; D348-R350 PolarHBondContact O-N 3.46Å
349	I	94.7	Very high	93.1	Very high	7 Å²	7	47.4 Å²	47.4	4%	0.036	24%	0.239	C	C	.	.			trans	-77	119.1	177.4	-58.6	-64.5	0	0	0	109.2	S272 N302 I343 Q346 L419	S272-I349 WeakPolarHBondContact O-CD1 3.22Å; N302-I349 HydrophobicContact CB-CD1 4.02Å; N302-I349 VanDerWaalsContact ND2-CD1 3.3Å; N302-I349 WeakPolarHBondContact ND2-CD1 3.26Å; I343-I349 HydrophobicContact CD1-CG2 4Å; I343-I349 HydrophobicContact CG1-CG2 4.15Å; I343-I349 HydrophobicContact CG2-CB 3.92Å; I343-I349 HydrophobicContact CG2-CG1 4.37Å; I343-I349 HydrophobicContact CG2-CG2 4Å; Q346-I349 HydrophobicContact CB-CG1 4.03Å; Q346-I349 PolarHBondContact O-N 3.06Å; I349-L419 WeakPolarHBondContact O-CD2 3.48Å
350	R	95.1	Very high	93	Very high	46 Å²	46	47.6 Å²	47.6	17%	0.174	24%	0.24	C	C	.	.			trans	-116.8	-22.7	-178.1	-66.3	-179.9	-58.8	-163.4	-2.1	113	E267 H268 T269 H273 D348 A386 L419	E267-R350 VanDerWaalsContact CD-NH1 3.29Å; E267-R350 WeakPolarHBondContact OE1-CD 3.5Å; E267-R350 IonicContact OE1-CZ 2.86Å; E267-R350 IonicContact OE1-NE 3.65Å; E267-R350 IonicContact OE1-NH1 3.06Å; E267-R350 PolarHBondContact OE1-NH1 2.83Å; H268-R350 PolarHBondContact O-NH1 2.93Å; H268-R350 VanDerWaalsContact O-NH1 3.12Å; H268-R350 PolarHBondContact O-NH2 2.81Å; T269-R350 PolarHBondContact OG1-NH2 3.38Å; H273-R350 PolarHBondContact CD2-NH2 3.11Å; H273-R350 VanDerWaalsContact CD2-NH2 3.28Å; H273-R350 PolarHBondContact O-N 3.19Å; D348-R350 PolarHBondContact O-N 3.46Å; R350-A386 HydrophobicContact CB-CB 3.72Å; R350-A386 HydrophobicContact CG-CB 4.3Å; R350-L419 PolarHBondContact O-N 2.78Å
351	W	96.7	Very high	92.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.5	-173.5	-56.3	101.4	0	0	0	110.8	H273 I274 Y275 L381 H384 A386 V390 V416 L417	H273-W351 PolarHBondContact O-N 3.05Å; I274-W351 WeakPolarHBondContact CA-O 3.46Å; I274-W351 HydrophobicContact CG1-CB 4.29Å; I274-W351 HydrophobicContact CG2-CB 4.37Å; Y275-W351 PolarHBondContact N-O 3.37Å; W351-L381 HydrophobicContact CB-CD1 4.12Å; W351-L381 HydrophobicContact CD2-CB 4.44Å; W351-L381 HydrophobicContact CD2-CD1 4.11Å; W351-L381 HydrophobicContact CD2-CD2 4Å; W351-L381 HydrophobicContact CD2-CG 4.39Å; W351-L381 HydrophobicContact CE3-CD2 3.95Å; W351-L381 HydrophobicContact CG-CD1 3.78Å; W351-L381 HydrophobicContact CH2-CD2 4.49Å; W351-L381 HydrophobicContact CZ2-CB 4.31Å; W351-L381 HydrophobicContact CZ3-CD2 4.2Å; W351-H384 HydrophobicContact CH2-CB 3.6Å; W351-H384 HydrophobicContact CZ2-CB 4.12Å; W351-A386 HydrophobicContact CD2-CB 4.4Å; W351-A386 HydrophobicContact CH2-CB 4.04Å; W351-A386 HydrophobicContact CZ2-CB 3.44Å; W351-A386 VanDerWaalsContact CZ2-CB 3.44Å; W351-V390 HydrophobicContact CH2-CB 4.19Å; W351-V390 HydrophobicContact CH2-CG1 4.13Å; W351-V390 HydrophobicContact CH2-CG2 4.22Å; W351-V390 HydrophobicContact CZ3-CB 3.82Å; W351-V390 HydrophobicContact CZ3-CG1 3.78Å; W351-V390 HydrophobicContact CZ3-CG2 4.34Å; W351-V416 HydrophobicContact CB-CG1 4.45Å; W351-V416 HydrophobicContact CE3-CG1 4.09Å; W351-L417 CarbonylContact C-O 3.44Å; W351-L417 WeakPolarHBondContact CA-O 3.46Å
352	L	97.8	Very high	92.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.4	166	-176	149.1	0	0	0	108.7	Y275 A277 L336 S339 I343 L354 V416 L417 V422	Y275-L352 HydrophobicContact CD1-CD1 4.25Å; Y275-L352 HydrophobicContact CD1-CG 4.41Å; Y275-L352 CarbonylContact O-C 3.54Å; Y275-L352 WeakPolarHBondContact O-CA 3.47Å; A277-L352 HydrophobicContact CB-CD1 4.5Å; A277-L352 HydrophobicContact CB-CD2 4.26Å; A277-L352 HydrophobicContact CB-CG 4.41Å; L336-L352 HydrophobicContact CD2-CD1 4.3Å; L336-L352 HydrophobicContact CD2-CD2 3.87Å; S339-L352 VanDerWaalsContact CB-CD1 3.5Å; I343-L352 HydrophobicContact CD1-CD1 4.49Å; L352-L354 HydrophobicContact CD2-CB 3.95Å; L352-V416 WeakPolarHBondContact O-CA 3.4Å; L352-L417 HydrophobicContact CD2-CD1 4.28Å; L352-L417 PolarHBondContact N-O 3.45Å; L352-L417 PolarHBondContact O-N 3.24Å; L352-V422 HydrophobicContact CB-CG2 3.77Å; L352-V422 HydrophobicContact CD1-CG1 4.22Å; L352-V422 HydrophobicContact CD1-CG2 4.16Å; L352-V422 HydrophobicContact CG-CG2 4.4Å
353	M	97.7	Very high	91.9	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	107.4	172.5	-174.5	161.4	-164	0	0	108.8	I274 Y275 F276 A277 V355 L361 V377 I415 V416 M459 T479	I274-M353 HydrophobicContact CG2-CB 3.94Å; Y275-M353 PolarHBondContact O-N 3.36Å; F276-M353 WeakPolarHBondContact CA-O 3.26Å; F276-M353 HydrophobicContact CD1-CB 3.96Å; F276-M353 HydrophobicContact CD1-CG 4.23Å; F276-M353 HydrophobicContact CD1-SD 4.14Å; F276-M353 HydrophobicContact CE1-CB 4.21Å; F276-M353 HydrophobicContact CE1-CG 4.39Å; F276-M353 HydrophobicContact CE1-SD 3.76Å; A277-M353 PolarHBondContact N-O 3.35Å; M353-V355 HydrophobicContact CE-CG1 4.07Å; M353-V355 HydrophobicContact CG-CG1 3.81Å; M353-L361 HydrophobicContact CE-CD1 3.98Å; M353-L361 HydrophobicContact CE-CD2 3.42Å; M353-L361 VanDerWaalsContact CE-CD2 3.42Å; M353-L361 HydrophobicContact CE-CG 4.32Å; M353-L361 HydrophobicContact SD-CD1 3.81Å; M353-L361 HydrophobicContact SD-CD2 4.36Å; M353-V377 HydrophobicContact SD-CG1 4.24Å; M353-I415 CarbonylContact C-O 3.58Å; M353-I415 WeakPolarHBondContact CA-O 3.43Å; M353-V416 HydrophobicContact CB-CG2 4.45Å; M353-V416 HydrophobicContact CE-CG2 4.16Å; M353-V416 HydrophobicContact CG-CG2 4.08Å; M353-V416 HydrophobicContact SD-CG2 4.17Å; M353-M459 HydrophobicContact CE-CE 4.18Å; M353-T479 HydrophobicContact CE-CG2 4.05Å
354	L	98.5	Very high	90.5	Very high	6 Å²	6	37.8 Å²	37.8	3%	0.031	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	123.9	176	176.3	67.9	0	0	0	108.6	A277 T332 I335 L352 G414 I415	A277-L354 HydrophobicContact CB-CD1 4.34Å; A277-L354 WeakPolarHBondContact O-CA 3.36Å; T332-L354 HydrophobicContact CG2-CD2 3.72Å; I335-L354 HydrophobicContact CG2-CD1 3.98Å; L352-L354 HydrophobicContact CD2-CB 3.95Å; L354-G414 CarbonylContact O-C 3.5Å; L354-G414 WeakPolarHBondContact O-CA 3.5Å; L354-I415 HydrophobicContact CB-CB 4.41Å; L354-I415 PolarHBondContact N-O 3.03Å; L354-I415 PolarHBondContact O-N 3.01Å
355	V	97.5	Very high	88.8	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	154.6	-177	-64.4	0	0	0	0	111.5	A277 I278 K279 W296 M353 T359 L361	A277-V355 PolarHBondContact O-N 2.89Å; I278-V355 WeakPolarHBondContact CA-O 3.44Å; I278-V355 HydrophobicContact CB-CG2 4.31Å; I278-V355 HydrophobicContact CG1-CG2 3.74Å; I278-V355 HydrophobicContact CG2-CG2 4.45Å; K279-V355 PolarHBondContact N-O 2.03Å; W296-V355 HydrophobicContact CH2-CG2 4.06Å; W296-V355 HydrophobicContact CZ2-CG2 4.11Å; M353-V355 HydrophobicContact CE-CG1 4.07Å; M353-V355 HydrophobicContact CG-CG1 3.81Å; V355-T359 HydrophobicContact CB-CG2 4.32Å; V355-T359 HydrophobicContact CG1-CG2 4.22Å; V355-L361 HydrophobicContact CG1-CD1 4.27Å; V355-L361 HydrophobicContact CG1-CD2 4.1Å
356	D	97.4	Very high	87.4	Confident	28 Å²	28	31.2 Å²	31.2	15%	0.15	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	161.9	171.1	-68	-15.2	0	0	0	110.2	K279 D358 T359 G412 H481	K279-D356 WeakPolarHBondContact CE-OD1 2.98Å; K279-D356 IonicContact NZ-OD1 3.6Å; K279-D356 PolarHBondContact NZ-OD1 3.49Å; D356-D358 PolarHBondContact O-N 2.82Å; D356-T359 PolarHBondContact N-OG1 3.37Å; D356-T359 PolarHBondContact O-N 3.46Å; D356-T359 PolarHBondContact O-OG1 2.86Å; D356-G412 WeakPolarHBondContact OD2-CA 3.41Å; D356-H481 IonicContact OD2-NE2 3.67Å
357	D	96.7	Very high	85.8	Confident	6 Å²	6	31.4 Å²	31.4	3%	0.032	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	0.5	179.8	63.8	10.8	0	0	0	114.4	I278 K279 T280 F284 R288 I289 I292 F483	I278-D357 HydrophobicContact CG2-CB 4.23Å; K279-D357 PolarHBondContact O-N 3.23Å; K279-D357 VanDerWaalsContact O-N 3.1Å; T280-D357 VanDerWaalsContact CA-OD2 3.31Å; T280-D357 WeakPolarHBondContact CA-OD2 3.43Å; T280-D357 VanDerWaalsContact CB-OD2 3.23Å; T280-D357 WeakPolarHBondContact CB-OD2 3Å; T280-D357 PolarHBondContact OG1-OD2 3.25Å; F284-D357 WeakPolarHBondContact CB-OD2 3.22Å; F284-D357 VanDerWaalsContact CD2-OD2 3.3Å; F284-D357 WeakPolarHBondContact CD2-OD2 3.4Å; R288-D357 HydrophobicContact CB-CB 4.36Å; R288-D357 WeakPolarHBondContact CB-O 3.41Å; R288-D357 VanDerWaalsContact CD-CG 3.49Å; R288-D357 WeakPolarHBondContact CD-OD1 3.43Å; R288-D357 IonicContact CZ-OD1 3.96Å; R288-D357 IonicContact NE-OD1 3.43Å; R288-D357 IonicContact NH1-OD1 3.67Å; R288-D357 PolarHBondContact NH1-OD1 3.22Å; I289-D357 HydrophobicContact CD1-CB 4.02Å; I292-D357 HydrophobicContact CD1-CB 4.22Å; I292-D357 WeakPolarHBondContact CD1-O 3.34Å; D357-F483 WeakPolarHBondContact O-CE2 3.48Å
358	D	97.4	Very high	84.1	Confident	13 Å²	13	28.5 Å²	28.5	7%	0.07	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.4	25.1	170.1	56.1	-11.7	0	0	0	113.4	R288 D356 H481 K482 F483	R288-D358 IonicContact CZ-OD2 3.58Å; R288-D358 VanDerWaalsContact CZ-OD2 3.25Å; R288-D358 IonicContact NH1-OD1 2.78Å; R288-D358 PolarHBondContact NH1-OD1 3.46Å; R288-D358 IonicContact NH1-OD2 2.7Å; R288-D358 PolarHBondContact NH1-OD2 2.74Å; R288-D358 IonicContact NH2-OD2 3.66Å; R288-D358 PolarHBondContact NH2-OD2 3.03Å; R288-D358 VanDerWaalsContact NH2-OD2 3.14Å; D356-D358 PolarHBondContact O-N 2.82Å; D358-H481 WeakPolarHBondContact O-CA 3.03Å; D358-H481 IonicContact OD1-CD2 2.63Å; D358-H481 PolarHBondContact OD1-CD2 3.45Å; D358-H481 IonicContact OD1-NE2 3.79Å; D358-H481 PolarHBondContact OD1-NE2 2.87Å; D358-H481 IonicContact OD2-NE2 2.76Å; D358-K482 PolarHBondContact O-N 3.02Å; D358-F483 HydrophobicContact CB-CB 4.29Å; D358-F483 HydrophobicContact CB-CD1 3.79Å; D358-F483 HydrophobicContact CB-CD2 4.04Å; D358-F483 HydrophobicContact CB-CE1 4.08Å; D358-F483 HydrophobicContact CB-CE2 4.33Å; D358-F483 HydrophobicContact CB-CG 3.77Å; D358-F483 HydrophobicContact CB-CZ 4.35Å; D358-F483 WeakPolarHBondContact O-CE1 3.22Å
359	T	97.6	Very high	81.9	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	129.3	168.5	-50.2	0	0	0	0	111.2	W296 V355 D356 L361 G412	W296-T359 PolarHBondContact NE1-O 3.31Å; V355-T359 HydrophobicContact CB-CG2 4.32Å; V355-T359 HydrophobicContact CG1-CG2 4.22Å; D356-T359 PolarHBondContact N-OG1 3.37Å; D356-T359 PolarHBondContact O-N 3.46Å; D356-T359 PolarHBondContact O-OG1 2.86Å; T359-L361 HydrophobicContact CG2-CD2 3.7Å; T359-G412 VanDerWaalsContact CG2-O 3.29Å; T359-G412 WeakPolarHBondContact CG2-O 3.48Å; T359-G412 PolarHBondContact OG1-O 3.07Å
360	L	95.6	Very high	79.4	Confident	5 Å²	5	36 Å²	36	3%	0.026	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	138.5	170.4	-62	174	0	0	0	110.6	T295 T479 F480 F483 P488 T491 L496	T295-L360 HydrophobicContact CG2-CD2 4.38Å; L360-T479 WeakPolarHBondContact O-CA 3.26Å; L360-T479 WeakPolarHBondContact O-CB 3.31Å; L360-F480 PolarHBondContact N-O 3.23Å; L360-F480 PolarHBondContact O-N 3.18Å; L360-F480 VanDerWaalsContact O-N 3.14Å; L360-F483 HydrophobicContact CD2-CE1 3.69Å; L360-F483 HydrophobicContact CD2-CZ 4.05Å; L360-F483 HydrophobicContact CG-CE1 3.83Å; L360-P488 HydrophobicContact CD1-CB 4.24Å; L360-P488 VanDerWaalsContact CD1-O 3.31Å; L360-P488 WeakPolarHBondContact CD1-O 3.4Å; L360-P488 HydrophobicContact CD2-CB 4.47Å; L360-T491 HydrophobicContact CD1-CG2 3.75Å; L360-L496 HydrophobicContact CB-CD1 3.46Å; L360-L496 VanDerWaalsContact CB-CD1 3.46Å
361	L	93.2	Very high	76.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	142	-175.5	-52.5	-176.5	0	0	0	112.9	F276 W296 M353 V355 T359 L363 L478 T479 Y492	F276-L361 HydrophobicContact CD1-CD1 3.94Å; F276-L361 HydrophobicContact CE1-CD1 3.89Å; W296-L361 HydrophobicContact CB-CB 4.13Å; W296-L361 WeakPolarHBondContact CB-O 2.75Å; W296-L361 HydrophobicContact CD2-CB 3.98Å; W296-L361 HydrophobicContact CD2-CD1 3.75Å; W296-L361 HydrophobicContact CD2-CG 3.84Å; W296-L361 HydrophobicContact CE3-CB 4.48Å; W296-L361 HydrophobicContact CE3-CD1 3.7Å; W296-L361 HydrophobicContact CE3-CG 4.31Å; W296-L361 HydrophobicContact CG-CB 3.82Å; W296-L361 HydrophobicContact CG-CD1 4.48Å; W296-L361 HydrophobicContact CG-CG 4.12Å; W296-L361 HydrophobicContact CH2-CD1 3.76Å; W296-L361 HydrophobicContact CZ2-CD1 3.82Å; W296-L361 HydrophobicContact CZ2-CG 4.14Å; W296-L361 HydrophobicContact CZ3-CD1 3.7Å; M353-L361 HydrophobicContact CE-CD1 3.98Å; M353-L361 HydrophobicContact CE-CD2 3.42Å; M353-L361 VanDerWaalsContact CE-CD2 3.42Å; M353-L361 HydrophobicContact CE-CG 4.32Å; M353-L361 HydrophobicContact SD-CD1 3.81Å; M353-L361 HydrophobicContact SD-CD2 4.36Å; V355-L361 HydrophobicContact CG1-CD1 4.27Å; V355-L361 HydrophobicContact CG1-CD2 4.1Å; T359-L361 HydrophobicContact CG2-CD2 3.7Å; L361-L363 HydrophobicContact CB-CG 4.05Å; L361-L363 HydrophobicContact CD1-CD1 4.42Å; L361-L363 PolarHBondContact O-N 2.83Å; L361-L478 CarbonylContact C-O 3.54Å; L361-T479 HydrophobicContact CD2-CG2 3.36Å; L361-Y492 WeakPolarHBondContact O-CE2 3.35Å
362	S	88.6	Confident	74.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.227	C	C	.	.			trans	-85.5	82.2	169.1	-170.4	0	0	0	0	111	L478 L496	S362-L478 PolarHBondContact N-O 3.01Å; S362-L496 PolarHBondContact OG-O 2.85Å
363	L	79.8	Confident	72.2	Confident	8 Å²	8	43.7 Å²	43.7	4%	0.042	24%	0.236	C	C	.	.			trans	-98.4	-5.8	172.9	-62.5	-175.7	0	0	0	113.7	F276 W296 D299 A300 L361 P375 V377	F276-L363 HydrophobicContact CD1-CD1 4.44Å; F276-L363 HydrophobicContact CE1-CD1 3.6Å; F276-L363 HydrophobicContact CE1-CD2 3.92Å; F276-L363 HydrophobicContact CE1-CG 4.34Å; F276-L363 HydrophobicContact CE2-CD1 4.27Å; F276-L363 HydrophobicContact CZ-CD1 3.49Å; F276-L363 VanDerWaalsContact CZ-CD1 3.49Å; F276-L363 HydrophobicContact CZ-CD2 3.76Å; F276-L363 HydrophobicContact CZ-CG 4.29Å; W296-L363 HydrophobicContact CB-CD1 4.39Å; W296-L363 HydrophobicContact CB-CG 4.49Å; W296-L363 HydrophobicContact CD2-CD1 4.43Å; W296-L363 HydrophobicContact CE3-CD1 3.6Å; W296-L363 HydrophobicContact CZ3-CD1 4.27Å; D299-L363 HydrophobicContact CB-CB 3.88Å; A300-L363 HydrophobicContact CB-CD1 3.8Å; L361-L363 HydrophobicContact CB-CG 4.05Å; L361-L363 HydrophobicContact CD1-CD1 4.42Å; L361-L363 PolarHBondContact O-N 2.83Å; L363-P375 VanDerWaalsContact O-CB 3.23Å; L363-P375 WeakPolarHBondContact O-CB 3.31Å; L363-P375 WeakPolarHBondContact O-CG 3.28Å; L363-V377 HydrophobicContact CD2-CB 3.89Å; L363-V377 HydrophobicContact CD2-CG1 4.31Å; L363-V377 HydrophobicContact CD2-CG2 3.93Å
364	H	65.9	Low	70.1	Confident	59 Å²	59	45.9 Å²	45.9	27%	0.273	25%	0.249	S	C	.	.	S	Bend	trans	-78.9	147.6	-177.5	-156.8	65.5	0	0	0	112.8	D299 I366 G497	D299-H364 IonicContact OD2-CG 2.74Å; D299-H364 IonicContact OD2-ND1 3.99Å; D299-H364 PolarHBondContact OD2-ND1 3.16Å; H364-I366 PolarHBondContact O-N 3.44Å; H364-G497 PolarHBondContact CD2-O 3.33Å
365	L	51.5	Low	68.9	Low	77 Å²	77	46.6 Å²	46.6	40%	0.403	25%	0.254	S	S	.	.			trans	-68.6	114	172.7	-73.1	167.2	0	0	0	109.7	H367 S373 P375	L365-H367 PolarHBondContact O-N 3.37Å; L365-H367 VanDerWaalsContact O-N 3.15Å; L365-S373 WeakPolarHBondContact CD2-O 3.29Å; L365-P375 HydrophobicContact CD2-CG 4.19Å
366	I	47.7	Very low	68.1	Low	29 Å²	29	48.9 Å²	48.9	15%	0.149	26%	0.263	C	S	.	.	S	Bend	trans	-71	-12.3	-172.2	-69.1	-174.6	0	0	0	114.1	H364 R376 V501	H364-I366 PolarHBondContact O-N 3.44Å; I366-R376 HydrophobicContact CD1-CG 3.27Å; I366-R376 HydrophobicContact CG1-CG 4.39Å; I366-V501 HydrophobicContact CG2-CG2 3.74Å
367	H	46	Very low	67.4	Low	95 Å²	95	47.7 Å²	47.7	44%	0.44	26%	0.257	S	S	.	.			trans	-144.3	96.7	172.2	-71.1	76.9	0	0	0	108.9	L365 H369 L370 S373	L365-H367 PolarHBondContact O-N 3.37Å; L365-H367 VanDerWaalsContact O-N 3.15Å; H367-H369 PolarHBondContact O-N 3.05Å; H367-L370 HydrophobicContact CB-CB 4.44Å; H367-L370 PolarHBondContact O-N 3.22Å; H367-S373 WeakPolarHBondContact O-CB 3.47Å; H367-S373 PolarHBondContact O-OG 2.68Å
368	T	41	Very low	66.8	Low	101 Å²	101	47.4 Å²	47.4	62%	0.62	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-6.3	175	45.6	0	0	0	0	113.9
369	H	43.6	Very low	66	Low	174 Å²	174	47.8 Å²	47.8	81%	0.806	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-4.6	179.3	-62.9	-58.1	0	0	0	115.6	H367	H367-H369 PolarHBondContact O-N 3.05Å
370	L	41.7	Very low	65.5	Low	108 Å²	108	48.3 Å²	48.3	57%	0.565	26%	0.263	S	S	*	.	S	Bend	trans	-108.1	124.9	170.1	-121.7	79	0	0	0	109	H367 T372 S373	H367-L370 HydrophobicContact CB-CB 4.44Å; H367-L370 PolarHBondContact O-N 3.22Å; L370-T372 WeakPolarHBondContact CD2-OG1 3.44Å; L370-T372 PolarHBondContact O-N 3.41Å; L370-S373 PolarHBondContact O-N 3.1Å; L370-S373 PolarHBondContact O-OG 2.98Å
371	P	41.6	Very low	65.2	Low	137 Å²	137	48.1 Å²	48.1	89%	0.89	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	12.2	177.7	24.4	-32	0	0	0	114.3
372	T	46.4	Very low	64.9	Low	45 Å²	45	48.6 Å²	48.6	28%	0.276	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.4	6.9	-173.4	61	0	0	0	0	112.1	L259 R262 L370 V374	L259-T372 HydrophobicContact CD1-CG2 3.38Å; R262-T372 PolarHBondContact NH1-O 2.7Å; L370-T372 WeakPolarHBondContact CD2-OG1 3.44Å; L370-T372 PolarHBondContact O-N 3.41Å; T372-V374 PolarHBondContact O-N 3.27Å
373	S	50	Low	64.7	Low	26 Å²	26	53.9 Å²	53.9	18%	0.182	29%	0.285	C	S	.	.			trans	-69.2	133.5	170.6	61.6	0	0	0	0	109.3	L365 H367 L370	L365-S373 WeakPolarHBondContact CD2-O 3.29Å; H367-S373 WeakPolarHBondContact O-CB 3.47Å; H367-S373 PolarHBondContact O-OG 2.68Å; L370-S373 PolarHBondContact O-N 3.1Å; L370-S373 PolarHBondContact O-OG 2.98Å
374	V	55.4	Low	65.1	Low	47 Å²	47	54.8 Å²	54.8	29%	0.285	29%	0.289	S	S	.	.			trans	-123.7	135.8	176.1	169.1	0	0	0	0	105.5	T372 R376 S378 A379	T372-V374 PolarHBondContact O-N 3.27Å; V374-R376 PolarHBondContact O-N 3.39Å; V374-S378 VanDerWaalsContact CG1-CB 3.41Å; V374-A379 HydrophobicContact CG1-CB 4.26Å
375	P	72	Confident	66.4	Low	20 Å²	20	55 Å²	55	13%	0.13	29%	0.292	C	S	.	.			trans	-49.9	141.5	176	-30.3	39.2	0	0	0	111.5	L363 L365 V377 S378 A379	L363-P375 VanDerWaalsContact O-CB 3.23Å; L363-P375 WeakPolarHBondContact O-CB 3.31Å; L363-P375 WeakPolarHBondContact O-CG 3.28Å; L365-P375 HydrophobicContact CD2-CG 4.19Å; P375-V377 PolarHBondContact O-N 2.99Å; P375-S378 WeakPolarHBondContact O-CA 3.42Å; P375-S378 WeakPolarHBondContact O-CB 3.35Å; P375-S378 PolarHBondContact O-N 3.03Å; P375-A379 PolarHBondContact O-N 2.71Å
376	R	80.5	Confident	68.4	Low	49 Å²	49	51.6 Å²	51.6	19%	0.185	28%	0.275	C	S	.	.	H	α-helix	trans	-56.5	-40.7	-173.1	-65.3	-176.3	176.3	136.7	9.1	112	I366 V374 S378 A379 L380 P477 L478 W495	I366-R376 HydrophobicContact CD1-CG 3.27Å; I366-R376 HydrophobicContact CG1-CG 4.39Å; V374-R376 PolarHBondContact O-N 3.39Å; R376-S378 VanDerWaalsContact C-N 3.35Å; R376-S378 PolarHBondContact O-N 3.24Å; R376-A379 PolarHBondContact O-N 3.27Å; R376-L380 PolarHBondContact O-N 3.47Å; R376-P477 VanDerWaalsContact CD-O 3.25Å; R376-P477 WeakPolarHBondContact CD-O 3.27Å; R376-P477 PolarHBondContact NH1-O 3.4Å; R376-L478 HydrophobicContact CB-CD2 3.3Å; R376-L478 HydrophobicContact CB-CG 4.47Å; R376-W495 PolarHBondContact NH1-O 3.06Å
377	V	83.3	Confident	70.6	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.018	30%	0.299	C	S	.	.	H	α-helix	trans	-61.2	-42.7	175.1	175.5	0	0	0	0	111.4	I274 M353 L363 P375 A379 L380 L381 L478	I274-V377 HydrophobicContact CD1-CG1 3.95Å; M353-V377 HydrophobicContact SD-CG1 4.24Å; L363-V377 HydrophobicContact CD2-CB 3.89Å; L363-V377 HydrophobicContact CD2-CG1 4.31Å; L363-V377 HydrophobicContact CD2-CG2 3.93Å; P375-V377 PolarHBondContact O-N 2.99Å; V377-A379 VanDerWaalsContact C-N 3.34Å; V377-A379 PolarHBondContact O-N 2.93Å; V377-L380 WeakPolarHBondContact O-CB 3.29Å; V377-L380 PolarHBondContact O-N 3.2Å; V377-L381 HydrophobicContact CG1-CD1 4.09Å; V377-L381 VanDerWaalsContact O-CG 3.31Å; V377-L381 WeakPolarHBondContact O-CG 3.42Å; V377-L381 PolarHBondContact O-N 3.05Å; V377-L478 HydrophobicContact CG2-CD2 3.97Å
378	S	83.3	Confident	72.9	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.5	-35.5	176.8	-65.5	0	0	0	0	112.6	T269 T270 V374 P375 R376 L381 C382	T269-S378 WeakPolarHBondContact O-CB 3.39Å; T270-S378 WeakPolarHBondContact CA-OG 3.23Å; V374-S378 VanDerWaalsContact CG1-CB 3.41Å; P375-S378 WeakPolarHBondContact O-CA 3.42Å; P375-S378 WeakPolarHBondContact O-CB 3.35Å; P375-S378 PolarHBondContact O-N 3.03Å; R376-S378 VanDerWaalsContact C-N 3.35Å; R376-S378 PolarHBondContact O-N 3.24Å; S378-L381 PolarHBondContact O-N 3.44Å; S378-C382 PolarHBondContact O-N 3.39Å
379	A	81.3	Confident	75.6	Confident	20 Å²	20	55 Å²	55	17%	0.165	29%	0.293	C	S	.	.	H	α-helix	trans	-69.1	-33.4	175.1	0	0	0	0	0	112.6	V374 P375 R376 V377 C382	V374-A379 HydrophobicContact CG1-CB 4.26Å; P375-A379 PolarHBondContact O-N 2.71Å; R376-A379 PolarHBondContact O-N 3.27Å; V377-A379 VanDerWaalsContact C-N 3.34Å; V377-A379 PolarHBondContact O-N 2.93Å; A379-C382 PolarHBondContact O-SG 3.32Å; A379-C382 VanDerWaalsContact O-SG 3.34Å
380	L	86.7	Confident	78.2	Confident	12 Å²	12	46.9 Å²	46.9	6%	0.063	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-55.1	168.8	170.4	68.8	0	0	0	110	R376 V377 C382 R383 H384 L392 V456 L478	R376-L380 PolarHBondContact O-N 3.47Å; V377-L380 WeakPolarHBondContact O-CB 3.29Å; V377-L380 PolarHBondContact O-N 3.2Å; L380-C382 VanDerWaalsContact C-N 3.33Å; L380-C382 PolarHBondContact O-N 3.03Å; L380-R383 PolarHBondContact O-N 3.43Å; L380-H384 PolarHBondContact O-CD2 3.43Å; L380-L392 HydrophobicContact CD2-CD1 4.14Å; L380-L392 HydrophobicContact CG-CD1 4.23Å; L380-V456 HydrophobicContact CD1-CG1 4.03Å; L380-V456 HydrophobicContact CD1-CG2 4.18Å; L380-V456 HydrophobicContact CD2-CG1 3.85Å; L380-V456 HydrophobicContact CD2-CG2 4.07Å; L380-L478 HydrophobicContact CD2-CD1 3.96Å
381	L	89.8	Confident	80.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-69	-27.7	-171	-63.2	177.1	0	0	0	113.9	T269 I274 W351 V377 S378 R383 H384 L392 V416	T269-L381 HydrophobicContact CG2-CB 3.92Å; T269-L381 HydrophobicContact CG2-CD1 4.46Å; I274-L381 HydrophobicContact CD1-CD1 3.61Å; I274-L381 HydrophobicContact CG1-CD1 3.91Å; W351-L381 HydrophobicContact CB-CD1 4.12Å; W351-L381 HydrophobicContact CD2-CB 4.44Å; W351-L381 HydrophobicContact CD2-CD1 4.11Å; W351-L381 HydrophobicContact CD2-CD2 4Å; W351-L381 HydrophobicContact CD2-CG 4.39Å; W351-L381 HydrophobicContact CE3-CD2 3.95Å; W351-L381 HydrophobicContact CG-CD1 3.78Å; W351-L381 HydrophobicContact CH2-CD2 4.49Å; W351-L381 HydrophobicContact CZ2-CB 4.31Å; W351-L381 HydrophobicContact CZ3-CD2 4.2Å; V377-L381 HydrophobicContact CG1-CD1 4.09Å; V377-L381 VanDerWaalsContact O-CG 3.31Å; V377-L381 WeakPolarHBondContact O-CG 3.42Å; V377-L381 PolarHBondContact O-N 3.05Å; S378-L381 PolarHBondContact O-N 3.44Å; L381-R383 PolarHBondContact O-N 3.16Å; L381-R383 VanDerWaalsContact O-N 3.11Å; L381-H384 PolarHBondContact O-N 2.95Å; L381-L392 HydrophobicContact CD2-CD1 3.69Å; L381-V416 HydrophobicContact CD1-CG1 4.29Å; L381-V416 HydrophobicContact CD2-CB 4.39Å; L381-V416 HydrophobicContact CD2-CG1 3.59Å
382	C	87.1	Confident	83.5	Confident	11 Å²	11	35.3 Å²	35.3	7%	0.074	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.7	177.4	80.8	0	0	0	0	113.3	L257 C266 E267 S378 A379 L380 H384	L257-C382 VanDerWaalsContact CD1-SG 3.54Å; C266-C382 CarbonylContact C-O 3.58Å; C266-C382 WeakPolarHBondContact CA-O 3.46Å; C266-C382 HydrophobicContact CB-CB 3.49Å; C266-C382 VanDerWaalsContact CB-CB 3.49Å; C266-C382 WeakPolarHBondContact CB-SG 3.24Å; C266-C382 WeakPolarHBondContact SG-CB 3.47Å; C266-C382 PolarHBondContact SG-O 3.49Å; C266-C382 CovalentContact SG-SG 2.06Å; C266-C382 PolarHBondContact SG-SG 3.23Å; E267-C382 PolarHBondContact N-O 3.49Å; E267-C382 WeakPolarHBondContact O-CA 3.27Å; E267-C382 WeakPolarHBondContact O-CB 3.41Å; S378-C382 PolarHBondContact O-N 3.39Å; A379-C382 PolarHBondContact O-SG 3.32Å; A379-C382 VanDerWaalsContact O-SG 3.34Å; L380-C382 VanDerWaalsContact C-N 3.33Å; L380-C382 PolarHBondContact O-N 3.03Å; C382-H384 PolarHBondContact O-N 2.87Å
383	R	84.3	Confident	85.9	Confident	110 Å²	110	33.1 Å²	33.1	42%	0.415	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-2.4	178.5	-61.1	-171.3	-79.3	-167.3	0.7	113.9	L257 L380 L381	L257-R383 HydrophobicContact CD1-CG 3.8Å; L257-R383 HydrophobicContact CD2-CG 4.47Å; L380-R383 PolarHBondContact O-N 3.43Å; L381-R383 PolarHBondContact O-N 3.16Å; L381-R383 VanDerWaalsContact O-N 3.11Å
384	H	89.2	Confident	88.1	Confident	27 Å²	27	32.8 Å²	32.8	13%	0.125	17%	0.169	C	C	.	.	S	Bend	trans	-120.2	140.2	-177.4	-63.8	-80.8	0	0	0	110.3	W351 L380 L381 C382 A386 V390	W351-H384 HydrophobicContact CH2-CB 3.6Å; W351-H384 HydrophobicContact CZ2-CB 4.12Å; L380-H384 PolarHBondContact O-CD2 3.43Å; L381-H384 PolarHBondContact O-N 2.95Å; C382-H384 PolarHBondContact O-N 2.87Å; H384-A386 PolarHBondContact O-N 3.2Å; H384-V390 HydrophobicContact CB-CG1 4.27Å; H384-V390 HydrophobicContact CB-CG2 4.38Å
385	N	91.3	Very high	90	Very high	63 Å²	63	32 Å²	32	34%	0.337	16%	0.161	S	C	.	.			trans	-76.9	112.4	174.1	179	-1.6	0	0	0	109.2	T387 E388	N385-T387 VanDerWaalsContact CG-OG1 3.26Å; N385-T387 PolarHBondContact ND2-OG1 3.01Å; N385-T387 PolarHBondContact O-N 2.72Å; N385-T387 VanDerWaalsContact O-N 3.11Å; N385-T387 WeakPolarHBondContact OD1-CB 3.39Å; N385-T387 PolarHBondContact OD1-N 3.2Å; N385-T387 VanDerWaalsContact OD1-N 3.09Å; N385-T387 PolarHBondContact OD1-OG1 3.31Å; N385-E388 HydrophobicContact CB-CG 4.14Å; N385-E388 PolarHBondContact ND2-OE1 3.45Å; N385-E388 VanDerWaalsContact ND2-OE1 3.07Å; N385-E388 PolarHBondContact O-N 3.08Å; N385-E388 VanDerWaalsContact O-N 3.12Å
386	A	93.7	Very high	91.2	Very high	6 Å²	6	31.8 Å²	31.8	5%	0.05	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-7.9	-175.3	0	0	0	0	0	114.5	E267 R350 W351 H384 P420	E267-A386 PolarHBondContact OE2-N 3.24Å; R350-A386 HydrophobicContact CB-CB 3.72Å; R350-A386 HydrophobicContact CG-CB 4.3Å; W351-A386 HydrophobicContact CD2-CB 4.4Å; W351-A386 HydrophobicContact CH2-CB 4.04Å; W351-A386 HydrophobicContact CZ2-CB 3.44Å; W351-A386 VanDerWaalsContact CZ2-CB 3.44Å; H384-A386 PolarHBondContact O-N 3.2Å; A386-P420 WeakPolarHBondContact O-CD 3.48Å
387	T	94.6	Very high	91.8	Very high	105 Å²	105	29.4 Å²	29.4	64%	0.644	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-14.9	174.3	69	0	0	0	0	113	N385	N385-T387 VanDerWaalsContact CG-OG1 3.26Å; N385-T387 PolarHBondContact ND2-OG1 3.01Å; N385-T387 PolarHBondContact O-N 2.72Å; N385-T387 VanDerWaalsContact O-N 3.11Å; N385-T387 WeakPolarHBondContact OD1-CB 3.39Å; N385-T387 PolarHBondContact OD1-N 3.2Å; N385-T387 VanDerWaalsContact OD1-N 3.09Å; N385-T387 PolarHBondContact OD1-OG1 3.31Å
388	E	95.5	Very high	92.4	Very high	115 Å²	115	29.5 Å²	29.5	54%	0.537	15%	0.149	S	C	.	.	S	Bend	trans	-88	167.8	177.1	-69.8	173.3	-163.7	0	0	112.4	N385 V390 S418	N385-E388 HydrophobicContact CB-CG 4.14Å; N385-E388 PolarHBondContact ND2-OE1 3.45Å; N385-E388 VanDerWaalsContact ND2-OE1 3.07Å; N385-E388 PolarHBondContact O-N 3.08Å; N385-E388 VanDerWaalsContact O-N 3.12Å; E388-V390 HydrophobicContact CB-CG2 4.15Å; E388-V390 PolarHBondContact O-N 2.95Å; E388-V390 VanDerWaalsContact O-N 3.07Å; E388-S418 WeakPolarHBondContact O-CB 3.47Å; E388-S418 PolarHBondContact O-OG 3.41Å
389	L	97.2	Very high	92.7	Very high	76 Å²	76	31.7 Å²	31.7	40%	0.398	16%	0.157	S	C	.	.			trans	-80.3	84.4	176	-59.9	-179.8	0	0	0	110.6	P420 L421 L424 V451	L389-P420 HydrophobicContact CD2-CB 4.17Å; L389-L421 HydrophobicContact CB-CD1 4.34Å; L389-L421 HydrophobicContact CD2-CB 4.18Å; L389-L421 HydrophobicContact CD2-CD1 4.25Å; L389-L424 HydrophobicContact CD1-CD2 3.74Å; L389-L424 HydrophobicContact CD2-CD2 4.16Å; L389-V451 HydrophobicContact CB-CG1 4.44Å; L389-V451 HydrophobicContact CB-CG2 4.21Å; L389-V451 HydrophobicContact CD1-CG2 3.99Å
390	V	96.6	Very high	93	Very high	5 Å²	5	31.4 Å²	31.4	3%	0.03	15%	0.152	C	C	.	.			trans	-101.2	125	-176	-179.5	0	0	0	0	111.6	W351 H384 E388 L392 L417 S418 L421	W351-V390 HydrophobicContact CH2-CB 4.19Å; W351-V390 HydrophobicContact CH2-CG1 4.13Å; W351-V390 HydrophobicContact CH2-CG2 4.22Å; W351-V390 HydrophobicContact CZ3-CB 3.82Å; W351-V390 HydrophobicContact CZ3-CG1 3.78Å; W351-V390 HydrophobicContact CZ3-CG2 4.34Å; H384-V390 HydrophobicContact CB-CG1 4.27Å; H384-V390 HydrophobicContact CB-CG2 4.38Å; E388-V390 HydrophobicContact CB-CG2 4.15Å; E388-V390 PolarHBondContact O-N 2.95Å; E388-V390 VanDerWaalsContact O-N 3.07Å; V390-L392 HydrophobicContact CG1-CD1 4.07Å; V390-L392 HydrophobicContact CG1-CD2 3.55Å; V390-L392 HydrophobicContact CG1-CG 3.63Å; V390-L417 WeakPolarHBondContact O-CA 3.47Å; V390-S418 PolarHBondContact N-OG 2.86Å; V390-S418 PolarHBondContact O-N 3.45Å; V390-L421 WeakPolarHBondContact O-CD2 3.42Å
391	Y	97.7	Very high	92.8	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	102.3	178.5	-179.9	-143.9	0	0	0	110.6	H409 I415 L417 L421 L442 L446 A453 I454	Y391-H409 AromaticContact CD1-CD2 3.74Å; Y391-H409 AromaticContact CD1-NE2 3.94Å; Y391-H409 AromaticContact CD2-CD2 3.44Å; Y391-H409 VanDerWaalsContact CD2-CD2 3.44Å; Y391-H409 WeakPolarHBondContact CD2-CD2 3.42Å; Y391-H409 AromaticContact CE1-CD2 3.61Å; Y391-H409 HydrophobicContact CE2-CB 3.97Å; Y391-H409 AromaticContact CE2-CD2 3.33Å; Y391-H409 WeakPolarHBondContact CE2-CD2 3.47Å; Y391-H409 AromaticContact CE2-CG 3.98Å; Y391-H409 AromaticContact CG-CD2 3.65Å; Y391-H409 AromaticContact CG-NE2 3.97Å; Y391-H409 AromaticContact CZ-CD2 3.4Å; Y391-H409 VanDerWaalsContact CZ-CD2 3.4Å; Y391-H409 AromaticContact CZ-CG 3.77Å; Y391-H409 PolarHBondContact O-NE2 3.37Å; Y391-H409 PolarHBondContact OH-N 3.12Å; Y391-I415 HydrophobicContact CD2-CG2 3.88Å; Y391-I415 HydrophobicContact CE2-CG2 3.49Å; Y391-I415 VanDerWaalsContact CE2-CG2 3.49Å; Y391-L417 HydrophobicContact CD2-CD2 3.53Å; Y391-L417 HydrophobicContact CE2-CD2 4.13Å; Y391-L417 HydrophobicContact CG-CD2 4.45Å; Y391-L421 HydrophobicContact CG-CD2 4.45Å; Y391-L442 HydrophobicContact CE2-CD2 4.22Å; Y391-L446 HydrophobicContact CD1-CB 4.48Å; Y391-L446 HydrophobicContact CD1-CD1 3.52Å; Y391-L446 HydrophobicContact CD2-CD1 3.79Å; Y391-L446 HydrophobicContact CE1-CD1 3.63Å; Y391-L446 HydrophobicContact CE2-CD1 3.85Å; Y391-L446 HydrophobicContact CG-CD1 3.62Å; Y391-A453 HydrophobicContact CD1-CB 3.93Å; Y391-A453 HydrophobicContact CE1-CB 3.86Å; Y391-I454 PolarHBondContact O-N 2.91Å
392	L	97.1	Very high	92.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	144.8	-175.2	-46.8	178.6	0	0	0	111.9	L380 L381 V390 H409 V416 I454 V456	L380-L392 HydrophobicContact CD2-CD1 4.14Å; L380-L392 HydrophobicContact CG-CD1 4.23Å; L381-L392 HydrophobicContact CD2-CD1 3.69Å; V390-L392 HydrophobicContact CG1-CD1 4.07Å; V390-L392 HydrophobicContact CG1-CD2 3.55Å; V390-L392 HydrophobicContact CG1-CG 3.63Å; L392-H409 PolarHBondContact O-CD2 3.18Å; L392-V416 HydrophobicContact CB-CB 4.18Å; L392-V416 PolarHBondContact N-O 2.92Å; L392-V416 PolarHBondContact O-N 3.31Å; L392-I454 WeakPolarHBondContact CA-O 3.22Å; L392-I454 HydrophobicContact CD2-CB 3.63Å; L392-I454 HydrophobicContact CD2-CD1 3.94Å; L392-I454 HydrophobicContact CD2-CG1 4.37Å; L392-I454 HydrophobicContact CD2-CG2 3.65Å; L392-V456 HydrophobicContact CB-CG2 3.8Å
393	G	96.9	Very high	92.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.5	-172.4	175.4	0	0	0	0	0	113.5	R395 H409 I454 H455 V456	G393-R395 PolarHBondContact O-N 3.03Å; G393-H409 PolarHBondContact N-CD2 3.34Å; G393-H409 VanDerWaalsContact N-CD2 3.27Å; G393-H409 PolarHBondContact N-NE2 2.91Å; G393-H409 PolarHBondContact O-ND1 3.01Å; G393-I454 PolarHBondContact N-O 2.86Å; G393-H455 CarbonylContact O-C 3.56Å; G393-H455 WeakPolarHBondContact O-CA 3.23Å; G393-V456 PolarHBondContact O-N 2.66Å
394	Q	96.7	Very high	92.4	Very high	19 Å²	19	42.1 Å²	42.1	9%	0.089	22%	0.223	C	C	.	.			trans	-78.1	117.8	168.6	-173.2	171.7	31.2	0	0	109.2	Y396 H409 T410 A413 M459	Q394-Y396 HydrophobicContact CG-CE1 4.17Å; Q394-H409 CarbonylContact O-C 3.55Å; Q394-H409 VanDerWaalsContact O-CA 3.23Å; Q394-H409 WeakPolarHBondContact O-CA 3.4Å; Q394-T410 PolarHBondContact O-N 3.23Å; Q394-A413 HydrophobicContact CB-CB 3.74Å; Q394-M459 HydrophobicContact CB-CB 4.36Å; Q394-M459 WeakPolarHBondContact CB-O 3.32Å; Q394-M459 VanDerWaalsContact CD-O 3.3Å
395	R	95.6	Very high	92.5	Very high	29 Å²	29	40.9 Å²	40.9	11%	0.109	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	120.8	-173.1	175.7	172.6	69.3	175.4	0.6	109.7	E77 G393 N407 Y408 H455	E77-R395 IonicContact OE1-CZ 3.31Å; E77-R395 IonicContact OE1-NH1 3.44Å; E77-R395 PolarHBondContact OE1-NH1 3.32Å; E77-R395 IonicContact OE1-NH2 2.72Å; E77-R395 IonicContact OE2-CZ 3.43Å; E77-R395 IonicContact OE2-NH1 3.39Å; E77-R395 IonicContact OE2-NH2 2.87Å; E77-R395 PolarHBondContact OE2-NH2 3Å; G393-R395 PolarHBondContact O-N 3.03Å; R395-N407 WeakPolarHBondContact CD-OD1 3.18Å; R395-N407 HydrophobicContact CG-CB 4.15Å; R395-Y408 WeakPolarHBondContact CA-O 3.29Å; R395-H455 HydrophobicContact CB-CB 3.73Å; R395-H455 PolarHBondContact N-ND1 2.69Å
396	Y	96.1	Very high	92.6	Very high	16 Å²	16	38 Å²	38	6%	0.063	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	159.4	160.9	-75	6.1	0	0	0	109.7	S196 I197 Q394 N407 Y408 T410 Q461	S196-Y396 CarbonylContact O-C 3.58Å; S196-Y396 VanDerWaalsContact O-CA 3.29Å; S196-Y396 WeakPolarHBondContact O-CA 3.39Å; S196-Y396 WeakPolarHBondContact O-CB 3.34Å; I197-Y396 HydrophobicContact CB-CD1 4.49Å; I197-Y396 HydrophobicContact CB-CE1 4.25Å; I197-Y396 HydrophobicContact CB-CE2 4.25Å; I197-Y396 HydrophobicContact CD1-CD2 4.37Å; I197-Y396 HydrophobicContact CD1-CE2 4.03Å; I197-Y396 HydrophobicContact CG1-CD1 4.49Å; I197-Y396 HydrophobicContact CG1-CD2 3.73Å; I197-Y396 HydrophobicContact CG1-CE1 4.46Å; I197-Y396 HydrophobicContact CG1-CE2 3.67Å; I197-Y396 HydrophobicContact CG1-CG 4.18Å; I197-Y396 HydrophobicContact CG2-CD1 4.48Å; I197-Y396 HydrophobicContact CG2-CE1 3.76Å; I197-Y396 HydrophobicContact CG2-CE2 3.95Å; I197-Y396 VanDerWaalsContact CG2-CZ 3.47Å; I197-Y396 WeakPolarHBondContact CG2-OH 3.31Å; Q394-Y396 HydrophobicContact CG-CE1 4.17Å; Y396-N407 WeakPolarHBondContact O-CA 3.43Å; Y396-Y408 PolarHBondContact N-O 2.95Å; Y396-Y408 PolarHBondContact O-N 2.84Å; Y396-T410 HydrophobicContact CD1-CG2 3.71Å; Y396-T410 HydrophobicContact CD2-CG2 3.27Å; Y396-T410 HydrophobicContact CE1-CG2 3.87Å; Y396-T410 HydrophobicContact CE2-CG2 3.46Å; Y396-T410 VanDerWaalsContact CE2-CG2 3.46Å; Y396-T410 HydrophobicContact CG-CG2 3.39Å; Y396-Q461 HydrophobicContact CE2-CG 4.46Å
397	G	94.8	Very high	92.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	148.4	172.4	0	0	0	0	0	111.7	F195 S196 F406	F195-G397 CarbonylContact C-O 3.49Å; F195-G397 VanDerWaalsContact CA-O 3.3Å; F195-G397 WeakPolarHBondContact CA-O 3.29Å; S196-G397 PolarHBondContact N-O 3.12Å; S196-G397 PolarHBondContact O-N 3.28Å; G397-F406 WeakPolarHBondContact CA-O 3.43Å
398	Y	94.2	Very high	92.8	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.016	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126.6	166.9	-177	-111.4	0	0	0	109.1	D194 F195 L400 G405 F406 M440 L544 L546	D194-Y398 HydrophobicContact CB-CD2 4.06Å; D194-Y398 HydrophobicContact CB-CE2 3.62Å; D194-Y398 CarbonylContact O-C 3.56Å; F195-Y398 AromaticContact CD1-CD2 3.97Å; F195-Y398 HydrophobicContact CD1-CD2 3.97Å; F195-Y398 HydrophobicContact CD2-CD2 4.45Å; F195-Y398 AromaticContact CE1-CD2 3.67Å; F195-Y398 HydrophobicContact CE1-CD2 3.67Å; F195-Y398 HydrophobicContact CE1-CE2 4.26Å; F195-Y398 HydrophobicContact CE2-CD2 4.16Å; F195-Y398 HydrophobicContact CE2-CE2 4.08Å; F195-Y398 HydrophobicContact CG-CD2 4.35Å; F195-Y398 AromaticContact CZ-CD2 3.76Å; F195-Y398 HydrophobicContact CZ-CD2 3.76Å; F195-Y398 AromaticContact CZ-CE2 3.87Å; F195-Y398 HydrophobicContact CZ-CE2 3.87Å; Y398-L400 VanDerWaalsContact C-N 3.26Å; Y398-L400 PolarHBondContact O-N 2.06Å; Y398-G405 CarbonylContact O-C 3.6Å; Y398-G405 WeakPolarHBondContact O-CA 3.13Å; Y398-F406 HydrophobicContact CD1-CD1 4.3Å; Y398-F406 AromaticContact CD1-CE1 3.59Å; Y398-F406 HydrophobicContact CD1-CE1 3.59Å; Y398-F406 HydrophobicContact CD1-CZ 4Å; Y398-F406 HydrophobicContact CE1-CE1 4.46Å; Y398-F406 HydrophobicContact CG-CE1 4.35Å; Y398-F406 HydrophobicContact CG-CZ 4.43Å; Y398-F406 PolarHBondContact N-O 3.32Å; Y398-F406 PolarHBondContact O-N 3.22Å; Y398-M440 HydrophobicContact CD1-CE 3.98Å; Y398-M440 HydrophobicContact CD2-CE 3.68Å; Y398-M440 HydrophobicContact CE1-CE 4.41Å; Y398-M440 HydrophobicContact CE2-CE 4.17Å; Y398-M440 HydrophobicContact CG-CE 3.57Å; Y398-L544 HydrophobicContact CE2-CD1 4.4Å; Y398-L546 HydrophobicContact CE1-CD1 4.33Å
399	R	90.7	Very high	92.9	Very high	47 Å²	47	28.2 Å²	28.2	18%	0.177	15%	0.148	C	C	.	.	S	Bend	trans	48.2	42.6	179	-63.9	-179.5	59.4	-140.2	-20.1	113.3	D194 H401 A402 D404 G405	D194-R399 HydrophobicContact CB-CG 3.74Å; D194-R399 PolarHBondContact O-N 2.92Å; R399-H401 PolarHBondContact O-N 2.94Å; R399-A402 HydrophobicContact CB-CB 4.14Å; R399-A402 WeakPolarHBondContact O-CB 3.16Å; R399-A402 PolarHBondContact O-N 3.49Å; R399-D404 IonicContact CZ-OD1 3.58Å; R399-D404 IonicContact CZ-OD2 3.66Å; R399-D404 VanDerWaalsContact CZ-OD2 3.27Å; R399-D404 IonicContact NH1-OD1 2.67Å; R399-D404 IonicContact NH1-OD2 3.11Å; R399-D404 PolarHBondContact NH1-OD2 3.18Å; R399-D404 IonicContact NH2-OD1 3.91Å; R399-D404 PolarHBondContact NH2-OD1 3.16Å; R399-D404 IonicContact NH2-OD2 3.6Å; R399-D404 PolarHBondContact NH2-OD2 2.82Å; R399-G405 WeakPolarHBondContact O-CA 3.1Å
400	L	88	Confident	92.9	Very high	13 Å²	13	24.6 Å²	24.6	7%	0.068	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-21.4	-176.1	-59.9	-174.5	0	0	0	114.2	N80 T83 D86 S196 Y398 A402	N80-L400 HydrophobicContact CB-CD2 4.12Å; N80-L400 WeakPolarHBondContact O-CD1 3.32Å; N80-L400 WeakPolarHBondContact O-CD2 3.39Å; T83-L400 HydrophobicContact CG2-CD1 4.11Å; D86-L400 WeakPolarHBondContact OD2-CB 3.43Å; S196-L400 WeakPolarHBondContact OG-CD1 3.4Å; Y398-L400 VanDerWaalsContact C-N 3.26Å; Y398-L400 PolarHBondContact O-N 2.06Å; L400-A402 VanDerWaalsContact C-N 3.3Å
401	H	81.1	Confident	93	Very high	122 Å²	122	24.7 Å²	24.7	57%	0.565	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-12.4	174.4	63	-93.4	0	0	0	113.8	D194 R399	D194-H401 IonicContact OD1-CE1 2.66Å; R399-H401 PolarHBondContact O-N 2.94Å
402	A	83.1	Confident	92.9	Very high	16 Å²	16	24.7 Å²	24.7	13%	0.132	13%	0.131	C	C	.	.	S	Bend	trans	-107.8	154.2	-175.1	0	0	0	0	0	111.9	R399 L400 D404 G405	R399-A402 HydrophobicContact CB-CB 4.14Å; R399-A402 WeakPolarHBondContact O-CB 3.16Å; R399-A402 PolarHBondContact O-N 3.49Å; L400-A402 VanDerWaalsContact C-N 3.3Å; A402-D404 VanDerWaalsContact CB-OD1 3.25Å; A402-D404 WeakPolarHBondContact CB-OD1 3.4Å; A402-D404 PolarHBondContact O-N 3.3Å; A402-G405 PolarHBondContact O-N 3.12Å
403	P	82.7	Confident	92.9	Very high	141 Å²	141	24.7 Å²	24.7	92%	0.916	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-26.2	-179.3	-24.2	34.7	0	0	0	114.8
404	D	88.3	Confident	93	Very high	79 Å²	79	24.7 Å²	24.7	42%	0.422	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	6.8	177.4	60.8	-28.3	0	0	0	113.1	R399 A402	R399-D404 IonicContact CZ-OD1 3.58Å; R399-D404 IonicContact CZ-OD2 3.66Å; R399-D404 VanDerWaalsContact CZ-OD2 3.27Å; R399-D404 IonicContact NH1-OD1 2.67Å; R399-D404 IonicContact NH1-OD2 3.11Å; R399-D404 PolarHBondContact NH1-OD2 3.18Å; R399-D404 IonicContact NH2-OD1 3.91Å; R399-D404 PolarHBondContact NH2-OD1 3.16Å; R399-D404 IonicContact NH2-OD2 3.6Å; R399-D404 PolarHBondContact NH2-OD2 2.82Å; A402-D404 VanDerWaalsContact CB-OD1 3.25Å; A402-D404 WeakPolarHBondContact CB-OD1 3.4Å; A402-D404 PolarHBondContact O-N 3.3Å
405	G	90.7	Very high	93.1	Very high	2 Å²	2	23.9 Å²	23.9	2%	0.021	13%	0.128	C	C	.	.			trans	-64.5	147.8	175.9	0	0	0	0	0	112.7	N80 Y398 R399 A402 Q447	N80-G405 PolarHBondContact ND2-O 3.15Å; Y398-G405 CarbonylContact O-C 3.6Å; Y398-G405 WeakPolarHBondContact O-CA 3.13Å; R399-G405 WeakPolarHBondContact O-CA 3.1Å; A402-G405 PolarHBondContact O-N 3.12Å; G405-Q447 PolarHBondContact O-NE2 2.87Å
406	F	93.7	Very high	93.2	Very high	1 Å²	1	22.6 Å²	22.6	0%	0.004	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	159.1	-178.5	63.3	-88.7	0	0	0	114.2	G397 Y398 Y408 M440 Y444 Q447 L546	G397-F406 WeakPolarHBondContact CA-O 3.43Å; Y398-F406 HydrophobicContact CD1-CD1 4.3Å; Y398-F406 AromaticContact CD1-CE1 3.59Å; Y398-F406 HydrophobicContact CD1-CE1 3.59Å; Y398-F406 HydrophobicContact CD1-CZ 4Å; Y398-F406 HydrophobicContact CE1-CE1 4.46Å; Y398-F406 HydrophobicContact CG-CE1 4.35Å; Y398-F406 HydrophobicContact CG-CZ 4.43Å; Y398-F406 PolarHBondContact N-O 3.32Å; Y398-F406 PolarHBondContact O-N 3.22Å; F406-Y408 HydrophobicContact CE2-CD1 4.2Å; F406-M440 HydrophobicContact CE2-CB 4.34Å; F406-M440 WeakPolarHBondContact CE2-O 3.47Å; F406-M440 HydrophobicContact CZ-CB 4.36Å; F406-M440 HydrophobicContact CZ-CE 4.09Å; F406-Y444 AromaticContact CD1-CD2 3.8Å; F406-Y444 HydrophobicContact CD1-CD2 3.8Å; F406-Y444 AromaticContact CE1-CD2 3.85Å; F406-Y444 HydrophobicContact CE1-CD2 3.85Å; F406-Y444 HydrophobicContact CE1-CG 4.41Å; F406-Y444 HydrophobicContact CG-CD2 4.35Å; F406-Y444 HydrophobicContact CZ-CD2 4.46Å; F406-Q447 HydrophobicContact CB-CB 4.28Å; F406-Q447 HydrophobicContact CB-CG 4.3Å; F406-L546 HydrophobicContact CE1-CD1 3.66Å; F406-L546 HydrophobicContact CZ-CD1 3.89Å
407	N	95	Very high	93.3	Very high	12 Å²	12	21.8 Å²	21.8	6%	0.064	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	144.8	170.1	-71.5	-71.3	0	0	0	111.1	N80 W82 R395 Y396 A453	N80-N407 WeakPolarHBondContact CA-ND2 3.44Å; N80-N407 PolarHBondContact OD1-ND2 2.85Å; W82-N407 PolarHBondContact NE1-OD1 3.04Å; R395-N407 WeakPolarHBondContact CD-OD1 3.18Å; R395-N407 HydrophobicContact CG-CB 4.15Å; Y396-N407 WeakPolarHBondContact O-CA 3.43Å; N407-A453 HydrophobicContact CB-CB 3.8Å
408	Y	97	Very high	93.5	Very high	9 Å²	9	21.8 Å²	21.8	4%	0.035	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	156.8	173.3	70.2	-79.6	0	0	0	110.3	F195 R395 Y396 F406 T410 D439 M440	F195-Y408 HydrophobicContact CD1-CE1 4.39Å; F195-Y408 WeakPolarHBondContact CD1-OH 3.49Å; R395-Y408 WeakPolarHBondContact CA-O 3.29Å; Y396-Y408 PolarHBondContact N-O 2.95Å; Y396-Y408 PolarHBondContact O-N 2.84Å; F406-Y408 HydrophobicContact CE2-CD1 4.2Å; Y408-T410 HydrophobicContact CE2-CG2 4.28Å; Y408-D439 HydrophobicContact CD2-CB 4.1Å; Y408-D439 HydrophobicContact CE2-CB 4.49Å; Y408-M440 HydrophobicContact CD1-CG 4.3Å; Y408-M440 HydrophobicContact CD2-CG 3.97Å; Y408-M440 HydrophobicContact CE1-CG 4.09Å; Y408-M440 HydrophobicContact CE2-CG 3.72Å; Y408-M440 HydrophobicContact CG-CG 4.24Å
409	H	97.9	Very high	93.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.5	172.7	-67	-37.3	0	0	0	110.4	Y391 L392 G393 Q394 I415 D439 A453 I454	Y391-H409 AromaticContact CD1-CD2 3.74Å; Y391-H409 AromaticContact CD1-NE2 3.94Å; Y391-H409 AromaticContact CD2-CD2 3.44Å; Y391-H409 VanDerWaalsContact CD2-CD2 3.44Å; Y391-H409 WeakPolarHBondContact CD2-CD2 3.42Å; Y391-H409 AromaticContact CE1-CD2 3.61Å; Y391-H409 HydrophobicContact CE2-CB 3.97Å; Y391-H409 AromaticContact CE2-CD2 3.33Å; Y391-H409 WeakPolarHBondContact CE2-CD2 3.47Å; Y391-H409 AromaticContact CE2-CG 3.98Å; Y391-H409 AromaticContact CG-CD2 3.65Å; Y391-H409 AromaticContact CG-NE2 3.97Å; Y391-H409 AromaticContact CZ-CD2 3.4Å; Y391-H409 VanDerWaalsContact CZ-CD2 3.4Å; Y391-H409 AromaticContact CZ-CG 3.77Å; Y391-H409 PolarHBondContact O-NE2 3.37Å; Y391-H409 PolarHBondContact OH-N 3.12Å; L392-H409 PolarHBondContact O-CD2 3.18Å; G393-H409 PolarHBondContact N-CD2 3.34Å; G393-H409 VanDerWaalsContact N-CD2 3.27Å; G393-H409 PolarHBondContact N-NE2 2.91Å; G393-H409 PolarHBondContact O-ND1 3.01Å; Q394-H409 CarbonylContact O-C 3.55Å; Q394-H409 VanDerWaalsContact O-CA 3.23Å; Q394-H409 WeakPolarHBondContact O-CA 3.4Å; H409-I415 HydrophobicContact CB-CD1 4.36Å; H409-I415 HydrophobicContact CB-CG1 4.02Å; H409-I415 WeakPolarHBondContact O-CD1 3.5Å; H409-D439 WeakPolarHBondContact O-CB 3.24Å; H409-A453 VanDerWaalsContact CE1-C 3.5Å; H409-I454 VanDerWaalsContact CE1-C 3.44Å; H409-I454 PolarHBondContact CE1-O 3.33Å; H409-I454 PolarHBondContact NE2-N 3.35Å; H409-I454 PolarHBondContact NE2-O 3.37Å; H409-I454 VanDerWaalsContact NE2-O 3.13Å
410	T	97.9	Very high	93.9	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.006	13%	0.125	C	C	.	.			trans	-67.3	134.2	-177	66	0	0	0	0	111.4	Q394 Y396 Y408 G412 A413 Q461	Q394-T410 PolarHBondContact O-N 3.23Å; Y396-T410 HydrophobicContact CD1-CG2 3.71Å; Y396-T410 HydrophobicContact CD2-CG2 3.27Å; Y396-T410 HydrophobicContact CE1-CG2 3.87Å; Y396-T410 HydrophobicContact CE2-CG2 3.46Å; Y396-T410 VanDerWaalsContact CE2-CG2 3.46Å; Y396-T410 HydrophobicContact CG-CG2 3.39Å; Y408-T410 HydrophobicContact CE2-CG2 4.28Å; T410-G412 PolarHBondContact O-N 3.46Å; T410-A413 VanDerWaalsContact OG1-CB 3.29Å; T410-A413 WeakPolarHBondContact OG1-CB 3.31Å; T410-Q461 VanDerWaalsContact CB-CD 3.47Å; T410-Q461 HydrophobicContact CG2-CB 4.4Å; T410-Q461 HydrophobicContact CG2-CG 4.16Å; T410-Q461 WeakPolarHBondContact OG1-CB 3.44Å; T410-Q461 PolarHBondContact OG1-OE1 3.1Å
411	G	96.9	Very high	94.4	Very high	6 Å²	6	21 Å²	21	6%	0.062	12%	0.122	C	C	.	.	S	Bend	trans	-62.6	-41.8	-174.7	0	0	0	0	0	114	A413 G414 D439	G411-A413 PolarHBondContact O-N 3.42Å; G411-G414 WeakPolarHBondContact O-CA 3.18Å; G411-G414 PolarHBondContact O-N 2.85Å; G411-D439 PolarHBondContact N-OD2 2.72Å; G411-D439 VanDerWaalsContact N-OD2 3.1Å
412	G	96.9	Very high	95.3	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.01	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-31.5	-175.5	0	0	0	0	0	114.1	D356 T359 T410 G414 Q461 H481	D356-G412 WeakPolarHBondContact OD2-CA 3.41Å; T359-G412 VanDerWaalsContact CG2-O 3.29Å; T359-G412 WeakPolarHBondContact CG2-O 3.48Å; T359-G412 PolarHBondContact OG1-O 3.07Å; T410-G412 PolarHBondContact O-N 3.46Å; G412-G414 PolarHBondContact O-N 3.26Å; G412-Q461 VanDerWaalsContact C-OE1 3.27Å; G412-H481 WeakPolarHBondContact CA-CD2 3.38Å; G412-H481 VanDerWaalsContact O-CB 3.31Å; G412-H481 WeakPolarHBondContact O-CB 3.35Å; G412-H481 PolarHBondContact O-CD2 3.21Å; G412-H481 VanDerWaalsContact O-CD2 3.27Å
413	A	97.6	Very high	96	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-16.6	172.7	0	0	0	0	0	112.2	Q394 T410 G411 M459 H460 Q461 T479	Q394-A413 HydrophobicContact CB-CB 3.74Å; T410-A413 VanDerWaalsContact OG1-CB 3.29Å; T410-A413 WeakPolarHBondContact OG1-CB 3.31Å; G411-A413 PolarHBondContact O-N 3.42Å; A413-M459 HydrophobicContact CB-CB 4.41Å; A413-M459 VanDerWaalsContact O-CE 3.22Å; A413-M459 WeakPolarHBondContact O-CE 3.26Å; A413-H460 WeakPolarHBondContact CA-O 3.5Å; A413-Q461 HydrophobicContact CB-CB 4.33Å; A413-T479 VanDerWaalsContact O-CB 3.27Å; A413-T479 WeakPolarHBondContact O-CB 3.35Å; A413-T479 WeakPolarHBondContact O-CG2 3.25Å; A413-T479 PolarHBondContact O-OG1 2.97Å
414	G	98	Very high	96.7	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.075	C	C	.	.			trans	87.6	148.4	-168	0	0	0	0	0	111.9	L354 G411 G412 M459	L354-G414 CarbonylContact O-C 3.5Å; L354-G414 WeakPolarHBondContact O-CA 3.5Å; G411-G414 WeakPolarHBondContact O-CA 3.18Å; G411-G414 PolarHBondContact O-N 2.85Å; G412-G414 PolarHBondContact O-N 3.26Å; G414-M459 WeakPolarHBondContact O-CE 3.35Å
415	I	98.6	Very high	97.2	Very high	3 Å²	3	11.3 Å²	11.3	2%	0.015	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	128.8	178.1	-61.7	177.2	0	0	0	108.1	M353 L354 Y391 H409 L417 L442	M353-I415 CarbonylContact C-O 3.58Å; M353-I415 WeakPolarHBondContact CA-O 3.43Å; L354-I415 HydrophobicContact CB-CB 4.41Å; L354-I415 PolarHBondContact N-O 3.03Å; L354-I415 PolarHBondContact O-N 3.01Å; Y391-I415 HydrophobicContact CD2-CG2 3.88Å; Y391-I415 HydrophobicContact CE2-CG2 3.49Å; Y391-I415 VanDerWaalsContact CE2-CG2 3.49Å; H409-I415 HydrophobicContact CB-CD1 4.36Å; H409-I415 HydrophobicContact CB-CG1 4.02Å; H409-I415 WeakPolarHBondContact O-CD1 3.5Å; I415-L417 HydrophobicContact CG2-CD2 3.84Å; I415-L417 HydrophobicContact CG2-CG 3.98Å; I415-L442 HydrophobicContact CD1-CD2 4.17Å
416	V	98.2	Very high	97.5	Very high	1 Å²	1	13.5 Å²	13.5	1%	0.006	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	128.2	173.2	-169.5	0	0	0	0	110.6	W351 L352 M353 L381 L392	W351-V416 HydrophobicContact CB-CG1 4.45Å; W351-V416 HydrophobicContact CE3-CG1 4.09Å; L352-V416 WeakPolarHBondContact O-CA 3.4Å; M353-V416 HydrophobicContact CB-CG2 4.45Å; M353-V416 HydrophobicContact CE-CG2 4.16Å; M353-V416 HydrophobicContact CG-CG2 4.08Å; M353-V416 HydrophobicContact SD-CG2 4.17Å; L381-V416 HydrophobicContact CD1-CG1 4.29Å; L381-V416 HydrophobicContact CD2-CB 4.39Å; L381-V416 HydrophobicContact CD2-CG1 3.59Å; L392-V416 HydrophobicContact CB-CB 4.18Å; L392-V416 PolarHBondContact N-O 2.92Å; L392-V416 PolarHBondContact O-N 3.31Å
417	L	98.5	Very high	97.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133	-177.6	-57.2	171.6	0	0	0	109.2	L336 W351 L352 V390 Y391 I415 L421 V422 I425	L336-L417 HydrophobicContact CD2-CD1 4.05Å; W351-L417 CarbonylContact C-O 3.44Å; W351-L417 WeakPolarHBondContact CA-O 3.46Å; L352-L417 HydrophobicContact CD2-CD1 4.28Å; L352-L417 PolarHBondContact N-O 3.45Å; L352-L417 PolarHBondContact O-N 3.24Å; V390-L417 WeakPolarHBondContact O-CA 3.47Å; Y391-L417 HydrophobicContact CD2-CD2 3.53Å; Y391-L417 HydrophobicContact CE2-CD2 4.13Å; Y391-L417 HydrophobicContact CG-CD2 4.45Å; I415-L417 HydrophobicContact CG2-CD2 3.84Å; I415-L417 HydrophobicContact CG2-CG 3.98Å; L417-L421 HydrophobicContact CD2-CD2 3.61Å; L417-L421 HydrophobicContact CD2-CG 4.29Å; L417-V422 HydrophobicContact CB-CG2 3.64Å; L417-V422 HydrophobicContact CD1-CG2 4.05Å; L417-V422 HydrophobicContact CG-CG2 4.5Å; L417-I425 HydrophobicContact CD1-CD1 3.82Å; L417-I425 HydrophobicContact CD2-CD1 4.04Å
418	S	97.5	Very high	97.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	146.9	161.8	59.5	0	0	0	0	110.6	E388 V390 L421 V422	E388-S418 WeakPolarHBondContact O-CB 3.47Å; E388-S418 PolarHBondContact O-OG 3.41Å; V390-S418 PolarHBondContact N-OG 2.86Å; V390-S418 PolarHBondContact O-N 3.45Å; S418-L421 WeakPolarHBondContact O-CA 3.5Å; S418-L421 WeakPolarHBondContact O-CB 3.44Å; S418-L421 PolarHBondContact O-N 3.28Å; S418-L421 WeakPolarHBondContact OG-CB 3.15Å; S418-L421 PolarHBondContact OG-N 2.82Å; S418-V422 WeakPolarHBondContact O-CG2 3.25Å; S418-V422 PolarHBondContact O-N 3.29Å
419	L	97.1	Very high	98	Very high	11 Å²	11	28.3 Å²	28.3	6%	0.058	13%	0.131	C	C	.	.	H	α-helix	trans	-60.4	-38.2	-179.8	-169.7	61.9	0	0	0	113.8	L340 I343 I349 R350 L421 V422 R423	L340-L419 HydrophobicContact CD2-CD1 3.58Å; I343-L419 HydrophobicContact CD1-CD1 3.9Å; I343-L419 HydrophobicContact CG2-CD2 4.16Å; I349-L419 WeakPolarHBondContact O-CD2 3.48Å; R350-L419 PolarHBondContact O-N 2.78Å; L419-L421 VanDerWaalsContact C-N 3.28Å; L419-L421 PolarHBondContact O-N 2.9Å; L419-V422 PolarHBondContact O-N 2.92Å; L419-R423 PolarHBondContact O-N 2.88Å
420	P	97.7	Very high	97.9	Very high	37 Å²	37	32.9 Å²	32.9	24%	0.24	16%	0.163	C	C	.	.	H	α-helix	trans	-55.7	-40.5	169.4	-26.6	36.6	0	0	0	113.3	A386 L389 R423 L424	A386-P420 WeakPolarHBondContact O-CD 3.48Å; L389-P420 HydrophobicContact CD2-CB 4.17Å; P420-R423 WeakPolarHBondContact O-CB 3.49Å; P420-R423 PolarHBondContact O-N 2.68Å; P420-L424 PolarHBondContact O-N 2.92Å; P420-L424 VanDerWaalsContact O-N 3.07Å
421	L	98.5	Very high	97.8	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.1	-40.5	177.5	-177.4	60.2	0	0	0	112.4	L389 V390 Y391 L417 S418 L419 R423 L424 I425 L446 V451	L389-L421 HydrophobicContact CB-CD1 4.34Å; L389-L421 HydrophobicContact CD2-CB 4.18Å; L389-L421 HydrophobicContact CD2-CD1 4.25Å; V390-L421 WeakPolarHBondContact O-CD2 3.42Å; Y391-L421 HydrophobicContact CG-CD2 4.45Å; L417-L421 HydrophobicContact CD2-CD2 3.61Å; L417-L421 HydrophobicContact CD2-CG 4.29Å; S418-L421 WeakPolarHBondContact O-CA 3.5Å; S418-L421 WeakPolarHBondContact O-CB 3.44Å; S418-L421 PolarHBondContact O-N 3.28Å; S418-L421 WeakPolarHBondContact OG-CB 3.15Å; S418-L421 PolarHBondContact OG-N 2.82Å; L419-L421 VanDerWaalsContact C-N 3.28Å; L419-L421 PolarHBondContact O-N 2.9Å; L421-R423 VanDerWaalsContact C-N 3.26Å; L421-R423 PolarHBondContact O-N 3.47Å; L421-L424 HydrophobicContact CD1-CD2 4.29Å; L421-L424 WeakPolarHBondContact O-CB 3.11Å; L421-L424 PolarHBondContact O-N 3.03Å; L421-L424 VanDerWaalsContact O-N 3.11Å; L421-I425 HydrophobicContact CD1-CD1 4.36Å; L421-I425 HydrophobicContact CD1-CG1 4.34Å; L421-I425 HydrophobicContact CD2-CD1 4.49Å; L421-I425 HydrophobicContact CG-CD1 3.86Å; L421-I425 HydrophobicContact CG-CG1 4.34Å; L421-I425 VanDerWaalsContact O-CG1 3.32Å; L421-I425 WeakPolarHBondContact O-CG1 3.39Å; L421-I425 PolarHBondContact O-N 3.43Å; L421-L446 HydrophobicContact CD1-CD2 3.65Å; L421-L446 HydrophobicContact CD2-CD1 4.41Å; L421-L446 HydrophobicContact CG-CD2 4.47Å; L421-V451 HydrophobicContact CD1-CG1 4.08Å; L421-V451 HydrophobicContact CD1-CG2 4.01Å; L421-V451 HydrophobicContact CD2-CG1 4.15Å
422	V	98.4	Very high	97.8	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-57.6	-42.4	175.1	-175.6	0	0	0	0	110.8	L336 L340 L352 L417 S418 L419 I425 V426	L336-V422 HydrophobicContact CB-CG1 4.31Å; L336-V422 HydrophobicContact CD2-CG1 4.3Å; L340-V422 HydrophobicContact CD1-CG1 4.02Å; L340-V422 HydrophobicContact CD2-CB 4Å; L340-V422 HydrophobicContact CD2-CG1 3.62Å; L340-V422 HydrophobicContact CG-CB 4.49Å; L340-V422 HydrophobicContact CG-CG1 3.63Å; L352-V422 HydrophobicContact CB-CG2 3.77Å; L352-V422 HydrophobicContact CD1-CG1 4.22Å; L352-V422 HydrophobicContact CD1-CG2 4.16Å; L352-V422 HydrophobicContact CG-CG2 4.4Å; L417-V422 HydrophobicContact CB-CG2 3.64Å; L417-V422 HydrophobicContact CD1-CG2 4.05Å; L417-V422 HydrophobicContact CG-CG2 4.5Å; S418-V422 WeakPolarHBondContact O-CG2 3.25Å; S418-V422 PolarHBondContact O-N 3.29Å; L419-V422 PolarHBondContact O-N 2.92Å; V422-I425 PolarHBondContact O-N 3.38Å; V422-V426 WeakPolarHBondContact O-CG2 3.19Å; V422-V426 PolarHBondContact O-N 3.19Å; V422-V426 VanDerWaalsContact O-N 3.08Å
423	R	97.9	Very high	97.8	Very high	116 Å²	116	40.6 Å²	40.6	44%	0.438	21%	0.214	S	C	.	.	H	α-helix	trans	-61.7	-43.9	175.7	-65.4	-179.7	-174.9	114.2	-0.1	111.7	L340 L419 P420 L421 Q427	L340-R423 HydrophobicContact CD1-CG 4.17Å; L340-R423 HydrophobicContact CD2-CG 3.88Å; L419-R423 PolarHBondContact O-N 2.88Å; P420-R423 WeakPolarHBondContact O-CB 3.49Å; P420-R423 PolarHBondContact O-N 2.68Å; L421-R423 VanDerWaalsContact C-N 3.26Å; L421-R423 PolarHBondContact O-N 3.47Å; R423-Q427 WeakPolarHBondContact O-CB 3.45Å; R423-Q427 WeakPolarHBondContact O-CG 3.31Å; R423-Q427 PolarHBondContact O-N 2.81Å; R423-Q427 VanDerWaalsContact O-N 3.16Å
424	L	98.5	Very high	97.7	Very high	37 Å²	37	42.7 Å²	42.7	19%	0.194	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-44.1	178	-174.8	66.3	0	0	0	111.6	L389 P420 L421 Q427 R428 L449 V451	L389-L424 HydrophobicContact CD1-CD2 3.74Å; L389-L424 HydrophobicContact CD2-CD2 4.16Å; P420-L424 PolarHBondContact O-N 2.92Å; P420-L424 VanDerWaalsContact O-N 3.07Å; L421-L424 HydrophobicContact CD1-CD2 4.29Å; L421-L424 WeakPolarHBondContact O-CB 3.11Å; L421-L424 PolarHBondContact O-N 3.03Å; L421-L424 VanDerWaalsContact O-N 3.11Å; L424-Q427 PolarHBondContact O-N 2.78Å; L424-R428 HydrophobicContact CD1-CG 3.74Å; L424-R428 HydrophobicContact CG-CG 4.4Å; L424-R428 WeakPolarHBondContact O-CB 3.23Å; L424-R428 WeakPolarHBondContact O-CG 3.2Å; L424-R428 PolarHBondContact O-N 2.95Å; L424-L449 HydrophobicContact CD2-CD1 4.19Å; L424-L449 HydrophobicContact CG-CD1 4.18Å; L424-V451 HydrophobicContact CD2-CG2 4.49Å
425	I	98.6	Very high	97.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-58.5	-52.1	178	-68.9	158.2	0	0	0	110.5	M333 L336 L417 L421 V422 Q427 R428 C429 L442 L446	M333-I425 HydrophobicContact CE-CG2 4.47Å; M333-I425 HydrophobicContact SD-CG2 4.03Å; L336-I425 HydrophobicContact CD1-CG2 3.64Å; L417-I425 HydrophobicContact CD1-CD1 3.82Å; L417-I425 HydrophobicContact CD2-CD1 4.04Å; L421-I425 HydrophobicContact CD1-CD1 4.36Å; L421-I425 HydrophobicContact CD1-CG1 4.34Å; L421-I425 HydrophobicContact CD2-CD1 4.49Å; L421-I425 HydrophobicContact CG-CD1 3.86Å; L421-I425 HydrophobicContact CG-CG1 4.34Å; L421-I425 VanDerWaalsContact O-CG1 3.32Å; L421-I425 WeakPolarHBondContact O-CG1 3.39Å; L421-I425 PolarHBondContact O-N 3.43Å; V422-I425 PolarHBondContact O-N 3.38Å; I425-Q427 PolarHBondContact O-N 2.91Å; I425-R428 PolarHBondContact O-N 2.95Å; I425-C429 HydrophobicContact CG2-CB 4.05Å; I425-C429 WeakPolarHBondContact O-CB 3.04Å; I425-C429 PolarHBondContact O-N 2.86Å; I425-L442 HydrophobicContact CD1-CD1 3.75Å; I425-L442 HydrophobicContact CG1-CD1 3.88Å; I425-L442 HydrophobicContact CG2-CD1 3.75Å; I425-L446 HydrophobicContact CD1-CD1 4.45Å; I425-L446 HydrophobicContact CD1-CD2 4.28Å; I425-L446 HydrophobicContact CG1-CD2 3.78Å
426	V	98.1	Very high	97.5	Very high	49 Å²	49	45.7 Å²	45.7	30%	0.297	25%	0.253	S	S	.	.	H	α-helix	trans	-61.9	-27.1	-179.1	171.5	0	0	0	0	112.1	L336 Q337 L340 V422	L336-V426 HydrophobicContact CB-CG2 3.86Å; Q337-V426 HydrophobicContact CB-CG1 4.21Å; Q337-V426 HydrophobicContact CB-CG2 4.4Å; Q337-V426 HydrophobicContact CG-CG1 4.15Å; L340-V426 HydrophobicContact CD1-CB 3.96Å; L340-V426 HydrophobicContact CD1-CG1 4.31Å; L340-V426 HydrophobicContact CD1-CG2 3.73Å; V422-V426 WeakPolarHBondContact O-CG2 3.19Å; V422-V426 PolarHBondContact O-N 3.19Å; V422-V426 VanDerWaalsContact O-N 3.08Å
427	Q	98	Very high	97.5	Very high	141 Å²	141	47.1 Å²	47.1	66%	0.659	26%	0.263	S	S	*	.	H	α-helix	trans	-85	-30.4	178.4	-72.5	172.8	7.6	0	0	114.2	R423 L424 I425	R423-Q427 WeakPolarHBondContact O-CB 3.45Å; R423-Q427 WeakPolarHBondContact O-CG 3.31Å; R423-Q427 PolarHBondContact O-N 2.81Å; R423-Q427 VanDerWaalsContact O-N 3.16Å; L424-Q427 PolarHBondContact O-N 2.78Å; I425-Q427 PolarHBondContact O-N 2.91Å
428	R	98.3	Very high	97.4	Very high	174 Å²	174	47.9 Å²	47.9	66%	0.657	27%	0.266	S	S	*	.	H	α-helix	trans	-122.2	-20.3	-164.4	-61.5	-61.6	-172.7	141.7	1.2	114.7	L424 I425 L449	L424-R428 HydrophobicContact CD1-CG 3.74Å; L424-R428 HydrophobicContact CG-CG 4.4Å; L424-R428 WeakPolarHBondContact O-CB 3.23Å; L424-R428 WeakPolarHBondContact O-CG 3.2Å; L424-R428 PolarHBondContact O-N 2.95Å; I425-R428 PolarHBondContact O-N 2.95Å; R428-L449 HydrophobicContact CB-CD1 3.98Å; R428-L449 HydrophobicContact CB-CD2 4.12Å; R428-L449 HydrophobicContact CG-CD2 4.35Å
429	C	98.3	Very high	97.4	Very high	17 Å²	17	49 Å²	49	12%	0.115	27%	0.272	C	S	.	.			trans	-98.9	146.2	-179.9	-56.8	0	0	0	0	111.1	M333 I425 C445	M333-C429 HydrophobicContact CE-CB 3.66Å; M333-C429 HydrophobicContact SD-CB 4.39Å; I425-C429 HydrophobicContact CG2-CB 4.05Å; I425-C429 WeakPolarHBondContact O-CB 3.04Å; I425-C429 PolarHBondContact O-N 2.86Å; C429-C445 WeakPolarHBondContact CA-SG 3.3Å; C429-C445 HydrophobicContact CB-CB 3.88Å; C429-C445 WeakPolarHBondContact CB-SG 3.45Å; C429-C445 WeakPolarHBondContact SG-CB 3.4Å; C429-C445 CovalentContact SG-SG 2.04Å; C429-C445 PolarHBondContact SG-SG 3.03Å
430	S	96.6	Very high	97.4	Very high	96 Å²	96	48.8 Å²	48.8	67%	0.671	27%	0.271	S	S	*	.			trans	-140.7	155.9	176.6	56.8	0	0	0	0	110.2
431	C	96.5	Very high	97.4	Very high	35 Å²	35	47.4 Å²	47.4	24%	0.236	26%	0.262	C	S	.	.			trans	-93	133	176.3	-66.6	0	0	0	0	111	C329 A330 M333 S433	C329-C431 VanDerWaalsContact CA-SG 3.6Å; C329-C431 HydrophobicContact CB-CB 3.78Å; C329-C431 WeakPolarHBondContact CB-SG 3.41Å; C329-C431 PolarHBondContact O-SG 3.2Å; C329-C431 VanDerWaalsContact SG-CA 3.53Å; C329-C431 WeakPolarHBondContact SG-CB 3.43Å; C329-C431 CovalentContact SG-SG 2.04Å; C329-C431 PolarHBondContact SG-SG 3.13Å; A330-C431 PolarHBondContact N-SG 3.19Å; A330-C431 VanDerWaalsContact N-SG 3.4Å; M333-C431 WeakPolarHBondContact CG-SG 3.33Å; C431-S433 VanDerWaalsContact C-N 3.28Å; C431-S433 PolarHBondContact O-N 2.84Å
432	P	95.7	Very high	97.4	Very high	81 Å²	81	47.6 Å²	47.6	53%	0.526	26%	0.263	S	S	.	.	S	Bend	trans	-68.8	-30.4	172.5	26.3	-31.5	0	0	0	111.7	A436 I441	P432-A436 HydrophobicContact CG-CB 3.81Å; P432-I441 HydrophobicContact CG-CD1 3.63Å; P432-I441 HydrophobicContact CG-CG1 4.3Å
433	S	96.4	Very high	97.4	Very high	55 Å²	55	47.6 Å²	47.6	39%	0.385	26%	0.263	S	S	.	.	S	Bend	trans	-154	165.4	170.4	69.2	0	0	0	0	111.1	C431 S435 A436	C431-S433 VanDerWaalsContact C-N 3.28Å; C431-S433 PolarHBondContact O-N 2.84Å; S433-S435 PolarHBondContact O-N 3.4Å; S433-A436 PolarHBondContact O-N 3.26Å; S433-A436 PolarHBondContact OG-N 3.14Å
434	A	95.5	Very high	97.3	Very high	44 Å²	44	47.2 Å²	47.2	36%	0.364	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-30.1	176.5	0	0	0	0	0	113.3	V324 H328 C329 A330	V324-A434 HydrophobicContact CG1-CB 4.32Å; H328-A434 CarbonylContact C-O 3.58Å; H328-A434 WeakPolarHBondContact CA-O 3.45Å; H328-A434 PolarHBondContact N-O 2.9Å; C329-A434 PolarHBondContact N-O 3.03Å; A330-A434 HydrophobicContact CB-CB 3.86Å
435	S	96.5	Very high	97.3	Very high	57 Å²	57	46.3 Å²	46.3	40%	0.399	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	6.8	-177.1	56.3	0	0	0	0	114.5	T326 G327 S433	T326-S435 VanDerWaalsContact O-CA 3.31Å; T326-S435 WeakPolarHBondContact O-CA 3.23Å; G327-S435 WeakPolarHBondContact CA-O 3.48Å; S433-S435 PolarHBondContact O-N 3.4Å
436	A	97.3	Very high	97.2	Very high	9 Å²	9	46.3 Å²	46.3	7%	0.074	26%	0.259	C	S	.	.	S	Bend	trans	-63.6	147.1	172.8	0	0	0	0	0	110.7	G327 H328 C329 P432 S433 D438 I441	G327-A436 CarbonylContact C-O 3.48Å; G327-A436 WeakPolarHBondContact CA-O 3.41Å; H328-A436 PolarHBondContact N-O 2.71Å; C329-A436 HydrophobicContact CB-CB 3.96Å; C329-A436 VanDerWaalsContact CB-O 3.32Å; C329-A436 WeakPolarHBondContact CB-O 3.08Å; C329-A436 PolarHBondContact N-O 3.33Å; P432-A436 HydrophobicContact CG-CB 3.81Å; S433-A436 PolarHBondContact O-N 3.26Å; S433-A436 PolarHBondContact OG-N 3.14Å; A436-D438 PolarHBondContact O-N 2.9Å; A436-D438 VanDerWaalsContact O-N 3.13Å; A436-I441 HydrophobicContact CB-CD1 4.25Å; A436-I441 HydrophobicContact CB-CG1 3.79Å
437	P	96.9	Very high	97.1	Very high	31 Å²	31	46 Å²	46	20%	0.201	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-62.2	111.5	176.6	25.5	-32.9	0	0	0	110	D439 M440 I441 L544	P437-D439 PolarHBondContact O-N 2.8Å; P437-M440 HydrophobicContact CB-CB 4.07Å; P437-M440 HydrophobicContact CB-CG 4.11Å; P437-M440 HydrophobicContact CB-SD 4.06Å; P437-M440 HydrophobicContact CG-CB 3.95Å; P437-M440 HydrophobicContact CG-CG 4.28Å; P437-M440 HydrophobicContact CG-SD 3.91Å; P437-M440 PolarHBondContact O-N 2.66Å; P437-I441 VanDerWaalsContact O-CG1 3.24Å; P437-I441 WeakPolarHBondContact O-CG1 3.3Å; P437-I441 PolarHBondContact O-N 3.35Å; P437-L544 HydrophobicContact CG-CD1 4.48Å; P437-L544 HydrophobicContact CG-CD2 4.14Å
438	D	97.5	Very high	96.9	Very high	15 Å²	15	43.1 Å²	43.1	8%	0.08	26%	0.255	C	S	.	.	H	α-helix	trans	-66.6	-42.1	-167.1	62.1	-30.1	0	0	0	113.1	K279 C329 T332 A436 L442	K279-D438 IonicContact NZ-OD1 3.25Å; K279-D438 IonicContact NZ-OD2 3.35Å; K279-D438 PolarHBondContact NZ-OD2 3.1Å; C329-D438 HydrophobicContact CB-CB 4.26Å; T332-D438 HydrophobicContact CG2-CB 4.27Å; T332-D438 PolarHBondContact OG1-OD2 2.56Å; A436-D438 PolarHBondContact O-N 2.9Å; A436-D438 VanDerWaalsContact O-N 3.13Å; D438-L442 VanDerWaalsContact O-CB 3.28Å; D438-L442 WeakPolarHBondContact O-CB 3.32Å; D438-L442 PolarHBondContact O-N 3.02Å
439	D	97.8	Very high	96.9	Very high	24 Å²	24	37.9 Å²	37.9	13%	0.128	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-43.9	176.5	56.2	-1	0	0	0	113	Y408 H409 G411 P437 L442 G443	Y408-D439 HydrophobicContact CD2-CB 4.1Å; Y408-D439 HydrophobicContact CE2-CB 4.49Å; H409-D439 WeakPolarHBondContact O-CB 3.24Å; G411-D439 PolarHBondContact N-OD2 2.72Å; G411-D439 VanDerWaalsContact N-OD2 3.1Å; P437-D439 PolarHBondContact O-N 2.8Å; D439-L442 PolarHBondContact O-N 2.81Å; D439-G443 PolarHBondContact O-N 3.14Å
440	M	97.4	Very high	96.7	Very high	7 Å²	7	39.9 Å²	39.9	3%	0.034	26%	0.262	C	S	.	.	H	α-helix	trans	-66.8	-44.3	176	-64.5	-175.8	71.7	0	0	112.2	F195 Y398 F406 Y408 P437 L442 G443 Y444 L544	F195-M440 HydrophobicContact CE1-CE 3.67Å; F195-M440 HydrophobicContact CE1-SD 3.75Å; F195-M440 HydrophobicContact CZ-CE 4.06Å; F195-M440 HydrophobicContact CZ-SD 4.11Å; Y398-M440 HydrophobicContact CD1-CE 3.98Å; Y398-M440 HydrophobicContact CD2-CE 3.68Å; Y398-M440 HydrophobicContact CE1-CE 4.41Å; Y398-M440 HydrophobicContact CE2-CE 4.17Å; Y398-M440 HydrophobicContact CG-CE 3.57Å; F406-M440 HydrophobicContact CE2-CB 4.34Å; F406-M440 WeakPolarHBondContact CE2-O 3.47Å; F406-M440 HydrophobicContact CZ-CB 4.36Å; F406-M440 HydrophobicContact CZ-CE 4.09Å; Y408-M440 HydrophobicContact CD1-CG 4.3Å; Y408-M440 HydrophobicContact CD2-CG 3.97Å; Y408-M440 HydrophobicContact CE1-CG 4.09Å; Y408-M440 HydrophobicContact CE2-CG 3.72Å; Y408-M440 HydrophobicContact CG-CG 4.24Å; P437-M440 HydrophobicContact CB-CB 4.07Å; P437-M440 HydrophobicContact CB-CG 4.11Å; P437-M440 HydrophobicContact CB-SD 4.06Å; P437-M440 HydrophobicContact CG-CB 3.95Å; P437-M440 HydrophobicContact CG-CG 4.28Å; P437-M440 HydrophobicContact CG-SD 3.91Å; P437-M440 PolarHBondContact O-N 2.66Å; M440-L442 VanDerWaalsContact C-N 3.27Å; M440-L442 PolarHBondContact O-N 2.89Å; M440-G443 PolarHBondContact O-N 2.91Å; M440-Y444 WeakPolarHBondContact O-CB 3.44Å; M440-Y444 PolarHBondContact O-N 3Å; M440-L544 HydrophobicContact CE-CD1 3.39Å; M440-L544 HydrophobicContact SD-CD1 3.61Å
441	I	97.7	Very high	96.6	Very high	8 Å²	8	35.7 Å²	35.7	4%	0.041	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-39.7	176.4	-65.8	-59.7	0	0	0	110.6	P432 A436 P437 C445 L546	P432-I441 HydrophobicContact CG-CD1 3.63Å; P432-I441 HydrophobicContact CG-CG1 4.3Å; A436-I441 HydrophobicContact CB-CD1 4.25Å; A436-I441 HydrophobicContact CB-CG1 3.79Å; P437-I441 VanDerWaalsContact O-CG1 3.24Å; P437-I441 WeakPolarHBondContact O-CG1 3.3Å; P437-I441 PolarHBondContact O-N 3.35Å; I441-C445 WeakPolarHBondContact O-CB 3.45Å; I441-C445 PolarHBondContact O-N 3.21Å; I441-L546 HydrophobicContact CD1-CD2 3.43Å; I441-L546 VanDerWaalsContact CD1-CD2 3.43Å
442	L	97.8	Very high	96.4	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-63.1	-49	175	-175.4	62.3	0	0	0	111.2	Y391 I415 I425 D438 D439 M440 Y444 C445 L446	Y391-L442 HydrophobicContact CE2-CD2 4.22Å; I415-L442 HydrophobicContact CD1-CD2 4.17Å; I425-L442 HydrophobicContact CD1-CD1 3.75Å; I425-L442 HydrophobicContact CG1-CD1 3.88Å; I425-L442 HydrophobicContact CG2-CD1 3.75Å; D438-L442 VanDerWaalsContact O-CB 3.28Å; D438-L442 WeakPolarHBondContact O-CB 3.32Å; D438-L442 PolarHBondContact O-N 3.02Å; D439-L442 PolarHBondContact O-N 2.81Å; M440-L442 VanDerWaalsContact C-N 3.27Å; M440-L442 PolarHBondContact O-N 2.89Å; L442-Y444 PolarHBondContact O-N 2.83Å; L442-C445 PolarHBondContact O-N 3.28Å; L442-L446 HydrophobicContact CD1-CD1 4.06Å; L442-L446 HydrophobicContact CD1-CG 4.17Å; L442-L446 HydrophobicContact CG-CD1 3.96Å; L442-L446 HydrophobicContact CG-CG 4.4Å; L442-L446 WeakPolarHBondContact O-CB 3.46Å; L442-L446 VanDerWaalsContact O-CG 3.23Å; L442-L446 WeakPolarHBondContact O-CG 3.39Å; L442-L446 PolarHBondContact O-N 2.96Å
443	G	97.3	Very high	96.4	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-45.2	177.8	0	0	0	0	0	113	D439 M440 L446 Q447	D439-G443 PolarHBondContact O-N 3.14Å; M440-G443 PolarHBondContact O-N 2.91Å; G443-L446 PolarHBondContact O-N 2.74Å; G443-Q447 WeakPolarHBondContact O-CB 2.95Å; G443-Q447 PolarHBondContact O-N 3.15Å
444	Y	96.8	Very high	96.2	Very high	107 Å²	107	31.4 Å²	31.4	42%	0.42	20%	0.204	S	C	.	.	H	α-helix	trans	-59.9	-48.7	176.2	179.1	-104.5	0	0	0	112	F406 M440 L442 L446 Q447 A448	F406-Y444 AromaticContact CD1-CD2 3.8Å; F406-Y444 HydrophobicContact CD1-CD2 3.8Å; F406-Y444 AromaticContact CE1-CD2 3.85Å; F406-Y444 HydrophobicContact CE1-CD2 3.85Å; F406-Y444 HydrophobicContact CE1-CG 4.41Å; F406-Y444 HydrophobicContact CG-CD2 4.35Å; F406-Y444 HydrophobicContact CZ-CD2 4.46Å; M440-Y444 WeakPolarHBondContact O-CB 3.44Å; M440-Y444 PolarHBondContact O-N 3Å; L442-Y444 PolarHBondContact O-N 2.83Å; Y444-L446 VanDerWaalsContact C-N 3.35Å; Y444-L446 PolarHBondContact O-N 2.61Å; Y444-Q447 PolarHBondContact O-N 2.82Å; Y444-A448 PolarHBondContact O-N 2.87Å
445	C	98.1	Very high	96.1	Very high	18 Å²	18	32.9 Å²	32.9	12%	0.122	20%	0.203	C	C	.	.	H	α-helix	trans	-59.6	-46.1	176.7	-178.6	0	0	0	0	111.7	C429 I441 L442 Q447 A448 L449	C429-C445 WeakPolarHBondContact CA-SG 3.3Å; C429-C445 HydrophobicContact CB-CB 3.88Å; C429-C445 WeakPolarHBondContact CB-SG 3.45Å; C429-C445 WeakPolarHBondContact SG-CB 3.4Å; C429-C445 CovalentContact SG-SG 2.04Å; C429-C445 PolarHBondContact SG-SG 3.03Å; I441-C445 WeakPolarHBondContact O-CB 3.45Å; I441-C445 PolarHBondContact O-N 3.21Å; L442-C445 PolarHBondContact O-N 3.28Å; C445-Q447 VanDerWaalsContact C-N 3.35Å; C445-Q447 PolarHBondContact O-N 2.78Å; C445-A448 WeakPolarHBondContact O-CB 3.38Å; C445-A448 PolarHBondContact O-N 2.62Å; C445-A448 VanDerWaalsContact O-N 3.17Å; C445-L449 WeakPolarHBondContact O-CG 3.48Å; C445-L449 PolarHBondContact O-N 3.24Å
446	L	97.3	Very high	96	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-66.9	-36.5	-178.1	-71.8	-176.5	0	0	0	112.4	Y391 L421 I425 L442 G443 Y444 L449 G450 V451	Y391-L446 HydrophobicContact CD1-CB 4.48Å; Y391-L446 HydrophobicContact CD1-CD1 3.52Å; Y391-L446 HydrophobicContact CD2-CD1 3.79Å; Y391-L446 HydrophobicContact CE1-CD1 3.63Å; Y391-L446 HydrophobicContact CE2-CD1 3.85Å; Y391-L446 HydrophobicContact CG-CD1 3.62Å; L421-L446 HydrophobicContact CD1-CD2 3.65Å; L421-L446 HydrophobicContact CD2-CD1 4.41Å; L421-L446 HydrophobicContact CG-CD2 4.47Å; I425-L446 HydrophobicContact CD1-CD1 4.45Å; I425-L446 HydrophobicContact CD1-CD2 4.28Å; I425-L446 HydrophobicContact CG1-CD2 3.78Å; L442-L446 HydrophobicContact CD1-CD1 4.06Å; L442-L446 HydrophobicContact CD1-CG 4.17Å; L442-L446 HydrophobicContact CG-CD1 3.96Å; L442-L446 HydrophobicContact CG-CG 4.4Å; L442-L446 WeakPolarHBondContact O-CB 3.46Å; L442-L446 VanDerWaalsContact O-CG 3.23Å; L442-L446 WeakPolarHBondContact O-CG 3.39Å; L442-L446 PolarHBondContact O-N 2.96Å; G443-L446 PolarHBondContact O-N 2.74Å; Y444-L446 VanDerWaalsContact C-N 3.35Å; Y444-L446 PolarHBondContact O-N 2.61Å; L446-L449 HydrophobicContact CD2-CD1 4.34Å; L446-L449 CarbonylContact O-C 3.6Å; L446-L449 PolarHBondContact O-N 3.35Å; L446-G450 PolarHBondContact O-N 3.37Å; L446-G450 VanDerWaalsContact O-N 3.14Å; L446-V451 HydrophobicContact CB-CB 4.2Å; L446-V451 HydrophobicContact CD2-CB 4.29Å; L446-V451 HydrophobicContact CD2-CG2 4.35Å; L446-V451 PolarHBondContact O-N 3.23Å
447	Q	94.4	Very high	95.7	Very high	41 Å²	41	31.8 Å²	31.8	19%	0.192	20%	0.197	C	C	.	.	H	α-helix	trans	-60	-46.7	169.7	169.7	156.8	-42.5	0	0	111.5	F79 N80 G405 F406 G443 Y444 C445 L449 G450	F79-Q447 HydrophobicContact CE1-CG 4.09Å; F79-Q447 HydrophobicContact CZ-CG 4.04Å; N80-Q447 PolarHBondContact ND2-NE2 3.09Å; N80-Q447 PolarHBondContact ND2-OE1 3.37Å; N80-Q447 PolarHBondContact OD1-OE1 3.24Å; G405-Q447 PolarHBondContact O-NE2 2.87Å; F406-Q447 HydrophobicContact CB-CB 4.28Å; F406-Q447 HydrophobicContact CB-CG 4.3Å; G443-Q447 WeakPolarHBondContact O-CB 2.95Å; G443-Q447 PolarHBondContact O-N 3.15Å; Y444-Q447 PolarHBondContact O-N 2.82Å; C445-Q447 VanDerWaalsContact C-N 3.35Å; C445-Q447 PolarHBondContact O-N 2.78Å; Q447-L449 PolarHBondContact O-N 2.9Å; Q447-G450 PolarHBondContact O-N 3.1Å
448	A	95.2	Very high	95.4	Very high	81 Å²	81	30.6 Å²	30.6	67%	0.669	19%	0.19	S	C	*	.	H	α-helix	trans	-62	-28	177.1	0	0	0	0	0	112.7	Y444 C445 G450	Y444-A448 PolarHBondContact O-N 2.87Å; C445-A448 WeakPolarHBondContact O-CB 3.38Å; C445-A448 PolarHBondContact O-N 2.62Å; C445-A448 VanDerWaalsContact O-N 3.17Å; A448-G450 VanDerWaalsContact C-N 3.33Å
449	L	96.9	Very high	95.4	Very high	65 Å²	65	30 Å²	30	34%	0.34	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-0.2	174.3	-66.1	170.8	0	0	0	113.8	L424 R428 C445 L446 Q447 V451	L424-L449 HydrophobicContact CD2-CD1 4.19Å; L424-L449 HydrophobicContact CG-CD1 4.18Å; R428-L449 HydrophobicContact CB-CD1 3.98Å; R428-L449 HydrophobicContact CB-CD2 4.12Å; R428-L449 HydrophobicContact CG-CD2 4.35Å; C445-L449 WeakPolarHBondContact O-CG 3.48Å; C445-L449 PolarHBondContact O-N 3.24Å; L446-L449 HydrophobicContact CD2-CD1 4.34Å; L446-L449 CarbonylContact O-C 3.6Å; L446-L449 PolarHBondContact O-N 3.35Å; Q447-L449 PolarHBondContact O-N 2.9Å; L449-V451 VanDerWaalsContact C-N 3.33Å; L449-V451 HydrophobicContact CB-CG2 4.33Å; L449-V451 PolarHBondContact O-N 3.44Å
450	G	94.8	Very high	95.3	Very high	58 Å²	58	29.5 Å²	29.5	60%	0.598	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.8	20.5	-179.3	0	0	0	0	0	114.5	L446 Q447 A448	L446-G450 PolarHBondContact O-N 3.37Å; L446-G450 VanDerWaalsContact O-N 3.14Å; Q447-G450 PolarHBondContact O-N 3.1Å; A448-G450 VanDerWaalsContact C-N 3.33Å
451	V	95.5	Very high	95.3	Very high	8 Å²	8	31 Å²	31	5%	0.048	19%	0.19	C	C	.	.			trans	-90.7	117.8	177.5	179.9	0	0	0	0	109.5	L389 L421 L424 L446 L449	L389-V451 HydrophobicContact CB-CG1 4.44Å; L389-V451 HydrophobicContact CB-CG2 4.21Å; L389-V451 HydrophobicContact CD1-CG2 3.99Å; L421-V451 HydrophobicContact CD1-CG1 4.08Å; L421-V451 HydrophobicContact CD1-CG2 4.01Å; L421-V451 HydrophobicContact CD2-CG1 4.15Å; L424-V451 HydrophobicContact CD2-CG2 4.49Å; L446-V451 HydrophobicContact CB-CB 4.2Å; L446-V451 HydrophobicContact CD2-CB 4.29Å; L446-V451 HydrophobicContact CD2-CG2 4.35Å; L446-V451 PolarHBondContact O-N 3.23Å; L449-V451 VanDerWaalsContact C-N 3.33Å; L449-V451 HydrophobicContact CB-CG2 4.33Å; L449-V451 PolarHBondContact O-N 3.44Å
452	P	92	Very high	95.2	Very high	52 Å²	52	30.7 Å²	30.7	34%	0.338	19%	0.189	S	C	.	.			trans	-73.5	137.6	-177.1	29	-34.1	0	0	0	112.3	I454	P452-I454 PolarHBondContact O-N 3.38Å
453	A	94.3	Very high	95.2	Very high	16 Å²	16	31.6 Å²	31.6	13%	0.132	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	96.4	170.7	0	0	0	0	0	110.5	Y391 N407 H409 H455	Y391-A453 HydrophobicContact CD1-CB 3.93Å; Y391-A453 HydrophobicContact CE1-CB 3.86Å; N407-A453 HydrophobicContact CB-CB 3.8Å; H409-A453 VanDerWaalsContact CE1-C 3.5Å; A453-H455 PolarHBondContact O-N 2.97Å
454	I	93.7	Very high	95.1	Very high	14 Å²	14	31.9 Å²	31.9	7%	0.072	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	113.5	-178.1	-59.6	167.4	0	0	0	109.9	H36 Y391 L392 G393 H409 P452	H36-I454 HydrophobicContact CB-CB 4.43Å; H36-I454 HydrophobicContact CB-CG1 4.06Å; H36-I454 HydrophobicContact CB-CG2 3.78Å; Y391-I454 PolarHBondContact O-N 2.91Å; L392-I454 WeakPolarHBondContact CA-O 3.22Å; L392-I454 HydrophobicContact CD2-CB 3.63Å; L392-I454 HydrophobicContact CD2-CD1 3.94Å; L392-I454 HydrophobicContact CD2-CG1 4.37Å; L392-I454 HydrophobicContact CD2-CG2 3.65Å; G393-I454 PolarHBondContact N-O 2.86Å; H409-I454 VanDerWaalsContact CE1-C 3.44Å; H409-I454 PolarHBondContact CE1-O 3.33Å; H409-I454 PolarHBondContact NE2-N 3.35Å; H409-I454 PolarHBondContact NE2-O 3.37Å; H409-I454 VanDerWaalsContact NE2-O 3.13Å; P452-I454 PolarHBondContact O-N 3.38Å
455	H	93.7	Very high	94.9	Very high	74 Å²	74	29.4 Å²	29.4	34%	0.343	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	138.4	178.7	-178.5	44.8	0	0	0	112.3	G393 R395 A453	G393-H455 CarbonylContact O-C 3.56Å; G393-H455 WeakPolarHBondContact O-CA 3.23Å; R395-H455 HydrophobicContact CB-CB 3.73Å; R395-H455 PolarHBondContact N-ND1 2.69Å; A453-H455 PolarHBondContact O-N 2.97Å
456	V	92.9	Very high	94.8	Very high	11 Å²	11	28.7 Å²	28.7	7%	0.067	18%	0.181	C	C	.	.			trans	-118.7	108.8	171.6	-176.3	0	0	0	0	109.7	L380 L392 G393 G458 M459 L478	L380-V456 HydrophobicContact CD1-CG1 4.03Å; L380-V456 HydrophobicContact CD1-CG2 4.18Å; L380-V456 HydrophobicContact CD2-CG1 3.85Å; L380-V456 HydrophobicContact CD2-CG2 4.07Å; L392-V456 HydrophobicContact CB-CG2 3.8Å; G393-V456 PolarHBondContact O-N 2.66Å; V456-G458 PolarHBondContact O-N 3.45Å; V456-G458 VanDerWaalsContact O-N 3.12Å; V456-M459 HydrophobicContact CB-CB 4.45Å; V456-M459 HydrophobicContact CB-CG 3.95Å; V456-M459 HydrophobicContact CB-SD 3.83Å; V456-M459 HydrophobicContact CG1-CG 3.75Å; V456-M459 HydrophobicContact CG1-SD 3.96Å; V456-M459 HydrophobicContact CG2-SD 4.14Å; V456-M459 PolarHBondContact O-N 3.05Å; V456-L478 HydrophobicContact CG1-CD1 3.37Å
457	A	90.8	Very high	94.7	Very high	33 Å²	33	30 Å²	30	27%	0.273	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-23.6	-175	0	0	0	0	0	114.6	H475	A457-H475 HydrophobicContact CB-CB 4.17Å
458	G	92.1	Very high	94.7	Very high	5 Å²	5	28.2 Å²	28.2	5%	0.052	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-7	177.7	0	0	0	0	0	114.8	V456 H460 L478 T479	V456-G458 PolarHBondContact O-N 3.45Å; V456-G458 VanDerWaalsContact O-N 3.12Å; G458-H460 VanDerWaalsContact C-CE1 3.49Å; G458-H460 PolarHBondContact O-CE1 2.87Å; G458-H460 PolarHBondContact O-ND1 2.96Å; G458-L478 WeakPolarHBondContact O-CA 3.31Å; G458-L478 WeakPolarHBondContact O-CB 3.31Å; G458-L478 PolarHBondContact O-N 2.85Å; G458-T479 PolarHBondContact O-N 2.66Å
459	M	96	Very high	94.6	Very high	3 Å²	3	25.5 Å²	25.5	2%	0.015	16%	0.158	C	C	.	.			trans	-97.2	134.8	-176.9	-63.1	-177.5	71.1	0	0	110.9	M353 Q394 A413 G414 V456 L478 T479	M353-M459 HydrophobicContact CE-CE 4.18Å; Q394-M459 HydrophobicContact CB-CB 4.36Å; Q394-M459 WeakPolarHBondContact CB-O 3.32Å; Q394-M459 VanDerWaalsContact CD-O 3.3Å; A413-M459 HydrophobicContact CB-CB 4.41Å; A413-M459 VanDerWaalsContact O-CE 3.22Å; A413-M459 WeakPolarHBondContact O-CE 3.26Å; G414-M459 WeakPolarHBondContact O-CE 3.35Å; V456-M459 HydrophobicContact CB-CB 4.45Å; V456-M459 HydrophobicContact CB-CG 3.95Å; V456-M459 HydrophobicContact CB-SD 3.83Å; V456-M459 HydrophobicContact CG1-CG 3.75Å; V456-M459 HydrophobicContact CG1-SD 3.96Å; V456-M459 HydrophobicContact CG2-SD 4.14Å; V456-M459 PolarHBondContact O-N 3.05Å; M459-L478 HydrophobicContact CG-CB 4.01Å; M459-L478 HydrophobicContact CG-CD1 4Å; M459-T479 VanDerWaalsContact CA-OG1 3.28Å; M459-T479 WeakPolarHBondContact CA-OG1 3.33Å; M459-T479 HydrophobicContact CE-CG2 4.01Å; M459-T479 HydrophobicContact CG-CG2 4.23Å
460	H	97.1	Very high	94.3	Very high	13 Å²	13	25.1 Å²	25.1	6%	0.06	16%	0.155	C	C	.	.			trans	-135.7	126.7	-170.1	-55.1	91.4	0	0	0	113.3	A413 G458 A462 Y467 T479 F480 H481	A413-H460 WeakPolarHBondContact CA-O 3.5Å; G458-H460 VanDerWaalsContact C-CE1 3.49Å; G458-H460 PolarHBondContact O-CE1 2.87Å; G458-H460 PolarHBondContact O-ND1 2.96Å; H460-A462 VanDerWaalsContact C-N 3.28Å; H460-A462 PolarHBondContact O-N 2.79Å; H460-Y467 HydrophobicContact CB-CD2 4.48Å; H460-Y467 HydrophobicContact CB-CE2 3.59Å; H460-Y467 AromaticContact CD2-CD2 3.86Å; H460-Y467 AromaticContact CD2-CE1 3.79Å; H460-Y467 AromaticContact CD2-CE2 3.65Å; H460-Y467 AromaticContact CD2-CZ 3.61Å; H460-Y467 AromaticContact CG-CE2 3.9Å; H460-T479 WeakPolarHBondContact CB-O 3.32Å; H460-T479 PolarHBondContact N-O 3.48Å; H460-T479 PolarHBondContact N-OG1 3.31Å; H460-T479 VanDerWaalsContact N-OG1 3.1Å; H460-T479 PolarHBondContact ND1-O 2.88Å; H460-F480 HydrophobicContact CB-CD1 3.63Å; H460-F480 HydrophobicContact CB-CE1 3.9Å; H460-F480 AromaticContact CG-CD1 3.93Å; H460-F480 AromaticContact CG-CE1 3.66Å; H460-F480 AromaticContact ND1-CE1 3.6Å; H460-F480 CarbonylContact O-C 3.57Å; H460-H481 PolarHBondContact O-N 2.95Å
461	Q	96.8	Very high	94.2	Very high	40 Å²	40	24.5 Å²	24.5	19%	0.187	14%	0.137	C	C	.	.	S	Bend	trans	-78	-10.1	179.4	-177.7	57.4	19.9	0	0	113.2	Y396 T410 G412 A413 Y467 H481	Y396-Q461 HydrophobicContact CE2-CG 4.46Å; T410-Q461 VanDerWaalsContact CB-CD 3.47Å; T410-Q461 HydrophobicContact CG2-CB 4.4Å; T410-Q461 HydrophobicContact CG2-CG 4.16Å; T410-Q461 WeakPolarHBondContact OG1-CB 3.44Å; T410-Q461 PolarHBondContact OG1-OE1 3.1Å; G412-Q461 VanDerWaalsContact C-OE1 3.27Å; A413-Q461 HydrophobicContact CB-CB 4.33Å; Q461-Y467 PolarHBondContact N-OH 2.79Å; Q461-H481 WeakPolarHBondContact O-CB 3.34Å; Q461-H481 PolarHBondContact O-ND1 3.26Å
462	A	96.7	Very high	94	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.008	14%	0.137	C	C	.	.	S	Bend	trans	-131.1	-173.9	-178.1	0	0	0	0	0	111.5	I146 I147 H460 D466 Y467 F480 H481	I146-A462 HydrophobicContact CG2-CB 4.14Å; I147-A462 HydrophobicContact CG2-CB 3.92Å; H460-A462 VanDerWaalsContact C-N 3.28Å; H460-A462 PolarHBondContact O-N 2.79Å; A462-D466 HydrophobicContact CB-CB 3.62Å; A462-D466 WeakPolarHBondContact CB-OD2 3.46Å; A462-Y467 HydrophobicContact CB-CE2 3.91Å; A462-Y467 PolarHBondContact N-OH 3.09Å; A462-Y467 VanDerWaalsContact N-OH 3.14Å; A462-F480 WeakPolarHBondContact O-CD1 3.42Å; A462-H481 CarbonylContact C-O 3.54Å; A462-H481 VanDerWaalsContact C-O 3.27Å; A462-H481 PolarHBondContact O-N 2.87Å; A462-H481 VanDerWaalsContact O-N 3.16Å
463	R	96.1	Very high	93.7	Very high	21 Å²	21	27.8 Å²	27.8	8%	0.079	15%	0.148	C	C	.	.			trans	-79.5	161.8	-178.3	-51.2	163.8	-63.2	154.8	6.9	109.5	E143 Q465 D466 Y467 H481 K482 W484 N485 T486	E143-R463 IonicContact OE1-CZ 3.45Å; E143-R463 IonicContact OE1-NH1 3.53Å; E143-R463 PolarHBondContact OE1-NH1 3.49Å; E143-R463 IonicContact OE1-NH2 3.64Å; E143-R463 PolarHBondContact OE1-NH2 3.18Å; R463-Q465 VanDerWaalsContact C-N 3.28Å; R463-Q465 HydrophobicContact CB-CG 4.34Å; R463-Q465 VanDerWaalsContact CB-OE1 3.27Å; R463-Q465 PolarHBondContact O-N 3.28Å; R463-D466 VanDerWaalsContact CB-OD2 3.29Å; R463-D466 WeakPolarHBondContact CB-OD2 3.44Å; R463-D466 IonicContact CZ-OD1 2.91Å; R463-D466 IonicContact CZ-OD2 2.87Å; R463-D466 PolarHBondContact N-OD2 3.44Å; R463-D466 IonicContact NE-OD1 3.53Å; R463-D466 IonicContact NE-OD2 3.55Å; R463-D466 PolarHBondContact NE-OD2 3.26Å; R463-D466 IonicContact NH2-OD1 3.14Å; R463-D466 PolarHBondContact NH2-OD1 2.85Å; R463-D466 IonicContact NH2-OD2 3.97Å; R463-D466 PolarHBondContact NH2-OD2 3.34Å; R463-D466 VanDerWaalsContact O-CB 3.28Å; R463-D466 WeakPolarHBondContact O-CB 3.38Å; R463-D466 PolarHBondContact O-N 2.93Å; R463-Y467 WeakPolarHBondContact O-CD2 3.24Å; R463-Y467 WeakPolarHBondContact O-CE2 3.4Å; R463-H481 PolarHBondContact N-O 2.95Å; R463-K482 HydrophobicContact CG-CB 4.1Å; R463-W484 VanDerWaalsContact CD-O 3.31Å; R463-W484 WeakPolarHBondContact CD-O 3.09Å; R463-N485 PolarHBondContact NH1-O 2.94Å; R463-N485 VanDerWaalsContact NH1-O 3.08Å; R463-T486 HydrophobicContact CG-CG2 4.47Å
464	P	95.3	Very high	93.4	Very high	8 Å²	8	27.2 Å²	27.2	5%	0.052	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-54.9	-40.7	177.6	-22.7	29.6	0	0	0	114.1	D466 Y467 L472 F480 T491 W495	P464-D466 PolarHBondContact O-N 2.83Å; P464-Y467 PolarHBondContact O-N 2.81Å; P464-Y467 VanDerWaalsContact O-N 3.09Å; P464-L472 HydrophobicContact CB-CD1 4.1Å; P464-L472 WeakPolarHBondContact O-CD1 3.41Å; P464-F480 HydrophobicContact CB-CD1 4.38Å; P464-F480 HydrophobicContact CB-CE1 3.93Å; P464-F480 HydrophobicContact CB-CE2 4.37Å; P464-F480 HydrophobicContact CB-CZ 3.91Å; P464-F480 HydrophobicContact CG-CD1 3.85Å; P464-F480 HydrophobicContact CG-CD2 3.85Å; P464-F480 HydrophobicContact CG-CE1 3.83Å; P464-F480 HydrophobicContact CG-CE2 3.83Å; P464-F480 HydrophobicContact CG-CG 3.86Å; P464-F480 HydrophobicContact CG-CZ 3.81Å; P464-T491 HydrophobicContact CG-CG2 3.68Å; P464-W495 HydrophobicContact CB-CD2 4.45Å; P464-W495 HydrophobicContact CB-CZ2 4.04Å; P464-W495 HydrophobicContact CG-CG 4.31Å
465	Q	94	Very high	92.9	Very high	55 Å²	55	27.8 Å²	27.8	26%	0.257	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-69.1	-11.4	179.8	63.6	-91.4	38	0	0	114.3	E143 R463 Y467 N485	E143-Q465 VanDerWaalsContact OE1-CG 3.29Å; E143-Q465 WeakPolarHBondContact OE1-CG 3.28Å; R463-Q465 VanDerWaalsContact C-N 3.28Å; R463-Q465 HydrophobicContact CB-CG 4.34Å; R463-Q465 VanDerWaalsContact CB-OE1 3.27Å; R463-Q465 PolarHBondContact O-N 3.28Å; Q465-Y467 PolarHBondContact O-N 3.29Å; Q465-N485 PolarHBondContact NE2-O 3.43Å
466	D	95.6	Very high	92.4	Very high	3 Å²	3	27 Å²	27	2%	0.016	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-78.5	-4.8	172.8	-66.6	-54.7	0	0	0	112	T145 I147 A462 R463 P464	T145-D466 VanDerWaalsContact OG1-CA 3.3Å; T145-D466 WeakPolarHBondContact OG1-CA 3.47Å; T145-D466 WeakPolarHBondContact OG1-CB 3.32Å; T145-D466 VanDerWaalsContact OG1-CG 3.29Å; T145-D466 PolarHBondContact OG1-O 2.76Å; T145-D466 PolarHBondContact OG1-OD1 3.4Å; I147-D466 WeakPolarHBondContact CD1-O 3.48Å; I147-D466 WeakPolarHBondContact CG1-O 3.38Å; A462-D466 HydrophobicContact CB-CB 3.62Å; A462-D466 WeakPolarHBondContact CB-OD2 3.46Å; R463-D466 VanDerWaalsContact CB-OD2 3.29Å; R463-D466 WeakPolarHBondContact CB-OD2 3.44Å; R463-D466 IonicContact CZ-OD1 2.91Å; R463-D466 IonicContact CZ-OD2 2.87Å; R463-D466 PolarHBondContact N-OD2 3.44Å; R463-D466 IonicContact NE-OD1 3.53Å; R463-D466 IonicContact NE-OD2 3.55Å; R463-D466 PolarHBondContact NE-OD2 3.26Å; R463-D466 IonicContact NH2-OD1 3.14Å; R463-D466 PolarHBondContact NH2-OD1 2.85Å; R463-D466 IonicContact NH2-OD2 3.97Å; R463-D466 PolarHBondContact NH2-OD2 3.34Å; R463-D466 VanDerWaalsContact O-CB 3.28Å; R463-D466 WeakPolarHBondContact O-CB 3.38Å; R463-D466 PolarHBondContact O-N 2.93Å; P464-D466 PolarHBondContact O-N 2.83Å
467	Y	95.4	Very high	92.3	Very high	27 Å²	27	26.8 Å²	26.8	11%	0.106	15%	0.15	C	C	.	.	S	Bend	trans	-121.9	148.2	179.6	-56.6	-84.4	0	0	0	111.5	I147 H460 Q461 A462 R463 P464 Q465 G469 L472 F480	I147-Y467 HydrophobicContact CD1-CD1 3.83Å; I147-Y467 HydrophobicContact CD1-CE1 3.91Å; I147-Y467 HydrophobicContact CG2-CE1 4.37Å; H460-Y467 HydrophobicContact CB-CD2 4.48Å; H460-Y467 HydrophobicContact CB-CE2 3.59Å; H460-Y467 AromaticContact CD2-CD2 3.86Å; H460-Y467 AromaticContact CD2-CE1 3.79Å; H460-Y467 AromaticContact CD2-CE2 3.65Å; H460-Y467 AromaticContact CD2-CZ 3.61Å; H460-Y467 AromaticContact CG-CE2 3.9Å; Q461-Y467 PolarHBondContact N-OH 2.79Å; A462-Y467 HydrophobicContact CB-CE2 3.91Å; A462-Y467 PolarHBondContact N-OH 3.09Å; A462-Y467 VanDerWaalsContact N-OH 3.14Å; R463-Y467 WeakPolarHBondContact O-CD2 3.24Å; R463-Y467 WeakPolarHBondContact O-CE2 3.4Å; P464-Y467 PolarHBondContact O-N 2.81Å; P464-Y467 VanDerWaalsContact O-N 3.09Å; Q465-Y467 PolarHBondContact O-N 3.29Å; Y467-G469 PolarHBondContact O-N 3.06Å; Y467-L472 HydrophobicContact CD2-CD2 4.42Å; Y467-L472 HydrophobicContact CG-CD2 4.31Å; Y467-F480 HydrophobicContact CD2-CE1 4.31Å; Y467-F480 HydrophobicContact CE2-CE1 4.45Å
468	A	94.1	Very high	92.4	Very high	5 Å²	5	25.8 Å²	25.8	4%	0.041	14%	0.14	C	C	.	.			trans	-59.5	134.3	172.7	0	0	0	0	0	111.3	L139 E470 L471 L472	L139-A468 HydrophobicContact CB-CB 4.18Å; L139-A468 HydrophobicContact CD1-CB 4.04Å; L139-A468 HydrophobicContact CD2-CB 4.11Å; L139-A468 HydrophobicContact CG-CB 4.34Å; A468-E470 PolarHBondContact O-N 3.47Å; A468-L471 HydrophobicContact CB-CD1 4.14Å; A468-L471 HydrophobicContact CB-CG 4.21Å; A468-L471 WeakPolarHBondContact O-CB 3.47Å; A468-L471 PolarHBondContact O-N 3.15Å; A468-L472 PolarHBondContact O-N 3.05Å
469	G	91.9	Very high	92.6	Very high	23 Å²	23	25.6 Å²	25.6	24%	0.237	14%	0.138	C	C	.	.	H	α-helix	trans	-61.2	-30.3	-174.8	0	0	0	0	0	113.4	Y467 L472 Q473	Y467-G469 PolarHBondContact O-N 3.06Å; G469-L472 PolarHBondContact O-N 3.31Å; G469-Q473 VanDerWaalsContact O-CG 3.32Å; G469-Q473 WeakPolarHBondContact O-CG 3.42Å; G469-Q473 PolarHBondContact O-N 3.42Å; G469-Q473 PolarHBondContact O-NE2 3.47Å
470	E	92	Very high	92.6	Very high	58 Å²	58	25.5 Å²	25.5	27%	0.271	14%	0.138	S	C	.	.	H	α-helix	trans	-66.2	-37	175.5	-63	88	161	0	0	112.2	L139 M163 A468 Q473 L474	L139-E470 HydrophobicContact CD2-CB 3.99Å; L139-E470 HydrophobicContact CD2-CG 4.22Å; M163-E470 HydrophobicContact SD-CB 4.31Å; A468-E470 PolarHBondContact O-N 3.47Å; E470-Q473 PolarHBondContact O-N 2.85Å; E470-L474 PolarHBondContact O-N 3.06Å
471	L	91.7	Very high	92.6	Very high	44 Å²	44	25.7 Å²	25.7	23%	0.23	14%	0.138	C	C	.	.	H	α-helix	trans	-69.8	-40.5	177.4	-66	176.1	0	0	0	111	L139 M163 A468 Q473 L474	L139-L471 HydrophobicContact CD1-CD1 3.86Å; L139-L471 HydrophobicContact CD1-CD2 4.15Å; L139-L471 HydrophobicContact CD1-CG 3.89Å; M163-L471 HydrophobicContact CE-CD2 4.19Å; M163-L471 HydrophobicContact CG-CD2 3.99Å; A468-L471 HydrophobicContact CB-CD1 4.14Å; A468-L471 HydrophobicContact CB-CG 4.21Å; A468-L471 WeakPolarHBondContact O-CB 3.47Å; A468-L471 PolarHBondContact O-N 3.15Å; L471-Q473 PolarHBondContact O-N 3.28Å; L471-L474 WeakPolarHBondContact O-CB 3.15Å; L471-L474 PolarHBondContact O-N 3.42Å
472	L	91.4	Very high	92.4	Very high	9 Å²	9	26.4 Å²	26.4	5%	0.047	14%	0.141	C	C	.	.	H	α-helix	trans	-66.4	-19.5	176.1	-62.5	-175.8	0	0	0	113.6	P464 Y467 A468 G469 P477 F480 W495	P464-L472 HydrophobicContact CB-CD1 4.1Å; P464-L472 WeakPolarHBondContact O-CD1 3.41Å; Y467-L472 HydrophobicContact CD2-CD2 4.42Å; Y467-L472 HydrophobicContact CG-CD2 4.31Å; A468-L472 PolarHBondContact O-N 3.05Å; G469-L472 PolarHBondContact O-N 3.31Å; L472-P477 HydrophobicContact CD2-CG 4.49Å; L472-F480 HydrophobicContact CD1-CZ 4.36Å; L472-F480 HydrophobicContact CD2-CE1 4.05Å; L472-F480 HydrophobicContact CD2-CZ 3.95Å; L472-W495 HydrophobicContact CB-CH2 4.12Å; L472-W495 HydrophobicContact CB-CZ3 3.9Å; L472-W495 HydrophobicContact CD1-CH2 3.64Å; L472-W495 HydrophobicContact CD1-CZ2 4.06Å; L472-W495 HydrophobicContact CD1-CZ3 4Å
473	Q	86.7	Confident	92.2	Very high	120 Å²	120	27.5 Å²	27.5	56%	0.561	15%	0.145	S	C	*	.	H	α-helix	trans	-84.8	-21.6	173.8	-71.4	169.1	39.4	0	0	112.7	G469 E470 L471	G469-Q473 VanDerWaalsContact O-CG 3.32Å; G469-Q473 WeakPolarHBondContact O-CG 3.42Å; G469-Q473 PolarHBondContact O-N 3.42Å; G469-Q473 PolarHBondContact O-NE2 3.47Å; E470-Q473 PolarHBondContact O-N 2.85Å; L471-Q473 PolarHBondContact O-N 3.28Å
474	L	87.1	Confident	91.9	Very high	5 Å²	5	35.6 Å²	35.6	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-75.9	-37.7	-176.4	-168.6	69.8	0	0	0	112.3	M163 S165 A251 P253 E254 E470 L471	M163-L474 HydrophobicContact CE-CB 4.49Å; M163-L474 HydrophobicContact CE-CD1 4.37Å; M163-L474 HydrophobicContact CE-CD2 3.98Å; S165-L474 VanDerWaalsContact OG-CD2 3.27Å; S165-L474 WeakPolarHBondContact OG-CD2 3.31Å; A251-L474 HydrophobicContact CB-CD1 3.51Å; A251-L474 HydrophobicContact CB-CD2 4.04Å; A251-L474 HydrophobicContact CB-CG 4.46Å; P253-L474 WeakPolarHBondContact CA-O 3.49Å; P253-L474 HydrophobicContact CB-CD1 4.3Å; P253-L474 HydrophobicContact CG-CD1 4.16Å; E254-L474 PolarHBondContact N-O 2.85Å; E470-L474 PolarHBondContact O-N 3.06Å; L471-L474 WeakPolarHBondContact O-CB 3.15Å; L471-L474 PolarHBondContact O-N 3.42Å
475	H	82.9	Confident	91.6	Very high	26 Å²	26	40.3 Å²	40.3	12%	0.12	20%	0.201	C	C	.	.	S	Bend	trans	-128.5	128.4	177	-57.3	-90.5	0	0	0	109.2	E254 A457 P477	E254-H475 VanDerWaalsContact CD-ND1 3.31Å; E254-H475 IonicContact OE1-CE1 2.72Å; E254-H475 IonicContact OE1-ND1 3.73Å; E254-H475 IonicContact OE2-CE1 3.58Å; E254-H475 IonicContact OE2-ND1 3.61Å; E254-H475 PolarHBondContact OE2-ND1 2.04Å; E254-H475 VanDerWaalsContact OE2-ND1 3.11Å; A457-H475 HydrophobicContact CB-CB 4.17Å; H475-P477 VanDerWaalsContact O-CD 3.29Å; H475-P477 WeakPolarHBondContact O-CD 3.39Å
476	A	84.5	Confident	91.5	Very high	58 Å²	58	39.6 Å²	39.6	48%	0.479	20%	0.201	S	C	.	.			trans	-63.7	122.3	179.1	0	0	0	0	0	110	L478	A476-L478 PolarHBondContact O-N 2.99Å
477	P	90.9	Very high	91.4	Very high	6 Å²	6	43.4 Å²	43.4	4%	0.039	22%	0.221	C	C	.	.			trans	-60.9	137.1	-174.7	-27.3	36.2	0	0	0	113.1	R376 L472 H475 F480 W495 L496	R376-P477 VanDerWaalsContact CD-O 3.25Å; R376-P477 WeakPolarHBondContact CD-O 3.27Å; R376-P477 PolarHBondContact NH1-O 3.4Å; L472-P477 HydrophobicContact CD2-CG 4.49Å; H475-P477 VanDerWaalsContact O-CD 3.29Å; H475-P477 WeakPolarHBondContact O-CD 3.39Å; P477-F480 HydrophobicContact CB-CD2 4.4Å; P477-F480 HydrophobicContact CB-CE2 3.44Å; P477-F480 VanDerWaalsContact CB-CE2 3.44Å; P477-F480 HydrophobicContact CB-CZ 3.63Å; P477-F480 HydrophobicContact CG-CE2 3.94Å; P477-F480 HydrophobicContact CG-CZ 3.8Å; P477-W495 HydrophobicContact CG-CE3 4.04Å; P477-L496 HydrophobicContact CB-CD2 4Å; P477-L496 WeakPolarHBondContact O-CD2 3.48Å
478	L	92.2	Very high	91.4	Very high	12 Å²	12	42.7 Å²	42.7	6%	0.063	22%	0.22	C	C	.	.			trans	-99.8	-42.9	175.1	-73.2	165.4	0	0	0	111.3	L361 S362 R376 V377 L380 V456 G458 M459 A476	L361-L478 CarbonylContact C-O 3.54Å; S362-L478 PolarHBondContact N-O 3.01Å; R376-L478 HydrophobicContact CB-CD2 3.3Å; R376-L478 HydrophobicContact CB-CG 4.47Å; V377-L478 HydrophobicContact CG2-CD2 3.97Å; L380-L478 HydrophobicContact CD2-CD1 3.96Å; V456-L478 HydrophobicContact CG1-CD1 3.37Å; G458-L478 WeakPolarHBondContact O-CA 3.31Å; G458-L478 WeakPolarHBondContact O-CB 3.31Å; G458-L478 PolarHBondContact O-N 2.85Å; M459-L478 HydrophobicContact CG-CB 4.01Å; M459-L478 HydrophobicContact CG-CD1 4Å; A476-L478 PolarHBondContact O-N 2.99Å
479	T	95.7	Very high	91.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	155.4	-178.2	69.7	0	0	0	0	111.5	M353 L360 L361 A413 G458 M459 H460	M353-T479 HydrophobicContact CE-CG2 4.05Å; L360-T479 WeakPolarHBondContact O-CA 3.26Å; L360-T479 WeakPolarHBondContact O-CB 3.31Å; L361-T479 HydrophobicContact CD2-CG2 3.36Å; A413-T479 VanDerWaalsContact O-CB 3.27Å; A413-T479 WeakPolarHBondContact O-CB 3.35Å; A413-T479 WeakPolarHBondContact O-CG2 3.25Å; A413-T479 PolarHBondContact O-OG1 2.97Å; G458-T479 PolarHBondContact O-N 2.66Å; M459-T479 VanDerWaalsContact CA-OG1 3.28Å; M459-T479 WeakPolarHBondContact CA-OG1 3.33Å; M459-T479 HydrophobicContact CE-CG2 4.01Å; M459-T479 HydrophobicContact CG-CG2 4.23Å; H460-T479 WeakPolarHBondContact CB-O 3.32Å; H460-T479 PolarHBondContact N-O 3.48Å; H460-T479 PolarHBondContact N-OG1 3.31Å; H460-T479 VanDerWaalsContact N-OG1 3.1Å; H460-T479 PolarHBondContact ND1-O 2.88Å
480	F	96.9	Very high	91.5	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.009	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	158.3	163.8	-73.4	-68	0	0	0	108.7	L360 H460 A462 P464 Y467 L472 P477 T491 W495 L496	L360-F480 PolarHBondContact N-O 3.23Å; L360-F480 PolarHBondContact O-N 3.18Å; L360-F480 VanDerWaalsContact O-N 3.14Å; H460-F480 HydrophobicContact CB-CD1 3.63Å; H460-F480 HydrophobicContact CB-CE1 3.9Å; H460-F480 AromaticContact CG-CD1 3.93Å; H460-F480 AromaticContact CG-CE1 3.66Å; H460-F480 AromaticContact ND1-CE1 3.6Å; H460-F480 CarbonylContact O-C 3.57Å; A462-F480 WeakPolarHBondContact O-CD1 3.42Å; P464-F480 HydrophobicContact CB-CD1 4.38Å; P464-F480 HydrophobicContact CB-CE1 3.93Å; P464-F480 HydrophobicContact CB-CE2 4.37Å; P464-F480 HydrophobicContact CB-CZ 3.91Å; P464-F480 HydrophobicContact CG-CD1 3.85Å; P464-F480 HydrophobicContact CG-CD2 3.85Å; P464-F480 HydrophobicContact CG-CE1 3.83Å; P464-F480 HydrophobicContact CG-CE2 3.83Å; P464-F480 HydrophobicContact CG-CG 3.86Å; P464-F480 HydrophobicContact CG-CZ 3.81Å; Y467-F480 HydrophobicContact CD2-CE1 4.31Å; Y467-F480 HydrophobicContact CE2-CE1 4.45Å; L472-F480 HydrophobicContact CD1-CZ 4.36Å; L472-F480 HydrophobicContact CD2-CE1 4.05Å; L472-F480 HydrophobicContact CD2-CZ 3.95Å; P477-F480 HydrophobicContact CB-CD2 4.4Å; P477-F480 HydrophobicContact CB-CE2 3.44Å; P477-F480 VanDerWaalsContact CB-CE2 3.44Å; P477-F480 HydrophobicContact CB-CZ 3.63Å; P477-F480 HydrophobicContact CG-CE2 3.94Å; P477-F480 HydrophobicContact CG-CZ 3.8Å; F480-T491 HydrophobicContact CD2-CG2 4.42Å; F480-W495 HydrophobicContact CD2-CB 4.23Å; F480-W495 HydrophobicContact CE2-CB 3.66Å; F480-W495 HydrophobicContact CE2-CD2 4.26Å; F480-W495 AromaticContact CE2-CG 3.86Å; F480-W495 HydrophobicContact CE2-CG 3.86Å; F480-L496 HydrophobicContact CD2-CD1 4.08Å; F480-L496 HydrophobicContact CD2-CD2 4.14Å; F480-L496 HydrophobicContact CD2-CG 4.2Å; F480-L496 HydrophobicContact CE2-CD2 4.3Å
481	H	97.2	Very high	91.6	Very high	16 Å²	16	46.1 Å²	46.1	7%	0.074	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	160.7	-176.5	176.9	-114.8	0	0	0	111.3	D356 D358 G412 H460 Q461 A462 R463	D356-H481 IonicContact OD2-NE2 3.67Å; D358-H481 WeakPolarHBondContact O-CA 3.03Å; D358-H481 IonicContact OD1-CD2 2.63Å; D358-H481 PolarHBondContact OD1-CD2 3.45Å; D358-H481 IonicContact OD1-NE2 3.79Å; D358-H481 PolarHBondContact OD1-NE2 2.87Å; D358-H481 IonicContact OD2-NE2 2.76Å; G412-H481 WeakPolarHBondContact CA-CD2 3.38Å; G412-H481 VanDerWaalsContact O-CB 3.31Å; G412-H481 WeakPolarHBondContact O-CB 3.35Å; G412-H481 PolarHBondContact O-CD2 3.21Å; G412-H481 VanDerWaalsContact O-CD2 3.27Å; H460-H481 PolarHBondContact O-N 2.95Å; Q461-H481 WeakPolarHBondContact O-CB 3.34Å; Q461-H481 PolarHBondContact O-ND1 3.26Å; A462-H481 CarbonylContact C-O 3.54Å; A462-H481 VanDerWaalsContact C-O 3.27Å; A462-H481 PolarHBondContact O-N 2.87Å; A462-H481 VanDerWaalsContact O-N 3.16Å; R463-H481 PolarHBondContact N-O 2.95Å
482	K	92.4	Very high	91.6	Very high	56 Å²	56	45 Å²	45	24%	0.243	22%	0.222	C	C	.	.			trans	75.1	122.7	-175.7	-48.7	-177.2	176.3	-167.8	0	113.6	D358 R463 T486	D358-K482 PolarHBondContact O-N 3.02Å; R463-K482 HydrophobicContact CG-CB 4.1Å; K482-T486 WeakPolarHBondContact O-CG2 3.4Å
483	F	92.9	Very high	91.6	Very high	23 Å²	23	51.1 Å²	51.1	10%	0.101	24%	0.244	C	C	.	.			trans	-88.7	-7.2	168.6	-66.3	-3.3	0	0	0	112.8	R288 I291 I292 D357 D358 L360 P488	R288-F483 HydrophobicContact CB-CD2 4.24Å; R288-F483 HydrophobicContact CB-CE2 4.1Å; R288-F483 HydrophobicContact CG-CD2 4.12Å; R288-F483 HydrophobicContact CG-CE2 4.47Å; I291-F483 HydrophobicContact CB-CD2 4.44Å; I291-F483 HydrophobicContact CB-CE2 3.83Å; I291-F483 HydrophobicContact CB-CZ 4.41Å; I291-F483 HydrophobicContact CD1-CD2 3.86Å; I291-F483 HydrophobicContact CD1-CE2 4.12Å; I291-F483 HydrophobicContact CG2-CD2 4.3Å; I291-F483 HydrophobicContact CG2-CE2 3.72Å; I291-F483 HydrophobicContact CG2-CZ 3.9Å; I292-F483 HydrophobicContact CG1-CZ 4.19Å; D357-F483 WeakPolarHBondContact O-CE2 3.48Å; D358-F483 HydrophobicContact CB-CB 4.29Å; D358-F483 HydrophobicContact CB-CD1 3.79Å; D358-F483 HydrophobicContact CB-CD2 4.04Å; D358-F483 HydrophobicContact CB-CE1 4.08Å; D358-F483 HydrophobicContact CB-CE2 4.33Å; D358-F483 HydrophobicContact CB-CG 3.77Å; D358-F483 HydrophobicContact CB-CZ 4.35Å; D358-F483 WeakPolarHBondContact O-CE1 3.22Å; L360-F483 HydrophobicContact CD2-CE1 3.69Å; L360-F483 HydrophobicContact CD2-CZ 4.05Å; L360-F483 HydrophobicContact CG-CE1 3.83Å; F483-P488 HydrophobicContact CB-CB 4.43Å; F483-P488 HydrophobicContact CB-CG 4.28Å; F483-P488 HydrophobicContact CD1-CB 3.57Å; F483-P488 HydrophobicContact CD1-CG 4.23Å; F483-P488 HydrophobicContact CD2-CB 4.48Å; F483-P488 HydrophobicContact CD2-CG 4.39Å; F483-P488 HydrophobicContact CE1-CB 3.88Å; F483-P488 HydrophobicContact CG-CB 3.91Å; F483-P488 HydrophobicContact CG-CG 4.05Å; F483-P488 HydrophobicContact CZ-CB 4.45Å
484	W	89	Confident	91.7	Very high	191 Å²	191	50.9 Å²	50.9	72%	0.723	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	142.3	180	179.5	-96.8	0	0	0	112	R463 T486	R463-W484 VanDerWaalsContact CD-O 3.31Å; R463-W484 WeakPolarHBondContact CD-O 3.09Å; W484-T486 PolarHBondContact O-N 3.05Å
485	N	89.1	Confident	91.7	Very high	108 Å²	108	53.7 Å²	53.7	58%	0.578	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	38.4	-179.6	-72	-7.3	0	0	0	113.4	R463 Q465	R463-N485 PolarHBondContact NH1-O 2.94Å; R463-N485 VanDerWaalsContact NH1-O 3.08Å; Q465-N485 PolarHBondContact NE2-O 3.43Å
486	T	91	Very high	92	Very high	40 Å²	40	52.5 Å²	52.5	25%	0.245	24%	0.243	C	C	.	.	S	Bend	trans	-157	160.7	172.3	-169.4	0	0	0	0	109.8	R463 K482 W484 P488 T491	R463-T486 HydrophobicContact CG-CG2 4.47Å; K482-T486 WeakPolarHBondContact O-CG2 3.4Å; W484-T486 PolarHBondContact O-N 3.05Å; T486-P488 WeakPolarHBondContact O-CD 3.33Å; T486-T491 PolarHBondContact OG1-OG1 3.15Å
487	D	95.2	Very high	91.5	Very high	82 Å²	82	50.3 Å²	50.3	44%	0.439	23%	0.226	S	C	.	.			trans	-90.6	107.6	161.6	174	-11.7	0	0	0	107.6	E489 H490 T491	D487-E489 VanDerWaalsContact C-N 3.33Å; D487-E489 PolarHBondContact O-N 3.18Å; D487-E489 PolarHBondContact OD1-N 2.76Å; D487-H490 HydrophobicContact CB-CB 3.79Å; D487-H490 VanDerWaalsContact CG-CB 3.41Å; D487-H490 PolarHBondContact O-N 3.09Å; D487-H490 PolarHBondContact OD1-N 3.02Å; D487-H490 WeakPolarHBondContact OD2-CB 3.25Å; D487-T491 WeakPolarHBondContact O-CB 3.35Å; D487-T491 PolarHBondContact O-N 2.76Å; D487-T491 PolarHBondContact O-OG1 2.78Å
488	P	95	Very high	90.1	Very high	13 Å²	13	51.1 Å²	51.1	8%	0.084	24%	0.235	C	C	.	.	H	α-helix	trans	-67.5	-31.2	-176.8	25.7	-33.2	0	0	0	112.9	I291 L360 F483 T486 T491 Y492	I291-P488 HydrophobicContact CD1-CG 3.95Å; I291-P488 HydrophobicContact CG2-CB 3.91Å; I291-P488 HydrophobicContact CG2-CG 3.7Å; L360-P488 HydrophobicContact CD1-CB 4.24Å; L360-P488 VanDerWaalsContact CD1-O 3.31Å; L360-P488 WeakPolarHBondContact CD1-O 3.4Å; L360-P488 HydrophobicContact CD2-CB 4.47Å; F483-P488 HydrophobicContact CB-CB 4.43Å; F483-P488 HydrophobicContact CB-CG 4.28Å; F483-P488 HydrophobicContact CD1-CB 3.57Å; F483-P488 HydrophobicContact CD1-CG 4.23Å; F483-P488 HydrophobicContact CD2-CB 4.48Å; F483-P488 HydrophobicContact CD2-CG 4.39Å; F483-P488 HydrophobicContact CE1-CB 3.88Å; F483-P488 HydrophobicContact CG-CB 3.91Å; F483-P488 HydrophobicContact CG-CG 4.05Å; F483-P488 HydrophobicContact CZ-CB 4.45Å; T486-P488 WeakPolarHBondContact O-CD 3.33Å; P488-T491 PolarHBondContact O-N 2.95Å; P488-Y492 VanDerWaalsContact O-CB 3.31Å; P488-Y492 WeakPolarHBondContact O-CB 3.44Å; P488-Y492 PolarHBondContact O-N 3.09Å
489	E	93.8	Very high	87.9	Confident	63 Å²	63	55.3 Å²	55.3	29%	0.294	27%	0.266	S	S	.	.	H	α-helix	trans	-75.4	-36.9	178.3	-65.6	-175	-148.8	0	0	111.3	I291 R294 T295 D487 R493	I291-E489 HydrophobicContact CG2-CG 4.25Å; R294-E489 IonicContact CZ-OE1 3.2Å; R294-E489 IonicContact NE-OE1 2.78Å; R294-E489 PolarHBondContact NE-OE1 3.48Å; R294-E489 IonicContact NE-OE2 3.84Å; R294-E489 IonicContact NH2-OE1 3.61Å; R294-E489 PolarHBondContact NH2-OE1 3.07Å; T295-E489 HydrophobicContact CG2-CG 4.19Å; D487-E489 VanDerWaalsContact C-N 3.33Å; D487-E489 PolarHBondContact O-N 3.18Å; D487-E489 PolarHBondContact OD1-N 2.76Å; E489-R493 WeakPolarHBondContact O-CB 3.39Å; E489-R493 WeakPolarHBondContact O-CG 3.34Å; E489-R493 PolarHBondContact O-N 3.1Å; E489-R493 PolarHBondContact O-NE 3.22Å
490	H	93.8	Very high	85.4	Confident	87 Å²	87	60.7 Å²	60.7	40%	0.403	29%	0.292	S	S	.	.	H	α-helix	trans	-63.7	-46.7	168.8	-178.5	80.3	0	0	0	111.3	D487 Y492 R493 R494	D487-H490 HydrophobicContact CB-CB 3.79Å; D487-H490 VanDerWaalsContact CG-CB 3.41Å; D487-H490 PolarHBondContact O-N 3.09Å; D487-H490 PolarHBondContact OD1-N 3.02Å; D487-H490 WeakPolarHBondContact OD2-CB 3.25Å; H490-Y492 VanDerWaalsContact C-N 3.33Å; H490-Y492 PolarHBondContact O-N 3.03Å; H490-R493 PolarHBondContact O-N 3.46Å; H490-R494 VanDerWaalsContact O-CB 3.26Å; H490-R494 WeakPolarHBondContact O-CB 3.49Å; H490-R494 PolarHBondContact O-N 3.32Å
491	T	93.6	Very high	82.5	Confident	8 Å²	8	63.8 Å²	63.8	5%	0.049	31%	0.311	C	S	.	.	H	α-helix	trans	-56.3	-48.5	177.6	-64.6	0	0	0	0	110.9	L360 P464 F480 T486 D487 P488 R494 W495	L360-T491 HydrophobicContact CD1-CG2 3.75Å; P464-T491 HydrophobicContact CG-CG2 3.68Å; F480-T491 HydrophobicContact CD2-CG2 4.42Å; T486-T491 PolarHBondContact OG1-OG1 3.15Å; D487-T491 WeakPolarHBondContact O-CB 3.35Å; D487-T491 PolarHBondContact O-N 2.76Å; D487-T491 PolarHBondContact O-OG1 2.78Å; P488-T491 PolarHBondContact O-N 2.95Å; T491-R494 PolarHBondContact O-N 2.98Å; T491-W495 PolarHBondContact O-N 3.21Å
492	Y	92.6	Very high	79.3	Confident	20 Å²	20	70.3 Å²	70.3	8%	0.078	35%	0.347	C	S	.	.	I	π-helix	trans	-57.1	-54.9	176.2	177	-108.4	0	0	0	111.4	T295 W296 L361 P488 H490 R494 W495 L496 G497	T295-Y492 HydrophobicContact CG2-CD1 3.74Å; T295-Y492 HydrophobicContact CG2-CD2 4.48Å; T295-Y492 HydrophobicContact CG2-CE1 4.45Å; T295-Y492 HydrophobicContact CG2-CG 3.76Å; T295-Y492 PolarHBondContact O-OH 2.96Å; W296-Y492 HydrophobicContact CB-CE2 3.89Å; L361-Y492 WeakPolarHBondContact O-CE2 3.35Å; P488-Y492 VanDerWaalsContact O-CB 3.31Å; P488-Y492 WeakPolarHBondContact O-CB 3.44Å; P488-Y492 PolarHBondContact O-N 3.09Å; H490-Y492 VanDerWaalsContact C-N 3.33Å; H490-Y492 PolarHBondContact O-N 3.03Å; Y492-R494 PolarHBondContact O-N 2.89Å; Y492-R494 VanDerWaalsContact C-N 3.3Å; Y492-W495 PolarHBondContact O-N 3.17Å; Y492-L496 HydrophobicContact CD2-CB 3.78Å; Y492-L496 HydrophobicContact CD2-CD1 4.38Å; Y492-L496 HydrophobicContact CE2-CB 4.09Å; Y492-L496 CarbonylContact O-C 3.37Å; Y492-L496 WeakPolarHBondContact O-CA 3.46Å; Y492-L496 PolarHBondContact O-N 3.21Å; Y492-G497 PolarHBondContact O-N 3.34Å
493	R	90.4	Very high	76.3	Confident	137 Å²	137	78.2 Å²	78.2	52%	0.517	38%	0.375	S	S	.	.	I	π-helix	trans	-59.7	-39.4	-178.8	-74.5	180	-69.2	156	-5.5	112.9	E489 H490	E489-R493 WeakPolarHBondContact O-CB 3.39Å; E489-R493 WeakPolarHBondContact O-CG 3.34Å; E489-R493 PolarHBondContact O-N 3.1Å; E489-R493 PolarHBondContact O-NE 3.22Å; H490-R493 PolarHBondContact O-N 3.46Å
494	R	89.2	Confident	73.3	Confident	115 Å²	115	83.1 Å²	83.1	43%	0.434	41%	0.412	S	S	.	.	I	π-helix	trans	-69.4	-47	-178.3	171.9	164.2	-172	129.8	1.5	112.4	H490 T491 Y492 M500	H490-R494 VanDerWaalsContact O-CB 3.26Å; H490-R494 WeakPolarHBondContact O-CB 3.49Å; H490-R494 PolarHBondContact O-N 3.32Å; T491-R494 PolarHBondContact O-N 2.98Å; Y492-R494 PolarHBondContact O-N 2.89Å; Y492-R494 VanDerWaalsContact C-N 3.3Å; R494-M500 HydrophobicContact CB-CE 3.93Å; R494-M500 HydrophobicContact CG-CE 3.49Å; R494-M500 VanDerWaalsContact CG-CE 3.49Å
495	W	87.9	Confident	70.3	Confident	65 Å²	65	76.9 Å²	76.9	25%	0.246	40%	0.401	C	S	.	.	I	π-helix	trans	-107.8	-31.3	-166.4	-65.1	102.9	0	0	0	114.4	R376 P464 L472 P477 F480 T491 Y492	R376-W495 PolarHBondContact NH1-O 3.06Å; P464-W495 HydrophobicContact CB-CD2 4.45Å; P464-W495 HydrophobicContact CB-CZ2 4.04Å; P464-W495 HydrophobicContact CG-CG 4.31Å; L472-W495 HydrophobicContact CB-CH2 4.12Å; L472-W495 HydrophobicContact CB-CZ3 3.9Å; L472-W495 HydrophobicContact CD1-CH2 3.64Å; L472-W495 HydrophobicContact CD1-CZ2 4.06Å; L472-W495 HydrophobicContact CD1-CZ3 4Å; P477-W495 HydrophobicContact CG-CE3 4.04Å; F480-W495 HydrophobicContact CD2-CB 4.23Å; F480-W495 HydrophobicContact CE2-CB 3.66Å; F480-W495 HydrophobicContact CE2-CD2 4.26Å; F480-W495 AromaticContact CE2-CG 3.86Å; F480-W495 HydrophobicContact CE2-CG 3.86Å; T491-W495 PolarHBondContact O-N 3.21Å; Y492-W495 PolarHBondContact O-N 3.17Å
496	L	89.1	Confident	67.4	Low	0 Å²	0	77 Å²	77	0%	0	41%	0.408	C	S	.	.	I	π-helix	trans	-121.9	-30.3	-163.6	-57.7	176.4	0	0	0	113.9	L360 S362 P477 F480 Y492 G498	L360-L496 HydrophobicContact CB-CD1 3.46Å; L360-L496 VanDerWaalsContact CB-CD1 3.46Å; S362-L496 PolarHBondContact OG-O 2.85Å; P477-L496 HydrophobicContact CB-CD2 4Å; P477-L496 WeakPolarHBondContact O-CD2 3.48Å; F480-L496 HydrophobicContact CD2-CD1 4.08Å; F480-L496 HydrophobicContact CD2-CD2 4.14Å; F480-L496 HydrophobicContact CD2-CG 4.2Å; F480-L496 HydrophobicContact CE2-CD2 4.3Å; Y492-L496 HydrophobicContact CD2-CB 3.78Å; Y492-L496 HydrophobicContact CD2-CD1 4.38Å; Y492-L496 HydrophobicContact CE2-CB 4.09Å; Y492-L496 CarbonylContact O-C 3.37Å; Y492-L496 WeakPolarHBondContact O-CA 3.46Å; Y492-L496 PolarHBondContact O-N 3.21Å; L496-G498 VanDerWaalsContact C-N 3.35Å; L496-G498 PolarHBondContact O-N 3.35Å
497	G	73.4	Confident	64.6	Low	12 Å²	12	81.4 Å²	81.4	12%	0.124	43%	0.429	C	S	.	.	S	Bend	trans	-86.9	13.1	-172.3	0	0	0	0	0	115.7	H364 Y492 S499	H364-G497 PolarHBondContact CD2-O 3.33Å; Y492-G497 PolarHBondContact O-N 3.34Å; G497-S499 VanDerWaalsContact C-N 3.27Å; G497-S499 PolarHBondContact O-N 3.1Å; G497-S499 VanDerWaalsContact O-N 3.15Å
498	G	60.8	Low	61.2	Low	23 Å²	23	80.8 Å²	80.8	24%	0.237	44%	0.436	C	S	.	.	S	Bend	trans	75.2	-3.6	171.5	0	0	0	0	0	117	L496 M500	L496-G498 VanDerWaalsContact C-N 3.35Å; L496-G498 PolarHBondContact O-N 3.35Å; G498-M500 VanDerWaalsContact C-N 3.33Å; G498-M500 PolarHBondContact O-N 2.57Å
499	S	47.7	Very low	58	Low	101 Å²	101	85 Å²	85	71%	0.706	47%	0.471	S	S	*	.			trans	-77.9	-7.1	-173.3	-119.1	0	0	0	0	115.7	G497	G497-S499 VanDerWaalsContact C-N 3.27Å; G497-S499 PolarHBondContact O-N 3.1Å; G497-S499 VanDerWaalsContact O-N 3.15Å
500	M	43.3	Very low	54.9	Low	112 Å²	112	89.9 Å²	89.9	55%	0.552	49%	0.494	S	S	*	.			trans	-134.4	71.1	-177.5	-66	-144.6	-66.5	0	0	113	R494 G498	R494-M500 HydrophobicContact CB-CE 3.93Å; R494-M500 HydrophobicContact CG-CE 3.49Å; R494-M500 VanDerWaalsContact CG-CE 3.49Å; G498-M500 VanDerWaalsContact C-N 3.33Å; G498-M500 PolarHBondContact O-N 2.57Å
501	V	34.3	Very low	51.6	Low	68 Å²	68	95.2 Å²	95.2	41%	0.412	52%	0.516	S	S	.	.			trans	-112.5	81.7	160.1	-173.3	0	0	0	0	107.9	I366	I366-V501 HydrophobicContact CG2-CG2 3.74Å
502	N	29.9	Very low	48.7	Very low	152 Å²	152	102.9 Å²	102.9	81%	0.813	55%	0.551	S	S	*	*			trans	176.5	35.2	152.5	-100.7	-8	0	0	0	114.8
503	R	30.8	Very low	45.4	Very low	223 Å²	223	110.4 Å²	110.4	84%	0.842	59%	0.587	S	S	*	*			trans	-127.2	83.6	159.8	-74.4	-169.8	-179.1	-178.6	1.5	109.9	A505	R503-A505 HydrophobicContact CB-CB 3.96Å; R503-A505 HydrophobicContact CG-CB 4.47Å; R503-A505 PolarHBondContact O-N 2.52Å
504	S	30.4	Very low	42.4	Very low	126 Å²	126	109.6 Å²	109.6	88%	0.881	60%	0.599	S	S	*	*			trans	-60.3	54.3	132.4	30.2	0	0	0	0	109.7
505	A	25.6	Very low	39.7	Very low	59 Å²	59	108.8 Å²	108.8	49%	0.488	62%	0.617	S	S	.	*			trans	-81.1	134	158.8	0	0	0	0	0	104.9	R503	R503-A505 HydrophobicContact CB-CB 3.96Å; R503-A505 HydrophobicContact CG-CB 4.47Å; R503-A505 PolarHBondContact O-N 2.52Å
506	P	27	Very low	36.8	Very low	110 Å²	110	110.2 Å²	110.2	71%	0.714	64%	0.643	S	S	*	*			trans	-48.5	152.8	162.1	-17.2	28.6	0	0	0	107.9	A508	P506-A508 PolarHBondContact O-N 3.31Å
507	L	32.1	Very low	33.9	Very low	133 Å²	133	113.1 Å²	113.1	70%	0.696	67%	0.673	S	S	*	*			trans	-56.6	76.6	155.6	-79.9	143.9	0	0	0	107.6	A509	L507-A509 PolarHBondContact O-N 3.24Å
508	A	24.1	Very low	31.7	Very low	70 Å²	70	118.7 Å²	118.7	58%	0.579	71%	0.707	S	S	*	*			trans	-55.6	122.9	150.3	0	0	0	0	0	103.1	P506 H510	P506-A508 PolarHBondContact O-N 3.31Å; A508-H510 PolarHBondContact O-N 3.12Å
509	A	28.1	Very low	30.1	Very low	100 Å²	100	125.4 Å²	125.4	83%	0.826	74%	0.736	S	S	*	*			trans	-52.7	86.7	176.6	0	0	0	0	0	108.7	L507 K511	L507-A509 PolarHBondContact O-N 3.24Å; A509-K511 PolarHBondContact O-N 3.48Å
510	H	28.1	Very low	29.1	Very low	166 Å²	166	129.4 Å²	129.4	77%	0.769	74%	0.744	S	S	*	*			trans	-65.8	102.7	160	-94.1	-68.9	0	0	0	102.8	A508 E512	A508-H510 PolarHBondContact O-N 3.12Å; H510-E512 PolarHBondContact O-N 3.05Å
511	K	26.2	Very low	28.4	Very low	199 Å²	199	132.2 Å²	132.2	87%	0.865	76%	0.757	S	S	*	*			trans	-50.2	95.7	152.1	-81.5	179.7	172.9	179.5	0	105.3	A509 Q513	A509-K511 PolarHBondContact O-N 3.48Å; K511-Q513 PolarHBondContact O-N 3.41Å
512	E	30.7	Very low	28.1	Very low	169 Å²	169	135 Å²	135	79%	0.79	78%	0.775	S	S	*	*			trans	-55.1	114.3	158.7	-76.4	-175	156	0	0	104.7	H510	H510-E512 PolarHBondContact O-N 3.05Å
513	Q	24.8	Very low	27.9	Very low	179 Å²	179	137 Å²	137	84%	0.836	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-54.8	126.2	164.9	-78.5	175	-39.9	0	0	105.4	K511 A515	K511-Q513 PolarHBondContact O-N 3.41Å; Q513-A515 PolarHBondContact O-N 3.15Å
514	P	27.5	Very low	27.8	Very low	120 Å²	120	129.5 Å²	129.5	78%	0.779	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-54.1	123.2	174	23	-31.8	0	0	0	106.7	A516	P514-A516 PolarHBondContact O-N 3.33Å; P514-A516 VanDerWaalsContact O-N 3.09Å
515	A	30.9	Very low	27.5	Very low	98 Å²	98	134.7 Å²	134.7	81%	0.81	77%	0.774	S	S	*	*	S	Bend	trans	-48.8	122.6	169.1	0	0	0	0	0	107.3	Q513	Q513-A515 PolarHBondContact O-N 3.15Å
516	A	28.8	Very low	27.7	Very low	94 Å²	94	140.8 Å²	140.8	78%	0.777	79%	0.792	S	S	*	*	S	Bend	trans	26.4	112.9	171.5	0	0	0	0	0	116.5	P514	P514-A516 PolarHBondContact O-N 3.33Å; P514-A516 VanDerWaalsContact O-N 3.09Å
517	G	26.9	Very low	27.8	Very low	62 Å²	62	140.9 Å²	140.9	64%	0.639	80%	0.796	S	S	*	*			trans	-46.9	159.7	168.9	0	0	0	0	0	113.1	L519	G517-L519 PolarHBondContact O-N 2.99Å
518	P	26.9	Very low	27.5	Very low	128 Å²	128	143.5 Å²	143.5	83%	0.831	81%	0.809	S	S	*	*			trans	-56	119.7	-171.8	24.5	-31.7	0	0	0	108.9	H520	P518-H520 PolarHBondContact O-N 2.86Å
519	L	28.3	Very low	27.6	Very low	164 Å²	164	144.2 Å²	144.2	86%	0.859	82%	0.816	S	S	*	*			trans	-53.2	114.1	160.6	-84.4	162.2	0	0	0	105.7	G517 M521	G517-L519 PolarHBondContact O-N 2.99Å; L519-M521 VanDerWaalsContact C-N 3.27Å; L519-M521 PolarHBondContact O-N 3.16Å
520	H	26.3	Very low	27.5	Very low	185 Å²	185	144 Å²	144	86%	0.856	81%	0.814	S	S	*	*			trans	-51.1	93.3	175.4	-122.9	-69	0	0	0	108.1	P518 T522	P518-H520 PolarHBondContact O-N 2.86Å; H520-T522 PolarHBondContact O-N 3.25Å; H520-T522 VanDerWaalsContact O-N 3.09Å
521	M	27.7	Very low	27.4	Very low	171 Å²	171	139.9 Å²	139.9	84%	0.842	82%	0.816	S	S	*	*			trans	-70.5	104.3	160.2	-76.6	-153	85.2	0	0	105.4	L519 M523	L519-M521 VanDerWaalsContact C-N 3.27Å; L519-M521 PolarHBondContact O-N 3.16Å; M521-M523 VanDerWaalsContact O-N 3.15Å; M521-M523 PolarHBondContact O-N 3.25Å
522	T	29.2	Very low	27.5	Very low	127 Å²	127	137.4 Å²	137.4	78%	0.779	82%	0.817	S	S	*	*			trans	-45.8	119.2	162.7	34.4	0	0	0	0	108.4	H520 G524	H520-T522 PolarHBondContact O-N 3.25Å; H520-T522 VanDerWaalsContact O-N 3.09Å; T522-G524 VanDerWaalsContact C-N 3.3Å; T522-G524 PolarHBondContact O-N 3.13Å
523	M	25.9	Very low	27.2	Very low	193 Å²	193	132.2 Å²	132.2	95%	0.951	81%	0.809	S	S	*	*			trans	-62.4	91.1	175.5	-77.5	-164.7	176.8	0	0	109.9	M521	M521-M523 VanDerWaalsContact O-N 3.15Å; M521-M523 PolarHBondContact O-N 3.25Å
524	G	28.5	Very low	27.3	Very low	67 Å²	67	131.1 Å²	131.1	69%	0.691	81%	0.808	S	S	*	*			trans	-81.6	106.8	154.7	0	0	0	0	0	108.3	T522 H526	T522-G524 VanDerWaalsContact C-N 3.3Å; T522-G524 PolarHBondContact O-N 3.13Å; G524-H526 PolarHBondContact O-N 3.47Å
525	R	25	Very low	27.4	Very low	235 Å²	235	133.1 Å²	133.1	89%	0.887	81%	0.811	S	S	*	*			trans	-57.7	98	172.9	-80.4	176.2	165.3	177.1	-4.1	110.4
526	H	28.7	Very low	27.1	Very low	186 Å²	186	136.7 Å²	136.7	86%	0.861	81%	0.811	S	S	*	*			trans	-146.1	113.3	154.4	-78.7	-59.2	0	0	0	111.3	G524	G524-H526 PolarHBondContact O-N 3.47Å
527	S	29.1	Very low	27.1	Very low	112 Å²	112	140.3 Å²	140.3	78%	0.783	81%	0.812	S	S	*	*			trans	30.6	105.3	159.6	-149.3	0	0	0	0	119.4	A529	S527-A529 PolarHBondContact O-N 2.88Å
528	L	25.6	Very low	27.5	Very low	188 Å²	188	141 Å²	141	98%	0.984	80%	0.804	S	S	*	*	S	Bend	trans	-68.2	84.7	161.9	-81.3	149.1	0	0	0	110.7
529	A	27	Very low	27.8	Very low	86 Å²	86	137.8 Å²	137.8	71%	0.711	79%	0.794	S	S	*	*			trans	-160.2	54.6	167.9	0	0	0	0	0	112.3	S527	S527-A529 PolarHBondContact O-N 2.88Å
530	A	26.6	Very low	28.1	Very low	96 Å²	96	132.5 Å²	132.5	79%	0.793	77%	0.766	S	S	*	*	S	Bend	trans	-158.6	5.7	171.9	0	0	0	0	0	116.2
531	G	25.8	Very low	28.3	Very low	79 Å²	79	127.3 Å²	127.3	81%	0.814	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	-1.9	-167.3	0	0	0	0	0	117.7
532	V	28.3	Very low	28.5	Very low	146 Å²	146	127.4 Å²	127.4	89%	0.885	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	2.9	-174.4	-172.2	0	0	0	0	112.4
533	G	23.8	Very low	28.7	Very low	60 Å²	60	127.5 Å²	127.5	62%	0.619	75%	0.75	S	S	*	*	S	Bend	trans	-97.8	-3.3	-170.5	0	0	0	0	0	117.8
534	L	26	Very low	29.6	Very low	156 Å²	156	120.6 Å²	120.6	82%	0.817	72%	0.717	S	S	*	*	S	Bend	trans	-108.3	-6.3	-169	-122.9	83.7	0	0	0	116.2
535	L	29.8	Very low	30	Very low	162 Å²	162	124.9 Å²	124.9	85%	0.848	72%	0.724	S	S	*	*	S	Bend	trans	-99.5	8.9	-178.2	-84.2	159.4	0	0	0	114.2
536	Q	26.3	Very low	30.9	Very low	173 Å²	173	118.2 Å²	118.2	81%	0.808	71%	0.705	S	S	*	*			trans	-101.9	9.8	179.4	-133.4	168.1	5.8	0	0	113.4
537	Q	28.7	Very low	31	Very low	171 Å²	171	114.8 Å²	114.8	80%	0.799	70%	0.697	S	S	*	*			trans	-96.6	13	179.7	-88.6	-168.7	-10.5	0	0	114.8	G539	Q537-G539 PolarHBondContact O-N 3.16Å
538	T	35.2	Very low	31.1	Very low	77 Å²	77	114.9 Å²	114.9	47%	0.472	69%	0.693	S	S	.	*	S	Bend	trans	-80	102.9	152.1	49.7	0	0	0	0	106.5	I146 L540	I146-T538 HydrophobicContact CD1-CG2 4.47Å; T538-L540 PolarHBondContact O-N 3.19Å
539	G	32.1	Very low	31.4	Very low	60 Å²	60	110.9 Å²	110.9	62%	0.619	68%	0.677	S	S	*	*			trans	-63	24.3	179.9	0	0	0	0	0	115.6	Q537 G541	Q537-G539 PolarHBondContact O-N 3.16Å; G539-G541 PolarHBondContact O-N 3.17Å
540	L	34.6	Very low	31.6	Very low	52 Å²	52	112.4 Å²	112.4	27%	0.272	68%	0.675	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79	15.7	-175.3	-80.6	159	0	0	0	113.9	F195 T538	F195-L540 HydrophobicContact CD1-CD2 3.97Å; F195-L540 HydrophobicContact CD2-CD2 3.61Å; F195-L540 HydrophobicContact CE1-CD2 4.01Å; F195-L540 HydrophobicContact CE2-CB 4.39Å; F195-L540 HydrophobicContact CE2-CD2 3.68Å; F195-L540 HydrophobicContact CG-CD2 3.77Å; F195-L540 HydrophobicContact CZ-CD2 3.88Å; T538-L540 PolarHBondContact O-N 3.19Å
541	G	30.3	Very low	31.9	Very low	76 Å²	76	113.4 Å²	113.4	78%	0.784	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.9	13.2	-176.7	0	0	0	0	0	115.9	G539	G539-G541 PolarHBondContact O-N 3.17Å
542	K	32.7	Very low	32.4	Very low	174 Å²	174	115.7 Å²	115.7	76%	0.757	66%	0.657	S	S	*	*	S	Bend	trans	-103.2	129.7	170.4	-69.9	-173.2	179	-176.9	0	108.3	L544	K542-L544 PolarHBondContact O-N 2.74Å
543	H	33.9	Very low	32.6	Very low	129 Å²	129	113.5 Å²	113.5	60%	0.597	64%	0.641	S	S	*	*			trans	-48.2	115.5	168.4	-156.3	-74	0	0	0	107.7	D545	H543-D545 PolarHBondContact O-N 2.78Å
544	L	43.1	Very low	33.3	Very low	48 Å²	48	117.6 Å²	117.6	25%	0.251	64%	0.643	S	S	.	*			trans	-81.6	109.8	177.2	-77.7	156.9	0	0	0	106.4	F195 Y398 P437 M440 K542 L546	F195-L544 HydrophobicContact CZ-CD1 4.46Å; Y398-L544 HydrophobicContact CE2-CD1 4.4Å; P437-L544 HydrophobicContact CG-CD1 4.48Å; P437-L544 HydrophobicContact CG-CD2 4.14Å; M440-L544 HydrophobicContact CE-CD1 3.39Å; M440-L544 HydrophobicContact SD-CD1 3.61Å; K542-L544 PolarHBondContact O-N 2.74Å; L544-L546 VanDerWaalsContact C-N 3.28Å; L544-L546 HydrophobicContact CB-CG 4.15Å; L544-L546 PolarHBondContact O-N 2.93Å
545	D	37.9	Very low	33.9	Very low	156 Å²	156	114.4 Å²	114.4	83%	0.834	63%	0.628	S	S	*	*			trans	-70.5	93.7	161.9	-76.5	-21	0	0	0	106.7	H543	H543-D545 PolarHBondContact O-N 2.78Å
546	L	43	Very low	34.3	Very low	95 Å²	95	110.1 Å²	110.1	50%	0.497	61%	0.608	S	S	.	*			trans	-84.3	0	175.8	-77	171.1	0	0	0	111.8	Y398 F406 I441 L544	Y398-L546 HydrophobicContact CE1-CD1 4.33Å; F406-L546 HydrophobicContact CE1-CD1 3.66Å; F406-L546 HydrophobicContact CZ-CD1 3.89Å; I441-L546 HydrophobicContact CD1-CD2 3.43Å; I441-L546 VanDerWaalsContact CD1-CD2 3.43Å; L544-L546 VanDerWaalsContact C-N 3.28Å; L544-L546 HydrophobicContact CB-CG 4.15Å; L544-L546 PolarHBondContact O-N 2.93Å

Retrieved 546 of 546 residues in 540 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).